A0A061IDC3_CRIGR Loading...

Tyrosine 3-monooxygenase

AlphaFold DB , UniProt , Accession A0A061IDC3, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 499 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	34.3	Very low	236 Å²	236	134.3 Å²	134.3	100%	1.163	84%	0.837	S	S	*	*				0	134.6	0	-78.9	-85.3	-87.9	0	0	107.8
2	P	44.9	Very low	33.8	Very low	116 Å²	116	139.6 Å²	139.6	75%	0.753	84%	0.839	S	S	*	*			cis	-130	162	2.5	36.5	-18.2	0	0	0	115.4
3	T	38.9	Very low	33.1	Very low	131 Å²	131	134.7 Å²	134.7	80%	0.804	83%	0.834	S	S	*	*			trans	-73.9	159.7	158.1	39.9	0	0	0	0	110.5
4	P	42.9	Very low	32.6	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	84%	0.837	S	S	*	*				-149.6	176	89.4	34	-12.7	0	0	0	112.2
5	S	30.5	Very low	32.1	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	84%	0.844	S	S	*	*			cis	-166.7	150.2	-7.1	42.7	0	0	0	0	106.8
6	A	34	Very low	31.9	Very low	103 Å²	103	152.1 Å²	152.1	85%	0.851	85%	0.847	S	S	*	*			trans	-67	147.5	175.9	0	0	0	0	0	113.6
7	S	30.3	Very low	31.5	Very low	118 Å²	118	148.9 Å²	148.9	83%	0.825	84%	0.844	S	S	*	*			trans	-148.8	124.2	146.6	60.7	0	0	0	0	110.2
8	S	29.9	Very low	31.3	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-78.3	144.4	172.7	37.2	0	0	0	0	110.5
9	P	30.9	Very low	31.4	Very low	130 Å²	130	142.4 Å²	142.4	84%	0.844	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-86.7	119.1	166.1	27.2	-19.3	0	0	0	110.1
10	Q	30.4	Very low	31.4	Very low	177 Å²	177	143.7 Å²	143.7	83%	0.827	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.5	151.6	165.2	-80.9	-168	-27.1	0	0	111.5	K12	Q10-K12 PolarHBondContact O-N 3.22Å
11	P	30.3	Very low	31.3	Very low	126 Å²	126	144.5 Å²	144.5	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.1	125.9	176	30.4	-31.4	0	0	0	110.5	G13	P11-G13 PolarHBondContact O-N 3Å
12	K	28.8	Very low	31.4	Very low	198 Å²	198	137.4 Å²	137.4	86%	0.861	78%	0.776	S	S	*	*			trans	-71.7	109.5	168.3	-75.1	-178.8	177.2	178.3	0	108.7	Q10 F14	Q10-K12 PolarHBondContact O-N 3.22Å; K12-F14 PolarHBondContact O-N 3.3Å
13	G	25.1	Very low	30.7	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	76%	0.764	S	S	*	*			trans	-63.2	115.3	168.9	0	0	0	0	0	110.8	P11 R15	P11-G13 PolarHBondContact O-N 3Å; G13-R15 PolarHBondContact O-N 3.17Å
14	F	25.3	Very low	30.2	Very low	199 Å²	199	135.7 Å²	135.7	87%	0.873	76%	0.757	S	S	*	*			trans	-81.6	95	161.6	-100.1	-93.2	0	0	0	107.9	K12 R16	K12-F14 PolarHBondContact O-N 3.3Å; F14-R16 PolarHBondContact O-N 3.28Å
15	R	25.6	Very low	29.6	Very low	248 Å²	248	136.4 Å²	136.4	94%	0.936	75%	0.75	S	S	*	*			trans	-71.5	104	158.2	-82.9	-177.2	174.9	176.4	-2	107	G13 A17	G13-R15 PolarHBondContact O-N 3.17Å; R15-A17 PolarHBondContact O-N 3.14Å
16	R	28.4	Very low	29.7	Very low	236 Å²	236	135.9 Å²	135.9	89%	0.891	74%	0.741	S	S	*	*			trans	-77	110.7	167.6	-141	176.8	-174.9	-178.5	-0.3	106.6	F14 V18	F14-R16 PolarHBondContact O-N 3.28Å; R16-V18 PolarHBondContact O-N 3.27Å
17	A	25.9	Very low	29.5	Very low	97 Å²	97	138 Å²	138	80%	0.802	73%	0.734	S	S	*	*			trans	-63.2	113	171.1	0	0	0	0	0	108.1	R15	R15-A17 PolarHBondContact O-N 3.14Å
18	V	28	Very low	29.4	Very low	124 Å²	124	136 Å²	136	75%	0.752	73%	0.725	S	S	*	*			trans	-68.9	127.8	167.4	-177.1	0	0	0	0	106.4	R16	R16-V18 PolarHBondContact O-N 3.27Å
19	S	32.2	Very low	29.5	Very low	51 Å²	51	137.7 Å²	137.7	36%	0.357	72%	0.724	S	S	.	*			trans	-72.1	138	-174.9	86.8	0	0	0	0	110.1	Q21 D22	S19-Q21 PolarHBondContact O-N 3.25Å; S19-D22 PolarHBondContact O-N 3Å; S19-D22 VanDerWaalsContact O-N 3.12Å; S19-D22 PolarHBondContact OG-OD2 3.18Å
20	E	32.1	Very low	29.3	Very low	168 Å²	168	136.6 Å²	136.6	79%	0.785	72%	0.715	S	S	*	*	H	α-helix	trans	-64	-2.5	173.9	-69.4	179.9	153.4	0	0	113.4
21	Q	28.9	Very low	29.2	Very low	160 Å²	160	132.6 Å²	132.6	75%	0.748	71%	0.706	S	S	*	*	H	α-helix	trans	-81.7	-30.3	172.6	-76.8	-177.9	-36.5	0	0	112.4	S19 Q25	S19-Q21 PolarHBondContact O-N 3.25Å; Q21-Q25 PolarHBondContact O-N 2.96Å
22	D	35.2	Very low	29.1	Very low	88 Å²	88	132.4 Å²	132.4	47%	0.471	71%	0.705	S	S	.	*	H	α-helix	trans	-72.5	-36.6	178.5	-62.9	-52.1	0	0	0	111.5	S19 K24 Q25 V26	S19-D22 PolarHBondContact O-N 3Å; S19-D22 VanDerWaalsContact O-N 3.12Å; S19-D22 PolarHBondContact OG-OD2 3.18Å; D22-K24 PolarHBondContact O-N 3.07Å; D22-Q25 PolarHBondContact O-N 3.02Å; D22-V26 WeakPolarHBondContact O-CG2 3.41Å; D22-V26 PolarHBondContact O-N 2.95Å
23	A	30.8	Very low	29.3	Very low	61 Å²	61	134.3 Å²	134.3	50%	0.504	71%	0.707	S	S	.	*	H	α-helix	trans	-68	-33.6	177.6	0	0	0	0	0	113.1	Q25 V26 E27	A23-Q25 VanDerWaalsContact C-N 3.33Å; A23-V26 PolarHBondContact O-N 3.43Å; A23-E27 PolarHBondContact O-N 3.22Å; A23-E27 VanDerWaalsContact O-N 3.12Å
24	K	28.9	Very low	29.2	Very low	150 Å²	150	140.1 Å²	140.1	65%	0.652	71%	0.711	S	S	*	*	H	α-helix	trans	-74	-24	176.9	-75.7	-177.7	178.6	176.8	0	113.2	D22 A28	D22-K24 PolarHBondContact O-N 3.07Å; K24-A28 PolarHBondContact O-N 2.87Å
25	Q	30.5	Very low	29.6	Very low	138 Å²	138	138.8 Å²	138.8	65%	0.645	71%	0.711	S	S	*	*	H	α-helix	trans	-75.9	-31.6	174.4	-131.7	172	4.7	0	0	111.4	Q21 D22 A23 I29	Q21-Q25 PolarHBondContact O-N 2.96Å; D22-Q25 PolarHBondContact O-N 3.02Å; A23-Q25 VanDerWaalsContact C-N 3.33Å; Q25-I29 WeakPolarHBondContact O-CD1 3.44Å; Q25-I29 WeakPolarHBondContact O-CG1 3.33Å
26	V	31.5	Very low	29.5	Very low	99 Å²	99	130.3 Å²	130.3	60%	0.6	70%	0.701	S	S	*	*	H	α-helix	trans	-73.8	-36.5	173.8	178.6	0	0	0	0	112	D22 A23 I29	D22-V26 WeakPolarHBondContact O-CG2 3.41Å; D22-V26 PolarHBondContact O-N 2.95Å; A23-V26 PolarHBondContact O-N 3.43Å; V26-I29 PolarHBondContact O-N 2.97Å
27	E	29.5	Very low	29.5	Very low	148 Å²	148	130.7 Å²	130.7	69%	0.692	70%	0.702	S	S	*	*	H	α-helix	trans	-72.2	-24.3	176.2	-110.8	-179	169.7	0	0	114	A23 I29 T30	A23-E27 PolarHBondContact O-N 3.22Å; A23-E27 VanDerWaalsContact O-N 3.12Å; E27-I29 VanDerWaalsContact C-N 3.29Å; E27-I29 PolarHBondContact O-N 3.03Å; E27-T30 PolarHBondContact O-OG1 2.83Å; E27-T30 VanDerWaalsContact O-OG1 3.12Å
28	A	28.1	Very low	29.8	Very low	77 Å²	77	138.3 Å²	138.3	64%	0.636	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-17.4	176.9	0	0	0	0	0	113.3	K24	K24-A28 PolarHBondContact O-N 2.87Å
29	I	32.8	Very low	30	Very low	141 Å²	141	138 Å²	138	72%	0.723	70%	0.701	S	S	*	*	S	Bend	trans	-83.6	-19.4	-179.3	-64.3	166.4	0	0	0	111.4	Q25 V26 E27	Q25-I29 WeakPolarHBondContact O-CD1 3.44Å; Q25-I29 WeakPolarHBondContact O-CG1 3.33Å; V26-I29 PolarHBondContact O-N 2.97Å; E27-I29 VanDerWaalsContact C-N 3.29Å; E27-I29 PolarHBondContact O-N 3.03Å
30	T	26.5	Very low	30.3	Very low	107 Å²	107	138.2 Å²	138.2	66%	0.656	70%	0.702	S	S	*	*	S	Bend	trans	-95.7	13.2	-171.4	51.5	0	0	0	0	115.2	E27	E27-T30 PolarHBondContact O-OG1 2.83Å; E27-T30 VanDerWaalsContact O-OG1 3.12Å
31	S	28.7	Very low	30.5	Very low	93 Å²	93	136.9 Å²	136.9	65%	0.65	70%	0.7	S	S	*	*			trans	-153.5	122.2	174.7	-129.5	0	0	0	0	115.2
32	P	28.5	Very low	31	Very low	122 Å²	122	135.3 Å²	135.3	79%	0.792	70%	0.695	S	S	*	*			trans	-110.4	98.9	148	22.4	-4.9	0	0	0	109.5	F34	P32-F34 PolarHBondContact O-N 3.37Å
33	R	32.2	Very low	31.3	Very low	237 Å²	237	135.6 Å²	135.6	89%	0.894	69%	0.693	S	S	*	*			trans	-73.6	100.1	145.9	-92.3	-175.3	169.1	175	-1.2	106.6
34	F	23.6	Very low	32.4	Very low	198 Å²	198	135.5 Å²	135.5	87%	0.868	68%	0.684	S	S	*	*			trans	-133.4	133.8	161.2	-120.1	-92.1	0	0	0	112.5	P32	P32-F34 PolarHBondContact O-N 3.37Å
35	I	33.8	Very low	33.4	Very low	171 Å²	171	129.9 Å²	129.9	88%	0.877	67%	0.666	S	S	*	*			trans	-94.4	118.7	-172.9	-67.7	164.2	0	0	0	106.9
36	G	24.1	Very low	35	Very low	70 Å²	70	130.5 Å²	130.5	72%	0.722	66%	0.663	S	S	*	*			trans	-170.2	104.1	173.6	0	0	0	0	0	112.3
37	R	27.5	Very low	36.7	Very low	244 Å²	244	130.9 Å²	130.9	92%	0.921	66%	0.656	S	S	*	*			trans	49.4	87.4	173.4	-89.5	-176.6	173.7	-176.8	-1.6	117.7	Q39	R37-Q39 PolarHBondContact O-N 3.36Å
38	R	31.4	Very low	38.6	Very low	258 Å²	258	129.1 Å²	129.1	97%	0.974	65%	0.648	S	S	*	*			trans	-77.6	88.5	155.5	-78.7	-179.7	173	177.1	-3.7	110.2
39	Q	33	Very low	40.7	Very low	118 Å²	118	128.3 Å²	128.3	55%	0.551	63%	0.629	S	S	*	*			trans	-106.4	129.1	139.2	-104.1	170.3	-24	0	0	105.4	R37 L41	R37-Q39 PolarHBondContact O-N 3.36Å; Q39-L41 PolarHBondContact O-N 2.91Å
40	S	38.1	Very low	42.6	Very low	54 Å²	54	126.8 Å²	126.8	38%	0.378	62%	0.618	S	S	.	*			trans	-68.1	128	-175.7	177.9	0	0	0	0	108.6	I42 E43 D44	S40-I42 PolarHBondContact O-N 2.89Å; S40-I42 WeakPolarHBondContact OG-CB 3.35Å; S40-I42 PolarHBondContact OG-N 3.44Å; S40-E43 WeakPolarHBondContact O-CA 3.25Å; S40-E43 WeakPolarHBondContact O-CB 3.42Å; S40-E43 PolarHBondContact O-N 3.45Å; S40-D44 PolarHBondContact O-N 3.39Å
41	L	37.8	Very low	44.9	Very low	141 Å²	141	124.6 Å²	124.6	74%	0.738	61%	0.611	S	S	*	*	H	α-helix	trans	-51.7	-27.3	173.6	-69.4	167.9	0	0	0	112.1	Q39 A45	Q39-L41 PolarHBondContact O-N 2.91Å; L41-A45 WeakPolarHBondContact O-CB 3.13Å; L41-A45 PolarHBondContact O-N 3.24Å
42	I	39.2	Very low	46.9	Very low	127 Å²	127	121 Å²	121	65%	0.651	59%	0.587	S	S	*	*	H	α-helix	trans	-69.7	-38.8	174.5	-57.7	170.4	0	0	0	111.5	S40 R46	S40-I42 PolarHBondContact O-N 2.89Å; S40-I42 WeakPolarHBondContact OG-CB 3.35Å; S40-I42 PolarHBondContact OG-N 3.44Å; I42-R46 WeakPolarHBondContact O-CB 3.35Å; I42-R46 PolarHBondContact O-N 2.96Å
43	E	41.6	Very low	48.9	Very low	93 Å²	93	117.1 Å²	117.1	44%	0.435	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-35.7	177.2	-73.7	-177	160.9	0	0	112	S40 K47	S40-E43 WeakPolarHBondContact O-CA 3.25Å; S40-E43 WeakPolarHBondContact O-CB 3.42Å; S40-E43 PolarHBondContact O-N 3.45Å; E43-K47 WeakPolarHBondContact O-CG 3.23Å; E43-K47 PolarHBondContact O-N 3.35Å
44	D	52.3	Low	50.7	Low	59 Å²	59	108.9 Å²	108.9	32%	0.316	55%	0.548	S	S	.	.	H	α-helix	trans	-70.5	-45.7	177	-69.2	-23.9	0	0	0	111	S40 R46 K47 E48	S40-D44 PolarHBondContact O-N 3.39Å; D44-R46 VanDerWaalsContact C-N 3.32Å; D44-R46 PolarHBondContact O-N 2.77Å; D44-K47 PolarHBondContact O-N 3.34Å; D44-E48 WeakPolarHBondContact O-CG 3.21Å; D44-E48 PolarHBondContact O-N 3.04Å
45	A	51.2	Low	52.9	Low	33 Å²	33	100.9 Å²	100.9	27%	0.273	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-40.1	173.2	0	0	0	0	0	112.3	L41 E48 R49	L41-A45 WeakPolarHBondContact O-CB 3.13Å; L41-A45 PolarHBondContact O-N 3.24Å; A45-E48 PolarHBondContact O-N 3.23Å; A45-R49 WeakPolarHBondContact O-CB 3.41Å; A45-R49 PolarHBondContact O-N 2.69Å
46	R	63.2	Low	54.3	Low	150 Å²	150	93.4 Å²	93.4	57%	0.566	48%	0.482	S	S	*	.	H	α-helix	trans	-63.8	-43.3	176.2	-165.4	-178.4	80.7	-166.4	-4.6	112	I42 D44 E48 R49 E50	I42-R46 WeakPolarHBondContact O-CB 3.35Å; I42-R46 PolarHBondContact O-N 2.96Å; D44-R46 VanDerWaalsContact C-N 3.32Å; D44-R46 PolarHBondContact O-N 2.77Å; R46-E48 VanDerWaalsContact C-N 3.35Å; R46-R49 PolarHBondContact O-N 3.24Å; R46-E50 IonicContact NE-OE1 3.77Å; R46-E50 PolarHBondContact NE-OE1 3.01Å; R46-E50 WeakPolarHBondContact O-CG 3.24Å; R46-E50 PolarHBondContact O-N 3.29Å
47	K	67	Low	56.3	Low	107 Å²	107	92.9 Å²	92.9	47%	0.465	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-40.4	175.6	-78.1	174.8	-175.5	166.1	0	112	E43 D44 E50 A51	E43-K47 WeakPolarHBondContact O-CG 3.23Å; E43-K47 PolarHBondContact O-N 3.35Å; D44-K47 PolarHBondContact O-N 3.34Å; K47-E50 PolarHBondContact O-N 2.7Å; K47-A51 VanDerWaalsContact O-CB 3.3Å; K47-A51 WeakPolarHBondContact O-CB 3.02Å; K47-A51 PolarHBondContact O-N 2.89Å
48	E	70.3	Confident	57.9	Low	112 Å²	112	84 Å²	84	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-62.8	-42.8	175.4	-74.5	-176.1	169.9	0	0	111.6	D44 A45 R46 A51 A52 T107	D44-E48 WeakPolarHBondContact O-CG 3.21Å; D44-E48 PolarHBondContact O-N 3.04Å; A45-E48 PolarHBondContact O-N 3.23Å; R46-E48 VanDerWaalsContact C-N 3.35Å; E48-A51 PolarHBondContact O-N 2.97Å; E48-A52 VanDerWaalsContact O-CB 3.28Å; E48-A52 WeakPolarHBondContact O-CB 3.43Å; E48-A52 PolarHBondContact O-N 3.02Å; E48-T107 HydrophobicContact CB-CG2 3.93Å
49	R	72.2	Confident	59.2	Low	60 Å²	60	74.2 Å²	74.2	23%	0.226	42%	0.424	C	S	.	.	H	α-helix	trans	-62.6	-45.6	175.5	-179.6	169.4	166.6	-169	-9	112.3	A45 R46 A52 A53 F108 E109 D142	A45-R49 WeakPolarHBondContact O-CB 3.41Å; A45-R49 PolarHBondContact O-N 2.69Å; R46-R49 PolarHBondContact O-N 3.24Å; R49-A52 PolarHBondContact O-N 3.47Å; R49-A53 WeakPolarHBondContact O-CB 3.37Å; R49-A53 PolarHBondContact O-N 3.28Å; R49-F108 HydrophobicContact CB-CE1 4.45Å; R49-F108 HydrophobicContact CG-CD1 3.91Å; R49-F108 HydrophobicContact CG-CE1 3.87Å; R49-E109 IonicContact NH1-OE2 3.84Å; R49-E109 PolarHBondContact NH1-OE2 3.11Å; R49-D142 VanDerWaalsContact CZ-CG 3.43Å; R49-D142 IonicContact CZ-OD1 3.29Å; R49-D142 VanDerWaalsContact CZ-OD1 3.27Å; R49-D142 IonicContact CZ-OD2 3.33Å; R49-D142 IonicContact NE-OD1 3.18Å; R49-D142 PolarHBondContact NE-OD1 2.75Å; R49-D142 IonicContact NE-OD2 2.73Å; R49-D142 PolarHBondContact NE-OD2 3.5Å; R49-D142 IonicContact NH2-OD1 2.89Å; R49-D142 PolarHBondContact NH2-OD1 3.3Å; R49-D142 VanDerWaalsContact NH2-OD1 3.08Å; R49-D142 IonicContact NH2-OD2 3.25Å; R49-D142 PolarHBondContact NH2-OD2 2.93Å
50	E	73.2	Confident	60.4	Low	108 Å²	108	71.9 Å²	71.9	51%	0.505	43%	0.425	S	S	.	.	H	α-helix	trans	-61.8	-44.2	175.3	-74	170.5	-163.4	0	0	111.7	R46 K47 A53 A54	R46-E50 IonicContact NE-OE1 3.77Å; R46-E50 PolarHBondContact NE-OE1 3.01Å; R46-E50 WeakPolarHBondContact O-CG 3.24Å; R46-E50 PolarHBondContact O-N 3.29Å; K47-E50 PolarHBondContact O-N 2.7Å; E50-A53 PolarHBondContact O-N 2.97Å; E50-A54 WeakPolarHBondContact O-CB 3.21Å; E50-A54 PolarHBondContact O-N 3.25Å
51	A	74.1	Confident	61.2	Low	62 Å²	62	75.6 Å²	75.6	51%	0.512	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-40.2	177.2	0	0	0	0	0	112.1	K47 E48 A54 A55	K47-A51 VanDerWaalsContact O-CB 3.3Å; K47-A51 WeakPolarHBondContact O-CB 3.02Å; K47-A51 PolarHBondContact O-N 2.89Å; E48-A51 PolarHBondContact O-N 2.97Å; A51-A54 PolarHBondContact O-N 3.47Å; A51-A55 VanDerWaalsContact O-CB 3.32Å; A51-A55 WeakPolarHBondContact O-CB 3.28Å; A51-A55 PolarHBondContact O-N 3.17Å
52	A	70.4	Confident	61.7	Low	16 Å²	16	73 Å²	73	13%	0.132	44%	0.444	C	S	.	.	H	α-helix	trans	-66.9	-41.6	176.4	0	0	0	0	0	111.8	E48 R49 A55 A56 F108	E48-A52 VanDerWaalsContact O-CB 3.28Å; E48-A52 WeakPolarHBondContact O-CB 3.43Å; E48-A52 PolarHBondContact O-N 3.02Å; R49-A52 PolarHBondContact O-N 3.47Å; A52-A55 PolarHBondContact O-N 2.89Å; A52-A56 WeakPolarHBondContact O-CB 3.4Å; A52-A56 PolarHBondContact O-N 2.97Å; A52-F108 HydrophobicContact CB-CE1 4.49Å; A52-F108 HydrophobicContact CB-CZ 3.71Å
53	A	70.2	Confident	61.8	Low	42 Å²	42	70.5 Å²	70.5	35%	0.347	44%	0.438	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174.5	0	0	0	0	0	111.7	R49 E50 A55 A56 A57 A145	R49-A53 WeakPolarHBondContact O-CB 3.37Å; R49-A53 PolarHBondContact O-N 3.28Å; E50-A53 PolarHBondContact O-N 2.97Å; A53-A55 VanDerWaalsContact C-N 3.33Å; A53-A55 PolarHBondContact O-N 3.27Å; A53-A56 PolarHBondContact O-N 2.98Å; A53-A57 WeakPolarHBondContact O-CB 3.4Å; A53-A57 PolarHBondContact O-N 3.46Å; A53-A145 HydrophobicContact CB-CB 4.23Å
54	A	70.1	Confident	61.8	Low	64 Å²	64	72.4 Å²	72.4	53%	0.529	46%	0.461	S	S	.	.	H	α-helix	trans	-62.1	-40.8	175.2	0	0	0	0	0	112	E50 A51 A57 A58	E50-A54 WeakPolarHBondContact O-CB 3.21Å; E50-A54 PolarHBondContact O-N 3.25Å; A51-A54 PolarHBondContact O-N 3.47Å; A54-A57 PolarHBondContact O-N 3.11Å; A54-A58 WeakPolarHBondContact O-CB 3.46Å; A54-A58 PolarHBondContact O-N 3.07Å
55	A	70.4	Confident	61.2	Low	30 Å²	30	77.5 Å²	77.5	25%	0.248	48%	0.483	C	S	.	.	H	α-helix	trans	-70.4	-35	177.9	0	0	0	0	0	112.7	A51 A52 A53 A59	A51-A55 VanDerWaalsContact O-CB 3.32Å; A51-A55 WeakPolarHBondContact O-CB 3.28Å; A51-A55 PolarHBondContact O-N 3.17Å; A52-A55 PolarHBondContact O-N 2.89Å; A53-A55 VanDerWaalsContact C-N 3.33Å; A53-A55 PolarHBondContact O-N 3.27Å; A55-A59 WeakPolarHBondContact O-CB 3.36Å; A55-A59 PolarHBondContact O-N 3.49Å
56	A	62.9	Low	60.8	Low	14 Å²	14	82.5 Å²	82.5	12%	0.116	51%	0.513	C	S	.	.	H	α-helix	trans	-66.6	-43.2	173.1	0	0	0	0	0	111.2	A52 A53 A59 A60	A52-A56 WeakPolarHBondContact O-CB 3.4Å; A52-A56 PolarHBondContact O-N 2.97Å; A53-A56 PolarHBondContact O-N 2.98Å; A56-A59 PolarHBondContact O-N 3.26Å; A56-A60 PolarHBondContact O-N 2.86Å
57	A	65.1	Low	60	Low	59 Å²	59	77.8 Å²	77.8	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-43.6	174.4	0	0	0	0	0	111.9	A53 A54 A60 V61	A53-A57 WeakPolarHBondContact O-CB 3.4Å; A53-A57 PolarHBondContact O-N 3.46Å; A54-A57 PolarHBondContact O-N 3.11Å; A57-A60 PolarHBondContact O-N 3.32Å; A57-V61 WeakPolarHBondContact O-CG2 3.42Å; A57-V61 PolarHBondContact O-N 3.33Å
58	A	62.3	Low	59.4	Low	58 Å²	58	76.4 Å²	76.4	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-38.7	176.8	0	0	0	0	0	112.7	A54 V61 A62	A54-A58 WeakPolarHBondContact O-CB 3.46Å; A54-A58 PolarHBondContact O-N 3.07Å; A58-V61 PolarHBondContact O-N 3.47Å; A58-A62 WeakPolarHBondContact O-CB 3.37Å; A58-A62 PolarHBondContact O-N 3.4Å; A58-A62 VanDerWaalsContact O-N 3.14Å
59	A	59.6	Low	58.6	Low	51 Å²	51	72.3 Å²	72.3	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-65.2	-40.8	176	0	0	0	0	0	112	A55 A56 V61 A62 S63	A55-A59 WeakPolarHBondContact O-CB 3.36Å; A55-A59 PolarHBondContact O-N 3.49Å; A56-A59 PolarHBondContact O-N 3.26Å; A59-V61 PolarHBondContact O-N 3.2Å; A59-A62 PolarHBondContact O-N 2.76Å; A59-A62 VanDerWaalsContact O-N 3.17Å; A59-S63 PolarHBondContact O-N 2.93Å; A59-S63 PolarHBondContact O-OG 3.48Å
60	A	56.4	Low	57.9	Low	69 Å²	69	72.2 Å²	72.2	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-63.1	-26	175.4	0	0	0	0	0	113.3	A56 A57	A56-A60 PolarHBondContact O-N 2.86Å; A57-A60 PolarHBondContact O-N 3.32Å
61	V	55.9	Low	57	Low	132 Å²	132	74.1 Å²	74.1	80%	0.8	50%	0.504	S	S	*	.	H	α-helix	trans	-85.6	-23.8	176.9	176	0	0	0	0	112.3	A57 A58 A59	A57-V61 WeakPolarHBondContact O-CG2 3.42Å; A57-V61 PolarHBondContact O-N 3.33Å; A58-V61 PolarHBondContact O-N 3.47Å; A59-V61 PolarHBondContact O-N 3.2Å
62	A	48.5	Very low	56.2	Low	86 Å²	86	74.7 Å²	74.7	71%	0.711	51%	0.509	S	S	*	.	H	α-helix	trans	-97.7	-18.3	-171.1	0	0	0	0	0	115.6	A58 A59	A58-A62 WeakPolarHBondContact O-CB 3.37Å; A58-A62 PolarHBondContact O-N 3.4Å; A58-A62 VanDerWaalsContact O-N 3.14Å; A59-A62 PolarHBondContact O-N 2.76Å; A59-A62 VanDerWaalsContact O-N 3.17Å
63	S	41.1	Very low	56.1	Low	76 Å²	76	74.5 Å²	74.5	53%	0.531	51%	0.506	S	S	.	.			trans	-98.8	126.6	-176.1	57.2	0	0	0	0	113.3	A59	A59-S63 PolarHBondContact O-N 2.93Å; A59-S63 PolarHBondContact O-OG 3.48Å
64	S	40.6	Very low	56.3	Low	133 Å²	133	78 Å²	78	93%	0.93	52%	0.523	S	S	*	.			trans	-97.9	17	165.7	46.9	0	0	0	0	113.1
65	E	41.3	Very low	56.8	Low	166 Å²	166	78.5 Å²	78.5	78%	0.776	51%	0.514	S	S	*	.	S	Bend	trans	-94.3	144.6	164.3	-72.3	-166.5	157	0	0	110
66	P	41.8	Very low	57.3	Low	137 Å²	137	84 Å²	84	89%	0.89	53%	0.534	S	S	*	.	S	Bend	trans	-79.4	132.7	-168.5	31.7	-31.9	0	0	0	111.7
67	G	47.3	Very low	58.2	Low	51 Å²	51	89.4 Å²	89.4	53%	0.526	56%	0.557	S	S	.	*			trans	148.9	90.4	158.7	0	0	0	0	0	112.1
68	N	53.4	Low	58.9	Low	79 Å²	79	92.8 Å²	92.8	42%	0.422	56%	0.562	S	S	.	*			trans	-48.2	132.9	160.1	174.9	-6.3	0	0	0	107.7	L70 E71	N68-L70 PolarHBondContact O-N 3.45Å; N68-L70 PolarHBondContact OD1-N 2.92Å; N68-E71 HydrophobicContact CB-CB 4.01Å; N68-E71 HydrophobicContact CB-CG 3.7Å; N68-E71 PolarHBondContact N-OE2 3.02Å; N68-E71 PolarHBondContact O-N 3.46Å
69	P	53.5	Low	59.9	Low	26 Å²	26	97.4 Å²	97.4	17%	0.169	58%	0.579	C	S	.	*	T	Hydrogen-bonded Turn	trans	-49.6	-27.6	-179.4	-31.1	34.9	0	0	0	114.5	R151	P69-R151 VanDerWaalsContact CB-NH1 3.31Å; P69-R151 PolarHBondContact O-NH1 3.23Å; P69-R151 PolarHBondContact O-NH2 3.04Å
70	L	57.3	Low	61	Low	58 Å²	58	97.1 Å²	97.1	30%	0.304	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-22.3	179	-62.5	164.7	0	0	0	114.4	N68 A72 V73 F75 L143 A144 L147	N68-L70 PolarHBondContact O-N 3.45Å; N68-L70 PolarHBondContact OD1-N 2.92Å; L70-A72 PolarHBondContact O-N 2.87Å; L70-V73 PolarHBondContact O-N 3.43Å; L70-F75 HydrophobicContact CD2-CE1 4.02Å; L70-L143 HydrophobicContact CD2-CD2 3.58Å; L70-L143 HydrophobicContact CD2-CG 3.88Å; L70-A144 HydrophobicContact CD1-CB 4.31Å; L70-A144 HydrophobicContact CG-CB 4.35Å; L70-L147 HydrophobicContact CD2-CD1 4.27Å
71	E	54.4	Low	62.6	Low	148 Å²	148	98 Å²	98	69%	0.692	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-22.4	-176.1	-92.7	168.3	175.5	0	0	113.4	N68	N68-E71 HydrophobicContact CB-CB 4.01Å; N68-E71 HydrophobicContact CB-CG 3.7Å; N68-E71 PolarHBondContact N-OE2 3.02Å; N68-E71 PolarHBondContact O-N 3.46Å
72	A	57.4	Low	64.1	Low	74 Å²	74	91.7 Å²	91.7	61%	0.612	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	2	-179.3	0	0	0	0	0	113.8	L70	L70-A72 PolarHBondContact O-N 2.87Å
73	V	67.8	Low	66	Low	11 Å²	11	88.8 Å²	88.8	7%	0.067	51%	0.507	C	S	.	.			trans	-125.4	122	-169.4	-175.1	0	0	0	0	111.3	L70 L84 L86 L147 S159	L70-V73 PolarHBondContact O-N 3.43Å; V73-L84 HydrophobicContact CG1-CD1 3.45Å; V73-L84 VanDerWaalsContact CG1-CD1 3.45Å; V73-L86 HydrophobicContact CG1-CD2 3.96Å; V73-L147 HydrophobicContact CB-CD1 4.24Å; V73-L147 HydrophobicContact CG1-CD1 4.27Å; V73-L147 HydrophobicContact CG1-CD2 4.48Å; V73-L147 HydrophobicContact CG2-CD1 3.98Å; V73-L147 HydrophobicContact CG2-CD2 4.31Å; V73-S159 WeakPolarHBondContact CA-OG 3.27Å; V73-S159 VanDerWaalsContact CG1-OG 3.28Å; V73-S159 WeakPolarHBondContact CG1-OG 3.35Å
74	V	75.9	Confident	68.4	Low	117 Å²	117	85.4 Å²	85.4	71%	0.709	48%	0.483	S	S	*	.			trans	-86.9	124.7	172.7	-175.5	0	0	0	0	108.6	S159	V74-S159 PolarHBondContact N-OG 3.29Å
75	F	79.3	Confident	70.7	Confident	74 Å²	74	80 Å²	80	33%	0.325	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.9	175.7	66.6	-86.5	0	0	0	110.3	L70 A82 V83 L84 L143	L70-F75 HydrophobicContact CD2-CE1 4.02Å; F75-A82 HydrophobicContact CD2-CB 3.69Å; F75-A82 HydrophobicContact CE2-CB 4.24Å; F75-A82 HydrophobicContact CG-CB 4.36Å; F75-V83 CarbonylContact C-O 3.1Å; F75-V83 WeakPolarHBondContact CA-O 3.32Å; F75-L84 HydrophobicContact CB-CB 3.74Å; F75-L84 HydrophobicContact CB-CD2 4.41Å; F75-L84 HydrophobicContact CB-CG 4.5Å; F75-L143 HydrophobicContact CB-CD2 4.38Å; F75-L143 HydrophobicContact CD1-CD2 3.66Å; F75-L143 HydrophobicContact CD2-CD2 3.94Å; F75-L143 HydrophobicContact CE1-CD2 3.8Å; F75-L143 HydrophobicContact CE2-CD2 4.06Å; F75-L143 HydrophobicContact CG-CD2 3.73Å; F75-L143 HydrophobicContact CZ-CD2 4Å
76	E	81.5	Confident	73	Confident	144 Å²	144	72.1 Å²	72.1	67%	0.673	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.4	172.2	-64.4	-178.7	175	0	0	108.6	A82 V83	E76-A82 CarbonylContact O-C 3.59Å; E76-A82 WeakPolarHBondContact O-CA 3.41Å; E76-V83 PolarHBondContact N-O 2.88Å; E76-V83 PolarHBondContact O-N 2.83Å
77	E	82.2	Confident	75.2	Confident	129 Å²	129	66.3 Å²	66.3	60%	0.603	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.3	177.3	-172.1	164.6	-157.6	0	0	109.9	K81 S140	E77-K81 WeakPolarHBondContact CA-O 3.44Å; E77-S140 WeakPolarHBondContact OE1-CB 3.48Å; E77-S140 PolarHBondContact OE1-OG 2.86Å
78	Q	80.1	Confident	77	Confident	129 Å²	129	64.1 Å²	64.1	60%	0.603	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.7	179.5	-168.4	175.1	5.2	0	0	109.3	G80 K81	Q78-G80 VanDerWaalsContact C-N 3.28Å; Q78-G80 PolarHBondContact O-N 2.91Å; Q78-K81 PolarHBondContact N-O 3.14Å; Q78-K81 WeakPolarHBondContact O-CB 3.28Å; Q78-K81 PolarHBondContact O-N 2.67Å
79	D	82.3	Confident	78.5	Confident	155 Å²	155	61.3 Å²	61.3	83%	0.829	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.7	176	-58.2	-38.4	0	0	0	114.9	K81	D79-K81 VanDerWaalsContact C-N 3.25Å; D79-K81 PolarHBondContact O-N 3.08Å
80	G	83.6	Confident	79.6	Confident	46 Å²	46	60.3 Å²	60.3	47%	0.474	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	11.6	-179.4	0	0	0	0	0	114.5	Q78 S140	Q78-G80 VanDerWaalsContact C-N 3.28Å; Q78-G80 PolarHBondContact O-N 2.91Å; G80-S140 PolarHBondContact O-N 3.16Å; G80-S140 PolarHBondContact O-OG 2.8Å
81	K	88.7	Confident	80.1	Confident	87 Å²	87	62.2 Å²	62.2	38%	0.378	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.2	171	-63.6	179.1	174.1	-178.2	0	110.2	E77 Q78 D79 E137 V138	E77-K81 WeakPolarHBondContact CA-O 3.44Å; Q78-K81 PolarHBondContact N-O 3.14Å; Q78-K81 WeakPolarHBondContact O-CB 3.28Å; Q78-K81 PolarHBondContact O-N 2.67Å; D79-K81 VanDerWaalsContact C-N 3.25Å; D79-K81 PolarHBondContact O-N 3.08Å; K81-E137 HydrophobicContact CD-CG 4.45Å; K81-E137 IonicContact NZ-OE1 2.59Å; K81-E137 PolarHBondContact NZ-OE1 2.91Å; K81-V138 CarbonylContact C-O 3.59Å; K81-V138 VanDerWaalsContact CA-O 3.29Å; K81-V138 WeakPolarHBondContact CA-O 3.03Å
82	A	89.1	Confident	80.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.8	168.6	0	0	0	0	0	110	F75 E76 E137 V138 S140 L143	F75-A82 HydrophobicContact CD2-CB 3.69Å; F75-A82 HydrophobicContact CE2-CB 4.24Å; F75-A82 HydrophobicContact CG-CB 4.36Å; E76-A82 CarbonylContact O-C 3.59Å; E76-A82 WeakPolarHBondContact O-CA 3.41Å; A82-E137 CarbonylContact O-C 3.58Å; A82-E137 VanDerWaalsContact O-CA 3.27Å; A82-E137 WeakPolarHBondContact O-CA 3.48Å; A82-V138 HydrophobicContact CB-CG1 4.34Å; A82-V138 PolarHBondContact N-O 3.16Å; A82-V138 PolarHBondContact O-N 3.24Å; A82-S140 PolarHBondContact N-OG 3.09Å; A82-L143 HydrophobicContact CB-CB 4.46Å; A82-L143 HydrophobicContact CB-CD1 4.43Å; A82-L143 HydrophobicContact CB-CD2 3.74Å; A82-L143 HydrophobicContact CB-CG 4.43Å
83	V	88.5	Confident	80.1	Confident	24 Å²	24	59.8 Å²	59.8	15%	0.145	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.9	173.5	-174.4	0	0	0	0	108.5	F75 E76 F136 E137	F75-V83 CarbonylContact C-O 3.1Å; F75-V83 WeakPolarHBondContact CA-O 3.32Å; E76-V83 PolarHBondContact N-O 2.88Å; E76-V83 PolarHBondContact O-N 2.83Å; V83-F136 WeakPolarHBondContact CA-O 3.35Å; V83-E137 HydrophobicContact CG2-CB 4.02Å
84	L	90.6	Very high	79.4	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.026	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	161.5	-179.8	63.9	158.1	0	0	0	113.3	V73 F75 L86 R135 F136 L143 L147	V73-L84 HydrophobicContact CG1-CD1 3.45Å; V73-L84 VanDerWaalsContact CG1-CD1 3.45Å; F75-L84 HydrophobicContact CB-CB 3.74Å; F75-L84 HydrophobicContact CB-CD2 4.41Å; F75-L84 HydrophobicContact CB-CG 4.5Å; L84-L86 HydrophobicContact CD1-CD1 4.11Å; L84-L86 HydrophobicContact CD1-CD2 3.77Å; L84-L86 HydrophobicContact CD1-CG 3.82Å; L84-L86 HydrophobicContact CG-CG 4.47Å; L84-R135 WeakPolarHBondContact O-CA 3.34Å; L84-F136 HydrophobicContact CD1-CE1 4.05Å; L84-F136 HydrophobicContact CD1-CZ 3.71Å; L84-F136 HydrophobicContact CD2-CD2 4.19Å; L84-F136 HydrophobicContact CD2-CE1 3.97Å; L84-F136 HydrophobicContact CD2-CE2 3.52Å; L84-F136 HydrophobicContact CD2-CZ 3.4Å; L84-F136 HydrophobicContact CG-CD1 4.41Å; L84-F136 HydrophobicContact CG-CE1 3.63Å; L84-F136 HydrophobicContact CG-CE2 4.13Å; L84-F136 HydrophobicContact CG-CZ 3.48Å; L84-F136 VanDerWaalsContact CG-CZ 3.48Å; L84-F136 PolarHBondContact N-O 2.98Å; L84-F136 VanDerWaalsContact N-O 3.12Å; L84-F136 PolarHBondContact O-N 2.87Å; L84-F136 VanDerWaalsContact O-N 3.16Å; L84-L143 HydrophobicContact CD1-CD1 3.96Å; L84-L143 HydrophobicContact CD2-CD1 3.52Å; L84-L143 HydrophobicContact CG-CD1 4.43Å; L84-L147 HydrophobicContact CD1-CD2 4.27Å
85	N	89.8	Confident	78.2	Confident	21 Å²	21	63.9 Å²	63.9	11%	0.112	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.1	173.6	-58.2	-40.5	0	0	0	109.3	F133 V134 R135 S159 A160	N85-F133 HydrophobicContact CB-CE2 3.81Å; N85-F133 HydrophobicContact CB-CZ 3.95Å; N85-V134 CarbonylContact C-O 3.57Å; N85-V134 WeakPolarHBondContact CA-O 2.99Å; N85-R135 WeakPolarHBondContact OD1-CB 3.3Å; N85-R135 VanDerWaalsContact OD1-CG 3.23Å; N85-R135 WeakPolarHBondContact OD1-CG 3.49Å; N85-S159 WeakPolarHBondContact O-CA 3.29Å; N85-A160 HydrophobicContact CB-CB 4.09Å; N85-A160 WeakPolarHBondContact CB-O 3.39Å; N85-A160 PolarHBondContact O-N 3.44Å
86	L	89	Confident	77	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141	176	-65.3	178.6	0	0	0	110.7	V73 L84 F133 V134 F136 L147 V157 R158	V73-L86 HydrophobicContact CG1-CD2 3.96Å; L84-L86 HydrophobicContact CD1-CD1 4.11Å; L84-L86 HydrophobicContact CD1-CD2 3.77Å; L84-L86 HydrophobicContact CD1-CG 3.82Å; L84-L86 HydrophobicContact CG-CG 4.47Å; L86-F133 CarbonylContact O-C 3.56Å; L86-F133 WeakPolarHBondContact O-CA 3.48Å; L86-V134 HydrophobicContact CB-CG1 3.84Å; L86-V134 PolarHBondContact N-O 2.99Å; L86-V134 PolarHBondContact O-N 2.85Å; L86-F136 HydrophobicContact CB-CE1 4.46Å; L86-F136 HydrophobicContact CD1-CE1 3.51Å; L86-F136 HydrophobicContact CD1-CZ 3.72Å; L86-F136 HydrophobicContact CG-CE1 3.8Å; L86-F136 HydrophobicContact CG-CZ 4.34Å; L86-L147 HydrophobicContact CD1-CD2 3.58Å; L86-L147 HydrophobicContact CD2-CD2 4.06Å; L86-L147 HydrophobicContact CG-CD2 4.44Å; L86-V157 HydrophobicContact CD1-CG1 4.39Å; L86-V157 HydrophobicContact CD2-CG1 4.43Å; L86-R158 WeakPolarHBondContact CA-O 3.21Å
87	L	87.4	Confident	76.3	Confident	15 Å²	15	56.4 Å²	56.4	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.7	159.8	-81.8	162.2	0	0	0	108.2	E131 Y132 F133 V157 R158 A160	L87-E131 HydrophobicContact CD2-CB 4.21Å; L87-Y132 CarbonylContact C-O 3.51Å; L87-Y132 VanDerWaalsContact CA-O 3.3Å; L87-Y132 WeakPolarHBondContact CA-O 3.37Å; L87-F133 HydrophobicContact CD2-CB 3.77Å; L87-F133 HydrophobicContact CD2-CD2 4.18Å; L87-F133 HydrophobicContact CD2-CG 4.48Å; L87-F133 HydrophobicContact CG-CD2 4.15Å; L87-V157 WeakPolarHBondContact O-CA 3.33Å; L87-R158 HydrophobicContact CB-CG 3.9Å; L87-R158 PolarHBondContact N-O 3.36Å; L87-R158 PolarHBondContact O-N 2.61Å; L87-A160 HydrophobicContact CB-CB 4.4Å; L87-A160 HydrophobicContact CD1-CB 3.7Å; L87-A160 HydrophobicContact CG-CB 3.72Å
88	F	86.2	Confident	75.8	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.5	173.6	64.7	-83.3	0	0	0	113.3	L90 A101 Y132 V134 S154 D156 V157	F88-L90 HydrophobicContact CD2-CD2 4.07Å; F88-L90 HydrophobicContact CE2-CD2 3.71Å; F88-L90 HydrophobicContact CE2-CG 4.24Å; F88-A101 HydrophobicContact CE2-CB 4.05Å; F88-A101 HydrophobicContact CZ-CB 4.47Å; F88-Y132 HydrophobicContact CD2-CD2 4.48Å; F88-Y132 HydrophobicContact CE2-CD2 4.22Å; F88-Y132 HydrophobicContact CE2-CG 4.08Å; F88-Y132 HydrophobicContact CZ-CG 4.18Å; F88-Y132 PolarHBondContact N-O 3.25Å; F88-Y132 PolarHBondContact O-N 2.98Å; F88-V134 HydrophobicContact CD1-CG1 4.16Å; F88-V134 HydrophobicContact CE1-CB 4.18Å; F88-V134 HydrophobicContact CE1-CG1 3.66Å; F88-S154 WeakPolarHBondContact CD2-OG 3.38Å; F88-D156 CarbonylContact C-O 3.39Å; F88-D156 WeakPolarHBondContact CA-O 3.39Å; F88-D156 WeakPolarHBondContact CB-O 3.44Å; F88-V157 HydrophobicContact CB-CB 4.44Å; F88-V157 HydrophobicContact CB-CG2 3.94Å
89	S	83.7	Confident	75.4	Confident	20 Å²	20	46 Å²	46	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136	171.3	62.8	0	0	0	0	109.8	S154 D155 D156	S89-S154 CarbonylContact O-C 3.44Å; S89-S154 WeakPolarHBondContact O-CA 3.49Å; S89-S154 VanDerWaalsContact O-CB 3.24Å; S89-S154 WeakPolarHBondContact O-CB 3.42Å; S89-D155 PolarHBondContact O-N 2.91Å; S89-D156 PolarHBondContact N-O 3.39Å; S89-D156 PolarHBondContact OG-N 3.41Å
90	L	77.4	Confident	75.1	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	147.7	-176.1	-67.8	172.1	0	0	0	112.5	F88 G92 S97 L98 A101 Y132	F88-L90 HydrophobicContact CD2-CD2 4.07Å; F88-L90 HydrophobicContact CE2-CD2 3.71Å; F88-L90 HydrophobicContact CE2-CG 4.24Å; L90-G92 PolarHBondContact O-N 3.42Å; L90-S97 WeakPolarHBondContact CD1-OG 3.44Å; L90-L98 HydrophobicContact CD1-CB 3.64Å; L90-L98 HydrophobicContact CD1-CD1 4.11Å; L90-L98 HydrophobicContact CD1-CG 4.48Å; L90-A101 HydrophobicContact CD2-CB 3.66Å; L90-Y132 HydrophobicContact CB-CE2 4.31Å; L90-Y132 HydrophobicContact CD1-CD2 4.02Å; L90-Y132 HydrophobicContact CD1-CE1 4.27Å; L90-Y132 HydrophobicContact CD1-CE2 3.33Å; L90-Y132 VanDerWaalsContact CD1-CZ 3.47Å; L90-Y132 HydrophobicContact CG-CD2 3.91Å; L90-Y132 HydrophobicContact CG-CE2 3.58Å
91	K	66.9	Low	74.9	Confident	98 Å²	98	44 Å²	44	43%	0.426	24%	0.235	S	C	.	.	S	Bend	trans	-69.7	112.7	176.2	-63.8	-153.9	170.3	147.1	0	111.7	R151 R152 V153 S154 D155	K91-R151 PolarHBondContact NZ-O 2.85Å; K91-R152 PolarHBondContact NZ-O 2.9Å; K91-V153 PolarHBondContact N-O 3.27Å; K91-S154 WeakPolarHBondContact CE-O 3.32Å; K91-D155 WeakPolarHBondContact CA-OD2 3.47Å; K91-D155 WeakPolarHBondContact CE-OD1 3.42Å; K91-D155 HydrophobicContact CG-CB 4.5Å; K91-D155 VanDerWaalsContact CG-OD1 3.25Å; K91-D155 WeakPolarHBondContact CG-OD1 3.15Å
92	G	59.8	Low	74.6	Confident	43 Å²	43	41.6 Å²	41.6	44%	0.443	23%	0.227	S	C	.	.	S	Bend	trans	72.7	170.6	177.8	0	0	0	0	0	114.1	L90 K94	L90-G92 PolarHBondContact O-N 3.42Å; G92-K94 VanDerWaalsContact C-N 3.28Å; G92-K94 PolarHBondContact O-N 3.46Å
93	T	51.8	Low	74.2	Confident	128 Å²	128	47.1 Å²	47.1	79%	0.785	25%	0.251	S	S	*	.	S	Bend	trans	-86.1	10.7	-174.7	52.1	0	0	0	0	114
94	K	53.9	Low	74.1	Confident	153 Å²	153	46.9 Å²	46.9	67%	0.665	25%	0.25	S	C	*	.			trans	-78.3	132.2	-174	-70.4	-169.6	179.6	-175.7	0	111	G92 S96 S97	G92-K94 VanDerWaalsContact C-N 3.28Å; G92-K94 PolarHBondContact O-N 3.46Å; K94-S96 VanDerWaalsContact C-N 3.3Å; K94-S96 PolarHBondContact O-N 2.84Å; K94-S97 VanDerWaalsContact O-CB 3.32Å; K94-S97 WeakPolarHBondContact O-CB 3.38Å; K94-S97 PolarHBondContact O-N 3.18Å; K94-S97 VanDerWaalsContact O-N 3.14Å; K94-S97 PolarHBondContact O-OG 3.28Å
95	P	50.4	Low	74	Confident	60 Å²	60	46.8 Å²	46.8	39%	0.39	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.5	-177.1	-28	35	0	0	0	115.9	S97 F213	P95-S97 PolarHBondContact O-N 3.42Å; P95-S97 VanDerWaalsContact O-N 3.09Å; P95-F213 HydrophobicContact CB-CD2 3.73Å; P95-F213 HydrophobicContact CB-CE1 4.14Å; P95-F213 HydrophobicContact CB-CE2 3.26Å; P95-F213 HydrophobicContact CB-CG 4.36Å; P95-F213 HydrophobicContact CB-CZ 3.51Å; P95-F213 HydrophobicContact CG-CD1 4.43Å; P95-F213 HydrophobicContact CG-CD2 3.26Å; P95-F213 HydrophobicContact CG-CE2 3.37Å; P95-F213 HydrophobicContact CG-CG 3.86Å; P95-F213 HydrophobicContact CG-CZ 4.04Å
96	S	55.1	Low	73.8	Confident	46 Å²	46	50.8 Å²	50.8	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-71.2	0.3	179.7	56.6	0	0	0	0	114.4	K94 S99 R100	K94-S96 VanDerWaalsContact C-N 3.3Å; K94-S96 PolarHBondContact O-N 2.84Å; S96-S99 PolarHBondContact O-OG 2.85Å; S96-R100 VanDerWaalsContact O-CD 3.26Å; S96-R100 WeakPolarHBondContact O-CD 3.48Å; S96-R100 WeakPolarHBondContact O-CG 3.2Å; S96-R100 PolarHBondContact O-N 2.99Å
97	S	64.8	Low	73.7	Confident	16 Å²	16	51.7 Å²	51.7	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-71.8	-33.6	178.1	56.8	0	0	0	0	112.5	L90 K94 P95 A101	L90-S97 WeakPolarHBondContact CD1-OG 3.44Å; K94-S97 VanDerWaalsContact O-CB 3.32Å; K94-S97 WeakPolarHBondContact O-CB 3.38Å; K94-S97 PolarHBondContact O-N 3.18Å; K94-S97 VanDerWaalsContact O-N 3.14Å; K94-S97 PolarHBondContact O-OG 3.28Å; P95-S97 PolarHBondContact O-N 3.42Å; P95-S97 VanDerWaalsContact O-N 3.09Å; S97-A101 PolarHBondContact O-N 2.96Å; S97-A101 VanDerWaalsContact O-N 3.08Å
98	L	72.5	Confident	73.7	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-75	-47.3	-180	179.9	67.6	0	0	0	111.8	L90 R100 A101 V102 Y132 H180 L181	L90-L98 HydrophobicContact CD1-CB 3.64Å; L90-L98 HydrophobicContact CD1-CD1 4.11Å; L90-L98 HydrophobicContact CD1-CG 4.48Å; L98-R100 PolarHBondContact O-N 3.37Å; L98-A101 CarbonylContact O-C 3.47Å; L98-A101 WeakPolarHBondContact O-CA 3.26Å; L98-A101 WeakPolarHBondContact O-CB 3.17Å; L98-A101 PolarHBondContact O-N 2.92Å; L98-V102 HydrophobicContact CD1-CG2 4.15Å; L98-V102 HydrophobicContact CG-CG2 4.19Å; L98-V102 WeakPolarHBondContact O-CG2 3.44Å; L98-V102 PolarHBondContact O-N 3.42Å; L98-Y132 HydrophobicContact CD1-CD1 3.67Å; L98-Y132 HydrophobicContact CD1-CE1 3.63Å; L98-Y132 HydrophobicContact CD1-CG 4.36Å; L98-Y132 HydrophobicContact CD2-CE1 3.97Å; L98-Y132 HydrophobicContact CG-CE1 4.27Å; L98-H180 WeakPolarHBondContact CD2-O 3.27Å; L98-L181 HydrophobicContact CD1-CD2 4.26Å; L98-L181 HydrophobicContact CD2-CB 4.48Å; L98-L181 HydrophobicContact CD2-CD2 3.43Å; L98-L181 VanDerWaalsContact CD2-CD2 3.43Å; L98-L181 HydrophobicContact CD2-CG 4.47Å; L98-L181 HydrophobicContact CG-CD2 4.47Å
99	S	71.7	Confident	73.7	Confident	32 Å²	32	57.1 Å²	57.1	22%	0.224	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-37.4	178.2	51.8	0	0	0	0	111	S96 K103	S96-S99 PolarHBondContact O-OG 2.85Å; S99-K103 VanDerWaalsContact O-CB 3.27Å; S99-K103 WeakPolarHBondContact O-CB 3.43Å; S99-K103 PolarHBondContact O-N 2.85Å
100	R	75.4	Confident	73.9	Confident	161 Å²	161	56.8 Å²	56.8	61%	0.608	30%	0.296	S	S	*	.	H	α-helix	trans	-63.2	-42.8	170.2	-71.7	171.1	-175.4	-172.7	-0.9	113.2	S96 L98 K103 V104	S96-R100 VanDerWaalsContact O-CD 3.26Å; S96-R100 WeakPolarHBondContact O-CD 3.48Å; S96-R100 WeakPolarHBondContact O-CG 3.2Å; S96-R100 PolarHBondContact O-N 2.99Å; L98-R100 PolarHBondContact O-N 3.37Å; R100-K103 PolarHBondContact O-N 3.13Å; R100-V104 WeakPolarHBondContact O-CG2 3.28Å; R100-V104 PolarHBondContact O-N 3.38Å; R100-V104 VanDerWaalsContact O-N 3.16Å
101	A	80.9	Confident	74.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-45.5	177.5	0	0	0	0	0	111.8	F88 L90 S97 L98 K103 V104 F105 V153	F88-A101 HydrophobicContact CE2-CB 4.05Å; F88-A101 HydrophobicContact CZ-CB 4.47Å; L90-A101 HydrophobicContact CD2-CB 3.66Å; S97-A101 PolarHBondContact O-N 2.96Å; S97-A101 VanDerWaalsContact O-N 3.08Å; L98-A101 CarbonylContact O-C 3.47Å; L98-A101 WeakPolarHBondContact O-CA 3.26Å; L98-A101 WeakPolarHBondContact O-CB 3.17Å; L98-A101 PolarHBondContact O-N 2.92Å; A101-K103 VanDerWaalsContact C-N 3.29Å; A101-K103 PolarHBondContact O-N 3.24Å; A101-V104 WeakPolarHBondContact O-CB 3.43Å; A101-V104 PolarHBondContact O-N 3.46Å; A101-V104 VanDerWaalsContact O-N 3.17Å; A101-F105 WeakPolarHBondContact O-CD2 3.43Å; A101-V153 HydrophobicContact CB-CG2 4.09Å
102	V	81.3	Confident	75.4	Confident	35 Å²	35	60.3 Å²	60.3	21%	0.212	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-40.9	173.8	176.5	0	0	0	0	110.6	L98 V104 F105 E106 I112 L115	L98-V102 HydrophobicContact CD1-CG2 4.15Å; L98-V102 HydrophobicContact CG-CG2 4.19Å; L98-V102 WeakPolarHBondContact O-CG2 3.44Å; L98-V102 PolarHBondContact O-N 3.42Å; V102-V104 PolarHBondContact O-N 2.89Å; V102-F105 WeakPolarHBondContact O-CB 3.38Å; V102-F105 PolarHBondContact O-N 2.91Å; V102-E106 PolarHBondContact O-N 3.3Å; V102-E106 VanDerWaalsContact O-N 3.1Å; V102-I112 HydrophobicContact CG1-CD1 4.43Å; V102-L115 HydrophobicContact CG2-CD2 4.21Å
103	K	81.4	Confident	76.6	Confident	116 Å²	116	61.1 Å²	61.1	50%	0.504	31%	0.305	S	S	.	.	H	α-helix	trans	-59.4	-34.6	177.3	-166.1	59.8	175.2	-179.1	0	113	S99 R100 A101 F105 E106 T107	S99-K103 VanDerWaalsContact O-CB 3.27Å; S99-K103 WeakPolarHBondContact O-CB 3.43Å; S99-K103 PolarHBondContact O-N 2.85Å; R100-K103 PolarHBondContact O-N 3.13Å; A101-K103 VanDerWaalsContact C-N 3.29Å; A101-K103 PolarHBondContact O-N 3.24Å; K103-F105 PolarHBondContact O-N 3.29Å; K103-E106 HydrophobicContact CD-CB 4.41Å; K103-E106 WeakPolarHBondContact CD-OE2 3.44Å; K103-E106 IonicContact NZ-OE2 3.13Å; K103-E106 PolarHBondContact NZ-OE2 2.86Å; K103-E106 PolarHBondContact O-N 2.97Å; K103-T107 PolarHBondContact O-N 3Å; K103-T107 PolarHBondContact O-OG1 3.22Å; K103-T107 VanDerWaalsContact O-OG1 3.09Å
104	V	86.7	Confident	78.2	Confident	19 Å²	19	55.7 Å²	55.7	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-57.9	-49.6	172.8	173.4	0	0	0	0	110.1	R100 A101 V102 E106 T107 F108 S149 V150 V153	R100-V104 WeakPolarHBondContact O-CG2 3.28Å; R100-V104 PolarHBondContact O-N 3.38Å; R100-V104 VanDerWaalsContact O-N 3.16Å; A101-V104 WeakPolarHBondContact O-CB 3.43Å; A101-V104 PolarHBondContact O-N 3.46Å; A101-V104 VanDerWaalsContact O-N 3.17Å; V102-V104 PolarHBondContact O-N 2.89Å; V104-E106 VanDerWaalsContact C-N 3.32Å; V104-E106 PolarHBondContact O-N 3.46Å; V104-T107 PolarHBondContact O-N 2.74Å; V104-F108 HydrophobicContact CG1-CD2 3.99Å; V104-F108 HydrophobicContact CG1-CE2 4.01Å; V104-F108 WeakPolarHBondContact O-CD2 3.28Å; V104-F108 PolarHBondContact O-N 3.35Å; V104-S149 VanDerWaalsContact CG1-CB 3.46Å; V104-V150 HydrophobicContact CG1-CG2 3.87Å; V104-V153 HydrophobicContact CG2-CG2 4.31Å
105	F	88.9	Confident	79.7	Confident	3 Å²	3	50 Å²	50	1%	0.013	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-43.3	178.4	-66.8	-85.2	0	0	0	111.7	A101 V102 K103 F108 E109 A110 I112 V134 F136 L146 V150	A101-F105 WeakPolarHBondContact O-CD2 3.43Å; V102-F105 WeakPolarHBondContact O-CB 3.38Å; V102-F105 PolarHBondContact O-N 2.91Å; K103-F105 PolarHBondContact O-N 3.29Å; F105-F108 PolarHBondContact O-N 3.12Å; F105-E109 PolarHBondContact O-N 2.78Å; F105-A110 HydrophobicContact CB-CB 4.08Å; F105-A110 HydrophobicContact CD1-CB 4.12Å; F105-A110 WeakPolarHBondContact O-CB 3.5Å; F105-A110 PolarHBondContact O-N 3.41Å; F105-I112 HydrophobicContact CB-CD1 3.91Å; F105-I112 HydrophobicContact CB-CG1 4.18Å; F105-I112 HydrophobicContact CD2-CD1 4.33Å; F105-I112 HydrophobicContact CG-CD1 4.09Å; F105-I112 HydrophobicContact CG-CG1 4.36Å; F105-V134 HydrophobicContact CE1-CG1 4.27Å; F105-V134 HydrophobicContact CZ-CG1 3.84Å; F105-V134 HydrophobicContact CZ-CG2 4.48Å; F105-F136 HydrophobicContact CD1-CD1 4.26Å; F105-F136 HydrophobicContact CD1-CD2 4.04Å; F105-F136 HydrophobicContact CD1-CE1 4.47Å; F105-F136 HydrophobicContact CD1-CE2 4.24Å; F105-F136 HydrophobicContact CD1-CG 4.03Å; F105-F136 HydrophobicContact CD1-CZ 4.45Å; F105-F136 AromaticContact CE1-CD1 3.67Å; F105-F136 HydrophobicContact CE1-CD1 3.67Å; F105-F136 HydrophobicContact CE1-CD2 4.07Å; F105-F136 AromaticContact CE1-CE1 3.6Å; F105-F136 HydrophobicContact CE1-CE1 3.6Å; F105-F136 AromaticContact CE1-CE2 3.98Å; F105-F136 HydrophobicContact CE1-CE2 3.98Å; F105-F136 AromaticContact CE1-CG 3.91Å; F105-F136 HydrophobicContact CE1-CG 3.91Å; F105-F136 AromaticContact CE1-CZ 3.74Å; F105-F136 HydrophobicContact CE1-CZ 3.74Å; F105-F136 HydrophobicContact CZ-CE1 4.4Å; F105-L146 HydrophobicContact CD1-CD1 4.04Å; F105-L146 HydrophobicContact CD1-CD2 4.24Å; F105-L146 HydrophobicContact CE1-CD1 4.48Å; F105-L146 HydrophobicContact CE1-CD2 3.9Å; F105-V150 HydrophobicContact CE1-CG2 4.32Å; F105-V150 HydrophobicContact CE2-CG2 4.02Å; F105-V150 HydrophobicContact CZ-CG2 3.77Å
106	E	85.4	Confident	81.2	Confident	105 Å²	105	47.2 Å²	47.2	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-60.2	-45.5	176.1	-66.2	177.8	-176.4	0	0	113	V102 K103 V104 F108 E109	V102-E106 PolarHBondContact O-N 3.3Å; V102-E106 VanDerWaalsContact O-N 3.1Å; K103-E106 HydrophobicContact CD-CB 4.41Å; K103-E106 WeakPolarHBondContact CD-OE2 3.44Å; K103-E106 IonicContact NZ-OE2 3.13Å; K103-E106 PolarHBondContact NZ-OE2 2.86Å; K103-E106 PolarHBondContact O-N 2.97Å; V104-E106 VanDerWaalsContact C-N 3.32Å; V104-E106 PolarHBondContact O-N 3.46Å; E106-F108 PolarHBondContact O-N 2.68Å; E106-E109 PolarHBondContact O-N 3.09Å
107	T	85.7	Confident	82.5	Confident	19 Å²	19	45 Å²	45	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-59	-30.9	179.3	-63.8	0	0	0	0	112.2	E48 K103 V104 E109	E48-T107 HydrophobicContact CB-CG2 3.93Å; K103-T107 PolarHBondContact O-N 3Å; K103-T107 PolarHBondContact O-OG1 3.22Å; K103-T107 VanDerWaalsContact O-OG1 3.09Å; V104-T107 PolarHBondContact O-N 2.74Å; T107-E109 VanDerWaalsContact C-N 3.33Å
108	F	88	Confident	83.1	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.013	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	9.9	177	-73.7	-76	0	0	0	113.7	R49 A52 V104 F105 E106 A110 V138 D142 A145 L146 S149	R49-F108 HydrophobicContact CB-CE1 4.45Å; R49-F108 HydrophobicContact CG-CD1 3.91Å; R49-F108 HydrophobicContact CG-CE1 3.87Å; A52-F108 HydrophobicContact CB-CE1 4.49Å; A52-F108 HydrophobicContact CB-CZ 3.71Å; V104-F108 HydrophobicContact CG1-CD2 3.99Å; V104-F108 HydrophobicContact CG1-CE2 4.01Å; V104-F108 WeakPolarHBondContact O-CD2 3.28Å; V104-F108 PolarHBondContact O-N 3.35Å; F105-F108 PolarHBondContact O-N 3.12Å; E106-F108 PolarHBondContact O-N 2.68Å; F108-A110 PolarHBondContact O-N 2.97Å; F108-A110 VanDerWaalsContact O-N 3.12Å; F108-V138 HydrophobicContact CB-CG2 4.33Å; F108-D142 HydrophobicContact CD1-CB 3.87Å; F108-D142 HydrophobicContact CE1-CB 4.48Å; F108-A145 HydrophobicContact CE1-CB 3.62Å; F108-A145 HydrophobicContact CZ-CB 3.89Å; F108-L146 HydrophobicContact CB-CB 4.32Å; F108-L146 HydrophobicContact CB-CD1 3.78Å; F108-L146 HydrophobicContact CB-CG 4.35Å; F108-L146 HydrophobicContact CD1-CB 4.3Å; F108-L146 HydrophobicContact CD2-CB 3.86Å; F108-L146 HydrophobicContact CD2-CD1 4.37Å; F108-L146 HydrophobicContact CD2-CG 4.04Å; F108-L146 HydrophobicContact CE2-CB 4.27Å; F108-L146 HydrophobicContact CG-CB 3.9Å; F108-L146 HydrophobicContact CG-CD1 4.24Å; F108-L146 HydrophobicContact CG-CG 4.27Å; F108-S149 WeakPolarHBondContact CE2-OG 3.48Å
109	E	86.3	Confident	83.3	Confident	131 Å²	131	47.9 Å²	47.9	61%	0.612	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	28.7	-176.9	-56.6	171.9	156.4	0	0	112.1	R49 F105 E106 T107 K111	R49-E109 IonicContact NH1-OE2 3.84Å; R49-E109 PolarHBondContact NH1-OE2 3.11Å; F105-E109 PolarHBondContact O-N 2.78Å; E106-E109 PolarHBondContact O-N 3.09Å; T107-E109 VanDerWaalsContact C-N 3.33Å; E109-K111 PolarHBondContact O-N 3.03Å
110	A	88.8	Confident	83.4	Confident	12 Å²	12	47.1 Å²	47.1	10%	0.099	22%	0.224	C	C	.	.			trans	-73.8	125.7	178	0	0	0	0	0	109.1	F105 F108 I112 F136 E137 V138 L146	F105-A110 HydrophobicContact CB-CB 4.08Å; F105-A110 HydrophobicContact CD1-CB 4.12Å; F105-A110 WeakPolarHBondContact O-CB 3.5Å; F105-A110 PolarHBondContact O-N 3.41Å; F108-A110 PolarHBondContact O-N 2.97Å; F108-A110 VanDerWaalsContact O-N 3.12Å; A110-I112 PolarHBondContact O-N 3.18Å; A110-F136 HydrophobicContact CB-CD2 3.99Å; A110-E137 CarbonylContact C-O 3.55Å; A110-E137 WeakPolarHBondContact CA-O 3.4Å; A110-V138 HydrophobicContact CB-CB 4.02Å; A110-V138 HydrophobicContact CB-CG2 4.17Å; A110-L146 HydrophobicContact CB-CD1 3.76Å
111	K	87.6	Confident	83	Confident	123 Å²	123	46.9 Å²	46.9	54%	0.535	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	109.9	173.5	173.4	-178.3	179.2	-175.7	0	108.2	E109 H113 F136 E137	E109-K111 PolarHBondContact O-N 3.03Å; K111-H113 PolarHBondContact O-N 3.26Å; K111-F136 CarbonylContact O-C 3.59Å; K111-F136 WeakPolarHBondContact O-CA 3.4Å; K111-F136 WeakPolarHBondContact O-CB 3.49Å; K111-E137 HydrophobicContact CB-CG 3.66Å; K111-E137 HydrophobicContact CD-CG 4.41Å; K111-E137 HydrophobicContact CG-CG 4.34Å; K111-E137 PolarHBondContact N-O 3.17Å; K111-E137 PolarHBondContact O-N 2.81Å
112	I	87.7	Confident	82.3	Confident	55 Å²	55	56.8 Å²	56.8	28%	0.282	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.6	173.1	-61.4	175.6	0	0	0	108.1	V102 F105 A110 L115 V134 F136	V102-I112 HydrophobicContact CG1-CD1 4.43Å; F105-I112 HydrophobicContact CB-CD1 3.91Å; F105-I112 HydrophobicContact CB-CG1 4.18Å; F105-I112 HydrophobicContact CD2-CD1 4.33Å; F105-I112 HydrophobicContact CG-CD1 4.09Å; F105-I112 HydrophobicContact CG-CG1 4.36Å; A110-I112 PolarHBondContact O-N 3.18Å; I112-L115 HydrophobicContact CG2-CB 4.14Å; I112-V134 HydrophobicContact CD1-CG2 4.46Å; I112-V134 HydrophobicContact CG1-CG2 4.27Å; I112-V134 HydrophobicContact CG2-CG2 3.88Å; I112-F136 HydrophobicContact CG1-CB 4.31Å
113	H	85.2	Confident	81.2	Confident	60 Å²	60	58.4 Å²	58.4	28%	0.278	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-32.6	175.3	-63.2	-60	0	0	0	111.6	K111 R135 E137	K111-H113 PolarHBondContact O-N 3.26Å; H113-R135 HydrophobicContact CB-CB 4.48Å; H113-R135 HydrophobicContact CB-CG 4.14Å; H113-R135 PolarHBondContact N-O 3.24Å; H113-E137 IonicContact CE1-OE2 3.46Å; H113-E137 PolarHBondContact CE1-OE2 3.4Å; H113-E137 VanDerWaalsContact CE1-OE2 3.25Å; H113-E137 WeakPolarHBondContact NE2-CG 3.28Å; H113-E137 IonicContact NE2-OE2 2.73Å; H113-E137 PolarHBondContact NE2-OE2 3.33Å
114	H	85.6	Confident	80.1	Confident	14 Å²	14	59.1 Å²	59.1	7%	0.065	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	139	-178	-175.6	87.2	0	0	0	110.7	E116 F133 V134 R135 R299 D362	H114-E116 IonicContact CE1-OE2 2.7Å; H114-E116 VanDerWaalsContact NE2-CG 3.27Å; H114-E116 WeakPolarHBondContact NE2-CG 3.3Å; H114-E116 IonicContact NE2-OE1 2.97Å; H114-E116 IonicContact NE2-OE2 3.44Å; H114-E116 PolarHBondContact NE2-OE2 3.12Å; H114-F133 AromaticContact CD2-CD1 3.45Å; H114-F133 VanDerWaalsContact CD2-CD1 3.45Å; H114-F133 WeakPolarHBondContact CD2-CD1 3.31Å; H114-F133 AromaticContact CD2-CE1 3.48Å; H114-F133 VanDerWaalsContact CD2-CE1 3.48Å; H114-F133 WeakPolarHBondContact CD2-CE1 3.32Å; H114-F133 AromaticContact NE2-CD1 3.89Å; H114-V134 CarbonylContact O-C 3.5Å; H114-V134 VanDerWaalsContact O-CA 3.31Å; H114-V134 WeakPolarHBondContact O-CA 3.48Å; H114-R135 HydrophobicContact CB-CB 3.84Å; H114-R135 PolarHBondContact N-O 3.1Å; H114-R135 VanDerWaalsContact N-O 3.14Å; H114-R135 PolarHBondContact O-N 3.37Å; H114-R299 PolarHBondContact CE1-NE 3.35Å; H114-D362 WeakPolarHBondContact CB-OD2 3.48Å; H114-D362 IonicContact CE1-OD1 3.17Å; H114-D362 IonicContact CG-OD1 3.27Å; H114-D362 IonicContact CG-OD2 2.72Å; H114-D362 VanDerWaalsContact ND1-CG 3.28Å; H114-D362 IonicContact ND1-OD1 3.43Å; H114-D362 PolarHBondContact ND1-OD1 3.18Å; H114-D362 IonicContact ND1-OD2 2.55Å; H114-D362 PolarHBondContact ND1-OD2 3.04Å
115	L	84.4	Confident	78.4	Confident	33 Å²	33	63.7 Å²	63.7	17%	0.173	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	123.1	174.7	-179.1	65.1	0	0	0	108.9	V102 I112 F133 V134 L181	V102-L115 HydrophobicContact CG2-CD2 4.21Å; I112-L115 HydrophobicContact CG2-CB 4.14Å; L115-F133 WeakPolarHBondContact CA-O 3.34Å; L115-V134 HydrophobicContact CD1-CB 3.96Å; L115-V134 HydrophobicContact CD1-CG2 4.16Å; L115-L181 HydrophobicContact CD1-CD2 4.41Å; L115-L181 HydrophobicContact CD2-CD1 4.43Å; L115-L181 HydrophobicContact CD2-CD2 3.85Å; L115-L181 HydrophobicContact CG-CD1 3.97Å; L115-L181 HydrophobicContact CG-CD2 3.87Å; L115-L181 WeakPolarHBondContact O-CD1 3.33Å
116	E	82.8	Confident	76.7	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.009	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	161.6	176.4	69.2	-176.7	-176.9	0	0	111.5	H114 R118 Y132 F133 W167	H114-E116 IonicContact CE1-OE2 2.7Å; H114-E116 VanDerWaalsContact NE2-CG 3.27Å; H114-E116 WeakPolarHBondContact NE2-CG 3.3Å; H114-E116 IonicContact NE2-OE1 2.97Å; H114-E116 IonicContact NE2-OE2 3.44Å; H114-E116 PolarHBondContact NE2-OE2 3.12Å; E116-R118 HydrophobicContact CG-CG 4.3Å; E116-R118 IonicContact OE1-CZ 2.7Å; E116-R118 IonicContact OE1-NE 3.15Å; E116-R118 PolarHBondContact OE1-NE 2.88Å; E116-R118 IonicContact OE1-NH2 3.69Å; E116-R118 PolarHBondContact OE1-NH2 2.8Å; E116-Y132 WeakPolarHBondContact O-CA 3.37Å; E116-F133 HydrophobicContact CG-CB 3.96Å; E116-F133 HydrophobicContact CG-CD1 4.02Å; E116-F133 HydrophobicContact CG-CG 4.43Å; E116-F133 PolarHBondContact N-O 3.42Å; E116-F133 PolarHBondContact O-N 2.87Å; E116-W167 PolarHBondContact OE2-N 3.01Å
117	T	81.3	Confident	75.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.8	173.3	50.5	0	0	0	0	110.2	L130 E131 Y132 W167 K177 L181	T117-L130 HydrophobicContact CG2-CD2 4.1Å; T117-L130 HydrophobicContact CG2-CG 4.4Å; T117-E131 CarbonylContact C-O 3.06Å; T117-E131 WeakPolarHBondContact CA-O 3.35Å; T117-Y132 HydrophobicContact CG2-CD1 3.63Å; T117-Y132 HydrophobicContact CG2-CE1 3.46Å; T117-Y132 VanDerWaalsContact CG2-CE1 3.46Å; T117-W167 VanDerWaalsContact O-CE3 3.29Å; T117-W167 WeakPolarHBondContact O-CZ3 3.39Å; T117-K177 PolarHBondContact OG1-O 3.46Å; T117-L181 HydrophobicContact CG2-CD1 4.36Å; T117-L181 HydrophobicContact CG2-CD2 3.93Å; T117-L181 HydrophobicContact CG2-CG 3.85Å
118	R	77.8	Confident	73.7	Confident	31 Å²	31	65.9 Å²	65.9	12%	0.117	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156.4	-177.9	-64.8	-176.8	178.9	-159.1	-3.9	111.7	E116 A120 L130 E131 D163 W167	E116-R118 HydrophobicContact CG-CG 4.3Å; E116-R118 IonicContact OE1-CZ 2.7Å; E116-R118 IonicContact OE1-NE 3.15Å; E116-R118 PolarHBondContact OE1-NE 2.88Å; E116-R118 IonicContact OE1-NH2 3.69Å; E116-R118 PolarHBondContact OE1-NH2 2.8Å; R118-A120 PolarHBondContact O-N 2.89Å; R118-L130 WeakPolarHBondContact O-CA 3.35Å; R118-E131 PolarHBondContact N-O 3.04Å; R118-E131 PolarHBondContact O-N 3.43Å; R118-D163 IonicContact CZ-OD2 3.04Å; R118-D163 IonicContact NH1-OD2 2.74Å; R118-D163 PolarHBondContact NH1-OD2 3.24Å; R118-D163 IonicContact NH2-OD2 2.69Å; R118-D163 PolarHBondContact NH2-OD2 2.63Å; R118-W167 HydrophobicContact CG-CB 4.38Å; R118-W167 HydrophobicContact CG-CG 4.31Å
119	P	76.1	Confident	72.7	Confident	51 Å²	51	72 Å²	72	33%	0.331	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	132.6	168.3	-13.7	26.8	0	0	0	110.4	Q121 K177	P119-Q121 PolarHBondContact O-N 2.66Å; P119-K177 HydrophobicContact CG-CD 4.02Å
120	A	75.4	Confident	72.3	Confident	17 Å²	17	66.5 Å²	66.5	14%	0.14	37%	0.371	C	S	.	.			trans	-62.7	127.4	176.4	0	0	0	0	0	111.2	R118 R122 H129 E131	R118-A120 PolarHBondContact O-N 2.89Å; A120-R122 VanDerWaalsContact C-N 3.31Å; A120-R122 PolarHBondContact O-N 2.64Å; A120-H129 PolarHBondContact N-O 2.85Å; A120-E131 HydrophobicContact CB-CG 3.83Å
121	Q	66.4	Low	72.1	Confident	155 Å²	155	66.5 Å²	66.5	72%	0.724	37%	0.369	S	S	*	.	S	Bend	trans	-71.6	-25.3	-178.9	-68.8	-166.9	-7.1	0	0	113.3	P119	P119-Q121 PolarHBondContact O-N 2.66Å
122	R	65.3	Low	72.1	Confident	208 Å²	208	61.3 Å²	61.3	79%	0.785	35%	0.346	S	S	*	.	S	Bend	trans	-136.6	82.5	176.4	-64.5	-177	-166.1	172.9	4.8	109.7	A120 L124	A120-R122 VanDerWaalsContact C-N 3.31Å; A120-R122 PolarHBondContact O-N 2.64Å; R122-L124 PolarHBondContact O-N 3.47Å
123	P	58.5	Low	72	Confident	69 Å²	69	59 Å²	59	45%	0.448	33%	0.334	S	S	.	.			trans	-63.8	120.6	176	14.4	-13.5	0	0	0	109.2
124	L	57.9	Low	72.2	Confident	132 Å²	132	56.2 Å²	56.2	69%	0.691	32%	0.321	S	S	*	.			trans	-72.8	148.6	166.2	-81.1	120.9	0	0	0	108.4	R122 G126 S127	R122-L124 PolarHBondContact O-N 3.47Å; L124-G126 PolarHBondContact O-N 3.29Å; L124-S127 PolarHBondContact N-OG 2.94Å; L124-S127 PolarHBondContact O-N 3.08Å; L124-S127 PolarHBondContact O-OG 3.25Å; L124-S127 VanDerWaalsContact O-OG 3.07Å
125	A	50.6	Low	72.4	Confident	115 Å²	115	59.1 Å²	59.1	95%	0.95	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	114.2	176.5	0	0	0	0	0	109.8
126	G	54.1	Low	72.7	Confident	89 Å²	89	57.6 Å²	57.6	92%	0.918	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	0.7	-177.3	0	0	0	0	0	116	L124	L124-G126 PolarHBondContact O-N 3.29Å
127	S	52.6	Low	73.1	Confident	34 Å²	34	59.1 Å²	59.1	24%	0.238	33%	0.331	C	S	.	.	S	Bend	trans	-85.8	149.6	173.7	75.3	0	0	0	0	111.8	L124 H129	L124-S127 PolarHBondContact N-OG 2.94Å; L124-S127 PolarHBondContact O-N 3.08Å; L124-S127 PolarHBondContact O-OG 3.25Å; L124-S127 VanDerWaalsContact O-OG 3.07Å; S127-H129 PolarHBondContact O-N 3Å; S127-H129 PolarHBondContact O-ND1 2.95Å
128	P	55.2	Low	73.7	Confident	49 Å²	49	59.2 Å²	59.2	32%	0.318	33%	0.331	S	S	.	.			trans	-55.9	137.6	170.5	22.2	-30.6	0	0	0	109.6	L130	P128-L130 PolarHBondContact O-N 3.42Å
129	H	68	Low	74.3	Confident	133 Å²	133	59.5 Å²	59.5	62%	0.616	34%	0.337	S	S	*	.	S	Bend	trans	-77.9	27.8	-179.7	-67.2	40.6	0	0	0	112	A120 S127	A120-H129 PolarHBondContact N-O 2.85Å; S127-H129 PolarHBondContact O-N 3Å; S127-H129 PolarHBondContact O-ND1 2.95Å
130	L	77.5	Confident	74.9	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.079	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.7	-168.3	-162.5	76.5	0	0	0	110	T117 R118 P128 Y132 K177 H180	T117-L130 HydrophobicContact CG2-CD2 4.1Å; T117-L130 HydrophobicContact CG2-CG 4.4Å; R118-L130 WeakPolarHBondContact O-CA 3.35Å; P128-L130 PolarHBondContact O-N 3.42Å; L130-Y132 HydrophobicContact CD2-CE2 4.23Å; L130-K177 HydrophobicContact CD1-CB 3.62Å; L130-K177 HydrophobicContact CD1-CG 3.87Å; L130-H180 HydrophobicContact CD2-CB 4.2Å; L130-H180 VanDerWaalsContact CD2-CD2 3.41Å; L130-H180 WeakPolarHBondContact CD2-CD2 3.41Å
131	E	84.7	Confident	75.4	Confident	11 Å²	11	61.4 Å²	61.4	5%	0.051	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	153.6	170.8	-72.5	172.8	174.5	0	0	109.2	L87 T117 R118 A120 R158	L87-E131 HydrophobicContact CD2-CB 4.21Å; T117-E131 CarbonylContact C-O 3.06Å; T117-E131 WeakPolarHBondContact CA-O 3.35Å; R118-E131 PolarHBondContact N-O 3.04Å; R118-E131 PolarHBondContact O-N 3.43Å; A120-E131 HydrophobicContact CB-CG 3.83Å; E131-R158 IonicContact OE1-CZ 2.68Å; E131-R158 VanDerWaalsContact OE1-CZ 3.26Å; E131-R158 IonicContact OE1-NH1 3.75Å; E131-R158 PolarHBondContact OE1-NH1 3.32Å; E131-R158 IonicContact OE1-NH2 3.77Å; E131-R158 PolarHBondContact OE1-NH2 2.85Å; E131-R158 IonicContact OE2-CZ 3.19Å; E131-R158 IonicContact OE2-NH2 3.11Å; E131-R158 PolarHBondContact OE2-NH2 2.72Å
132	Y	86.2	Confident	76.4	Confident	14 Å²	14	54.9 Å²	54.9	6%	0.055	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.5	176.1	-63.2	-93.3	0	0	0	108.2	L87 F88 L90 L98 E116 T117 L130 H180 L181	L87-Y132 CarbonylContact C-O 3.51Å; L87-Y132 VanDerWaalsContact CA-O 3.3Å; L87-Y132 WeakPolarHBondContact CA-O 3.37Å; F88-Y132 HydrophobicContact CD2-CD2 4.48Å; F88-Y132 HydrophobicContact CE2-CD2 4.22Å; F88-Y132 HydrophobicContact CE2-CG 4.08Å; F88-Y132 HydrophobicContact CZ-CG 4.18Å; F88-Y132 PolarHBondContact N-O 3.25Å; F88-Y132 PolarHBondContact O-N 2.98Å; L90-Y132 HydrophobicContact CB-CE2 4.31Å; L90-Y132 HydrophobicContact CD1-CD2 4.02Å; L90-Y132 HydrophobicContact CD1-CE1 4.27Å; L90-Y132 HydrophobicContact CD1-CE2 3.33Å; L90-Y132 VanDerWaalsContact CD1-CZ 3.47Å; L90-Y132 HydrophobicContact CG-CD2 3.91Å; L90-Y132 HydrophobicContact CG-CE2 3.58Å; L98-Y132 HydrophobicContact CD1-CD1 3.67Å; L98-Y132 HydrophobicContact CD1-CE1 3.63Å; L98-Y132 HydrophobicContact CD1-CG 4.36Å; L98-Y132 HydrophobicContact CD2-CE1 3.97Å; L98-Y132 HydrophobicContact CG-CE1 4.27Å; E116-Y132 WeakPolarHBondContact O-CA 3.37Å; T117-Y132 HydrophobicContact CG2-CD1 3.63Å; T117-Y132 HydrophobicContact CG2-CE1 3.46Å; T117-Y132 VanDerWaalsContact CG2-CE1 3.46Å; L130-Y132 HydrophobicContact CD2-CE2 4.23Å; Y132-H180 HydrophobicContact CE1-CB 4.41Å; Y132-L181 HydrophobicContact CD1-CD2 3.78Å; Y132-L181 HydrophobicContact CE1-CD2 3.81Å
133	F	87.3	Confident	77.5	Confident	8 Å²	8	45.1 Å²	45.1	4%	0.035	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.7	171.6	174.6	-92.4	0	0	0	108.5	N85 L86 L87 H114 L115 E116 A160	N85-F133 HydrophobicContact CB-CE2 3.81Å; N85-F133 HydrophobicContact CB-CZ 3.95Å; L86-F133 CarbonylContact O-C 3.56Å; L86-F133 WeakPolarHBondContact O-CA 3.48Å; L87-F133 HydrophobicContact CD2-CB 3.77Å; L87-F133 HydrophobicContact CD2-CD2 4.18Å; L87-F133 HydrophobicContact CD2-CG 4.48Å; L87-F133 HydrophobicContact CG-CD2 4.15Å; H114-F133 AromaticContact CD2-CD1 3.45Å; H114-F133 VanDerWaalsContact CD2-CD1 3.45Å; H114-F133 WeakPolarHBondContact CD2-CD1 3.31Å; H114-F133 AromaticContact CD2-CE1 3.48Å; H114-F133 VanDerWaalsContact CD2-CE1 3.48Å; H114-F133 WeakPolarHBondContact CD2-CE1 3.32Å; H114-F133 AromaticContact NE2-CD1 3.89Å; L115-F133 WeakPolarHBondContact CA-O 3.34Å; E116-F133 HydrophobicContact CG-CB 3.96Å; E116-F133 HydrophobicContact CG-CD1 4.02Å; E116-F133 HydrophobicContact CG-CG 4.43Å; E116-F133 PolarHBondContact N-O 3.42Å; E116-F133 PolarHBondContact O-N 2.87Å; F133-A160 HydrophobicContact CD2-CB 3.77Å; F133-A160 HydrophobicContact CE2-CB 3.6Å
134	V	88.9	Confident	78.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131.9	177	65.3	0	0	0	0	110.6	N85 L86 F88 F105 I112 H114 L115 F136	N85-V134 CarbonylContact C-O 3.57Å; N85-V134 WeakPolarHBondContact CA-O 2.99Å; L86-V134 HydrophobicContact CB-CG1 3.84Å; L86-V134 PolarHBondContact N-O 2.99Å; L86-V134 PolarHBondContact O-N 2.85Å; F88-V134 HydrophobicContact CD1-CG1 4.16Å; F88-V134 HydrophobicContact CE1-CB 4.18Å; F88-V134 HydrophobicContact CE1-CG1 3.66Å; F105-V134 HydrophobicContact CE1-CG1 4.27Å; F105-V134 HydrophobicContact CZ-CG1 3.84Å; F105-V134 HydrophobicContact CZ-CG2 4.48Å; I112-V134 HydrophobicContact CD1-CG2 4.46Å; I112-V134 HydrophobicContact CG1-CG2 4.27Å; I112-V134 HydrophobicContact CG2-CG2 3.88Å; H114-V134 CarbonylContact O-C 3.5Å; H114-V134 VanDerWaalsContact O-CA 3.31Å; H114-V134 WeakPolarHBondContact O-CA 3.48Å; L115-V134 HydrophobicContact CD1-CB 3.96Å; L115-V134 HydrophobicContact CD1-CG2 4.16Å; V134-F136 HydrophobicContact CG1-CD1 4.04Å; V134-F136 HydrophobicContact CG1-CE1 4.21Å; V134-F136 HydrophobicContact CG2-CD1 4.14Å
135	R	89.5	Confident	80.2	Confident	75 Å²	75	37.3 Å²	37.3	28%	0.283	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129	164.8	-179	-179.1	-175.9	161.1	13.7	108.3	L84 N85 H113 H114 E162	L84-R135 WeakPolarHBondContact O-CA 3.34Å; N85-R135 WeakPolarHBondContact OD1-CB 3.3Å; N85-R135 VanDerWaalsContact OD1-CG 3.23Å; N85-R135 WeakPolarHBondContact OD1-CG 3.49Å; H113-R135 HydrophobicContact CB-CB 4.48Å; H113-R135 HydrophobicContact CB-CG 4.14Å; H113-R135 PolarHBondContact N-O 3.24Å; H114-R135 HydrophobicContact CB-CB 3.84Å; H114-R135 PolarHBondContact N-O 3.1Å; H114-R135 VanDerWaalsContact N-O 3.14Å; H114-R135 PolarHBondContact O-N 3.37Å; R135-E162 IonicContact CZ-OE1 3.13Å; R135-E162 IonicContact CZ-OE2 3.08Å; R135-E162 IonicContact NH1-OE1 3.02Å; R135-E162 PolarHBondContact NH1-OE1 3.11Å; R135-E162 IonicContact NH1-OE2 3.29Å; R135-E162 IonicContact NH2-OE1 3.93Å; R135-E162 IonicContact NH2-OE2 3.67Å
136	F	90.8	Very high	82.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	161.3	-179.3	65.7	-78.5	0	0	0	111.7	V83 L84 L86 F105 A110 K111 I112 V134 V138 L146	V83-F136 WeakPolarHBondContact CA-O 3.35Å; L84-F136 HydrophobicContact CD1-CE1 4.05Å; L84-F136 HydrophobicContact CD1-CZ 3.71Å; L84-F136 HydrophobicContact CD2-CD2 4.19Å; L84-F136 HydrophobicContact CD2-CE1 3.97Å; L84-F136 HydrophobicContact CD2-CE2 3.52Å; L84-F136 HydrophobicContact CD2-CZ 3.4Å; L84-F136 HydrophobicContact CG-CD1 4.41Å; L84-F136 HydrophobicContact CG-CE1 3.63Å; L84-F136 HydrophobicContact CG-CE2 4.13Å; L84-F136 HydrophobicContact CG-CZ 3.48Å; L84-F136 VanDerWaalsContact CG-CZ 3.48Å; L84-F136 PolarHBondContact N-O 2.98Å; L84-F136 VanDerWaalsContact N-O 3.12Å; L84-F136 PolarHBondContact O-N 2.87Å; L84-F136 VanDerWaalsContact O-N 3.16Å; L86-F136 HydrophobicContact CB-CE1 4.46Å; L86-F136 HydrophobicContact CD1-CE1 3.51Å; L86-F136 HydrophobicContact CD1-CZ 3.72Å; L86-F136 HydrophobicContact CG-CE1 3.8Å; L86-F136 HydrophobicContact CG-CZ 4.34Å; F105-F136 HydrophobicContact CD1-CD1 4.26Å; F105-F136 HydrophobicContact CD1-CD2 4.04Å; F105-F136 HydrophobicContact CD1-CE1 4.47Å; F105-F136 HydrophobicContact CD1-CE2 4.24Å; F105-F136 HydrophobicContact CD1-CG 4.03Å; F105-F136 HydrophobicContact CD1-CZ 4.45Å; F105-F136 AromaticContact CE1-CD1 3.67Å; F105-F136 HydrophobicContact CE1-CD1 3.67Å; F105-F136 HydrophobicContact CE1-CD2 4.07Å; F105-F136 AromaticContact CE1-CE1 3.6Å; F105-F136 HydrophobicContact CE1-CE1 3.6Å; F105-F136 AromaticContact CE1-CE2 3.98Å; F105-F136 HydrophobicContact CE1-CE2 3.98Å; F105-F136 AromaticContact CE1-CG 3.91Å; F105-F136 HydrophobicContact CE1-CG 3.91Å; F105-F136 AromaticContact CE1-CZ 3.74Å; F105-F136 HydrophobicContact CE1-CZ 3.74Å; F105-F136 HydrophobicContact CZ-CE1 4.4Å; A110-F136 HydrophobicContact CB-CD2 3.99Å; K111-F136 CarbonylContact O-C 3.59Å; K111-F136 WeakPolarHBondContact O-CA 3.4Å; K111-F136 WeakPolarHBondContact O-CB 3.49Å; I112-F136 HydrophobicContact CG1-CB 4.31Å; V134-F136 HydrophobicContact CG1-CD1 4.04Å; V134-F136 HydrophobicContact CG1-CE1 4.21Å; V134-F136 HydrophobicContact CG2-CD1 4.14Å; F136-V138 HydrophobicContact CD2-CB 4.21Å; F136-V138 HydrophobicContact CD2-CG1 4.3Å; F136-V138 HydrophobicContact CE2-CB 4.19Å; F136-V138 HydrophobicContact CE2-CG1 3.87Å; F136-L146 HydrophobicContact CD2-CD1 4.39Å; F136-L146 HydrophobicContact CE2-CD1 3.85Å; F136-L146 HydrophobicContact CE2-CD2 3.82Å; F136-L146 HydrophobicContact CZ-CD2 3.79Å
137	E	91.6	Very high	83.7	Confident	35 Å²	35	27.6 Å²	27.6	16%	0.164	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.6	165.3	66.6	-179.7	-138.6	0	0	110.3	K81 A82 V83 A110 K111 H113	K81-E137 HydrophobicContact CD-CG 4.45Å; K81-E137 IonicContact NZ-OE1 2.59Å; K81-E137 PolarHBondContact NZ-OE1 2.91Å; A82-E137 CarbonylContact O-C 3.58Å; A82-E137 VanDerWaalsContact O-CA 3.27Å; A82-E137 WeakPolarHBondContact O-CA 3.48Å; V83-E137 HydrophobicContact CG2-CB 4.02Å; A110-E137 CarbonylContact C-O 3.55Å; A110-E137 WeakPolarHBondContact CA-O 3.4Å; K111-E137 HydrophobicContact CB-CG 3.66Å; K111-E137 HydrophobicContact CD-CG 4.41Å; K111-E137 HydrophobicContact CG-CG 4.34Å; K111-E137 PolarHBondContact N-O 3.17Å; K111-E137 PolarHBondContact O-N 2.81Å; H113-E137 IonicContact CE1-OE2 3.46Å; H113-E137 PolarHBondContact CE1-OE2 3.4Å; H113-E137 VanDerWaalsContact CE1-OE2 3.25Å; H113-E137 WeakPolarHBondContact NE2-CG 3.28Å; H113-E137 IonicContact NE2-OE2 2.73Å; H113-E137 PolarHBondContact NE2-OE2 3.33Å
138	V	92.8	Very high	85.4	Confident	1 Å²	1	27 Å²	27	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.3	177.9	64.1	0	0	0	0	108.8	K81 A82 F108 A110 F136 S140 D142 L143 L146	K81-V138 CarbonylContact C-O 3.59Å; K81-V138 VanDerWaalsContact CA-O 3.29Å; K81-V138 WeakPolarHBondContact CA-O 3.03Å; A82-V138 HydrophobicContact CB-CG1 4.34Å; A82-V138 PolarHBondContact N-O 3.16Å; A82-V138 PolarHBondContact O-N 3.24Å; F108-V138 HydrophobicContact CB-CG2 4.33Å; A110-V138 HydrophobicContact CB-CB 4.02Å; A110-V138 HydrophobicContact CB-CG2 4.17Å; F136-V138 HydrophobicContact CD2-CB 4.21Å; F136-V138 HydrophobicContact CD2-CG1 4.3Å; F136-V138 HydrophobicContact CE2-CB 4.19Å; F136-V138 HydrophobicContact CE2-CG1 3.87Å; V138-S140 PolarHBondContact O-N 3.12Å; V138-D142 HydrophobicContact CG2-CB 4.16Å; V138-L143 HydrophobicContact CG1-CB 4.18Å; V138-L143 HydrophobicContact CG1-CD1 3.8Å; V138-L146 HydrophobicContact CB-CD1 4.11Å; V138-L146 HydrophobicContact CG1-CD1 4.42Å; V138-L146 HydrophobicContact CG2-CD1 3.73Å
139	P	91.3	Very high	87	Confident	38 Å²	38	25.4 Å²	25.4	25%	0.247	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	133	171.7	-21.1	31.3	0	0	0	110.9	G141 D142	P139-G141 PolarHBondContact O-N 2.92Å; P139-D142 WeakPolarHBondContact CB-OD2 3.45Å; P139-D142 PolarHBondContact O-N 3.26Å
140	S	87.4	Confident	87.9	Confident	32 Å²	32	19.1 Å²	19.1	22%	0.224	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-56.4	-32.9	-170.7	-59.5	0	0	0	0	113.1	E77 G80 A82 V138 D142 L143	E77-S140 WeakPolarHBondContact OE1-CB 3.48Å; E77-S140 PolarHBondContact OE1-OG 2.86Å; G80-S140 PolarHBondContact O-N 3.16Å; G80-S140 PolarHBondContact O-OG 2.8Å; A82-S140 PolarHBondContact N-OG 3.09Å; V138-S140 PolarHBondContact O-N 3.12Å; S140-D142 PolarHBondContact O-N 3.09Å; S140-L143 PolarHBondContact O-N 3.33Å
141	G	86.3	Confident	88.3	Confident	76 Å²	76	21.9 Å²	21.9	78%	0.784	13%	0.134	S	C	*	.	G	3₁₀ helix	trans	-64.2	-22.5	178.7	0	0	0	0	0	114.6	P139	P139-G141 PolarHBondContact O-N 2.92Å
142	D	88.6	Confident	88.3	Confident	18 Å²	18	28 Å²	28	10%	0.096	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-101.8	-10.2	-177.1	-54.2	-68.4	0	0	0	113.8	R49 F108 V138 P139 S140 A144 A145 L146	R49-D142 VanDerWaalsContact CZ-CG 3.43Å; R49-D142 IonicContact CZ-OD1 3.29Å; R49-D142 VanDerWaalsContact CZ-OD1 3.27Å; R49-D142 IonicContact CZ-OD2 3.33Å; R49-D142 IonicContact NE-OD1 3.18Å; R49-D142 PolarHBondContact NE-OD1 2.75Å; R49-D142 IonicContact NE-OD2 2.73Å; R49-D142 PolarHBondContact NE-OD2 3.5Å; R49-D142 IonicContact NH2-OD1 2.89Å; R49-D142 PolarHBondContact NH2-OD1 3.3Å; R49-D142 VanDerWaalsContact NH2-OD1 3.08Å; R49-D142 IonicContact NH2-OD2 3.25Å; R49-D142 PolarHBondContact NH2-OD2 2.93Å; F108-D142 HydrophobicContact CD1-CB 3.87Å; F108-D142 HydrophobicContact CE1-CB 4.48Å; V138-D142 HydrophobicContact CG2-CB 4.16Å; P139-D142 WeakPolarHBondContact CB-OD2 3.45Å; P139-D142 PolarHBondContact O-N 3.26Å; S140-D142 PolarHBondContact O-N 3.09Å; D142-A144 VanDerWaalsContact C-N 3.27Å; D142-A144 PolarHBondContact O-N 3.29Å; D142-A145 PolarHBondContact O-N 2.78Å; D142-L146 PolarHBondContact O-N 3.31Å
143	L	87.3	Confident	88.1	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-52.3	-45.6	-173.5	177.8	62.4	0	0	0	112.1	L70 F75 A82 L84 V138 S140 A145 L146 L147	L70-L143 HydrophobicContact CD2-CD2 3.58Å; L70-L143 HydrophobicContact CD2-CG 3.88Å; F75-L143 HydrophobicContact CB-CD2 4.38Å; F75-L143 HydrophobicContact CD1-CD2 3.66Å; F75-L143 HydrophobicContact CD2-CD2 3.94Å; F75-L143 HydrophobicContact CE1-CD2 3.8Å; F75-L143 HydrophobicContact CE2-CD2 4.06Å; F75-L143 HydrophobicContact CG-CD2 3.73Å; F75-L143 HydrophobicContact CZ-CD2 4Å; A82-L143 HydrophobicContact CB-CB 4.46Å; A82-L143 HydrophobicContact CB-CD1 4.43Å; A82-L143 HydrophobicContact CB-CD2 3.74Å; A82-L143 HydrophobicContact CB-CG 4.43Å; L84-L143 HydrophobicContact CD1-CD1 3.96Å; L84-L143 HydrophobicContact CD2-CD1 3.52Å; L84-L143 HydrophobicContact CG-CD1 4.43Å; V138-L143 HydrophobicContact CG1-CB 4.18Å; V138-L143 HydrophobicContact CG1-CD1 3.8Å; S140-L143 PolarHBondContact O-N 3.33Å; L143-A145 PolarHBondContact O-N 3.26Å; L143-L146 PolarHBondContact O-N 3.39Å; L143-L147 HydrophobicContact CD1-CD1 4.08Å; L143-L147 HydrophobicContact CD1-CG 4.12Å; L143-L147 HydrophobicContact CG-CD1 4.04Å; L143-L147 HydrophobicContact CG-CG 4.48Å; L143-L147 WeakPolarHBondContact O-CB 3.39Å; L143-L147 VanDerWaalsContact O-CG 3.28Å; L143-L147 WeakPolarHBondContact O-CG 3.36Å; L143-L147 PolarHBondContact O-N 2.77Å
144	A	86.6	Confident	87.9	Confident	31 Å²	31	29 Å²	29	26%	0.256	16%	0.164	S	C	.	.	H	α-helix	trans	-65.1	-38.3	180	0	0	0	0	0	112.8	L70 D142 S148	L70-A144 HydrophobicContact CD1-CB 4.31Å; L70-A144 HydrophobicContact CG-CB 4.35Å; D142-A144 VanDerWaalsContact C-N 3.27Å; D142-A144 PolarHBondContact O-N 3.29Å; A144-S148 WeakPolarHBondContact O-CB 3.27Å; A144-S148 PolarHBondContact O-N 3.47Å; A144-S148 VanDerWaalsContact O-N 3.07Å; A144-S148 PolarHBondContact O-OG 2.55Å
145	A	87.5	Confident	87.3	Confident	6 Å²	6	33.8 Å²	33.8	5%	0.05	19%	0.19	C	C	.	.	H	α-helix	trans	-72.3	-39.2	178.4	0	0	0	0	0	111.6	A53 F108 D142 L143 S148 S149	A53-A145 HydrophobicContact CB-CB 4.23Å; F108-A145 HydrophobicContact CE1-CB 3.62Å; F108-A145 HydrophobicContact CZ-CB 3.89Å; D142-A145 PolarHBondContact O-N 2.78Å; L143-A145 PolarHBondContact O-N 3.26Å; A145-S148 PolarHBondContact O-N 2.86Å; A145-S149 WeakPolarHBondContact O-CB 2.82Å; A145-S149 PolarHBondContact O-N 3.43Å; A145-S149 PolarHBondContact O-OG 3.22Å
146	L	89.8	Confident	86.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-53.9	172.5	-177.6	157.9	0	0	0	110.6	F105 F108 A110 F136 V138 D142 L143 S148 S149 V150	F105-L146 HydrophobicContact CD1-CD1 4.04Å; F105-L146 HydrophobicContact CD1-CD2 4.24Å; F105-L146 HydrophobicContact CE1-CD1 4.48Å; F105-L146 HydrophobicContact CE1-CD2 3.9Å; F108-L146 HydrophobicContact CB-CB 4.32Å; F108-L146 HydrophobicContact CB-CD1 3.78Å; F108-L146 HydrophobicContact CB-CG 4.35Å; F108-L146 HydrophobicContact CD1-CB 4.3Å; F108-L146 HydrophobicContact CD2-CB 3.86Å; F108-L146 HydrophobicContact CD2-CD1 4.37Å; F108-L146 HydrophobicContact CD2-CG 4.04Å; F108-L146 HydrophobicContact CE2-CB 4.27Å; F108-L146 HydrophobicContact CG-CB 3.9Å; F108-L146 HydrophobicContact CG-CD1 4.24Å; F108-L146 HydrophobicContact CG-CG 4.27Å; A110-L146 HydrophobicContact CB-CD1 3.76Å; F136-L146 HydrophobicContact CD2-CD1 4.39Å; F136-L146 HydrophobicContact CE2-CD1 3.85Å; F136-L146 HydrophobicContact CE2-CD2 3.82Å; F136-L146 HydrophobicContact CZ-CD2 3.79Å; V138-L146 HydrophobicContact CB-CD1 4.11Å; V138-L146 HydrophobicContact CG1-CD1 4.42Å; V138-L146 HydrophobicContact CG2-CD1 3.73Å; D142-L146 PolarHBondContact O-N 3.31Å; L143-L146 PolarHBondContact O-N 3.39Å; L146-S148 VanDerWaalsContact C-N 3.25Å; L146-S148 PolarHBondContact O-N 3.2Å; L146-S149 CarbonylContact O-C 3.5Å; L146-S149 WeakPolarHBondContact O-CA 3.38Å; L146-S149 WeakPolarHBondContact O-CB 3.42Å; L146-S149 PolarHBondContact O-N 3.06Å; L146-V150 HydrophobicContact CD2-CG2 3.8Å; L146-V150 HydrophobicContact CG-CG2 4.48Å; L146-V150 WeakPolarHBondContact O-CG2 3.31Å; L146-V150 PolarHBondContact O-N 2.66Å
147	L	88.6	Confident	86.6	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-40.7	179.5	-73.6	173.1	0	0	0	111.9	L70 V73 L84 L86 L143 S149 V150 R151	L70-L147 HydrophobicContact CD2-CD1 4.27Å; V73-L147 HydrophobicContact CB-CD1 4.24Å; V73-L147 HydrophobicContact CG1-CD1 4.27Å; V73-L147 HydrophobicContact CG1-CD2 4.48Å; V73-L147 HydrophobicContact CG2-CD1 3.98Å; V73-L147 HydrophobicContact CG2-CD2 4.31Å; L84-L147 HydrophobicContact CD1-CD2 4.27Å; L86-L147 HydrophobicContact CD1-CD2 3.58Å; L86-L147 HydrophobicContact CD2-CD2 4.06Å; L86-L147 HydrophobicContact CG-CD2 4.44Å; L143-L147 HydrophobicContact CD1-CD1 4.08Å; L143-L147 HydrophobicContact CD1-CG 4.12Å; L143-L147 HydrophobicContact CG-CD1 4.04Å; L143-L147 HydrophobicContact CG-CG 4.48Å; L143-L147 WeakPolarHBondContact O-CB 3.39Å; L143-L147 VanDerWaalsContact O-CG 3.28Å; L143-L147 WeakPolarHBondContact O-CG 3.36Å; L143-L147 PolarHBondContact O-N 2.77Å; L147-S149 VanDerWaalsContact C-N 3.33Å; L147-S149 PolarHBondContact O-N 2.99Å; L147-V150 PolarHBondContact O-N 2.96Å; L147-R151 WeakPolarHBondContact O-CG 3.23Å; L147-R151 PolarHBondContact O-N 3.33Å
148	S	87.5	Confident	86.3	Confident	21 Å²	21	35.5 Å²	35.5	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-39.3	175.6	-61.1	0	0	0	0	112	A144 A145 L146 R152	A144-S148 WeakPolarHBondContact O-CB 3.27Å; A144-S148 PolarHBondContact O-N 3.47Å; A144-S148 VanDerWaalsContact O-N 3.07Å; A144-S148 PolarHBondContact O-OG 2.55Å; A145-S148 PolarHBondContact O-N 2.86Å; L146-S148 VanDerWaalsContact C-N 3.25Å; L146-S148 PolarHBondContact O-N 3.2Å; S148-R152 WeakPolarHBondContact O-CG 3.27Å; S148-R152 PolarHBondContact O-N 3.38Å
149	S	88	Confident	85.9	Confident	16 Å²	16	37.1 Å²	37.1	11%	0.112	21%	0.213	C	C	.	.	H	α-helix	trans	-70.7	-41	178.2	-58.8	0	0	0	0	112	V104 F108 A145 L146 L147 R151 R152 V153	V104-S149 VanDerWaalsContact CG1-CB 3.46Å; F108-S149 WeakPolarHBondContact CE2-OG 3.48Å; A145-S149 WeakPolarHBondContact O-CB 2.82Å; A145-S149 PolarHBondContact O-N 3.43Å; A145-S149 PolarHBondContact O-OG 3.22Å; L146-S149 CarbonylContact O-C 3.5Å; L146-S149 WeakPolarHBondContact O-CA 3.38Å; L146-S149 WeakPolarHBondContact O-CB 3.42Å; L146-S149 PolarHBondContact O-N 3.06Å; L147-S149 VanDerWaalsContact C-N 3.33Å; L147-S149 PolarHBondContact O-N 2.99Å; S149-R151 PolarHBondContact O-N 2.94Å; S149-R152 WeakPolarHBondContact O-CB 3.34Å; S149-R152 PolarHBondContact O-N 2.99Å; S149-R152 VanDerWaalsContact O-N 3.11Å; S149-V153 PolarHBondContact O-N 2.72Å
150	V	87.3	Confident	85.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-42.7	174.5	175.5	0	0	0	0	111.1	V104 F105 L146 L147 R152 V153 S154 V157	V104-V150 HydrophobicContact CG1-CG2 3.87Å; F105-V150 HydrophobicContact CE1-CG2 4.32Å; F105-V150 HydrophobicContact CE2-CG2 4.02Å; F105-V150 HydrophobicContact CZ-CG2 3.77Å; L146-V150 HydrophobicContact CD2-CG2 3.8Å; L146-V150 HydrophobicContact CG-CG2 4.48Å; L146-V150 WeakPolarHBondContact O-CG2 3.31Å; L146-V150 PolarHBondContact O-N 2.66Å; L147-V150 PolarHBondContact O-N 2.96Å; V150-R152 PolarHBondContact O-N 3.33Å; V150-V153 VanDerWaalsContact O-CG2 3.28Å; V150-V153 WeakPolarHBondContact O-CG2 3.35Å; V150-V153 PolarHBondContact O-N 3.08Å; V150-S154 VanDerWaalsContact O-CB 3.23Å; V150-S154 WeakPolarHBondContact O-CB 3.33Å; V150-S154 PolarHBondContact O-N 3.29Å; V150-S154 PolarHBondContact O-OG 2.92Å; V150-V157 HydrophobicContact CG1-CG1 4.31Å; V150-V157 HydrophobicContact CG1-CG2 4.04Å
151	R	87.1	Confident	84.8	Confident	74 Å²	74	45.4 Å²	45.4	28%	0.279	24%	0.238	S	C	.	.	H	α-helix	trans	-65.2	-20.7	175	-74.2	-179.3	-173.5	130.6	2.4	114.1	P69 K91 L147 S149 V157	P69-R151 VanDerWaalsContact CB-NH1 3.31Å; P69-R151 PolarHBondContact O-NH1 3.23Å; P69-R151 PolarHBondContact O-NH2 3.04Å; K91-R151 PolarHBondContact NZ-O 2.85Å; L147-R151 WeakPolarHBondContact O-CG 3.23Å; L147-R151 PolarHBondContact O-N 3.33Å; S149-R151 PolarHBondContact O-N 2.94Å; R151-V157 HydrophobicContact CB-CG2 4.41Å; R151-V157 HydrophobicContact CG-CB 3.83Å; R151-V157 HydrophobicContact CG-CG1 4.36Å; R151-V157 HydrophobicContact CG-CG2 3.67Å
152	R	84.9	Confident	84	Confident	140 Å²	140	47.1 Å²	47.1	53%	0.528	23%	0.226	S	C	.	.	H	α-helix	trans	-72.5	-37	173.8	-73.2	172.4	-177.5	-161.3	-0.1	111.4	K91 S148 S149 V150	K91-R152 PolarHBondContact NZ-O 2.9Å; S148-R152 WeakPolarHBondContact O-CG 3.27Å; S148-R152 PolarHBondContact O-N 3.38Å; S149-R152 WeakPolarHBondContact O-CB 3.34Å; S149-R152 PolarHBondContact O-N 2.99Å; S149-R152 VanDerWaalsContact O-N 3.11Å; V150-R152 PolarHBondContact O-N 3.33Å
153	V	81	Confident	83.1	Confident	39 Å²	39	50.1 Å²	50.1	24%	0.236	24%	0.242	C	C	.	.	H	α-helix	trans	-96.8	-4.2	-177	-58.6	0	0	0	0	114.2	K91 A101 V104 S149 V150	K91-V153 PolarHBondContact N-O 3.27Å; A101-V153 HydrophobicContact CB-CG2 4.09Å; V104-V153 HydrophobicContact CG2-CG2 4.31Å; S149-V153 PolarHBondContact O-N 2.72Å; V150-V153 VanDerWaalsContact O-CG2 3.28Å; V150-V153 WeakPolarHBondContact O-CG2 3.35Å; V150-V153 PolarHBondContact O-N 3.08Å
154	S	82.9	Confident	82.6	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.2	-177.9	-47.8	0	0	0	0	112.1	F88 S89 K91 V150	F88-S154 WeakPolarHBondContact CD2-OG 3.38Å; S89-S154 CarbonylContact O-C 3.44Å; S89-S154 WeakPolarHBondContact O-CA 3.49Å; S89-S154 VanDerWaalsContact O-CB 3.24Å; S89-S154 WeakPolarHBondContact O-CB 3.42Å; K91-S154 WeakPolarHBondContact CE-O 3.32Å; V150-S154 VanDerWaalsContact O-CB 3.23Å; V150-S154 WeakPolarHBondContact O-CB 3.33Å; V150-S154 PolarHBondContact O-N 3.29Å; V150-S154 PolarHBondContact O-OG 2.92Å
155	D	77.3	Confident	82.6	Confident	103 Å²	103	60.4 Å²	60.4	55%	0.551	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	-43.5	-180	-80.5	-33.8	0	0	0	112.9	S89 K91	S89-D155 PolarHBondContact O-N 2.91Å; K91-D155 WeakPolarHBondContact CA-OD2 3.47Å; K91-D155 WeakPolarHBondContact CE-OD1 3.42Å; K91-D155 HydrophobicContact CG-CB 4.5Å; K91-D155 VanDerWaalsContact CG-OD1 3.25Å; K91-D155 WeakPolarHBondContact CG-OD1 3.15Å
156	D	79.9	Confident	82.7	Confident	61 Å²	61	61.4 Å²	61.4	33%	0.326	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.6	175	-173.7	19.3	0	0	0	108.6	F88 S89 R158	F88-D156 CarbonylContact C-O 3.39Å; F88-D156 WeakPolarHBondContact CA-O 3.39Å; F88-D156 WeakPolarHBondContact CB-O 3.44Å; S89-D156 PolarHBondContact N-O 3.39Å; S89-D156 PolarHBondContact OG-N 3.41Å; D156-R158 IonicContact OD2-CZ 3.79Å; D156-R158 IonicContact OD2-NH1 2.77Å; D156-R158 PolarHBondContact OD2-NH1 3.22Å
157	V	84.8	Confident	82.6	Confident	19 Å²	19	63.8 Å²	63.8	12%	0.115	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	117	177.2	-176.4	0	0	0	0	108.5	L86 L87 F88 V150 R151	L86-V157 HydrophobicContact CD1-CG1 4.39Å; L86-V157 HydrophobicContact CD2-CG1 4.43Å; L87-V157 WeakPolarHBondContact O-CA 3.33Å; F88-V157 HydrophobicContact CB-CB 4.44Å; F88-V157 HydrophobicContact CB-CG2 3.94Å; V150-V157 HydrophobicContact CG1-CG1 4.31Å; V150-V157 HydrophobicContact CG1-CG2 4.04Å; R151-V157 HydrophobicContact CB-CG2 4.41Å; R151-V157 HydrophobicContact CG-CB 3.83Å; R151-V157 HydrophobicContact CG-CG1 4.36Å; R151-V157 HydrophobicContact CG-CG2 3.67Å
158	R	85.9	Confident	82.8	Confident	66 Å²	66	64.5 Å²	64.5	25%	0.249	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	153.3	-175.2	63.7	-165.8	-170.1	-133.9	2	112	L86 L87 E131 D156	L86-R158 WeakPolarHBondContact CA-O 3.21Å; L87-R158 HydrophobicContact CB-CG 3.9Å; L87-R158 PolarHBondContact N-O 3.36Å; L87-R158 PolarHBondContact O-N 2.61Å; E131-R158 IonicContact OE1-CZ 2.68Å; E131-R158 VanDerWaalsContact OE1-CZ 3.26Å; E131-R158 IonicContact OE1-NH1 3.75Å; E131-R158 PolarHBondContact OE1-NH1 3.32Å; E131-R158 IonicContact OE1-NH2 3.77Å; E131-R158 PolarHBondContact OE1-NH2 2.85Å; E131-R158 IonicContact OE2-CZ 3.19Å; E131-R158 IonicContact OE2-NH2 3.11Å; E131-R158 PolarHBondContact OE2-NH2 2.72Å; D156-R158 IonicContact OD2-CZ 3.79Å; D156-R158 IonicContact OD2-NH1 2.77Å; D156-R158 PolarHBondContact OD2-NH1 3.22Å
159	S	83.6	Confident	83.1	Confident	35 Å²	35	63.6 Å²	63.6	25%	0.245	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	144.4	170.2	-85.7	0	0	0	0	111.9	V73 V74 N85	V73-S159 WeakPolarHBondContact CA-OG 3.27Å; V73-S159 VanDerWaalsContact CG1-OG 3.28Å; V73-S159 WeakPolarHBondContact CG1-OG 3.35Å; V74-S159 PolarHBondContact N-OG 3.29Å; N85-S159 WeakPolarHBondContact O-CA 3.29Å
160	A	80.6	Confident	83.4	Confident	18 Å²	18	69.3 Å²	69.3	15%	0.149	32%	0.315	C	S	.	.			trans	-118.2	151.3	176.6	0	0	0	0	0	110.9	N85 L87 F133	N85-A160 HydrophobicContact CB-CB 4.09Å; N85-A160 WeakPolarHBondContact CB-O 3.39Å; N85-A160 PolarHBondContact O-N 3.44Å; L87-A160 HydrophobicContact CB-CB 4.4Å; L87-A160 HydrophobicContact CD1-CB 3.7Å; L87-A160 HydrophobicContact CG-CB 3.72Å; F133-A160 HydrophobicContact CD2-CB 3.77Å; F133-A160 HydrophobicContact CE2-CB 3.6Å
161	R	75.8	Confident	83.8	Confident	225 Å²	225	75 Å²	75	85%	0.849	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-83	146.5	167.4	-67.3	-174.5	179.6	-172.1	-0.8	108.7	D163	R161-D163 PolarHBondContact O-N 2.73Å
162	E	68.9	Low	84.2	Confident	113 Å²	113	72.1 Å²	72.1	53%	0.528	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-70.9	123.8	170.4	-168.3	170.9	177.6	0	0	109	R135	R135-E162 IonicContact CZ-OE1 3.13Å; R135-E162 IonicContact CZ-OE2 3.08Å; R135-E162 IonicContact NH1-OE1 3.02Å; R135-E162 PolarHBondContact NH1-OE1 3.11Å; R135-E162 IonicContact NH1-OE2 3.29Å; R135-E162 IonicContact NH2-OE1 3.93Å; R135-E162 IonicContact NH2-OE2 3.67Å
163	D	70.3	Confident	84.6	Confident	80 Å²	80	68.2 Å²	68.2	43%	0.428	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-78	142.2	169.1	-70.1	-48.4	0	0	0	109.4	R118 R161 V165	R118-D163 IonicContact CZ-OD2 3.04Å; R118-D163 IonicContact NH1-OD2 2.74Å; R118-D163 PolarHBondContact NH1-OD2 3.24Å; R118-D163 IonicContact NH2-OD2 2.69Å; R118-D163 PolarHBondContact NH2-OD2 2.63Å; R161-D163 PolarHBondContact O-N 2.73Å; D163-V165 WeakPolarHBondContact CB-O 3.42Å; D163-V165 PolarHBondContact O-N 2.73Å; D163-V165 VanDerWaalsContact O-N 3.14Å
164	K	77	Confident	85.1	Confident	214 Å²	214	68.5 Å²	68.5	93%	0.93	32%	0.323	S	S	*	.	S	Bend	trans	-62.7	-21.2	177.5	-69.3	-173.5	177.9	-176.3	0	113.4
165	V	85.7	Confident	85.5	Confident	36 Å²	36	68.4 Å²	68.4	22%	0.218	32%	0.322	C	S	.	.	S	Bend	trans	-134.3	127.4	180	-176.8	0	0	0	0	107.3	D163 P456 F457	D163-V165 WeakPolarHBondContact CB-O 3.42Å; D163-V165 PolarHBondContact O-N 2.73Å; D163-V165 VanDerWaalsContact O-N 3.14Å; V165-P456 HydrophobicContact CG2-CG 3.53Å; V165-F457 HydrophobicContact CB-CE1 4.47Å; V165-F457 HydrophobicContact CG1-CE1 3.78Å; V165-F457 HydrophobicContact CG1-CZ 3.73Å; V165-F457 HydrophobicContact CG2-CE1 4.13Å
166	P	88.9	Confident	86	Confident	28 Å²	28	65 Å²	65	18%	0.182	30%	0.304	C	S	.	.			trans	-53.8	146.2	173.3	-29	38.3	0	0	0	111.9
167	W	89.6	Confident	86.1	Confident	49 Å²	49	64.4 Å²	64.4	19%	0.186	30%	0.299	C	S	.	.			trans	-66.7	151.2	178.5	175.6	86.7	0	0	0	110	E116 T117 R118 P169	E116-W167 PolarHBondContact OE2-N 3.01Å; T117-W167 VanDerWaalsContact O-CE3 3.29Å; T117-W167 WeakPolarHBondContact O-CZ3 3.39Å; R118-W167 HydrophobicContact CG-CB 4.38Å; R118-W167 HydrophobicContact CG-CG 4.31Å; W167-P169 HydrophobicContact CH2-CB 4.09Å; W167-P169 HydrophobicContact CH2-CG 4.5Å; W167-P169 HydrophobicContact CZ2-CB 4.41Å
168	F	92.7	Very high	85.9	Confident	16 Å²	16	63.5 Å²	63.5	7%	0.07	29%	0.293	C	S	.	.			trans	-150.3	149.5	170.6	63.2	-86.5	0	0	0	110	R170 L358 F457 I468 V470	F168-R170 HydrophobicContact CE2-CG 4.25Å; F168-L358 HydrophobicContact CB-CB 4.42Å; F168-L358 HydrophobicContact CB-CD2 4.07Å; F168-L358 HydrophobicContact CD2-CB 3.9Å; F168-L358 HydrophobicContact CD2-CD1 4.18Å; F168-L358 HydrophobicContact CD2-CD2 4.17Å; F168-L358 HydrophobicContact CD2-CG 4.3Å; F168-L358 HydrophobicContact CE2-CB 4.31Å; F168-L358 HydrophobicContact CE2-CD1 4.47Å; F168-L358 HydrophobicContact CG-CB 4.08Å; F168-L358 HydrophobicContact CG-CD2 4.43Å; F168-F457 HydrophobicContact CE1-CE1 4.48Å; F168-F457 HydrophobicContact CE1-CE2 4.02Å; F168-F457 AromaticContact CE1-CZ 3.58Å; F168-F457 HydrophobicContact CE1-CZ 3.58Å; F168-F457 HydrophobicContact CZ-CE2 4.02Å; F168-F457 AromaticContact CZ-CZ 3.98Å; F168-F457 HydrophobicContact CZ-CZ 3.98Å; F168-I468 HydrophobicContact CE2-CG2 4.16Å; F168-V470 HydrophobicContact CE2-CG2 4.34Å; F168-V470 HydrophobicContact CZ-CG2 3.93Å
169	P	93.3	Very high	85.3	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.013	28%	0.282	C	S	.	.			trans	-62.3	136.5	176.6	24.6	-33.5	0	0	0	110.6	W167 E174 L175 A303 F307	W167-P169 HydrophobicContact CH2-CB 4.09Å; W167-P169 HydrophobicContact CH2-CG 4.5Å; W167-P169 HydrophobicContact CZ2-CB 4.41Å; P169-E174 WeakPolarHBondContact CA-OE2 3.38Å; P169-E174 HydrophobicContact CB-CB 3.8Å; P169-L175 HydrophobicContact CB-CD2 4.21Å; P169-L175 HydrophobicContact CG-CD2 3.79Å; P169-A303 HydrophobicContact CG-CB 4.14Å; P169-F307 HydrophobicContact CB-CE2 4.18Å; P169-F307 HydrophobicContact CB-CZ 4.24Å; P169-F307 HydrophobicContact CG-CE2 3.84Å; P169-F307 HydrophobicContact CG-CZ 4.34Å; P169-F307 VanDerWaalsContact O-CZ 3.32Å; P169-F307 WeakPolarHBondContact O-CZ 3.47Å
170	R	94.3	Very high	84.6	Confident	135 Å²	135	61.1 Å²	61.1	51%	0.509	28%	0.281	S	S	.	.	S	Bend	trans	-102.7	-17.4	177.2	-66.8	-166.1	177.8	-162	-1	113.5	F168 E174 A467 I468	F168-R170 HydrophobicContact CE2-CG 4.25Å; R170-E174 PolarHBondContact N-OE2 3.48Å; R170-A467 CarbonylContact O-C 3.02Å; R170-A467 VanDerWaalsContact O-CA 3.27Å; R170-A467 WeakPolarHBondContact O-CA 3.38Å; R170-A467 WeakPolarHBondContact O-CB 3.39Å; R170-I468 PolarHBondContact O-N 3.46Å
171	K	94.8	Very high	83.9	Confident	119 Å²	119	60.3 Å²	60.3	52%	0.517	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-129.5	149	174.9	-64.9	-173.2	177.5	-174	0	109.3	S173 E174 F307 A467	K171-S173 PolarHBondContact O-N 3.39Å; K171-S173 VanDerWaalsContact O-N 3.12Å; K171-E174 HydrophobicContact CB-CG 4.32Å; K171-E174 WeakPolarHBondContact O-CB 3.39Å; K171-E174 PolarHBondContact O-N 3.36Å; K171-F307 VanDerWaalsContact C-CE1 3.49Å; K171-A467 HydrophobicContact CG-CB 4.25Å
172	V	95.4	Very high	83.5	Confident	15 Å²	15	51.5 Å²	51.5	9%	0.091	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-55.3	-33.7	177.8	67.8	0	0	0	0	112.8	E174 L175 Q217 F307 V309 L466	V172-E174 PolarHBondContact O-N 3.23Å; V172-L175 HydrophobicContact CG2-CD1 4.14Å; V172-L175 VanDerWaalsContact O-CB 3.31Å; V172-L175 WeakPolarHBondContact O-CB 3.21Å; V172-L175 WeakPolarHBondContact O-CG 3.45Å; V172-L175 PolarHBondContact O-N 2.84Å; V172-L175 VanDerWaalsContact O-N 3.12Å; V172-Q217 HydrophobicContact CG1-CG 4.16Å; V172-Q217 HydrophobicContact CG2-CG 4.39Å; V172-F307 HydrophobicContact CB-CB 4.43Å; V172-F307 HydrophobicContact CB-CD1 3.82Å; V172-F307 HydrophobicContact CB-CG 4.33Å; V172-F307 HydrophobicContact CG2-CB 4.1Å; V172-F307 HydrophobicContact CG2-CD1 4.39Å; V172-F307 HydrophobicContact CG2-CG 4.43Å; V172-V309 HydrophobicContact CG2-CG2 3.79Å; V172-L466 HydrophobicContact CB-CB 4.2Å; V172-L466 HydrophobicContact CG1-CB 3.6Å; V172-L466 HydrophobicContact CG1-CD1 4.06Å; V172-L466 HydrophobicContact CG1-CG 4.47Å; V172-L466 PolarHBondContact N-O 3.35Å
173	S	93.1	Very high	83.1	Confident	58 Å²	58	49.7 Å²	49.7	41%	0.406	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-65.6	-19.1	176.3	60.6	0	0	0	0	113.9	K171 L175 D176	K171-S173 PolarHBondContact O-N 3.39Å; K171-S173 VanDerWaalsContact O-N 3.12Å; S173-L175 PolarHBondContact O-N 3.49Å; S173-D176 WeakPolarHBondContact O-CB 3.35Å; S173-D176 PolarHBondContact O-N 3.08Å
174	E	92.3	Very high	82.7	Confident	45 Å²	45	50.8 Å²	50.8	21%	0.21	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-77.5	-10.5	176.4	-62.7	-177.2	162.4	0	0	112.7	P169 R170 K171 V172 D176 K177	P169-E174 WeakPolarHBondContact CA-OE2 3.38Å; P169-E174 HydrophobicContact CB-CB 3.8Å; R170-E174 PolarHBondContact N-OE2 3.48Å; K171-E174 HydrophobicContact CB-CG 4.32Å; K171-E174 WeakPolarHBondContact O-CB 3.39Å; K171-E174 PolarHBondContact O-N 3.36Å; V172-E174 PolarHBondContact O-N 3.23Å; E174-D176 PolarHBondContact O-N 3.43Å; E174-K177 VanDerWaalsContact O-CB 3.31Å; E174-K177 WeakPolarHBondContact O-CB 3.21Å; E174-K177 PolarHBondContact O-N 2.74Å
175	L	91.8	Very high	81.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-63.3	-15.4	168.2	-60.4	179.8	0	0	0	112.5	P169 V172 S173 K177 C178 F307 V309	P169-L175 HydrophobicContact CB-CD2 4.21Å; P169-L175 HydrophobicContact CG-CD2 3.79Å; V172-L175 HydrophobicContact CG2-CD1 4.14Å; V172-L175 VanDerWaalsContact O-CB 3.31Å; V172-L175 WeakPolarHBondContact O-CB 3.21Å; V172-L175 WeakPolarHBondContact O-CG 3.45Å; V172-L175 PolarHBondContact O-N 2.84Å; V172-L175 VanDerWaalsContact O-N 3.12Å; S173-L175 PolarHBondContact O-N 3.49Å; L175-K177 PolarHBondContact O-N 2.74Å; L175-C178 HydrophobicContact CD2-CB 4.41Å; L175-C178 PolarHBondContact O-N 2.84Å; L175-C178 VanDerWaalsContact O-N 3.13Å; L175-F307 HydrophobicContact CD1-CB 4.26Å; L175-F307 HydrophobicContact CD1-CD2 4.17Å; L175-F307 HydrophobicContact CD1-CG 4.33Å; L175-F307 HydrophobicContact CD2-CD2 4.18Å; L175-F307 HydrophobicContact CD2-CE2 4.37Å; L175-F307 HydrophobicContact CG-CD2 4.4Å; L175-V309 HydrophobicContact CD1-CB 3.73Å; L175-V309 HydrophobicContact CD1-CG1 3.92Å; L175-V309 HydrophobicContact CD1-CG2 3.82Å
176	D	88.1	Confident	81	Confident	31 Å²	31	43.1 Å²	43.1	17%	0.166	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-61.1	-6.2	166.4	-70.3	-15	0	0	0	113.6	S173 E174 H179 K216 Q217 R290	S173-D176 WeakPolarHBondContact O-CB 3.35Å; S173-D176 PolarHBondContact O-N 3.08Å; E174-D176 PolarHBondContact O-N 3.43Å; D176-H179 VanDerWaalsContact C-CD2 3.43Å; D176-H179 PolarHBondContact O-CD2 3.12Å; D176-H179 PolarHBondContact O-NE2 3.08Å; D176-H179 VanDerWaalsContact O-NE2 3.09Å; D176-K216 HydrophobicContact CB-CD 4.12Å; D176-K216 WeakPolarHBondContact OD2-CD 3.45Å; D176-Q217 PolarHBondContact OD1-N 3.41Å; D176-Q217 PolarHBondContact OD2-N 3.16Å; D176-R290 IonicContact OD1-CZ 3.43Å; D176-R290 IonicContact OD1-NH1 3.23Å; D176-R290 PolarHBondContact OD1-NH1 3.13Å; D176-R290 IonicContact OD1-NH2 3.26Å; D176-R290 PolarHBondContact OD1-NH2 3.22Å
177	K	82.2	Confident	79.5	Confident	48 Å²	48	42.1 Å²	42.1	21%	0.209	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-30.5	176.2	-58.5	168.3	-171	164	0	111.2	T117 P119 L130 E174 L175 H179	T117-K177 PolarHBondContact OG1-O 3.46Å; P119-K177 HydrophobicContact CG-CD 4.02Å; L130-K177 HydrophobicContact CD1-CB 3.62Å; L130-K177 HydrophobicContact CD1-CG 3.87Å; E174-K177 VanDerWaalsContact O-CB 3.31Å; E174-K177 WeakPolarHBondContact O-CB 3.21Å; E174-K177 PolarHBondContact O-N 2.74Å; L175-K177 PolarHBondContact O-N 2.74Å; K177-H179 VanDerWaalsContact C-N 3.29Å; K177-H179 PolarHBondContact O-N 3.38Å
178	C	80.9	Confident	78.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	16.7	-175	-62.7	0	0	0	0	115	L175 L296 D300	L175-C178 HydrophobicContact CD2-CB 4.41Å; L175-C178 PolarHBondContact O-N 2.84Å; L175-C178 VanDerWaalsContact O-N 3.13Å; C178-L296 WeakPolarHBondContact O-CD1 3.43Å; C178-D300 HydrophobicContact CB-CB 3.93Å; C178-D300 WeakPolarHBondContact CB-OD1 3.34Å; C178-D300 WeakPolarHBondContact O-CB 3.41Å; C178-D300 PolarHBondContact SG-OD1 2.98Å; C178-D300 VanDerWaalsContact SG-OD1 3.38Å
179	H	72.5	Confident	76.6	Confident	3 Å²	3	47.5 Å²	47.5	1%	0.014	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	2.5	-175.2	73.1	82.9	0	0	0	114.1	D176 K177 F213	D176-H179 VanDerWaalsContact C-CD2 3.43Å; D176-H179 PolarHBondContact O-CD2 3.12Å; D176-H179 PolarHBondContact O-NE2 3.08Å; D176-H179 VanDerWaalsContact O-NE2 3.09Å; K177-H179 VanDerWaalsContact C-N 3.29Å; K177-H179 PolarHBondContact O-N 3.38Å; H179-F213 AromaticContact ND1-CD1 3.92Å
180	H	67.9	Low	75.5	Confident	48 Å²	48	49.8 Å²	49.8	22%	0.222	25%	0.247	C	C	.	.			trans	-96.9	-18.2	-174.5	-72.1	-75	0	0	0	113.9	L98 L130 Y132 V182 F213	L98-H180 WeakPolarHBondContact CD2-O 3.27Å; L130-H180 HydrophobicContact CD2-CB 4.2Å; L130-H180 VanDerWaalsContact CD2-CD2 3.41Å; L130-H180 WeakPolarHBondContact CD2-CD2 3.41Å; Y132-H180 HydrophobicContact CE1-CB 4.41Å; H180-V182 PolarHBondContact O-N 3.13Å; H180-F213 AromaticContact ND1-CD1 3.89Å
181	L	66.4	Low	74.7	Confident	1 Å²	1	49 Å²	49	1%	0.005	25%	0.253	C	S	.	.			trans	-81.5	64.8	179.2	-63.4	-171.5	0	0	0	111.9	L98 L115 T117 Y132 T183 L296 S297 D300	L98-L181 HydrophobicContact CD1-CD2 4.26Å; L98-L181 HydrophobicContact CD2-CB 4.48Å; L98-L181 HydrophobicContact CD2-CD2 3.43Å; L98-L181 VanDerWaalsContact CD2-CD2 3.43Å; L98-L181 HydrophobicContact CD2-CG 4.47Å; L98-L181 HydrophobicContact CG-CD2 4.47Å; L115-L181 HydrophobicContact CD1-CD2 4.41Å; L115-L181 HydrophobicContact CD2-CD1 4.43Å; L115-L181 HydrophobicContact CD2-CD2 3.85Å; L115-L181 HydrophobicContact CG-CD1 3.97Å; L115-L181 HydrophobicContact CG-CD2 3.87Å; L115-L181 WeakPolarHBondContact O-CD1 3.33Å; T117-L181 HydrophobicContact CG2-CD1 4.36Å; T117-L181 HydrophobicContact CG2-CD2 3.93Å; T117-L181 HydrophobicContact CG2-CG 3.85Å; Y132-L181 HydrophobicContact CD1-CD2 3.78Å; Y132-L181 HydrophobicContact CE1-CD2 3.81Å; L181-T183 PolarHBondContact O-N 3.38Å; L181-L296 CarbonylContact O-C 3.6Å; L181-L296 VanDerWaalsContact O-CA 3.25Å; L181-L296 WeakPolarHBondContact O-CA 3.32Å; L181-S297 PolarHBondContact O-N 3.24Å; L181-S297 VanDerWaalsContact O-N 3.08Å; L181-D300 WeakPolarHBondContact CD1-OD2 3.38Å
182	V	67.4	Low	73.8	Confident	41 Å²	41	50.6 Å²	50.6	25%	0.248	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	116.3	173	-176.1	0	0	0	0	109	H180 A293 L295 L296	H180-V182 PolarHBondContact O-N 3.13Å; V182-A293 HydrophobicContact CG2-CB 4.28Å; V182-L295 CarbonylContact C-O 3.56Å; V182-L295 VanDerWaalsContact CA-O 3.28Å; V182-L295 WeakPolarHBondContact CA-O 3.31Å; V182-L296 HydrophobicContact CG2-CD2 4.44Å
183	T	60.1	Low	73.1	Confident	75 Å²	75	50.2 Å²	50.2	46%	0.46	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-19.1	-164.3	56.3	0	0	0	0	115	L181 L295	L181-T183 PolarHBondContact O-N 3.38Å; T183-L295 PolarHBondContact N-O 3.47Å; T183-L295 PolarHBondContact OG1-O 2.84Å
184	K	63.2	Low	72.7	Confident	103 Å²	103	49.8 Å²	49.8	45%	0.448	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	171	-178.1	-68.9	-171.4	178.6	-179.9	0	111.5	L295 D426	K184-L295 HydrophobicContact CB-CD2 4.32Å; K184-L295 HydrophobicContact CD-CD2 4.28Å; K184-L295 HydrophobicContact CG-CD2 4.38Å; K184-D426 IonicContact NZ-OD2 3.24Å; K184-D426 PolarHBondContact NZ-OD2 3.24Å
185	F	58.8	Low	72.4	Confident	38 Å²	38	47.7 Å²	47.7	17%	0.167	25%	0.25	C	C	.	.			trans	66.8	44.1	162.4	-56.4	-54.5	0	0	0	114.4	R205 L295 P326 E327	F185-R205 PolarHBondContact O-NH2 2.95Å; F185-R205 VanDerWaalsContact O-NH2 3.11Å; F185-L295 HydrophobicContact CD2-CB 4.27Å; F185-L295 HydrophobicContact CE2-CD1 4.4Å; F185-P326 HydrophobicContact CE1-CB 4.21Å; F185-P326 WeakPolarHBondContact CE1-O 3.42Å; F185-P326 VanDerWaalsContact CZ-O 3.25Å; F185-P326 WeakPolarHBondContact CZ-O 3.25Å; F185-E327 HydrophobicContact CB-CB 4.32Å; F185-E327 HydrophobicContact CB-CG 3.68Å; F185-E327 VanDerWaalsContact CB-OE1 3.31Å; F185-E327 WeakPolarHBondContact CB-OE1 3.45Å; F185-E327 HydrophobicContact CD1-CG 3.86Å; F185-E327 HydrophobicContact CG-CB 4.34Å; F185-E327 HydrophobicContact CG-CG 3.79Å; F185-E327 VanDerWaalsContact O-OE1 3.08Å
186	D	67.3	Low	72	Confident	51 Å²	51	50.5 Å²	50.5	27%	0.273	26%	0.262	S	S	.	.			trans	-94	114.2	168.8	-173.2	-16.3	0	0	0	108.8	D188 L189 D190	D186-D188 PolarHBondContact O-N 2.79Å; D186-D188 VanDerWaalsContact O-N 3.11Å; D186-D188 WeakPolarHBondContact OD1-CB 3.34Å; D186-D188 PolarHBondContact OD1-N 3.09Å; D186-L189 HydrophobicContact CB-CB 4.19Å; D186-L189 HydrophobicContact CB-CD1 3.99Å; D186-L189 HydrophobicContact CB-CG 4.09Å; D186-L189 PolarHBondContact O-N 3.41Å; D186-D190 PolarHBondContact O-N 3.14Å
187	P	57	Low	72	Confident	6 Å²	6	53.8 Å²	53.8	4%	0.039	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-9.2	-179.9	29.9	-37.4	0	0	0	113.3	L189 F196 R202 R205	P187-L189 VanDerWaalsContact C-N 3.32Å; P187-F196 WeakPolarHBondContact O-CD2 3.32Å; P187-R202 HydrophobicContact CB-CG 4.02Å; P187-R202 HydrophobicContact CG-CG 4.24Å; P187-R205 HydrophobicContact CG-CB 4.26Å; P187-R205 HydrophobicContact CG-CG 4.21Å
188	D	63.1	Low	72.5	Confident	62 Å²	62	53.8 Å²	53.8	33%	0.332	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.8	167.6	-74.6	-27	0	0	0	112.8	D186 K206	D186-D188 PolarHBondContact O-N 2.79Å; D186-D188 VanDerWaalsContact O-N 3.11Å; D186-D188 WeakPolarHBondContact OD1-CB 3.34Å; D186-D188 PolarHBondContact OD1-N 3.09Å; D188-K206 VanDerWaalsContact CG-NZ 3.28Å; D188-K206 IonicContact OD1-NZ 3.01Å; D188-K206 PolarHBondContact OD1-NZ 3.17Å; D188-K206 WeakPolarHBondContact OD2-CE 3.41Å; D188-K206 IonicContact OD2-NZ 2.68Å; D188-K206 PolarHBondContact OD2-NZ 2.77Å
189	L	59.3	Low	73	Confident	117 Å²	117	60 Å²	60	61%	0.613	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	-21.5	-170.7	-59.3	178.9	0	0	0	114	D186 P187	D186-L189 HydrophobicContact CB-CB 4.19Å; D186-L189 HydrophobicContact CB-CD1 3.99Å; D186-L189 HydrophobicContact CB-CG 4.09Å; D186-L189 PolarHBondContact O-N 3.41Å; P187-L189 VanDerWaalsContact C-N 3.32Å
190	D	71	Confident	74.1	Confident	49 Å²	49	65.3 Å²	65.3	26%	0.262	35%	0.352	S	S	.	.			trans	-102.9	107.4	-176.3	-170.9	-10.3	0	0	0	112.2	D186 D192 H193 F196	D186-D190 PolarHBondContact O-N 3.14Å; D190-D192 PolarHBondContact O-N 2.86Å; D190-D192 PolarHBondContact OD1-N 3.08Å; D190-H193 HydrophobicContact CB-CB 4.05Å; D190-H193 WeakPolarHBondContact O-CB 3.5Å; D190-H193 PolarHBondContact O-N 3.44Å; D190-F196 WeakPolarHBondContact O-CB 3.43Å; D190-F196 WeakPolarHBondContact O-CD2 3.47Å; D190-F196 WeakPolarHBondContact O-CG 3.46Å
191	L	75.5	Confident	75.3	Confident	119 Å²	119	64.2 Å²	64.2	62%	0.623	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.6	-179.3	-75.2	164.1	0	0	0	113.5	F196	L191-F196 HydrophobicContact CD2-CD1 4.03Å; L191-F196 HydrophobicContact CD2-CE1 3.38Å; L191-F196 HydrophobicContact CD2-CE2 3.97Å; L191-F196 HydrophobicContact CD2-CZ 3.33Å; L191-F196 HydrophobicContact CG-CE2 4.42Å; L191-F196 HydrophobicContact CG-CZ 4.24Å
192	D	77.3	Confident	76.4	Confident	152 Å²	152	65.6 Å²	65.6	81%	0.813	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.7	-176	-64.9	-35.8	0	0	0	111.7	D190	D190-D192 PolarHBondContact O-N 2.86Å; D190-D192 PolarHBondContact OD1-N 3.08Å
193	H	81.2	Confident	77.6	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.037	36%	0.361	C	S	.	.	S	Bend	trans	-64.9	131.4	175.7	-176.5	-74.6	0	0	0	110.6	D190 G195 F196 Y201 E327	D190-H193 HydrophobicContact CB-CB 4.05Å; D190-H193 WeakPolarHBondContact O-CB 3.5Å; D190-H193 PolarHBondContact O-N 3.44Å; H193-G195 PolarHBondContact CE1-N 3.01Å; H193-G195 WeakPolarHBondContact ND1-CA 3.35Å; H193-G195 PolarHBondContact ND1-N 3.5Å; H193-G195 PolarHBondContact O-N 3.46Å; H193-G195 VanDerWaalsContact O-N 3.1Å; H193-F196 WeakPolarHBondContact O-CB 3.35Å; H193-F196 PolarHBondContact O-N 3.05Å; H193-Y201 AromaticContact CE1-CE1 3.36Å; H193-Y201 WeakPolarHBondContact CE1-CE1 3.45Å; H193-Y201 AromaticContact CE1-CZ 3.99Å; H193-E327 IonicContact CD2-OE1 3.39Å; H193-E327 PolarHBondContact CD2-OE1 3.3Å; H193-E327 IonicContact NE2-OE1 2.96Å; H193-E327 PolarHBondContact NE2-OE1 3.39Å; H193-E327 IonicContact NE2-OE2 2.81Å
194	P	83.9	Confident	79.2	Confident	49 Å²	49	67.5 Å²	67.5	32%	0.318	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.7	-174.9	21.2	-32.8	0	0	0	113.5	H318	P194-H318 HydrophobicContact CB-CB 4.24Å; P194-H318 HydrophobicContact CG-CB 4.06Å
195	G	85.3	Confident	80.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	3.8	173.6	0	0	0	0	0	116.2	H193 S197 D198	H193-G195 PolarHBondContact CE1-N 3.01Å; H193-G195 WeakPolarHBondContact ND1-CA 3.35Å; H193-G195 PolarHBondContact ND1-N 3.5Å; H193-G195 PolarHBondContact O-N 3.46Å; H193-G195 VanDerWaalsContact O-N 3.1Å; G195-S197 VanDerWaalsContact C-N 3.31Å; G195-S197 PolarHBondContact O-N 2.78Å; G195-D198 PolarHBondContact O-N 2.66Å; G195-D198 VanDerWaalsContact O-N 3.15Å
196	F	84.4	Confident	82	Confident	59 Å²	59	65.4 Å²	65.4	26%	0.259	34%	0.34	S	S	.	.	S	Bend	trans	-59.2	-41.1	-176.1	176.1	-97.1	0	0	0	112.6	P187 D190 L191 H193 R202	P187-F196 WeakPolarHBondContact O-CD2 3.32Å; D190-F196 WeakPolarHBondContact O-CB 3.43Å; D190-F196 WeakPolarHBondContact O-CD2 3.47Å; D190-F196 WeakPolarHBondContact O-CG 3.46Å; L191-F196 HydrophobicContact CD2-CD1 4.03Å; L191-F196 HydrophobicContact CD2-CE1 3.38Å; L191-F196 HydrophobicContact CD2-CE2 3.97Å; L191-F196 HydrophobicContact CD2-CZ 3.33Å; L191-F196 HydrophobicContact CG-CE2 4.42Å; L191-F196 HydrophobicContact CG-CZ 4.24Å; H193-F196 WeakPolarHBondContact O-CB 3.35Å; H193-F196 PolarHBondContact O-N 3.05Å; F196-R202 PolarHBondContact O-NE 3.07Å; F196-R202 PolarHBondContact O-NH1 2.8Å; F196-R202 PolarHBondContact O-NH2 2.77Å
197	S	87.9	Confident	83.2	Confident	101 Å²	101	67 Å²	67	71%	0.706	35%	0.348	S	S	*	.	S	Bend	trans	-84.5	-16	179.5	65.7	0	0	0	0	113.2	G195 Q199 R202	G195-S197 VanDerWaalsContact C-N 3.31Å; G195-S197 PolarHBondContact O-N 2.78Å; S197-Q199 PolarHBondContact O-N 2.86Å; S197-R202 PolarHBondContact O-NH2 3.47Å
198	D	91.3	Very high	84.9	Confident	48 Å²	48	67 Å²	67	26%	0.257	35%	0.347	S	S	.	.			trans	-82.6	111	179.9	-172.4	-18	0	0	0	111	G195 V200 Y201 R202 H318	G195-D198 PolarHBondContact O-N 2.66Å; G195-D198 VanDerWaalsContact O-N 3.15Å; D198-V200 WeakPolarHBondContact OD1-CA 3.34Å; D198-V200 WeakPolarHBondContact OD1-CB 3.49Å; D198-V200 PolarHBondContact OD1-N 3.28Å; D198-Y201 PolarHBondContact OD1-N 3.19Å; D198-R202 WeakPolarHBondContact O-CG 3.25Å; D198-R202 PolarHBondContact O-N 3.47Å; D198-R202 PolarHBondContact O-NE 3.14Å; D198-H318 IonicContact OD2-NE2 2.74Å; D198-H318 PolarHBondContact OD2-NE2 3.09Å
199	Q	92.7	Very high	86.2	Confident	130 Å²	130	64.9 Å²	64.9	61%	0.607	34%	0.339	S	S	*	.	H	α-helix	trans	-71.7	-32.5	178.2	-64.6	-68.8	-4.8	0	0	112.5	S197 R202 Q203	S197-Q199 PolarHBondContact O-N 2.86Å; Q199-R202 VanDerWaalsContact CD-CZ 3.45Å; Q199-Q203 WeakPolarHBondContact O-CB 3.36Å; Q199-Q203 PolarHBondContact O-N 3.4Å
200	V	95	Very high	87.6	Confident	115 Å²	115	63.8 Å²	63.8	70%	0.697	33%	0.33	S	S	*	.	H	α-helix	trans	-70	-47.3	179.9	179.8	0	0	0	0	109.3	D198 R202 Q203 R204	D198-V200 WeakPolarHBondContact OD1-CA 3.34Å; D198-V200 WeakPolarHBondContact OD1-CB 3.49Å; D198-V200 PolarHBondContact OD1-N 3.28Å; V200-R202 PolarHBondContact O-N 3.39Å; V200-Q203 PolarHBondContact O-N 2.86Å; V200-R204 WeakPolarHBondContact O-CB 3.26Å; V200-R204 PolarHBondContact O-N 3.49Å
201	Y	93.4	Very high	88.6	Confident	24 Å²	24	63 Å²	63	9%	0.094	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-44.3	176.3	-176.4	-95.8	0	0	0	112.2	H193 D198 Q203 R204 R205 I316 H318	H193-Y201 AromaticContact CE1-CE1 3.36Å; H193-Y201 WeakPolarHBondContact CE1-CE1 3.45Å; H193-Y201 AromaticContact CE1-CZ 3.99Å; D198-Y201 PolarHBondContact OD1-N 3.19Å; Y201-Q203 PolarHBondContact O-N 3.01Å; Y201-R204 WeakPolarHBondContact O-CB 3.42Å; Y201-R204 PolarHBondContact O-N 3.21Å; Y201-R205 HydrophobicContact CD1-CG 4.03Å; Y201-R205 HydrophobicContact CE1-CG 3.63Å; Y201-R205 WeakPolarHBondContact O-CG 3.28Å; Y201-R205 PolarHBondContact O-N 3.47Å; Y201-I316 WeakPolarHBondContact CE2-O 3.33Å; Y201-I316 PolarHBondContact OH-O 3.36Å; Y201-H318 HydrophobicContact CD2-CB 4.43Å; Y201-H318 AromaticContact CD2-CD2 3.7Å; Y201-H318 HydrophobicContact CE2-CB 4.06Å; Y201-H318 AromaticContact CG-CD2 3.75Å
202	R	89.7	Confident	89.3	Confident	30 Å²	30	57.5 Å²	57.5	11%	0.113	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-43.1	175.5	-77.8	179.6	-69	-174.2	-17.1	112.9	P187 F196 S197 D198 Q199 V200 R204 R205 K206	P187-R202 HydrophobicContact CB-CG 4.02Å; P187-R202 HydrophobicContact CG-CG 4.24Å; F196-R202 PolarHBondContact O-NE 3.07Å; F196-R202 PolarHBondContact O-NH1 2.8Å; F196-R202 PolarHBondContact O-NH2 2.77Å; S197-R202 PolarHBondContact O-NH2 3.47Å; D198-R202 WeakPolarHBondContact O-CG 3.25Å; D198-R202 PolarHBondContact O-N 3.47Å; D198-R202 PolarHBondContact O-NE 3.14Å; Q199-R202 VanDerWaalsContact CD-CZ 3.45Å; V200-R202 PolarHBondContact O-N 3.39Å; R202-R204 VanDerWaalsContact C-N 3.3Å; R202-R204 PolarHBondContact O-N 2.92Å; R202-R205 PolarHBondContact O-N 3.42Å; R202-K206 WeakPolarHBondContact O-CG 3.39Å; R202-K206 PolarHBondContact O-N 3.01Å
203	Q	91.8	Very high	89.6	Confident	101 Å²	101	52 Å²	52	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-64.2	-39.4	175.8	-173.2	59.6	33	0	0	111	Q199 V200 Y201 K206 L207	Q199-Q203 WeakPolarHBondContact O-CB 3.36Å; Q199-Q203 PolarHBondContact O-N 3.4Å; V200-Q203 PolarHBondContact O-N 2.86Å; Y201-Q203 PolarHBondContact O-N 3.01Å; Q203-K206 PolarHBondContact O-N 3.19Å; Q203-L207 WeakPolarHBondContact O-CG 3.37Å; Q203-L207 PolarHBondContact O-N 3.12Å; Q203-L207 VanDerWaalsContact O-N 3.08Å
204	R	94.8	Very high	90	Very high	55 Å²	55	58.3 Å²	58.3	21%	0.208	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-44.6	175.6	-176.8	56.8	170.6	179.6	-1.9	112.2	V200 Y201 R202 K206 L207 I208 E225 E230	V200-R204 WeakPolarHBondContact O-CB 3.26Å; V200-R204 PolarHBondContact O-N 3.49Å; Y201-R204 WeakPolarHBondContact O-CB 3.42Å; Y201-R204 PolarHBondContact O-N 3.21Å; R202-R204 VanDerWaalsContact C-N 3.3Å; R202-R204 PolarHBondContact O-N 2.92Å; R204-K206 VanDerWaalsContact C-N 3.34Å; R204-K206 PolarHBondContact O-N 3.11Å; R204-L207 PolarHBondContact O-N 2.85Å; R204-I208 HydrophobicContact CG-CD1 4.3Å; R204-I208 WeakPolarHBondContact O-CG1 3.36Å; R204-I208 PolarHBondContact O-N 2.93Å; R204-I208 VanDerWaalsContact O-N 3.09Å; R204-E225 PolarHBondContact NH2-O 3.08Å; R204-E230 WeakPolarHBondContact CG-OE1 3.44Å; R204-E230 IonicContact CZ-OE1 3.56Å; R204-E230 IonicContact CZ-OE2 2.66Å; R204-E230 IonicContact NE-OE1 2.98Å; R204-E230 PolarHBondContact NE-OE1 2.85Å; R204-E230 IonicContact NE-OE2 2.72Å; R204-E230 IonicContact NH2-OE1 2.64Å; R204-E230 PolarHBondContact NH2-OE1 3.04Å; R204-E230 IonicContact NH2-OE2 2.89Å; R204-E230 PolarHBondContact NH2-OE2 2.88Å
205	R	90.9	Very high	90.4	Very high	18 Å²	18	56.5 Å²	56.5	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-41.9	174.1	-74.8	-71.9	-62.8	-80	0.7	112.3	F185 P187 Y201 R202 I208 A209 Y315 E327	F185-R205 PolarHBondContact O-NH2 2.95Å; F185-R205 VanDerWaalsContact O-NH2 3.11Å; P187-R205 HydrophobicContact CG-CB 4.26Å; P187-R205 HydrophobicContact CG-CG 4.21Å; Y201-R205 HydrophobicContact CD1-CG 4.03Å; Y201-R205 HydrophobicContact CE1-CG 3.63Å; Y201-R205 WeakPolarHBondContact O-CG 3.28Å; Y201-R205 PolarHBondContact O-N 3.47Å; R202-R205 PolarHBondContact O-N 3.42Å; R205-I208 PolarHBondContact O-N 3.4Å; R205-A209 VanDerWaalsContact O-CB 3.26Å; R205-A209 WeakPolarHBondContact O-CB 3.33Å; R205-A209 PolarHBondContact O-N 3.18Å; R205-Y315 VanDerWaalsContact CD-CB 3.49Å; R205-Y315 VanDerWaalsContact CD-CG 3.41Å; R205-Y315 PolarHBondContact NH2-OH 2.94Å; R205-E327 IonicContact CZ-OE2 2.73Å; R205-E327 IonicContact NH1-OE1 3.26Å; R205-E327 PolarHBondContact NH1-OE1 3.29Å; R205-E327 IonicContact NH1-OE2 3.31Å; R205-E327 PolarHBondContact NH1-OE2 3.49Å; R205-E327 IonicContact NH2-OE1 2.76Å; R205-E327 IonicContact NH2-OE2 3.44Å; R205-E327 PolarHBondContact NH2-OE2 2.79Å; R205-E327 VanDerWaalsContact NH2-OE2 3.11Å
206	K	89.1	Confident	90.7	Very high	80 Å²	80	60 Å²	60	35%	0.348	30%	0.298	S	S	.	.	H	α-helix	trans	-61.6	-46.7	175.8	-73.3	169	-176.3	165.4	0	112.4	D188 R202 Q203 R204 I208 A209 E210	D188-K206 VanDerWaalsContact CG-NZ 3.28Å; D188-K206 IonicContact OD1-NZ 3.01Å; D188-K206 PolarHBondContact OD1-NZ 3.17Å; D188-K206 WeakPolarHBondContact OD2-CE 3.41Å; D188-K206 IonicContact OD2-NZ 2.68Å; D188-K206 PolarHBondContact OD2-NZ 2.77Å; R202-K206 WeakPolarHBondContact O-CG 3.39Å; R202-K206 PolarHBondContact O-N 3.01Å; Q203-K206 PolarHBondContact O-N 3.19Å; R204-K206 VanDerWaalsContact C-N 3.34Å; R204-K206 PolarHBondContact O-N 3.11Å; K206-I208 VanDerWaalsContact C-N 3.33Å; K206-I208 PolarHBondContact O-N 3.18Å; K206-A209 PolarHBondContact O-N 2.96Å; K206-E210 WeakPolarHBondContact O-CG 3.08Å; K206-E210 PolarHBondContact O-N 2.79Å
207	L	92.1	Very high	91.2	Very high	83 Å²	83	59.1 Å²	59.1	44%	0.435	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-43.3	178.3	-69.1	169.2	0	0	0	111.9	Q203 R204 E210	Q203-L207 WeakPolarHBondContact O-CG 3.37Å; Q203-L207 PolarHBondContact O-N 3.12Å; Q203-L207 VanDerWaalsContact O-N 3.08Å; R204-L207 PolarHBondContact O-N 2.85Å; L207-E210 PolarHBondContact O-N 3.42Å
208	I	94	Very high	91.4	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-70.7	-39.2	177.9	-65	175.2	0	0	0	111.1	R204 R205 K206 E210 I211 V224 Q314	R204-I208 HydrophobicContact CG-CD1 4.3Å; R204-I208 WeakPolarHBondContact O-CG1 3.36Å; R204-I208 PolarHBondContact O-N 2.93Å; R204-I208 VanDerWaalsContact O-N 3.09Å; R205-I208 PolarHBondContact O-N 3.4Å; K206-I208 VanDerWaalsContact C-N 3.33Å; K206-I208 PolarHBondContact O-N 3.18Å; I208-E210 VanDerWaalsContact C-N 3.28Å; I208-E210 PolarHBondContact O-N 2.94Å; I208-I211 WeakPolarHBondContact O-CB 3.13Å; I208-I211 PolarHBondContact O-N 3.07Å; I208-V224 HydrophobicContact CD1-CG1 4.25Å; I208-V224 HydrophobicContact CG1-CG1 4.36Å; I208-Q314 HydrophobicContact CG2-CB 3.54Å
209	A	89.2	Confident	91.6	Very high	18 Å²	18	60.2 Å²	60.2	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-36	176.2	0	0	0	0	0	112.2	R205 K206 I211 A212 F213 A293	R205-A209 VanDerWaalsContact O-CB 3.26Å; R205-A209 WeakPolarHBondContact O-CB 3.33Å; R205-A209 PolarHBondContact O-N 3.18Å; K206-A209 PolarHBondContact O-N 2.96Å; A209-I211 VanDerWaalsContact C-N 3.26Å; A209-I211 PolarHBondContact O-N 3.41Å; A209-A212 WeakPolarHBondContact O-CB 3.19Å; A209-A212 PolarHBondContact O-N 3.19Å; A209-A212 VanDerWaalsContact O-N 3.12Å; A209-F213 HydrophobicContact CB-CD2 4.38Å; A209-F213 HydrophobicContact CB-CE2 3.92Å; A209-F213 WeakPolarHBondContact O-CD2 3.43Å; A209-F213 PolarHBondContact O-N 3.05Å; A209-A293 HydrophobicContact CB-CB 3.85Å
210	E	88.3	Confident	91.8	Very high	94 Å²	94	58.1 Å²	58.1	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-59	-35.1	175.3	-77.5	173.9	-166	0	0	112.7	K206 L207 I208 F213 Q214	K206-E210 WeakPolarHBondContact O-CG 3.08Å; K206-E210 PolarHBondContact O-N 2.79Å; L207-E210 PolarHBondContact O-N 3.42Å; I208-E210 VanDerWaalsContact C-N 3.28Å; I208-E210 PolarHBondContact O-N 2.94Å; E210-F213 PolarHBondContact O-N 3Å; E210-Q214 WeakPolarHBondContact O-CB 3.19Å; E210-Q214 VanDerWaalsContact O-CG 3.28Å; E210-Q214 WeakPolarHBondContact O-CG 3.47Å; E210-Q214 PolarHBondContact O-N 3.43Å
211	I	92	Very high	92	Very high	32 Å²	32	52.8 Å²	52.8	16%	0.164	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-50.6	173.2	-64.7	170.4	0	0	0	110.3	I208 A209 F213 Q214 Y215 P222 V224	I208-I211 WeakPolarHBondContact O-CB 3.13Å; I208-I211 PolarHBondContact O-N 3.07Å; A209-I211 VanDerWaalsContact C-N 3.26Å; A209-I211 PolarHBondContact O-N 3.41Å; I211-F213 VanDerWaalsContact C-N 3.33Å; I211-F213 PolarHBondContact O-N 3.34Å; I211-Q214 PolarHBondContact O-N 3.13Å; I211-Y215 PolarHBondContact O-N 3.46Å; I211-P222 HydrophobicContact CG2-CB 3.69Å; I211-P222 HydrophobicContact CG2-CG 3.73Å; I211-V224 HydrophobicContact CD1-CG2 3.58Å
212	A	90.4	Very high	92.2	Very high	3 Å²	3	54.3 Å²	54.3	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-38	-179.8	0	0	0	0	0	112.6	A209 P291 V292 A293	A209-A212 WeakPolarHBondContact O-CB 3.19Å; A209-A212 PolarHBondContact O-N 3.19Å; A209-A212 VanDerWaalsContact O-N 3.12Å; A212-P291 HydrophobicContact CB-CB 4.16Å; A212-P291 WeakPolarHBondContact CB-O 3.45Å; A212-V292 VanDerWaalsContact CB-C 3.49Å; A212-A293 HydrophobicContact CB-CB 4.14Å
213	F	84.9	Confident	92.6	Very high	37 Å²	37	58.1 Å²	58.1	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-71.5	-29.3	178.2	-67.8	-56.6	0	0	0	113.8	P95 H179 H180 A209 E210 I211 A293	P95-F213 HydrophobicContact CB-CD2 3.73Å; P95-F213 HydrophobicContact CB-CE1 4.14Å; P95-F213 HydrophobicContact CB-CE2 3.26Å; P95-F213 HydrophobicContact CB-CG 4.36Å; P95-F213 HydrophobicContact CB-CZ 3.51Å; P95-F213 HydrophobicContact CG-CD1 4.43Å; P95-F213 HydrophobicContact CG-CD2 3.26Å; P95-F213 HydrophobicContact CG-CE2 3.37Å; P95-F213 HydrophobicContact CG-CG 3.86Å; P95-F213 HydrophobicContact CG-CZ 4.04Å; H179-F213 AromaticContact ND1-CD1 3.92Å; H180-F213 AromaticContact ND1-CD1 3.89Å; A209-F213 HydrophobicContact CB-CD2 4.38Å; A209-F213 HydrophobicContact CB-CE2 3.92Å; A209-F213 WeakPolarHBondContact O-CD2 3.43Å; A209-F213 PolarHBondContact O-N 3.05Å; E210-F213 PolarHBondContact O-N 3Å; I211-F213 VanDerWaalsContact C-N 3.33Å; I211-F213 PolarHBondContact O-N 3.34Å; F213-A293 HydrophobicContact CD2-CB 4.39Å; F213-A293 HydrophobicContact CE1-CB 3.98Å; F213-A293 HydrophobicContact CE2-CB 3.62Å; F213-A293 HydrophobicContact CZ-CB 3.37Å
214	Q	88.9	Confident	92.9	Very high	141 Å²	141	53.6 Å²	53.6	66%	0.659	28%	0.282	S	S	*	.	H	α-helix	trans	-84.9	-27.6	179.7	-70.2	177	16.5	0	0	112.7	E210 I211 K216	E210-Q214 WeakPolarHBondContact O-CB 3.19Å; E210-Q214 VanDerWaalsContact O-CG 3.28Å; E210-Q214 WeakPolarHBondContact O-CG 3.47Å; E210-Q214 PolarHBondContact O-N 3.43Å; I211-Q214 PolarHBondContact O-N 3.13Å; Q214-K216 PolarHBondContact O-N 3.21Å
215	Y	92.8	Very high	93	Very high	11 Å²	11	59.5 Å²	59.5	4%	0.043	31%	0.312	C	S	.	.			trans	-56.7	133.8	-178.5	177.3	-96.4	0	0	0	113	I211 E219 I221 R290 P291	I211-Y215 PolarHBondContact O-N 3.46Å; Y215-E219 VanDerWaalsContact CE2-O 3.32Å; Y215-E219 WeakPolarHBondContact CE2-O 3.4Å; Y215-I221 HydrophobicContact CD2-CG1 4.49Å; Y215-I221 HydrophobicContact CE2-CB 4.42Å; Y215-I221 HydrophobicContact CE2-CG1 3.78Å; Y215-R290 HydrophobicContact CD1-CG 3.98Å; Y215-R290 HydrophobicContact CE1-CB 4.49Å; Y215-R290 HydrophobicContact CE1-CG 3.77Å; Y215-R290 PolarHBondContact O-NH2 3.49Å; Y215-P291 HydrophobicContact CD1-CG 3.85Å; Y215-P291 HydrophobicContact CD2-CG 3.9Å; Y215-P291 HydrophobicContact CG-CG 3.5Å; Y215-P291 VanDerWaalsContact CG-CG 3.5Å
216	K	92.1	Very high	93.4	Very high	74 Å²	74	59.7 Å²	59.7	32%	0.322	31%	0.313	S	S	.	.			trans	-122.2	149.5	171.9	-61	-62.8	167	-155.1	0	112.3	D176 Q214 G218 E219	D176-K216 HydrophobicContact CB-CD 4.12Å; D176-K216 WeakPolarHBondContact OD2-CD 3.45Å; Q214-K216 PolarHBondContact O-N 3.21Å; K216-G218 PolarHBondContact O-N 3.1Å; K216-E219 HydrophobicContact CB-CG 4.41Å; K216-E219 PolarHBondContact N-OE2 2.96Å; K216-E219 WeakPolarHBondContact O-CB 3.4Å; K216-E219 PolarHBondContact O-N 3.09Å; K216-E219 VanDerWaalsContact O-N 3.13Å
217	Q	93.4	Very high	93.8	Very high	40 Å²	40	58.9 Å²	58.9	19%	0.187	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	126.8	-179.2	-179.2	61	30.2	0	0	111.4	V172 D176	V172-Q217 HydrophobicContact CG1-CG 4.16Å; V172-Q217 HydrophobicContact CG2-CG 4.39Å; D176-Q217 PolarHBondContact OD1-N 3.41Å; D176-Q217 PolarHBondContact OD2-N 3.16Å
218	G	92.1	Very high	94.1	Very high	69 Å²	69	59 Å²	59	71%	0.711	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	-10.2	178.8	0	0	0	0	0	114.1	K216	K216-G218 PolarHBondContact O-N 3.1Å
219	E	95.9	Very high	94.3	Very high	103 Å²	103	64.8 Å²	64.8	48%	0.481	35%	0.354	S	S	.	.	S	Bend	trans	-80.8	153.4	168.1	-61.7	-178.2	157.6	0	0	110.5	Y215 K216	Y215-E219 VanDerWaalsContact CE2-O 3.32Å; Y215-E219 WeakPolarHBondContact CE2-O 3.4Å; K216-E219 HydrophobicContact CB-CG 4.41Å; K216-E219 PolarHBondContact N-OE2 2.96Å; K216-E219 WeakPolarHBondContact O-CB 3.4Å; K216-E219 PolarHBondContact O-N 3.09Å; K216-E219 VanDerWaalsContact O-N 3.13Å
220	P	97.9	Very high	94.7	Very high	86 Å²	86	64.8 Å²	64.8	56%	0.558	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-66.3	141.8	169.8	28.5	-33.9	0	0	0	110.3	P222	P220-P222 WeakPolarHBondContact O-CD 3.44Å
221	I	98.2	Very high	95.2	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.01	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-67.3	124.2	177.4	-54.2	171.3	0	0	0	108.7	Y215 H223 L274 E275 L289 P291	Y215-I221 HydrophobicContact CD2-CG1 4.49Å; Y215-I221 HydrophobicContact CE2-CB 4.42Å; Y215-I221 HydrophobicContact CE2-CG1 3.78Å; I221-H223 PolarHBondContact O-N 3.3Å; I221-L274 HydrophobicContact CB-CB 4.49Å; I221-L274 HydrophobicContact CD1-CB 3.92Å; I221-L274 HydrophobicContact CG2-CB 3.91Å; I221-L274 HydrophobicContact CG2-CD1 4.5Å; I221-E275 HydrophobicContact CB-CB 4.07Å; I221-E275 PolarHBondContact N-OE2 3.12Å; I221-L289 HydrophobicContact CD1-CB 4.11Å; I221-L289 WeakPolarHBondContact CD1-O 3.32Å; I221-P291 HydrophobicContact CG2-CB 4.21Å; I221-P291 HydrophobicContact CG2-CG 3.95Å
222	P	98	Very high	95.5	Very high	56 Å²	56	63.7 Å²	63.7	36%	0.364	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-62.9	136.8	-178.7	-25.9	36.9	0	0	0	112.3	I211 P220 Q314	I211-P222 HydrophobicContact CG2-CB 3.69Å; I211-P222 HydrophobicContact CG2-CG 3.73Å; P220-P222 WeakPolarHBondContact O-CD 3.44Å; P222-Q314 PolarHBondContact O-NE2 3.36Å; P222-Q314 VanDerWaalsContact O-NE2 3.08Å
223	H	97.6	Very high	95.8	Very high	111 Å²	111	63.9 Å²	63.9	51%	0.514	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-73.5	144.4	177.4	-73.4	-153.8	0	0	0	110.7	I221	I221-H223 PolarHBondContact O-N 3.3Å
224	V	97.8	Very high	96.5	Very high	6 Å²	6	62.1 Å²	62.1	4%	0.036	35%	0.349	C	S	.	.			trans	-105.3	121.7	172.3	176.1	0	0	0	0	108.7	I208 I211 Y226 Q273 Q314	I208-V224 HydrophobicContact CD1-CG1 4.25Å; I208-V224 HydrophobicContact CG1-CG1 4.36Å; I211-V224 HydrophobicContact CD1-CG2 3.58Å; V224-Y226 HydrophobicContact CB-CD2 4.43Å; V224-Y226 HydrophobicContact CB-CE1 4.25Å; V224-Y226 HydrophobicContact CB-CE2 3.97Å; V224-Y226 HydrophobicContact CG1-CD1 3.9Å; V224-Y226 HydrophobicContact CG1-CD2 4.34Å; V224-Y226 HydrophobicContact CG1-CE1 3.73Å; V224-Y226 HydrophobicContact CG1-CE2 4.19Å; V224-Y226 HydrophobicContact CG1-CG 4.21Å; V224-Y226 WeakPolarHBondContact O-CD2 3.38Å; V224-Y226 PolarHBondContact O-N 2.98Å; V224-Y226 VanDerWaalsContact O-N 3.16Å; V224-Q273 PolarHBondContact O-NE2 3.14Å; V224-Q314 HydrophobicContact CG2-CB 4.23Å
225	E	97.8	Very high	96.9	Very high	179 Å²	179	60.3 Å²	60.3	84%	0.836	34%	0.339	S	S	*	.			trans	-76.6	98.6	168.2	-172.5	179	178.9	0	0	108.6	R204	R204-E225 PolarHBondContact NH2-O 3.08Å
226	Y	98.4	Very high	97.1	Very high	22 Å²	22	64.4 Å²	64.4	9%	0.086	36%	0.358	C	S	.	.			trans	-73.8	140.1	179.7	-67	-77.1	0	0	0	111.8	V224 E230 I271 Q314	V224-Y226 HydrophobicContact CB-CD2 4.43Å; V224-Y226 HydrophobicContact CB-CE1 4.25Å; V224-Y226 HydrophobicContact CB-CE2 3.97Å; V224-Y226 HydrophobicContact CG1-CD1 3.9Å; V224-Y226 HydrophobicContact CG1-CD2 4.34Å; V224-Y226 HydrophobicContact CG1-CE1 3.73Å; V224-Y226 HydrophobicContact CG1-CE2 4.19Å; V224-Y226 HydrophobicContact CG1-CG 4.21Å; V224-Y226 WeakPolarHBondContact O-CD2 3.38Å; V224-Y226 PolarHBondContact O-N 2.98Å; V224-Y226 VanDerWaalsContact O-N 3.16Å; Y226-E230 WeakPolarHBondContact CA-OE2 3.45Å; Y226-E230 HydrophobicContact CD1-CB 4.31Å; Y226-E230 WeakPolarHBondContact CD1-OE2 3.46Å; Y226-I271 HydrophobicContact CD1-CD1 3.61Å; Y226-I271 HydrophobicContact CD2-CB 3.68Å; Y226-I271 HydrophobicContact CD2-CD1 4.06Å; Y226-I271 HydrophobicContact CD2-CG1 4.4Å; Y226-I271 HydrophobicContact CD2-CG2 3.96Å; Y226-I271 HydrophobicContact CE1-CD1 4.05Å; Y226-I271 HydrophobicContact CE1-CG2 4.29Å; Y226-I271 HydrophobicContact CE2-CB 3.76Å; Y226-I271 HydrophobicContact CE2-CD1 4.46Å; Y226-I271 HydrophobicContact CE2-CG2 3.48Å; Y226-I271 VanDerWaalsContact CE2-CG2 3.48Å; Y226-I271 HydrophobicContact CG-CB 4.16Å; Y226-I271 HydrophobicContact CG-CD1 3.62Å; Y226-I271 HydrophobicContact CG-CG1 4.41Å; Y226-Q314 VanDerWaalsContact CE1-O 3.3Å; Y226-Q314 WeakPolarHBondContact CE1-O 3.33Å; Y226-Q314 PolarHBondContact OH-O 3.19Å
227	T	98.3	Very high	97.3	Very high	62 Å²	62	61 Å²	61	38%	0.38	34%	0.344	S	S	.	.			trans	-74.6	164.2	178.1	77.9	0	0	0	0	111.1	E229 E230 I231	T227-E229 PolarHBondContact O-N 3.01Å; T227-E229 PolarHBondContact OG1-N 3.49Å; T227-E230 PolarHBondContact N-OE2 3.03Å; T227-E230 PolarHBondContact O-N 3.47Å; T227-E230 WeakPolarHBondContact OG1-CG 3.38Å; T227-E230 PolarHBondContact OG1-N 2.87Å; T227-I231 WeakPolarHBondContact O-CG1 3.32Å; T227-I231 PolarHBondContact O-N 3.33Å
228	A	98.3	Very high	97.5	Very high	85 Å²	85	59.2 Å²	59.2	70%	0.702	34%	0.335	S	S	*	.	H	α-helix	trans	-60.7	-32.9	175.5	0	0	0	0	0	113	A232	A228-A232 WeakPolarHBondContact O-CB 3.32Å; A228-A232 PolarHBondContact O-N 3.22Å
229	E	97.8	Very high	97.8	Very high	130 Å²	130	57.8 Å²	57.8	61%	0.607	32%	0.317	S	S	*	.	H	α-helix	trans	-69.6	-45.1	176.1	-177.4	175.8	-121	0	0	111.2	T227 I231 A232 T233 A319	T227-E229 PolarHBondContact O-N 3.01Å; T227-E229 PolarHBondContact OG1-N 3.49Å; E229-I231 VanDerWaalsContact C-N 3.34Å; E229-I231 PolarHBondContact O-N 3.29Å; E229-A232 WeakPolarHBondContact O-CB 3.46Å; E229-A232 PolarHBondContact O-N 2.77Å; E229-A232 VanDerWaalsContact O-N 3.12Å; E229-T233 PolarHBondContact O-N 2.98Å; E229-T233 PolarHBondContact O-OG1 2.8Å; E229-A319 HydrophobicContact CG-CB 3.93Å
230	E	98.4	Very high	97.8	Very high	17 Å²	17	55.2 Å²	55.2	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-45.6	175.6	-67.4	174.3	150.1	0	0	110.7	R204 Y226 T227 A232 T233 W234 I271 I316	R204-E230 WeakPolarHBondContact CG-OE1 3.44Å; R204-E230 IonicContact CZ-OE1 3.56Å; R204-E230 IonicContact CZ-OE2 2.66Å; R204-E230 IonicContact NE-OE1 2.98Å; R204-E230 PolarHBondContact NE-OE1 2.85Å; R204-E230 IonicContact NE-OE2 2.72Å; R204-E230 IonicContact NH2-OE1 2.64Å; R204-E230 PolarHBondContact NH2-OE1 3.04Å; R204-E230 IonicContact NH2-OE2 2.89Å; R204-E230 PolarHBondContact NH2-OE2 2.88Å; Y226-E230 WeakPolarHBondContact CA-OE2 3.45Å; Y226-E230 HydrophobicContact CD1-CB 4.31Å; Y226-E230 WeakPolarHBondContact CD1-OE2 3.46Å; T227-E230 PolarHBondContact N-OE2 3.03Å; T227-E230 PolarHBondContact O-N 3.47Å; T227-E230 WeakPolarHBondContact OG1-CG 3.38Å; T227-E230 PolarHBondContact OG1-N 2.87Å; E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 3.44Å; E230-T233 PolarHBondContact O-N 2.79Å; E230-W234 PolarHBondContact O-N 3.17Å; E230-I271 HydrophobicContact CB-CD1 4.34Å; E230-I316 HydrophobicContact CB-CG2 3.71Å; E230-I316 HydrophobicContact CG-CG2 3.53Å; E230-I316 VanDerWaalsContact O-CD1 3.32Å; E230-I316 WeakPolarHBondContact O-CD1 3.32Å
231	I	98.6	Very high	97.7	Very high	49 Å²	49	51.2 Å²	51.2	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-37	176.3	-65.9	165.9	0	0	0	111.3	T227 E229 W234 K235 D269 I271	T227-I231 WeakPolarHBondContact O-CG1 3.32Å; T227-I231 PolarHBondContact O-N 3.33Å; E229-I231 VanDerWaalsContact C-N 3.34Å; E229-I231 PolarHBondContact O-N 3.29Å; I231-W234 PolarHBondContact O-N 3.25Å; I231-K235 WeakPolarHBondContact O-CB 3.48Å; I231-K235 PolarHBondContact O-N 3.27Å; I231-D269 WeakPolarHBondContact CG2-O 3.19Å; I231-I271 HydrophobicContact CG1-CD1 4.44Å
232	A	98.2	Very high	97.6	Very high	55 Å²	55	55 Å²	55	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-66.3	-40.7	176.2	0	0	0	0	0	112.2	A228 E229 E230 K235 E236	A228-A232 WeakPolarHBondContact O-CB 3.32Å; A228-A232 PolarHBondContact O-N 3.22Å; E229-A232 WeakPolarHBondContact O-CB 3.46Å; E229-A232 PolarHBondContact O-N 2.77Å; E229-A232 VanDerWaalsContact O-N 3.12Å; E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 3.44Å; A232-K235 WeakPolarHBondContact O-CB 3.49Å; A232-K235 PolarHBondContact O-N 3.05Å; A232-E236 PolarHBondContact O-N 2.95Å; A232-E236 VanDerWaalsContact O-N 3.15Å
233	T	97.4	Very high	97.6	Very high	6 Å²	6	55.3 Å²	55.3	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-46.4	173.2	-58.7	0	0	0	0	111.4	E229 E230 K235 E236 V237 I316 R317 A319 P322	E229-T233 PolarHBondContact O-N 2.98Å; E229-T233 PolarHBondContact O-OG1 2.8Å; E230-T233 PolarHBondContact O-N 2.79Å; T233-K235 VanDerWaalsContact C-N 3.32Å; T233-K235 PolarHBondContact O-N 2.86Å; T233-E236 PolarHBondContact O-N 3.04Å; T233-V237 WeakPolarHBondContact O-CG2 3.39Å; T233-V237 PolarHBondContact O-N 3.4Å; T233-I316 HydrophobicContact CG2-CD1 4.15Å; T233-I316 HydrophobicContact CG2-CG1 4.18Å; T233-R317 HydrophobicContact CG2-CG 3.84Å; T233-A319 WeakPolarHBondContact OG1-CB 3.46Å; T233-P322 HydrophobicContact CG2-CB 4.21Å
234	W	98.2	Very high	97.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-56.9	-46.6	174.3	166.3	-93.7	0	0	0	111.7	E230 I231 E236 V237 Y238 R267 S270 I271 P272 I316 L334 L335	E230-W234 PolarHBondContact O-N 3.17Å; I231-W234 PolarHBondContact O-N 3.25Å; W234-E236 VanDerWaalsContact C-N 3.3Å; W234-E236 PolarHBondContact O-N 2.88Å; W234-V237 PolarHBondContact O-N 3.2Å; W234-Y238 AromaticContact CE2-CD2 3.72Å; W234-Y238 HydrophobicContact CH2-CD2 4.27Å; W234-Y238 AromaticContact CZ2-CD2 3.44Å; W234-Y238 HydrophobicContact CZ2-CD2 3.44Å; W234-Y238 VanDerWaalsContact CZ2-CD2 3.44Å; W234-Y238 AromaticContact CZ2-CE2 3.98Å; W234-Y238 HydrophobicContact CZ2-CE2 3.98Å; W234-Y238 HydrophobicContact CZ2-CG 4.45Å; W234-Y238 AromaticContact NE1-CD2 3.86Å; W234-Y238 WeakPolarHBondContact O-CB 3.33Å; W234-Y238 PolarHBondContact O-N 3.07Å; W234-R267 PolarHBondContact NE1-O 3.25Å; W234-S270 PolarHBondContact NE1-O 2.73Å; W234-I271 HydrophobicContact CB-CD1 3.87Å; W234-I271 HydrophobicContact CB-CG1 3.5Å; W234-I271 VanDerWaalsContact CB-CG1 3.5Å; W234-I271 HydrophobicContact CD2-CG1 3.83Å; W234-I271 HydrophobicContact CE3-CG1 4.2Å; W234-I271 HydrophobicContact CE3-CG2 4.42Å; W234-I271 HydrophobicContact CG-CD1 4.4Å; W234-I271 HydrophobicContact CG-CG1 3.51Å; W234-P272 HydrophobicContact CH2-CG 4.15Å; W234-P272 VanDerWaalsContact CZ2-CD 3.43Å; W234-P272 HydrophobicContact CZ2-CG 4.06Å; W234-I316 HydrophobicContact CB-CD1 3.75Å; W234-L334 HydrophobicContact CH2-CB 3.99Å; W234-L334 HydrophobicContact CH2-CD1 4.12Å; W234-L334 HydrophobicContact CZ3-CB 4.09Å; W234-L334 HydrophobicContact CZ3-CD1 3.99Å; W234-L335 HydrophobicContact CH2-CD1 4.36Å; W234-L335 HydrophobicContact CH2-CD2 3.56Å; W234-L335 HydrophobicContact CH2-CG 3.87Å; W234-L335 HydrophobicContact CZ2-CD2 4.07Å; W234-L335 HydrophobicContact CZ3-CD1 4.24Å; W234-L335 HydrophobicContact CZ3-CD2 4.21Å; W234-L335 HydrophobicContact CZ3-CG 4.01Å
235	K	98	Very high	97.6	Very high	103 Å²	103	51.4 Å²	51.4	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-54.9	-46.6	-180	-178.8	167.6	-179.9	178.3	0	112.2	I231 A232 T233 A239 E268	I231-K235 WeakPolarHBondContact O-CB 3.48Å; I231-K235 PolarHBondContact O-N 3.27Å; A232-K235 WeakPolarHBondContact O-CB 3.49Å; A232-K235 PolarHBondContact O-N 3.05Å; T233-K235 VanDerWaalsContact C-N 3.32Å; T233-K235 PolarHBondContact O-N 2.86Å; K235-A239 VanDerWaalsContact O-CB 3.25Å; K235-A239 WeakPolarHBondContact O-CB 3.4Å; K235-A239 PolarHBondContact O-N 3.42Å; K235-E268 VanDerWaalsContact CA-O 3.25Å; K235-E268 WeakPolarHBondContact CA-O 3.39Å; K235-E268 WeakPolarHBondContact CB-O 3.41Å; K235-E268 HydrophobicContact CG-CB 4.15Å; K235-E268 WeakPolarHBondContact CG-O 3.46Å
236	E	96.6	Very high	97.5	Very high	97 Å²	97	46.7 Å²	46.7	45%	0.453	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-47.3	-179.6	-174.4	173.8	170.4	0	0	111.7	A232 T233 W234 T240 P322	A232-E236 PolarHBondContact O-N 2.95Å; A232-E236 VanDerWaalsContact O-N 3.15Å; T233-E236 PolarHBondContact O-N 3.04Å; W234-E236 VanDerWaalsContact C-N 3.3Å; W234-E236 PolarHBondContact O-N 2.88Å; E236-T240 WeakPolarHBondContact O-CB 3.45Å; E236-T240 PolarHBondContact O-N 3.06Å; E236-T240 PolarHBondContact O-OG1 3.16Å; E236-P322 VanDerWaalsContact CD-CG 3.47Å; E236-P322 HydrophobicContact CG-CB 4.4Å; E236-P322 HydrophobicContact CG-CG 4.5Å; E236-P322 WeakPolarHBondContact OE1-CG 3.44Å; E236-P322 WeakPolarHBondContact OE2-CG 3.39Å
237	V	96.8	Very high	97.4	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-48.7	178.6	177.1	0	0	0	0	111.1	T233 W234 T240 L241 P322 C331 L335	T233-V237 WeakPolarHBondContact O-CG2 3.39Å; T233-V237 PolarHBondContact O-N 3.4Å; W234-V237 PolarHBondContact O-N 3.2Å; V237-T240 PolarHBondContact O-N 2.82Å; V237-L241 HydrophobicContact CG1-CD1 3.61Å; V237-L241 HydrophobicContact CG1-CG 4.46Å; V237-L241 WeakPolarHBondContact O-CB 3.11Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.4Å; V237-P322 HydrophobicContact CG2-CB 4.36Å; V237-P322 WeakPolarHBondContact CG2-O 3.32Å; V237-C331 HydrophobicContact CG1-CB 4.09Å; V237-L335 HydrophobicContact CG1-CD1 3.98Å
238	Y	97.9	Very high	97.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-51.7	-178.6	-175.3	-77.6	0	0	0	111.7	W234 T240 L241 K242 F257 E261 Y266 E268 L335	W234-Y238 AromaticContact CE2-CD2 3.72Å; W234-Y238 HydrophobicContact CH2-CD2 4.27Å; W234-Y238 AromaticContact CZ2-CD2 3.44Å; W234-Y238 HydrophobicContact CZ2-CD2 3.44Å; W234-Y238 VanDerWaalsContact CZ2-CD2 3.44Å; W234-Y238 AromaticContact CZ2-CE2 3.98Å; W234-Y238 HydrophobicContact CZ2-CE2 3.98Å; W234-Y238 HydrophobicContact CZ2-CG 4.45Å; W234-Y238 AromaticContact NE1-CD2 3.86Å; W234-Y238 WeakPolarHBondContact O-CB 3.33Å; W234-Y238 PolarHBondContact O-N 3.07Å; Y238-T240 VanDerWaalsContact C-N 3.3Å; Y238-T240 PolarHBondContact O-N 2.89Å; Y238-L241 PolarHBondContact O-N 2.93Å; Y238-K242 HydrophobicContact CD1-CB 4.45Å; Y238-K242 HydrophobicContact CD1-CD 4.25Å; Y238-K242 HydrophobicContact CE1-CB 4.38Å; Y238-K242 HydrophobicContact CE1-CD 3.47Å; Y238-K242 VanDerWaalsContact CE1-CD 3.47Å; Y238-K242 WeakPolarHBondContact O-CB 3.32Å; Y238-K242 PolarHBondContact O-N 3.49Å; Y238-F257 HydrophobicContact CD2-CZ 4.36Å; Y238-F257 HydrophobicContact CE2-CE1 4.21Å; Y238-F257 HydrophobicContact CE2-CE2 4.46Å; Y238-F257 AromaticContact CE2-CZ 3.54Å; Y238-F257 HydrophobicContact CE2-CZ 3.54Å; Y238-F257 AromaticContact CZ-CE1 3.89Å; Y238-F257 AromaticContact CZ-CZ 3.68Å; Y238-F257 WeakPolarHBondContact OH-CE1 3.41Å; Y238-E261 PolarHBondContact OH-OE1 3.43Å; Y238-Y266 HydrophobicContact CE2-CD1 4.33Å; Y238-E268 HydrophobicContact CD1-CB 4.31Å; Y238-E268 HydrophobicContact CD1-CG 3.39Å; Y238-E268 HydrophobicContact CE1-CG 3.75Å; Y238-E268 HydrophobicContact CG-CG 4.37Å; Y238-L335 HydrophobicContact CD2-CD2 3.76Å; Y238-L335 HydrophobicContact CE2-CD2 4.13Å
239	A	97.1	Very high	97.4	Very high	40 Å²	40	44.5 Å²	44.5	33%	0.331	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-40.7	-177.5	0	0	0	0	0	111.4	K235 G243 E268	K235-A239 VanDerWaalsContact O-CB 3.25Å; K235-A239 WeakPolarHBondContact O-CB 3.4Å; K235-A239 PolarHBondContact O-N 3.42Å; A239-G243 PolarHBondContact O-N 2.86Å; A239-E268 HydrophobicContact CB-CG 4.4Å
240	T	95.8	Very high	97.4	Very high	48 Å²	48	38.3 Å²	38.3	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-66.7	-50.2	-179.5	-54.8	0	0	0	0	111.7	E236 V237 Y238 G243 M323 Y398	E236-T240 WeakPolarHBondContact O-CB 3.45Å; E236-T240 PolarHBondContact O-N 3.06Å; E236-T240 PolarHBondContact O-OG1 3.16Å; V237-T240 PolarHBondContact O-N 2.82Å; Y238-T240 VanDerWaalsContact C-N 3.3Å; Y238-T240 PolarHBondContact O-N 2.89Å; T240-G243 PolarHBondContact O-N 3.38Å; T240-M323 HydrophobicContact CG2-CE 3.6Å; T240-Y398 HydrophobicContact CG2-CD2 3.66Å; T240-Y398 HydrophobicContact CG2-CE2 4.28Å; T240-Y398 HydrophobicContact CG2-CG 4.19Å
241	L	96.6	Very high	97.4	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-40.8	-178.7	-70.7	169.1	0	0	0	112.4	V237 Y238 G243 L244 Y245 L335	V237-L241 HydrophobicContact CG1-CD1 3.61Å; V237-L241 HydrophobicContact CG1-CG 4.46Å; V237-L241 WeakPolarHBondContact O-CB 3.11Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.4Å; Y238-L241 PolarHBondContact O-N 2.93Å; L241-G243 PolarHBondContact O-N 2.94Å; L241-L244 WeakPolarHBondContact O-CA 3.29Å; L241-L244 WeakPolarHBondContact O-CB 3.27Å; L241-L244 PolarHBondContact O-N 3.16Å; L241-Y245 HydrophobicContact CB-CE1 3.93Å; L241-Y245 HydrophobicContact CB-CE2 4.15Å; L241-Y245 WeakPolarHBondContact CB-OH 3.47Å; L241-Y245 WeakPolarHBondContact O-CD1 3.28Å; L241-Y245 PolarHBondContact O-N 3.25Å; L241-L335 HydrophobicContact CD1-CD1 3.89Å
242	K	96.8	Very high	97.4	Very high	82 Å²	82	42.2 Å²	42.2	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-34.4	176.5	-176.7	173.8	173.9	-179.7	0	112.3	Y238 L244 Y245 F257 E261	Y238-K242 HydrophobicContact CD1-CB 4.45Å; Y238-K242 HydrophobicContact CD1-CD 4.25Å; Y238-K242 HydrophobicContact CE1-CB 4.38Å; Y238-K242 HydrophobicContact CE1-CD 3.47Å; Y238-K242 VanDerWaalsContact CE1-CD 3.47Å; Y238-K242 WeakPolarHBondContact O-CB 3.32Å; Y238-K242 PolarHBondContact O-N 3.49Å; K242-L244 PolarHBondContact O-N 3.44Å; K242-Y245 HydrophobicContact CB-CD2 4.4Å; K242-F257 HydrophobicContact CD-CE1 4.29Å; K242-E261 VanDerWaalsContact CE-OE1 3.28Å; K242-E261 WeakPolarHBondContact CE-OE1 3.36Å; K242-E261 IonicContact NZ-OE1 3.58Å; K242-E261 PolarHBondContact NZ-OE1 3.23Å
243	G	96.8	Very high	97.4	Very high	62 Å²	62	39.6 Å²	39.6	64%	0.639	23%	0.225	S	C	*	.	H	α-helix	trans	-62.7	-23.8	173.1	0	0	0	0	0	114.2	A239 T240 L241	A239-G243 PolarHBondContact O-N 2.86Å; T240-G243 PolarHBondContact O-N 3.38Å; L241-G243 PolarHBondContact O-N 2.94Å
244	L	96.8	Very high	97.5	Very high	29 Å²	29	41.7 Å²	41.7	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-98.8	-26.1	-178.9	-65.5	-175.5	0	0	0	114.3	L241 K242 A246 T247 H248 Y398 L401 L402	L241-L244 WeakPolarHBondContact O-CA 3.29Å; L241-L244 WeakPolarHBondContact O-CB 3.27Å; L241-L244 PolarHBondContact O-N 3.16Å; K242-L244 PolarHBondContact O-N 3.44Å; L244-A246 VanDerWaalsContact C-N 3.28Å; L244-A246 PolarHBondContact O-N 2.9Å; L244-T247 PolarHBondContact O-N 3.43Å; L244-T247 VanDerWaalsContact O-N 3.1Å; L244-T247 PolarHBondContact O-OG1 3.4Å; L244-T247 VanDerWaalsContact O-OG1 3.07Å; L244-H248 PolarHBondContact O-N 3.31Å; L244-H248 PolarHBondContact O-ND1 2.96Å; L244-Y398 HydrophobicContact CD1-CD2 3.38Å; L244-Y398 HydrophobicContact CD1-CE2 3.72Å; L244-Y398 HydrophobicContact CD1-CG 4.44Å; L244-Y398 HydrophobicContact CG-CD2 4.4Å; L244-L401 HydrophobicContact CB-CD2 3.96Å; L244-L401 HydrophobicContact CD1-CD2 4.05Å; L244-L402 HydrophobicContact CD1-CD2 4.06Å; L244-L402 HydrophobicContact CD1-CG 4.33Å; L244-L402 HydrophobicContact CD2-CD2 4.27Å
245	Y	98.2	Very high	97.5	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.02	26%	0.257	C	S	.	.	H	α-helix	trans	-56.3	-40.7	-171.6	-67.2	-31.8	0	0	0	113.5	L241 K242 T247 H248 A249 H253 F257 L395	L241-Y245 HydrophobicContact CB-CE1 3.93Å; L241-Y245 HydrophobicContact CB-CE2 4.15Å; L241-Y245 WeakPolarHBondContact CB-OH 3.47Å; L241-Y245 WeakPolarHBondContact O-CD1 3.28Å; L241-Y245 PolarHBondContact O-N 3.25Å; K242-Y245 HydrophobicContact CB-CD2 4.4Å; Y245-T247 PolarHBondContact O-N 3.47Å; Y245-H248 PolarHBondContact O-N 3.11Å; Y245-A249 HydrophobicContact CD1-CB 4.07Å; Y245-A249 HydrophobicContact CG-CB 4.37Å; Y245-A249 WeakPolarHBondContact O-CB 3.3Å; Y245-A249 PolarHBondContact O-N 3.26Å; Y245-H253 AromaticContact CD1-CE1 3.94Å; Y245-H253 AromaticContact CD2-CE1 3.75Å; Y245-H253 AromaticContact CE1-CE1 3.87Å; Y245-H253 AromaticContact CE2-CE1 3.7Å; Y245-H253 AromaticContact CG-CE1 3.89Å; Y245-H253 AromaticContact CZ-CE1 3.75Å; Y245-F257 HydrophobicContact CD2-CZ 4.48Å; Y245-F257 HydrophobicContact CE2-CD2 4.31Å; Y245-F257 AromaticContact CE2-CE2 3.85Å; Y245-F257 HydrophobicContact CE2-CE2 3.85Å; Y245-F257 AromaticContact CE2-CZ 3.99Å; Y245-F257 HydrophobicContact CE2-CZ 3.99Å; Y245-L395 HydrophobicContact CD1-CD2 4.22Å; Y245-L395 HydrophobicContact CE1-CB 4.41Å; Y245-L395 HydrophobicContact CE1-CD2 4.14Å; Y245-L395 VanDerWaalsContact CE1-O 3.28Å; Y245-L395 WeakPolarHBondContact CE1-O 3.25Å; Y245-L395 PolarHBondContact OH-O 2.9Å
246	A	96.3	Very high	97.5	Very high	80 Å²	80	41.6 Å²	41.6	66%	0.661	24%	0.238	S	C	*	.	H	α-helix	trans	-56.5	-28.7	-178	0	0	0	0	0	113.7	L244	L244-A246 VanDerWaalsContact C-N 3.28Å; L244-A246 PolarHBondContact O-N 2.9Å
247	T	96.1	Very high	97.6	Very high	85 Å²	85	37.5 Å²	37.5	52%	0.521	22%	0.218	S	C	.	.	H	α-helix	trans	-104	-28.5	-178.8	45.4	0	0	0	0	113.3	L244 Y245 K388	L244-T247 PolarHBondContact O-N 3.43Å; L244-T247 VanDerWaalsContact O-N 3.1Å; L244-T247 PolarHBondContact O-OG1 3.4Å; L244-T247 VanDerWaalsContact O-OG1 3.07Å; Y245-T247 PolarHBondContact O-N 3.47Å; T247-K388 PolarHBondContact O-NZ 3.11Å
248	H	98.2	Very high	97.6	Very high	35 Å²	35	43.1 Å²	43.1	16%	0.162	25%	0.245	C	C	.	.	H	α-helix	trans	-108.7	-32.7	-170.1	-59.9	70.6	0	0	0	114.1	L244 Y245 K388 A389 L401 L402 L405	L244-H248 PolarHBondContact O-N 3.31Å; L244-H248 PolarHBondContact O-ND1 2.96Å; Y245-H248 PolarHBondContact O-N 3.11Å; H248-K388 CarbonylContact O-C 3.54Å; H248-K388 WeakPolarHBondContact O-CA 3.35Å; H248-A389 PolarHBondContact O-N 3.39Å; H248-L401 HydrophobicContact CB-CD1 3.77Å; H248-L401 HydrophobicContact CB-CD2 3.9Å; H248-L401 HydrophobicContact CB-CG 3.79Å; H248-L402 VanDerWaalsContact NE2-CD2 3.32Å; H248-L402 WeakPolarHBondContact NE2-CD2 3.42Å; H248-L405 HydrophobicContact CB-CD1 3.83Å
249	A	98.5	Very high	97.7	Very high	3 Å²	3	45 Å²	45	3%	0.025	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-81.3	152.7	-175.3	0	0	0	0	0	112	Y245 H253 L254 L395	Y245-A249 HydrophobicContact CD1-CB 4.07Å; Y245-A249 HydrophobicContact CG-CB 4.37Å; Y245-A249 WeakPolarHBondContact O-CB 3.3Å; Y245-A249 PolarHBondContact O-N 3.26Å; A249-H253 HydrophobicContact CB-CB 4.27Å; A249-L254 HydrophobicContact CB-CD2 4.34Å; A249-L254 HydrophobicContact CB-CG 4.4Å; A249-L395 HydrophobicContact CB-CD2 3.56Å
250	C	98.5	Very high	97.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.239	C	C	.	.			trans	-67.8	157.1	172.8	70.9	0	0	0	0	111.5	E252 H253 L254 C381 K388 A389	C250-E252 VanDerWaalsContact C-N 3.28Å; C250-E252 PolarHBondContact O-N 2.78Å; C250-H253 WeakPolarHBondContact O-CB 3.24Å; C250-H253 PolarHBondContact O-N 2.98Å; C250-L254 PolarHBondContact O-N 3.17Å; C250-C381 VanDerWaalsContact CB-SG 3.52Å; C250-K388 HydrophobicContact CB-CB 4.09Å; C250-A389 PolarHBondContact N-O 2.59Å
251	R	98.4	Very high	97.8	Very high	125 Å²	125	43.6 Å²	43.6	47%	0.472	24%	0.238	S	C	.	.	H	α-helix	trans	-56	-40	-179.6	-178.1	179.8	61.2	91.3	8.7	113.2	H253 L254 E255	R251-H253 VanDerWaalsContact C-N 3.34Å; R251-H253 PolarHBondContact O-N 3.5Å; R251-L254 PolarHBondContact O-N 3.14Å; R251-E255 WeakPolarHBondContact CD-OE1 3.22Å; R251-E255 HydrophobicContact CG-CG 4.25Å; R251-E255 VanDerWaalsContact CG-OE1 3.25Å; R251-E255 WeakPolarHBondContact CG-OE1 3.47Å; R251-E255 IonicContact CZ-OE1 2.75Å; R251-E255 IonicContact NE-OE1 3.64Å; R251-E255 IonicContact NH1-OE1 3.13Å; R251-E255 PolarHBondContact NH1-OE1 2.87Å; R251-E255 IonicContact NH1-OE2 3.32Å; R251-E255 WeakPolarHBondContact O-CG 3.32Å; R251-E255 PolarHBondContact O-N 2.89Å
252	E	98.4	Very high	97.9	Very high	24 Å²	24	51.8 Å²	51.8	11%	0.112	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-40.6	-178.3	-68	72	-161.7	0	0	111.4	C250 A256 M340 D343 Q383 F439	C250-E252 VanDerWaalsContact C-N 3.28Å; C250-E252 PolarHBondContact O-N 2.78Å; E252-A256 WeakPolarHBondContact O-CB 3.3Å; E252-A256 PolarHBondContact O-N 3.1Å; E252-M340 HydrophobicContact CB-CE 4.24Å; E252-D343 HydrophobicContact CB-CB 4.32Å; E252-D343 HydrophobicContact CG-CB 4.49Å; E252-Q383 PolarHBondContact OE2-NE2 2.73Å; E252-F439 HydrophobicContact CB-CE2 4.11Å; E252-F439 HydrophobicContact CG-CD2 4.21Å; E252-F439 HydrophobicContact CG-CE2 3.76Å
253	H	98.7	Very high	97.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-50.1	172.4	179.4	-84	0	0	0	111.1	Y245 A249 C250 R251 E255 A256 F257 L335 P339 M340 L395	Y245-H253 AromaticContact CD1-CE1 3.94Å; Y245-H253 AromaticContact CD2-CE1 3.75Å; Y245-H253 AromaticContact CE1-CE1 3.87Å; Y245-H253 AromaticContact CE2-CE1 3.7Å; Y245-H253 AromaticContact CG-CE1 3.89Å; Y245-H253 AromaticContact CZ-CE1 3.75Å; A249-H253 HydrophobicContact CB-CB 4.27Å; C250-H253 WeakPolarHBondContact O-CB 3.24Å; C250-H253 PolarHBondContact O-N 2.98Å; R251-H253 VanDerWaalsContact C-N 3.34Å; R251-H253 PolarHBondContact O-N 3.5Å; H253-E255 PolarHBondContact O-N 2.81Å; H253-A256 PolarHBondContact O-N 3.41Å; H253-F257 AromaticContact CE1-CD2 3.89Å; H253-F257 VanDerWaalsContact O-CB 3.27Å; H253-F257 WeakPolarHBondContact O-CB 3.47Å; H253-F257 PolarHBondContact O-N 3.2Å; H253-L335 PolarHBondContact NE2-O 3.12Å; H253-P339 VanDerWaalsContact CD2-CB 3.42Å; H253-P339 WeakPolarHBondContact CD2-CB 3.16Å; H253-M340 HydrophobicContact CB-SD 3.84Å; H253-L395 HydrophobicContact CB-CD1 4.48Å; H253-L395 VanDerWaalsContact CD2-CD1 3.43Å; H253-L395 WeakPolarHBondContact CD2-CD1 3.17Å
254	L	98.5	Very high	97.9	Very high	50 Å²	50	52 Å²	52	26%	0.262	25%	0.25	S	C	.	.	H	α-helix	trans	-59.8	-44.3	-179	-66.4	175.7	0	0	0	112.7	A249 C250 R251 F257 Q258	A249-L254 HydrophobicContact CB-CD2 4.34Å; A249-L254 HydrophobicContact CB-CG 4.4Å; C250-L254 PolarHBondContact O-N 3.17Å; R251-L254 PolarHBondContact O-N 3.14Å; L254-F257 PolarHBondContact O-N 3.21Å; L254-Q258 WeakPolarHBondContact O-CG 3.39Å; L254-Q258 PolarHBondContact O-N 3.49Å
255	E	98.3	Very high	97.8	Very high	95 Å²	95	51.6 Å²	51.6	44%	0.444	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-44.3	177.8	-73.2	175.2	-172.7	0	0	111.4	R251 H253	R251-E255 WeakPolarHBondContact CD-OE1 3.22Å; R251-E255 HydrophobicContact CG-CG 4.25Å; R251-E255 VanDerWaalsContact CG-OE1 3.25Å; R251-E255 WeakPolarHBondContact CG-OE1 3.47Å; R251-E255 IonicContact CZ-OE1 2.75Å; R251-E255 IonicContact NE-OE1 3.64Å; R251-E255 IonicContact NH1-OE1 3.13Å; R251-E255 PolarHBondContact NH1-OE1 2.87Å; R251-E255 IonicContact NH1-OE2 3.32Å; R251-E255 WeakPolarHBondContact O-CG 3.32Å; R251-E255 PolarHBondContact O-N 2.89Å; H253-E255 PolarHBondContact O-N 2.81Å
256	A	98.2	Very high	97.8	Very high	6 Å²	6	51.4 Å²	51.4	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-67.1	-41.2	176.9	0	0	0	0	0	112.3	E252 H253 Q258 L259 L260 P339 A342	E252-A256 WeakPolarHBondContact O-CB 3.3Å; E252-A256 PolarHBondContact O-N 3.1Å; H253-A256 PolarHBondContact O-N 3.41Å; A256-Q258 VanDerWaalsContact C-N 3.34Å; A256-Q258 PolarHBondContact O-N 3.25Å; A256-L259 WeakPolarHBondContact O-CB 3.15Å; A256-L259 PolarHBondContact O-N 2.8Å; A256-L260 WeakPolarHBondContact O-CG 3.25Å; A256-L260 PolarHBondContact O-N 2.7Å; A256-P339 HydrophobicContact CB-CB 3.97Å; A256-P339 WeakPolarHBondContact CB-O 3.43Å; A256-A342 HydrophobicContact CB-CB 3.94Å
257	F	98.4	Very high	97.9	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.044	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-42.5	-179	-160.4	-92.2	0	0	0	111.8	Y238 K242 Y245 H253 L254 L259 L260 E261 Y266 L335 P339	Y238-F257 HydrophobicContact CD2-CZ 4.36Å; Y238-F257 HydrophobicContact CE2-CE1 4.21Å; Y238-F257 HydrophobicContact CE2-CE2 4.46Å; Y238-F257 AromaticContact CE2-CZ 3.54Å; Y238-F257 HydrophobicContact CE2-CZ 3.54Å; Y238-F257 AromaticContact CZ-CE1 3.89Å; Y238-F257 AromaticContact CZ-CZ 3.68Å; Y238-F257 WeakPolarHBondContact OH-CE1 3.41Å; K242-F257 HydrophobicContact CD-CE1 4.29Å; Y245-F257 HydrophobicContact CD2-CZ 4.48Å; Y245-F257 HydrophobicContact CE2-CD2 4.31Å; Y245-F257 AromaticContact CE2-CE2 3.85Å; Y245-F257 HydrophobicContact CE2-CE2 3.85Å; Y245-F257 AromaticContact CE2-CZ 3.99Å; Y245-F257 HydrophobicContact CE2-CZ 3.99Å; H253-F257 AromaticContact CE1-CD2 3.89Å; H253-F257 VanDerWaalsContact O-CB 3.27Å; H253-F257 WeakPolarHBondContact O-CB 3.47Å; H253-F257 PolarHBondContact O-N 3.2Å; L254-F257 PolarHBondContact O-N 3.21Å; F257-L259 PolarHBondContact O-N 3.19Å; F257-L260 PolarHBondContact O-N 3.11Å; F257-L260 VanDerWaalsContact O-N 3.13Å; F257-E261 HydrophobicContact CD1-CG 4.03Å; F257-E261 HydrophobicContact CE1-CG 3.97Å; F257-E261 WeakPolarHBondContact O-CG 3.39Å; F257-E261 PolarHBondContact O-N 2.68Å; F257-Y266 HydrophobicContact CD2-CD1 4.47Å; F257-Y266 AromaticContact CE2-CD1 3.95Å; F257-Y266 HydrophobicContact CE2-CD1 3.95Å; F257-Y266 HydrophobicContact CE2-CE1 4.27Å; F257-Y266 HydrophobicContact CZ-CD1 4.26Å; F257-L335 HydrophobicContact CE2-CD2 3.82Å; F257-L335 HydrophobicContact CZ-CD2 4.19Å; F257-P339 HydrophobicContact CD2-CG 4.14Å
258	Q	98.2	Very high	97.9	Very high	122 Å²	122	53 Å²	53	57%	0.57	23%	0.234	S	C	*	.	H	α-helix	trans	-59.6	-34.6	174.7	-71.1	175.8	13	0	0	113	L254 A256 R262	L254-Q258 WeakPolarHBondContact O-CG 3.39Å; L254-Q258 PolarHBondContact O-N 3.49Å; A256-Q258 VanDerWaalsContact C-N 3.34Å; A256-Q258 PolarHBondContact O-N 3.25Å; Q258-R262 PolarHBondContact O-N 2.97Å
259	L	98.3	Very high	97.8	Very high	40 Å²	40	56.2 Å²	56.2	21%	0.209	25%	0.252	C	S	.	.	H	α-helix	trans	-74	-39.5	176.3	-61.5	172.5	0	0	0	111.1	A256 F257 R262 Y263 F280	A256-L259 WeakPolarHBondContact O-CB 3.15Å; A256-L259 PolarHBondContact O-N 2.8Å; F257-L259 PolarHBondContact O-N 3.19Å; L259-R262 PolarHBondContact O-N 3.21Å; L259-R262 VanDerWaalsContact O-N 3.16Å; L259-Y263 HydrophobicContact CB-CD2 4.28Å; L259-Y263 HydrophobicContact CD2-CD2 4.38Å; L259-Y263 HydrophobicContact CD2-CE2 3.87Å; L259-Y263 VanDerWaalsContact O-CD2 3.23Å; L259-Y263 WeakPolarHBondContact O-CD2 3.23Å; L259-Y263 PolarHBondContact O-N 3.33Å; L259-F280 HydrophobicContact CB-CE2 4.08Å; L259-F280 HydrophobicContact CB-CZ 3.8Å; L259-F280 HydrophobicContact CD1-CZ 4.42Å
260	L	98.4	Very high	97.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-39.6	176.6	-68.9	165.6	0	0	0	111.8	A256 F257 R262 C264 G265 Y266 F280 V338 P339	A256-L260 WeakPolarHBondContact O-CG 3.25Å; A256-L260 PolarHBondContact O-N 2.7Å; F257-L260 PolarHBondContact O-N 3.11Å; F257-L260 VanDerWaalsContact O-N 3.13Å; L260-R262 VanDerWaalsContact C-N 3.29Å; L260-R262 PolarHBondContact O-N 3.11Å; L260-C264 HydrophobicContact CD2-CB 4Å; L260-C264 CarbonylContact O-C 3.55Å; L260-C264 WeakPolarHBondContact O-CA 3.28Å; L260-C264 WeakPolarHBondContact O-CB 3.36Å; L260-C264 PolarHBondContact O-N 3.15Å; L260-G265 PolarHBondContact O-N 3.1Å; L260-Y266 HydrophobicContact CB-CD1 4.04Å; L260-Y266 HydrophobicContact CB-CD2 3.75Å; L260-Y266 HydrophobicContact CB-CE1 4.22Å; L260-Y266 HydrophobicContact CB-CE2 3.95Å; L260-Y266 HydrophobicContact CB-CG 3.82Å; L260-Y266 HydrophobicContact CD1-CE1 4.06Å; L260-Y266 HydrophobicContact CD1-CE2 4.46Å; L260-Y266 HydrophobicContact CD2-CE2 3.97Å; L260-Y266 HydrophobicContact CG-CE2 4.35Å; L260-Y266 PolarHBondContact O-N 2.91Å; L260-F280 HydrophobicContact CD2-CD1 3.61Å; L260-F280 HydrophobicContact CD2-CE1 3.53Å; L260-F280 HydrophobicContact CD2-CG 4.46Å; L260-F280 HydrophobicContact CD2-CZ 4.32Å; L260-F280 HydrophobicContact CG-CE1 4.08Å; L260-V338 HydrophobicContact CD1-CG1 3.86Å; L260-V338 HydrophobicContact CD2-CG1 3.83Å; L260-P339 HydrophobicContact CD1-CB 4.08Å; L260-P339 HydrophobicContact CD1-CG 3.76Å
261	E	98.1	Very high	97.7	Very high	60 Å²	60	57.9 Å²	57.9	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-60.3	-40.3	172	-70.1	-174.1	124.9	0	0	112.1	Y238 K242 F257	Y238-E261 PolarHBondContact OH-OE1 3.43Å; K242-E261 VanDerWaalsContact CE-OE1 3.28Å; K242-E261 WeakPolarHBondContact CE-OE1 3.36Å; K242-E261 IonicContact NZ-OE1 3.58Å; K242-E261 PolarHBondContact NZ-OE1 3.23Å; F257-E261 HydrophobicContact CD1-CG 4.03Å; F257-E261 HydrophobicContact CE1-CG 3.97Å; F257-E261 WeakPolarHBondContact O-CG 3.39Å; F257-E261 PolarHBondContact O-N 2.68Å
262	R	97.6	Very high	97.8	Very high	174 Å²	174	52.1 Å²	52.1	66%	0.657	24%	0.242	S	C	*	.	H	α-helix	trans	-76.3	-39.6	-176.6	-171.3	175.7	-65	177.4	4.7	113.3	Q258 L259 L260	Q258-R262 PolarHBondContact O-N 2.97Å; L259-R262 PolarHBondContact O-N 3.21Å; L259-R262 VanDerWaalsContact O-N 3.16Å; L260-R262 VanDerWaalsContact C-N 3.29Å; L260-R262 PolarHBondContact O-N 3.11Å
263	Y	97.5	Very high	97.8	Very high	144 Å²	144	52.4 Å²	52.4	57%	0.565	24%	0.243	S	C	*	.	H	α-helix	trans	-117.2	-19.6	-166	-58.4	-63.5	0	0	0	114.6	L259 F280	L259-Y263 HydrophobicContact CB-CD2 4.28Å; L259-Y263 HydrophobicContact CD2-CD2 4.38Å; L259-Y263 HydrophobicContact CD2-CE2 3.87Å; L259-Y263 VanDerWaalsContact O-CD2 3.23Å; L259-Y263 WeakPolarHBondContact O-CD2 3.23Å; L259-Y263 PolarHBondContact O-N 3.33Å; Y263-F280 HydrophobicContact CD2-CE2 4.45Å
264	C	97.1	Very high	97.7	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.041	24%	0.244	C	C	.	.	S	Bend	trans	-117.8	10.8	-172.8	-58.4	0	0	0	0	113.4	L260 Y266 V277 F280	L260-C264 HydrophobicContact CD2-CB 4Å; L260-C264 CarbonylContact O-C 3.55Å; L260-C264 WeakPolarHBondContact O-CA 3.28Å; L260-C264 WeakPolarHBondContact O-CB 3.36Å; L260-C264 PolarHBondContact O-N 3.15Å; C264-Y266 VanDerWaalsContact C-N 3.31Å; C264-Y266 HydrophobicContact CB-CD2 3.97Å; C264-Y266 HydrophobicContact CB-CE2 4.13Å; C264-Y266 PolarHBondContact O-N 3.34Å; C264-V277 HydrophobicContact CB-CG2 4.12Å; C264-F280 WeakPolarHBondContact SG-CB 3.48Å; C264-F280 WeakPolarHBondContact SG-CG 3.36Å
265	G	94.4	Very high	97.7	Very high	19 Å²	19	51.1 Å²	51.1	20%	0.196	24%	0.236	C	C	.	.			trans	72.5	18.8	174.8	0	0	0	0	0	115.1	L260 R267	L260-G265 PolarHBondContact O-N 3.1Å; G265-R267 PolarHBondContact O-N 3.35Å
266	Y	98.3	Very high	97.7	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	23%	0.232	C	C	.	.			trans	-64.1	107.8	173.1	-82.3	-129.1	0	0	0	109.6	Y238 F257 L260 C264 P272 V277 L334 L335 V338	Y238-Y266 HydrophobicContact CE2-CD1 4.33Å; F257-Y266 HydrophobicContact CD2-CD1 4.47Å; F257-Y266 AromaticContact CE2-CD1 3.95Å; F257-Y266 HydrophobicContact CE2-CD1 3.95Å; F257-Y266 HydrophobicContact CE2-CE1 4.27Å; F257-Y266 HydrophobicContact CZ-CD1 4.26Å; L260-Y266 HydrophobicContact CB-CD1 4.04Å; L260-Y266 HydrophobicContact CB-CD2 3.75Å; L260-Y266 HydrophobicContact CB-CE1 4.22Å; L260-Y266 HydrophobicContact CB-CE2 3.95Å; L260-Y266 HydrophobicContact CB-CG 3.82Å; L260-Y266 HydrophobicContact CD1-CE1 4.06Å; L260-Y266 HydrophobicContact CD1-CE2 4.46Å; L260-Y266 HydrophobicContact CD2-CE2 3.97Å; L260-Y266 HydrophobicContact CG-CE2 4.35Å; L260-Y266 PolarHBondContact O-N 2.91Å; C264-Y266 VanDerWaalsContact C-N 3.31Å; C264-Y266 HydrophobicContact CB-CD2 3.97Å; C264-Y266 HydrophobicContact CB-CE2 4.13Å; C264-Y266 PolarHBondContact O-N 3.34Å; Y266-P272 HydrophobicContact CD1-CG 4.38Å; Y266-P272 HydrophobicContact CD2-CB 3.81Å; Y266-P272 HydrophobicContact CD2-CG 3.23Å; Y266-P272 HydrophobicContact CE1-CG 4.5Å; Y266-P272 HydrophobicContact CE2-CB 3.65Å; Y266-P272 HydrophobicContact CE2-CG 3.39Å; Y266-P272 HydrophobicContact CG-CG 3.76Å; Y266-V277 HydrophobicContact CE2-CG2 3.9Å; Y266-L334 HydrophobicContact CE1-CB 4.38Å; Y266-L334 WeakPolarHBondContact CE1-O 3.31Å; Y266-L334 WeakPolarHBondContact OH-CA 3.34Å; Y266-L334 WeakPolarHBondContact OH-CB 3.49Å; Y266-L334 PolarHBondContact OH-O 2.94Å; Y266-L335 HydrophobicContact CD1-CD2 4.35Å; Y266-L335 HydrophobicContact CE1-CD2 4.2Å; Y266-V338 WeakPolarHBondContact OH-CG1 3.46Å
267	R	97.3	Very high	97.8	Very high	119 Å²	119	49.5 Å²	49.5	45%	0.449	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-148	157.2	178	-61.8	-174.4	-61.5	-83.6	-5.6	109.5	W234 G265 D269 S270	W234-R267 PolarHBondContact NE1-O 3.25Å; G265-R267 PolarHBondContact O-N 3.35Å; R267-D269 VanDerWaalsContact CB-OD1 3.29Å; R267-D269 WeakPolarHBondContact CB-OD1 3.38Å; R267-D269 IonicContact NE-OD1 3.64Å; R267-D269 PolarHBondContact NE-OD1 2.84Å; R267-D269 PolarHBondContact O-N 3.01Å; R267-S270 VanDerWaalsContact NH2-CB 3.33Å; R267-S270 PolarHBondContact NH2-OG 3.35Å; R267-S270 PolarHBondContact O-N 3.33Å; R267-S270 VanDerWaalsContact O-O 3.06Å
268	E	96.6	Very high	97.8	Very high	79 Å²	79	49.5 Å²	49.5	37%	0.369	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.7	175.9	-79.1	176.1	-152.3	0	0	113.4	K235 Y238 A239	K235-E268 VanDerWaalsContact CA-O 3.25Å; K235-E268 WeakPolarHBondContact CA-O 3.39Å; K235-E268 WeakPolarHBondContact CB-O 3.41Å; K235-E268 HydrophobicContact CG-CB 4.15Å; K235-E268 WeakPolarHBondContact CG-O 3.46Å; Y238-E268 HydrophobicContact CD1-CB 4.31Å; Y238-E268 HydrophobicContact CD1-CG 3.39Å; Y238-E268 HydrophobicContact CE1-CG 3.75Å; Y238-E268 HydrophobicContact CG-CG 4.37Å; A239-E268 HydrophobicContact CB-CG 4.4Å
269	D	96.4	Very high	97.8	Very high	103 Å²	103	50 Å²	50	55%	0.551	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	10.8	-173.2	64.9	-12.3	0	0	0	114	I231 R267	I231-D269 WeakPolarHBondContact CG2-O 3.19Å; R267-D269 VanDerWaalsContact CB-OD1 3.29Å; R267-D269 WeakPolarHBondContact CB-OD1 3.38Å; R267-D269 IonicContact NE-OD1 3.64Å; R267-D269 PolarHBondContact NE-OD1 2.84Å; R267-D269 PolarHBondContact O-N 3.01Å
270	S	97	Very high	97.8	Very high	33 Å²	33	49 Å²	49	23%	0.231	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-152.9	119.7	-174.4	-173.6	0	0	0	0	111.2	W234 R267 P272	W234-S270 PolarHBondContact NE1-O 2.73Å; R267-S270 VanDerWaalsContact NH2-CB 3.33Å; R267-S270 PolarHBondContact NH2-OG 3.35Å; R267-S270 PolarHBondContact O-N 3.33Å; R267-S270 VanDerWaalsContact O-O 3.06Å; S270-P272 WeakPolarHBondContact O-CD 3.49Å
271	I	98.6	Very high	97.8	Very high	6 Å²	6	49 Å²	49	3%	0.031	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-74.1	124.5	170.2	-59.7	169.2	0	0	0	108.5	Y226 E230 I231 W234 I316 L334	Y226-I271 HydrophobicContact CD1-CD1 3.61Å; Y226-I271 HydrophobicContact CD2-CB 3.68Å; Y226-I271 HydrophobicContact CD2-CD1 4.06Å; Y226-I271 HydrophobicContact CD2-CG1 4.4Å; Y226-I271 HydrophobicContact CD2-CG2 3.96Å; Y226-I271 HydrophobicContact CE1-CD1 4.05Å; Y226-I271 HydrophobicContact CE1-CG2 4.29Å; Y226-I271 HydrophobicContact CE2-CB 3.76Å; Y226-I271 HydrophobicContact CE2-CD1 4.46Å; Y226-I271 HydrophobicContact CE2-CG2 3.48Å; Y226-I271 VanDerWaalsContact CE2-CG2 3.48Å; Y226-I271 HydrophobicContact CG-CB 4.16Å; Y226-I271 HydrophobicContact CG-CD1 3.62Å; Y226-I271 HydrophobicContact CG-CG1 4.41Å; E230-I271 HydrophobicContact CB-CD1 4.34Å; I231-I271 HydrophobicContact CG1-CD1 4.44Å; W234-I271 HydrophobicContact CB-CD1 3.87Å; W234-I271 HydrophobicContact CB-CG1 3.5Å; W234-I271 VanDerWaalsContact CB-CG1 3.5Å; W234-I271 HydrophobicContact CD2-CG1 3.83Å; W234-I271 HydrophobicContact CE3-CG1 4.2Å; W234-I271 HydrophobicContact CE3-CG2 4.42Å; W234-I271 HydrophobicContact CG-CD1 4.4Å; W234-I271 HydrophobicContact CG-CG1 3.51Å; I271-I316 HydrophobicContact CD1-CD1 3.86Å; I271-L334 HydrophobicContact CG2-CD1 4.2Å
272	P	98.5	Very high	97.8	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.019	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-59.4	142.9	175.7	-24.4	33.4	0	0	0	113	W234 Y266 S270 V277 L334	W234-P272 HydrophobicContact CH2-CG 4.15Å; W234-P272 VanDerWaalsContact CZ2-CD 3.43Å; W234-P272 HydrophobicContact CZ2-CG 4.06Å; Y266-P272 HydrophobicContact CD1-CG 4.38Å; Y266-P272 HydrophobicContact CD2-CB 3.81Å; Y266-P272 HydrophobicContact CD2-CG 3.23Å; Y266-P272 HydrophobicContact CE1-CG 4.5Å; Y266-P272 HydrophobicContact CE2-CB 3.65Å; Y266-P272 HydrophobicContact CE2-CG 3.39Å; Y266-P272 HydrophobicContact CG-CG 3.76Å; S270-P272 WeakPolarHBondContact O-CD 3.49Å; P272-V277 HydrophobicContact CB-CG2 3.9Å; P272-L334 HydrophobicContact CB-CD1 4.13Å; P272-L334 HydrophobicContact CG-CD1 4.2Å
273	Q	98.5	Very high	97.9	Very high	30 Å²	30	51.3 Å²	51.3	14%	0.14	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-86.5	136.6	173.8	-63	-64.3	-37.9	0	0	110.3	V224 E275 D276 V277	V224-Q273 PolarHBondContact O-NE2 3.14Å; Q273-E275 PolarHBondContact O-N 3.4Å; Q273-D276 PolarHBondContact O-N 3.22Å; Q273-V277 WeakPolarHBondContact O-CG2 3.38Å; Q273-V277 PolarHBondContact O-N 2.95Å
274	L	98.6	Very high	97.8	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-60.6	-32.9	-175.8	-61.8	-163.6	0	0	0	113.1	I221 V277 S278 L289 C312 Q314 L334	I221-L274 HydrophobicContact CB-CB 4.49Å; I221-L274 HydrophobicContact CD1-CB 3.92Å; I221-L274 HydrophobicContact CG2-CB 3.91Å; I221-L274 HydrophobicContact CG2-CD1 4.5Å; L274-V277 PolarHBondContact O-N 3.35Å; L274-S278 WeakPolarHBondContact O-CB 3.49Å; L274-S278 PolarHBondContact O-N 3.17Å; L274-L289 HydrophobicContact CB-CD1 4.25Å; L274-L289 HydrophobicContact CD2-CD1 3.96Å; L274-C312 HydrophobicContact CD1-CB 3.97Å; L274-C312 VanDerWaalsContact CD2-SG 3.53Å; L274-Q314 HydrophobicContact CD1-CG 3.29Å; L274-Q314 HydrophobicContact CG-CG 3.72Å; L274-L334 HydrophobicContact CD2-CD2 3.87Å
275	E	98.4	Very high	97.9	Very high	23 Å²	23	50 Å²	50	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-47.4	179	177	59.1	-166.3	0	0	111.9	I221 Q273 V277 S278 R279	I221-E275 HydrophobicContact CB-CB 4.07Å; I221-E275 PolarHBondContact N-OE2 3.12Å; Q273-E275 PolarHBondContact O-N 3.4Å; E275-V277 PolarHBondContact O-N 3.37Å; E275-S278 PolarHBondContact O-N 3.37Å; E275-R279 WeakPolarHBondContact O-CG 3.2Å; E275-R279 PolarHBondContact O-N 3.15Å; E275-R279 IonicContact OE1-CZ 3.79Å; E275-R279 IonicContact OE1-NE 3.25Å; E275-R279 PolarHBondContact OE1-NE 3.5Å; E275-R279 IonicContact OE1-NH2 2.63Å; E275-R279 PolarHBondContact OE1-NH2 3.39Å
276	D	98.3	Very high	98.1	Very high	67 Å²	67	50.4 Å²	50.4	36%	0.358	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-42.9	-179.6	-64.4	-36.3	0	0	0	110.8	Q273 R279 F280	Q273-D276 PolarHBondContact O-N 3.22Å; D276-R279 PolarHBondContact O-N 2.94Å; D276-F280 PolarHBondContact O-N 3.17Å; D276-F280 VanDerWaalsContact O-N 3.1Å
277	V	98.8	Very high	98.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-40.4	177	-178.4	0	0	0	0	111.6	C264 Y266 P272 Q273 L274 E275 F280 L281 L289 L334 V338	C264-V277 HydrophobicContact CB-CG2 4.12Å; Y266-V277 HydrophobicContact CE2-CG2 3.9Å; P272-V277 HydrophobicContact CB-CG2 3.9Å; Q273-V277 WeakPolarHBondContact O-CG2 3.38Å; Q273-V277 PolarHBondContact O-N 2.95Å; L274-V277 PolarHBondContact O-N 3.35Å; E275-V277 PolarHBondContact O-N 3.37Å; V277-F280 WeakPolarHBondContact O-CB 3.31Å; V277-F280 PolarHBondContact O-N 3.04Å; V277-L281 HydrophobicContact CG1-CD1 4.36Å; V277-L281 WeakPolarHBondContact O-CG 3.25Å; V277-L281 PolarHBondContact O-N 3.41Å; V277-L289 HydrophobicContact CB-CD1 3.91Å; V277-L289 HydrophobicContact CG1-CD1 3.68Å; V277-L334 HydrophobicContact CG2-CD2 4.27Å; V277-V338 HydrophobicContact CG1-CB 4.35Å; V277-V338 HydrophobicContact CG1-CG1 3.41Å; V277-V338 VanDerWaalsContact CG1-CG1 3.41Å; V277-V338 HydrophobicContact CG1-CG2 3.96Å
278	S	98.8	Very high	98.1	Very high	10 Å²	10	46 Å²	46	7%	0.07	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-43.8	177.8	-173	0	0	0	0	111.4	L274 E275 L281 K282 L289	L274-S278 WeakPolarHBondContact O-CB 3.49Å; L274-S278 PolarHBondContact O-N 3.17Å; E275-S278 PolarHBondContact O-N 3.37Å; S278-L281 PolarHBondContact O-N 3.24Å; S278-K282 WeakPolarHBondContact O-CB 3.22Å; S278-K282 PolarHBondContact O-N 3.1Å; S278-L289 PolarHBondContact OG-N 3.23Å
279	R	98.6	Very high	98.2	Very high	132 Å²	132	42.4 Å²	42.4	50%	0.498	21%	0.205	S	C	.	.	H	α-helix	trans	-61.1	-45.3	174.1	-70.3	178.4	-166.5	163.5	8.9	111.7	E275 D276 K282 E283	E275-R279 WeakPolarHBondContact O-CG 3.2Å; E275-R279 PolarHBondContact O-N 3.15Å; E275-R279 IonicContact OE1-CZ 3.79Å; E275-R279 IonicContact OE1-NE 3.25Å; E275-R279 PolarHBondContact OE1-NE 3.5Å; E275-R279 IonicContact OE1-NH2 2.63Å; E275-R279 PolarHBondContact OE1-NH2 3.39Å; D276-R279 PolarHBondContact O-N 2.94Å; R279-K282 WeakPolarHBondContact O-CB 3.47Å; R279-K282 PolarHBondContact O-N 3.28Å; R279-E283 PolarHBondContact O-N 3.25Å; R279-E283 VanDerWaalsContact O-N 3.11Å
280	F	98.6	Very high	98.3	Very high	20 Å²	20	37.5 Å²	37.5	9%	0.088	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-50.7	176.4	171	-96.6	0	0	0	112	L259 L260 Y263 C264 D276 V277 K282 E283 R284 A342	L259-F280 HydrophobicContact CB-CE2 4.08Å; L259-F280 HydrophobicContact CB-CZ 3.8Å; L259-F280 HydrophobicContact CD1-CZ 4.42Å; L260-F280 HydrophobicContact CD2-CD1 3.61Å; L260-F280 HydrophobicContact CD2-CE1 3.53Å; L260-F280 HydrophobicContact CD2-CG 4.46Å; L260-F280 HydrophobicContact CD2-CZ 4.32Å; L260-F280 HydrophobicContact CG-CE1 4.08Å; Y263-F280 HydrophobicContact CD2-CE2 4.45Å; C264-F280 WeakPolarHBondContact SG-CB 3.48Å; C264-F280 WeakPolarHBondContact SG-CG 3.36Å; D276-F280 PolarHBondContact O-N 3.17Å; D276-F280 VanDerWaalsContact O-N 3.1Å; V277-F280 WeakPolarHBondContact O-CB 3.31Å; V277-F280 PolarHBondContact O-N 3.04Å; F280-K282 PolarHBondContact O-N 2.83Å; F280-E283 PolarHBondContact O-N 2.96Å; F280-R284 HydrophobicContact CD1-CG 4.3Å; F280-R284 HydrophobicContact CD2-CG 4.26Å; F280-R284 HydrophobicContact CE1-CG 3.98Å; F280-R284 HydrophobicContact CE2-CG 3.94Å; F280-R284 HydrophobicContact CG-CG 4.44Å; F280-R284 HydrophobicContact CZ-CG 3.79Å; F280-R284 WeakPolarHBondContact O-CG 3.14Å; F280-R284 PolarHBondContact O-N 2.88Å; F280-R284 VanDerWaalsContact O-N 3.12Å; F280-A342 HydrophobicContact CE1-CB 3.97Å
281	L	98.8	Very high	98.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-38.1	177.6	-73	177.4	0	0	0	111.9	V277 S278 E283 R284 T285 G286 F287 L289 V338 L341 A342	V277-L281 HydrophobicContact CG1-CD1 4.36Å; V277-L281 WeakPolarHBondContact O-CG 3.25Å; V277-L281 PolarHBondContact O-N 3.41Å; S278-L281 PolarHBondContact O-N 3.24Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.4Å; L281-R284 PolarHBondContact O-N 3.21Å; L281-R284 VanDerWaalsContact O-N 3.12Å; L281-T285 PolarHBondContact O-N 3.11Å; L281-T285 PolarHBondContact O-OG1 3.07Å; L281-G286 PolarHBondContact O-N 3.01Å; L281-F287 CarbonylContact C-O 3.5Å; L281-F287 HydrophobicContact CB-CB 4.12Å; L281-F287 VanDerWaalsContact CB-O 3.22Å; L281-F287 WeakPolarHBondContact CB-O 3.49Å; L281-L289 HydrophobicContact CD1-CD2 3.67Å; L281-L289 HydrophobicContact CD1-CG 4.06Å; L281-V338 HydrophobicContact CD1-CG1 4.29Å; L281-V338 HydrophobicContact CD1-CG2 4.43Å; L281-V338 HydrophobicContact CD2-CG1 4.4Å; L281-V338 HydrophobicContact CG-CG1 4.5Å; L281-L341 HydrophobicContact CD1-CB 4.4Å; L281-L341 HydrophobicContact CD2-CB 4.03Å; L281-A342 HydrophobicContact CD2-CB 3.89Å
282	K	98.2	Very high	98	Very high	114 Å²	114	36 Å²	36	50%	0.496	17%	0.169	S	C	.	.	H	α-helix	trans	-62.9	-41.6	-179.5	-171.4	177.1	-175.1	164.7	0	111.4	S278 R279 F280 R284 G286 F287 Q288	S278-K282 WeakPolarHBondContact O-CB 3.22Å; S278-K282 PolarHBondContact O-N 3.1Å; R279-K282 WeakPolarHBondContact O-CB 3.47Å; R279-K282 PolarHBondContact O-N 3.28Å; F280-K282 PolarHBondContact O-N 2.83Å; K282-R284 VanDerWaalsContact C-N 3.33Å; K282-G286 VanDerWaalsContact O-CA 3.25Å; K282-G286 WeakPolarHBondContact O-CA 3.34Å; K282-G286 PolarHBondContact O-N 3.3Å; K282-G286 VanDerWaalsContact O-N 3.07Å; K282-F287 WeakPolarHBondContact CA-O 3.35Å; K282-F287 PolarHBondContact N-O 2.71Å; K282-Q288 HydrophobicContact CB-CG 3.92Å; K282-Q288 HydrophobicContact CD-CG 3.89Å; K282-Q288 HydrophobicContact CG-CG 3.98Å
283	E	97.9	Very high	97.5	Very high	168 Å²	168	36.5 Å²	36.5	79%	0.785	17%	0.172	S	C	*	.	H	α-helix	trans	-70.5	-27.8	176.2	-69.1	179.8	-174.5	0	0	113.1	R279 F280 L281	R279-E283 PolarHBondContact O-N 3.25Å; R279-E283 VanDerWaalsContact O-N 3.11Å; F280-E283 PolarHBondContact O-N 2.96Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.4Å
284	R	97.2	Very high	96.8	Very high	112 Å²	112	35.2 Å²	35.2	42%	0.423	17%	0.167	S	C	.	.	H	α-helix	trans	-85.2	-51.1	-176	-67.4	-65.4	-62.5	-162.8	-4.9	113.3	F280 L281 K282	F280-R284 HydrophobicContact CD1-CG 4.3Å; F280-R284 HydrophobicContact CD2-CG 4.26Å; F280-R284 HydrophobicContact CE1-CG 3.98Å; F280-R284 HydrophobicContact CE2-CG 3.94Å; F280-R284 HydrophobicContact CG-CG 4.44Å; F280-R284 HydrophobicContact CZ-CG 3.79Å; F280-R284 WeakPolarHBondContact O-CG 3.14Å; F280-R284 PolarHBondContact O-N 2.88Å; F280-R284 VanDerWaalsContact O-N 3.12Å; L281-R284 PolarHBondContact O-N 3.21Å; L281-R284 VanDerWaalsContact O-N 3.12Å; K282-R284 VanDerWaalsContact C-N 3.33Å
285	T	98.3	Very high	96.1	Very high	9 Å²	9	38 Å²	38	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-135.6	0.2	-170.4	60.9	0	0	0	0	112.6	L281 F287 R308 L341 A342 R344 A347	L281-T285 PolarHBondContact O-N 3.11Å; L281-T285 PolarHBondContact O-OG1 3.07Å; T285-F287 PolarHBondContact O-N 3.37Å; T285-R308 WeakPolarHBondContact O-CD 3.2Å; T285-R308 PolarHBondContact O-NH1 3.42Å; T285-L341 VanDerWaalsContact CG2-O 3.29Å; T285-L341 WeakPolarHBondContact CG2-O 3.17Å; T285-L341 PolarHBondContact OG1-O 2.9Å; T285-A342 WeakPolarHBondContact CG2-O 3.38Å; T285-R344 HydrophobicContact CG2-CG 4.17Å; T285-A347 HydrophobicContact CG2-CB 3.91Å
286	G	98.1	Very high	95.5	Very high	29 Å²	29	37.4 Å²	37.4	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	77.6	-2.3	-173.6	0	0	0	0	0	113.8	L281 K282	L281-G286 PolarHBondContact O-N 3.01Å; K282-G286 VanDerWaalsContact O-CA 3.25Å; K282-G286 WeakPolarHBondContact O-CA 3.34Å; K282-G286 PolarHBondContact O-N 3.3Å; K282-G286 VanDerWaalsContact O-N 3.07Å
287	F	98.6	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.			trans	-67.1	145.6	173.7	-99.4	-99.5	0	0	0	111.8	L281 K282 T285 L305 R308 F310 L341 A347	L281-F287 CarbonylContact C-O 3.5Å; L281-F287 HydrophobicContact CB-CB 4.12Å; L281-F287 VanDerWaalsContact CB-O 3.22Å; L281-F287 WeakPolarHBondContact CB-O 3.49Å; K282-F287 WeakPolarHBondContact CA-O 3.35Å; K282-F287 PolarHBondContact N-O 2.71Å; T285-F287 PolarHBondContact O-N 3.37Å; F287-L305 HydrophobicContact CE1-CD2 4.3Å; F287-R308 CarbonylContact C-O 3.58Å; F287-R308 WeakPolarHBondContact CA-O 3.36Å; F287-R308 HydrophobicContact CB-CB 4.44Å; F287-R308 HydrophobicContact CD1-CB 4.17Å; F287-R308 WeakPolarHBondContact CD1-O 3.42Å; F287-R308 HydrophobicContact CD2-CB 3.52Å; F287-R308 HydrophobicContact CD2-CG 3.81Å; F287-R308 HydrophobicContact CE1-CB 4.29Å; F287-R308 HydrophobicContact CE2-CB 3.63Å; F287-R308 HydrophobicContact CE2-CG 3.59Å; F287-R308 HydrophobicContact CG-CB 3.81Å; F287-R308 HydrophobicContact CZ-CB 4.04Å; F287-R308 HydrophobicContact CZ-CG 4.22Å; F287-F310 HydrophobicContact CD1-CB 4.25Å; F287-F310 HydrophobicContact CE1-CB 4.46Å; F287-L341 HydrophobicContact CD1-CD1 4.13Å; F287-L341 HydrophobicContact CD1-CD2 3.91Å; F287-L341 HydrophobicContact CD1-CG 4.46Å; F287-L341 HydrophobicContact CE1-CD1 4.47Å; F287-L341 HydrophobicContact CE1-CD2 3.71Å; F287-L341 HydrophobicContact CE2-CD2 4.42Å; F287-L341 HydrophobicContact CG-CD2 4.34Å; F287-L341 HydrophobicContact CZ-CD2 3.99Å; F287-A347 HydrophobicContact CD2-CB 3.72Å; F287-A347 HydrophobicContact CE2-CB 3.72Å; F287-A347 VanDerWaalsContact CE2-O 3.31Å; F287-A347 WeakPolarHBondContact CE2-O 3.31Å
288	Q	98.1	Very high	94.5	Very high	28 Å²	28	36.8 Å²	36.8	13%	0.131	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	148.6	174.7	-74.1	164.5	56.7	0	0	109.1	K282 R308 V309 F310	K282-Q288 HydrophobicContact CB-CG 3.92Å; K282-Q288 HydrophobicContact CD-CG 3.89Å; K282-Q288 HydrophobicContact CG-CG 3.98Å; Q288-R308 PolarHBondContact N-O 3.44Å; Q288-V309 WeakPolarHBondContact O-CA 3.36Å; Q288-F310 PolarHBondContact O-N 2.97Å
289	L	98.4	Very high	94.2	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	149.9	171	-54.8	-174.4	0	0	0	109.9	I221 L274 V277 S278 L281 F310 C312 V338	I221-L289 HydrophobicContact CD1-CB 4.11Å; I221-L289 WeakPolarHBondContact CD1-O 3.32Å; L274-L289 HydrophobicContact CB-CD1 4.25Å; L274-L289 HydrophobicContact CD2-CD1 3.96Å; V277-L289 HydrophobicContact CB-CD1 3.91Å; V277-L289 HydrophobicContact CG1-CD1 3.68Å; S278-L289 PolarHBondContact OG-N 3.23Å; L281-L289 HydrophobicContact CD1-CD2 3.67Å; L281-L289 HydrophobicContact CD1-CG 4.06Å; L289-F310 CarbonylContact C-O 3.53Å; L289-F310 WeakPolarHBondContact CA-O 3.47Å; L289-F310 HydrophobicContact CD2-CB 4.07Å; L289-F310 HydrophobicContact CD2-CD1 3.99Å; L289-F310 HydrophobicContact CD2-CG 4.48Å; L289-C312 HydrophobicContact CB-CB 4.38Å; L289-C312 HydrophobicContact CD2-CB 4.4Å; L289-V338 HydrophobicContact CD1-CG2 4.29Å; L289-V338 HydrophobicContact CD2-CG2 4.32Å
290	R	97.9	Very high	93.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	126.8	170.6	176.1	172.1	-178.2	103.8	12.9	108.7	D176 Y215 V292 V309 F310 Q311 C312	D176-R290 IonicContact OD1-CZ 3.43Å; D176-R290 IonicContact OD1-NH1 3.23Å; D176-R290 PolarHBondContact OD1-NH1 3.13Å; D176-R290 IonicContact OD1-NH2 3.26Å; D176-R290 PolarHBondContact OD1-NH2 3.22Å; Y215-R290 HydrophobicContact CD1-CG 3.98Å; Y215-R290 HydrophobicContact CE1-CB 4.49Å; Y215-R290 HydrophobicContact CE1-CG 3.77Å; Y215-R290 PolarHBondContact O-NH2 3.49Å; R290-V292 PolarHBondContact O-N 2.86Å; R290-V309 HydrophobicContact CB-CG1 3.65Å; R290-F310 PolarHBondContact N-O 3.35Å; R290-Q311 WeakPolarHBondContact O-CA 3.43Å; R290-C312 PolarHBondContact O-N 2.93Å
291	P	96.8	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	132.3	178.6	28.9	-36.6	0	0	0	110.3	A212 Y215 I221 C312	A212-P291 HydrophobicContact CB-CB 4.16Å; A212-P291 WeakPolarHBondContact CB-O 3.45Å; Y215-P291 HydrophobicContact CD1-CG 3.85Å; Y215-P291 HydrophobicContact CD2-CG 3.9Å; Y215-P291 HydrophobicContact CG-CG 3.5Å; Y215-P291 VanDerWaalsContact CG-CG 3.5Å; I221-P291 HydrophobicContact CG2-CB 4.21Å; I221-P291 HydrophobicContact CG2-CG 3.95Å; P291-C312 WeakPolarHBondContact CA-O 3.47Å
292	V	92.4	Very high	93.6	Very high	9 Å²	9	31.8 Å²	31.8	6%	0.055	16%	0.163	C	C	.	.			trans	-126.6	143.5	176.5	77.1	0	0	0	0	110.9	A212 R290 G294 L296 Q311 C312 T313	A212-V292 VanDerWaalsContact CB-C 3.49Å; R290-V292 PolarHBondContact O-N 2.86Å; V292-G294 VanDerWaalsContact C-N 3.32Å; V292-G294 WeakPolarHBondContact CG2-O 3.36Å; V292-L296 HydrophobicContact CG2-CD1 3.8Å; V292-L296 HydrophobicContact CG2-CD2 3.68Å; V292-L296 HydrophobicContact CG2-CG 3.62Å; V292-Q311 HydrophobicContact CB-CB 4.09Å; V292-Q311 HydrophobicContact CG1-CB 4.12Å; V292-Q311 HydrophobicContact CG2-CB 4.43Å; V292-C312 PolarHBondContact N-O 3.23Å; V292-T313 HydrophobicContact CG1-CG2 3.84Å
293	A	87.6	Confident	93.5	Very high	12 Å²	12	26.6 Å²	26.6	10%	0.099	14%	0.141	C	C	.	.	S	Bend	trans	-76.2	-19.4	-176.3	0	0	0	0	0	113.5	V182 A209 A212 F213	V182-A293 HydrophobicContact CG2-CB 4.28Å; A209-A293 HydrophobicContact CB-CB 3.85Å; A212-A293 HydrophobicContact CB-CB 4.14Å; F213-A293 HydrophobicContact CD2-CB 4.39Å; F213-A293 HydrophobicContact CE1-CB 3.98Å; F213-A293 HydrophobicContact CE2-CB 3.62Å; F213-A293 HydrophobicContact CZ-CB 3.37Å
294	G	85.7	Confident	93.5	Very high	3 Å²	3	18.6 Å²	18.6	3%	0.031	10%	0.104	C	C	.	.	S	Bend	trans	172.7	-161.4	-177.8	0	0	0	0	0	111.6	V292 L296	V292-G294 VanDerWaalsContact C-N 3.32Å; V292-G294 WeakPolarHBondContact CG2-O 3.36Å; G294-L296 PolarHBondContact O-N 3.09Å
295	L	82.4	Confident	93.5	Very high	61 Å²	61	13.3 Å²	13.3	32%	0.319	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	113	-174.5	-160.3	103.4	0	0	0	112	V182 T183 K184 F185 P328	V182-L295 CarbonylContact C-O 3.56Å; V182-L295 VanDerWaalsContact CA-O 3.28Å; V182-L295 WeakPolarHBondContact CA-O 3.31Å; T183-L295 PolarHBondContact N-O 3.47Å; T183-L295 PolarHBondContact OG1-O 2.84Å; K184-L295 HydrophobicContact CB-CD2 4.32Å; K184-L295 HydrophobicContact CD-CD2 4.28Å; K184-L295 HydrophobicContact CG-CD2 4.38Å; F185-L295 HydrophobicContact CD2-CB 4.27Å; F185-L295 HydrophobicContact CE2-CD1 4.4Å; L295-P328 HydrophobicContact CD1-CG 4.28Å
296	L	85.8	Confident	93.5	Very high	9 Å²	9	12.9 Å²	12.9	5%	0.047	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	168.4	176.3	-62.5	175.7	0	0	0	112.2	C178 L181 V182 V292 G294 D300 F301 Q311	C178-L296 WeakPolarHBondContact O-CD1 3.43Å; L181-L296 CarbonylContact O-C 3.6Å; L181-L296 VanDerWaalsContact O-CA 3.25Å; L181-L296 WeakPolarHBondContact O-CA 3.32Å; V182-L296 HydrophobicContact CG2-CD2 4.44Å; V292-L296 HydrophobicContact CG2-CD1 3.8Å; V292-L296 HydrophobicContact CG2-CD2 3.68Å; V292-L296 HydrophobicContact CG2-CG 3.62Å; G294-L296 PolarHBondContact O-N 3.09Å; L296-D300 HydrophobicContact CB-CB 4.36Å; L296-F301 HydrophobicContact CB-CB 4.25Å; L296-Q311 HydrophobicContact CD1-CB 4.09Å; L296-Q311 HydrophobicContact CD1-CG 3.64Å
297	S	86.2	Confident	93.6	Very high	18 Å²	18	11.9 Å²	11.9	13%	0.126	7%	0.069	C	C	.	.			trans	-57.3	144.6	162.3	77	0	0	0	0	109.9	L181 R299 D300 F301	L181-S297 PolarHBondContact O-N 3.24Å; L181-S297 VanDerWaalsContact O-N 3.08Å; S297-R299 PolarHBondContact O-N 3.46Å; S297-D300 PolarHBondContact O-N 2.64Å; S297-D300 VanDerWaalsContact O-N 3.14Å; S297-D300 WeakPolarHBondContact OG-CB 3.22Å; S297-D300 VanDerWaalsContact OG-CG 3.31Å; S297-D300 PolarHBondContact OG-N 3.45Å; S297-D300 PolarHBondContact OG-OD2 3.42Å; S297-D300 VanDerWaalsContact OG-OD2 3.13Å; S297-F301 PolarHBondContact O-N 3.12Å
298	A	90.1	Very high	93.6	Very high	37 Å²	37	14.7 Å²	14.7	31%	0.306	8%	0.079	S	C	.	.	H	α-helix	trans	-55.1	-39.8	178.3	0	0	0	0	0	111.4	F301 L302 I365	A298-F301 PolarHBondContact O-N 3.4Å; A298-L302 VanDerWaalsContact O-CB 3.25Å; A298-L302 WeakPolarHBondContact O-CB 3.4Å; A298-L302 WeakPolarHBondContact O-CG 3.18Å; A298-L302 PolarHBondContact O-N 3.07Å; A298-I365 HydrophobicContact CB-CG2 3.81Å
299	R	93	Very high	93.6	Very high	17 Å²	17	13.5 Å²	13.5	6%	0.064	7%	0.074	C	C	.	.	H	α-helix	trans	-59	-49.9	176.9	-178.1	175.4	-66.5	-75.4	2	112.3	H114 S297 A303 A360 D362 I365	H114-R299 PolarHBondContact CE1-NE 3.35Å; S297-R299 PolarHBondContact O-N 3.46Å; R299-A303 WeakPolarHBondContact O-CB 3.41Å; R299-A303 PolarHBondContact O-N 3.18Å; R299-A360 VanDerWaalsContact CZ-O 3.3Å; R299-A360 PolarHBondContact NH1-O 3.38Å; R299-A360 PolarHBondContact NH2-O 2.86Å; R299-D362 IonicContact CZ-OD1 2.73Å; R299-D362 IonicContact NE-OD1 3.39Å; R299-D362 IonicContact NH2-OD1 3.21Å; R299-D362 PolarHBondContact NH2-OD1 3.02Å; R299-I365 HydrophobicContact CB-CG1 4.46Å; R299-I365 HydrophobicContact CB-CG2 4.29Å
300	D	90.6	Very high	93.6	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-68	-41.9	-178.8	-77.9	-29.4	0	0	0	112.3	C178 L181 L296 S297 S304	C178-D300 HydrophobicContact CB-CB 3.93Å; C178-D300 WeakPolarHBondContact CB-OD1 3.34Å; C178-D300 WeakPolarHBondContact O-CB 3.41Å; C178-D300 PolarHBondContact SG-OD1 2.98Å; C178-D300 VanDerWaalsContact SG-OD1 3.38Å; L181-D300 WeakPolarHBondContact CD1-OD2 3.38Å; L296-D300 HydrophobicContact CB-CB 4.36Å; S297-D300 PolarHBondContact O-N 2.64Å; S297-D300 VanDerWaalsContact O-N 3.14Å; S297-D300 WeakPolarHBondContact OG-CB 3.22Å; S297-D300 VanDerWaalsContact OG-CG 3.31Å; S297-D300 PolarHBondContact OG-N 3.45Å; S297-D300 PolarHBondContact OG-OD2 3.42Å; S297-D300 VanDerWaalsContact OG-OD2 3.13Å; D300-S304 PolarHBondContact O-N 2.99Å; D300-S304 VanDerWaalsContact O-N 3.16Å; D300-S304 PolarHBondContact O-OG 2.95Å
301	F	94.9	Very high	93.5	Very high	35 Å²	35	13.6 Å²	13.6	15%	0.154	7%	0.074	C	C	.	.	H	α-helix	trans	-63.2	-52.8	177.7	179.7	-96.4	0	0	0	111.1	L296 S297 A298 A303 S304 L305 F310 Q311 Y372	L296-F301 HydrophobicContact CB-CB 4.25Å; S297-F301 PolarHBondContact O-N 3.12Å; A298-F301 PolarHBondContact O-N 3.4Å; F301-A303 VanDerWaalsContact C-N 3.33Å; F301-A303 PolarHBondContact O-N 3.13Å; F301-S304 VanDerWaalsContact O-CB 3.24Å; F301-S304 WeakPolarHBondContact O-CB 3.48Å; F301-S304 PolarHBondContact O-N 3.37Å; F301-L305 HydrophobicContact CE1-CD1 4.17Å; F301-L305 PolarHBondContact O-N 2.81Å; F301-F310 HydrophobicContact CE2-CE2 4.15Å; F301-F310 HydrophobicContact CZ-CD2 4.17Å; F301-F310 AromaticContact CZ-CE2 3.68Å; F301-F310 HydrophobicContact CZ-CE2 3.68Å; F301-F310 HydrophobicContact CZ-CZ 4.32Å; F301-Q311 HydrophobicContact CD2-CB 3.9Å; F301-Q311 HydrophobicContact CD2-CG 4.19Å; F301-Q311 HydrophobicContact CE2-CB 4.05Å; F301-Y372 AromaticContact CE1-CE1 3.93Å; F301-Y372 HydrophobicContact CE1-CE1 3.93Å; F301-Y372 AromaticContact CE1-CE2 3.81Å; F301-Y372 HydrophobicContact CE1-CE2 3.81Å; F301-Y372 AromaticContact CE1-CZ 3.48Å; F301-Y372 VanDerWaalsContact CE1-CZ 3.48Å; F301-Y372 WeakPolarHBondContact CE1-OH 3.43Å; F301-Y372 HydrophobicContact CZ-CE2 4.49Å; F301-Y372 AromaticContact CZ-CZ 3.93Å; F301-Y372 WeakPolarHBondContact CZ-OH 3.06Å
302	L	96.8	Very high	93.5	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-63.3	-39.1	179.8	-65	178.6	0	0	0	111.5	A298 S304 L305 I353 G354 L368 Y372	A298-L302 VanDerWaalsContact O-CB 3.25Å; A298-L302 WeakPolarHBondContact O-CB 3.4Å; A298-L302 WeakPolarHBondContact O-CG 3.18Å; A298-L302 PolarHBondContact O-N 3.07Å; L302-S304 PolarHBondContact O-N 3.02Å; L302-L305 HydrophobicContact CD2-CD1 3.98Å; L302-L305 WeakPolarHBondContact O-CB 3.28Å; L302-L305 PolarHBondContact O-N 2.65Å; L302-L305 VanDerWaalsContact O-N 3.07Å; L302-I353 HydrophobicContact CD2-CG2 3.82Å; L302-G354 WeakPolarHBondContact O-CA 3.07Å; L302-L368 HydrophobicContact CD1-CB 3.97Å; L302-Y372 HydrophobicContact CD2-CD2 4.01Å; L302-Y372 HydrophobicContact CD2-CG 4.19Å
303	A	96.6	Very high	93.7	Very high	4 Å²	4	13.2 Å²	13.2	3%	0.033	7%	0.072	C	C	.	.	H	α-helix	trans	-59	-34.2	175.1	0	0	0	0	0	112.3	P169 R299 F301 L305 A306 F307 S357 L358	P169-A303 HydrophobicContact CG-CB 4.14Å; R299-A303 WeakPolarHBondContact O-CB 3.41Å; R299-A303 PolarHBondContact O-N 3.18Å; F301-A303 VanDerWaalsContact C-N 3.33Å; F301-A303 PolarHBondContact O-N 3.13Å; A303-L305 VanDerWaalsContact C-N 3.31Å; A303-L305 PolarHBondContact O-N 2.88Å; A303-A306 VanDerWaalsContact O-CB 3.27Å; A303-A306 WeakPolarHBondContact O-CB 3.36Å; A303-A306 PolarHBondContact O-N 3.29Å; A303-F307 VanDerWaalsContact O-CD2 3.29Å; A303-F307 WeakPolarHBondContact O-CD2 3.41Å; A303-S357 PolarHBondContact N-OG 3.22Å; A303-L358 HydrophobicContact CB-CD2 3.82Å
304	S	97.6	Very high	94.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.4	-38.4	176.5	-55.2	0	0	0	0	111.9	D300 F301 L302 A306 F307 V309 Q311	D300-S304 PolarHBondContact O-N 2.99Å; D300-S304 VanDerWaalsContact O-N 3.16Å; D300-S304 PolarHBondContact O-OG 2.95Å; F301-S304 VanDerWaalsContact O-CB 3.24Å; F301-S304 WeakPolarHBondContact O-CB 3.48Å; F301-S304 PolarHBondContact O-N 3.37Å; L302-S304 PolarHBondContact O-N 3.02Å; S304-A306 PolarHBondContact O-N 3.25Å; S304-F307 PolarHBondContact O-N 2.99Å; S304-F307 VanDerWaalsContact O-N 3.07Å; S304-V309 CarbonylContact C-O 3.56Å; S304-V309 VanDerWaalsContact CB-O 3.3Å; S304-V309 WeakPolarHBondContact CB-O 3.36Å; S304-V309 PolarHBondContact O-N 2.96Å; S304-V309 VanDerWaalsContact O-O 3.1Å; S304-Q311 PolarHBondContact OG-NE2 2.85Å
305	L	98.5	Very high	94.7	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-61.8	-29	178.4	-56.2	179.6	0	0	0	112.5	F287 F301 L302 A303 F307 R308 V309 F310 Q351 Y372	F287-L305 HydrophobicContact CE1-CD2 4.3Å; F301-L305 HydrophobicContact CE1-CD1 4.17Å; F301-L305 PolarHBondContact O-N 2.81Å; L302-L305 HydrophobicContact CD2-CD1 3.98Å; L302-L305 WeakPolarHBondContact O-CB 3.28Å; L302-L305 PolarHBondContact O-N 2.65Å; L302-L305 VanDerWaalsContact O-N 3.07Å; A303-L305 VanDerWaalsContact C-N 3.31Å; A303-L305 PolarHBondContact O-N 2.88Å; L305-F307 PolarHBondContact O-N 3.39Å; L305-R308 PolarHBondContact O-N 3.12Å; L305-V309 PolarHBondContact N-O 2.93Å; L305-F310 HydrophobicContact CD2-CD2 4.05Å; L305-Q351 WeakPolarHBondContact O-CA 3.48Å; L305-Y372 HydrophobicContact CD1-CD2 4.07Å; L305-Y372 HydrophobicContact CD1-CE2 3.76Å
306	A	98.4	Very high	95.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.8	-30.9	177.4	0	0	0	0	0	112.4	A303 S304 R308 Q351 L355 L358 I468	A303-A306 VanDerWaalsContact O-CB 3.27Å; A303-A306 WeakPolarHBondContact O-CB 3.36Å; A303-A306 PolarHBondContact O-N 3.29Å; S304-A306 PolarHBondContact O-N 3.25Å; A306-R308 VanDerWaalsContact C-N 3.33Å; A306-Q351 PolarHBondContact O-NE2 3.05Å; A306-L355 HydrophobicContact CB-CD2 4.1Å; A306-L355 HydrophobicContact CB-CG 4.3Å; A306-L358 HydrophobicContact CB-CD1 3.81Å; A306-L358 HydrophobicContact CB-CD2 4.08Å; A306-L358 HydrophobicContact CB-CG 4.05Å; A306-I468 HydrophobicContact CB-CD1 4.38Å
307	F	98.5	Very high	95.7	Very high	7 Å²	7	10.4 Å²	10.4	3%	0.031	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	7.3	177.7	-61.5	-89.5	0	0	0	113.1	P169 K171 V172 L175 A303 S304 L305 V309 F461 I468	P169-F307 HydrophobicContact CB-CE2 4.18Å; P169-F307 HydrophobicContact CB-CZ 4.24Å; P169-F307 HydrophobicContact CG-CE2 3.84Å; P169-F307 HydrophobicContact CG-CZ 4.34Å; P169-F307 VanDerWaalsContact O-CZ 3.32Å; P169-F307 WeakPolarHBondContact O-CZ 3.47Å; K171-F307 VanDerWaalsContact C-CE1 3.49Å; V172-F307 HydrophobicContact CB-CB 4.43Å; V172-F307 HydrophobicContact CB-CD1 3.82Å; V172-F307 HydrophobicContact CB-CG 4.33Å; V172-F307 HydrophobicContact CG2-CB 4.1Å; V172-F307 HydrophobicContact CG2-CD1 4.39Å; V172-F307 HydrophobicContact CG2-CG 4.43Å; L175-F307 HydrophobicContact CD1-CB 4.26Å; L175-F307 HydrophobicContact CD1-CD2 4.17Å; L175-F307 HydrophobicContact CD1-CG 4.33Å; L175-F307 HydrophobicContact CD2-CD2 4.18Å; L175-F307 HydrophobicContact CD2-CE2 4.37Å; L175-F307 HydrophobicContact CG-CD2 4.4Å; A303-F307 VanDerWaalsContact O-CD2 3.29Å; A303-F307 WeakPolarHBondContact O-CD2 3.41Å; S304-F307 PolarHBondContact O-N 2.99Å; S304-F307 VanDerWaalsContact O-N 3.07Å; L305-F307 PolarHBondContact O-N 3.39Å; F307-V309 HydrophobicContact CB-CG2 3.99Å; F307-V309 PolarHBondContact O-N 3.25Å; F307-F461 HydrophobicContact CB-CE2 4.38Å; F307-F461 HydrophobicContact CD1-CD2 4.22Å; F307-F461 AromaticContact CD1-CE2 3.88Å; F307-F461 HydrophobicContact CD1-CE2 3.88Å; F307-I468 HydrophobicContact CE1-CD1 4.14Å; F307-I468 HydrophobicContact CE1-CG1 3.65Å; F307-I468 HydrophobicContact CE2-CG1 4.13Å; F307-I468 HydrophobicContact CZ-CD1 4.06Å; F307-I468 HydrophobicContact CZ-CG1 3.37Å
308	R	98.6	Very high	96.1	Very high	60 Å²	60	11.1 Å²	11.1	23%	0.226	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	38.9	-166.9	-56.5	-168.3	173.9	171.5	1.9	111.8	T285 F287 Q288 L305 A306 Q351	T285-R308 WeakPolarHBondContact O-CD 3.2Å; T285-R308 PolarHBondContact O-NH1 3.42Å; F287-R308 CarbonylContact C-O 3.58Å; F287-R308 WeakPolarHBondContact CA-O 3.36Å; F287-R308 HydrophobicContact CB-CB 4.44Å; F287-R308 HydrophobicContact CD1-CB 4.17Å; F287-R308 WeakPolarHBondContact CD1-O 3.42Å; F287-R308 HydrophobicContact CD2-CB 3.52Å; F287-R308 HydrophobicContact CD2-CG 3.81Å; F287-R308 HydrophobicContact CE1-CB 4.29Å; F287-R308 HydrophobicContact CE2-CB 3.63Å; F287-R308 HydrophobicContact CE2-CG 3.59Å; F287-R308 HydrophobicContact CG-CB 3.81Å; F287-R308 HydrophobicContact CZ-CB 4.04Å; F287-R308 HydrophobicContact CZ-CG 4.22Å; Q288-R308 PolarHBondContact N-O 3.44Å; L305-R308 PolarHBondContact O-N 3.12Å; A306-R308 VanDerWaalsContact C-N 3.33Å; R308-Q351 HydrophobicContact CG-CB 4.32Å; R308-Q351 HydrophobicContact CG-CG 4.15Å; R308-Q351 VanDerWaalsContact CZ-OE1 3.31Å
309	V	98.6	Very high	96.3	Very high	2 Å²	2	11 Å²	11	1%	0.012	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.4	174.3	176.8	0	0	0	0	108.4	V172 L175 Q288 R290 S304 L305 F307	V172-V309 HydrophobicContact CG2-CG2 3.79Å; L175-V309 HydrophobicContact CD1-CB 3.73Å; L175-V309 HydrophobicContact CD1-CG1 3.92Å; L175-V309 HydrophobicContact CD1-CG2 3.82Å; Q288-V309 WeakPolarHBondContact O-CA 3.36Å; R290-V309 HydrophobicContact CB-CG1 3.65Å; S304-V309 CarbonylContact C-O 3.56Å; S304-V309 VanDerWaalsContact CB-O 3.3Å; S304-V309 WeakPolarHBondContact CB-O 3.36Å; S304-V309 PolarHBondContact O-N 2.96Å; S304-V309 VanDerWaalsContact O-O 3.1Å; L305-V309 PolarHBondContact N-O 2.93Å; F307-V309 HydrophobicContact CB-CG2 3.99Å; F307-V309 PolarHBondContact O-N 3.25Å
310	F	98.4	Very high	96.2	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.009	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.3	175	-174.9	-94.9	0	0	0	109.6	F287 Q288 L289 R290 F301 L305 C312 E333 H337 L341	F287-F310 HydrophobicContact CD1-CB 4.25Å; F287-F310 HydrophobicContact CE1-CB 4.46Å; Q288-F310 PolarHBondContact O-N 2.97Å; L289-F310 CarbonylContact C-O 3.53Å; L289-F310 WeakPolarHBondContact CA-O 3.47Å; L289-F310 HydrophobicContact CD2-CB 4.07Å; L289-F310 HydrophobicContact CD2-CD1 3.99Å; L289-F310 HydrophobicContact CD2-CG 4.48Å; R290-F310 PolarHBondContact N-O 3.35Å; F301-F310 HydrophobicContact CE2-CE2 4.15Å; F301-F310 HydrophobicContact CZ-CD2 4.17Å; F301-F310 AromaticContact CZ-CE2 3.68Å; F301-F310 HydrophobicContact CZ-CE2 3.68Å; F301-F310 HydrophobicContact CZ-CZ 4.32Å; L305-F310 HydrophobicContact CD2-CD2 4.05Å; F310-C312 HydrophobicContact CD1-CB 4.05Å; F310-C312 HydrophobicContact CE1-CB 4.24Å; F310-C312 PolarHBondContact O-N 3.23Å; F310-E333 WeakPolarHBondContact CE1-OE2 3.32Å; F310-E333 VanDerWaalsContact CZ-OE2 3.28Å; F310-E333 WeakPolarHBondContact CZ-OE2 3.29Å; F310-H337 HydrophobicContact CE1-CB 4.06Å; F310-H337 HydrophobicContact CE2-CB 4.13Å; F310-H337 AromaticContact CE2-CG 3.74Å; F310-H337 AromaticContact CE2-ND1 3.76Å; F310-H337 HydrophobicContact CZ-CB 3.72Å; F310-H337 AromaticContact CZ-CD2 3.36Å; F310-H337 WeakPolarHBondContact CZ-CD2 3.44Å; F310-H337 AromaticContact CZ-CG 3.37Å; F310-H337 AromaticContact CZ-ND1 3.85Å; F310-H337 AromaticContact CZ-NE2 3.83Å; F310-L341 HydrophobicContact CB-CD1 3.75Å; F310-L341 HydrophobicContact CD1-CD1 4.25Å; F310-L341 HydrophobicContact CD2-CD1 3.81Å; F310-L341 HydrophobicContact CG-CD1 3.66Å
311	Q	96.4	Very high	96	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.009	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	117.6	178.8	-59.9	-80.3	5.2	0	0	107.7	R290 V292 L296 F301 S304	R290-Q311 WeakPolarHBondContact O-CA 3.43Å; V292-Q311 HydrophobicContact CB-CB 4.09Å; V292-Q311 HydrophobicContact CG1-CB 4.12Å; V292-Q311 HydrophobicContact CG2-CB 4.43Å; L296-Q311 HydrophobicContact CD1-CB 4.09Å; L296-Q311 HydrophobicContact CD1-CG 3.64Å; F301-Q311 HydrophobicContact CD2-CB 3.9Å; F301-Q311 HydrophobicContact CD2-CG 4.19Å; F301-Q311 HydrophobicContact CE2-CB 4.05Å; S304-Q311 PolarHBondContact OG-NE2 2.85Å
312	C	96.7	Very high	95.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.5	-166.3	-176.2	0	0	0	0	110	L274 L289 R290 P291 V292 F310 E333	L274-C312 HydrophobicContact CD1-CB 3.97Å; L274-C312 VanDerWaalsContact CD2-SG 3.53Å; L289-C312 HydrophobicContact CB-CB 4.38Å; L289-C312 HydrophobicContact CD2-CB 4.4Å; R290-C312 PolarHBondContact O-N 2.93Å; P291-C312 WeakPolarHBondContact CA-O 3.47Å; V292-C312 PolarHBondContact N-O 3.23Å; F310-C312 HydrophobicContact CD1-CB 4.05Å; F310-C312 HydrophobicContact CE1-CB 4.24Å; F310-C312 PolarHBondContact O-N 3.23Å; C312-E333 WeakPolarHBondContact SG-CB 3.35Å
313	T	96.1	Very high	94.8	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.104	C	C	.	.			trans	-73.2	155.1	174.2	64.7	0	0	0	0	111.1	V292 Y315 P328	V292-T313 HydrophobicContact CG1-CG2 3.84Å; T313-Y315 HydrophobicContact CG2-CD1 4.41Å; T313-Y315 HydrophobicContact CG2-CE1 3.63Å; T313-P328 WeakPolarHBondContact CB-O 3.32Å; T313-P328 VanDerWaalsContact CG2-O 3.28Å; T313-P328 WeakPolarHBondContact CG2-O 3.48Å; T313-P328 PolarHBondContact OG1-O 2.89Å
314	Q	97.4	Very high	93.7	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.014	13%	0.127	C	C	.	.			trans	-112.4	-12.2	177.4	-74.7	-173	-83.8	0	0	113.6	I208 P222 V224 Y226 L274	I208-Q314 HydrophobicContact CG2-CB 3.54Å; P222-Q314 PolarHBondContact O-NE2 3.36Å; P222-Q314 VanDerWaalsContact O-NE2 3.08Å; V224-Q314 HydrophobicContact CG2-CB 4.23Å; Y226-Q314 VanDerWaalsContact CE1-O 3.3Å; Y226-Q314 WeakPolarHBondContact CE1-O 3.33Å; Y226-Q314 PolarHBondContact OH-O 3.19Å; L274-Q314 HydrophobicContact CD1-CG 3.29Å; L274-Q314 HydrophobicContact CG-CG 3.72Å
315	Y	96.4	Very high	92.7	Very high	5 Å²	5	24.8 Å²	24.8	2%	0.02	14%	0.137	C	C	.	.			trans	-81.4	155.1	179	62.9	-97.7	0	0	0	110.5	R205 T313 E327 D329 C330	R205-Y315 VanDerWaalsContact CD-CB 3.49Å; R205-Y315 VanDerWaalsContact CD-CG 3.41Å; R205-Y315 PolarHBondContact NH2-OH 2.94Å; T313-Y315 HydrophobicContact CG2-CD1 4.41Å; T313-Y315 HydrophobicContact CG2-CE1 3.63Å; Y315-E327 HydrophobicContact CE2-CB 4.41Å; Y315-E327 VanDerWaalsContact CE2-OE2 3.23Å; Y315-E327 WeakPolarHBondContact CE2-OE2 3.46Å; Y315-E327 PolarHBondContact OH-OE2 2.82Å; Y315-D329 HydrophobicContact CD2-CB 4.15Å; Y315-D329 HydrophobicContact CE2-CB 4.03Å; Y315-C330 WeakPolarHBondContact O-CB 3.48Å; Y315-C330 PolarHBondContact O-N 3.39Å
316	I	96.4	Very high	91.3	Very high	5 Å²	5	27 Å²	27	3%	0.026	15%	0.152	C	C	.	.			trans	-105.4	151.3	174.3	-166	158.2	0	0	0	110.3	Y201 E230 T233 W234 I271	Y201-I316 WeakPolarHBondContact CE2-O 3.33Å; Y201-I316 PolarHBondContact OH-O 3.36Å; E230-I316 HydrophobicContact CB-CG2 3.71Å; E230-I316 HydrophobicContact CG-CG2 3.53Å; E230-I316 VanDerWaalsContact O-CD1 3.32Å; E230-I316 WeakPolarHBondContact O-CD1 3.32Å; T233-I316 HydrophobicContact CG2-CD1 4.15Å; T233-I316 HydrophobicContact CG2-CG1 4.18Å; W234-I316 HydrophobicContact CB-CD1 3.75Å; I271-I316 HydrophobicContact CD1-CD1 3.86Å
317	R	94.1	Very high	90.5	Very high	14 Å²	14	27.3 Å²	27.3	5%	0.053	15%	0.153	C	C	.	.			trans	-55.4	157.3	173.4	66.8	-169.2	66.6	-178.8	-7	112.2	T233 P322 D329	T233-R317 HydrophobicContact CG2-CG 3.84Å; R317-P322 WeakPolarHBondContact CD-O 3.5Å; R317-P322 PolarHBondContact NH1-O 2.91Å; R317-D329 HydrophobicContact CB-CB 4.26Å; R317-D329 VanDerWaalsContact CB-OD2 3.32Å; R317-D329 WeakPolarHBondContact CB-OD2 3.27Å; R317-D329 WeakPolarHBondContact CG-OD2 3.32Å; R317-D329 IonicContact CZ-OD1 2.76Å; R317-D329 IonicContact CZ-OD2 2.94Å; R317-D329 PolarHBondContact N-OD2 3.39Å; R317-D329 IonicContact NE-OD1 3.52Å; R317-D329 PolarHBondContact NE-OD1 3.39Å; R317-D329 IonicContact NE-OD2 2.64Å; R317-D329 PolarHBondContact NE-OD2 2.9Å; R317-D329 IonicContact NH2-OD1 3.66Å; R317-D329 PolarHBondContact NH2-OD1 2.95Å; R317-D329 IonicContact NH2-OD2 3.53Å
318	H	94.6	Very high	90	Very high	32 Å²	32	28.2 Å²	28.2	15%	0.148	16%	0.16	C	C	.	.			trans	-66.8	137.6	179.9	-170.6	-96.7	0	0	0	112.1	P194 D198 Y201 S320 S321	P194-H318 HydrophobicContact CB-CB 4.24Å; P194-H318 HydrophobicContact CG-CB 4.06Å; D198-H318 IonicContact OD2-NE2 2.74Å; D198-H318 PolarHBondContact OD2-NE2 3.09Å; Y201-H318 HydrophobicContact CD2-CB 4.43Å; Y201-H318 AromaticContact CD2-CD2 3.7Å; Y201-H318 HydrophobicContact CE2-CB 4.06Å; Y201-H318 AromaticContact CG-CD2 3.75Å; H318-S320 PolarHBondContact CE1-OG 3.49Å; H318-S320 WeakPolarHBondContact ND1-CB 3.44Å; H318-S320 PolarHBondContact ND1-N 3.22Å; H318-S320 PolarHBondContact ND1-OG 2.9Å; H318-S320 PolarHBondContact O-N 3.14Å; H318-S320 VanDerWaalsContact O-N 3.09Å; H318-S321 PolarHBondContact O-N 2.97Å; H318-S321 VanDerWaalsContact O-N 3.08Å
319	A	93.6	Very high	89.8	Confident	36 Å²	36	25.3 Å²	25.3	30%	0.298	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.9	-172.9	0	0	0	0	0	114.8	E229 T233 S321	E229-A319 HydrophobicContact CG-CB 3.93Å; T233-A319 WeakPolarHBondContact OG1-CB 3.46Å; A319-S321 PolarHBondContact O-N 3.38Å
320	S	91.1	Very high	89.7	Confident	77 Å²	77	25.2 Å²	25.2	54%	0.538	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.8	175.1	69.4	0	0	0	0	113.9	H318	H318-S320 PolarHBondContact CE1-OG 3.49Å; H318-S320 WeakPolarHBondContact ND1-CB 3.44Å; H318-S320 PolarHBondContact ND1-N 3.22Å; H318-S320 PolarHBondContact ND1-OG 2.9Å; H318-S320 PolarHBondContact O-N 3.14Å; H318-S320 VanDerWaalsContact O-N 3.09Å
321	S	86.4	Confident	89.7	Confident	42 Å²	42	25.1 Å²	25.1	29%	0.294	15%	0.148	S	C	.	.			trans	-140.7	59.5	-173.2	-57.1	0	0	0	0	110.8	H318 A319 M323 H324	H318-S321 PolarHBondContact O-N 2.97Å; H318-S321 VanDerWaalsContact O-N 3.08Å; A319-S321 PolarHBondContact O-N 3.38Å; S321-M323 PolarHBondContact O-N 3.44Å; S321-H324 PolarHBondContact O-N 3.4Å
322	P	85.1	Confident	89.7	Confident	16 Å²	16	26 Å²	26	10%	0.104	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.6	-175	25.3	-33.2	0	0	0	112.4	T233 E236 V237 R317	T233-P322 HydrophobicContact CG2-CB 4.21Å; E236-P322 VanDerWaalsContact CD-CG 3.47Å; E236-P322 HydrophobicContact CG-CB 4.4Å; E236-P322 HydrophobicContact CG-CG 4.5Å; E236-P322 WeakPolarHBondContact OE1-CG 3.44Å; E236-P322 WeakPolarHBondContact OE2-CG 3.39Å; V237-P322 HydrophobicContact CG2-CB 4.36Å; V237-P322 WeakPolarHBondContact CG2-O 3.32Å; R317-P322 WeakPolarHBondContact CD-O 3.5Å; R317-P322 PolarHBondContact NH1-O 2.91Å
323	M	81.7	Confident	89.8	Confident	70 Å²	70	26.5 Å²	26.5	35%	0.345	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-2.6	-175	-59.2	-57.1	-79.4	0	0	114.5	T240 S321 Y398	T240-M323 HydrophobicContact CG2-CE 3.6Å; S321-M323 PolarHBondContact O-N 3.44Å; M323-Y398 VanDerWaalsContact CE-CB 3.4Å; M323-Y398 HydrophobicContact CE-CD1 3.92Å; M323-Y398 HydrophobicContact CE-CD2 4.36Å; M323-Y398 HydrophobicContact CE-CG 3.64Å
324	H	73	Confident	89.9	Confident	115 Å²	115	26.4 Å²	26.4	53%	0.532	15%	0.154	S	C	.	.			trans	-145.3	126.6	-180	175.4	75.3	0	0	0	110.4	S321	S321-H324 PolarHBondContact O-N 3.4Å
325	S	76.6	Confident	89.9	Confident	30 Å²	30	26.3 Å²	26.3	21%	0.21	15%	0.153	C	C	.	.			trans	-133.2	125.3	173	-172.3	0	0	0	0	108.4	E327	S325-E327 WeakPolarHBondContact CB-O 3.38Å; S325-E327 PolarHBondContact O-N 3.09Å; S325-E327 PolarHBondContact OG-N 3.08Å; S325-E327 PolarHBondContact OG-O 2.68Å
326	P	69.6	Low	90	Very high	49 Å²	49	26 Å²	26	32%	0.318	15%	0.152	S	C	.	.	S	Bend	trans	-73	-10.5	169.9	30.4	-32.8	0	0	0	112	F185	F185-P326 HydrophobicContact CE1-CB 4.21Å; F185-P326 WeakPolarHBondContact CE1-O 3.42Å; F185-P326 VanDerWaalsContact CZ-O 3.25Å; F185-P326 WeakPolarHBondContact CZ-O 3.25Å
327	E	80.4	Confident	90.1	Very high	6 Å²	6	26 Å²	26	3%	0.028	15%	0.152	C	C	.	.	S	Bend	trans	-115.3	147.3	-176.5	-40	-174.1	154.7	0	0	111.4	F185 H193 R205 Y315 S325 D329	F185-E327 HydrophobicContact CB-CB 4.32Å; F185-E327 HydrophobicContact CB-CG 3.68Å; F185-E327 VanDerWaalsContact CB-OE1 3.31Å; F185-E327 WeakPolarHBondContact CB-OE1 3.45Å; F185-E327 HydrophobicContact CD1-CG 3.86Å; F185-E327 HydrophobicContact CG-CB 4.34Å; F185-E327 HydrophobicContact CG-CG 3.79Å; F185-E327 VanDerWaalsContact O-OE1 3.08Å; H193-E327 IonicContact CD2-OE1 3.39Å; H193-E327 PolarHBondContact CD2-OE1 3.3Å; H193-E327 IonicContact NE2-OE1 2.96Å; H193-E327 PolarHBondContact NE2-OE1 3.39Å; H193-E327 IonicContact NE2-OE2 2.81Å; R205-E327 IonicContact CZ-OE2 2.73Å; R205-E327 IonicContact NH1-OE1 3.26Å; R205-E327 PolarHBondContact NH1-OE1 3.29Å; R205-E327 IonicContact NH1-OE2 3.31Å; R205-E327 PolarHBondContact NH1-OE2 3.49Å; R205-E327 IonicContact NH2-OE1 2.76Å; R205-E327 IonicContact NH2-OE2 3.44Å; R205-E327 PolarHBondContact NH2-OE2 2.79Å; R205-E327 VanDerWaalsContact NH2-OE2 3.11Å; Y315-E327 HydrophobicContact CE2-CB 4.41Å; Y315-E327 VanDerWaalsContact CE2-OE2 3.23Å; Y315-E327 WeakPolarHBondContact CE2-OE2 3.46Å; Y315-E327 PolarHBondContact OH-OE2 2.82Å; S325-E327 WeakPolarHBondContact CB-O 3.38Å; S325-E327 PolarHBondContact O-N 3.09Å; S325-E327 PolarHBondContact OG-N 3.08Å; S325-E327 PolarHBondContact OG-O 2.68Å; E327-D329 VanDerWaalsContact C-N 3.34Å; E327-D329 PolarHBondContact O-N 3.25Å
328	P	88.1	Confident	90.4	Very high	25 Å²	25	25.4 Å²	25.4	16%	0.162	15%	0.15	C	C	.	.			trans	-74.4	86	172.7	32.1	-34.4	0	0	0	109.8	L295 T313 H332	L295-P328 HydrophobicContact CD1-CG 4.28Å; T313-P328 WeakPolarHBondContact CB-O 3.32Å; T313-P328 VanDerWaalsContact CG2-O 3.28Å; T313-P328 WeakPolarHBondContact CG2-O 3.48Å; T313-P328 PolarHBondContact OG1-O 2.89Å; P328-H332 VanDerWaalsContact CB-CD2 3.46Å; P328-H332 WeakPolarHBondContact CB-CD2 3.4Å
329	D	94.9	Very high	90.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.142	C	C	.	.			trans	-80.6	173.5	175	78.4	-42.5	0	0	0	111.7	Y315 R317 E327 C331 H332 E333	Y315-D329 HydrophobicContact CD2-CB 4.15Å; Y315-D329 HydrophobicContact CE2-CB 4.03Å; R317-D329 HydrophobicContact CB-CB 4.26Å; R317-D329 VanDerWaalsContact CB-OD2 3.32Å; R317-D329 WeakPolarHBondContact CB-OD2 3.27Å; R317-D329 WeakPolarHBondContact CG-OD2 3.32Å; R317-D329 IonicContact CZ-OD1 2.76Å; R317-D329 IonicContact CZ-OD2 2.94Å; R317-D329 PolarHBondContact N-OD2 3.39Å; R317-D329 IonicContact NE-OD1 3.52Å; R317-D329 PolarHBondContact NE-OD1 3.39Å; R317-D329 IonicContact NE-OD2 2.64Å; R317-D329 PolarHBondContact NE-OD2 2.9Å; R317-D329 IonicContact NH2-OD1 3.66Å; R317-D329 PolarHBondContact NH2-OD1 2.95Å; R317-D329 IonicContact NH2-OD2 3.53Å; E327-D329 VanDerWaalsContact C-N 3.34Å; E327-D329 PolarHBondContact O-N 3.25Å; D329-C331 PolarHBondContact O-N 3.21Å; D329-H332 WeakPolarHBondContact O-CA 3.23Å; D329-H332 WeakPolarHBondContact O-CB 3.46Å; D329-H332 PolarHBondContact O-N 3Å; D329-H332 PolarHBondContact OD1-N 2.94Å; D329-E333 WeakPolarHBondContact O-CG 3.42Å; D329-E333 PolarHBondContact O-N 2.85Å; D329-E333 VanDerWaalsContact O-N 3.16Å
330	C	96.9	Very high	90.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59	-25.1	-176.6	69.1	0	0	0	0	113.7	Y315 L334	Y315-C330 WeakPolarHBondContact O-CB 3.48Å; Y315-C330 PolarHBondContact O-N 3.39Å; C330-L334 HydrophobicContact CB-CD1 4.26Å; C330-L334 WeakPolarHBondContact O-CB 3.37Å; C330-L334 WeakPolarHBondContact O-CG 3.39Å; C330-L334 PolarHBondContact O-N 3.5Å
331	C	97.6	Very high	91.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-47.5	170.4	-68.1	0	0	0	0	111.6	V237 D329 L335	V237-C331 HydrophobicContact CG1-CB 4.09Å; D329-C331 PolarHBondContact O-N 3.21Å; C331-L335 HydrophobicContact CB-CD1 4.49Å; C331-L335 WeakPolarHBondContact O-CB 3.4Å; C331-L335 WeakPolarHBondContact O-CG 3.4Å; C331-L335 PolarHBondContact O-N 3.12Å
332	H	97.4	Very high	91.7	Very high	21 Å²	21	16.9 Å²	16.9	10%	0.097	9%	0.091	C	C	.	.	H	α-helix	trans	-59.5	-49	176.6	174.5	82.8	0	0	0	111.9	P328 D329 G336 H337 E377 S396	P328-H332 VanDerWaalsContact CB-CD2 3.46Å; P328-H332 WeakPolarHBondContact CB-CD2 3.4Å; D329-H332 WeakPolarHBondContact O-CA 3.23Å; D329-H332 WeakPolarHBondContact O-CB 3.46Å; D329-H332 PolarHBondContact O-N 3Å; D329-H332 PolarHBondContact OD1-N 2.94Å; H332-G336 VanDerWaalsContact O-CA 3.3Å; H332-G336 WeakPolarHBondContact O-CA 3.37Å; H332-G336 PolarHBondContact O-N 3.41Å; H332-H337 AromaticContact CD2-CD2 3.85Å; H332-H337 AromaticContact CD2-NE2 3.88Å; H332-H337 AromaticContact CE1-NE2 3.97Å; H332-H337 AromaticContact NE2-CD2 3.6Å; H332-H337 AromaticContact NE2-NE2 3.17Å; H332-H337 PolarHBondContact NE2-NE2 2.88Å; H332-H337 VanDerWaalsContact NE2-NE2 3.17Å; H332-E377 IonicContact CE1-OE2 3.6Å; H332-E377 PolarHBondContact CE1-OE2 2.89Å; H332-E377 VanDerWaalsContact CE1-OE2 3.31Å; H332-E377 IonicContact NE2-OE2 2.79Å; H332-E377 PolarHBondContact NE2-OE2 3.39Å; H332-S396 PolarHBondContact ND1-OG 3.46Å
333	E	98	Very high	92.4	Very high	9 Å²	9	18 Å²	18	4%	0.042	10%	0.097	C	C	.	.	I	π-helix	trans	-64.7	-51.3	-177.7	-48	-63.7	-168	0	0	112.3	F310 C312 D329 H337 V338	F310-E333 WeakPolarHBondContact CE1-OE2 3.32Å; F310-E333 VanDerWaalsContact CZ-OE2 3.28Å; F310-E333 WeakPolarHBondContact CZ-OE2 3.29Å; C312-E333 WeakPolarHBondContact SG-CB 3.35Å; D329-E333 WeakPolarHBondContact O-CG 3.42Å; D329-E333 PolarHBondContact O-N 2.85Å; D329-E333 VanDerWaalsContact O-N 3.16Å; E333-H337 WeakPolarHBondContact O-CB 3.47Å; E333-H337 PolarHBondContact O-N 2.89Å; E333-H337 IonicContact OE2-CD2 3.12Å; E333-H337 PolarHBondContact OE2-CD2 3.36Å; E333-H337 VanDerWaalsContact OE2-CD2 3.29Å; E333-V338 WeakPolarHBondContact O-CG2 3.44Å; E333-V338 PolarHBondContact O-N 3.16Å
334	L	98.6	Very high	93.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	I	π-helix	trans	-76.2	-34.8	-171.4	-65.4	174.1	0	0	0	112.3	W234 Y266 I271 P272 L274 V277 C330 V338 P339	W234-L334 HydrophobicContact CH2-CB 3.99Å; W234-L334 HydrophobicContact CH2-CD1 4.12Å; W234-L334 HydrophobicContact CZ3-CB 4.09Å; W234-L334 HydrophobicContact CZ3-CD1 3.99Å; Y266-L334 HydrophobicContact CE1-CB 4.38Å; Y266-L334 WeakPolarHBondContact CE1-O 3.31Å; Y266-L334 WeakPolarHBondContact OH-CA 3.34Å; Y266-L334 WeakPolarHBondContact OH-CB 3.49Å; Y266-L334 PolarHBondContact OH-O 2.94Å; I271-L334 HydrophobicContact CG2-CD1 4.2Å; P272-L334 HydrophobicContact CB-CD1 4.13Å; P272-L334 HydrophobicContact CG-CD1 4.2Å; L274-L334 HydrophobicContact CD2-CD2 3.87Å; V277-L334 HydrophobicContact CG2-CD2 4.27Å; C330-L334 HydrophobicContact CB-CD1 4.26Å; C330-L334 WeakPolarHBondContact O-CB 3.37Å; C330-L334 WeakPolarHBondContact O-CG 3.39Å; C330-L334 PolarHBondContact O-N 3.5Å; L334-V338 HydrophobicContact CD2-CG2 4.18Å; L334-P339 WeakPolarHBondContact O-CD 3.35Å
335	L	98.4	Very high	94.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.104	C	C	.	.	I	π-helix	trans	-93.4	-29.6	-176.9	-56.4	177.1	0	0	0	112.9	W234 V237 Y238 L241 H253 F257 Y266 C331	W234-L335 HydrophobicContact CH2-CD1 4.36Å; W234-L335 HydrophobicContact CH2-CD2 3.56Å; W234-L335 HydrophobicContact CH2-CG 3.87Å; W234-L335 HydrophobicContact CZ2-CD2 4.07Å; W234-L335 HydrophobicContact CZ3-CD1 4.24Å; W234-L335 HydrophobicContact CZ3-CD2 4.21Å; W234-L335 HydrophobicContact CZ3-CG 4.01Å; V237-L335 HydrophobicContact CG1-CD1 3.98Å; Y238-L335 HydrophobicContact CD2-CD2 3.76Å; Y238-L335 HydrophobicContact CE2-CD2 4.13Å; L241-L335 HydrophobicContact CD1-CD1 3.89Å; H253-L335 PolarHBondContact NE2-O 3.12Å; F257-L335 HydrophobicContact CE2-CD2 3.82Å; F257-L335 HydrophobicContact CZ-CD2 4.19Å; Y266-L335 HydrophobicContact CD1-CD2 4.35Å; Y266-L335 HydrophobicContact CE1-CD2 4.2Å; C331-L335 HydrophobicContact CB-CD1 4.49Å; C331-L335 WeakPolarHBondContact O-CB 3.4Å; C331-L335 WeakPolarHBondContact O-CG 3.4Å; C331-L335 PolarHBondContact O-N 3.12Å
336	G	98	Very high	95.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.094	C	C	.	.	I	π-helix	trans	-90.6	-68.1	179.2	0	0	0	0	0	113	H332	H332-G336 VanDerWaalsContact O-CA 3.3Å; H332-G336 WeakPolarHBondContact O-CA 3.37Å; H332-G336 PolarHBondContact O-N 3.41Å
337	H	98.7	Very high	96.7	Very high	5 Å²	5	17.1 Å²	17.1	2%	0.023	8%	0.079	C	C	.	.	I	π-helix	trans	-74.5	-50.7	-170.6	-73.6	-70.7	0	0	0	114.1	F310 H332 E333 M340 L341 Y372 E377 A392	F310-H337 HydrophobicContact CE1-CB 4.06Å; F310-H337 HydrophobicContact CE2-CB 4.13Å; F310-H337 AromaticContact CE2-CG 3.74Å; F310-H337 AromaticContact CE2-ND1 3.76Å; F310-H337 HydrophobicContact CZ-CB 3.72Å; F310-H337 AromaticContact CZ-CD2 3.36Å; F310-H337 WeakPolarHBondContact CZ-CD2 3.44Å; F310-H337 AromaticContact CZ-CG 3.37Å; F310-H337 AromaticContact CZ-ND1 3.85Å; F310-H337 AromaticContact CZ-NE2 3.83Å; H332-H337 AromaticContact CD2-CD2 3.85Å; H332-H337 AromaticContact CD2-NE2 3.88Å; H332-H337 AromaticContact CE1-NE2 3.97Å; H332-H337 AromaticContact NE2-CD2 3.6Å; H332-H337 AromaticContact NE2-NE2 3.17Å; H332-H337 PolarHBondContact NE2-NE2 2.88Å; H332-H337 VanDerWaalsContact NE2-NE2 3.17Å; E333-H337 WeakPolarHBondContact O-CB 3.47Å; E333-H337 PolarHBondContact O-N 2.89Å; E333-H337 IonicContact OE2-CD2 3.12Å; E333-H337 PolarHBondContact OE2-CD2 3.36Å; E333-H337 VanDerWaalsContact OE2-CD2 3.29Å; H337-M340 PolarHBondContact O-N 2.82Å; H337-L341 HydrophobicContact CB-CD1 4.47Å; H337-L341 PolarHBondContact O-N 3.44Å; H337-Y372 PolarHBondContact CE1-OH 2.76Å; H337-E377 IonicContact CE1-OE1 3.73Å; H337-E377 PolarHBondContact CE1-OE1 3.37Å; H337-E377 IonicContact CE1-OE2 3.57Å; H337-E377 IonicContact NE2-OE1 3.9Å; H337-E377 PolarHBondContact NE2-OE1 3.37Å; H337-E377 VanDerWaalsContact NE2-OE1 3.13Å; H337-E377 IonicContact NE2-OE2 3.53Å; H337-A392 HydrophobicContact CB-CB 4.39Å; H337-A392 VanDerWaalsContact CD2-CB 3.47Å; H337-A392 WeakPolarHBondContact CD2-CB 3.45Å; H337-A392 WeakPolarHBondContact CE1-CB 3.29Å; H337-A392 WeakPolarHBondContact ND1-CB 3.47Å; H337-A392 VanDerWaalsContact NE2-CB 3.33Å; H337-A392 WeakPolarHBondContact NE2-CB 3.19Å
338	V	98.8	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-54.6	-45.7	-169.9	166.3	0	0	0	0	113.4	L260 Y266 V277 L281 L289 E333 L334 M340 L341 A342	L260-V338 HydrophobicContact CD1-CG1 3.86Å; L260-V338 HydrophobicContact CD2-CG1 3.83Å; Y266-V338 WeakPolarHBondContact OH-CG1 3.46Å; V277-V338 HydrophobicContact CG1-CB 4.35Å; V277-V338 HydrophobicContact CG1-CG1 3.41Å; V277-V338 VanDerWaalsContact CG1-CG1 3.41Å; V277-V338 HydrophobicContact CG1-CG2 3.96Å; L281-V338 HydrophobicContact CD1-CG1 4.29Å; L281-V338 HydrophobicContact CD1-CG2 4.43Å; L281-V338 HydrophobicContact CD2-CG1 4.4Å; L281-V338 HydrophobicContact CG-CG1 4.5Å; L289-V338 HydrophobicContact CD1-CG2 4.29Å; L289-V338 HydrophobicContact CD2-CG2 4.32Å; E333-V338 WeakPolarHBondContact O-CG2 3.44Å; E333-V338 PolarHBondContact O-N 3.16Å; L334-V338 HydrophobicContact CD2-CG2 4.18Å; V338-M340 VanDerWaalsContact C-N 3.28Å; V338-M340 PolarHBondContact O-N 2.78Å; V338-L341 PolarHBondContact O-N 3.04Å; V338-A342 PolarHBondContact O-N 3.44Å
339	P	98.8	Very high	98.1	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.1	-40.1	179.5	-23.8	34.9	0	0	0	112.2	H253 A256 F257 L260 L334 A342	H253-P339 VanDerWaalsContact CD2-CB 3.42Å; H253-P339 WeakPolarHBondContact CD2-CB 3.16Å; A256-P339 HydrophobicContact CB-CB 3.97Å; A256-P339 WeakPolarHBondContact CB-O 3.43Å; F257-P339 HydrophobicContact CD2-CG 4.14Å; L260-P339 HydrophobicContact CD1-CB 4.08Å; L260-P339 HydrophobicContact CD1-CG 3.76Å; L334-P339 WeakPolarHBondContact O-CD 3.35Å; P339-A342 WeakPolarHBondContact O-CB 3.5Å; P339-A342 PolarHBondContact O-N 3.42Å
340	M	98.6	Very high	98.2	Very high	1 Å²	1	18 Å²	18	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-69.9	-37.1	179.1	-66.6	-52.6	-53.4	0	0	112.4	E252 H253 H337 V338 A342 D343 F346 Y390 L395 F439	E252-M340 HydrophobicContact CB-CE 4.24Å; H253-M340 HydrophobicContact CB-SD 3.84Å; H337-M340 PolarHBondContact O-N 2.82Å; V338-M340 VanDerWaalsContact C-N 3.28Å; V338-M340 PolarHBondContact O-N 2.78Å; M340-A342 PolarHBondContact O-N 3.3Å; M340-D343 PolarHBondContact O-N 3.28Å; M340-F346 VanDerWaalsContact C-CD1 3.49Å; M340-F346 HydrophobicContact CB-CD1 3.57Å; M340-F346 HydrophobicContact CB-CD2 4.42Å; M340-F346 HydrophobicContact CB-CE1 3.51Å; M340-F346 HydrophobicContact CB-CE2 4.38Å; M340-F346 HydrophobicContact CB-CG 4.03Å; M340-F346 HydrophobicContact CB-CZ 3.93Å; M340-F346 HydrophobicContact CE-CB 4.19Å; M340-F346 HydrophobicContact CE-CD2 3.66Å; M340-F346 HydrophobicContact CE-CE2 4.14Å; M340-F346 HydrophobicContact CE-CG 3.86Å; M340-F346 WeakPolarHBondContact O-CB 3.43Å; M340-F346 VanDerWaalsContact O-CD1 3.31Å; M340-F346 WeakPolarHBondContact O-CD1 3.11Å; M340-Y390 WeakPolarHBondContact CG-O 3.46Å; M340-L395 HydrophobicContact CG-CD1 4.4Å; M340-F439 HydrophobicContact CE-CE1 4.19Å; M340-F439 HydrophobicContact CE-CE2 3.67Å; M340-F439 HydrophobicContact CE-CZ 3.4Å; M340-F439 VanDerWaalsContact CE-CZ 3.4Å
341	L	98.8	Very high	98.3	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-66	-15	175.6	-66.9	175.3	0	0	0	113.7	L281 T285 F287 F310 H337 V338 D343 F346	L281-L341 HydrophobicContact CD1-CB 4.4Å; L281-L341 HydrophobicContact CD2-CB 4.03Å; T285-L341 VanDerWaalsContact CG2-O 3.29Å; T285-L341 WeakPolarHBondContact CG2-O 3.17Å; T285-L341 PolarHBondContact OG1-O 2.9Å; F287-L341 HydrophobicContact CD1-CD1 4.13Å; F287-L341 HydrophobicContact CD1-CD2 3.91Å; F287-L341 HydrophobicContact CD1-CG 4.46Å; F287-L341 HydrophobicContact CE1-CD1 4.47Å; F287-L341 HydrophobicContact CE1-CD2 3.71Å; F287-L341 HydrophobicContact CE2-CD2 4.42Å; F287-L341 HydrophobicContact CG-CD2 4.34Å; F287-L341 HydrophobicContact CZ-CD2 3.99Å; F310-L341 HydrophobicContact CB-CD1 3.75Å; F310-L341 HydrophobicContact CD1-CD1 4.25Å; F310-L341 HydrophobicContact CD2-CD1 3.81Å; F310-L341 HydrophobicContact CG-CD1 3.66Å; H337-L341 HydrophobicContact CB-CD1 4.47Å; H337-L341 PolarHBondContact O-N 3.44Å; V338-L341 PolarHBondContact O-N 3.04Å; L341-D343 VanDerWaalsContact C-N 3.34Å; L341-F346 HydrophobicContact CD2-CD1 4.35Å; L341-F346 HydrophobicContact CD2-CE1 4.29Å
342	A	98.4	Very high	98.3	Very high	5 Å²	5	19.2 Å²	19.2	4%	0.041	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-11.3	173.4	0	0	0	0	0	113.4	A256 F280 L281 T285 V338 P339 M340	A256-A342 HydrophobicContact CB-CB 3.94Å; F280-A342 HydrophobicContact CE1-CB 3.97Å; L281-A342 HydrophobicContact CD2-CB 3.89Å; T285-A342 WeakPolarHBondContact CG2-O 3.38Å; V338-A342 PolarHBondContact O-N 3.44Å; P339-A342 WeakPolarHBondContact O-CB 3.5Å; P339-A342 PolarHBondContact O-N 3.42Å; M340-A342 PolarHBondContact O-N 3.3Å
343	D	98.4	Very high	98.4	Very high	40 Å²	40	18.2 Å²	18.2	21%	0.214	8%	0.083	C	C	.	.	S	Bend	trans	-84.4	136.6	169.2	175.8	-104.9	0	0	0	111.3	E252 M340 L341 T345 F346 A347	E252-D343 HydrophobicContact CB-CB 4.32Å; E252-D343 HydrophobicContact CG-CB 4.49Å; M340-D343 PolarHBondContact O-N 3.28Å; L341-D343 VanDerWaalsContact C-N 3.34Å; D343-T345 WeakPolarHBondContact OD1-CA 3.4Å; D343-T345 WeakPolarHBondContact OD1-CB 3.32Å; D343-T345 PolarHBondContact OD1-N 3.34Å; D343-F346 HydrophobicContact CB-CB 4.08Å; D343-F346 PolarHBondContact OD1-N 3.25Å; D343-A347 WeakPolarHBondContact O-CB 3.44Å; D343-A347 PolarHBondContact O-N 3.17Å
344	R	97.6	Very high	98.4	Very high	197 Å²	197	17.8 Å²	17.8	74%	0.743	8%	0.081	S	C	*	.	H	α-helix	trans	-69.7	-36.4	-175.2	-69	-178.3	176.7	-175.6	0.3	113	T285 Q348	T285-R344 HydrophobicContact CG2-CG 4.17Å; R344-Q348 WeakPolarHBondContact O-CB 3.44Å; R344-Q348 PolarHBondContact O-N 3.04Å; R344-Q348 VanDerWaalsContact O-N 3.11Å
345	T	97.6	Very high	98.4	Very high	47 Å²	47	19 Å²	19	29%	0.288	9%	0.087	S	C	.	.	H	α-helix	trans	-74.6	-43.8	-177.4	-51.8	0	0	0	0	109.8	D343 Q348 F349 F439	D343-T345 WeakPolarHBondContact OD1-CA 3.4Å; D343-T345 WeakPolarHBondContact OD1-CB 3.32Å; D343-T345 PolarHBondContact OD1-N 3.34Å; T345-Q348 PolarHBondContact O-N 3.41Å; T345-F349 WeakPolarHBondContact O-CB 3.25Å; T345-F349 PolarHBondContact O-N 3.32Å; T345-F439 HydrophobicContact CG2-CB 3.62Å
346	F	98.4	Very high	98.4	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	9%	0.089	C	C	.	.	H	α-helix	trans	-64.4	-44.7	175.3	-168.1	-90.9	0	0	0	112.1	M340 L341 D343 Q348 F349 S350 V376 Y390 F439	M340-F346 VanDerWaalsContact C-CD1 3.49Å; M340-F346 HydrophobicContact CB-CD1 3.57Å; M340-F346 HydrophobicContact CB-CD2 4.42Å; M340-F346 HydrophobicContact CB-CE1 3.51Å; M340-F346 HydrophobicContact CB-CE2 4.38Å; M340-F346 HydrophobicContact CB-CG 4.03Å; M340-F346 HydrophobicContact CB-CZ 3.93Å; M340-F346 HydrophobicContact CE-CB 4.19Å; M340-F346 HydrophobicContact CE-CD2 3.66Å; M340-F346 HydrophobicContact CE-CE2 4.14Å; M340-F346 HydrophobicContact CE-CG 3.86Å; M340-F346 WeakPolarHBondContact O-CB 3.43Å; M340-F346 VanDerWaalsContact O-CD1 3.31Å; M340-F346 WeakPolarHBondContact O-CD1 3.11Å; L341-F346 HydrophobicContact CD2-CD1 4.35Å; L341-F346 HydrophobicContact CD2-CE1 4.29Å; D343-F346 HydrophobicContact CB-CB 4.08Å; D343-F346 PolarHBondContact OD1-N 3.25Å; F346-Q348 VanDerWaalsContact C-N 3.29Å; F346-Q348 PolarHBondContact O-N 3.29Å; F346-F349 HydrophobicContact CE2-CD1 4.49Å; F346-F349 WeakPolarHBondContact O-CB 3.41Å; F346-F349 PolarHBondContact O-N 3.32Å; F346-F349 VanDerWaalsContact O-N 3.1Å; F346-S350 WeakPolarHBondContact CE1-OG 3.38Å; F346-S350 PolarHBondContact O-N 2.7Å; F346-S350 PolarHBondContact O-OG 2.95Å; F346-V376 HydrophobicContact CE1-CG1 4.37Å; F346-V376 HydrophobicContact CZ-CB 4.32Å; F346-V376 HydrophobicContact CZ-CG1 3.97Å; F346-V376 HydrophobicContact CZ-CG2 4.09Å; F346-Y390 HydrophobicContact CD2-CD2 4.31Å; F346-Y390 HydrophobicContact CD2-CE2 4.5Å; F346-Y390 AromaticContact CE2-CD2 3.52Å; F346-Y390 HydrophobicContact CE2-CD2 3.52Å; F346-Y390 AromaticContact CE2-CE2 3.6Å; F346-Y390 HydrophobicContact CE2-CE2 3.6Å; F346-Y390 HydrophobicContact CZ-CD2 4.27Å; F346-Y390 HydrophobicContact CZ-CE2 4.4Å; F346-F439 HydrophobicContact CD2-CD1 4.2Å; F346-F439 HydrophobicContact CD2-CE1 4.12Å
347	A	98.4	Very high	98.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-57	-42.4	173.7	0	0	0	0	0	112.1	T285 F287 D343 Q351	T285-A347 HydrophobicContact CG2-CB 3.91Å; F287-A347 HydrophobicContact CD2-CB 3.72Å; F287-A347 HydrophobicContact CE2-CB 3.72Å; F287-A347 VanDerWaalsContact CE2-O 3.31Å; F287-A347 WeakPolarHBondContact CE2-O 3.31Å; D343-A347 WeakPolarHBondContact O-CB 3.44Å; D343-A347 PolarHBondContact O-N 3.17Å; A347-Q351 WeakPolarHBondContact O-CB 3.18Å; A347-Q351 PolarHBondContact O-N 3.15Å
348	Q	98.4	Very high	98.2	Very high	45 Å²	45	19 Å²	19	21%	0.21	9%	0.088	C	C	.	.	H	α-helix	trans	-66.4	-41.3	175.5	-171.5	62.4	59.2	0	0	111.9	R344 T345 F346 Q351 D352 K443 R447	R344-Q348 WeakPolarHBondContact O-CB 3.44Å; R344-Q348 PolarHBondContact O-N 3.04Å; R344-Q348 VanDerWaalsContact O-N 3.11Å; T345-Q348 PolarHBondContact O-N 3.41Å; F346-Q348 VanDerWaalsContact C-N 3.29Å; F346-Q348 PolarHBondContact O-N 3.29Å; Q348-Q351 PolarHBondContact O-N 3.21Å; Q348-D352 PolarHBondContact NE2-OD1 2.86Å; Q348-D352 WeakPolarHBondContact O-CB 3.45Å; Q348-D352 PolarHBondContact O-N 3.17Å; Q348-K443 HydrophobicContact CB-CD 4.45Å; Q348-K443 HydrophobicContact CG-CD 4.12Å; Q348-R447 VanDerWaalsContact CG-NH2 3.35Å
349	F	98.4	Very high	98	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.013	9%	0.091	C	C	.	.	H	α-helix	trans	-57	-50.7	174.7	172.5	-97.4	0	0	0	111.4	T345 F346 Q351 D352 I353 T375 V376 A442 K443 L446	T345-F349 WeakPolarHBondContact O-CB 3.25Å; T345-F349 PolarHBondContact O-N 3.32Å; F346-F349 HydrophobicContact CE2-CD1 4.49Å; F346-F349 WeakPolarHBondContact O-CB 3.41Å; F346-F349 PolarHBondContact O-N 3.32Å; F346-F349 VanDerWaalsContact O-N 3.1Å; F349-Q351 VanDerWaalsContact C-N 3.33Å; F349-Q351 PolarHBondContact O-N 3.35Å; F349-D352 PolarHBondContact O-N 3.4Å; F349-D352 VanDerWaalsContact O-N 3.15Å; F349-I353 HydrophobicContact CD1-CD1 4.34Å; F349-I353 HydrophobicContact CE1-CD1 3.74Å; F349-I353 HydrophobicContact CZ-CD1 4.01Å; F349-I353 PolarHBondContact O-N 3.21Å; F349-I353 VanDerWaalsContact O-N 3.15Å; F349-T375 HydrophobicContact CZ-CG2 3.92Å; F349-V376 HydrophobicContact CD1-CG2 4.32Å; F349-V376 HydrophobicContact CE1-CG2 3.87Å; F349-A442 HydrophobicContact CD2-CB 4.4Å; F349-A442 HydrophobicContact CE2-CB 4.1Å; F349-K443 HydrophobicContact CB-CB 4.41Å; F349-K443 HydrophobicContact CD2-CB 4.18Å; F349-L446 HydrophobicContact CD2-CB 4.34Å; F349-L446 HydrophobicContact CD2-CD2 3.7Å; F349-L446 HydrophobicContact CE2-CB 3.89Å; F349-L446 HydrophobicContact CE2-CD2 3.54Å; F349-L446 HydrophobicContact CE2-CG 4.27Å; F349-L446 HydrophobicContact CG-CD2 4.43Å; F349-L446 HydrophobicContact CZ-CD2 4.15Å
350	S	98.4	Very high	97.7	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.014	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-40.4	176.8	-56.5	0	0	0	0	112.2	F346 D352 I353 G354	F346-S350 WeakPolarHBondContact CE1-OG 3.38Å; F346-S350 PolarHBondContact O-N 2.7Å; F346-S350 PolarHBondContact O-OG 2.95Å; S350-D352 VanDerWaalsContact C-N 3.35Å; S350-I353 PolarHBondContact O-N 2.85Å; S350-G354 PolarHBondContact O-N 3.18Å
351	Q	98.7	Very high	97.4	Very high	6 Å²	6	21.9 Å²	21.9	3%	0.028	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-38.3	175.3	-174.9	179.2	29.2	0	0	112.3	L305 A306 R308 A347 Q348 F349 I353 G354 L355	L305-Q351 WeakPolarHBondContact O-CA 3.48Å; A306-Q351 PolarHBondContact O-NE2 3.05Å; R308-Q351 HydrophobicContact CG-CB 4.32Å; R308-Q351 HydrophobicContact CG-CG 4.15Å; R308-Q351 VanDerWaalsContact CZ-OE1 3.31Å; A347-Q351 WeakPolarHBondContact O-CB 3.18Å; A347-Q351 PolarHBondContact O-N 3.15Å; Q348-Q351 PolarHBondContact O-N 3.21Å; F349-Q351 VanDerWaalsContact C-N 3.33Å; F349-Q351 PolarHBondContact O-N 3.35Å; Q351-I353 VanDerWaalsContact C-N 3.32Å; Q351-I353 PolarHBondContact O-N 3.35Å; Q351-G354 CarbonylContact O-C 3.52Å; Q351-G354 WeakPolarHBondContact O-CA 3.32Å; Q351-G354 PolarHBondContact O-N 2.8Å; Q351-G354 VanDerWaalsContact O-N 3.09Å; Q351-L355 HydrophobicContact CG-CD1 4.1Å; Q351-L355 HydrophobicContact CG-CG 4.32Å; Q351-L355 WeakPolarHBondContact O-CG 3.33Å; Q351-L355 PolarHBondContact O-N 2.7Å
352	D	98.4	Very high	96.9	Very high	18 Å²	18	23.9 Å²	23.9	10%	0.096	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-37.5	179.1	-67.9	-19.7	0	0	0	111.1	Q348 F349 S350 G354 L355 A356 K443 L446 R447	Q348-D352 PolarHBondContact NE2-OD1 2.86Å; Q348-D352 WeakPolarHBondContact O-CB 3.45Å; Q348-D352 PolarHBondContact O-N 3.17Å; F349-D352 PolarHBondContact O-N 3.4Å; F349-D352 VanDerWaalsContact O-N 3.15Å; S350-D352 VanDerWaalsContact C-N 3.35Å; D352-G354 VanDerWaalsContact C-N 3.33Å; D352-L355 PolarHBondContact O-N 2.9Å; D352-A356 WeakPolarHBondContact O-CB 3.16Å; D352-A356 PolarHBondContact O-N 3.32Å; D352-K443 WeakPolarHBondContact OD2-CG 3.47Å; D352-L446 HydrophobicContact CB-CD2 4Å; D352-R447 IonicContact OD1-NE 2.76Å; D352-R447 IonicContact OD1-NH2 3.78Å; D352-R447 PolarHBondContact OD1-NH2 2.91Å; D352-R447 IonicContact OD2-CZ 3.51Å; D352-R447 VanDerWaalsContact OD2-CZ 3.26Å; D352-R447 IonicContact OD2-NE 3.64Å; D352-R447 PolarHBondContact OD2-NE 3.15Å; D352-R447 IonicContact OD2-NH2 3.86Å; D352-R447 PolarHBondContact OD2-NH2 3.4Å
353	I	98.3	Very high	96.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.8	-47.6	169.6	-58.9	177.3	0	0	0	109.8	L302 F349 S350 Q351 L355 A356 S357 Y372 V376 L446	L302-I353 HydrophobicContact CD2-CG2 3.82Å; F349-I353 HydrophobicContact CD1-CD1 4.34Å; F349-I353 HydrophobicContact CE1-CD1 3.74Å; F349-I353 HydrophobicContact CZ-CD1 4.01Å; F349-I353 PolarHBondContact O-N 3.21Å; F349-I353 VanDerWaalsContact O-N 3.15Å; S350-I353 PolarHBondContact O-N 2.85Å; Q351-I353 VanDerWaalsContact C-N 3.32Å; Q351-I353 PolarHBondContact O-N 3.35Å; I353-L355 PolarHBondContact O-N 3.42Å; I353-A356 WeakPolarHBondContact O-CB 3.3Å; I353-A356 PolarHBondContact O-N 3.22Å; I353-S357 PolarHBondContact O-N 2.99Å; I353-S357 VanDerWaalsContact O-N 3.13Å; I353-Y372 HydrophobicContact CD1-CD2 4.08Å; I353-V376 HydrophobicContact CD1-CG2 4Å; I353-L446 HydrophobicContact CB-CD2 4.45Å; I353-L446 HydrophobicContact CD1-CD2 4.34Å; I353-L446 HydrophobicContact CG1-CD1 4.2Å; I353-L446 HydrophobicContact CG1-CD2 3.38Å; I353-L446 HydrophobicContact CG1-CG 4.42Å
354	G	98.1	Very high	96.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-44.4	179.3	0	0	0	0	0	113.2	L302 S350 Q351 D352 A356 S357	L302-G354 WeakPolarHBondContact O-CA 3.07Å; S350-G354 PolarHBondContact O-N 3.18Å; Q351-G354 CarbonylContact O-C 3.52Å; Q351-G354 WeakPolarHBondContact O-CA 3.32Å; Q351-G354 PolarHBondContact O-N 2.8Å; Q351-G354 VanDerWaalsContact O-N 3.09Å; D352-G354 VanDerWaalsContact C-N 3.33Å; G354-A356 VanDerWaalsContact C-N 3.29Å; G354-A356 PolarHBondContact O-N 3.47Å; G354-S357 WeakPolarHBondContact O-CB 3.4Å; G354-S357 PolarHBondContact O-N 3.08Å; G354-S357 VanDerWaalsContact O-N 3.12Å; G354-S357 PolarHBondContact O-OG 3.25Å
355	L	98.5	Very high	96.3	Very high	26 Å²	26	20.1 Å²	20.1	14%	0.136	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-33	177	-71.2	168.4	0	0	0	112.8	A306 Q351 D352 I353 S357 L358 R455 V459 F461 I468	A306-L355 HydrophobicContact CB-CD2 4.1Å; A306-L355 HydrophobicContact CB-CG 4.3Å; Q351-L355 HydrophobicContact CG-CD1 4.1Å; Q351-L355 HydrophobicContact CG-CG 4.32Å; Q351-L355 WeakPolarHBondContact O-CG 3.33Å; Q351-L355 PolarHBondContact O-N 2.7Å; D352-L355 PolarHBondContact O-N 2.9Å; I353-L355 PolarHBondContact O-N 3.42Å; L355-S357 VanDerWaalsContact C-N 3.3Å; L355-L358 HydrophobicContact CD2-CD1 4.34Å; L355-R455 PolarHBondContact O-NH1 3.11Å; L355-V459 HydrophobicContact CB-CG2 4.33Å; L355-V459 HydrophobicContact CD2-CG2 4.03Å; L355-V459 WeakPolarHBondContact O-CG2 3.39Å; L355-F461 HydrophobicContact CD2-CB 4.17Å; L355-I468 HydrophobicContact CD2-CD1 3.95Å
356	A	98	Very high	96.2	Very high	3 Å²	3	24.3 Å²	24.3	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-66	-33.3	174.1	0	0	0	0	0	111.9	D352 I353 G354 L358 L368 A450 I453	D352-A356 WeakPolarHBondContact O-CB 3.16Å; D352-A356 PolarHBondContact O-N 3.32Å; I353-A356 WeakPolarHBondContact O-CB 3.3Å; I353-A356 PolarHBondContact O-N 3.22Å; G354-A356 VanDerWaalsContact C-N 3.29Å; G354-A356 PolarHBondContact O-N 3.47Å; A356-L358 PolarHBondContact O-N 3.34Å; A356-L368 HydrophobicContact CB-CD1 3.97Å; A356-L368 HydrophobicContact CB-CD2 3.88Å; A356-A450 HydrophobicContact CB-CB 3.77Å; A356-I453 HydrophobicContact CB-CD1 3.97Å
357	S	97	Very high	96.1	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-71.2	-25.6	-179.6	80.1	0	0	0	0	114.4	A303 I353 G354 L355 G359 A360	A303-S357 PolarHBondContact N-OG 3.22Å; I353-S357 PolarHBondContact O-N 2.99Å; I353-S357 VanDerWaalsContact O-N 3.13Å; G354-S357 WeakPolarHBondContact O-CB 3.4Å; G354-S357 PolarHBondContact O-N 3.08Å; G354-S357 VanDerWaalsContact O-N 3.12Å; G354-S357 PolarHBondContact O-OG 3.25Å; L355-S357 VanDerWaalsContact C-N 3.3Å; S357-G359 PolarHBondContact O-N 3.02Å; S357-G359 VanDerWaalsContact O-N 3.11Å; S357-A360 WeakPolarHBondContact O-CB 3.28Å; S357-A360 PolarHBondContact O-N 3.16Å; S357-A360 VanDerWaalsContact O-N 3.1Å
358	L	96.3	Very high	96	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	113.8	-173.3	-58	-174.4	0	0	0	111.8	F168 A303 A306 L355 A356 A360 R455 V459 I468	F168-L358 HydrophobicContact CB-CB 4.42Å; F168-L358 HydrophobicContact CB-CD2 4.07Å; F168-L358 HydrophobicContact CD2-CB 3.9Å; F168-L358 HydrophobicContact CD2-CD1 4.18Å; F168-L358 HydrophobicContact CD2-CD2 4.17Å; F168-L358 HydrophobicContact CD2-CG 4.3Å; F168-L358 HydrophobicContact CE2-CB 4.31Å; F168-L358 HydrophobicContact CE2-CD1 4.47Å; F168-L358 HydrophobicContact CG-CB 4.08Å; F168-L358 HydrophobicContact CG-CD2 4.43Å; A303-L358 HydrophobicContact CB-CD2 3.82Å; A306-L358 HydrophobicContact CB-CD1 3.81Å; A306-L358 HydrophobicContact CB-CD2 4.08Å; A306-L358 HydrophobicContact CB-CG 4.05Å; L355-L358 HydrophobicContact CD2-CD1 4.34Å; A356-L358 PolarHBondContact O-N 3.34Å; L358-A360 PolarHBondContact O-N 2.8Å; L358-R455 PolarHBondContact O-NH1 3.43Å; L358-V459 HydrophobicContact CB-CG2 4.5Å; L358-V459 HydrophobicContact CD1-CG2 4.28Å; L358-I468 HydrophobicContact CD1-CB 4.4Å; L358-I468 HydrophobicContact CD1-CD1 3.65Å; L358-I468 HydrophobicContact CD1-CG1 3.69Å; L358-I468 HydrophobicContact CD1-CG2 3.91Å
359	G	93.4	Very high	95.9	Very high	5 Å²	5	25.4 Å²	25.4	5%	0.052	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	11.5	-177.9	0	0	0	0	0	114.6	S357	S357-G359 PolarHBondContact O-N 3.02Å; S357-G359 VanDerWaalsContact O-N 3.11Å
360	A	94.3	Very high	95.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.008	14%	0.137	C	C	.	.			trans	-72.3	151.2	175.4	0	0	0	0	0	111.4	R299 S357 L358 E364 I365 I453	R299-A360 VanDerWaalsContact CZ-O 3.3Å; R299-A360 PolarHBondContact NH1-O 3.38Å; R299-A360 PolarHBondContact NH2-O 2.86Å; S357-A360 WeakPolarHBondContact O-CB 3.28Å; S357-A360 PolarHBondContact O-N 3.16Å; S357-A360 VanDerWaalsContact O-N 3.1Å; L358-A360 PolarHBondContact O-N 2.8Å; A360-E364 HydrophobicContact CB-CB 4.03Å; A360-I365 HydrophobicContact CB-CD1 4.15Å; A360-I365 HydrophobicContact CB-CG1 4.42Å; A360-I453 HydrophobicContact CB-CG2 4.31Å
361	S	91.8	Very high	95.9	Very high	54 Å²	54	26 Å²	26	38%	0.378	14%	0.137	S	C	.	.			trans	-64.4	164.7	172.6	63.5	0	0	0	0	111.4	E363 E364 I365	S361-E363 VanDerWaalsContact C-N 3.31Å; S361-E363 PolarHBondContact O-N 2.93Å; S361-E364 PolarHBondContact O-N 3.15Å; S361-E364 WeakPolarHBondContact OG-CG 3.35Å; S361-E364 PolarHBondContact OG-N 3.17Å; S361-I365 WeakPolarHBondContact O-CG1 3.23Å; S361-I365 PolarHBondContact O-N 3.38Å
362	D	88.4	Confident	95.8	Very high	45 Å²	45	26.4 Å²	26.4	24%	0.241	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-38.3	178.7	-62.6	-43.6	0	0	0	112.3	H114 R299 E364 I365 E366	H114-D362 WeakPolarHBondContact CB-OD2 3.48Å; H114-D362 IonicContact CE1-OD1 3.17Å; H114-D362 IonicContact CG-OD1 3.27Å; H114-D362 IonicContact CG-OD2 2.72Å; H114-D362 VanDerWaalsContact ND1-CG 3.28Å; H114-D362 IonicContact ND1-OD1 3.43Å; H114-D362 PolarHBondContact ND1-OD1 3.18Å; H114-D362 IonicContact ND1-OD2 2.55Å; H114-D362 PolarHBondContact ND1-OD2 3.04Å; R299-D362 IonicContact CZ-OD1 2.73Å; R299-D362 IonicContact NE-OD1 3.39Å; R299-D362 IonicContact NH2-OD1 3.21Å; R299-D362 PolarHBondContact NH2-OD1 3.02Å; D362-E364 VanDerWaalsContact C-N 3.31Å; D362-E364 PolarHBondContact O-N 3.13Å; D362-I365 WeakPolarHBondContact O-CB 3.49Å; D362-I365 PolarHBondContact O-N 3.36Å; D362-I365 VanDerWaalsContact O-N 3.14Å; D362-E366 WeakPolarHBondContact O-CG 3.41Å; D362-E366 PolarHBondContact O-N 3.15Å
363	E	91.9	Very high	95.8	Very high	118 Å²	118	27.4 Å²	27.4	55%	0.551	14%	0.14	S	C	*	.	H	α-helix	trans	-58.5	-42.1	174	-172.8	-169.4	156.5	0	0	112	S361 E366 K367	S361-E363 VanDerWaalsContact C-N 3.31Å; S361-E363 PolarHBondContact O-N 2.93Å; E363-E366 PolarHBondContact O-N 2.8Å; E363-K367 WeakPolarHBondContact O-CG 3.34Å; E363-K367 PolarHBondContact O-N 3.18Å; E363-K367 VanDerWaalsContact O-N 3.09Å; E363-K367 WeakPolarHBondContact OE1-CE 3.46Å; E363-K367 IonicContact OE1-NZ 2.78Å; E363-K367 PolarHBondContact OE1-NZ 3.44Å
364	E	95.4	Very high	95.8	Very high	35 Å²	35	27.5 Å²	27.5	16%	0.164	14%	0.141	C	C	.	.	H	α-helix	trans	-73.4	-30.8	178.1	-66.8	-59.4	132.4	0	0	111.9	A360 S361 D362 K367 L368 I453	A360-E364 HydrophobicContact CB-CB 4.03Å; S361-E364 PolarHBondContact O-N 3.15Å; S361-E364 WeakPolarHBondContact OG-CG 3.35Å; S361-E364 PolarHBondContact OG-N 3.17Å; D362-E364 VanDerWaalsContact C-N 3.31Å; D362-E364 PolarHBondContact O-N 3.13Å; E364-K367 PolarHBondContact O-N 2.85Å; E364-K367 IonicContact OE1-NZ 3.01Å; E364-K367 PolarHBondContact OE1-NZ 3.31Å; E364-L368 WeakPolarHBondContact O-CB 3.17Å; E364-L368 VanDerWaalsContact O-CG 3.23Å; E364-L368 WeakPolarHBondContact O-CG 3.48Å; E364-L368 PolarHBondContact O-N 3.49Å; E364-I453 HydrophobicContact CB-CG2 4.4Å; E364-I453 HydrophobicContact CG-CG2 4.26Å
365	I	94.8	Very high	95.8	Very high	9 Å²	9	27.5 Å²	27.5	5%	0.046	14%	0.141	C	C	.	.	H	α-helix	trans	-64.2	-42.9	170.1	-68.8	-60.4	0	0	0	111.2	A298 R299 A360 S361 D362 L368 S369	A298-I365 HydrophobicContact CB-CG2 3.81Å; R299-I365 HydrophobicContact CB-CG1 4.46Å; R299-I365 HydrophobicContact CB-CG2 4.29Å; A360-I365 HydrophobicContact CB-CD1 4.15Å; A360-I365 HydrophobicContact CB-CG1 4.42Å; S361-I365 WeakPolarHBondContact O-CG1 3.23Å; S361-I365 PolarHBondContact O-N 3.38Å; D362-I365 WeakPolarHBondContact O-CB 3.49Å; D362-I365 PolarHBondContact O-N 3.36Å; D362-I365 VanDerWaalsContact O-N 3.14Å; I365-L368 PolarHBondContact O-N 3.23Å; I365-S369 WeakPolarHBondContact O-CB 3.42Å; I365-S369 PolarHBondContact O-N 3.33Å
366	E	94.1	Very high	95.8	Very high	135 Å²	135	26.4 Å²	26.4	63%	0.631	14%	0.135	S	C	*	.	H	α-helix	trans	-59.4	-48.8	175.7	-72.7	178.5	-177.9	0	0	110.9	D362 E363 L368 S369 T370	D362-E366 WeakPolarHBondContact O-CG 3.41Å; D362-E366 PolarHBondContact O-N 3.15Å; E363-E366 PolarHBondContact O-N 2.8Å; E366-L368 PolarHBondContact O-N 3.21Å; E366-S369 WeakPolarHBondContact O-CB 3.43Å; E366-S369 PolarHBondContact O-N 3.26Å; E366-T370 PolarHBondContact O-N 3.01Å; E366-T370 PolarHBondContact O-OG1 2.95Å
367	K	96.9	Very high	95.7	Very high	43 Å²	43	27.4 Å²	27.4	19%	0.187	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-46.6	175.8	-73.6	176.2	-165.7	160.1	0	112.6	E363 E364 S369 T370 V371 A420 Y449	E363-K367 WeakPolarHBondContact O-CG 3.34Å; E363-K367 PolarHBondContact O-N 3.18Å; E363-K367 VanDerWaalsContact O-N 3.09Å; E363-K367 WeakPolarHBondContact OE1-CE 3.46Å; E363-K367 IonicContact OE1-NZ 2.78Å; E363-K367 PolarHBondContact OE1-NZ 3.44Å; E364-K367 PolarHBondContact O-N 2.85Å; E364-K367 IonicContact OE1-NZ 3.01Å; E364-K367 PolarHBondContact OE1-NZ 3.31Å; K367-S369 VanDerWaalsContact C-N 3.31Å; K367-S369 PolarHBondContact O-N 2.89Å; K367-T370 WeakPolarHBondContact O-CB 3.38Å; K367-T370 PolarHBondContact O-N 3.19Å; K367-V371 WeakPolarHBondContact O-CG2 3.32Å; K367-V371 PolarHBondContact O-N 2.73Å; K367-A420 HydrophobicContact CB-CB 3.9Å; K367-A420 HydrophobicContact CG-CB 4.14Å; K367-Y449 WeakPolarHBondContact CB-OH 3.49Å
368	L	97.6	Very high	95.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-37	176.8	-74.8	170.2	0	0	0	112	L302 A356 E364 I365 E366 T370 V371 Y372 Y449 I453	L302-L368 HydrophobicContact CD1-CB 3.97Å; A356-L368 HydrophobicContact CB-CD1 3.97Å; A356-L368 HydrophobicContact CB-CD2 3.88Å; E364-L368 WeakPolarHBondContact O-CB 3.17Å; E364-L368 VanDerWaalsContact O-CG 3.23Å; E364-L368 WeakPolarHBondContact O-CG 3.48Å; E364-L368 PolarHBondContact O-N 3.49Å; I365-L368 PolarHBondContact O-N 3.23Å; E366-L368 PolarHBondContact O-N 3.21Å; L368-T370 VanDerWaalsContact C-N 3.33Å; L368-V371 PolarHBondContact O-N 2.88Å; L368-Y372 WeakPolarHBondContact O-CB 3.11Å; L368-Y372 PolarHBondContact O-N 2.9Å; L368-Y449 HydrophobicContact CD2-CE1 4.2Å; L368-I453 HydrophobicContact CD1-CD1 4.11Å; L368-I453 HydrophobicContact CD2-CD1 4.21Å; L368-I453 HydrophobicContact CG-CD1 4.36Å
369	S	95.8	Very high	95.9	Very high	28 Å²	28	28.2 Å²	28.2	20%	0.196	14%	0.142	C	C	.	.	H	α-helix	trans	-63.6	-39.5	174	-167.2	0	0	0	0	111.4	I365 E366 K367 Y372 W373	I365-S369 WeakPolarHBondContact O-CB 3.42Å; I365-S369 PolarHBondContact O-N 3.33Å; E366-S369 WeakPolarHBondContact O-CB 3.43Å; E366-S369 PolarHBondContact O-N 3.26Å; K367-S369 VanDerWaalsContact C-N 3.31Å; K367-S369 PolarHBondContact O-N 2.89Å; S369-Y372 WeakPolarHBondContact O-CB 3.47Å; S369-Y372 PolarHBondContact O-N 3.46Å; S369-W373 PolarHBondContact O-N 3.38Å
370	T	97.4	Very high	96.1	Very high	18 Å²	18	28 Å²	28	11%	0.11	14%	0.14	C	C	.	.	H	α-helix	trans	-68.6	-40.2	175.4	-51.6	0	0	0	0	111.7	E366 K367 L368 Y372 W373 F374 A419 A420 Q422 Y424	E366-T370 PolarHBondContact O-N 3.01Å; E366-T370 PolarHBondContact O-OG1 2.95Å; K367-T370 WeakPolarHBondContact O-CB 3.38Å; K367-T370 PolarHBondContact O-N 3.19Å; L368-T370 VanDerWaalsContact C-N 3.33Å; T370-Y372 VanDerWaalsContact C-N 3.32Å; T370-Y372 PolarHBondContact O-N 2.81Å; T370-W373 WeakPolarHBondContact O-CB 3.45Å; T370-W373 PolarHBondContact O-N 3.28Å; T370-F374 HydrophobicContact CG2-CD2 3.83Å; T370-F374 HydrophobicContact CG2-CE2 3.74Å; T370-F374 WeakPolarHBondContact O-CD2 3.35Å; T370-F374 PolarHBondContact O-N 3.18Å; T370-A419 WeakPolarHBondContact CG2-O 3.34Å; T370-A420 WeakPolarHBondContact CB-O 3.36Å; T370-Q422 WeakPolarHBondContact CG2-O 3.43Å; T370-Y424 HydrophobicContact CG2-CD1 3.94Å; T370-Y424 HydrophobicContact CG2-CE1 3.89Å
371	V	98.2	Very high	96.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.3	-43.9	172.4	172.4	0	0	0	0	110.6	K367 L368 W373 F374 T375 F414 A420 L446	K367-V371 WeakPolarHBondContact O-CG2 3.32Å; K367-V371 PolarHBondContact O-N 2.73Å; L368-V371 PolarHBondContact O-N 2.88Å; V371-W373 VanDerWaalsContact C-N 3.34Å; V371-W373 PolarHBondContact O-N 3.45Å; V371-F374 PolarHBondContact O-N 3.19Å; V371-T375 WeakPolarHBondContact O-CB 3.14Å; V371-T375 WeakPolarHBondContact O-CG2 3.44Å; V371-T375 PolarHBondContact O-N 3.3Å; V371-T375 VanDerWaalsContact O-N 3.13Å; V371-T375 PolarHBondContact O-OG1 3.39Å; V371-F414 HydrophobicContact CG1-CE2 4.38Å; V371-F414 HydrophobicContact CG1-CZ 4.17Å; V371-A420 HydrophobicContact CG2-CB 3.84Å; V371-L446 HydrophobicContact CG1-CD1 4.09Å
372	Y	98.2	Very high	96.6	Very high	14 Å²	14	30 Å²	30	6%	0.055	14%	0.142	C	C	.	.	H	α-helix	trans	-59.6	-44	175.3	179.6	-86.3	0	0	0	111.3	F301 L302 L305 H337 I353 L368 S369 T370 T375 V376 E377	F301-Y372 AromaticContact CE1-CE1 3.93Å; F301-Y372 HydrophobicContact CE1-CE1 3.93Å; F301-Y372 AromaticContact CE1-CE2 3.81Å; F301-Y372 HydrophobicContact CE1-CE2 3.81Å; F301-Y372 AromaticContact CE1-CZ 3.48Å; F301-Y372 VanDerWaalsContact CE1-CZ 3.48Å; F301-Y372 WeakPolarHBondContact CE1-OH 3.43Å; F301-Y372 HydrophobicContact CZ-CE2 4.49Å; F301-Y372 AromaticContact CZ-CZ 3.93Å; F301-Y372 WeakPolarHBondContact CZ-OH 3.06Å; L302-Y372 HydrophobicContact CD2-CD2 4.01Å; L302-Y372 HydrophobicContact CD2-CG 4.19Å; L305-Y372 HydrophobicContact CD1-CD2 4.07Å; L305-Y372 HydrophobicContact CD1-CE2 3.76Å; H337-Y372 PolarHBondContact CE1-OH 2.76Å; I353-Y372 HydrophobicContact CD1-CD2 4.08Å; L368-Y372 WeakPolarHBondContact O-CB 3.11Å; L368-Y372 PolarHBondContact O-N 2.9Å; S369-Y372 WeakPolarHBondContact O-CB 3.47Å; S369-Y372 PolarHBondContact O-N 3.46Å; T370-Y372 VanDerWaalsContact C-N 3.32Å; T370-Y372 PolarHBondContact O-N 2.81Å; Y372-T375 CarbonylContact O-C 3.57Å; Y372-T375 PolarHBondContact O-N 3.3Å; Y372-T375 PolarHBondContact O-OG1 3.27Å; Y372-V376 HydrophobicContact CD1-CB 4.44Å; Y372-V376 HydrophobicContact CD2-CB 3.74Å; Y372-V376 HydrophobicContact CD2-CG1 4.25Å; Y372-V376 HydrophobicContact CD2-CG2 3.65Å; Y372-V376 HydrophobicContact CE1-CB 4.24Å; Y372-V376 HydrophobicContact CE1-CG1 4.35Å; Y372-V376 HydrophobicContact CE2-CB 3.48Å; Y372-V376 VanDerWaalsContact CE2-CB 3.48Å; Y372-V376 HydrophobicContact CE2-CG1 3.46Å; Y372-V376 VanDerWaalsContact CE2-CG1 3.46Å; Y372-V376 HydrophobicContact CE2-CG2 3.66Å; Y372-V376 HydrophobicContact CG-CB 4.19Å; Y372-V376 HydrophobicContact CG-CG2 4.39Å; Y372-V376 VanDerWaalsContact CZ-CG1 3.48Å; Y372-V376 PolarHBondContact O-N 3.44Å; Y372-V376 WeakPolarHBondContact OH-CG1 3.42Å; Y372-E377 HydrophobicContact CD1-CG 3.91Å; Y372-E377 HydrophobicContact CE1-CG 3.55Å; Y372-E377 WeakPolarHBondContact CE1-OE1 3.07Å; Y372-E377 PolarHBondContact O-N 3.12Å; Y372-E377 PolarHBondContact OH-OE1 3.33Å
373	W	97.4	Very high	96.9	Very high	39 Å²	39	29.6 Å²	29.6	15%	0.148	14%	0.139	C	C	.	.	I	π-helix	trans	-56.5	-52.1	175.2	-175.7	-92.1	0	0	0	112.4	S369 T370 V371 T375 E377 F378 Y424 Q425 D426	S369-W373 PolarHBondContact O-N 3.38Å; T370-W373 WeakPolarHBondContact O-CB 3.45Å; T370-W373 PolarHBondContact O-N 3.28Å; V371-W373 VanDerWaalsContact C-N 3.34Å; V371-W373 PolarHBondContact O-N 3.45Å; W373-T375 PolarHBondContact O-N 2.94Å; W373-E377 HydrophobicContact CE3-CB 4.46Å; W373-E377 HydrophobicContact CE3-CG 4.35Å; W373-E377 WeakPolarHBondContact O-CB 3.27Å; W373-F378 AromaticContact CD2-CD2 3.78Å; W373-F378 HydrophobicContact CD2-CD2 3.78Å; W373-F378 AromaticContact CD2-CE2 3.83Å; W373-F378 HydrophobicContact CD2-CE2 3.83Å; W373-F378 AromaticContact CE2-CD2 3.43Å; W373-F378 VanDerWaalsContact CE2-CD2 3.43Å; W373-F378 AromaticContact CE2-CE2 3.39Å; W373-F378 HydrophobicContact CE3-CD2 4.34Å; W373-F378 HydrophobicContact CE3-CE2 4.01Å; W373-F378 HydrophobicContact CG-CD2 4.18Å; W373-F378 HydrophobicContact CH2-CD2 4.33Å; W373-F378 AromaticContact CH2-CE2 3.44Å; W373-F378 HydrophobicContact CH2-CE2 3.44Å; W373-F378 VanDerWaalsContact CH2-CE2 3.44Å; W373-F378 HydrophobicContact CH2-CZ 4.03Å; W373-F378 AromaticContact CZ2-CD2 3.76Å; W373-F378 HydrophobicContact CZ2-CD2 3.76Å; W373-F378 AromaticContact CZ2-CE2 3.2Å; W373-F378 HydrophobicContact CZ2-CE2 3.2Å; W373-F378 AromaticContact CZ2-CZ 3.82Å; W373-F378 HydrophobicContact CZ2-CZ 3.82Å; W373-F378 AromaticContact CZ3-CE2 3.83Å; W373-F378 HydrophobicContact CZ3-CE2 3.83Å; W373-F378 AromaticContact NE1-CD2 3.59Å; W373-F378 PolarHBondContact O-N 3.43Å; W373-Y424 HydrophobicContact CB-CD1 4.5Å; W373-Y424 HydrophobicContact CB-CE1 4.21Å; W373-Y424 HydrophobicContact CB-CE2 4.49Å; W373-Y424 AromaticContact CD1-CD1 3.95Å; W373-Y424 AromaticContact CD1-CD2 3.79Å; W373-Y424 AromaticContact CD1-CG 3.59Å; W373-Y424 AromaticContact CD2-CD2 3.49Å; W373-Y424 HydrophobicContact CD2-CD2 3.49Å; W373-Y424 VanDerWaalsContact CD2-CD2 3.49Å; W373-Y424 AromaticContact CD2-CE2 3.45Å; W373-Y424 HydrophobicContact CD2-CE2 3.45Å; W373-Y424 VanDerWaalsContact CD2-CE2 3.45Å; W373-Y424 HydrophobicContact CD2-CG 4.1Å; W373-Y424 AromaticContact CE2-CD2 3.24Å; W373-Y424 AromaticContact CE2-CE2 3.71Å; W373-Y424 AromaticContact CE2-CG 3.84Å; W373-Y424 HydrophobicContact CE3-CD2 4.06Å; W373-Y424 AromaticContact CE3-CE2 3.61Å; W373-Y424 HydrophobicContact CE3-CE2 3.61Å; W373-Y424 HydrophobicContact CG-CD1 4.12Å; W373-Y424 AromaticContact CG-CD2 3.83Å; W373-Y424 HydrophobicContact CG-CD2 3.83Å; W373-Y424 HydrophobicContact CG-CE1 4.17Å; W373-Y424 AromaticContact CG-CE2 3.87Å; W373-Y424 HydrophobicContact CG-CE2 3.87Å; W373-Y424 AromaticContact CG-CG 3.95Å; W373-Y424 HydrophobicContact CG-CG 3.95Å; W373-Y424 HydrophobicContact CH2-CD2 4.16Å; W373-Y424 HydrophobicContact CH2-CE2 4.2Å; W373-Y424 AromaticContact CZ2-CD2 3.61Å; W373-Y424 HydrophobicContact CZ2-CD2 3.61Å; W373-Y424 HydrophobicContact CZ2-CE2 4.08Å; W373-Y424 HydrophobicContact CZ3-CD2 4.37Å; W373-Y424 AromaticContact CZ3-CE2 3.99Å; W373-Y424 HydrophobicContact CZ3-CE2 3.99Å; W373-Y424 AromaticContact NE1-CD2 3.45Å; W373-Y424 AromaticContact NE1-CG 3.53Å; W373-Q425 WeakPolarHBondContact CZ2-O 3.43Å; W373-D426 HydrophobicContact CH2-CB 3.94Å
374	F	98.1	Very high	96.9	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.009	16%	0.158	C	C	.	.	I	π-helix	trans	-78.9	2.6	-178.1	-73.2	-63.5	0	0	0	114.9	T370 V371 A419 Q422 Y424 V432 F434	T370-F374 HydrophobicContact CG2-CD2 3.83Å; T370-F374 HydrophobicContact CG2-CE2 3.74Å; T370-F374 WeakPolarHBondContact O-CD2 3.35Å; T370-F374 PolarHBondContact O-N 3.18Å; V371-F374 PolarHBondContact O-N 3.19Å; F374-A419 HydrophobicContact CB-CB 4.4Å; F374-Q422 HydrophobicContact CD2-CB 4.26Å; F374-Q422 HydrophobicContact CD2-CG 4.37Å; F374-Q422 HydrophobicContact CE1-CG 4.19Å; F374-Q422 HydrophobicContact CE2-CB 3.59Å; F374-Q422 HydrophobicContact CE2-CG 3.45Å; F374-Q422 VanDerWaalsContact CE2-CG 3.45Å; F374-Q422 WeakPolarHBondContact CE2-O 3.47Å; F374-Q422 HydrophobicContact CZ-CB 4.03Å; F374-Q422 HydrophobicContact CZ-CG 3.32Å; F374-Y424 HydrophobicContact CE2-CD1 4.1Å; F374-Y424 HydrophobicContact CZ-CD1 4.47Å; F374-V432 WeakPolarHBondContact CE1-O 3.36Å; F374-F434 HydrophobicContact CB-CB 4.46Å; F374-F434 HydrophobicContact CB-CD2 3.64Å; F374-F434 HydrophobicContact CB-CE2 4.25Å; F374-F434 HydrophobicContact CB-CG 4.37Å; F374-F434 AromaticContact CD1-CD2 3.59Å; F374-F434 HydrophobicContact CD1-CD2 3.59Å; F374-F434 AromaticContact CD1-CE2 3.94Å; F374-F434 HydrophobicContact CD1-CE2 3.94Å; F374-F434 HydrophobicContact CD2-CD2 4.28Å; F374-F434 HydrophobicContact CD2-CE2 4.09Å; F374-F434 HydrophobicContact CE1-CD2 4.31Å; F374-F434 HydrophobicContact CE1-CE2 4.3Å; F374-F434 HydrophobicContact CE2-CE2 4.46Å; F374-F434 AromaticContact CG-CD2 3.56Å; F374-F434 HydrophobicContact CG-CD2 3.56Å; F374-F434 AromaticContact CG-CE2 3.82Å; F374-F434 HydrophobicContact CG-CE2 3.82Å
375	T	98.4	Very high	96.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	I	π-helix	trans	-123.6	-80	176.2	57	0	0	0	0	111	F349 V371 Y372 W373 E377 G379 Y390 F414	F349-T375 HydrophobicContact CZ-CG2 3.92Å; V371-T375 WeakPolarHBondContact O-CB 3.14Å; V371-T375 WeakPolarHBondContact O-CG2 3.44Å; V371-T375 PolarHBondContact O-N 3.3Å; V371-T375 VanDerWaalsContact O-N 3.13Å; V371-T375 PolarHBondContact O-OG1 3.39Å; Y372-T375 CarbonylContact O-C 3.57Å; Y372-T375 PolarHBondContact O-N 3.3Å; Y372-T375 PolarHBondContact O-OG1 3.27Å; W373-T375 PolarHBondContact O-N 2.94Å; T375-E377 VanDerWaalsContact C-N 3.28Å; T375-E377 PolarHBondContact O-N 2.87Å; T375-G379 WeakPolarHBondContact O-CA 3.28Å; T375-G379 PolarHBondContact O-N 3.29Å; T375-Y390 VanDerWaalsContact CA-OH 3.27Å; T375-Y390 WeakPolarHBondContact CA-OH 3.41Å; T375-Y390 WeakPolarHBondContact CB-OH 3.41Å; T375-Y390 WeakPolarHBondContact O-CE2 3.49Å; T375-F414 HydrophobicContact CG2-CD2 3.78Å; T375-F414 HydrophobicContact CG2-CE1 4.21Å; T375-F414 HydrophobicContact CG2-CE2 3.3Å; T375-F414 HydrophobicContact CG2-CG 4.43Å; T375-F414 HydrophobicContact CG2-CZ 3.54Å
376	V	98.3	Very high	96.8	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	20%	0.204	C	C	.	.	I	π-helix	trans	-61.1	-34.9	-175.3	-176.2	0	0	0	0	112.3	F346 F349 I353 Y372 G391 A392	F346-V376 HydrophobicContact CE1-CG1 4.37Å; F346-V376 HydrophobicContact CZ-CB 4.32Å; F346-V376 HydrophobicContact CZ-CG1 3.97Å; F346-V376 HydrophobicContact CZ-CG2 4.09Å; F349-V376 HydrophobicContact CD1-CG2 4.32Å; F349-V376 HydrophobicContact CE1-CG2 3.87Å; I353-V376 HydrophobicContact CD1-CG2 4Å; Y372-V376 HydrophobicContact CD1-CB 4.44Å; Y372-V376 HydrophobicContact CD2-CB 3.74Å; Y372-V376 HydrophobicContact CD2-CG1 4.25Å; Y372-V376 HydrophobicContact CD2-CG2 3.65Å; Y372-V376 HydrophobicContact CE1-CB 4.24Å; Y372-V376 HydrophobicContact CE1-CG1 4.35Å; Y372-V376 HydrophobicContact CE2-CB 3.48Å; Y372-V376 VanDerWaalsContact CE2-CB 3.48Å; Y372-V376 HydrophobicContact CE2-CG1 3.46Å; Y372-V376 VanDerWaalsContact CE2-CG1 3.46Å; Y372-V376 HydrophobicContact CE2-CG2 3.66Å; Y372-V376 HydrophobicContact CG-CB 4.19Å; Y372-V376 HydrophobicContact CG-CG2 4.39Å; Y372-V376 VanDerWaalsContact CZ-CG1 3.48Å; Y372-V376 PolarHBondContact O-N 3.44Å; Y372-V376 WeakPolarHBondContact OH-CG1 3.42Å; V376-G391 WeakPolarHBondContact O-CA 3.43Å; V376-A392 PolarHBondContact O-N 3.48Å
377	E	97.3	Very high	96.9	Very high	23 Å²	23	35.5 Å²	35.5	11%	0.107	19%	0.19	C	C	.	.	I	π-helix	trans	-88.7	-50.7	-179.9	-63.6	-61.5	153.8	0	0	113.8	H332 H337 Y372 W373 T375 G391 A392 G393	H332-E377 IonicContact CE1-OE2 3.6Å; H332-E377 PolarHBondContact CE1-OE2 2.89Å; H332-E377 VanDerWaalsContact CE1-OE2 3.31Å; H332-E377 IonicContact NE2-OE2 2.79Å; H332-E377 PolarHBondContact NE2-OE2 3.39Å; H337-E377 IonicContact CE1-OE1 3.73Å; H337-E377 PolarHBondContact CE1-OE1 3.37Å; H337-E377 IonicContact CE1-OE2 3.57Å; H337-E377 IonicContact NE2-OE1 3.9Å; H337-E377 PolarHBondContact NE2-OE1 3.37Å; H337-E377 VanDerWaalsContact NE2-OE1 3.13Å; H337-E377 IonicContact NE2-OE2 3.53Å; Y372-E377 HydrophobicContact CD1-CG 3.91Å; Y372-E377 HydrophobicContact CE1-CG 3.55Å; Y372-E377 WeakPolarHBondContact CE1-OE1 3.07Å; Y372-E377 PolarHBondContact O-N 3.12Å; Y372-E377 PolarHBondContact OH-OE1 3.33Å; W373-E377 HydrophobicContact CE3-CB 4.46Å; W373-E377 HydrophobicContact CE3-CG 4.35Å; W373-E377 WeakPolarHBondContact O-CB 3.27Å; T375-E377 VanDerWaalsContact C-N 3.28Å; T375-E377 PolarHBondContact O-N 2.87Å; E377-G391 CarbonylContact O-C 3.59Å; E377-G391 WeakPolarHBondContact O-CA 3.35Å; E377-A392 PolarHBondContact O-N 2.8Å; E377-A392 VanDerWaalsContact O-N 3.07Å; E377-G393 WeakPolarHBondContact O-CA 3.41Å; E377-G393 PolarHBondContact O-N 3.07Å
378	F	97.6	Very high	97	Very high	21 Å²	21	34.9 Å²	34.9	9%	0.092	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	27.9	-172.2	-64.5	-89.6	0	0	0	113	W373 L394 E400 Q430 Y433	W373-F378 AromaticContact CD2-CD2 3.78Å; W373-F378 HydrophobicContact CD2-CD2 3.78Å; W373-F378 AromaticContact CD2-CE2 3.83Å; W373-F378 HydrophobicContact CD2-CE2 3.83Å; W373-F378 AromaticContact CE2-CD2 3.43Å; W373-F378 VanDerWaalsContact CE2-CD2 3.43Å; W373-F378 AromaticContact CE2-CE2 3.39Å; W373-F378 HydrophobicContact CE3-CD2 4.34Å; W373-F378 HydrophobicContact CE3-CE2 4.01Å; W373-F378 HydrophobicContact CG-CD2 4.18Å; W373-F378 HydrophobicContact CH2-CD2 4.33Å; W373-F378 AromaticContact CH2-CE2 3.44Å; W373-F378 HydrophobicContact CH2-CE2 3.44Å; W373-F378 VanDerWaalsContact CH2-CE2 3.44Å; W373-F378 HydrophobicContact CH2-CZ 4.03Å; W373-F378 AromaticContact CZ2-CD2 3.76Å; W373-F378 HydrophobicContact CZ2-CD2 3.76Å; W373-F378 AromaticContact CZ2-CE2 3.2Å; W373-F378 HydrophobicContact CZ2-CE2 3.2Å; W373-F378 AromaticContact CZ2-CZ 3.82Å; W373-F378 HydrophobicContact CZ2-CZ 3.82Å; W373-F378 AromaticContact CZ3-CE2 3.83Å; W373-F378 HydrophobicContact CZ3-CE2 3.83Å; W373-F378 AromaticContact NE1-CD2 3.59Å; W373-F378 PolarHBondContact O-N 3.43Å; F378-L394 HydrophobicContact CD1-CD2 3.76Å; F378-L394 HydrophobicContact CD1-CG 4.4Å; F378-L394 HydrophobicContact CE1-CD2 4.49Å; F378-E400 HydrophobicContact CD1-CG 4.13Å; F378-E400 HydrophobicContact CE1-CG 3.87Å; F378-Q430 HydrophobicContact CB-CG 4.4Å; F378-Q430 HydrophobicContact CD1-CG 3.64Å; F378-Q430 HydrophobicContact CD2-CG 4.47Å; F378-Q430 HydrophobicContact CE1-CG 3.99Å; F378-Q430 HydrophobicContact CG-CG 3.92Å; F378-Y433 HydrophobicContact CB-CD1 4.25Å; F378-Y433 HydrophobicContact CB-CE1 4.2Å; F378-Y433 HydrophobicContact CD1-CE1 4.25Å; F378-Y433 WeakPolarHBondContact O-CD1 3.4Å
379	G	98.1	Very high	97.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.			trans	-78	141.4	-179.4	0	0	0	0	0	114.3	T375 Y390 G391	T375-G379 WeakPolarHBondContact O-CA 3.28Å; T375-G379 PolarHBondContact O-N 3.29Å; G379-Y390 WeakPolarHBondContact O-CD1 3.49Å; G379-Y390 PolarHBondContact O-N 2.87Å; G379-Y390 VanDerWaalsContact O-N 3.11Å; G379-G391 PolarHBondContact O-N 2.93Å
380	L	98.7	Very high	97.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	152.5	169.8	-64.8	179.5	0	0	0	110.2	K388 A389 Y390 L394 L405 Y433 F434 V435 S436	L380-K388 CarbonylContact C-O 3.41Å; L380-K388 WeakPolarHBondContact CA-O 3.47Å; L380-A389 HydrophobicContact CD2-CB 4.18Å; L380-Y390 VanDerWaalsContact C-CE1 3.47Å; L380-Y390 WeakPolarHBondContact O-CE1 3.39Å; L380-L394 HydrophobicContact CD2-CD1 3.5Å; L380-L394 HydrophobicContact CG-CD1 4.29Å; L380-L405 HydrophobicContact CD1-CD2 4.37Å; L380-L405 HydrophobicContact CD2-CD2 3.72Å; L380-Y433 HydrophobicContact CD1-CG 4.11Å; L380-F434 PolarHBondContact N-O 3.13Å; L380-V435 HydrophobicContact CB-CG2 3.93Å; L380-V435 HydrophobicContact CD1-CG2 4.35Å; L380-V435 CarbonylContact O-C 3.5Å; L380-V435 VanDerWaalsContact O-CA 3.25Å; L380-V435 WeakPolarHBondContact O-CA 3.38Å; L380-S436 PolarHBondContact O-N 3.02Å
381	C	98.3	Very high	97.2	Very high	4 Å²	4	32.8 Å²	32.8	3%	0.027	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160	173.6	68	0	0	0	0	111.5	C250 L387 K388 Y390 S436 F439	C250-C381 VanDerWaalsContact CB-SG 3.52Å; C381-L387 WeakPolarHBondContact O-CA 3.31Å; C381-K388 PolarHBondContact N-O 2.9Å; C381-K388 PolarHBondContact O-N 2.95Å; C381-Y390 HydrophobicContact CB-CD1 3.79Å; C381-Y390 HydrophobicContact CB-CE1 4.21Å; C381-S436 VanDerWaalsContact CA-O 3.26Å; C381-S436 WeakPolarHBondContact CA-O 3.35Å; C381-F439 HydrophobicContact CB-CE1 4.49Å
382	K	97	Very high	97.2	Very high	93 Å²	93	32.8 Å²	32.8	40%	0.404	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.7	175.5	-163.7	174	-176.7	176.2	0	110.6	E386 V435 S436	K382-E386 CarbonylContact C-O 3.52Å; K382-E386 WeakPolarHBondContact CA-O 3.43Å; K382-V435 HydrophobicContact CB-CG1 4.32Å; K382-S436 PolarHBondContact N-O 3.28Å
383	Q	95.3	Very high	97	Very high	37 Å²	37	32.4 Å²	32.4	17%	0.173	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	121.2	175.8	-65.5	-169.6	-33.2	0	0	109.4	E252 G385 E386 K388	E252-Q383 PolarHBondContact OE2-NE2 2.73Å; Q383-G385 PolarHBondContact O-N 3.04Å; Q383-G385 VanDerWaalsContact O-N 3.11Å; Q383-E386 PolarHBondContact N-O 3.04Å; Q383-E386 PolarHBondContact O-N 2.89Å; Q383-K388 HydrophobicContact CB-CG 4.27Å
384	N	92.9	Very high	97	Very high	177 Å²	177	30.6 Å²	30.6	95%	0.947	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	31	-178.1	-54.8	-40.9	0	0	0	114.1	E386	N384-E386 VanDerWaalsContact C-N 3.31Å
385	G	91.5	Very high	96.9	Very high	61 Å²	61	30.5 Å²	30.5	63%	0.629	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.6	-6.5	-177.8	0	0	0	0	0	115.1	Q383	Q383-G385 PolarHBondContact O-N 3.04Å; Q383-G385 VanDerWaalsContact O-N 3.11Å
386	E	95.6	Very high	96.8	Very high	118 Å²	118	30.8 Å²	30.8	55%	0.551	17%	0.168	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	152.7	175.8	-61.8	-175.5	172.3	0	0	111.7	K382 Q383 N384 K388	K382-E386 CarbonylContact C-O 3.52Å; K382-E386 WeakPolarHBondContact CA-O 3.43Å; Q383-E386 PolarHBondContact N-O 3.04Å; Q383-E386 PolarHBondContact O-N 2.89Å; N384-E386 VanDerWaalsContact C-N 3.31Å; E386-K388 WeakPolarHBondContact OE2-CE 3.22Å; E386-K388 IonicContact OE2-NZ 3.55Å; E386-K388 PolarHBondContact OE2-NZ 2.96Å
387	L	97.5	Very high	96.5	Very high	65 Å²	65	32 Å²	32	34%	0.34	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.7	169.6	-63.8	179.2	0	0	0	110.2	C381 L405 V411 V435	C381-L387 WeakPolarHBondContact O-CA 3.31Å; L387-L405 HydrophobicContact CB-CD2 3.83Å; L387-V411 HydrophobicContact CD1-CG1 4.08Å; L387-V435 HydrophobicContact CD2-CB 4.38Å; L387-V435 HydrophobicContact CD2-CG1 3.66Å; L387-V435 HydrophobicContact CD2-CG2 3.73Å
388	K	98.4	Very high	96.2	Very high	30 Å²	30	35.6 Å²	35.6	13%	0.13	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.3	174.4	-59	-66.3	170.2	-174.2	0	110.2	T247 H248 C250 L380 C381 Q383 E386	T247-K388 PolarHBondContact O-NZ 3.11Å; H248-K388 CarbonylContact O-C 3.54Å; H248-K388 WeakPolarHBondContact O-CA 3.35Å; C250-K388 HydrophobicContact CB-CB 4.09Å; L380-K388 CarbonylContact C-O 3.41Å; L380-K388 WeakPolarHBondContact CA-O 3.47Å; C381-K388 PolarHBondContact N-O 2.9Å; C381-K388 PolarHBondContact O-N 2.95Å; Q383-K388 HydrophobicContact CB-CG 4.27Å; E386-K388 WeakPolarHBondContact OE2-CE 3.22Å; E386-K388 IonicContact OE2-NZ 3.55Å; E386-K388 PolarHBondContact OE2-NZ 2.96Å
389	A	98.5	Very high	95.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.5	176	0	0	0	0	0	111.5	H248 C250 L380 L394 L395 L401	H248-A389 PolarHBondContact O-N 3.39Å; C250-A389 PolarHBondContact N-O 2.59Å; L380-A389 HydrophobicContact CD2-CB 4.18Å; A389-L394 HydrophobicContact CB-CB 3.89Å; A389-L394 HydrophobicContact CB-CD1 3.77Å; A389-L394 HydrophobicContact CB-CG 4.49Å; A389-L395 HydrophobicContact CB-CD2 4.2Å; A389-L395 HydrophobicContact CB-CG 4.49Å; A389-L401 HydrophobicContact CB-CD1 3.46Å; A389-L401 VanDerWaalsContact CB-CD1 3.46Å
390	Y	98.5	Very high	95.6	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	20%	0.195	C	C	.	.			trans	-128.8	-15.8	165.9	77	-98.7	0	0	0	112.8	M340 F346 T375 G379 L380 C381 L395 S436 F439	M340-Y390 WeakPolarHBondContact CG-O 3.46Å; F346-Y390 HydrophobicContact CD2-CD2 4.31Å; F346-Y390 HydrophobicContact CD2-CE2 4.5Å; F346-Y390 AromaticContact CE2-CD2 3.52Å; F346-Y390 HydrophobicContact CE2-CD2 3.52Å; F346-Y390 AromaticContact CE2-CE2 3.6Å; F346-Y390 HydrophobicContact CE2-CE2 3.6Å; F346-Y390 HydrophobicContact CZ-CD2 4.27Å; F346-Y390 HydrophobicContact CZ-CE2 4.4Å; T375-Y390 VanDerWaalsContact CA-OH 3.27Å; T375-Y390 WeakPolarHBondContact CA-OH 3.41Å; T375-Y390 WeakPolarHBondContact CB-OH 3.41Å; T375-Y390 WeakPolarHBondContact O-CE2 3.49Å; G379-Y390 WeakPolarHBondContact O-CD1 3.49Å; G379-Y390 PolarHBondContact O-N 2.87Å; G379-Y390 VanDerWaalsContact O-N 3.11Å; L380-Y390 VanDerWaalsContact C-CE1 3.47Å; L380-Y390 WeakPolarHBondContact O-CE1 3.39Å; C381-Y390 HydrophobicContact CB-CD1 3.79Å; C381-Y390 HydrophobicContact CB-CE1 4.21Å; Y390-L395 WeakPolarHBondContact O-CD1 3.31Å; Y390-S436 PolarHBondContact OH-OG 3.11Å; Y390-F439 AromaticContact CD1-CE1 3.67Å; Y390-F439 HydrophobicContact CD1-CE1 3.67Å; Y390-F439 HydrophobicContact CD1-CZ 4.19Å; Y390-F439 AromaticContact CD2-CE1 3.87Å; Y390-F439 HydrophobicContact CD2-CE1 3.87Å; Y390-F439 HydrophobicContact CD2-CZ 4.39Å; Y390-F439 AromaticContact CE1-CE1 3.96Å; Y390-F439 HydrophobicContact CE1-CE1 3.96Å; Y390-F439 HydrophobicContact CE2-CE1 4.19Å; Y390-F439 AromaticContact CG-CE1 3.6Å; Y390-F439 HydrophobicContact CG-CE1 3.6Å; Y390-F439 AromaticContact CG-CZ 3.9Å; Y390-F439 HydrophobicContact CG-CZ 3.9Å
391	G	98.3	Very high	95.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.			trans	-62	134.9	175.9	0	0	0	0	0	112.1	V376 E377 G379 G393 L394 L395	V376-G391 WeakPolarHBondContact O-CA 3.43Å; E377-G391 CarbonylContact O-C 3.59Å; E377-G391 WeakPolarHBondContact O-CA 3.35Å; G379-G391 PolarHBondContact O-N 2.93Å; G391-G393 PolarHBondContact O-N 3.23Å; G391-L394 WeakPolarHBondContact O-CB 3.31Å; G391-L394 PolarHBondContact O-N 3.39Å; G391-L394 VanDerWaalsContact O-N 3.12Å; G391-L395 WeakPolarHBondContact O-CG 3.43Å; G391-L395 PolarHBondContact O-N 2.83Å
392	A	97.5	Very high	95.4	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-38.9	-177.8	0	0	0	0	0	113.3	H337 V376 E377 L394 L395 S396	H337-A392 HydrophobicContact CB-CB 4.39Å; H337-A392 VanDerWaalsContact CD2-CB 3.47Å; H337-A392 WeakPolarHBondContact CD2-CB 3.45Å; H337-A392 WeakPolarHBondContact CE1-CB 3.29Å; H337-A392 WeakPolarHBondContact ND1-CB 3.47Å; H337-A392 VanDerWaalsContact NE2-CB 3.33Å; H337-A392 WeakPolarHBondContact NE2-CB 3.19Å; V376-A392 PolarHBondContact O-N 3.48Å; E377-A392 PolarHBondContact O-N 2.8Å; E377-A392 VanDerWaalsContact O-N 3.07Å; A392-L394 PolarHBondContact O-N 3.26Å; A392-L395 PolarHBondContact O-N 3.1Å; A392-S396 VanDerWaalsContact O-CB 3.32Å; A392-S396 WeakPolarHBondContact O-CB 3.49Å; A392-S396 PolarHBondContact O-N 3.18Å; A392-S396 PolarHBondContact O-OG 3.05Å
393	G	94.9	Very high	95.3	Very high	6 Å²	6	35.5 Å²	35.5	6%	0.062	20%	0.196	C	C	.	.	H	α-helix	trans	-59.1	-35.2	173.4	0	0	0	0	0	112.6	E377 G391 S397	E377-G393 WeakPolarHBondContact O-CA 3.41Å; E377-G393 PolarHBondContact O-N 3.07Å; G391-G393 PolarHBondContact O-N 3.23Å; G393-S397 WeakPolarHBondContact O-CB 3.43Å; G393-S397 PolarHBondContact O-N 3.45Å
394	L	96.2	Very high	95.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.2	-50.1	173.8	-52	-177.4	0	0	0	111	F378 L380 A389 G391 A392 S396 S397 E400 L401 Y433	F378-L394 HydrophobicContact CD1-CD2 3.76Å; F378-L394 HydrophobicContact CD1-CG 4.4Å; F378-L394 HydrophobicContact CE1-CD2 4.49Å; L380-L394 HydrophobicContact CD2-CD1 3.5Å; L380-L394 HydrophobicContact CG-CD1 4.29Å; A389-L394 HydrophobicContact CB-CB 3.89Å; A389-L394 HydrophobicContact CB-CD1 3.77Å; A389-L394 HydrophobicContact CB-CG 4.49Å; G391-L394 WeakPolarHBondContact O-CB 3.31Å; G391-L394 PolarHBondContact O-N 3.39Å; G391-L394 VanDerWaalsContact O-N 3.12Å; A392-L394 PolarHBondContact O-N 3.26Å; L394-S396 PolarHBondContact O-N 3.03Å; L394-S396 VanDerWaalsContact O-N 3.13Å; L394-S397 PolarHBondContact O-N 3.31Å; L394-S397 VanDerWaalsContact O-O 3.13Å; L394-E400 HydrophobicContact CD2-CB 4.24Å; L394-E400 HydrophobicContact CD2-CG 3.47Å; L394-E400 VanDerWaalsContact CD2-CG 3.47Å; L394-L401 HydrophobicContact CB-CD1 4.2Å; L394-L401 WeakPolarHBondContact O-CB 3.13Å; L394-Y433 HydrophobicContact CD2-CE1 3.74Å
395	L	97.4	Very high	95.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-72.5	-7.2	-173	-67.4	168	0	0	0	114	Y245 A249 H253 M340 A389 Y390 G391 A392	Y245-L395 HydrophobicContact CD1-CD2 4.22Å; Y245-L395 HydrophobicContact CE1-CB 4.41Å; Y245-L395 HydrophobicContact CE1-CD2 4.14Å; Y245-L395 VanDerWaalsContact CE1-O 3.28Å; Y245-L395 WeakPolarHBondContact CE1-O 3.25Å; Y245-L395 PolarHBondContact OH-O 2.9Å; A249-L395 HydrophobicContact CB-CD2 3.56Å; H253-L395 HydrophobicContact CB-CD1 4.48Å; H253-L395 VanDerWaalsContact CD2-CD1 3.43Å; H253-L395 WeakPolarHBondContact CD2-CD1 3.17Å; M340-L395 HydrophobicContact CG-CD1 4.4Å; A389-L395 HydrophobicContact CB-CD2 4.2Å; A389-L395 HydrophobicContact CB-CG 4.49Å; Y390-L395 WeakPolarHBondContact O-CD1 3.31Å; G391-L395 WeakPolarHBondContact O-CG 3.43Å; G391-L395 PolarHBondContact O-N 2.83Å; A392-L395 PolarHBondContact O-N 3.1Å
396	S	95.3	Very high	95.7	Very high	6 Å²	6	26.9 Å²	26.9	4%	0.042	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.6	177.7	62.6	0	0	0	0	114.5	H332 A392 L394	H332-S396 PolarHBondContact ND1-OG 3.46Å; A392-S396 VanDerWaalsContact O-CB 3.32Å; A392-S396 WeakPolarHBondContact O-CB 3.49Å; A392-S396 PolarHBondContact O-N 3.18Å; A392-S396 PolarHBondContact O-OG 3.05Å; L394-S396 PolarHBondContact O-N 3.03Å; L394-S396 VanDerWaalsContact O-N 3.13Å
397	S	91.6	Very high	95.7	Very high	29 Å²	29	30.9 Å²	30.9	20%	0.203	16%	0.159	C	C	.	.			trans	-126.7	110.7	179.1	179.2	0	0	0	0	110.2	G393 L394 G399 E400 L401	G393-S397 WeakPolarHBondContact O-CB 3.43Å; G393-S397 PolarHBondContact O-N 3.45Å; L394-S397 PolarHBondContact O-N 3.31Å; L394-S397 VanDerWaalsContact O-O 3.13Å; S397-G399 VanDerWaalsContact C-N 3.32Å; S397-G399 PolarHBondContact O-N 2.9Å; S397-E400 PolarHBondContact O-N 3.39Å; S397-E400 WeakPolarHBondContact OG-CB 3.48Å; S397-E400 PolarHBondContact OG-N 3.35Å; S397-L401 VanDerWaalsContact O-CB 3.28Å; S397-L401 WeakPolarHBondContact O-CB 3.33Å; S397-L401 PolarHBondContact O-N 3.5Å
398	Y	90.4	Very high	95.6	Very high	99 Å²	99	35.4 Å²	35.4	39%	0.388	18%	0.178	S	C	.	.	H	α-helix	trans	-55.1	-47.2	179.1	164	-93.2	0	0	0	112.3	T240 L244 M323 L401 L402	T240-Y398 HydrophobicContact CG2-CD2 3.66Å; T240-Y398 HydrophobicContact CG2-CE2 4.28Å; T240-Y398 HydrophobicContact CG2-CG 4.19Å; L244-Y398 HydrophobicContact CD1-CD2 3.38Å; L244-Y398 HydrophobicContact CD1-CE2 3.72Å; L244-Y398 HydrophobicContact CD1-CG 4.44Å; L244-Y398 HydrophobicContact CG-CD2 4.4Å; M323-Y398 VanDerWaalsContact CE-CB 3.4Å; M323-Y398 HydrophobicContact CE-CD1 3.92Å; M323-Y398 HydrophobicContact CE-CD2 4.36Å; M323-Y398 HydrophobicContact CE-CG 3.64Å; Y398-L401 PolarHBondContact O-N 3.43Å; Y398-L402 HydrophobicContact CD2-CD1 4.44Å; Y398-L402 HydrophobicContact CE1-CD1 3.89Å; Y398-L402 HydrophobicContact CE2-CD1 3.69Å; Y398-L402 HydrophobicContact CE2-CG 4.37Å; Y398-L402 WeakPolarHBondContact O-CG 3.28Å; Y398-L402 PolarHBondContact O-N 2.95Å; Y398-L402 VanDerWaalsContact OH-CD1 3.31Å; Y398-L402 WeakPolarHBondContact OH-CD1 3.43Å
399	G	91.2	Very high	95.5	Very high	13 Å²	13	34.6 Å²	34.6	13%	0.134	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-45.3	-176.9	0	0	0	0	0	112.3	S397 L401 L402 H403 Y429	S397-G399 VanDerWaalsContact C-N 3.32Å; S397-G399 PolarHBondContact O-N 2.9Å; G399-L401 VanDerWaalsContact C-N 3.34Å; G399-L401 PolarHBondContact O-N 2.71Å; G399-L402 PolarHBondContact O-N 2.95Å; G399-H403 VanDerWaalsContact O-CB 3.3Å; G399-H403 WeakPolarHBondContact O-CB 3.37Å; G399-H403 PolarHBondContact O-N 2.93Å; G399-Y429 WeakPolarHBondContact CA-OH 3.32Å
400	E	93.7	Very high	95.5	Very high	13 Å²	13	39.3 Å²	39.3	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-38.8	178.2	-155.9	81	-164.3	0	0	111.8	F378 L394 S397 L402 H403 S404 Y429 Q430 Y433	F378-E400 HydrophobicContact CD1-CG 4.13Å; F378-E400 HydrophobicContact CE1-CG 3.87Å; L394-E400 HydrophobicContact CD2-CB 4.24Å; L394-E400 HydrophobicContact CD2-CG 3.47Å; L394-E400 VanDerWaalsContact CD2-CG 3.47Å; S397-E400 PolarHBondContact O-N 3.39Å; S397-E400 WeakPolarHBondContact OG-CB 3.48Å; S397-E400 PolarHBondContact OG-N 3.35Å; E400-L402 PolarHBondContact O-N 2.78Å; E400-H403 PolarHBondContact O-N 3.23Å; E400-S404 VanDerWaalsContact O-CB 3.25Å; E400-S404 WeakPolarHBondContact O-CB 3.37Å; E400-S404 PolarHBondContact O-N 2.89Å; E400-S404 PolarHBondContact O-OG 2.94Å; E400-S404 VanDerWaalsContact O-OG 3.06Å; E400-Y429 VanDerWaalsContact OE1-CA 3.26Å; E400-Y429 WeakPolarHBondContact OE1-CA 3.37Å; E400-Y429 WeakPolarHBondContact OE2-CA 3.12Å; E400-Y429 WeakPolarHBondContact OE2-CD1 3.42Å; E400-Q430 PolarHBondContact OE1-N 3.19Å; E400-Y433 PolarHBondContact OE1-OH 2.76Å
401	L	95.6	Very high	95.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-45.1	179.2	-172.1	55	0	0	0	111.8	L244 H248 A389 L394 S397 Y398 G399 S404	L244-L401 HydrophobicContact CB-CD2 3.96Å; L244-L401 HydrophobicContact CD1-CD2 4.05Å; H248-L401 HydrophobicContact CB-CD1 3.77Å; H248-L401 HydrophobicContact CB-CD2 3.9Å; H248-L401 HydrophobicContact CB-CG 3.79Å; A389-L401 HydrophobicContact CB-CD1 3.46Å; A389-L401 VanDerWaalsContact CB-CD1 3.46Å; L394-L401 HydrophobicContact CB-CD1 4.2Å; L394-L401 WeakPolarHBondContact O-CB 3.13Å; S397-L401 VanDerWaalsContact O-CB 3.28Å; S397-L401 WeakPolarHBondContact O-CB 3.33Å; S397-L401 PolarHBondContact O-N 3.5Å; Y398-L401 PolarHBondContact O-N 3.43Å; G399-L401 VanDerWaalsContact C-N 3.34Å; G399-L401 PolarHBondContact O-N 2.71Å; L401-S404 PolarHBondContact O-OG 3.49Å; L401-S404 VanDerWaalsContact O-OG 3.04Å
402	L	95.5	Very high	95.5	Very high	60 Å²	60	46 Å²	46	31%	0.314	23%	0.23	S	C	.	.	H	α-helix	trans	-69.4	-42.9	176.7	-65.5	-174.9	0	0	0	111.6	L244 H248 Y398 G399 E400 L405 S406	L244-L402 HydrophobicContact CD1-CD2 4.06Å; L244-L402 HydrophobicContact CD1-CG 4.33Å; L244-L402 HydrophobicContact CD2-CD2 4.27Å; H248-L402 VanDerWaalsContact NE2-CD2 3.32Å; H248-L402 WeakPolarHBondContact NE2-CD2 3.42Å; Y398-L402 HydrophobicContact CD2-CD1 4.44Å; Y398-L402 HydrophobicContact CE1-CD1 3.89Å; Y398-L402 HydrophobicContact CE2-CD1 3.69Å; Y398-L402 HydrophobicContact CE2-CG 4.37Å; Y398-L402 WeakPolarHBondContact O-CG 3.28Å; Y398-L402 PolarHBondContact O-N 2.95Å; Y398-L402 VanDerWaalsContact OH-CD1 3.31Å; Y398-L402 WeakPolarHBondContact OH-CD1 3.43Å; G399-L402 PolarHBondContact O-N 2.95Å; E400-L402 PolarHBondContact O-N 2.78Å; L402-L405 PolarHBondContact O-N 3.4Å; L402-S406 PolarHBondContact O-N 3.41Å
403	H	95.8	Very high	95.5	Very high	30 Å²	30	49.3 Å²	49.3	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-48.8	179.4	179.8	74.7	0	0	0	111.9	G399 E400 L405 S406 E408 P409 Y429 Q430 Y433	G399-H403 VanDerWaalsContact O-CB 3.3Å; G399-H403 WeakPolarHBondContact O-CB 3.37Å; G399-H403 PolarHBondContact O-N 2.93Å; E400-H403 PolarHBondContact O-N 3.23Å; H403-L405 PolarHBondContact O-N 3.01Å; H403-L405 VanDerWaalsContact O-N 3.17Å; H403-S406 WeakPolarHBondContact O-CB 3.27Å; H403-S406 PolarHBondContact O-N 3.13Å; H403-S406 PolarHBondContact O-OG 2.91Å; H403-E408 IonicContact CE1-OE2 2.88Å; H403-E408 IonicContact ND1-OE2 3.7Å; H403-P409 WeakPolarHBondContact O-CD 3.11Å; H403-P409 WeakPolarHBondContact O-CG 3.43Å; H403-Y429 HydrophobicContact CB-CD2 3.76Å; H403-Y429 HydrophobicContact CB-CE2 4.27Å; H403-Y429 HydrophobicContact CB-CG 4.37Å; H403-Y429 AromaticContact CG-CD2 3.67Å; H403-Y429 AromaticContact ND1-CD2 3.92Å; H403-Q430 PolarHBondContact NE2-O 3.13Å; H403-Y433 PolarHBondContact CD2-OH 3.28Å
404	S	96.1	Very high	95.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-24.2	-176.5	66.1	0	0	0	0	114.7	E400 L401 Y433	E400-S404 VanDerWaalsContact O-CB 3.25Å; E400-S404 WeakPolarHBondContact O-CB 3.37Å; E400-S404 PolarHBondContact O-N 2.89Å; E400-S404 PolarHBondContact O-OG 2.94Å; E400-S404 VanDerWaalsContact O-OG 3.06Å; L401-S404 PolarHBondContact O-OG 3.49Å; L401-S404 VanDerWaalsContact O-OG 3.04Å; S404-Y433 VanDerWaalsContact CB-CZ 3.47Å
405	L	96.4	Very high	95.8	Very high	48 Å²	48	52.5 Å²	52.5	25%	0.251	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	8.6	178.2	-59.5	-173.1	0	0	0	113.1	H248 L380 L387 L402 H403	H248-L405 HydrophobicContact CB-CD1 3.83Å; L380-L405 HydrophobicContact CD1-CD2 4.37Å; L380-L405 HydrophobicContact CD2-CD2 3.72Å; L387-L405 HydrophobicContact CB-CD2 3.83Å; L402-L405 PolarHBondContact O-N 3.4Å; H403-L405 PolarHBondContact O-N 3.01Å; H403-L405 VanDerWaalsContact O-N 3.17Å
406	S	96	Very high	95.8	Very high	46 Å²	46	52.7 Å²	52.7	32%	0.322	27%	0.274	S	S	.	.	S	Bend	trans	-83.6	-177.1	172.7	78.8	0	0	0	0	111.9	L402 H403 E408 P409	L402-S406 PolarHBondContact O-N 3.41Å; H403-S406 WeakPolarHBondContact O-CB 3.27Å; H403-S406 PolarHBondContact O-N 3.13Å; H403-S406 PolarHBondContact O-OG 2.91Å; S406-E408 VanDerWaalsContact C-N 3.33Å; S406-E408 PolarHBondContact OG-N 3.02Å; S406-E408 VanDerWaalsContact OG-N 3.16Å; S406-P409 VanDerWaalsContact OG-CD 3.3Å; S406-P409 WeakPolarHBondContact OG-CD 3.4Å
407	E	94.3	Very high	95.9	Very high	202 Å²	202	56.4 Å²	56.4	94%	0.944	29%	0.291	S	S	*	.	S	Bend	trans	-86.9	-2.9	173.1	-61	-175.4	169.8	0	0	113
408	E	95.7	Very high	96.2	Very high	159 Å²	159	57.2 Å²	57.2	74%	0.743	30%	0.299	S	S	*	.	S	Bend	trans	-74.9	-47.8	-175.3	-61.4	-166.9	172.9	0	0	114.7	H403 S406	H403-E408 IonicContact CE1-OE2 2.88Å; H403-E408 IonicContact ND1-OE2 3.7Å; S406-E408 VanDerWaalsContact C-N 3.33Å; S406-E408 PolarHBondContact OG-N 3.02Å; S406-E408 VanDerWaalsContact OG-N 3.16Å
409	P	97.1	Very high	96.5	Very high	13 Å²	13	52.5 Å²	52.5	8%	0.084	28%	0.281	C	S	.	.	S	Bend	trans	-80.8	156.2	-176.2	33.8	-36.7	0	0	0	112.5	H403 S406 Y433	H403-P409 WeakPolarHBondContact O-CD 3.11Å; H403-P409 WeakPolarHBondContact O-CG 3.43Å; S406-P409 VanDerWaalsContact OG-CD 3.3Å; S406-P409 WeakPolarHBondContact OG-CD 3.4Å; P409-Y433 HydrophobicContact CB-CD2 3.59Å; P409-Y433 HydrophobicContact CB-CE2 3.47Å; P409-Y433 VanDerWaalsContact CB-CE2 3.47Å; P409-Y433 HydrophobicContact CG-CD2 3.83Å; P409-Y433 HydrophobicContact CG-CE2 3.71Å
410	E	97.9	Very high	96.8	Very high	100 Å²	100	52.1 Å²	52.1	47%	0.467	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.4	170.3	-168.2	-174.7	162.4	0	0	110.3	R412 P431 V432 Y433	E410-R412 VanDerWaalsContact CD-NE 3.28Å; E410-R412 HydrophobicContact CG-CG 4.36Å; E410-R412 IonicContact OE1-CZ 2.95Å; E410-R412 IonicContact OE1-NE 2.7Å; E410-R412 PolarHBondContact OE1-NE 2.71Å; E410-R412 IonicContact OE1-NH2 3.07Å; E410-R412 PolarHBondContact OE1-NH2 3.25Å; E410-R412 VanDerWaalsContact OE1-NH2 3.13Å; E410-R412 IonicContact OE2-CZ 3.65Å; E410-R412 IonicContact OE2-NE 3.53Å; E410-R412 IonicContact OE2-NH2 2.77Å; E410-R412 PolarHBondContact OE2-NH2 2.97Å; E410-P431 PolarHBondContact N-O 2.89Å; E410-V432 HydrophobicContact CB-CG2 4.28Å; E410-V432 CarbonylContact O-C 3.5Å; E410-V432 VanDerWaalsContact O-CA 3.3Å; E410-V432 WeakPolarHBondContact O-CA 3.29Å; E410-Y433 PolarHBondContact O-N 2.64Å
411	V	97.9	Very high	96.9	Very high	59 Å²	59	56.2 Å²	56.2	36%	0.358	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.8	-179.1	-178.1	0	0	0	0	109.5	L387 V435	L387-V411 HydrophobicContact CD1-CG1 4.08Å; V411-V435 HydrophobicContact CG1-CB 4.46Å; V411-V435 HydrophobicContact CG1-CG2 3.1Å
412	R	98.2	Very high	97	Very high	82 Å²	82	58 Å²	58	31%	0.309	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.4	-177.4	-60.7	-178.2	-173.1	154.6	10	111.4	E410 V432 Y433 F434 V435	E410-R412 VanDerWaalsContact CD-NE 3.28Å; E410-R412 HydrophobicContact CG-CG 4.36Å; E410-R412 IonicContact OE1-CZ 2.95Å; E410-R412 IonicContact OE1-NE 2.7Å; E410-R412 PolarHBondContact OE1-NE 2.71Å; E410-R412 IonicContact OE1-NH2 3.07Å; E410-R412 PolarHBondContact OE1-NH2 3.25Å; E410-R412 VanDerWaalsContact OE1-NH2 3.13Å; E410-R412 IonicContact OE2-CZ 3.65Å; E410-R412 IonicContact OE2-NE 3.53Å; E410-R412 IonicContact OE2-NH2 2.77Å; E410-R412 PolarHBondContact OE2-NH2 2.97Å; R412-V432 HydrophobicContact CG-CG1 4.33Å; R412-Y433 PolarHBondContact N-O 2.94Å; R412-F434 HydrophobicContact CB-CD1 4.07Å; R412-F434 HydrophobicContact CB-CE1 4.12Å; R412-F434 CarbonylContact O-C 3.58Å; R412-F434 VanDerWaalsContact O-CA 3.32Å; R412-F434 WeakPolarHBondContact O-CA 3.4Å; R412-V435 PolarHBondContact O-N 2.81Å
413	A	98.2	Very high	96.9	Very high	70 Å²	70	60 Å²	60	58%	0.579	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	138.7	171.2	0	0	0	0	0	110.4	D415 F434	A413-D415 PolarHBondContact O-N 2.65Å; A413-F434 WeakPolarHBondContact O-CD1 3.39Å
414	F	98.4	Very high	96.6	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.009	34%	0.337	C	S	.	.			trans	-65	116.1	177.9	178.8	-118.4	0	0	0	111.3	V371 T375 P416 A419 F434 V435 A442 K445	V371-F414 HydrophobicContact CG1-CE2 4.38Å; V371-F414 HydrophobicContact CG1-CZ 4.17Å; T375-F414 HydrophobicContact CG2-CD2 3.78Å; T375-F414 HydrophobicContact CG2-CE1 4.21Å; T375-F414 HydrophobicContact CG2-CE2 3.3Å; T375-F414 HydrophobicContact CG2-CG 4.43Å; T375-F414 HydrophobicContact CG2-CZ 3.54Å; F414-P416 HydrophobicContact CE1-CG 3.95Å; F414-P416 HydrophobicContact CE2-CG 4.46Å; F414-P416 HydrophobicContact CZ-CB 4.31Å; F414-P416 HydrophobicContact CZ-CG 3.75Å; F414-A419 HydrophobicContact CD2-CB 4.35Å; F414-A419 HydrophobicContact CE2-CB 4.05Å; F414-F434 HydrophobicContact CB-CB 4.27Å; F414-F434 HydrophobicContact CD2-CB 4.15Å; F414-V435 WeakPolarHBondContact CB-O 3.15Å; F414-V435 PolarHBondContact N-O 2.83Å; F414-A442 HydrophobicContact CD1-CB 3.95Å; F414-A442 HydrophobicContact CE1-CB 4.01Å; F414-K445 HydrophobicContact CD1-CD 4.36Å; F414-K445 WeakPolarHBondContact O-CD 2.97Å; F414-K445 PolarHBondContact O-NZ 3.47Å
415	D	98.2	Very high	96.1	Very high	72 Å²	72	65.4 Å²	65.4	39%	0.385	35%	0.349	S	S	.	.			trans	-131.3	119.2	168.6	175.1	-105.8	0	0	0	108	A413 E417 A418 A419	A413-D415 PolarHBondContact O-N 2.65Å; D415-E417 VanDerWaalsContact C-N 3.3Å; D415-E417 PolarHBondContact O-N 3.07Å; D415-E417 WeakPolarHBondContact OD1-CB 3.37Å; D415-E417 PolarHBondContact OD1-N 3.27Å; D415-A418 HydrophobicContact CB-CB 4.19Å; D415-A418 PolarHBondContact O-N 3.35Å; D415-A418 WeakPolarHBondContact OD1-CB 3.4Å; D415-A418 PolarHBondContact OD1-N 3.44Å; D415-A419 VanDerWaalsContact O-CB 3.32Å; D415-A419 WeakPolarHBondContact O-CB 3.41Å; D415-A419 PolarHBondContact O-N 3.12Å
416	P	97.6	Very high	95.5	Very high	4 Å²	4	66.8 Å²	66.8	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-32.9	-175	-25.5	32.7	0	0	0	114.6	F414 A420 K445 Y449	F414-P416 HydrophobicContact CE1-CG 3.95Å; F414-P416 HydrophobicContact CE2-CG 4.46Å; F414-P416 HydrophobicContact CZ-CB 4.31Å; F414-P416 HydrophobicContact CZ-CG 3.75Å; P416-A420 WeakPolarHBondContact O-CB 3.03Å; P416-A420 PolarHBondContact O-N 2.93Å; P416-K445 HydrophobicContact CG-CB 3.87Å; P416-Y449 HydrophobicContact CB-CD1 4.2Å; P416-Y449 HydrophobicContact CB-CD2 3.82Å; P416-Y449 HydrophobicContact CB-CG 3.62Å
417	E	97.1	Very high	94.8	Very high	84 Å²	84	72.3 Å²	72.3	39%	0.393	38%	0.377	S	S	.	.	H	α-helix	trans	-68.7	-45.6	179.6	-66.6	-72.8	175.2	0	0	110.7	D415 Y449 R452	D415-E417 VanDerWaalsContact C-N 3.3Å; D415-E417 PolarHBondContact O-N 3.07Å; D415-E417 WeakPolarHBondContact OD1-CB 3.37Å; D415-E417 PolarHBondContact OD1-N 3.27Å; E417-Y449 HydrophobicContact CG-CD2 4.08Å; E417-Y449 HydrophobicContact CG-CE2 4.36Å; E417-Y449 WeakPolarHBondContact OE1-CD2 3.33Å; E417-R452 IonicContact OE1-CZ 3.52Å; E417-R452 IonicContact OE1-NE 3.83Å; E417-R452 PolarHBondContact OE1-NE 3.24Å; E417-R452 IonicContact OE1-NH2 2.66Å; E417-R452 PolarHBondContact OE1-NH2 3.24Å
418	A	97.9	Very high	94.5	Very high	46 Å²	46	67 Å²	67	38%	0.38	36%	0.359	S	S	.	.	H	α-helix	trans	-66.6	-41.7	175.2	0	0	0	0	0	112.2	D415 Q422 F434	D415-A418 HydrophobicContact CB-CB 4.19Å; D415-A418 PolarHBondContact O-N 3.35Å; D415-A418 WeakPolarHBondContact OD1-CB 3.4Å; D415-A418 PolarHBondContact OD1-N 3.44Å; A418-Q422 PolarHBondContact O-N 3.19Å; A418-F434 HydrophobicContact CB-CE1 4.41Å
419	A	97.4	Very high	94.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-42.8	179.4	0	0	0	0	0	111.7	T370 F374 F414 D415 V421 Q422 F434	T370-A419 WeakPolarHBondContact CG2-O 3.34Å; F374-A419 HydrophobicContact CB-CB 4.4Å; F414-A419 HydrophobicContact CD2-CB 4.35Å; F414-A419 HydrophobicContact CE2-CB 4.05Å; D415-A419 VanDerWaalsContact O-CB 3.32Å; D415-A419 WeakPolarHBondContact O-CB 3.41Å; D415-A419 PolarHBondContact O-N 3.12Å; A419-V421 PolarHBondContact O-N 2.85Å; A419-V421 VanDerWaalsContact O-N 3.07Å; A419-Q422 PolarHBondContact O-N 3.48Å; A419-Q422 VanDerWaalsContact O-N 3.11Å; A419-F434 HydrophobicContact CB-CD1 4.46Å; A419-F434 HydrophobicContact CB-CD2 4.36Å; A419-F434 HydrophobicContact CB-CE1 4.2Å; A419-F434 HydrophobicContact CB-CE2 4.09Å; A419-F434 HydrophobicContact CB-CZ 3.99Å
420	A	96.9	Very high	94.1	Very high	4 Å²	4	64.4 Å²	64.4	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-57	-26.7	-176.7	0	0	0	0	0	114.8	K367 T370 V371 P416 Y449	K367-A420 HydrophobicContact CB-CB 3.9Å; K367-A420 HydrophobicContact CG-CB 4.14Å; T370-A420 WeakPolarHBondContact CB-O 3.36Å; V371-A420 HydrophobicContact CG2-CB 3.84Å; P416-A420 WeakPolarHBondContact O-CB 3.03Å; P416-A420 PolarHBondContact O-N 2.93Å; A420-Y449 HydrophobicContact CB-CE2 4.37Å; A420-Y449 WeakPolarHBondContact CB-OH 3.47Å
421	V	96.6	Very high	94	Very high	100 Å²	100	63.6 Å²	63.6	61%	0.606	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	2.2	-178	-58	0	0	0	0	113.2	A419 P423	A419-V421 PolarHBondContact O-N 2.85Å; A419-V421 VanDerWaalsContact O-N 3.07Å; V421-P423 VanDerWaalsContact O-CD 3.29Å; V421-P423 WeakPolarHBondContact O-CD 3.33Å
422	Q	97.1	Very high	94	Very high	37 Å²	37	61.2 Å²	61.2	17%	0.173	33%	0.33	C	S	.	.			trans	-71.1	122.4	178.5	172.4	61.5	53.4	0	0	109.6	T370 F374 A418 A419 F434	T370-Q422 WeakPolarHBondContact CG2-O 3.43Å; F374-Q422 HydrophobicContact CD2-CB 4.26Å; F374-Q422 HydrophobicContact CD2-CG 4.37Å; F374-Q422 HydrophobicContact CE1-CG 4.19Å; F374-Q422 HydrophobicContact CE2-CB 3.59Å; F374-Q422 HydrophobicContact CE2-CG 3.45Å; F374-Q422 VanDerWaalsContact CE2-CG 3.45Å; F374-Q422 WeakPolarHBondContact CE2-O 3.47Å; F374-Q422 HydrophobicContact CZ-CB 4.03Å; F374-Q422 HydrophobicContact CZ-CG 3.32Å; A418-Q422 PolarHBondContact O-N 3.19Å; A419-Q422 PolarHBondContact O-N 3.48Å; A419-Q422 VanDerWaalsContact O-N 3.11Å; Q422-F434 HydrophobicContact CB-CE2 4.16Å; Q422-F434 HydrophobicContact CB-CZ 4.32Å; Q422-F434 HydrophobicContact CG-CE2 4.06Å; Q422-F434 HydrophobicContact CG-CZ 4.49Å
423	P	93.3	Very high	94	Very high	102 Å²	102	57.3 Å²	57.3	66%	0.662	32%	0.315	S	S	*	.			trans	-64.5	143.3	173.3	-21.9	33.9	0	0	0	111.7	V421	V421-P423 VanDerWaalsContact O-CD 3.29Å; V421-P423 WeakPolarHBondContact O-CD 3.33Å
424	Y	90.1	Very high	94	Very high	90 Å²	90	54.1 Å²	54.1	35%	0.353	29%	0.289	S	S	.	.			trans	-141.2	172.6	173.5	67.6	-90.3	0	0	0	111.2	T370 W373 F374	T370-Y424 HydrophobicContact CG2-CD1 3.94Å; T370-Y424 HydrophobicContact CG2-CE1 3.89Å; W373-Y424 HydrophobicContact CB-CD1 4.5Å; W373-Y424 HydrophobicContact CB-CE1 4.21Å; W373-Y424 HydrophobicContact CB-CE2 4.49Å; W373-Y424 AromaticContact CD1-CD1 3.95Å; W373-Y424 AromaticContact CD1-CD2 3.79Å; W373-Y424 AromaticContact CD1-CG 3.59Å; W373-Y424 AromaticContact CD2-CD2 3.49Å; W373-Y424 HydrophobicContact CD2-CD2 3.49Å; W373-Y424 VanDerWaalsContact CD2-CD2 3.49Å; W373-Y424 AromaticContact CD2-CE2 3.45Å; W373-Y424 HydrophobicContact CD2-CE2 3.45Å; W373-Y424 VanDerWaalsContact CD2-CE2 3.45Å; W373-Y424 HydrophobicContact CD2-CG 4.1Å; W373-Y424 AromaticContact CE2-CD2 3.24Å; W373-Y424 AromaticContact CE2-CE2 3.71Å; W373-Y424 AromaticContact CE2-CG 3.84Å; W373-Y424 HydrophobicContact CE3-CD2 4.06Å; W373-Y424 AromaticContact CE3-CE2 3.61Å; W373-Y424 HydrophobicContact CE3-CE2 3.61Å; W373-Y424 HydrophobicContact CG-CD1 4.12Å; W373-Y424 AromaticContact CG-CD2 3.83Å; W373-Y424 HydrophobicContact CG-CD2 3.83Å; W373-Y424 HydrophobicContact CG-CE1 4.17Å; W373-Y424 AromaticContact CG-CE2 3.87Å; W373-Y424 HydrophobicContact CG-CE2 3.87Å; W373-Y424 AromaticContact CG-CG 3.95Å; W373-Y424 HydrophobicContact CG-CG 3.95Å; W373-Y424 HydrophobicContact CH2-CD2 4.16Å; W373-Y424 HydrophobicContact CH2-CE2 4.2Å; W373-Y424 AromaticContact CZ2-CD2 3.61Å; W373-Y424 HydrophobicContact CZ2-CD2 3.61Å; W373-Y424 HydrophobicContact CZ2-CE2 4.08Å; W373-Y424 HydrophobicContact CZ3-CD2 4.37Å; W373-Y424 AromaticContact CZ3-CE2 3.99Å; W373-Y424 HydrophobicContact CZ3-CE2 3.99Å; W373-Y424 AromaticContact NE1-CD2 3.45Å; W373-Y424 AromaticContact NE1-CG 3.53Å; F374-Y424 HydrophobicContact CE2-CD1 4.1Å; F374-Y424 HydrophobicContact CZ-CD1 4.47Å
425	Q	86.9	Confident	94	Very high	53 Å²	53	54.5 Å²	54.5	25%	0.248	29%	0.291	C	S	.	.			trans	-145.8	159.3	177.3	59.8	71.8	49	0	0	110.1	W373 T428 Q430	W373-Q425 WeakPolarHBondContact CZ2-O 3.43Å; Q425-T428 VanDerWaalsContact CD-OG1 3.22Å; Q425-T428 VanDerWaalsContact NE2-C 3.32Å; Q425-T428 PolarHBondContact NE2-O 2.63Å; Q425-T428 PolarHBondContact NE2-OG1 2.85Å; Q425-T428 PolarHBondContact OE1-OG1 3.23Å; Q425-Q430 PolarHBondContact O-NE2 3.4Å
426	D	81.9	Confident	94	Very high	77 Å²	77	51 Å²	51	41%	0.412	27%	0.273	S	S	.	.	S	Bend	trans	-111.3	7.3	-172.2	55.7	-2.2	0	0	0	114.1	K184 W373	K184-D426 IonicContact NZ-OD2 3.24Å; K184-D426 PolarHBondContact NZ-OD2 3.24Å; W373-D426 HydrophobicContact CH2-CB 3.94Å
427	Q	82	Confident	93.9	Very high	162 Å²	162	55.5 Å²	55.5	76%	0.757	29%	0.293	S	S	*	.	S	Bend	trans	-100.1	-35.5	-174.2	-58.5	-177.7	1.7	0	0	114.2
428	T	87.3	Confident	93.8	Very high	91 Å²	91	54 Å²	54	56%	0.558	29%	0.292	S	S	*	.	S	Bend	trans	-124.2	176.5	-176.8	65	0	0	0	0	111.4	Q425 Q430	Q425-T428 VanDerWaalsContact CD-OG1 3.22Å; Q425-T428 VanDerWaalsContact NE2-C 3.32Å; Q425-T428 PolarHBondContact NE2-O 2.63Å; Q425-T428 PolarHBondContact NE2-OG1 2.85Å; Q425-T428 PolarHBondContact OE1-OG1 3.23Å; T428-Q430 PolarHBondContact O-NE2 3.49Å
429	Y	92	Very high	93.6	Very high	115 Å²	115	52.6 Å²	52.6	45%	0.451	28%	0.277	S	S	.	.			trans	-64.7	146.8	175.7	-56.4	-15.7	0	0	0	111.3	G399 E400 H403	G399-Y429 WeakPolarHBondContact CA-OH 3.32Å; E400-Y429 VanDerWaalsContact OE1-CA 3.26Å; E400-Y429 WeakPolarHBondContact OE1-CA 3.37Å; E400-Y429 WeakPolarHBondContact OE2-CA 3.12Å; E400-Y429 WeakPolarHBondContact OE2-CD1 3.42Å; H403-Y429 HydrophobicContact CB-CD2 3.76Å; H403-Y429 HydrophobicContact CB-CE2 4.27Å; H403-Y429 HydrophobicContact CB-CG 4.37Å; H403-Y429 AromaticContact CG-CD2 3.67Å; H403-Y429 AromaticContact ND1-CD2 3.92Å
430	Q	94.3	Very high	93.4	Very high	3 Å²	3	55 Å²	55	1%	0.014	30%	0.295	C	S	.	.			trans	-69.2	132	-177.7	-52.9	-57.1	-67.9	0	0	110.2	F378 E400 H403 Q425 T428 V432 Y433	F378-Q430 HydrophobicContact CB-CG 4.4Å; F378-Q430 HydrophobicContact CD1-CG 3.64Å; F378-Q430 HydrophobicContact CD2-CG 4.47Å; F378-Q430 HydrophobicContact CE1-CG 3.99Å; F378-Q430 HydrophobicContact CG-CG 3.92Å; E400-Q430 PolarHBondContact OE1-N 3.19Å; H403-Q430 PolarHBondContact NE2-O 3.13Å; Q425-Q430 PolarHBondContact O-NE2 3.4Å; T428-Q430 PolarHBondContact O-NE2 3.49Å; Q430-V432 VanDerWaalsContact C-N 3.32Å; Q430-Y433 HydrophobicContact CB-CD1 4.42Å; Q430-Y433 HydrophobicContact CB-CE1 3.72Å; Q430-Y433 HydrophobicContact CB-CE2 4.14Å; Q430-Y433 HydrophobicContact CG-CE1 4.06Å; Q430-Y433 VanDerWaalsContact O-CE2 3.26Å; Q430-Y433 WeakPolarHBondContact O-CE2 3.44Å; Q430-Y433 PolarHBondContact O-OH 3.38Å
431	P	95.4	Very high	93.4	Very high	82 Å²	82	57.2 Å²	57.2	53%	0.532	31%	0.305	S	S	.	.	S	Bend	trans	-79.8	-17.9	175.1	31.5	-34.6	0	0	0	112.5	E410	E410-P431 PolarHBondContact N-O 2.89Å
432	V	97.5	Very high	93.4	Very high	9 Å²	9	52.5 Å²	52.5	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.6	-176.5	-176.8	0	0	0	0	109.8	F374 E410 R412 Q430 F434	F374-V432 WeakPolarHBondContact CE1-O 3.36Å; E410-V432 HydrophobicContact CB-CG2 4.28Å; E410-V432 CarbonylContact O-C 3.5Å; E410-V432 VanDerWaalsContact O-CA 3.3Å; E410-V432 WeakPolarHBondContact O-CA 3.29Å; R412-V432 HydrophobicContact CG-CG1 4.33Å; Q430-V432 VanDerWaalsContact C-N 3.32Å; V432-F434 HydrophobicContact CG1-CE2 4.35Å
433	Y	98.3	Very high	93.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.6	172.2	-62.6	-82.9	0	0	0	111.4	F378 L380 L394 E400 H403 S404 P409 E410 R412 Q430	F378-Y433 HydrophobicContact CB-CD1 4.25Å; F378-Y433 HydrophobicContact CB-CE1 4.2Å; F378-Y433 HydrophobicContact CD1-CE1 4.25Å; F378-Y433 WeakPolarHBondContact O-CD1 3.4Å; L380-Y433 HydrophobicContact CD1-CG 4.11Å; L394-Y433 HydrophobicContact CD2-CE1 3.74Å; E400-Y433 PolarHBondContact OE1-OH 2.76Å; H403-Y433 PolarHBondContact CD2-OH 3.28Å; S404-Y433 VanDerWaalsContact CB-CZ 3.47Å; P409-Y433 HydrophobicContact CB-CD2 3.59Å; P409-Y433 HydrophobicContact CB-CE2 3.47Å; P409-Y433 VanDerWaalsContact CB-CE2 3.47Å; P409-Y433 HydrophobicContact CG-CD2 3.83Å; P409-Y433 HydrophobicContact CG-CE2 3.71Å; E410-Y433 PolarHBondContact O-N 2.64Å; R412-Y433 PolarHBondContact N-O 2.94Å; Q430-Y433 HydrophobicContact CB-CD1 4.42Å; Q430-Y433 HydrophobicContact CB-CE1 3.72Å; Q430-Y433 HydrophobicContact CB-CE2 4.14Å; Q430-Y433 HydrophobicContact CG-CE1 4.06Å; Q430-Y433 VanDerWaalsContact O-CE2 3.26Å; Q430-Y433 WeakPolarHBondContact O-CE2 3.44Å; Q430-Y433 PolarHBondContact O-OH 3.38Å
434	F	98.6	Very high	93.5	Very high	3 Å²	3	51 Å²	51	1%	0.013	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.3	173.3	-73.3	-93.2	0	0	0	111.6	F374 L380 R412 A413 F414 A418 A419 Q422 V432	F374-F434 HydrophobicContact CB-CB 4.46Å; F374-F434 HydrophobicContact CB-CD2 3.64Å; F374-F434 HydrophobicContact CB-CE2 4.25Å; F374-F434 HydrophobicContact CB-CG 4.37Å; F374-F434 AromaticContact CD1-CD2 3.59Å; F374-F434 HydrophobicContact CD1-CD2 3.59Å; F374-F434 AromaticContact CD1-CE2 3.94Å; F374-F434 HydrophobicContact CD1-CE2 3.94Å; F374-F434 HydrophobicContact CD2-CD2 4.28Å; F374-F434 HydrophobicContact CD2-CE2 4.09Å; F374-F434 HydrophobicContact CE1-CD2 4.31Å; F374-F434 HydrophobicContact CE1-CE2 4.3Å; F374-F434 HydrophobicContact CE2-CE2 4.46Å; F374-F434 AromaticContact CG-CD2 3.56Å; F374-F434 HydrophobicContact CG-CD2 3.56Å; F374-F434 AromaticContact CG-CE2 3.82Å; F374-F434 HydrophobicContact CG-CE2 3.82Å; L380-F434 PolarHBondContact N-O 3.13Å; R412-F434 HydrophobicContact CB-CD1 4.07Å; R412-F434 HydrophobicContact CB-CE1 4.12Å; R412-F434 CarbonylContact O-C 3.58Å; R412-F434 VanDerWaalsContact O-CA 3.32Å; R412-F434 WeakPolarHBondContact O-CA 3.4Å; A413-F434 WeakPolarHBondContact O-CD1 3.39Å; F414-F434 HydrophobicContact CB-CB 4.27Å; F414-F434 HydrophobicContact CD2-CB 4.15Å; A418-F434 HydrophobicContact CB-CE1 4.41Å; A419-F434 HydrophobicContact CB-CD1 4.46Å; A419-F434 HydrophobicContact CB-CD2 4.36Å; A419-F434 HydrophobicContact CB-CE1 4.2Å; A419-F434 HydrophobicContact CB-CE2 4.09Å; A419-F434 HydrophobicContact CB-CZ 3.99Å; Q422-F434 HydrophobicContact CB-CE2 4.16Å; Q422-F434 HydrophobicContact CB-CZ 4.32Å; Q422-F434 HydrophobicContact CG-CE2 4.06Å; Q422-F434 HydrophobicContact CG-CZ 4.49Å; V432-F434 HydrophobicContact CG1-CE2 4.35Å
435	V	98.6	Very high	93.9	Very high	10 Å²	10	49.5 Å²	49.5	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122	-178.2	-174.7	0	0	0	0	110.5	L380 K382 L387 V411 R412 F414	L380-V435 HydrophobicContact CB-CG2 3.93Å; L380-V435 HydrophobicContact CD1-CG2 4.35Å; L380-V435 CarbonylContact O-C 3.5Å; L380-V435 VanDerWaalsContact O-CA 3.25Å; L380-V435 WeakPolarHBondContact O-CA 3.38Å; K382-V435 HydrophobicContact CB-CG1 4.32Å; L387-V435 HydrophobicContact CD2-CB 4.38Å; L387-V435 HydrophobicContact CD2-CG1 3.66Å; L387-V435 HydrophobicContact CD2-CG2 3.73Å; V411-V435 HydrophobicContact CG1-CB 4.46Å; V411-V435 HydrophobicContact CG1-CG2 3.1Å; R412-V435 PolarHBondContact O-N 2.81Å; F414-V435 WeakPolarHBondContact CB-O 3.15Å; F414-V435 PolarHBondContact N-O 2.83Å
436	S	97.7	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.2	169.4	-60.2	0	0	0	0	110.6	L380 C381 K382 Y390 S438	L380-S436 PolarHBondContact O-N 3.02Å; C381-S436 VanDerWaalsContact CA-O 3.26Å; C381-S436 WeakPolarHBondContact CA-O 3.35Å; K382-S436 PolarHBondContact N-O 3.28Å; Y390-S436 PolarHBondContact OH-OG 3.11Å; S436-S438 VanDerWaalsContact C-N 3.29Å; S436-S438 PolarHBondContact O-N 3.07Å
437	E	95.9	Very high	95.1	Very high	98 Å²	98	48.2 Å²	48.2	46%	0.458	25%	0.245	S	C	.	.	S	Bend	trans	-66.2	-36.3	174.8	-71.5	-63.5	143.4	0	0	111.3	D441	E437-D441 HydrophobicContact CB-CB 4.49Å
438	S	94.4	Very high	95.8	Very high	53 Å²	53	45.3 Å²	45.3	37%	0.371	24%	0.235	S	C	.	.			trans	-159	163.7	167.8	66.9	0	0	0	0	109.7	S436 S440 D441 A442	S436-S438 VanDerWaalsContact C-N 3.29Å; S436-S438 PolarHBondContact O-N 3.07Å; S438-S440 PolarHBondContact O-N 3.28Å; S438-D441 PolarHBondContact O-N 3.44Å; S438-D441 WeakPolarHBondContact OG-CB 3.36Å; S438-D441 PolarHBondContact OG-N 3.03Å; S438-D441 VanDerWaalsContact OG-N 3.09Å; S438-A442 PolarHBondContact O-N 2.84Å
439	F	92.9	Very high	96.3	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.066	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-28.5	173.8	-60.5	-45.4	0	0	0	113	E252 M340 T345 F346 C381 Y390 K443	E252-F439 HydrophobicContact CB-CE2 4.11Å; E252-F439 HydrophobicContact CG-CD2 4.21Å; E252-F439 HydrophobicContact CG-CE2 3.76Å; M340-F439 HydrophobicContact CE-CE1 4.19Å; M340-F439 HydrophobicContact CE-CE2 3.67Å; M340-F439 HydrophobicContact CE-CZ 3.4Å; M340-F439 VanDerWaalsContact CE-CZ 3.4Å; T345-F439 HydrophobicContact CG2-CB 3.62Å; F346-F439 HydrophobicContact CD2-CD1 4.2Å; F346-F439 HydrophobicContact CD2-CE1 4.12Å; C381-F439 HydrophobicContact CB-CE1 4.49Å; Y390-F439 AromaticContact CD1-CE1 3.67Å; Y390-F439 HydrophobicContact CD1-CE1 3.67Å; Y390-F439 HydrophobicContact CD1-CZ 4.19Å; Y390-F439 AromaticContact CD2-CE1 3.87Å; Y390-F439 HydrophobicContact CD2-CE1 3.87Å; Y390-F439 HydrophobicContact CD2-CZ 4.39Å; Y390-F439 AromaticContact CE1-CE1 3.96Å; Y390-F439 HydrophobicContact CE1-CE1 3.96Å; Y390-F439 HydrophobicContact CE2-CE1 4.19Å; Y390-F439 AromaticContact CG-CE1 3.6Å; Y390-F439 HydrophobicContact CG-CE1 3.6Å; Y390-F439 AromaticContact CG-CZ 3.9Å; Y390-F439 HydrophobicContact CG-CZ 3.9Å; F439-K443 WeakPolarHBondContact O-CB 3.35Å; F439-K443 PolarHBondContact O-N 3.38Å
440	S	94.8	Very high	96.4	Very high	52 Å²	52	36.7 Å²	36.7	36%	0.364	20%	0.196	S	C	.	.	H	α-helix	trans	-69.6	-43.9	174.3	-162.9	0	0	0	0	111.6	S438 K443 D444	S438-S440 PolarHBondContact O-N 3.28Å; S440-K443 PolarHBondContact O-N 2.95Å; S440-D444 VanDerWaalsContact O-CG 3.23Å; S440-D444 PolarHBondContact O-N 3.41Å
441	D	95.4	Very high	96.4	Very high	49 Å²	49	41 Å²	41	26%	0.262	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-47	175.4	174.6	69.5	0	0	0	111.3	E437 S438 K443 D444 K445	E437-D441 HydrophobicContact CB-CB 4.49Å; S438-D441 PolarHBondContact O-N 3.44Å; S438-D441 WeakPolarHBondContact OG-CB 3.36Å; S438-D441 PolarHBondContact OG-N 3.03Å; S438-D441 VanDerWaalsContact OG-N 3.09Å; D441-K443 VanDerWaalsContact C-N 3.32Å; D441-K443 PolarHBondContact O-N 3.2Å; D441-D444 PolarHBondContact O-N 2.93Å; D441-K445 WeakPolarHBondContact O-CB 3.49Å; D441-K445 WeakPolarHBondContact O-CG 3.38Å; D441-K445 PolarHBondContact O-N 2.73Å; D441-K445 WeakPolarHBondContact OD1-CE 3.44Å; D441-K445 IonicContact OD1-NZ 2.69Å; D441-K445 WeakPolarHBondContact OD2-CE 3.13Å; D441-K445 IonicContact OD2-NZ 3.71Å; D441-K445 PolarHBondContact OD2-NZ 2.62Å
442	A	96.5	Very high	96.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-43	177.1	0	0	0	0	0	112.1	F349 F414 S438 L446	F349-A442 HydrophobicContact CD2-CB 4.4Å; F349-A442 HydrophobicContact CE2-CB 4.1Å; F414-A442 HydrophobicContact CD1-CB 3.95Å; F414-A442 HydrophobicContact CE1-CB 4.01Å; S438-A442 PolarHBondContact O-N 2.84Å; A442-L446 VanDerWaalsContact O-CB 3.31Å; A442-L446 WeakPolarHBondContact O-CB 3.33Å; A442-L446 PolarHBondContact O-N 3.23Å
443	K	96.4	Very high	96.1	Very high	34 Å²	34	43.6 Å²	43.6	15%	0.148	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-45.1	175.4	-178.5	-163.6	70.5	-171.7	0	112.6	Q348 F349 D352 F439 S440 D441 L446 R447	Q348-K443 HydrophobicContact CB-CD 4.45Å; Q348-K443 HydrophobicContact CG-CD 4.12Å; F349-K443 HydrophobicContact CB-CB 4.41Å; F349-K443 HydrophobicContact CD2-CB 4.18Å; D352-K443 WeakPolarHBondContact OD2-CG 3.47Å; F439-K443 WeakPolarHBondContact O-CB 3.35Å; F439-K443 PolarHBondContact O-N 3.38Å; S440-K443 PolarHBondContact O-N 2.95Å; D441-K443 VanDerWaalsContact C-N 3.32Å; D441-K443 PolarHBondContact O-N 3.2Å; K443-L446 PolarHBondContact O-N 2.92Å; K443-R447 WeakPolarHBondContact O-CB 3.22Å; K443-R447 VanDerWaalsContact O-CG 3.31Å; K443-R447 WeakPolarHBondContact O-CG 3.47Å; K443-R447 PolarHBondContact O-N 3.34Å
444	D	97	Very high	95.6	Very high	73 Å²	73	51.8 Å²	51.8	39%	0.39	26%	0.263	S	S	.	.	H	α-helix	trans	-68.2	-40.1	-179.3	-64.9	-22.4	0	0	0	111	S440 D441 R447 N448	S440-D444 VanDerWaalsContact O-CG 3.23Å; S440-D444 PolarHBondContact O-N 3.41Å; D441-D444 PolarHBondContact O-N 2.93Å; D444-R447 PolarHBondContact O-N 3.01Å; D444-N448 VanDerWaalsContact O-CG 3.25Å; D444-N448 PolarHBondContact O-N 3.32Å; D444-N448 PolarHBondContact O-ND2 3.23Å
445	K	98.1	Very high	95.3	Very high	59 Å²	59	54.4 Å²	54.4	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-59.8	-47	171.3	-75.1	173.9	176.3	167.3	0	112.2	F414 P416 D441 R447 N448 Y449	F414-K445 HydrophobicContact CD1-CD 4.36Å; F414-K445 WeakPolarHBondContact O-CD 2.97Å; F414-K445 PolarHBondContact O-NZ 3.47Å; P416-K445 HydrophobicContact CG-CB 3.87Å; D441-K445 WeakPolarHBondContact O-CB 3.49Å; D441-K445 WeakPolarHBondContact O-CG 3.38Å; D441-K445 PolarHBondContact O-N 2.73Å; D441-K445 WeakPolarHBondContact OD1-CE 3.44Å; D441-K445 IonicContact OD1-NZ 2.69Å; D441-K445 WeakPolarHBondContact OD2-CE 3.13Å; D441-K445 IonicContact OD2-NZ 3.71Å; D441-K445 PolarHBondContact OD2-NZ 2.62Å; K445-R447 PolarHBondContact O-N 2.99Å; K445-N448 PolarHBondContact O-N 2.93Å; K445-Y449 WeakPolarHBondContact O-CB 3.5Å; K445-Y449 PolarHBondContact O-N 3.23Å
446	L	97.4	Very high	94.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-43.9	177.6	175.8	69	0	0	0	111.6	F349 D352 I353 V371 A442 K443 N448 Y449 A450	F349-L446 HydrophobicContact CD2-CB 4.34Å; F349-L446 HydrophobicContact CD2-CD2 3.7Å; F349-L446 HydrophobicContact CE2-CB 3.89Å; F349-L446 HydrophobicContact CE2-CD2 3.54Å; F349-L446 HydrophobicContact CE2-CG 4.27Å; F349-L446 HydrophobicContact CG-CD2 4.43Å; F349-L446 HydrophobicContact CZ-CD2 4.15Å; D352-L446 HydrophobicContact CB-CD2 4Å; I353-L446 HydrophobicContact CB-CD2 4.45Å; I353-L446 HydrophobicContact CD1-CD2 4.34Å; I353-L446 HydrophobicContact CG1-CD1 4.2Å; I353-L446 HydrophobicContact CG1-CD2 3.38Å; I353-L446 HydrophobicContact CG1-CG 4.42Å; V371-L446 HydrophobicContact CG1-CD1 4.09Å; A442-L446 VanDerWaalsContact O-CB 3.31Å; A442-L446 WeakPolarHBondContact O-CB 3.33Å; A442-L446 PolarHBondContact O-N 3.23Å; K443-L446 PolarHBondContact O-N 2.92Å; L446-N448 VanDerWaalsContact C-N 3.33Å; L446-N448 PolarHBondContact O-N 3.09Å; L446-Y449 HydrophobicContact CD1-CD1 4.48Å; L446-Y449 WeakPolarHBondContact O-CB 3.48Å; L446-Y449 PolarHBondContact O-N 3.28Å; L446-A450 VanDerWaalsContact O-CB 3.32Å; L446-A450 WeakPolarHBondContact O-CB 3.32Å; L446-A450 PolarHBondContact O-N 2.77Å
447	R	96.6	Very high	94.7	Very high	103 Å²	103	59.9 Å²	59.9	39%	0.389	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-42.5	177.2	-75.6	172.4	176.8	-161.7	-11.2	112	Q348 D352 K443 D444 K445 Y449 A450 S451	Q348-R447 VanDerWaalsContact CG-NH2 3.35Å; D352-R447 IonicContact OD1-NE 2.76Å; D352-R447 IonicContact OD1-NH2 3.78Å; D352-R447 PolarHBondContact OD1-NH2 2.91Å; D352-R447 IonicContact OD2-CZ 3.51Å; D352-R447 VanDerWaalsContact OD2-CZ 3.26Å; D352-R447 IonicContact OD2-NE 3.64Å; D352-R447 PolarHBondContact OD2-NE 3.15Å; D352-R447 IonicContact OD2-NH2 3.86Å; D352-R447 PolarHBondContact OD2-NH2 3.4Å; K443-R447 WeakPolarHBondContact O-CB 3.22Å; K443-R447 VanDerWaalsContact O-CG 3.31Å; K443-R447 WeakPolarHBondContact O-CG 3.47Å; K443-R447 PolarHBondContact O-N 3.34Å; D444-R447 PolarHBondContact O-N 3.01Å; K445-R447 PolarHBondContact O-N 2.99Å; R447-Y449 VanDerWaalsContact C-N 3.35Å; R447-A450 PolarHBondContact O-N 3.27Å; R447-S451 WeakPolarHBondContact O-CB 3.28Å; R447-S451 PolarHBondContact O-N 3.26Å
448	N	97.1	Very high	94.6	Very high	101 Å²	101	58.6 Å²	58.6	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-43	175.7	-70.6	-27.8	0	0	0	111.3	D444 K445 L446 S451	D444-N448 VanDerWaalsContact O-CG 3.25Å; D444-N448 PolarHBondContact O-N 3.32Å; D444-N448 PolarHBondContact O-ND2 3.23Å; K445-N448 PolarHBondContact O-N 2.93Å; L446-N448 VanDerWaalsContact C-N 3.33Å; L446-N448 PolarHBondContact O-N 3.09Å; N448-S451 PolarHBondContact O-N 3.19Å; N448-S451 PolarHBondContact O-OG 2.9Å
449	Y	96.7	Very high	94.7	Very high	7 Å²	7	57 Å²	57	3%	0.027	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-53	173.3	175.1	-99.1	0	0	0	112	K367 L368 P416 E417 A420 K445 L446 R447 S451 R452	K367-Y449 WeakPolarHBondContact CB-OH 3.49Å; L368-Y449 HydrophobicContact CD2-CE1 4.2Å; P416-Y449 HydrophobicContact CB-CD1 4.2Å; P416-Y449 HydrophobicContact CB-CD2 3.82Å; P416-Y449 HydrophobicContact CB-CG 3.62Å; E417-Y449 HydrophobicContact CG-CD2 4.08Å; E417-Y449 HydrophobicContact CG-CE2 4.36Å; E417-Y449 WeakPolarHBondContact OE1-CD2 3.33Å; A420-Y449 HydrophobicContact CB-CE2 4.37Å; A420-Y449 WeakPolarHBondContact CB-OH 3.47Å; K445-Y449 WeakPolarHBondContact O-CB 3.5Å; K445-Y449 PolarHBondContact O-N 3.23Å; L446-Y449 HydrophobicContact CD1-CD1 4.48Å; L446-Y449 WeakPolarHBondContact O-CB 3.48Å; L446-Y449 PolarHBondContact O-N 3.28Å; R447-Y449 VanDerWaalsContact C-N 3.35Å; Y449-S451 PolarHBondContact O-N 3.31Å; Y449-R452 WeakPolarHBondContact O-CB 3.44Å; Y449-R452 PolarHBondContact O-N 3.44Å
450	A	94.4	Very high	94.8	Very high	19 Å²	19	59.8 Å²	59.8	16%	0.157	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-28.6	-179.4	0	0	0	0	0	113.1	A356 L446 R447 R452 I453	A356-A450 HydrophobicContact CB-CB 3.77Å; L446-A450 VanDerWaalsContact O-CB 3.32Å; L446-A450 WeakPolarHBondContact O-CB 3.32Å; L446-A450 PolarHBondContact O-N 2.77Å; R447-A450 PolarHBondContact O-N 3.27Å; A450-R452 PolarHBondContact O-N 3.22Å; A450-I453 HydrophobicContact CB-CD1 4.37Å; A450-I453 WeakPolarHBondContact O-CB 3.4Å; A450-I453 PolarHBondContact O-N 3.35Å
451	S	93.7	Very high	94.8	Very high	92 Å²	92	58.6 Å²	58.6	64%	0.643	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18	176.3	79	0	0	0	0	113.7	R447 N448 Y449	R447-S451 WeakPolarHBondContact O-CB 3.28Å; R447-S451 PolarHBondContact O-N 3.26Å; N448-S451 PolarHBondContact O-N 3.19Å; N448-S451 PolarHBondContact O-OG 2.9Å; Y449-S451 PolarHBondContact O-N 3.31Å
452	R	93.4	Very high	94.8	Very high	132 Å²	132	57.8 Å²	57.8	50%	0.498	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.7	178	-61.9	-170.5	-79.1	-107.2	1.7	113.5	E417 Y449 A450 Q454	E417-R452 IonicContact OE1-CZ 3.52Å; E417-R452 IonicContact OE1-NE 3.83Å; E417-R452 PolarHBondContact OE1-NE 3.24Å; E417-R452 IonicContact OE1-NH2 2.66Å; E417-R452 PolarHBondContact OE1-NH2 3.24Å; Y449-R452 WeakPolarHBondContact O-CB 3.44Å; Y449-R452 PolarHBondContact O-N 3.44Å; A450-R452 PolarHBondContact O-N 3.22Å; R452-Q454 PolarHBondContact O-N 2.88Å; R452-Q454 PolarHBondContact O-NE2 2.93Å; R452-Q454 VanDerWaalsContact O-NE2 3.08Å
453	I	93.4	Very high	94.6	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.072	32%	0.316	C	S	.	.	S	Bend	trans	-63.5	120.5	178.9	-62	176.2	0	0	0	109	A356 A360 E364 L368 A450 R455	A356-I453 HydrophobicContact CB-CD1 3.97Å; A360-I453 HydrophobicContact CB-CG2 4.31Å; E364-I453 HydrophobicContact CB-CG2 4.4Å; E364-I453 HydrophobicContact CG-CG2 4.26Å; L368-I453 HydrophobicContact CD1-CD1 4.11Å; L368-I453 HydrophobicContact CD2-CD1 4.21Å; L368-I453 HydrophobicContact CG-CD1 4.36Å; A450-I453 HydrophobicContact CB-CD1 4.37Å; A450-I453 WeakPolarHBondContact O-CB 3.4Å; A450-I453 PolarHBondContact O-N 3.35Å; I453-R455 PolarHBondContact O-N 3.06Å
454	Q	89.4	Confident	94.3	Very high	172 Å²	172	69.1 Å²	69.1	80%	0.804	35%	0.345	S	S	*	.			trans	-78.7	116	-176	-63.2	-60.3	-50.3	0	0	110.9	R452	R452-Q454 PolarHBondContact O-N 2.88Å; R452-Q454 PolarHBondContact O-NE2 2.93Å; R452-Q454 VanDerWaalsContact O-NE2 3.08Å
455	R	90.8	Very high	94.1	Very high	59 Å²	59	69.9 Å²	69.9	22%	0.223	35%	0.352	C	S	.	.			trans	-148.4	152.8	170.1	47.8	170.3	-176.9	-158	-4.8	110.2	L355 L358 I453 F457	L355-R455 PolarHBondContact O-NH1 3.11Å; L358-R455 PolarHBondContact O-NH1 3.43Å; I453-R455 PolarHBondContact O-N 3.06Å; R455-F457 VanDerWaalsContact CD-O 3.28Å; R455-F457 WeakPolarHBondContact CD-O 3.25Å; R455-F457 VanDerWaalsContact CG-O 3.25Å; R455-F457 WeakPolarHBondContact CG-O 3.49Å; R455-F457 PolarHBondContact NE-O 3.33Å; R455-F457 PolarHBondContact O-N 3.06Å
456	P	91.1	Very high	94	Very high	97 Å²	97	70 Å²	70	63%	0.63	36%	0.356	S	S	*	.	S	Bend	trans	-74.5	5.5	-173.9	29.1	-33.2	0	0	0	114.4	V165	V165-P456 HydrophobicContact CG2-CG 3.53Å
457	F	93.4	Very high	93.9	Very high	28 Å²	28	70.6 Å²	70.6	12%	0.123	36%	0.361	C	S	.	.	S	Bend	trans	-154	164.6	-177.3	51.2	-104.7	0	0	0	111.2	V165 F168 R455 V459 V470 D472	V165-F457 HydrophobicContact CB-CE1 4.47Å; V165-F457 HydrophobicContact CG1-CE1 3.78Å; V165-F457 HydrophobicContact CG1-CZ 3.73Å; V165-F457 HydrophobicContact CG2-CE1 4.13Å; F168-F457 HydrophobicContact CE1-CE1 4.48Å; F168-F457 HydrophobicContact CE1-CE2 4.02Å; F168-F457 AromaticContact CE1-CZ 3.58Å; F168-F457 HydrophobicContact CE1-CZ 3.58Å; F168-F457 HydrophobicContact CZ-CE2 4.02Å; F168-F457 AromaticContact CZ-CZ 3.98Å; F168-F457 HydrophobicContact CZ-CZ 3.98Å; R455-F457 VanDerWaalsContact CD-O 3.28Å; R455-F457 WeakPolarHBondContact CD-O 3.25Å; R455-F457 VanDerWaalsContact CG-O 3.25Å; R455-F457 WeakPolarHBondContact CG-O 3.49Å; R455-F457 PolarHBondContact NE-O 3.33Å; R455-F457 PolarHBondContact O-N 3.06Å; F457-V459 HydrophobicContact CD2-CG1 3.77Å; F457-V459 HydrophobicContact CE2-CG1 3.74Å; F457-V470 HydrophobicContact CB-CG1 3.76Å; F457-V470 HydrophobicContact CD1-CG1 4.03Å; F457-V470 HydrophobicContact CD2-CG1 3.9Å; F457-V470 HydrophobicContact CG-CG1 3.62Å; F457-D472 HydrophobicContact CB-CB 3.87Å
458	S	93.7	Very high	93.9	Very high	71 Å²	71	66.1 Å²	66.1	50%	0.497	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	161.3	162.8	-67.2	0	0	0	0	110.6	L471	S458-L471 PolarHBondContact N-O 2.96Å; S458-L471 WeakPolarHBondContact O-CB 3.39Å; S458-L471 PolarHBondContact O-N 3.35Å
459	V	95.6	Very high	93.8	Very high	18 Å²	18	64.2 Å²	64.2	11%	0.109	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.3	176.4	-60.2	0	0	0	0	110.8	L355 L358 F457 I468 D469	L355-V459 HydrophobicContact CB-CG2 4.33Å; L355-V459 HydrophobicContact CD2-CG2 4.03Å; L355-V459 WeakPolarHBondContact O-CG2 3.39Å; L358-V459 HydrophobicContact CB-CG2 4.5Å; L358-V459 HydrophobicContact CD1-CG2 4.28Å; F457-V459 HydrophobicContact CD2-CG1 3.77Å; F457-V459 HydrophobicContact CE2-CG1 3.74Å; V459-I468 HydrophobicContact CB-CG2 3.71Å; V459-I468 HydrophobicContact CG1-CG2 3.94Å; V459-D469 WeakPolarHBondContact CA-O 3.48Å
460	K	94.8	Very high	93.7	Very high	75 Å²	75	64.6 Å²	64.6	33%	0.326	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.1	172.4	177.5	-173.3	174.9	-169.4	0	108.7	I468 D469 L471 S480	K460-I468 WeakPolarHBondContact O-CA 3.25Å; K460-D469 HydrophobicContact CB-CB 4.4Å; K460-D469 PolarHBondContact N-O 2.82Å; K460-D469 PolarHBondContact O-N 3.06Å; K460-L471 HydrophobicContact CB-CD1 4.19Å; K460-S480 WeakPolarHBondContact CD-OG 3.3Å; K460-S480 PolarHBondContact NZ-OG 3.3Å
461	F	96.3	Very high	93.7	Very high	27 Å²	27	65.2 Å²	65.2	12%	0.118	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.2	169.2	176.7	-109.5	0	0	0	110.1	F307 L355 P463 L466 I468	F307-F461 HydrophobicContact CB-CE2 4.38Å; F307-F461 HydrophobicContact CD1-CD2 4.22Å; F307-F461 AromaticContact CD1-CE2 3.88Å; F307-F461 HydrophobicContact CD1-CE2 3.88Å; L355-F461 HydrophobicContact CD2-CB 4.17Å; F461-P463 HydrophobicContact CD1-CB 4.44Å; F461-P463 HydrophobicContact CE1-CB 3.93Å; F461-L466 HydrophobicContact CZ-CD2 3.97Å; F461-I468 HydrophobicContact CB-CD1 4.09Å; F461-I468 HydrophobicContact CD2-CD1 4.01Å
462	D	94.4	Very high	93.6	Very high	31 Å²	31	65.6 Å²	65.6	17%	0.166	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	109.4	170.3	175.4	15.7	0	0	0	109.8	Y464 T465 L466 A467	D462-Y464 PolarHBondContact O-N 2.89Å; D462-Y464 WeakPolarHBondContact OD1-CB 3.38Å; D462-Y464 WeakPolarHBondContact OD1-CD2 3.26Å; D462-Y464 PolarHBondContact OD1-N 3.34Å; D462-T465 WeakPolarHBondContact OD2-CB 3.26Å; D462-T465 WeakPolarHBondContact OD2-CG2 3.5Å; D462-T465 PolarHBondContact OD2-N 3.18Å; D462-T465 PolarHBondContact OD2-OG1 3.48Å; D462-L466 VanDerWaalsContact O-CA 3.32Å; D462-L466 WeakPolarHBondContact O-CA 3.45Å; D462-L466 PolarHBondContact O-N 3.41Å; D462-A467 PolarHBondContact N-O 2.93Å; D462-A467 PolarHBondContact O-N 2.93Å
463	P	92.3	Very high	93.6	Very high	80 Å²	80	61 Å²	61	52%	0.519	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.9	-179.4	30.3	-35.8	0	0	0	113.5	F461 L466	F461-P463 HydrophobicContact CD1-CB 4.44Å; F461-P463 HydrophobicContact CE1-CB 3.93Å; P463-L466 WeakPolarHBondContact O-CD2 2.84Å
464	Y	91.4	Very high	93.7	Very high	194 Å²	194	64.8 Å²	64.8	76%	0.761	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-43	-179.9	-64.5	-78.2	0	0	0	111.8	D462	D462-Y464 PolarHBondContact O-N 2.89Å; D462-Y464 WeakPolarHBondContact OD1-CB 3.38Å; D462-Y464 WeakPolarHBondContact OD1-CD2 3.26Å; D462-Y464 PolarHBondContact OD1-N 3.34Å
465	T	92.6	Very high	93.8	Very high	88 Å²	88	63.3 Å²	63.3	54%	0.54	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-6.4	179.2	63.2	0	0	0	0	113.5	D462 A467	D462-T465 WeakPolarHBondContact OD2-CB 3.26Å; D462-T465 WeakPolarHBondContact OD2-CG2 3.5Å; D462-T465 PolarHBondContact OD2-N 3.18Å; D462-T465 PolarHBondContact OD2-OG1 3.48Å; T465-A467 PolarHBondContact O-N 3.26Å; T465-A467 WeakPolarHBondContact OG1-CB 3.38Å
466	L	95.1	Very high	93.8	Very high	63 Å²	63	62.4 Å²	62.4	33%	0.33	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	43.5	-175.1	-54.7	175.8	0	0	0	111.8	V172 F461 D462 P463	V172-L466 HydrophobicContact CB-CB 4.2Å; V172-L466 HydrophobicContact CG1-CB 3.6Å; V172-L466 HydrophobicContact CG1-CD1 4.06Å; V172-L466 HydrophobicContact CG1-CG 4.47Å; V172-L466 PolarHBondContact N-O 3.35Å; F461-L466 HydrophobicContact CZ-CD2 3.97Å; D462-L466 VanDerWaalsContact O-CA 3.32Å; D462-L466 WeakPolarHBondContact O-CA 3.45Å; D462-L466 PolarHBondContact O-N 3.41Å; P463-L466 WeakPolarHBondContact O-CD2 2.84Å
467	A	96.2	Very high	93.9	Very high	12 Å²	12	61.4 Å²	61.4	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	164	-173.9	0	0	0	0	0	112.1	R170 K171 D462 T465	R170-A467 CarbonylContact O-C 3.02Å; R170-A467 VanDerWaalsContact O-CA 3.27Å; R170-A467 WeakPolarHBondContact O-CA 3.38Å; R170-A467 WeakPolarHBondContact O-CB 3.39Å; K171-A467 HydrophobicContact CG-CB 4.25Å; D462-A467 PolarHBondContact N-O 2.93Å; D462-A467 PolarHBondContact O-N 2.93Å; T465-A467 PolarHBondContact O-N 3.26Å; T465-A467 WeakPolarHBondContact OG1-CB 3.38Å
468	I	97.1	Very high	93.8	Very high	9 Å²	9	67.1 Å²	67.1	5%	0.046	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.6	173.5	-58.7	-64.6	0	0	0	109	F168 R170 A306 F307 L355 L358 V459 K460 F461	F168-I468 HydrophobicContact CE2-CG2 4.16Å; R170-I468 PolarHBondContact O-N 3.46Å; A306-I468 HydrophobicContact CB-CD1 4.38Å; F307-I468 HydrophobicContact CE1-CD1 4.14Å; F307-I468 HydrophobicContact CE1-CG1 3.65Å; F307-I468 HydrophobicContact CE2-CG1 4.13Å; F307-I468 HydrophobicContact CZ-CD1 4.06Å; F307-I468 HydrophobicContact CZ-CG1 3.37Å; L355-I468 HydrophobicContact CD2-CD1 3.95Å; L358-I468 HydrophobicContact CD1-CB 4.4Å; L358-I468 HydrophobicContact CD1-CD1 3.65Å; L358-I468 HydrophobicContact CD1-CG1 3.69Å; L358-I468 HydrophobicContact CD1-CG2 3.91Å; V459-I468 HydrophobicContact CB-CG2 3.71Å; V459-I468 HydrophobicContact CG1-CG2 3.94Å; K460-I468 WeakPolarHBondContact O-CA 3.25Å; F461-I468 HydrophobicContact CB-CD1 4.09Å; F461-I468 HydrophobicContact CD2-CD1 4.01Å
469	D	94.3	Very high	93.5	Very high	61 Å²	61	72.5 Å²	72.5	33%	0.326	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	120.2	167.6	-74.2	-26.6	0	0	0	109.5	V459 K460 L471	V459-D469 WeakPolarHBondContact CA-O 3.48Å; K460-D469 HydrophobicContact CB-CB 4.4Å; K460-D469 PolarHBondContact N-O 2.82Å; K460-D469 PolarHBondContact O-N 3.06Å; D469-L471 HydrophobicContact CB-CD2 4.23Å
470	V	95.3	Very high	93.2	Very high	14 Å²	14	72.6 Å²	72.6	9%	0.085	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.2	171.9	-176.6	0	0	0	0	108.5	F168 F457 D472 T476	F168-V470 HydrophobicContact CE2-CG2 4.34Å; F168-V470 HydrophobicContact CZ-CG2 3.93Å; F457-V470 HydrophobicContact CB-CG1 3.76Å; F457-V470 HydrophobicContact CD1-CG1 4.03Å; F457-V470 HydrophobicContact CD2-CG1 3.9Å; F457-V470 HydrophobicContact CG-CG1 3.62Å; V470-D472 HydrophobicContact CG1-CB 4.12Å; V470-D472 PolarHBondContact O-N 3.32Å; V470-T476 PolarHBondContact O-OG1 3.45Å
471	L	93.9	Very high	93	Very high	32 Å²	32	74.1 Å²	74.1	17%	0.168	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	77.5	-177.4	-52.6	-179.1	0	0	0	109	S458 K460 D469 I477	S458-L471 PolarHBondContact N-O 2.96Å; S458-L471 WeakPolarHBondContact O-CB 3.39Å; S458-L471 PolarHBondContact O-N 3.35Å; K460-L471 HydrophobicContact CB-CD1 4.19Å; D469-L471 HydrophobicContact CB-CD2 4.23Å; L471-I477 HydrophobicContact CB-CG1 4.07Å
472	D	92.1	Very high	92.6	Very high	101 Å²	101	77.8 Å²	77.8	54%	0.54	39%	0.389	S	S	.	.			trans	-111.7	-2.8	-176	60.1	-0.3	0	0	0	113.7	F457 V470 T476	F457-D472 HydrophobicContact CB-CB 3.87Å; V470-D472 HydrophobicContact CG1-CB 4.12Å; V470-D472 PolarHBondContact O-N 3.32Å; D472-T476 PolarHBondContact N-OG1 3.49Å; D472-T476 PolarHBondContact OD1-OG1 3.44Å
473	S	93.3	Very high	92.2	Very high	35 Å²	35	78 Å²	78	25%	0.245	40%	0.398	C	S	.	.	S	Bend	trans	-146.8	156.3	-178	73.5	0	0	0	0	112.5	H475 T476 I477	S473-H475 PolarHBondContact O-N 2.81Å; S473-H475 VanDerWaalsContact O-N 3.11Å; S473-T476 PolarHBondContact N-OG1 3.3Å; S473-T476 PolarHBondContact O-N 3.2Å; S473-T476 PolarHBondContact O-OG1 3.48Å; S473-T476 PolarHBondContact OG-N 2.76Å; S473-T476 PolarHBondContact OG-OG1 3.12Å; S473-T476 VanDerWaalsContact OG-OG1 3.08Å; S473-I477 WeakPolarHBondContact O-CG1 3.46Å; S473-I477 PolarHBondContact O-N 2.76Å; S473-I477 VanDerWaalsContact O-N 3.08Å
474	P	94	Very high	92	Very high	94 Å²	94	76.9 Å²	76.9	61%	0.61	39%	0.39	S	S	*	.	H	α-helix	trans	-56	-29.4	174.5	-27.1	35.4	0	0	0	113.7	R478	P474-R478 WeakPolarHBondContact O-CB 3.26Å; P474-R478 PolarHBondContact O-N 3.49Å
475	H	91.7	Very high	92.1	Very high	140 Å²	140	72.9 Å²	72.9	65%	0.648	38%	0.378	S	S	*	.	H	α-helix	trans	-71.3	-46.1	179.3	-65.4	93.1	0	0	0	112	S473 I477 R478 R479	S473-H475 PolarHBondContact O-N 2.81Å; S473-H475 VanDerWaalsContact O-N 3.11Å; H475-I477 VanDerWaalsContact C-N 3.34Å; H475-R478 PolarHBondContact O-N 3.47Å; H475-R479 PolarHBondContact O-N 3.05Å; H475-R479 VanDerWaalsContact O-N 3.16Å
476	T	90.4	Very high	92.1	Very high	40 Å²	40	73.7 Å²	73.7	25%	0.245	38%	0.379	C	S	.	.	H	α-helix	trans	-67.7	-37.1	178	48.1	0	0	0	0	111.3	V470 D472 S473 S480	V470-T476 PolarHBondContact O-OG1 3.45Å; D472-T476 PolarHBondContact N-OG1 3.49Å; D472-T476 PolarHBondContact OD1-OG1 3.44Å; S473-T476 PolarHBondContact N-OG1 3.3Å; S473-T476 PolarHBondContact O-N 3.2Å; S473-T476 PolarHBondContact O-OG1 3.48Å; S473-T476 PolarHBondContact OG-N 2.76Å; S473-T476 PolarHBondContact OG-OG1 3.12Å; S473-T476 VanDerWaalsContact OG-OG1 3.08Å; T476-S480 PolarHBondContact O-N 2.85Å
477	I	93.2	Very high	92	Very high	77 Å²	77	76 Å²	76	40%	0.395	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-47.9	174	-64.1	165.2	0	0	0	111.4	L471 S473 H475 R479 S480 L481	L471-I477 HydrophobicContact CB-CG1 4.07Å; S473-I477 WeakPolarHBondContact O-CG1 3.46Å; S473-I477 PolarHBondContact O-N 2.76Å; S473-I477 VanDerWaalsContact O-N 3.08Å; H475-I477 VanDerWaalsContact C-N 3.34Å; I477-R479 VanDerWaalsContact C-N 3.35Å; I477-R479 PolarHBondContact O-N 3.1Å; I477-S480 WeakPolarHBondContact O-CB 3.42Å; I477-S480 PolarHBondContact O-N 2.76Å; I477-S480 VanDerWaalsContact O-N 3.13Å; I477-L481 HydrophobicContact CG2-CD1 4.1Å; I477-L481 HydrophobicContact CG2-CG 4.49Å; I477-L481 WeakPolarHBondContact O-CG 3.46Å; I477-L481 PolarHBondContact O-N 2.99Å
478	R	91.8	Very high	91.9	Very high	148 Å²	148	80.6 Å²	80.6	56%	0.558	41%	0.41	S	S	*	.	H	α-helix	trans	-59.3	-44.9	180	-176.3	178.7	-67.4	136.1	0.1	111.9	P474 H475 S480 L481 E482	P474-R478 WeakPolarHBondContact O-CB 3.26Å; P474-R478 PolarHBondContact O-N 3.49Å; H475-R478 PolarHBondContact O-N 3.47Å; R478-S480 VanDerWaalsContact C-N 3.27Å; R478-S480 PolarHBondContact O-N 2.93Å; R478-L481 WeakPolarHBondContact O-CB 3.21Å; R478-L481 PolarHBondContact O-N 3.19Å; R478-L481 VanDerWaalsContact O-N 3.09Å; R478-E482 PolarHBondContact O-N 2.92Å; R478-E482 VanDerWaalsContact O-N 3.1Å
479	R	88.1	Confident	91.9	Very high	184 Å²	184	85.5 Å²	85.5	69%	0.694	43%	0.433	S	S	*	.	H	α-helix	trans	-57.9	-40.6	176.2	-172.4	-173.5	-61.7	169.5	0.9	112	H475 I477 L481 E482	H475-R479 PolarHBondContact O-N 3.05Å; H475-R479 VanDerWaalsContact O-N 3.16Å; I477-R479 VanDerWaalsContact C-N 3.35Å; I477-R479 PolarHBondContact O-N 3.1Å; R479-L481 VanDerWaalsContact C-N 3.32Å; R479-L481 PolarHBondContact O-N 3.3Å; R479-E482 PolarHBondContact O-N 3.05Å
480	S	88.1	Confident	91.9	Very high	20 Å²	20	87.1 Å²	87.1	14%	0.14	45%	0.445	C	S	.	.	H	α-helix	trans	-67.8	-32	177.6	-172	0	0	0	0	112.8	K460 T476 I477 R478	K460-S480 WeakPolarHBondContact CD-OG 3.3Å; K460-S480 PolarHBondContact NZ-OG 3.3Å; T476-S480 PolarHBondContact O-N 2.85Å; I477-S480 WeakPolarHBondContact O-CB 3.42Å; I477-S480 PolarHBondContact O-N 2.76Å; I477-S480 VanDerWaalsContact O-N 3.13Å; R478-S480 VanDerWaalsContact C-N 3.27Å; R478-S480 PolarHBondContact O-N 2.93Å
481	L	90.8	Very high	92	Very high	106 Å²	106	91.9 Å²	91.9	56%	0.555	47%	0.469	S	S	*	.	H	α-helix	trans	-72.8	-32.4	177.1	-72.5	171	0	0	0	113.2	I477 R478 R479 G483 V484 Q485	I477-L481 HydrophobicContact CG2-CD1 4.1Å; I477-L481 HydrophobicContact CG2-CG 4.49Å; I477-L481 WeakPolarHBondContact O-CG 3.46Å; I477-L481 PolarHBondContact O-N 2.99Å; R478-L481 WeakPolarHBondContact O-CB 3.21Å; R478-L481 PolarHBondContact O-N 3.19Å; R478-L481 VanDerWaalsContact O-N 3.09Å; R479-L481 VanDerWaalsContact C-N 3.32Å; R479-L481 PolarHBondContact O-N 3.3Å; L481-G483 VanDerWaalsContact C-N 3.33Å; L481-G483 PolarHBondContact O-N 3.07Å; L481-V484 PolarHBondContact O-N 2.83Å; L481-Q485 PolarHBondContact O-N 2.79Å
482	E	89.2	Confident	92.1	Very high	105 Å²	105	92.8 Å²	92.8	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-56.6	-46.1	178	-73.2	165.4	-176.5	0	0	111.2	R478 R479 V484 Q485 D486	R478-E482 PolarHBondContact O-N 2.92Å; R478-E482 VanDerWaalsContact O-N 3.1Å; R479-E482 PolarHBondContact O-N 3.05Å; E482-V484 PolarHBondContact O-N 3.03Å; E482-Q485 WeakPolarHBondContact O-CB 3.25Å; E482-Q485 PolarHBondContact O-N 2.79Å; E482-Q485 VanDerWaalsContact O-N 3.15Å; E482-D486 PolarHBondContact O-N 2.8Å; E482-D486 VanDerWaalsContact O-N 3.12Å
483	G	84.6	Confident	92.3	Very high	35 Å²	35	94.7 Å²	94.7	36%	0.361	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-36.4	177	0	0	0	0	0	113.9	L481 Q485 D486 E487	L481-G483 VanDerWaalsContact C-N 3.33Å; L481-G483 PolarHBondContact O-N 3.07Å; G483-Q485 VanDerWaalsContact C-N 3.31Å; G483-D486 PolarHBondContact O-N 3.41Å; G483-E487 PolarHBondContact O-N 3.48Å; G483-E487 VanDerWaalsContact O-N 3.17Å
484	V	89.8	Confident	92.5	Very high	57 Å²	57	95.2 Å²	95.2	35%	0.345	49%	0.493	S	S	.	.	H	α-helix	trans	-67.5	-36.7	175.5	178.1	0	0	0	0	110.7	L481 E482 D486 E487 L488	L481-V484 PolarHBondContact O-N 2.83Å; E482-V484 PolarHBondContact O-N 3.03Å; V484-D486 VanDerWaalsContact C-N 3.33Å; V484-D486 PolarHBondContact O-N 3.17Å; V484-E487 PolarHBondContact O-N 3.04Å; V484-L488 HydrophobicContact CG1-CD1 4.13Å; V484-L488 HydrophobicContact CG1-CG 4.37Å; V484-L488 WeakPolarHBondContact O-CB 3.32Å; V484-L488 WeakPolarHBondContact O-CG 3.31Å; V484-L488 PolarHBondContact O-N 2.89Å
485	Q	93.6	Very high	92.6	Very high	110 Å²	110	95.8 Å²	95.8	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-40.7	176.8	-171.9	179.4	-16.4	0	0	111.4	L481 E482 G483 L488 H489	L481-Q485 PolarHBondContact O-N 2.79Å; E482-Q485 WeakPolarHBondContact O-CB 3.25Å; E482-Q485 PolarHBondContact O-N 2.79Å; E482-Q485 VanDerWaalsContact O-N 3.15Å; G483-Q485 VanDerWaalsContact C-N 3.31Å; Q485-L488 PolarHBondContact O-N 2.89Å; Q485-H489 PolarHBondContact NE2-NE2 2.76Å; Q485-H489 PolarHBondContact O-CD2 3.47Å; Q485-H489 PolarHBondContact O-N 2.88Å
486	D	91.4	Very high	92.8	Very high	105 Å²	105	93.4 Å²	93.4	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-64.7	-41	176.2	-69.1	-22.2	0	0	0	112.4	E482 G483 V484 H489 T490	E482-D486 PolarHBondContact O-N 2.8Å; E482-D486 VanDerWaalsContact O-N 3.12Å; G483-D486 PolarHBondContact O-N 3.41Å; V484-D486 VanDerWaalsContact C-N 3.33Å; V484-D486 PolarHBondContact O-N 3.17Å; D486-H489 PolarHBondContact O-N 2.75Å; D486-T490 PolarHBondContact O-N 3.33Å; D486-T490 PolarHBondContact O-OG1 2.84Å
487	E	93.1	Very high	93	Very high	112 Å²	112	95 Å²	95	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-45.6	173.8	-71.9	178.7	-172.9	0	0	111.4	G483 V484 H489 T490 L491	G483-E487 PolarHBondContact O-N 3.48Å; G483-E487 VanDerWaalsContact O-N 3.17Å; V484-E487 PolarHBondContact O-N 3.04Å; E487-H489 VanDerWaalsContact C-N 3.35Å; E487-H489 PolarHBondContact O-N 3.13Å; E487-T490 WeakPolarHBondContact O-CB 3.35Å; E487-T490 PolarHBondContact O-N 3.41Å; E487-L491 WeakPolarHBondContact O-CG 3.39Å; E487-L491 PolarHBondContact O-N 2.86Å
488	L	95.4	Very high	93.1	Very high	107 Å²	107	98.2 Å²	98.2	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-62.4	-40.3	176.5	-73.6	173.6	0	0	0	112	V484 Q485 T490 L491 A492	V484-L488 HydrophobicContact CG1-CD1 4.13Å; V484-L488 HydrophobicContact CG1-CG 4.37Å; V484-L488 WeakPolarHBondContact O-CB 3.32Å; V484-L488 WeakPolarHBondContact O-CG 3.31Å; V484-L488 PolarHBondContact O-N 2.89Å; Q485-L488 PolarHBondContact O-N 2.89Å; L488-T490 VanDerWaalsContact C-N 3.33Å; L488-T490 PolarHBondContact O-N 3.12Å; L488-L491 PolarHBondContact O-N 2.94Å; L488-A492 VanDerWaalsContact O-CB 3.27Å; L488-A492 WeakPolarHBondContact O-CB 3.32Å; L488-A492 PolarHBondContact O-N 2.71Å
489	H	95.8	Very high	92.6	Very high	112 Å²	112	97.6 Å²	97.6	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-42.4	174.3	-82.9	-56.2	0	0	0	111.8	Q485 D486 E487 A492 H493	Q485-H489 PolarHBondContact NE2-NE2 2.76Å; Q485-H489 PolarHBondContact O-CD2 3.47Å; Q485-H489 PolarHBondContact O-N 2.88Å; D486-H489 PolarHBondContact O-N 2.75Å; E487-H489 VanDerWaalsContact C-N 3.35Å; E487-H489 PolarHBondContact O-N 3.13Å; H489-A492 PolarHBondContact O-N 2.69Å; H489-H493 WeakPolarHBondContact O-CB 3.3Å; H489-H493 PolarHBondContact O-N 3.34Å
490	T	95.7	Very high	92.8	Very high	95 Å²	95	93.3 Å²	93.3	58%	0.583	53%	0.534	S	S	*	.	H	α-helix	trans	-62.5	-46.2	177.1	-58.6	0	0	0	0	111.3	D486 E487 L488 H493 A494	D486-T490 PolarHBondContact O-N 3.33Å; D486-T490 PolarHBondContact O-OG1 2.84Å; E487-T490 WeakPolarHBondContact O-CB 3.35Å; E487-T490 PolarHBondContact O-N 3.41Å; L488-T490 VanDerWaalsContact C-N 3.33Å; L488-T490 PolarHBondContact O-N 3.12Å; T490-H493 PolarHBondContact O-N 3.4Å; T490-A494 WeakPolarHBondContact O-CB 3.33Å; T490-A494 PolarHBondContact O-N 2.88Å
491	L	96.1	Very high	93.1	Very high	114 Å²	114	97.2 Å²	97.2	60%	0.597	56%	0.555	S	S	*	*	H	α-helix	trans	-65.7	-40.3	177.7	-68.9	175.1	0	0	0	112.2	E487 L488 A494 L495	E487-L491 WeakPolarHBondContact O-CG 3.39Å; E487-L491 PolarHBondContact O-N 2.86Å; L488-L491 PolarHBondContact O-N 2.94Å; L491-A494 PolarHBondContact O-N 3.28Å; L491-L495 WeakPolarHBondContact O-CB 3.39Å; L491-L495 PolarHBondContact O-N 2.83Å
492	A	96.1	Very high	93.2	Very high	51 Å²	51	96.7 Å²	96.7	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-61.8	-45.4	175.7	0	0	0	0	0	111.2	L488 H489 L495 S496	L488-A492 VanDerWaalsContact O-CB 3.27Å; L488-A492 WeakPolarHBondContact O-CB 3.32Å; L488-A492 PolarHBondContact O-N 2.71Å; H489-A492 PolarHBondContact O-N 2.69Å; A492-L495 PolarHBondContact O-N 3.12Å; A492-S496 PolarHBondContact O-N 3Å; A492-S496 PolarHBondContact O-OG 3.19Å; A492-S496 VanDerWaalsContact O-OG 3.12Å
493	H	96.3	Very high	93.4	Very high	142 Å²	142	96.2 Å²	96.2	66%	0.657	56%	0.559	S	S	*	*	H	α-helix	trans	-62.7	-45.2	175.4	179.7	-86.4	0	0	0	112	H489 T490 L495 S496 A497	H489-H493 WeakPolarHBondContact O-CB 3.3Å; H489-H493 PolarHBondContact O-N 3.34Å; T490-H493 PolarHBondContact O-N 3.4Å; H493-L495 VanDerWaalsContact C-N 3.32Å; H493-L495 PolarHBondContact O-N 3.11Å; H493-S496 PolarHBondContact O-N 3.04Å; H493-A497 WeakPolarHBondContact O-CB 3.32Å; H493-A497 PolarHBondContact O-N 3.23Å
494	A	96.6	Very high	94	Very high	45 Å²	45	100 Å²	100	37%	0.372	57%	0.571	S	S	.	*	H	α-helix	trans	-59.8	-43	177	0	0	0	0	0	111.7	T490 L491 A497 I498	T490-A494 WeakPolarHBondContact O-CB 3.33Å; T490-A494 PolarHBondContact O-N 2.88Å; L491-A494 PolarHBondContact O-N 3.28Å; A494-A497 PolarHBondContact O-N 3.36Å; A494-I498 WeakPolarHBondContact O-CG1 3.3Å; A494-I498 PolarHBondContact O-N 3.16Å
495	L	96.3	Very high	94.3	Very high	106 Å²	106	102.9 Å²	102.9	56%	0.555	59%	0.586	S	S	*	*	H	α-helix	trans	-62.9	-47.3	175.7	-176.1	62.1	0	0	0	111	L491 A492 H493 A497 I498 S499	L491-L495 WeakPolarHBondContact O-CB 3.39Å; L491-L495 PolarHBondContact O-N 2.83Å; A492-L495 PolarHBondContact O-N 3.12Å; H493-L495 VanDerWaalsContact C-N 3.32Å; H493-L495 PolarHBondContact O-N 3.11Å; L495-A497 PolarHBondContact O-N 3.34Å; L495-I498 WeakPolarHBondContact O-CG1 3.47Å; L495-I498 PolarHBondContact O-N 3.26Å; L495-S499 WeakPolarHBondContact O-CB 3.36Å; L495-S499 PolarHBondContact O-N 3.48Å; L495-S499 PolarHBondContact O-OG 3.24Å
496	S	95.9	Very high	94.3	Very high	90 Å²	90	102.4 Å²	102.4	63%	0.629	59%	0.591	S	S	*	*	H	α-helix	trans	-62.7	-26.9	176.7	-63	0	0	0	0	113.8	A492 H493	A492-S496 PolarHBondContact O-N 3Å; A492-S496 PolarHBondContact O-OG 3.19Å; A492-S496 VanDerWaalsContact O-OG 3.12Å; H493-S496 PolarHBondContact O-N 3.04Å
497	A	95.9	Very high	94.5	Very high	75 Å²	75	102.2 Å²	102.2	62%	0.62	59%	0.594	S	S	*	*	H	α-helix	trans	-76.7	-22.1	178	0	0	0	0	0	113.6	H493 A494 L495	H493-A497 WeakPolarHBondContact O-CB 3.32Å; H493-A497 PolarHBondContact O-N 3.23Å; A494-A497 PolarHBondContact O-N 3.36Å; L495-A497 PolarHBondContact O-N 3.34Å
498	I	95.4	Very high	94.7	Very high	144 Å²	144	101.3 Å²	101.3	74%	0.738	60%	0.6	S	S	*	*	H	α-helix	trans	-110.6	-7.8	-179	67.5	178.4	0	0	0	113.8	A494 L495	A494-I498 WeakPolarHBondContact O-CG1 3.3Å; A494-I498 PolarHBondContact O-N 3.16Å; L495-I498 WeakPolarHBondContact O-CG1 3.47Å; L495-I498 PolarHBondContact O-N 3.26Å
499	S	80.5	Confident	94.6	Very high	135 Å²	135	100.8 Å²	100.8	94%	0.944	60%	0.603	S	S	*	*			trans	-88.8	0	172.4	-51.1	0	0	0	0	109.8	L495	L495-S499 WeakPolarHBondContact O-CB 3.36Å; L495-S499 PolarHBondContact O-N 3.48Å; L495-S499 PolarHBondContact O-OG 3.24Å

Retrieved 499 of 499 residues in 96.7 ms (Link to these results)

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