A0A077ZF79_TRITR Loading...

Serine:threonine protein kinase H1

AlphaFold DB , UniProt , Accession A0A077ZF79, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 445 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	31.9	Very low	27.1	Very low	249 Å²	249	148.1 Å²	148.1	100%	1.227	84%	0.844	S	S	*	*				0	118.9	0	-71.7	-151.7	-121.1	0	0	107.6
2	G	29.3	Very low	27.2	Very low	76 Å²	76	145.2 Å²	145.2	78%	0.784	84%	0.835	S	S	*	*			trans	-91.5	-168.1	-161.2	0	0	0	0	0	116.1
3	C	25.2	Very low	27.3	Very low	102 Å²	102	153.1 Å²	153.1	69%	0.689	84%	0.843	S	S	*	*			trans	84.2	87.1	170.5	-67.6	0	0	0	0	117.5
4	L	28.2	Very low	27.4	Very low	184 Å²	184	147 Å²	147	96%	0.963	83%	0.833	S	S	*	*			trans	-120.4	87.8	138.1	-76.9	172.3	0	0	0	107.9	S6	L4-S6 PolarHBondContact O-N 2.88Å
5	H	29.2	Very low	27.4	Very low	156 Å²	156	150.3 Å²	150.3	72%	0.722	84%	0.839	S	S	*	*			trans	-61.6	128.9	170	-86.2	-96.5	0	0	0	109.7	V7	H5-V7 PolarHBondContact O-N 2.83Å
6	S	26.1	Very low	27.6	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	82%	0.819	S	S	*	*			trans	-54.1	110.5	169.1	51.1	0	0	0	0	111.5	L4 S8	L4-S6 PolarHBondContact O-N 2.88Å; S6-S8 PolarHBondContact O-N 2.68Å
7	V	27	Very low	27.7	Very low	144 Å²	144	142.9 Å²	142.9	87%	0.873	81%	0.814	S	S	*	*			trans	-87.5	87.3	165.9	-176.6	0	0	0	0	107.6	H5	H5-V7 PolarHBondContact O-N 2.83Å
8	S	24.1	Very low	27.8	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	80%	0.799	S	S	*	*			trans	-121.1	71.7	164.3	76	0	0	0	0	109.7	S6	S6-S8 PolarHBondContact O-N 2.68Å
9	E	25.8	Very low	28.1	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	80%	0.797	S	S	*	*			trans	-103.2	99.7	167	-75.3	-171.2	162.9	0	0	109.4	C11	E9-C11 PolarHBondContact O-N 3.47Å
10	K	25.9	Very low	28.6	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.865	80%	0.795	S	S	*	*			trans	-59.9	120.8	165.7	-72.3	173.9	176.1	173.2	0	108.1	P12	K10-P12 VanDerWaalsContact O-CD 3.25Å; K10-P12 WeakPolarHBondContact O-CD 3.06Å
11	C	25.3	Very low	28.9	Very low	123 Å²	123	137.8 Å²	137.8	83%	0.831	79%	0.785	S	S	*	*			trans	-67.2	114.1	168.5	179.4	0	0	0	0	109.3	E9 R13	E9-C11 PolarHBondContact O-N 3.47Å; C11-R13 PolarHBondContact O-N 3.29Å
12	P	28.7	Very low	29.2	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	73%	0.731	S	S	*	*			trans	-83.8	115.5	178.1	30.9	-22.9	0	0	0	108.7	K10	K10-P12 VanDerWaalsContact O-CD 3.25Å; K10-P12 WeakPolarHBondContact O-CD 3.06Å
13	R	28.3	Very low	29.7	Very low	248 Å²	248	126.3 Å²	126.3	94%	0.936	72%	0.717	S	S	*	*			trans	25.5	113.2	158.1	-59.2	-177.8	-169.7	-173.9	3.2	117.3	C11	C11-R13 PolarHBondContact O-N 3.29Å
14	G	28.5	Very low	30.5	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	72%	0.717	S	S	*	*			trans	-152.3	70.9	162	0	0	0	0	0	109.9	I16	G14-I16 PolarHBondContact O-N 3.37Å
15	E	28	Very low	31.1	Very low	197 Å²	197	123.7 Å²	123.7	92%	0.921	69%	0.694	S	S	*	*			trans	-64.8	96.9	174.7	-70.5	-174.3	161.2	0	0	109.8	G17	E15-G17 PolarHBondContact O-N 3.21Å
16	I	30.7	Very low	31.5	Very low	102 Å²	102	117.6 Å²	117.6	52%	0.523	67%	0.666	S	S	.	*			trans	-83.6	96.3	169.7	-62.1	177	0	0	0	107.3	G14 L18	G14-I16 PolarHBondContact O-N 3.37Å; I16-L18 PolarHBondContact O-N 3.46Å
17	G	28.2	Very low	32	Very low	72 Å²	72	121.2 Å²	121.2	74%	0.742	67%	0.669	S	S	*	*			trans	-61.8	115.2	173	0	0	0	0	0	111.4	E15	E15-G17 PolarHBondContact O-N 3.21Å
18	L	30.7	Very low	32.5	Very low	104 Å²	104	121.7 Å²	121.7	55%	0.545	66%	0.661	S	S	.	*			trans	-74.9	129.2	166.9	-77.2	157.4	0	0	0	108.6	I16	I16-L18 PolarHBondContact O-N 3.46Å
19	K	32.5	Very low	33.5	Very low	175 Å²	175	118.4 Å²	118.4	76%	0.761	64%	0.64	S	S	*	*			trans	-61.8	136.2	171.3	-76.1	-170.9	177.4	-179	0	109.6	A21 A22	K19-A21 VanDerWaalsContact C-N 3.26Å; K19-A21 PolarHBondContact O-N 2.8Å; K19-A21 VanDerWaalsContact O-N 3.07Å; K19-A22 PolarHBondContact O-N 2.78Å
20	P	38.3	Very low	34.1	Very low	115 Å²	115	113 Å²	113	75%	0.747	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-32.1	-168.1	-28.1	33.9	0	0	0	115.8	A22 S23	P20-A22 VanDerWaalsContact C-N 3.27Å; P20-A22 PolarHBondContact O-N 2.8Å; P20-S23 PolarHBondContact O-N 3.21Å
21	A	35.9	Very low	34.6	Very low	71 Å²	71	106.3 Å²	106.3	59%	0.587	60%	0.601	S	S	*	*	H	α-helix	trans	-63	-28.9	-174.7	0	0	0	0	0	113.9	K19	K19-A21 VanDerWaalsContact C-N 3.26Å; K19-A21 PolarHBondContact O-N 2.8Å; K19-A21 VanDerWaalsContact O-N 3.07Å
22	A	37.3	Very low	34.8	Very low	11 Å²	11	107.1 Å²	107.1	9%	0.091	61%	0.606	C	S	.	*	H	α-helix	trans	-76.8	-21.9	-178.8	0	0	0	0	0	113.3	K19 P20 L26 I112	K19-A22 PolarHBondContact O-N 2.78Å; P20-A22 VanDerWaalsContact C-N 3.27Å; P20-A22 PolarHBondContact O-N 2.8Å; A22-L26 WeakPolarHBondContact O-CD1 3.41Å; A22-L26 WeakPolarHBondContact O-CG 3.25Å; A22-I112 HydrophobicContact CB-CG2 4.43Å
23	S	39.1	Very low	34.8	Very low	72 Å²	72	107 Å²	107	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-81.2	-28.5	-172.6	-179	0	0	0	0	114	P20	P20-S23 PolarHBondContact O-N 3.21Å
24	L	41.8	Very low	34.8	Very low	131 Å²	131	99.2 Å²	99.2	69%	0.686	60%	0.597	S	S	*	*	H	α-helix	trans	-73.7	-44.9	-171.7	-135.5	88.7	0	0	0	111.3	L26	L24-L26 VanDerWaalsContact C-N 3.29Å; L24-L26 PolarHBondContact O-N 2.87Å
25	H	41.7	Very low	34.6	Very low	101 Å²	101	103.5 Å²	103.5	47%	0.468	60%	0.603	S	S	.	*	H	α-helix	trans	-71.4	-17.7	-175.2	-63.6	-62.2	0	0	0	114.7	L115	H25-L115 HydrophobicContact CB-CD2 4.37Å
26	L	38.2	Very low	34.5	Very low	28 Å²	28	102.7 Å²	102.7	15%	0.147	60%	0.599	C	S	.	*	H	α-helix	trans	-80.7	-29.4	-176.3	-68.5	167	0	0	0	113.4	A22 L24 A29 P101 F102 I123	A22-L26 WeakPolarHBondContact O-CD1 3.41Å; A22-L26 WeakPolarHBondContact O-CG 3.25Å; L24-L26 VanDerWaalsContact C-N 3.29Å; L24-L26 PolarHBondContact O-N 2.87Å; L26-A29 PolarHBondContact O-N 3.1Å; L26-P101 HydrophobicContact CD1-CB 4.29Å; L26-F102 HydrophobicContact CD1-CE2 3.48Å; L26-F102 VanDerWaalsContact CD1-CE2 3.48Å; L26-F102 HydrophobicContact CD1-CZ 3.38Å; L26-F102 HydrophobicContact CD2-CE1 4.43Å; L26-F102 HydrophobicContact CD2-CZ 3.82Å; L26-F102 HydrophobicContact CG-CZ 4.25Å; L26-I123 HydrophobicContact CD2-CD1 4.14Å
27	K	35.8	Very low	34.3	Very low	182 Å²	182	101.6 Å²	101.6	79%	0.791	60%	0.6	S	S	*	*	H	α-helix	trans	-71.6	-34.6	179.6	-89.2	-175.4	173.5	-177.4	0	112.4	A29	K27-A29 VanDerWaalsContact C-N 3.3Å
28	E	38.6	Very low	34.5	Very low	154 Å²	154	104 Å²	104	72%	0.72	61%	0.605	S	S	*	*	H	α-helix	trans	-73.3	-24.1	177.2	-66.6	176.9	164	0	0	112.5
29	A	43.3	Very low	34.6	Very low	32 Å²	32	104.5 Å²	104.5	26%	0.264	62%	0.616	S	S	.	*	H	α-helix	trans	-84.3	-27.8	-173.1	0	0	0	0	0	114.7	L26 K27	L26-A29 PolarHBondContact O-N 3.1Å; K27-A29 VanDerWaalsContact C-N 3.3Å
30	F	39.8	Very low	34.7	Very low	76 Å²	76	99.6 Å²	99.6	33%	0.333	62%	0.615	S	S	.	*	S	Bend	trans	-137.8	61.6	-167.4	-57.5	-73.5	0	0	0	113.1	I123	F30-I123 HydrophobicContact CE2-CD1 3.53Å; F30-I123 HydrophobicContact CE2-CG1 4.27Å; F30-I123 HydrophobicContact CE2-CG2 4.38Å; F30-I123 HydrophobicContact CZ-CB 4.48Å; F30-I123 HydrophobicContact CZ-CD1 3.65Å; F30-I123 HydrophobicContact CZ-CG1 3.86Å; F30-I123 HydrophobicContact CZ-CG2 3.83Å
31	G	35	Very low	34.3	Very low	58 Å²	58	103.4 Å²	103.4	60%	0.598	62%	0.623	S	S	*	*			trans	-38.4	150.5	171.6	0	0	0	0	0	113.9	S33	G31-S33 PolarHBondContact O-N 3.27Å
32	C	29.9	Very low	34.1	Very low	139 Å²	139	108.4 Å²	108.4	94%	0.939	63%	0.628	S	S	*	*	S	Bend	trans	-65.5	22	-156.3	-145.2	0	0	0	0	118.1
33	S	29.9	Very low	33.6	Very low	112 Å²	112	113 Å²	113	78%	0.783	66%	0.658	S	S	*	*			trans	-108.8	83.8	-175.4	55.8	0	0	0	0	112.2	G31	G31-S33 PolarHBondContact O-N 3.27Å
34	A	26.7	Very low	33.3	Very low	83 Å²	83	115.7 Å²	115.7	69%	0.686	68%	0.677	S	S	*	*			trans	-150.3	60.5	163.1	0	0	0	0	0	110.8
35	L	25.9	Very low	32.8	Very low	159 Å²	159	113.8 Å²	113.8	83%	0.832	67%	0.674	S	S	*	*			trans	-140.1	112.6	172.3	-73.4	161.3	0	0	0	103.5
36	Q	24.7	Very low	32.6	Very low	180 Å²	180	117.6 Å²	117.6	84%	0.841	69%	0.69	S	S	*	*				176.1	152.9	75.3	-107.7	172.4	-31.7	0	0	109.9
37	C	27	Very low	33.3	Very low	79 Å²	79	122.2 Å²	122.2	53%	0.534	71%	0.711	S	S	.	*			trans	162.5	149.9	133.6	-173.4	0	0	0	0	109.6	R145	C37-R145 VanDerWaalsContact C-NH1 3.33Å; C37-R145 PolarHBondContact O-NH1 2.98Å; C37-R145 PolarHBondContact O-NH2 3.42Å
38	S	32.8	Very low	34.8	Very low	121 Å²	121	115.1 Å²	115.1	85%	0.846	68%	0.684	S	S	*	*			trans	-119.6	12.8	-148.2	34.1	0	0	0	0	117.8
39	C	31.9	Very low	36.1	Very low	115 Å²	115	108.7 Å²	108.7	78%	0.777	66%	0.656	S	S	*	*			trans	-109.8	43.3	-172.5	65.6	0	0	0	0	115.9	Q41	C39-Q41 PolarHBondContact O-N 3.26Å
40	G	34.4	Very low	37.5	Very low	72 Å²	72	107.2 Å²	107.2	74%	0.742	64%	0.644	S	S	*	*			trans	-67.2	92.6	-177.5	0	0	0	0	0	115.4
41	Q	30.4	Very low	39.1	Very low	195 Å²	195	108.5 Å²	108.5	91%	0.911	65%	0.65	S	S	*	*			trans	-121.3	124.8	163.2	-77.1	-167.9	-39.5	0	0	111.4	C39	C39-Q41 PolarHBondContact O-N 3.26Å
42	Y	32.7	Very low	40.9	Very low	177 Å²	177	107.9 Å²	107.9	69%	0.694	63%	0.632	S	S	*	*			trans	-103.2	144.1	-179.5	-84	-94.1	0	0	0	110.6
43	C	26.3	Very low	42.9	Very low	106 Å²	106	101.3 Å²	101.3	72%	0.716	59%	0.589	S	S	*	*			trans	-76.5	124.8	169	-172	0	0	0	0	109.8	S45	C43-S45 VanDerWaalsContact C-N 3.27Å; C43-S45 PolarHBondContact O-N 3.13Å; C43-S45 VanDerWaalsContact O-N 3.09Å
44	S	32.7	Very low	45.2	Very low	129 Å²	129	99 Å²	99	90%	0.902	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	29.1	-168	51.9	0	0	0	0	115.7
45	S	31.7	Very low	47.3	Very low	91 Å²	91	99.7 Å²	99.7	64%	0.636	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	7.3	-172.7	53.4	0	0	0	0	116.2	C43	C43-S45 VanDerWaalsContact C-N 3.27Å; C43-S45 PolarHBondContact O-N 3.13Å; C43-S45 VanDerWaalsContact O-N 3.09Å
46	F	36.6	Very low	49.1	Very low	181 Å²	181	96 Å²	96	79%	0.794	53%	0.533	S	S	*	.	S	Bend	trans	-126.5	116.9	170.9	-97.4	-97.3	0	0	0	110.1	S48	F46-S48 PolarHBondContact O-N 3.23Å
47	E	53.7	Low	51.1	Low	126 Å²	126	90 Å²	90	59%	0.589	51%	0.505	S	S	*	.			trans	-62.5	121.2	169	-73.6	-176.3	169.5	0	0	109	M52	E47-M52 HydrophobicContact CB-CG 4.33Å
48	S	66.6	Low	52.5	Low	33 Å²	33	96.6 Å²	96.6	23%	0.231	52%	0.519	C	S	.	.			trans	-68.3	144.3	178.6	66.4	0	0	0	0	110.3	F46 V50 Q51 M52	F46-S48 PolarHBondContact O-N 3.23Å; S48-V50 PolarHBondContact O-N 2.93Å; S48-Q51 WeakPolarHBondContact O-CB 3.36Å; S48-Q51 PolarHBondContact O-N 3.07Å; S48-Q51 VanDerWaalsContact OG-CG 3.27Å; S48-Q51 WeakPolarHBondContact OG-CG 3.39Å; S48-Q51 PolarHBondContact OG-N 3.24Å; S48-Q51 PolarHBondContact OG-OE1 2.9Å; S48-M52 PolarHBondContact O-N 2.94Å
49	P	66.7	Low	53.3	Low	18 Å²	18	98.5 Å²	98.5	12%	0.117	51%	0.514	C	S	.	.	H	α-helix	trans	-55.1	-26.4	175.6	-31.8	39.7	0	0	0	114	A53 E151 L155	P49-A53 WeakPolarHBondContact O-CB 3.23Å; P49-A53 PolarHBondContact O-N 2.89Å; P49-E151 WeakPolarHBondContact CB-O 3.35Å; P49-E151 HydrophobicContact CG-CB 4.06Å; P49-E151 HydrophobicContact CG-CG 4.43Å; P49-L155 HydrophobicContact CB-CB 4.07Å; P49-L155 HydrophobicContact CB-CD1 4.25Å; P49-L155 HydrophobicContact CG-CB 4.37Å; P49-L155 HydrophobicContact CG-CD1 4.35Å
50	V	72.4	Confident	53.6	Low	2 Å²	2	95.8 Å²	95.8	1%	0.012	51%	0.506	C	S	.	.	H	α-helix	trans	-66.3	-47.1	172.6	-176.8	0	0	0	0	111.7	S48 M52 A53 Q54 F150 L154 V171 Q173	S48-V50 PolarHBondContact O-N 2.93Å; V50-M52 VanDerWaalsContact C-N 3.31Å; V50-M52 PolarHBondContact O-N 3.23Å; V50-A53 PolarHBondContact O-N 2.78Å; V50-Q54 HydrophobicContact CG1-CG 4.39Å; V50-Q54 WeakPolarHBondContact O-CB 3.48Å; V50-Q54 VanDerWaalsContact O-CG 3.27Å; V50-Q54 WeakPolarHBondContact O-CG 3.18Å; V50-Q54 PolarHBondContact O-N 2.74Å; V50-F150 HydrophobicContact CG2-CE2 3.99Å; V50-L154 HydrophobicContact CG2-CD1 3.61Å; V50-V171 HydrophobicContact CG1-CG1 3.94Å; V50-Q173 HydrophobicContact CG1-CB 3.74Å; V50-Q173 VanDerWaalsContact CG1-OE1 3.3Å; V50-Q173 HydrophobicContact CG2-CB 4.44Å
51	Q	72.7	Confident	53.4	Low	102 Å²	102	97.6 Å²	97.6	48%	0.477	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-41.4	176.5	-74.8	164.9	-39.4	0	0	110.9	S48 A53 Q54 Q55	S48-Q51 WeakPolarHBondContact O-CB 3.36Å; S48-Q51 PolarHBondContact O-N 3.07Å; S48-Q51 VanDerWaalsContact OG-CG 3.27Å; S48-Q51 WeakPolarHBondContact OG-CG 3.39Å; S48-Q51 PolarHBondContact OG-N 3.24Å; S48-Q51 PolarHBondContact OG-OE1 2.9Å; Q51-A53 PolarHBondContact O-N 2.72Å; Q51-Q54 CarbonylContact O-C 3.52Å; Q51-Q54 PolarHBondContact O-N 3.38Å; Q51-Q55 WeakPolarHBondContact O-CB 3.05Å; Q51-Q55 PolarHBondContact O-N 3.3Å
52	M	73	Confident	53.2	Low	45 Å²	45	94.8 Å²	94.8	22%	0.222	50%	0.498	C	S	.	.	H	α-helix	trans	-59.1	-48.1	174.8	-62.7	-175.3	77.1	0	0	111.6	E47 S48 V50 Q54 Q55 Q56 L155	E47-M52 HydrophobicContact CB-CG 4.33Å; S48-M52 PolarHBondContact O-N 2.94Å; V50-M52 VanDerWaalsContact C-N 3.31Å; V50-M52 PolarHBondContact O-N 3.23Å; M52-Q54 VanDerWaalsContact C-N 3.31Å; M52-Q54 PolarHBondContact O-N 3.47Å; M52-Q55 PolarHBondContact O-N 3.18Å; M52-Q56 WeakPolarHBondContact O-CG 3.49Å; M52-Q56 PolarHBondContact O-N 3.43Å; M52-L155 HydrophobicContact SD-CD1 3.95Å
53	A	72.8	Confident	52.9	Low	2 Å²	2	91.5 Å²	91.5	2%	0.017	50%	0.496	C	S	.	.	H	α-helix	trans	-60.6	-40.6	176.8	0	0	0	0	0	111.8	P49 V50 Q51 Q57 L168 V171	P49-A53 WeakPolarHBondContact O-CB 3.23Å; P49-A53 PolarHBondContact O-N 2.89Å; V50-A53 PolarHBondContact O-N 2.78Å; Q51-A53 PolarHBondContact O-N 2.72Å; A53-Q57 VanDerWaalsContact O-CD 3.29Å; A53-Q57 WeakPolarHBondContact O-CG 3.23Å; A53-Q57 PolarHBondContact O-N 3.15Å; A53-Q57 PolarHBondContact O-NE2 2.96Å; A53-L168 HydrophobicContact CB-CD2 4.16Å; A53-V171 HydrophobicContact CB-CG2 3.95Å
54	Q	77.3	Confident	52.8	Low	64 Å²	64	95.3 Å²	95.3	30%	0.299	51%	0.506	S	S	.	.	H	α-helix	trans	-69.3	-32.9	176.6	-73.5	174.8	-13	0	0	113.2	V50 Q51 M52 V171	V50-Q54 HydrophobicContact CG1-CG 4.39Å; V50-Q54 WeakPolarHBondContact O-CB 3.48Å; V50-Q54 VanDerWaalsContact O-CG 3.27Å; V50-Q54 WeakPolarHBondContact O-CG 3.18Å; V50-Q54 PolarHBondContact O-N 2.74Å; Q51-Q54 CarbonylContact O-C 3.52Å; Q51-Q54 PolarHBondContact O-N 3.38Å; M52-Q54 VanDerWaalsContact C-N 3.31Å; M52-Q54 PolarHBondContact O-N 3.47Å; Q54-V171 PolarHBondContact NE2-O 2.99Å
55	Q	71.8	Confident	52.4	Low	97 Å²	97	96.5 Å²	96.5	45%	0.453	50%	0.502	S	S	.	.	H	α-helix	trans	-73.6	-41.2	179	-172.8	175.1	4.3	0	0	111.8	Q51 M52 Q57 R58	Q51-Q55 WeakPolarHBondContact O-CB 3.05Å; Q51-Q55 PolarHBondContact O-N 3.3Å; M52-Q55 PolarHBondContact O-N 3.18Å; Q55-Q57 PolarHBondContact O-N 3.31Å; Q55-R58 WeakPolarHBondContact O-CB 3.34Å; Q55-R58 PolarHBondContact O-N 3.32Å
56	Q	63.6	Low	52	Low	81 Å²	81	95.5 Å²	95.5	38%	0.379	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-30.8	175	-73.3	175.4	-20.3	0	0	112.1	M52 R58 Q59 S158	M52-Q56 WeakPolarHBondContact O-CG 3.49Å; M52-Q56 PolarHBondContact O-N 3.43Å; Q56-R58 VanDerWaalsContact C-N 3.34Å; Q56-R58 PolarHBondContact O-N 3.19Å; Q56-Q59 PolarHBondContact O-N 3.34Å; Q56-S158 PolarHBondContact OE1-O 3.26Å; Q56-S158 PolarHBondContact OE1-OG 3.01Å; Q56-S158 VanDerWaalsContact OE1-OG 3.12Å
57	Q	65.1	Low	51.2	Low	54 Å²	54	94.5 Å²	94.5	25%	0.252	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-33.2	173.9	-68.5	155.3	31.3	0	0	112.8	A53 Q55 Q59 G60 E170	A53-Q57 VanDerWaalsContact O-CD 3.29Å; A53-Q57 WeakPolarHBondContact O-CG 3.23Å; A53-Q57 PolarHBondContact O-N 3.15Å; A53-Q57 PolarHBondContact O-NE2 2.96Å; Q55-Q57 PolarHBondContact O-N 3.31Å; Q57-Q59 PolarHBondContact O-N 2.92Å; Q57-G60 PolarHBondContact O-N 2.85Å; Q57-E170 VanDerWaalsContact NE2-CA 3.32Å
58	R	57.7	Low	49.7	Very low	218 Å²	218	95.7 Å²	95.7	82%	0.823	52%	0.519	S	S	*	.	H	α-helix	trans	-69.1	-23.2	178.5	-66.4	-174.3	-179.1	-166.6	0	112.8	Q55 Q56	Q55-R58 WeakPolarHBondContact O-CB 3.34Å; Q55-R58 PolarHBondContact O-N 3.32Å; Q56-R58 VanDerWaalsContact C-N 3.34Å; Q56-R58 PolarHBondContact O-N 3.19Å
59	Q	49.9	Very low	47.5	Very low	161 Å²	161	100 Å²	100	75%	0.752	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-9	179.5	-65.3	-178.3	-11.3	0	0	113.2	Q56 Q57	Q56-Q59 PolarHBondContact O-N 3.34Å; Q57-Q59 PolarHBondContact O-N 2.92Å
60	G	36.8	Very low	45.3	Very low	58 Å²	58	108 Å²	108	60%	0.598	58%	0.581	S	S	*	*			trans	-103.9	7.4	-172.8	0	0	0	0	0	116.7	Q57 T62	Q57-G60 PolarHBondContact O-N 2.85Å; G60-T62 PolarHBondContact O-N 3.14Å
61	V	30.8	Very low	42.8	Very low	110 Å²	110	119.1 Å²	119.1	67%	0.667	62%	0.622	S	S	*	*			trans	-89.8	85.8	-177.3	-172.2	0	0	0	0	110.4	T63	V61-T63 HydrophobicContact CG1-CG2 4.31Å; V61-T63 PolarHBondContact O-N 3.22Å
62	T	26.5	Very low	40.6	Very low	135 Å²	135	119.6 Å²	119.6	83%	0.828	64%	0.637	S	S	*	*			trans	-80	106.8	154.3	30.2	0	0	0	0	108.2	G60 M64	G60-T62 PolarHBondContact O-N 3.14Å; T62-M64 PolarHBondContact O-N 2.86Å
63	T	26.7	Very low	38.3	Very low	108 Å²	108	126.1 Å²	126.1	66%	0.663	67%	0.667	S	S	*	*			trans	-58.7	114.9	174.9	45.3	0	0	0	0	110.8	V61	V61-T63 HydrophobicContact CG1-CG2 4.31Å; V61-T63 PolarHBondContact O-N 3.22Å
64	M	23.9	Very low	35.9	Very low	187 Å²	187	135.1 Å²	135.1	92%	0.921	71%	0.708	S	S	*	*			trans	-95.8	99.5	158.3	-77	-79.9	-110.5	0	0	107	T62	T62-M64 PolarHBondContact O-N 2.86Å
65	N	23.2	Very low	33.5	Very low	153 Å²	153	138.2 Å²	138.2	82%	0.818	73%	0.731	S	S	*	*			trans	-65.3	130.6	172.2	-77.9	-16.4	0	0	0	109.7
66	G	23.6	Very low	31	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	74%	0.744	S	S	*	*			trans	-160.9	83.2	173.1	0	0	0	0	0	109.4	L68	G66-L68 PolarHBondContact O-N 3.19Å
67	D	20.8	Very low	29.3	Very low	161 Å²	161	140.7 Å²	140.7	86%	0.861	77%	0.765	S	S	*	*			trans	-60.8	120.4	175	-70.8	-43.4	0	0	0	110.9
68	L	21.9	Very low	27.3	Very low	151 Å²	151	146.9 Å²	146.9	79%	0.791	79%	0.794	S	S	*	*			trans	-133.6	90.2	162.5	-82.1	168.2	0	0	0	109	G66 F70	G66-L68 PolarHBondContact O-N 3.19Å; L68-F70 HydrophobicContact CB-CE2 4.42Å; L68-F70 PolarHBondContact O-N 3.32Å
69	C	19.9	Very low	25.8	Very low	122 Å²	122	143.8 Å²	143.8	82%	0.824	79%	0.794	S	S	*	*			trans	-75.6	109.2	175.5	-170.3	0	0	0	0	109.9
70	F	20.8	Very low	24.6	Very low	186 Å²	186	140.2 Å²	140.2	82%	0.816	79%	0.787	S	S	*	*			trans	-94.5	104.9	171.8	-83.9	-88	0	0	0	110.2	L68	L68-F70 HydrophobicContact CB-CE2 4.42Å; L68-F70 PolarHBondContact O-N 3.32Å
71	R	19.8	Very low	24.2	Very low	236 Å²	236	142.3 Å²	142.3	89%	0.891	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.5	118.9	167.4	-85.3	-179.9	167.4	172.7	-3.6	109.5
72	S	26.8	Very low	23.9	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96.3	124.8	168.7	37.3	0	0	0	0	109.3
73	H	24.3	Very low	24	Very low	182 Å²	182	147.4 Å²	147.4	84%	0.843	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-76.3	118.3	173.6	-103.4	-115.3	0	0	0	109.3
74	E	23.5	Very low	24	Very low	191 Å²	191	147 Å²	147	89%	0.893	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-81	121.5	166.3	-71.9	-177.3	154.9	0	0	109.1
75	V	25.1	Very low	24.2	Very low	129 Å²	129	147.2 Å²	147.2	78%	0.782	80%	0.801	S	S	*	*			trans	-105.8	111.5	166.2	179.5	0	0	0	0	106.9
76	G	21.3	Very low	24.4	Very low	70 Å²	70	148.3 Å²	148.3	72%	0.722	81%	0.806	S	S	*	*			trans	-71.7	142.5	177.6	0	0	0	0	0	112
77	I	26.6	Very low	24.5	Very low	161 Å²	161	149.1 Å²	149.1	83%	0.826	81%	0.806	S	S	*	*			trans	-129	114.3	163	-63.1	-178.9	0	0	0	107.1
78	H	23.6	Very low	24.9	Very low	184 Å²	184	149 Å²	149	85%	0.852	80%	0.804	S	S	*	*			trans	-59	136.8	162.2	-90.8	-111	0	0	0	110
79	D	26.7	Very low	25.1	Very low	153 Å²	153	152.1 Å²	152.1	82%	0.818	81%	0.812	S	S	*	*				-157.4	147.2	122.5	-153.5	-0.6	0	0	0	111.5
80	S	24.3	Very low	25.5	Very low	86 Å²	86	151.9 Å²	151.9	60%	0.601	81%	0.809	S	S	*	*			trans	-99.5	168.9	-167.2	50.2	0	0	0	0	112.8
81	S	27.3	Very low	25.9	Very low	102 Å²	102	154.3 Å²	154.3	71%	0.713	81%	0.812	S	S	*	*			trans	88.6	98.9	148.6	76.3	0	0	0	0	119.3
82	S	26.2	Very low	26.4	Very low	108 Å²	108	148.6 Å²	148.6	76%	0.755	81%	0.806	S	S	*	*				48.5	118.5	122.2	60.8	0	0	0	0	120.4
83	R	27.9	Very low	26.7	Very low	243 Å²	243	152 Å²	152	92%	0.917	81%	0.807	S	S	*	*				-170.6	140.1	100.7	-121.4	174.7	174	174.5	-2.9	112.4
84	S	26.6	Very low	27.1	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	80%	0.804	S	S	*	*			trans	-59	145.8	167.7	40.2	0	0	0	0	113
85	Q	29.1	Very low	27.5	Very low	192 Å²	192	150.7 Å²	150.7	90%	0.897	80%	0.801	S	S	*	*				-171.1	134.8	122.5	-101.4	171.3	38.8	0	0	111.4
86	L	25.7	Very low	28.1	Very low	175 Å²	175	155.7 Å²	155.7	92%	0.916	81%	0.805	S	S	*	*			trans	-70.2	138.4	176.4	-67.1	136.9	0	0	0	110.3
87	A	26.8	Very low	28.8	Very low	87 Å²	87	162 Å²	162	72%	0.719	81%	0.813	S	S	*	*			trans	-175.9	132.4	139.6	0	0	0	0	0	112.2
88	L	28.6	Very low	29.5	Very low	159 Å²	159	163.6 Å²	163.6	83%	0.832	81%	0.814	S	S	*	*			trans	71.1	90.1	151.5	-62.8	159.7	0	0	0	117.1	P90	L88-P90 WeakPolarHBondContact O-CD 3.19Å
89	F	25.7	Very low	30.9	Very low	217 Å²	217	159.9 Å²	159.9	95%	0.952	81%	0.809	S	S	*	*			trans	-57.4	107	167.1	-70.3	-89.7	0	0	0	112.2
90	P	29	Very low	32.4	Very low	116 Å²	116	161.3 Å²	161.3	75%	0.753	80%	0.802	S	S	*	*			trans	-80.9	131.1	162.2	2	20.3	0	0	0	106.9	L88	L88-P90 WeakPolarHBondContact O-CD 3.19Å
91	R	28.2	Very low	34.8	Very low	237 Å²	237	160 Å²	160	89%	0.894	79%	0.792	S	S	*	*			trans	-45.1	132.2	176.5	-66.7	-178.5	177.6	-159.8	-1.1	109.8	F93	R91-F93 PolarHBondContact O-N 3.3Å
92	P	30.9	Very low	37.5	Very low	116 Å²	116	155.7 Å²	155.7	75%	0.753	76%	0.76	S	S	*	*			trans	-63.3	110.4	-171.2	12.8	-13.2	0	0	0	108.4	V94	P92-V94 VanDerWaalsContact C-N 3.3Å; P92-V94 PolarHBondContact O-N 2.84Å
93	F	32.6	Very low	40.4	Very low	185 Å²	185	152.1 Å²	152.1	81%	0.811	73%	0.733	S	S	*	*			trans	-50.5	104	161.5	-173.2	-94.3	0	0	0	105.5	R91 R95	R91-F93 PolarHBondContact O-N 3.3Å; F93-R95 HydrophobicContact CD1-CG 4.11Å; F93-R95 PolarHBondContact O-N 3.46Å
94	V	33.3	Very low	43.3	Very low	129 Å²	129	144.6 Å²	144.6	78%	0.782	71%	0.71	S	S	*	*			trans	-64.6	89.5	176.5	179.8	0	0	0	0	104.8	P92 R96	P92-V94 VanDerWaalsContact C-N 3.3Å; P92-V94 PolarHBondContact O-N 2.84Å; V94-R96 VanDerWaalsContact C-N 3.3Å; V94-R96 PolarHBondContact O-N 3.39Å
95	R	32.3	Very low	46.4	Very low	216 Å²	216	145.3 Å²	145.3	82%	0.815	70%	0.697	S	S	*	*			trans	-54	104	170.4	-90.9	-178	154.9	174.5	-4.9	104.1	F93 K97	F93-R95 HydrophobicContact CD1-CG 4.11Å; F93-R95 PolarHBondContact O-N 3.46Å; R95-K97 VanDerWaalsContact C-N 3.34Å; R95-K97 PolarHBondContact O-N 2.86Å
96	R	36.7	Very low	49.4	Very low	234 Å²	234	136.1 Å²	136.1	88%	0.883	65%	0.654	S	S	*	*			trans	-43.2	108.6	163.4	-85.2	-179	157	144.8	-4.8	104.9	V94 K98	V94-R96 VanDerWaalsContact C-N 3.3Å; V94-R96 PolarHBondContact O-N 3.39Å; R96-K98 VanDerWaalsContact C-N 3.33Å; R96-K98 PolarHBondContact O-N 2.87Å
97	K	36.4	Very low	52.4	Low	203 Å²	203	129.3 Å²	129.3	88%	0.883	62%	0.622	S	S	*	*			trans	-51.9	106.9	177.4	-87.4	178.3	175.9	173.3	0	104.3	R95 S99	R95-K97 VanDerWaalsContact C-N 3.34Å; R95-K97 PolarHBondContact O-N 2.86Å; K97-S99 PolarHBondContact O-N 2.86Å
98	K	42.1	Very low	55.6	Low	194 Å²	194	129.5 Å²	129.5	84%	0.843	61%	0.614	S	S	*	*			trans	-53.2	111.4	176.9	-78.3	180	177.2	175.5	0	104.5	R96 R100	R96-K98 VanDerWaalsContact C-N 3.33Å; R96-K98 PolarHBondContact O-N 2.87Å; K98-R100 PolarHBondContact O-N 2.78Å; K98-R100 VanDerWaalsContact O-N 3.1Å
99	S	51.6	Low	58.8	Low	106 Å²	106	125.5 Å²	125.5	74%	0.741	59%	0.589	S	S	*	*			trans	-54.7	124.8	179.6	61.2	0	0	0	0	106.4	K97	K97-S99 PolarHBondContact O-N 2.86Å
100	R	59.6	Low	62.1	Low	182 Å²	182	115.3 Å²	115.3	69%	0.687	55%	0.545	S	S	*	.			trans	-56	130.4	176.1	-68	-174	-179.2	-163.1	1.9	107.1	K98 F102	K98-R100 PolarHBondContact O-N 2.78Å; K98-R100 VanDerWaalsContact O-N 3.1Å; R100-F102 PolarHBondContact O-N 2.93Å; R100-F102 VanDerWaalsContact O-N 3.13Å
101	P	74.9	Confident	65.3	Low	59 Å²	59	112.3 Å²	112.3	38%	0.383	52%	0.522	S	S	.	.	S	Bend	trans	-64.6	-19.5	-174.6	21	-29.4	0	0	0	112.8	L26 R177	L26-P101 HydrophobicContact CD1-CB 4.29Å; P101-R177 PolarHBondContact O-NH1 2.98Å; P101-R177 VanDerWaalsContact O-NH1 3.15Å
102	F	83.5	Confident	68.4	Low	12 Å²	12	101.9 Å²	101.9	5%	0.053	48%	0.484	C	S	.	.	S	Bend	trans	-132.1	150.2	-178.1	-55.5	-79.5	0	0	0	110.9	L26 R100 I112 L125 M140 Y179	L26-F102 HydrophobicContact CD1-CE2 3.48Å; L26-F102 VanDerWaalsContact CD1-CE2 3.48Å; L26-F102 HydrophobicContact CD1-CZ 3.38Å; L26-F102 HydrophobicContact CD2-CE1 4.43Å; L26-F102 HydrophobicContact CD2-CZ 3.82Å; L26-F102 HydrophobicContact CG-CZ 4.25Å; R100-F102 PolarHBondContact O-N 2.93Å; R100-F102 VanDerWaalsContact O-N 3.13Å; F102-I112 HydrophobicContact CD1-CD1 4.4Å; F102-I112 HydrophobicContact CD1-CG1 4.35Å; F102-I112 HydrophobicContact CD2-CG1 4.07Å; F102-I112 HydrophobicContact CE1-CD1 4.33Å; F102-I112 HydrophobicContact CE1-CG1 4.18Å; F102-I112 HydrophobicContact CE2-CB 4.43Å; F102-I112 HydrophobicContact CE2-CG1 3.9Å; F102-I112 HydrophobicContact CE2-CG2 4.4Å; F102-I112 HydrophobicContact CG-CG1 4.31Å; F102-I112 HydrophobicContact CZ-CB 4.43Å; F102-I112 HydrophobicContact CZ-CG1 3.95Å; F102-I112 HydrophobicContact CZ-CG2 3.98Å; F102-L125 HydrophobicContact CE1-CD1 3.57Å; F102-L125 HydrophobicContact CZ-CD1 3.95Å; F102-M140 HydrophobicContact CD1-CE 4.04Å; F102-M140 HydrophobicContact CD1-SD 3.9Å; F102-M140 HydrophobicContact CE1-CE 3.9Å; F102-M140 HydrophobicContact CE1-SD 3.54Å; F102-M140 VanDerWaalsContact CE1-SD 3.54Å; F102-Y179 HydrophobicContact CD1-CE1 4.12Å
103	D	87.3	Confident	71.3	Confident	33 Å²	33	99.5 Å²	99.5	18%	0.176	46%	0.464	C	S	.	.			trans	-58.8	145.3	172.1	-175.2	-88.1	0	0	0	110.9	R105 V106 S107 T174 Y179	D103-R105 VanDerWaalsContact C-N 3.31Å; D103-R105 PolarHBondContact O-N 3.47Å; D103-R105 VanDerWaalsContact OD1-CB 3.23Å; D103-R105 WeakPolarHBondContact OD1-CB 3.36Å; D103-R105 WeakPolarHBondContact OD1-CG 3.42Å; D103-R105 IonicContact OD1-CZ 3.82Å; D103-R105 PolarHBondContact OD1-N 3.28Å; D103-R105 IonicContact OD1-NE 2.92Å; D103-R105 PolarHBondContact OD1-NE 2.84Å; D103-R105 IonicContact OD1-NH2 3.52Å; D103-R105 IonicContact OD2-CZ 2.66Å; D103-R105 IonicContact OD2-NE 3.79Å; D103-R105 IonicContact OD2-NH2 3.65Å; D103-R105 PolarHBondContact OD2-NH2 2.98Å; D103-V106 HydrophobicContact CB-CB 4.47Å; D103-V106 HydrophobicContact CB-CG2 4.12Å; D103-V106 WeakPolarHBondContact O-CB 3.33Å; D103-V106 PolarHBondContact O-N 3.33Å; D103-S107 PolarHBondContact O-N 2.9Å; D103-S107 PolarHBondContact O-OG 3.39Å; D103-T174 HydrophobicContact CB-CG2 3.76Å; D103-T174 WeakPolarHBondContact OD2-CG2 3.12Å; D103-Y179 HydrophobicContact CB-CE2 3.99Å; D103-Y179 PolarHBondContact N-OH 3.47Å
104	I	89.1	Confident	74.2	Confident	85 Å²	85	92.8 Å²	92.8	44%	0.436	44%	0.44	S	S	.	.	H	α-helix	trans	-57.8	-43.5	-178.1	-174.7	53.1	0	0	0	111.8	V106 S107 T108	I104-V106 VanDerWaalsContact C-N 3.26Å; I104-V106 PolarHBondContact O-N 2.81Å; I104-S107 WeakPolarHBondContact CA-OG 3.44Å; I104-S107 PolarHBondContact O-N 3.47Å; I104-S107 VanDerWaalsContact O-N 3.14Å; I104-S107 PolarHBondContact O-OG 2.77Å; I104-T108 WeakPolarHBondContact O-CB 2.99Å; I104-T108 PolarHBondContact O-N 2.78Å; I104-T108 PolarHBondContact O-OG1 2.88Å
105	R	90.7	Very high	77	Confident	114 Å²	114	89.8 Å²	89.8	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-62	-37.4	-178.4	-62.1	167.8	-69.7	172.8	-2	111.5	D103 K109 F172 Q173	D103-R105 VanDerWaalsContact C-N 3.31Å; D103-R105 PolarHBondContact O-N 3.47Å; D103-R105 VanDerWaalsContact OD1-CB 3.23Å; D103-R105 WeakPolarHBondContact OD1-CB 3.36Å; D103-R105 WeakPolarHBondContact OD1-CG 3.42Å; D103-R105 IonicContact OD1-CZ 3.82Å; D103-R105 PolarHBondContact OD1-N 3.28Å; D103-R105 IonicContact OD1-NE 2.92Å; D103-R105 PolarHBondContact OD1-NE 2.84Å; D103-R105 IonicContact OD1-NH2 3.52Å; D103-R105 IonicContact OD2-CZ 2.66Å; D103-R105 IonicContact OD2-NE 3.79Å; D103-R105 IonicContact OD2-NH2 3.65Å; D103-R105 PolarHBondContact OD2-NH2 2.98Å; R105-K109 PolarHBondContact O-N 3.04Å; R105-F172 HydrophobicContact CB-CD1 3.97Å; R105-F172 HydrophobicContact CB-CE1 4.15Å; R105-Q173 PolarHBondContact NH1-O 3.28Å; R105-Q173 PolarHBondContact NH2-O 3Å
106	V	91.7	Very high	79.7	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-68	-51.6	174.9	178	0	0	0	0	110.1	D103 I104 T108 K109 Y110 M138 F172 Y179	D103-V106 HydrophobicContact CB-CB 4.47Å; D103-V106 HydrophobicContact CB-CG2 4.12Å; D103-V106 WeakPolarHBondContact O-CB 3.33Å; D103-V106 PolarHBondContact O-N 3.33Å; I104-V106 VanDerWaalsContact C-N 3.26Å; I104-V106 PolarHBondContact O-N 2.81Å; V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 2.83Å; V106-K109 PolarHBondContact O-N 2.91Å; V106-Y110 PolarHBondContact O-N 2.78Å; V106-M138 HydrophobicContact CG1-CE 3.48Å; V106-M138 VanDerWaalsContact CG1-CE 3.48Å; V106-M138 HydrophobicContact CG1-SD 3.69Å; V106-F172 HydrophobicContact CG2-CB 3.77Å; V106-F172 HydrophobicContact CG2-CD1 4.14Å; V106-F172 HydrophobicContact CG2-CD2 3.73Å; V106-F172 HydrophobicContact CG2-CE2 4.34Å; V106-F172 HydrophobicContact CG2-CG 3.61Å; V106-Y179 HydrophobicContact CG1-CD1 4.23Å; V106-Y179 HydrophobicContact CG2-CD1 3.91Å; V106-Y179 HydrophobicContact CG2-CD2 3.86Å; V106-Y179 HydrophobicContact CG2-CE1 4.25Å; V106-Y179 HydrophobicContact CG2-CE2 4.2Å; V106-Y179 HydrophobicContact CG2-CG 3.72Å
107	S	90.6	Very high	82	Confident	32 Å²	32	73.4 Å²	73.4	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-67	-27.1	-176	64.5	0	0	0	0	114.2	D103 I104 R130	D103-S107 PolarHBondContact O-N 2.9Å; D103-S107 PolarHBondContact O-OG 3.39Å; I104-S107 WeakPolarHBondContact CA-OG 3.44Å; I104-S107 PolarHBondContact O-N 3.47Å; I104-S107 VanDerWaalsContact O-N 3.14Å; I104-S107 PolarHBondContact O-OG 2.77Å; S107-R130 PolarHBondContact O-NE 3.03Å; S107-R130 PolarHBondContact O-NH2 2.84Å
108	T	93.4	Very high	84.2	Confident	90 Å²	90	71 Å²	71	55%	0.552	36%	0.36	S	S	*	.	H	α-helix	trans	-73.5	-29.9	176	-62.5	0	0	0	0	112.2	I104 V106 R130	I104-T108 WeakPolarHBondContact O-CB 2.99Å; I104-T108 PolarHBondContact O-N 2.78Å; I104-T108 PolarHBondContact O-OG1 2.88Å; V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 2.83Å; T108-R130 WeakPolarHBondContact O-CD 3.27Å
109	K	95.1	Very high	85.6	Confident	75 Å²	75	63.6 Å²	63.6	33%	0.326	34%	0.339	S	S	.	.	H	α-helix	trans	-99.3	-30	-178	-165.1	172.6	-179	-174.4	0	113.3	R105 V106 H129 R130 E170 F172	R105-K109 PolarHBondContact O-N 3.04Å; V106-K109 PolarHBondContact O-N 2.91Å; K109-H129 WeakPolarHBondContact CE-NE2 3.28Å; K109-H129 WeakPolarHBondContact CG-NE2 3.41Å; K109-R130 PolarHBondContact O-N 2.75Å; K109-E170 WeakPolarHBondContact CD-OE1 3.45Å; K109-E170 WeakPolarHBondContact CE-OE1 3.24Å; K109-E170 IonicContact NZ-OE1 3.34Å; K109-E170 PolarHBondContact NZ-OE1 2.88Å; K109-E170 IonicContact NZ-OE2 3.97Å; K109-E170 PolarHBondContact NZ-OE2 3.24Å; K109-F172 HydrophobicContact CD-CZ 4.19Å
110	Y	96.1	Very high	86.5	Confident	3 Å²	3	63.3 Å²	63.3	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.2	-174.5	-68.2	-81.5	0	0	0	113.7	V106 V127 Q128 H129 F136 M138 E170 F172 V181	V106-Y110 PolarHBondContact O-N 2.78Å; Y110-V127 HydrophobicContact CD1-CB 4.1Å; Y110-V127 HydrophobicContact CD1-CG2 3.61Å; Y110-V127 HydrophobicContact CE1-CG2 4.11Å; Y110-V127 HydrophobicContact CG-CB 4.44Å; Y110-V127 HydrophobicContact CG-CG2 4.2Å; Y110-Q128 CarbonylContact C-O 3.6Å; Y110-Q128 WeakPolarHBondContact CA-O 3.37Å; Y110-H129 HydrophobicContact CD1-CB 4.2Å; Y110-H129 HydrophobicContact CE1-CB 3.82Å; Y110-H129 AromaticContact CE1-CD2 3.91Å; Y110-H129 AromaticContact CZ-CD2 3.82Å; Y110-F136 AromaticContact CE1-CD2 3.73Å; Y110-F136 HydrophobicContact CE1-CD2 3.73Å; Y110-F136 HydrophobicContact CE1-CE2 4.29Å; Y110-F136 HydrophobicContact CE1-CG 4.44Å; Y110-M138 HydrophobicContact CD2-CE 3.93Å; Y110-M138 HydrophobicContact CG-CE 4.02Å; Y110-E170 HydrophobicContact CE2-CG 4.49Å; Y110-E170 WeakPolarHBondContact CE2-OE1 3.47Å; Y110-E170 PolarHBondContact OH-OE1 2.78Å; Y110-F172 HydrophobicContact CD2-CE2 4.36Å; Y110-F172 AromaticContact CE2-CE2 3.95Å; Y110-F172 HydrophobicContact CE2-CE2 3.95Å; Y110-F172 HydrophobicContact CE2-CZ 4.1Å; Y110-V181 HydrophobicContact CE1-CG1 4.24Å; Y110-V181 HydrophobicContact CE2-CG2 4.14Å
111	N	95.1	Very high	87.3	Confident	53 Å²	53	62.6 Å²	62.6	28%	0.283	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.1	160.7	-72.2	-35.7	0	0	0	109.2	V127 Q128 R130	N111-V127 CarbonylContact O-C 3.5Å; N111-V127 VanDerWaalsContact O-CA 3.23Å; N111-V127 WeakPolarHBondContact O-CA 3.12Å; N111-Q128 HydrophobicContact CB-CB 4.4Å; N111-Q128 PolarHBondContact N-O 2.47Å; N111-Q128 PolarHBondContact O-N 2.83Å; N111-R130 PolarHBondContact OD1-NE 2.87Å; N111-R130 PolarHBondContact OD1-NH1 3.06Å; N111-R130 PolarHBondContact OD1-NH2 2.78Å
112	I	93	Very high	87.7	Confident	19 Å²	19	61 Å²	61	10%	0.097	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.9	173	-50.9	-56.6	0	0	0	108.6	A22 F102 L125 V127 M138	A22-I112 HydrophobicContact CB-CG2 4.43Å; F102-I112 HydrophobicContact CD1-CD1 4.4Å; F102-I112 HydrophobicContact CD1-CG1 4.35Å; F102-I112 HydrophobicContact CD2-CG1 4.07Å; F102-I112 HydrophobicContact CE1-CD1 4.33Å; F102-I112 HydrophobicContact CE1-CG1 4.18Å; F102-I112 HydrophobicContact CE2-CB 4.43Å; F102-I112 HydrophobicContact CE2-CG1 3.9Å; F102-I112 HydrophobicContact CE2-CG2 4.4Å; F102-I112 HydrophobicContact CG-CG1 4.31Å; F102-I112 HydrophobicContact CZ-CB 4.43Å; F102-I112 HydrophobicContact CZ-CG1 3.95Å; F102-I112 HydrophobicContact CZ-CG2 3.98Å; I112-L125 HydrophobicContact CG2-CB 4.45Å; I112-L125 HydrophobicContact CG2-CD1 3.89Å; I112-L125 HydrophobicContact CG2-CD2 4.46Å; I112-V127 HydrophobicContact CD1-CB 4.44Å; I112-V127 HydrophobicContact CD1-CG1 3.5Å; I112-M138 HydrophobicContact CD1-SD 4.2Å
113	I	93.1	Very high	88	Confident	65 Å²	65	60.7 Å²	60.7	33%	0.333	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-61.9	-174.6	-61.3	168.9	0	0	0	110.9	K126 Q128	I113-K126 HydrophobicContact CB-CB 4.36Å; I113-K126 HydrophobicContact CB-CG 4.27Å; I113-K126 WeakPolarHBondContact CB-O 3.31Å; I113-K126 HydrophobicContact CD1-CD 4.36Å; I113-K126 HydrophobicContact CD1-CG 4.07Å; I113-K126 HydrophobicContact CG2-CD 4.44Å; I113-K126 PolarHBondContact N-O 2.84Å; I113-Q128 HydrophobicContact CD1-CB 3.61Å; I113-Q128 HydrophobicContact CG1-CB 4.32Å
114	S	93	Very high	88.2	Confident	44 Å²	44	60.9 Å²	60.9	31%	0.308	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	159.4	-171.9	62.5	0	0	0	0	112.1	L125 K126	S114-L125 CarbonylContact O-C 3.55Å; S114-L125 VanDerWaalsContact O-CA 3.28Å; S114-L125 WeakPolarHBondContact O-CA 3.29Å; S114-K126 PolarHBondContact N-O 2.8Å; S114-K126 PolarHBondContact O-N 2.78Å
115	L	91.3	Very high	88.5	Confident	66 Å²	66	57 Å²	57	35%	0.346	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	130.7	165.6	-177.4	69.7	0	0	0	108.9	H25 G117 I123 L125	H25-L115 HydrophobicContact CB-CD2 4.37Å; L115-G117 WeakPolarHBondContact CD1-O 3.4Å; L115-I123 HydrophobicContact CD1-CB 3.95Å; L115-I123 HydrophobicContact CD1-CG2 4.45Å; L115-L125 HydrophobicContact CB-CD2 4.22Å; L115-L125 HydrophobicContact CD1-CD2 3.87Å
116	I	89.1	Confident	88.7	Confident	82 Å²	82	55 Å²	55	42%	0.421	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	-15.3	178.6	60.4	173.3	0	0	0	113.4	V124 K126 A137 L184	I116-V124 HydrophobicContact CD1-CG1 3.82Å; I116-V124 HydrophobicContact CG1-CB 4.03Å; I116-V124 HydrophobicContact CG1-CG1 3.73Å; I116-V124 VanDerWaalsContact CG1-O 3.28Å; I116-V124 WeakPolarHBondContact CG1-O 3.39Å; I116-V124 PolarHBondContact N-O 3.03Å; I116-K126 HydrophobicContact CD1-CB 4.42Å; I116-K126 HydrophobicContact CG2-CB 3.74Å; I116-A137 HydrophobicContact CD1-CB 4.14Å; I116-L184 HydrophobicContact CD1-CD1 3.87Å
117	G	84.8	Confident	89	Confident	25 Å²	25	55 Å²	55	26%	0.258	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	150	175.3	0	0	0	0	0	112.2	L115 I123 V124	L115-G117 WeakPolarHBondContact CD1-O 3.4Å; G117-I123 CarbonylContact O-C 3.56Å; G117-V124 PolarHBondContact N-O 3.42Å; G117-V124 PolarHBondContact O-N 3.17Å
118	K	82.4	Confident	89.3	Confident	151 Å²	151	57 Å²	57	66%	0.657	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	112.7	175.9	-175.6	178.3	-178.6	-177	0	109.1	I123	K118-I123 HydrophobicContact CG-CG2 4.33Å
119	G	72.3	Confident	89.5	Confident	39 Å²	39	53.5 Å²	53.5	40%	0.402	29%	0.289	S	S	.	.			trans	-97	-177.9	170.2	0	0	0	0	0	111.7	F121 S122	G119-F121 VanDerWaalsContact C-N 3.33Å; G119-F121 PolarHBondContact O-N 3.4Å; G119-S122 WeakPolarHBondContact CA-O 3.17Å; G119-S122 PolarHBondContact N-O 3.2Å
120	S	70	Confident	89.5	Confident	101 Å²	101	54 Å²	54	71%	0.706	29%	0.288	S	S	*	.	S	Bend	trans	-62.8	-37.2	177.4	47.5	0	0	0	0	113.3
121	F	76.7	Confident	89.5	Confident	167 Å²	167	62.1 Å²	62.1	73%	0.732	33%	0.327	S	S	*	.	S	Bend	trans	-128.1	7.6	-175.8	-54.3	-71.8	0	0	0	113.7	G119 P142	G119-F121 VanDerWaalsContact C-N 3.33Å; G119-F121 PolarHBondContact O-N 3.4Å; F121-P142 WeakPolarHBondContact O-CD 3.48Å
122	S	84.5	Confident	89.5	Confident	25 Å²	25	64.6 Å²	64.6	18%	0.175	34%	0.344	C	S	.	.			trans	-145.6	151.3	-178.9	61.7	0	0	0	0	112	G119 M140	G119-S122 WeakPolarHBondContact CA-O 3.17Å; G119-S122 PolarHBondContact N-O 3.2Å; S122-M140 CarbonylContact C-O 3.54Å; S122-M140 WeakPolarHBondContact CA-O 3.05Å; S122-M140 VanDerWaalsContact CB-O 3.3Å; S122-M140 WeakPolarHBondContact CB-O 3.44Å
123	I	88.7	Confident	89.5	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	151.3	164.9	65.3	167.2	0	0	0	109	L26 F30 L115 G117 K118 L125 K139 M140	L26-I123 HydrophobicContact CD2-CD1 4.14Å; F30-I123 HydrophobicContact CE2-CD1 3.53Å; F30-I123 HydrophobicContact CE2-CG1 4.27Å; F30-I123 HydrophobicContact CE2-CG2 4.38Å; F30-I123 HydrophobicContact CZ-CB 4.48Å; F30-I123 HydrophobicContact CZ-CD1 3.65Å; F30-I123 HydrophobicContact CZ-CG1 3.86Å; F30-I123 HydrophobicContact CZ-CG2 3.83Å; L115-I123 HydrophobicContact CD1-CB 3.95Å; L115-I123 HydrophobicContact CD1-CG2 4.45Å; G117-I123 CarbonylContact O-C 3.56Å; K118-I123 HydrophobicContact CG-CG2 4.33Å; I123-L125 HydrophobicContact CD1-CD1 4.19Å; I123-L125 HydrophobicContact CD1-CD2 4.13Å; I123-L125 HydrophobicContact CD1-CG 4.14Å; I123-K139 CarbonylContact O-C 3.6Å; I123-K139 WeakPolarHBondContact O-CA 3.42Å; I123-M140 HydrophobicContact CD1-CB 4.47Å; I123-M140 HydrophobicContact CD1-CE 4.43Å; I123-M140 HydrophobicContact CD1-SD 4.17Å; I123-M140 HydrophobicContact CG1-CB 3.78Å; I123-M140 HydrophobicContact CG1-CG 4.5Å; I123-M140 HydrophobicContact CG1-SD 4.41Å; I123-M140 PolarHBondContact N-O 3.28Å; I123-M140 PolarHBondContact O-N 3.27Å
124	V	92	Very high	89.7	Confident	37 Å²	37	63.4 Å²	63.4	22%	0.224	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.3	176.3	-168.1	0	0	0	0	107.7	I116 G117 A137 M138 K139	I116-V124 HydrophobicContact CD1-CG1 3.82Å; I116-V124 HydrophobicContact CG1-CB 4.03Å; I116-V124 HydrophobicContact CG1-CG1 3.73Å; I116-V124 VanDerWaalsContact CG1-O 3.28Å; I116-V124 WeakPolarHBondContact CG1-O 3.39Å; I116-V124 PolarHBondContact N-O 3.03Å; G117-V124 PolarHBondContact N-O 3.42Å; G117-V124 PolarHBondContact O-N 3.17Å; V124-A137 HydrophobicContact CG1-CB 4.2Å; V124-M138 WeakPolarHBondContact CA-O 3.02Å; V124-K139 HydrophobicContact CG2-CB 4.45Å; V124-K139 HydrophobicContact CG2-CG 4.31Å
125	L	94.5	Very high	89.8	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.7	-178.9	-61.1	171.6	0	0	0	109.9	F102 I112 S114 L115 I123 V127 A137 M138 M140	F102-L125 HydrophobicContact CE1-CD1 3.57Å; F102-L125 HydrophobicContact CZ-CD1 3.95Å; I112-L125 HydrophobicContact CG2-CB 4.45Å; I112-L125 HydrophobicContact CG2-CD1 3.89Å; I112-L125 HydrophobicContact CG2-CD2 4.46Å; S114-L125 CarbonylContact O-C 3.55Å; S114-L125 VanDerWaalsContact O-CA 3.28Å; S114-L125 WeakPolarHBondContact O-CA 3.29Å; L115-L125 HydrophobicContact CB-CD2 4.22Å; L115-L125 HydrophobicContact CD1-CD2 3.87Å; I123-L125 HydrophobicContact CD1-CD1 4.19Å; I123-L125 HydrophobicContact CD1-CD2 4.13Å; I123-L125 HydrophobicContact CD1-CG 4.14Å; L125-V127 HydrophobicContact CB-CG1 4.15Å; L125-A137 CarbonylContact O-C 3.6Å; L125-A137 WeakPolarHBondContact O-CA 3.31Å; L125-M138 HydrophobicContact CB-CB 4.46Å; L125-M138 PolarHBondContact N-O 2.86Å; L125-M138 PolarHBondContact O-N 3.49Å; L125-M140 HydrophobicContact CD1-CG 4.5Å; L125-M140 HydrophobicContact CD1-SD 3.41Å; L125-M140 WeakPolarHBondContact CD1-SD 3.27Å; L125-M140 HydrophobicContact CG-SD 4.43Å
126	K	95.9	Very high	90.1	Very high	71 Å²	71	62.1 Å²	62.1	31%	0.309	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.2	160.5	-176.4	175.1	-178.6	174.3	0	108.3	I113 S114 I116 L184	I113-K126 HydrophobicContact CB-CB 4.36Å; I113-K126 HydrophobicContact CB-CG 4.27Å; I113-K126 WeakPolarHBondContact CB-O 3.31Å; I113-K126 HydrophobicContact CD1-CD 4.36Å; I113-K126 HydrophobicContact CD1-CG 4.07Å; I113-K126 HydrophobicContact CG2-CD 4.44Å; I113-K126 PolarHBondContact N-O 2.84Å; S114-K126 PolarHBondContact N-O 2.8Å; S114-K126 PolarHBondContact O-N 2.78Å; I116-K126 HydrophobicContact CD1-CB 4.42Å; I116-K126 HydrophobicContact CG2-CB 3.74Å; K126-L184 HydrophobicContact CD-CD2 4.18Å; K126-L184 HydrophobicContact CG-CD2 4.03Å
127	V	96.9	Very high	90.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.6	178.5	-55.1	0	0	0	0	110.4	Y110 N111 I112 L125 A135 F136 M138	Y110-V127 HydrophobicContact CD1-CB 4.1Å; Y110-V127 HydrophobicContact CD1-CG2 3.61Å; Y110-V127 HydrophobicContact CE1-CG2 4.11Å; Y110-V127 HydrophobicContact CG-CB 4.44Å; Y110-V127 HydrophobicContact CG-CG2 4.2Å; N111-V127 CarbonylContact O-C 3.5Å; N111-V127 VanDerWaalsContact O-CA 3.23Å; N111-V127 WeakPolarHBondContact O-CA 3.12Å; I112-V127 HydrophobicContact CD1-CB 4.44Å; I112-V127 HydrophobicContact CD1-CG1 3.5Å; L125-V127 HydrophobicContact CB-CG1 4.15Å; V127-A135 CarbonylContact O-C 3.48Å; V127-A135 WeakPolarHBondContact O-CA 3.39Å; V127-F136 HydrophobicContact CG2-CB 3.8Å; V127-F136 PolarHBondContact N-O 2.95Å; V127-F136 PolarHBondContact O-N 3.07Å; V127-M138 HydrophobicContact CB-CE 4.4Å; V127-M138 HydrophobicContact CG1-CB 3.62Å; V127-M138 HydrophobicContact CG1-CE 3.94Å; V127-M138 HydrophobicContact CG1-CG 4.46Å; V127-M138 HydrophobicContact CG1-SD 4.04Å; V127-M138 HydrophobicContact CG2-CB 4.04Å; V127-M138 HydrophobicContact CG2-CE 4.08Å
128	Q	97.4	Very high	91	Very high	73 Å²	73	57.5 Å²	57.5	34%	0.341	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.9	175.9	177.8	177.3	46.4	0	0	109.8	Y110 N111 I113 R130 G133 G134	Y110-Q128 CarbonylContact C-O 3.6Å; Y110-Q128 WeakPolarHBondContact CA-O 3.37Å; N111-Q128 HydrophobicContact CB-CB 4.4Å; N111-Q128 PolarHBondContact N-O 2.47Å; N111-Q128 PolarHBondContact O-N 2.83Å; I113-Q128 HydrophobicContact CD1-CB 3.61Å; I113-Q128 HydrophobicContact CG1-CB 4.32Å; Q128-R130 PolarHBondContact O-N 2.77Å; Q128-G133 WeakPolarHBondContact CG-O 3.45Å; Q128-G133 PolarHBondContact NE2-O 2.81Å; Q128-G134 CarbonylContact C-O 3.54Å; Q128-G134 VanDerWaalsContact CA-O 3.29Å; Q128-G134 WeakPolarHBondContact CA-O 3.3Å
129	H	97.4	Very high	91.5	Very high	17 Å²	17	51.3 Å²	51.3	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	130.3	175.1	-170.4	-78.3	0	0	0	109.6	K109 Y110 E131 T132 G133 G134 F136	K109-H129 WeakPolarHBondContact CE-NE2 3.28Å; K109-H129 WeakPolarHBondContact CG-NE2 3.41Å; Y110-H129 HydrophobicContact CD1-CB 4.2Å; Y110-H129 HydrophobicContact CE1-CB 3.82Å; Y110-H129 AromaticContact CE1-CD2 3.91Å; Y110-H129 AromaticContact CZ-CD2 3.82Å; H129-E131 IonicContact CE1-OE2 2.67Å; H129-E131 PolarHBondContact ND1-N 2.83Å; H129-T132 WeakPolarHBondContact CB-OG1 3.46Å; H129-T132 PolarHBondContact ND1-N 2.78Å; H129-T132 PolarHBondContact ND1-OG1 2.81Å; H129-G133 WeakPolarHBondContact O-CA 3.15Å; H129-G133 PolarHBondContact O-N 2.87Å; H129-G134 PolarHBondContact N-O 3.43Å; H129-F136 HydrophobicContact CB-CD2 4.32Å; H129-F136 HydrophobicContact CB-CE2 3.85Å
130	R	96.1	Very high	92.3	Very high	85 Å²	85	49.6 Å²	49.6	32%	0.321	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-41.8	-170.1	-77.4	168.9	174.3	-77.5	-7	113.5	S107 T108 K109 N111 Q128	S107-R130 PolarHBondContact O-NE 3.03Å; S107-R130 PolarHBondContact O-NH2 2.84Å; T108-R130 WeakPolarHBondContact O-CD 3.27Å; K109-R130 PolarHBondContact O-N 2.75Å; N111-R130 PolarHBondContact OD1-NE 2.87Å; N111-R130 PolarHBondContact OD1-NH1 3.06Å; N111-R130 PolarHBondContact OD1-NH2 2.78Å; Q128-R130 PolarHBondContact O-N 2.77Å
131	E	94.7	Very high	93.2	Very high	175 Å²	175	45.7 Å²	45.7	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-54.8	-176.3	-59.1	170.6	172	0	0	111.1	H129	H129-E131 IonicContact CE1-OE2 2.67Å; H129-E131 PolarHBondContact ND1-N 2.83Å
132	T	95.4	Very high	93.5	Very high	104 Å²	104	40.9 Å²	40.9	64%	0.638	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.9	-177.5	65.5	0	0	0	0	115.2	H129 G134	H129-T132 WeakPolarHBondContact CB-OG1 3.46Å; H129-T132 PolarHBondContact ND1-N 2.78Å; H129-T132 PolarHBondContact ND1-OG1 2.81Å; T132-G134 PolarHBondContact O-N 2.97Å; T132-G134 VanDerWaalsContact O-N 3.17Å; T132-G134 PolarHBondContact OG1-N 2.76Å
133	G	94.2	Very high	93.3	Very high	34 Å²	34	40.4 Å²	40.4	35%	0.351	23%	0.227	S	C	.	.			trans	70.6	0.9	-173.9	0	0	0	0	0	115.3	Q128 H129	Q128-G133 WeakPolarHBondContact CG-O 3.45Å; Q128-G133 PolarHBondContact NE2-O 2.81Å; H129-G133 WeakPolarHBondContact O-CA 3.15Å; H129-G133 PolarHBondContact O-N 2.87Å
134	G	95.7	Very high	92.5	Very high	25 Å²	25	44.7 Å²	44.7	26%	0.258	25%	0.25	S	C	.	.			trans	-66.8	141.8	-178.3	0	0	0	0	0	113.3	Q128 H129 T132 F136	Q128-G134 CarbonylContact C-O 3.54Å; Q128-G134 VanDerWaalsContact CA-O 3.29Å; Q128-G134 WeakPolarHBondContact CA-O 3.3Å; H129-G134 PolarHBondContact N-O 3.43Å; T132-G134 PolarHBondContact O-N 2.97Å; T132-G134 VanDerWaalsContact O-N 3.17Å; T132-G134 PolarHBondContact OG1-N 2.76Å; G134-F136 VanDerWaalsContact O-CD2 3.31Å; G134-F136 WeakPolarHBondContact O-CD2 3.12Å; G134-F136 VanDerWaalsContact O-CE2 3.31Å; G134-F136 WeakPolarHBondContact O-CE2 3.39Å
135	A	96.1	Very high	90.8	Very high	45 Å²	45	51 Å²	51	37%	0.372	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.5	-179	0	0	0	0	0	112.3	V127 L184	V127-A135 CarbonylContact O-C 3.48Å; V127-A135 WeakPolarHBondContact O-CA 3.39Å; A135-L184 HydrophobicContact CB-CD2 3.8Å
136	F	97.6	Very high	88.9	Confident	39 Å²	39	52.9 Å²	52.9	17%	0.171	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	161.1	-174.3	-59.1	-80.7	0	0	0	111.7	Y110 V127 H129 G134 I169 V181 L182	Y110-F136 AromaticContact CE1-CD2 3.73Å; Y110-F136 HydrophobicContact CE1-CD2 3.73Å; Y110-F136 HydrophobicContact CE1-CE2 4.29Å; Y110-F136 HydrophobicContact CE1-CG 4.44Å; V127-F136 HydrophobicContact CG2-CB 3.8Å; V127-F136 PolarHBondContact N-O 2.95Å; V127-F136 PolarHBondContact O-N 3.07Å; H129-F136 HydrophobicContact CB-CD2 4.32Å; H129-F136 HydrophobicContact CB-CE2 3.85Å; G134-F136 VanDerWaalsContact O-CD2 3.31Å; G134-F136 WeakPolarHBondContact O-CD2 3.12Å; G134-F136 VanDerWaalsContact O-CE2 3.31Å; G134-F136 WeakPolarHBondContact O-CE2 3.39Å; F136-I169 HydrophobicContact CD1-CD1 4.35Å; F136-I169 HydrophobicContact CD1-CG1 3.75Å; F136-I169 HydrophobicContact CD1-CG2 4.42Å; F136-I169 HydrophobicContact CE1-CD1 4.09Å; F136-I169 HydrophobicContact CE1-CG1 3.89Å; F136-I169 HydrophobicContact CE1-CG2 4.12Å; F136-V181 HydrophobicContact CB-CG1 3.66Å; F136-V181 HydrophobicContact CD1-CG1 4.4Å; F136-V181 HydrophobicContact CG-CG1 4.02Å; F136-L182 WeakPolarHBondContact CB-O 3.33Å
137	A	96.6	Very high	87.1	Confident	10 Å²	10	57 Å²	57	8%	0.083	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.7	167.4	0	0	0	0	0	109	I116 V124 L125 V181 L182 L184	I116-A137 HydrophobicContact CD1-CB 4.14Å; V124-A137 HydrophobicContact CG1-CB 4.2Å; L125-A137 CarbonylContact O-C 3.6Å; L125-A137 WeakPolarHBondContact O-CA 3.31Å; A137-V181 CarbonylContact O-C 3.5Å; A137-V181 WeakPolarHBondContact O-CA 3.4Å; A137-L182 HydrophobicContact CB-CB 4.43Å; A137-L182 PolarHBondContact N-O 3.25Å; A137-L182 PolarHBondContact O-N 3.47Å; A137-L184 HydrophobicContact CB-CD1 3.95Å
138	M	95.9	Very high	85.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.6	177.7	-176	-178.7	-74	0	0	109.5	V106 Y110 I112 V124 L125 V127 M140 Y179 V180 V181	V106-M138 HydrophobicContact CG1-CE 3.48Å; V106-M138 VanDerWaalsContact CG1-CE 3.48Å; V106-M138 HydrophobicContact CG1-SD 3.69Å; Y110-M138 HydrophobicContact CD2-CE 3.93Å; Y110-M138 HydrophobicContact CG-CE 4.02Å; I112-M138 HydrophobicContact CD1-SD 4.2Å; V124-M138 WeakPolarHBondContact CA-O 3.02Å; L125-M138 HydrophobicContact CB-CB 4.46Å; L125-M138 PolarHBondContact N-O 2.86Å; L125-M138 PolarHBondContact O-N 3.49Å; V127-M138 HydrophobicContact CB-CE 4.4Å; V127-M138 HydrophobicContact CG1-CB 3.62Å; V127-M138 HydrophobicContact CG1-CE 3.94Å; V127-M138 HydrophobicContact CG1-CG 4.46Å; V127-M138 HydrophobicContact CG1-SD 4.04Å; V127-M138 HydrophobicContact CG2-CB 4.04Å; V127-M138 HydrophobicContact CG2-CE 4.08Å; M138-M140 HydrophobicContact CG-CG 4.27Å; M138-Y179 HydrophobicContact SD-CD1 3.85Å; M138-V180 CarbonylContact C-O 3.14Å; M138-V180 WeakPolarHBondContact CA-O 3.33Å; M138-V181 HydrophobicContact CE-CG2 3.75Å; M138-V181 HydrophobicContact CG-CG2 4.42Å
139	K	92.6	Very high	83.8	Confident	20 Å²	20	59.3 Å²	59.3	9%	0.087	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.6	172.6	-172.9	173.1	179.6	-178.8	0	108.8	I123 V124 E153 V180 D249	I123-K139 CarbonylContact O-C 3.6Å; I123-K139 WeakPolarHBondContact O-CA 3.42Å; V124-K139 HydrophobicContact CG2-CB 4.45Å; V124-K139 HydrophobicContact CG2-CG 4.31Å; K139-E153 VanDerWaalsContact NZ-CD 3.27Å; K139-E153 IonicContact NZ-OE1 3.98Å; K139-E153 PolarHBondContact NZ-OE1 3.03Å; K139-E153 IonicContact NZ-OE2 2.63Å; K139-E153 PolarHBondContact NZ-OE2 2.94Å; K139-V180 HydrophobicContact CB-CB 4.3Å; K139-V180 PolarHBondContact N-O 3.27Å; K139-V180 PolarHBondContact O-N 3.09Å; K139-D249 IonicContact NZ-OD1 3.22Å; K139-D249 PolarHBondContact NZ-OD1 2.93Å; K139-D249 VanDerWaalsContact NZ-OD1 3.13Å
140	M	90.6	Very high	83	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.015	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.5	179	-69.7	179.1	50.3	0	0	110.6	F102 S122 I123 L125 M138 R177 V178 Y179	F102-M140 HydrophobicContact CD1-CE 4.04Å; F102-M140 HydrophobicContact CD1-SD 3.9Å; F102-M140 HydrophobicContact CE1-CE 3.9Å; F102-M140 HydrophobicContact CE1-SD 3.54Å; F102-M140 VanDerWaalsContact CE1-SD 3.54Å; S122-M140 CarbonylContact C-O 3.54Å; S122-M140 WeakPolarHBondContact CA-O 3.05Å; S122-M140 VanDerWaalsContact CB-O 3.3Å; S122-M140 WeakPolarHBondContact CB-O 3.44Å; I123-M140 HydrophobicContact CD1-CB 4.47Å; I123-M140 HydrophobicContact CD1-CE 4.43Å; I123-M140 HydrophobicContact CD1-SD 4.17Å; I123-M140 HydrophobicContact CG1-CB 3.78Å; I123-M140 HydrophobicContact CG1-CG 4.5Å; I123-M140 HydrophobicContact CG1-SD 4.41Å; I123-M140 PolarHBondContact N-O 3.28Å; I123-M140 PolarHBondContact O-N 3.27Å; L125-M140 HydrophobicContact CD1-CG 4.5Å; L125-M140 HydrophobicContact CD1-SD 3.41Å; L125-M140 WeakPolarHBondContact CD1-SD 3.27Å; L125-M140 HydrophobicContact CG-SD 4.43Å; M138-M140 HydrophobicContact CG-CG 4.27Å; M140-R177 VanDerWaalsContact CE-NH1 3.31Å; M140-V178 WeakPolarHBondContact CA-O 3.42Å; M140-Y179 HydrophobicContact CE-CD1 4.14Å; M140-Y179 HydrophobicContact CE-CE1 3.46Å; M140-Y179 VanDerWaalsContact CE-CE1 3.46Å; M140-Y179 HydrophobicContact CG-CD1 3.52Å; M140-Y179 HydrophobicContact CG-CE1 3.89Å; M140-Y179 HydrophobicContact CG-CG 4.41Å; M140-Y179 HydrophobicContact SD-CD1 3.82Å; M140-Y179 HydrophobicContact SD-CE1 3.65Å
141	M	88	Confident	82.4	Confident	19 Å²	19	56.7 Å²	56.7	9%	0.094	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	151.1	-173	32.2	150.3	-68.7	0	0	110.4	A143 F150 R177 V178	M141-A143 PolarHBondContact O-N 3.39Å; M141-F150 HydrophobicContact CE-CB 3.08Å; M141-F150 HydrophobicContact CE-CD1 3.08Å; M141-F150 HydrophobicContact CE-CD2 3.73Å; M141-F150 HydrophobicContact CE-CE1 3.87Å; M141-F150 HydrophobicContact CE-CE2 4.43Å; M141-F150 HydrophobicContact CE-CG 3.01Å; M141-F150 HydrophobicContact CE-CZ 4.49Å; M141-F150 HydrophobicContact SD-CB 3.16Å; M141-F150 WeakPolarHBondContact SD-CB 3.41Å; M141-F150 HydrophobicContact SD-CD1 4.37Å; M141-F150 HydrophobicContact SD-CD2 4.39Å; M141-F150 HydrophobicContact SD-CG 3.79Å; M141-R177 CarbonylContact O-C 3.49Å; M141-R177 WeakPolarHBondContact O-CA 3.45Å; M141-V178 HydrophobicContact CE-CB 3.53Å; M141-V178 HydrophobicContact CE-CG1 4.23Å; M141-V178 HydrophobicContact CE-CG2 3.65Å; M141-V178 HydrophobicContact CG-CB 4.18Å; M141-V178 PolarHBondContact N-O 3.46Å; M141-V178 VanDerWaalsContact N-O 3.07Å; M141-V178 PolarHBondContact O-N 2.86Å; M141-V178 HydrophobicContact SD-CB 4.2Å; M141-V178 HydrophobicContact SD-CG1 4.46Å
142	P	83.9	Confident	82.1	Confident	66 Å²	66	51.3 Å²	51.3	43%	0.429	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	136.7	177.1	-21.4	32.5	0	0	0	111.5	F121 N144	F121-P142 WeakPolarHBondContact O-CD 3.48Å; P142-N144 PolarHBondContact O-N 3.13Å
143	A	80.1	Confident	81.8	Confident	15 Å²	15	47.1 Å²	47.1	12%	0.124	27%	0.271	C	S	.	.			trans	-81.4	110.7	165.2	0	0	0	0	0	107.8	M141 T174 T176 V178	M141-A143 PolarHBondContact O-N 3.39Å; A143-T174 WeakPolarHBondContact CB-O 3.28Å; A143-T176 VanDerWaalsContact CB-C 3.5Å; A143-T176 PolarHBondContact N-O 2.79Å; A143-V178 HydrophobicContact CB-CG2 4.04Å
144	N	71.4	Confident	81.6	Confident	96 Å²	96	45.5 Å²	45.5	51%	0.513	26%	0.255	S	S	.	.			trans	-77.9	136.4	168.1	-81.7	-5.2	0	0	0	109.4	P142 G146	P142-N144 PolarHBondContact O-N 3.13Å; N144-G146 PolarHBondContact O-N 3.02Å
145	R	55.8	Low	81.4	Confident	170 Å²	170	46 Å²	46	64%	0.642	25%	0.251	S	S	*	.	S	Bend	trans	-70.5	97.8	176.9	-64.8	175.4	-179.4	-163.1	-7.3	109.5	C37	C37-R145 VanDerWaalsContact C-NH1 3.33Å; C37-R145 PolarHBondContact O-NH1 2.98Å; C37-R145 PolarHBondContact O-NH2 3.42Å
146	G	54	Low	81.2	Confident	43 Å²	43	43.9 Å²	43.9	44%	0.443	23%	0.234	S	C	.	.	S	Bend	trans	129.9	-23.8	160.3	0	0	0	0	0	117	N144	N144-G146 PolarHBondContact O-N 3.02Å
147	K	58	Low	81.1	Confident	159 Å²	159	42 Å²	42	69%	0.691	23%	0.226	S	C	*	.			trans	170.1	99	170.5	-98.3	154.3	-169.6	-164.8	0	107.4	E151	K147-E151 WeakPolarHBondContact CA-OE1 3.4Å; K147-E151 VanDerWaalsContact CG-OE2 3.23Å; K147-E151 WeakPolarHBondContact CG-OE2 3.46Å
148	G	60.7	Low	80.9	Confident	7 Å²	7	42.4 Å²	42.4	7%	0.072	23%	0.228	C	C	.	.			trans	-86.2	157	179.4	0	0	0	0	0	112	F150 E151	G148-F150 PolarHBondContact O-N 2.96Å; G148-E151 PolarHBondContact O-N 3.26Å
149	P	65.4	Low	80.7	Confident	113 Å²	113	47.8 Å²	47.8	73%	0.734	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-17.2	176.2	22.2	-32.6	0	0	0	113.6
150	F	79.8	Confident	80.8	Confident	5 Å²	5	47 Å²	47	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-75.2	-20.1	177.7	72.8	-94.1	0	0	0	115.7	V50 M141 G148 N152 E153 L154 V178	V50-F150 HydrophobicContact CG2-CE2 3.99Å; M141-F150 HydrophobicContact CE-CB 3.08Å; M141-F150 HydrophobicContact CE-CD1 3.08Å; M141-F150 HydrophobicContact CE-CD2 3.73Å; M141-F150 HydrophobicContact CE-CE1 3.87Å; M141-F150 HydrophobicContact CE-CE2 4.43Å; M141-F150 HydrophobicContact CE-CG 3.01Å; M141-F150 HydrophobicContact CE-CZ 4.49Å; M141-F150 HydrophobicContact SD-CB 3.16Å; M141-F150 WeakPolarHBondContact SD-CB 3.41Å; M141-F150 HydrophobicContact SD-CD1 4.37Å; M141-F150 HydrophobicContact SD-CD2 4.39Å; M141-F150 HydrophobicContact SD-CG 3.79Å; G148-F150 PolarHBondContact O-N 2.96Å; F150-N152 VanDerWaalsContact C-N 3.27Å; F150-N152 PolarHBondContact O-N 2.89Å; F150-E153 WeakPolarHBondContact O-CB 3.42Å; F150-E153 PolarHBondContact O-N 3.05Å; F150-E153 VanDerWaalsContact O-N 3.13Å; F150-L154 HydrophobicContact CD2-CD1 3.59Å; F150-L154 HydrophobicContact CD2-CG 4.14Å; F150-L154 HydrophobicContact CE2-CD1 3.87Å; F150-L154 PolarHBondContact O-N 3.03Å; F150-V178 HydrophobicContact CD1-CG2 4.46Å; F150-V178 HydrophobicContact CD2-CG1 4.3Å; F150-V178 HydrophobicContact CD2-CG2 4.1Å; F150-V178 HydrophobicContact CE1-CG2 4.02Å; F150-V178 HydrophobicContact CE2-CG1 4.34Å; F150-V178 HydrophobicContact CE2-CG2 3.67Å; F150-V178 HydrophobicContact CZ-CG2 3.63Å
151	E	85	Confident	81	Confident	43 Å²	43	56.1 Å²	56.1	20%	0.201	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-41	-174	-80	-175.3	-171.4	0	0	111	P49 K147 G148 L154 L155	P49-E151 WeakPolarHBondContact CB-O 3.35Å; P49-E151 HydrophobicContact CG-CB 4.06Å; P49-E151 HydrophobicContact CG-CG 4.43Å; K147-E151 WeakPolarHBondContact CA-OE1 3.4Å; K147-E151 VanDerWaalsContact CG-OE2 3.23Å; K147-E151 WeakPolarHBondContact CG-OE2 3.46Å; G148-E151 PolarHBondContact O-N 3.26Å; E151-L154 PolarHBondContact O-N 2.71Å; E151-L155 WeakPolarHBondContact O-CB 3.43Å; E151-L155 PolarHBondContact O-N 3.13Å
152	N	86.8	Confident	81.5	Confident	61 Å²	61	57.6 Å²	57.6	33%	0.326	29%	0.286	S	S	.	.	H	α-helix	trans	-64.4	-42.7	173.5	-177.4	63.7	0	0	0	111.9	F150 L154 L155 I156 A253	F150-N152 VanDerWaalsContact C-N 3.27Å; F150-N152 PolarHBondContact O-N 2.89Å; N152-L154 PolarHBondContact O-N 3.04Å; N152-L155 WeakPolarHBondContact O-CB 3.47Å; N152-L155 PolarHBondContact O-N 3.41Å; N152-I156 WeakPolarHBondContact O-CB 3.37Å; N152-I156 WeakPolarHBondContact O-CG1 3.44Å; N152-I156 PolarHBondContact O-N 3.22Å; N152-A253 PolarHBondContact ND2-O 2.89Å
153	E	89.5	Confident	82.1	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-46.5	176.4	-175.6	177.1	-177.8	0	0	111.2	K139 F150 I156 L157 F250	K139-E153 VanDerWaalsContact NZ-CD 3.27Å; K139-E153 IonicContact NZ-OE1 3.98Å; K139-E153 PolarHBondContact NZ-OE1 3.03Å; K139-E153 IonicContact NZ-OE2 2.63Å; K139-E153 PolarHBondContact NZ-OE2 2.94Å; F150-E153 WeakPolarHBondContact O-CB 3.42Å; F150-E153 PolarHBondContact O-N 3.05Å; F150-E153 VanDerWaalsContact O-N 3.13Å; E153-I156 PolarHBondContact O-N 3.49Å; E153-L157 HydrophobicContact CG-CD1 3.83Å; E153-L157 HydrophobicContact CG-CG 4.41Å; E153-L157 VanDerWaalsContact O-CB 3.3Å; E153-L157 WeakPolarHBondContact O-CB 3.16Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.3Å; E153-F250 HydrophobicContact CG-CB 4.06Å
154	L	90.1	Very high	82.9	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-41.5	176.8	-75.5	-175.6	0	0	0	112.9	V50 F150 E151 N152 I156 L157 S158 V171 V178 V180	V50-L154 HydrophobicContact CG2-CD1 3.61Å; F150-L154 HydrophobicContact CD2-CD1 3.59Å; F150-L154 HydrophobicContact CD2-CG 4.14Å; F150-L154 HydrophobicContact CE2-CD1 3.87Å; F150-L154 PolarHBondContact O-N 3.03Å; E151-L154 PolarHBondContact O-N 2.71Å; N152-L154 PolarHBondContact O-N 3.04Å; L154-I156 VanDerWaalsContact C-N 3.27Å; L154-I156 PolarHBondContact O-N 2.88Å; L154-L157 PolarHBondContact O-N 3.22Å; L154-S158 WeakPolarHBondContact O-CB 3.45Å; L154-S158 PolarHBondContact O-N 3.48Å; L154-V171 HydrophobicContact CD1-CG1 3.94Å; L154-V171 HydrophobicContact CD2-CG1 4.17Å; L154-V171 HydrophobicContact CD2-CG2 3.71Å; L154-V178 HydrophobicContact CD1-CG1 4.07Å; L154-V180 HydrophobicContact CD2-CB 4.33Å; L154-V180 HydrophobicContact CD2-CG1 3.79Å; L154-V180 HydrophobicContact CD2-CG2 3.59Å
155	L	90.9	Very high	84.2	Confident	35 Å²	35	54.7 Å²	54.7	18%	0.183	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-39.1	177.8	-174.4	66.3	0	0	0	111.8	P49 M52 E151 N152 S158 R159 L255	P49-L155 HydrophobicContact CB-CB 4.07Å; P49-L155 HydrophobicContact CB-CD1 4.25Å; P49-L155 HydrophobicContact CG-CB 4.37Å; P49-L155 HydrophobicContact CG-CD1 4.35Å; M52-L155 HydrophobicContact SD-CD1 3.95Å; E151-L155 WeakPolarHBondContact O-CB 3.43Å; E151-L155 PolarHBondContact O-N 3.13Å; N152-L155 WeakPolarHBondContact O-CB 3.47Å; N152-L155 PolarHBondContact O-N 3.41Å; L155-S158 PolarHBondContact O-OG 2.81Å; L155-R159 WeakPolarHBondContact O-CG 3.36Å; L155-L255 HydrophobicContact CD2-CD2 4Å; L155-L255 HydrophobicContact CG-CD2 4.13Å
156	I	93.2	Very high	86.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.6	-53	175.2	-72.5	168.9	0	0	0	109.9	N152 E153 L154 S158 R159 I160 V224 F250 A253 L255	N152-I156 WeakPolarHBondContact O-CB 3.37Å; N152-I156 WeakPolarHBondContact O-CG1 3.44Å; N152-I156 PolarHBondContact O-N 3.22Å; E153-I156 PolarHBondContact O-N 3.49Å; L154-I156 VanDerWaalsContact C-N 3.27Å; L154-I156 PolarHBondContact O-N 2.88Å; I156-S158 PolarHBondContact O-N 3.46Å; I156-R159 PolarHBondContact O-N 3.48Å; I156-I160 HydrophobicContact CG2-CD1 4.09Å; I156-I160 HydrophobicContact CG2-CG2 4.34Å; I156-I160 WeakPolarHBondContact O-CG2 3.48Å; I156-I160 PolarHBondContact O-N 2.97Å; I156-V224 HydrophobicContact CG1-CG2 4.45Å; I156-V224 HydrophobicContact CG2-CG1 3.92Å; I156-V224 HydrophobicContact CG2-CG2 4.01Å; I156-F250 HydrophobicContact CG2-CB 4.35Å; I156-F250 HydrophobicContact CG2-CD1 3.65Å; I156-F250 HydrophobicContact CG2-CE1 4.3Å; I156-F250 HydrophobicContact CG2-CG 4.16Å; I156-A253 HydrophobicContact CD1-CB 3.62Å; I156-L255 HydrophobicContact CD1-CB 4.11Å; I156-L255 HydrophobicContact CG1-CB 3.82Å
157	L	94.3	Very high	88.1	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-30.7	-177.9	-79.2	172.9	0	0	0	113.4	E153 L154 R159 I160 T166 L168 V180 L182 F250	E153-L157 HydrophobicContact CG-CD1 3.83Å; E153-L157 HydrophobicContact CG-CG 4.41Å; E153-L157 VanDerWaalsContact O-CB 3.3Å; E153-L157 WeakPolarHBondContact O-CB 3.16Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.3Å; L154-L157 PolarHBondContact O-N 3.22Å; L157-R159 VanDerWaalsContact C-N 3.34Å; L157-I160 HydrophobicContact CD2-CD1 4.09Å; L157-T166 HydrophobicContact CD2-CG2 4.15Å; L157-L168 HydrophobicContact CB-CB 4.16Å; L157-L168 HydrophobicContact CB-CD2 4.17Å; L157-L168 WeakPolarHBondContact O-CB 3.36Å; L157-V180 HydrophobicContact CD1-CG1 4.16Å; L157-L182 HydrophobicContact CD1-CD2 4.13Å; L157-L182 HydrophobicContact CD2-CD2 4.31Å; L157-F250 HydrophobicContact CD2-CD2 3.78Å; L157-F250 HydrophobicContact CD2-CE2 4.31Å; L157-F250 HydrophobicContact CD2-CG 4.41Å; L157-F250 HydrophobicContact CG-CD2 4.5Å
158	S	92.9	Very high	89.9	Confident	17 Å²	17	40 Å²	40	12%	0.119	19%	0.191	C	C	.	.	H	α-helix	trans	-75.5	-22.7	177.5	90.5	0	0	0	0	113	Q56 L154 L155 I156	Q56-S158 PolarHBondContact OE1-O 3.26Å; Q56-S158 PolarHBondContact OE1-OG 3.01Å; Q56-S158 VanDerWaalsContact OE1-OG 3.12Å; L154-S158 WeakPolarHBondContact O-CB 3.45Å; L154-S158 PolarHBondContact O-N 3.48Å; L155-S158 PolarHBondContact O-OG 2.81Å; I156-S158 PolarHBondContact O-N 3.46Å
159	R	91.3	Very high	91.6	Very high	114 Å²	114	42.3 Å²	42.3	43%	0.43	20%	0.201	S	C	.	.	H	α-helix	trans	-94.7	-15.9	-178.6	-71.5	-172.7	170.1	111.9	2	114.4	L155 I156 L157 L255	L155-R159 WeakPolarHBondContact O-CG 3.36Å; I156-R159 PolarHBondContact O-N 3.48Å; L157-R159 VanDerWaalsContact C-N 3.34Å; R159-L255 VanDerWaalsContact NH1-CD2 3.29Å
160	I	95	Very high	93	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	17%	0.17	C	C	.	.			trans	-99.5	138.9	-174.4	67.2	-174.6	0	0	0	112	I156 L157 V165 Q167 Y218 L219 V222 V224 F250	I156-I160 HydrophobicContact CG2-CD1 4.09Å; I156-I160 HydrophobicContact CG2-CG2 4.34Å; I156-I160 WeakPolarHBondContact O-CG2 3.48Å; I156-I160 PolarHBondContact O-N 2.97Å; L157-I160 HydrophobicContact CD2-CD1 4.09Å; I160-V165 HydrophobicContact CD1-CG1 3.56Å; I160-V165 HydrophobicContact CG1-CG1 4.13Å; I160-Q167 PolarHBondContact O-NE2 3.27Å; I160-Y218 WeakPolarHBondContact CA-OH 3.19Å; I160-Y218 HydrophobicContact CB-CE1 3.98Å; I160-Y218 HydrophobicContact CG2-CE1 4.24Å; I160-L219 HydrophobicContact CD1-CD2 4.31Å; I160-L219 HydrophobicContact CG2-CD2 4.01Å; I160-V222 HydrophobicContact CG2-CG2 4.16Å; I160-V224 HydrophobicContact CG2-CG2 4.2Å; I160-F250 HydrophobicContact CD1-CD1 4.23Å; I160-F250 HydrophobicContact CD1-CD2 4.25Å; I160-F250 HydrophobicContact CD1-CE1 3.79Å; I160-F250 HydrophobicContact CD1-CE2 3.82Å; I160-F250 HydrophobicContact CD1-CG 4.45Å; I160-F250 HydrophobicContact CD1-CZ 3.58Å
161	R	95.5	Very high	93.7	Very high	195 Å²	195	37.5 Å²	37.5	74%	0.736	17%	0.169	S	C	*	.			trans	-154.5	106.6	175.2	-179.4	162.4	-167.5	138.5	-0	109.8	Q167 Y218	R161-Q167 VanDerWaalsContact CG-OE1 3.22Å; R161-Y218 PolarHBondContact N-OH 2.83Å; R161-Y218 PolarHBondContact O-OH 3.31Å
162	H	97.6	Very high	94	Very high	51 Å²	51	36.4 Å²	36.4	24%	0.236	16%	0.164	C	C	.	.			trans	-157.2	147.7	-179.9	-176.5	-100.3	0	0	0	110.3	N164 V165 Y218	H162-N164 PolarHBondContact CE1-OD1 3.35Å; H162-N164 VanDerWaalsContact CE1-OD1 3.28Å; H162-N164 PolarHBondContact ND1-N 3.32Å; H162-N164 PolarHBondContact O-N 2.82Å; H162-V165 HydrophobicContact CB-CB 4.18Å; H162-V165 HydrophobicContact CB-CG2 4.07Å; H162-V165 PolarHBondContact O-N 3.47Å; H162-V165 VanDerWaalsContact O-N 3.08Å; H162-Y218 HydrophobicContact CB-CD1 3.42Å; H162-Y218 VanDerWaalsContact CB-CD1 3.42Å; H162-Y218 HydrophobicContact CB-CD2 4.17Å; H162-Y218 HydrophobicContact CB-CE1 3.67Å; H162-Y218 HydrophobicContact CB-CE2 4.39Å; H162-Y218 HydrophobicContact CB-CG 3.69Å; H162-Y218 AromaticContact CD2-CG 3.81Å; H162-Y218 AromaticContact CG-CD1 3.91Å; H162-Y218 AromaticContact CG-CG 3.75Å
163	Q	96.7	Very high	94.1	Very high	114 Å²	114	36.2 Å²	36.2	53%	0.533	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31	-176.4	70	-179.1	7.6	0	0	113.4	K244	Q163-K244 WeakPolarHBondContact O-CD 3.36Å
164	N	97.9	Very high	93.9	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	20.1	179.8	-57.2	109.3	0	0	0	113.5	H162 Q211 Q214 L245 I247	H162-N164 PolarHBondContact CE1-OD1 3.35Å; H162-N164 VanDerWaalsContact CE1-OD1 3.28Å; H162-N164 PolarHBondContact ND1-N 3.32Å; H162-N164 PolarHBondContact O-N 2.82Å; N164-Q211 WeakPolarHBondContact CB-O 3.41Å; N164-Q211 WeakPolarHBondContact ND2-CB 3.35Å; N164-Q211 PolarHBondContact ND2-OE1 2.74Å; N164-Q211 VanDerWaalsContact ND2-OE1 3.1Å; N164-Q214 PolarHBondContact OD1-OE1 3.35Å; N164-L245 VanDerWaalsContact CA-O 3.22Å; N164-L245 WeakPolarHBondContact CA-O 3.48Å; N164-L245 WeakPolarHBondContact CB-O 3.4Å; N164-L245 PolarHBondContact ND2-O 2.82Å; N164-I247 PolarHBondContact O-N 3.26Å
165	V	97.7	Very high	93.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-136.8	137.5	178.1	177.1	0	0	0	0	108.5	I160 H162 Q167 Y218 L219 I247 F250	I160-V165 HydrophobicContact CD1-CG1 3.56Å; I160-V165 HydrophobicContact CG1-CG1 4.13Å; H162-V165 HydrophobicContact CB-CB 4.18Å; H162-V165 HydrophobicContact CB-CG2 4.07Å; H162-V165 PolarHBondContact O-N 3.47Å; H162-V165 VanDerWaalsContact O-N 3.08Å; V165-Q167 PolarHBondContact O-N 3.49Å; V165-Y218 HydrophobicContact CG2-CD1 4.24Å; V165-L219 HydrophobicContact CG1-CD2 4.39Å; V165-L219 HydrophobicContact CG2-CD1 4.4Å; V165-L219 HydrophobicContact CG2-CD2 4.17Å; V165-L219 HydrophobicContact CG2-CG 4.15Å; V165-I247 HydrophobicContact CG2-CB 4.48Å; V165-F250 HydrophobicContact CG1-CE2 3.86Å; V165-F250 HydrophobicContact CG1-CZ 3.54Å
166	T	96	Very high	93.2	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.049	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-59	133.9	178	-172.4	0	0	0	0	111.5	L157 I247 T248 F250	L157-T166 HydrophobicContact CD2-CG2 4.15Å; T166-I247 PolarHBondContact N-O 2.78Å; T166-T248 HydrophobicContact CG2-CG2 4.32Å; T166-F250 HydrophobicContact CG2-CD2 4.42Å; T166-F250 HydrophobicContact CG2-CE2 4.06Å
167	Q	96.2	Very high	93	Very high	37 Å²	37	48.5 Å²	48.5	17%	0.173	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-89.3	134.2	178.9	-173.9	56.3	64.6	0	0	111.7	I160 R161 V165 I169 L182 E183	I160-Q167 PolarHBondContact O-NE2 3.27Å; R161-Q167 VanDerWaalsContact CG-OE1 3.22Å; V165-Q167 PolarHBondContact O-N 3.49Å; Q167-I169 HydrophobicContact CG-CD1 4.33Å; Q167-L182 WeakPolarHBondContact O-CA 3.3Å; Q167-E183 HydrophobicContact CB-CB 4.31Å; Q167-E183 PolarHBondContact O-N 3.15Å
168	L	96.1	Very high	92.8	Very high	17 Å²	17	48.5 Å²	48.5	9%	0.089	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.5	164.2	-177.8	64.3	0	0	0	110.5	A53 L157 V171 V180 L182	A53-L168 HydrophobicContact CB-CD2 4.16Å; L157-L168 HydrophobicContact CB-CB 4.16Å; L157-L168 HydrophobicContact CB-CD2 4.17Å; L157-L168 WeakPolarHBondContact O-CB 3.36Å; L168-V171 HydrophobicContact CD1-CG2 3.83Å; L168-V171 HydrophobicContact CD2-CG2 4Å; L168-V171 HydrophobicContact CG-CG2 4.38Å; L168-V180 HydrophobicContact CD1-CG1 3.43Å; L168-V180 VanDerWaalsContact CD1-CG1 3.43Å; L168-L182 HydrophobicContact CB-CD2 4.4Å; L168-L182 HydrophobicContact CD1-CD2 3.87Å
169	I	95.8	Very high	92.8	Very high	57 Å²	57	47.9 Å²	47.9	29%	0.292	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-59.1	177.6	-50.3	-58.1	0	0	0	109.6	F136 Q167 V181	F136-I169 HydrophobicContact CD1-CD1 4.35Å; F136-I169 HydrophobicContact CD1-CG1 3.75Å; F136-I169 HydrophobicContact CD1-CG2 4.42Å; F136-I169 HydrophobicContact CE1-CD1 4.09Å; F136-I169 HydrophobicContact CE1-CG1 3.89Å; F136-I169 HydrophobicContact CE1-CG2 4.12Å; Q167-I169 HydrophobicContact CG-CD1 4.33Å; I169-V181 WeakPolarHBondContact CA-O 3.27Å; I169-V181 HydrophobicContact CB-CB 4.27Å; I169-V181 HydrophobicContact CB-CG1 4.05Å; I169-V181 WeakPolarHBondContact CB-O 3.47Å; I169-V181 HydrophobicContact CG1-CG1 4.46Å; I169-V181 HydrophobicContact CG2-CG1 4.4Å; I169-V181 PolarHBondContact N-O 3.21Å
170	E	94.9	Very high	92.9	Very high	15 Å²	15	42.6 Å²	42.6	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	167.7	176	67.2	-175.5	132.3	0	0	114.4	Q57 K109 Y110 F172 V181	Q57-E170 VanDerWaalsContact NE2-CA 3.32Å; K109-E170 WeakPolarHBondContact CD-OE1 3.45Å; K109-E170 WeakPolarHBondContact CE-OE1 3.24Å; K109-E170 IonicContact NZ-OE1 3.34Å; K109-E170 PolarHBondContact NZ-OE1 2.88Å; K109-E170 IonicContact NZ-OE2 3.97Å; K109-E170 PolarHBondContact NZ-OE2 3.24Å; Y110-E170 HydrophobicContact CE2-CG 4.49Å; Y110-E170 WeakPolarHBondContact CE2-OE1 3.47Å; Y110-E170 PolarHBondContact OH-OE1 2.78Å; E170-F172 VanDerWaalsContact CD-CZ 3.4Å; E170-F172 HydrophobicContact CG-CD2 4.47Å; E170-F172 HydrophobicContact CG-CE2 3.64Å; E170-F172 HydrophobicContact CG-CZ 4.04Å; E170-F172 WeakPolarHBondContact OE2-CZ 3.12Å; E170-V181 HydrophobicContact CG-CB 3.82Å; E170-V181 HydrophobicContact CG-CG2 3.73Å; E170-V181 PolarHBondContact N-O 2.83Å; E170-V181 PolarHBondContact O-N 3.43Å
171	V	93.6	Very high	93	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.6	-179	-173.2	0	0	0	0	111	V50 A53 Q54 L154 L168 V178 Y179	V50-V171 HydrophobicContact CG1-CG1 3.94Å; A53-V171 HydrophobicContact CB-CG2 3.95Å; Q54-V171 PolarHBondContact NE2-O 2.99Å; L154-V171 HydrophobicContact CD1-CG1 3.94Å; L154-V171 HydrophobicContact CD2-CG1 4.17Å; L154-V171 HydrophobicContact CD2-CG2 3.71Å; L168-V171 HydrophobicContact CD1-CG2 3.83Å; L168-V171 HydrophobicContact CD2-CG2 4Å; L168-V171 HydrophobicContact CG-CG2 4.38Å; V171-V178 HydrophobicContact CG1-CG1 4.04Å; V171-Y179 CarbonylContact C-O 3.59Å; V171-Y179 WeakPolarHBondContact CA-O 3.18Å
172	F	92.2	Very high	93.1	Very high	20 Å²	20	34.2 Å²	34.2	9%	0.088	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.5	167.7	-51	-95	0	0	0	109.7	R105 V106 K109 Y110 E170 V178 Y179 V181	R105-F172 HydrophobicContact CB-CD1 3.97Å; R105-F172 HydrophobicContact CB-CE1 4.15Å; V106-F172 HydrophobicContact CG2-CB 3.77Å; V106-F172 HydrophobicContact CG2-CD1 4.14Å; V106-F172 HydrophobicContact CG2-CD2 3.73Å; V106-F172 HydrophobicContact CG2-CE2 4.34Å; V106-F172 HydrophobicContact CG2-CG 3.61Å; K109-F172 HydrophobicContact CD-CZ 4.19Å; Y110-F172 HydrophobicContact CD2-CE2 4.36Å; Y110-F172 AromaticContact CE2-CE2 3.95Å; Y110-F172 HydrophobicContact CE2-CE2 3.95Å; Y110-F172 HydrophobicContact CE2-CZ 4.1Å; E170-F172 VanDerWaalsContact CD-CZ 3.4Å; E170-F172 HydrophobicContact CG-CD2 4.47Å; E170-F172 HydrophobicContact CG-CE2 3.64Å; E170-F172 HydrophobicContact CG-CZ 4.04Å; E170-F172 WeakPolarHBondContact OE2-CZ 3.12Å; F172-V178 CarbonylContact O-C 3.54Å; F172-V178 WeakPolarHBondContact O-CA 3.49Å; F172-Y179 HydrophobicContact CB-CD2 4.02Å; F172-Y179 HydrophobicContact CB-CG 4.38Å; F172-Y179 PolarHBondContact N-O 2.88Å; F172-Y179 PolarHBondContact O-N 2.97Å; F172-V181 HydrophobicContact CD2-CG2 4.35Å; F172-V181 HydrophobicContact CE2-CG2 3.97Å
173	Q	89	Confident	93	Very high	57 Å²	57	34.3 Å²	34.3	27%	0.266	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138	173	179.5	178.5	15.5	0	0	110.5	V50 R105 V178	V50-Q173 HydrophobicContact CG1-CB 3.74Å; V50-Q173 VanDerWaalsContact CG1-OE1 3.3Å; V50-Q173 HydrophobicContact CG2-CB 4.44Å; R105-Q173 PolarHBondContact NH1-O 3.28Å; R105-Q173 PolarHBondContact NH2-O 3Å; Q173-V178 HydrophobicContact CG-CG2 4.21Å
174	T	86.2	Confident	92.9	Very high	19 Å²	19	30 Å²	30	12%	0.117	15%	0.153	C	C	.	.			trans	-121.8	171.8	169.2	66.9	0	0	0	0	108.7	D103 A143 T176 R177 Y179	D103-T174 HydrophobicContact CB-CG2 3.76Å; D103-T174 WeakPolarHBondContact OD2-CG2 3.12Å; A143-T174 WeakPolarHBondContact CB-O 3.28Å; T174-T176 PolarHBondContact O-N 3.22Å; T174-T176 PolarHBondContact OG1-N 2.81Å; T174-T176 PolarHBondContact OG1-OG1 2.88Å; T174-R177 PolarHBondContact N-O 2.9Å; T174-R177 WeakPolarHBondContact OG1-CA 3.23Å; T174-R177 PolarHBondContact OG1-N 3.01Å; T174-R177 PolarHBondContact OG1-O 3.44Å; T174-Y179 HydrophobicContact CG2-CE2 4.07Å
175	N	82	Confident	92.7	Very high	152 Å²	152	31 Å²	31	81%	0.813	16%	0.162	S	C	*	.	S	Bend	trans	-61.8	-14.8	174.7	-62.8	-15.1	0	0	0	113.7
176	T	83.6	Confident	92.5	Very high	81 Å²	81	34.9 Å²	34.9	50%	0.497	19%	0.185	S	C	.	.	S	Bend	trans	-122.1	-21.4	-174	55.1	0	0	0	0	114.3	A143 T174	A143-T176 VanDerWaalsContact CB-C 3.5Å; A143-T176 PolarHBondContact N-O 2.79Å; T174-T176 PolarHBondContact O-N 3.22Å; T174-T176 PolarHBondContact OG1-N 2.81Å; T174-T176 PolarHBondContact OG1-OG1 2.88Å
177	R	87.8	Confident	92.2	Very high	58 Å²	58	35 Å²	35	22%	0.219	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	145.5	-168.2	-66	-176.5	177	-153.8	-9.2	111.5	P101 M140 M141 T174 Y179	P101-R177 PolarHBondContact O-NH1 2.98Å; P101-R177 VanDerWaalsContact O-NH1 3.15Å; M140-R177 VanDerWaalsContact CE-NH1 3.31Å; M141-R177 CarbonylContact O-C 3.49Å; M141-R177 WeakPolarHBondContact O-CA 3.45Å; T174-R177 PolarHBondContact N-O 2.9Å; T174-R177 WeakPolarHBondContact OG1-CA 3.23Å; T174-R177 PolarHBondContact OG1-N 3.01Å; T174-R177 PolarHBondContact OG1-O 3.44Å; R177-Y179 HydrophobicContact CB-CD2 4.49Å; R177-Y179 HydrophobicContact CB-CE2 3.74Å; R177-Y179 WeakPolarHBondContact CD-OH 3.46Å
178	V	90.2	Very high	91.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.6	168.5	-175.4	0	0	0	0	108.2	M140 M141 A143 F150 L154 V171 F172 Q173 V180	M140-V178 WeakPolarHBondContact CA-O 3.42Å; M141-V178 HydrophobicContact CE-CB 3.53Å; M141-V178 HydrophobicContact CE-CG1 4.23Å; M141-V178 HydrophobicContact CE-CG2 3.65Å; M141-V178 HydrophobicContact CG-CB 4.18Å; M141-V178 PolarHBondContact N-O 3.46Å; M141-V178 VanDerWaalsContact N-O 3.07Å; M141-V178 PolarHBondContact O-N 2.86Å; M141-V178 HydrophobicContact SD-CB 4.2Å; M141-V178 HydrophobicContact SD-CG1 4.46Å; A143-V178 HydrophobicContact CB-CG2 4.04Å; F150-V178 HydrophobicContact CD1-CG2 4.46Å; F150-V178 HydrophobicContact CD2-CG1 4.3Å; F150-V178 HydrophobicContact CD2-CG2 4.1Å; F150-V178 HydrophobicContact CE1-CG2 4.02Å; F150-V178 HydrophobicContact CE2-CG1 4.34Å; F150-V178 HydrophobicContact CE2-CG2 3.67Å; F150-V178 HydrophobicContact CZ-CG2 3.63Å; L154-V178 HydrophobicContact CD1-CG1 4.07Å; V171-V178 HydrophobicContact CG1-CG1 4.04Å; F172-V178 CarbonylContact O-C 3.54Å; F172-V178 WeakPolarHBondContact O-CA 3.49Å; Q173-V178 HydrophobicContact CG-CG2 4.21Å; V178-V180 HydrophobicContact CG1-CG2 4.05Å
179	Y	93.2	Very high	91.5	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.02	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.4	178.3	-53.3	-102.2	0	0	0	107.5	F102 D103 V106 M138 M140 V171 F172 T174 R177	F102-Y179 HydrophobicContact CD1-CE1 4.12Å; D103-Y179 HydrophobicContact CB-CE2 3.99Å; D103-Y179 PolarHBondContact N-OH 3.47Å; V106-Y179 HydrophobicContact CG1-CD1 4.23Å; V106-Y179 HydrophobicContact CG2-CD1 3.91Å; V106-Y179 HydrophobicContact CG2-CD2 3.86Å; V106-Y179 HydrophobicContact CG2-CE1 4.25Å; V106-Y179 HydrophobicContact CG2-CE2 4.2Å; V106-Y179 HydrophobicContact CG2-CG 3.72Å; M138-Y179 HydrophobicContact SD-CD1 3.85Å; M140-Y179 HydrophobicContact CE-CD1 4.14Å; M140-Y179 HydrophobicContact CE-CE1 3.46Å; M140-Y179 VanDerWaalsContact CE-CE1 3.46Å; M140-Y179 HydrophobicContact CG-CD1 3.52Å; M140-Y179 HydrophobicContact CG-CE1 3.89Å; M140-Y179 HydrophobicContact CG-CG 4.41Å; M140-Y179 HydrophobicContact SD-CD1 3.82Å; M140-Y179 HydrophobicContact SD-CE1 3.65Å; V171-Y179 CarbonylContact C-O 3.59Å; V171-Y179 WeakPolarHBondContact CA-O 3.18Å; F172-Y179 HydrophobicContact CB-CD2 4.02Å; F172-Y179 HydrophobicContact CB-CG 4.38Å; F172-Y179 PolarHBondContact N-O 2.88Å; F172-Y179 PolarHBondContact O-N 2.97Å; T174-Y179 HydrophobicContact CG2-CE2 4.07Å; R177-Y179 HydrophobicContact CB-CD2 4.49Å; R177-Y179 HydrophobicContact CB-CE2 3.74Å; R177-Y179 WeakPolarHBondContact CD-OH 3.46Å
180	V	94.6	Very high	91	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110	-179.3	-169	0	0	0	0	107.5	M138 K139 L154 L157 L168 V178 L182	M138-V180 CarbonylContact C-O 3.14Å; M138-V180 WeakPolarHBondContact CA-O 3.33Å; K139-V180 HydrophobicContact CB-CB 4.3Å; K139-V180 PolarHBondContact N-O 3.27Å; K139-V180 PolarHBondContact O-N 3.09Å; L154-V180 HydrophobicContact CD2-CB 4.33Å; L154-V180 HydrophobicContact CD2-CG1 3.79Å; L154-V180 HydrophobicContact CD2-CG2 3.59Å; L157-V180 HydrophobicContact CD1-CG1 4.16Å; L168-V180 HydrophobicContact CD1-CG1 3.43Å; L168-V180 VanDerWaalsContact CD1-CG1 3.43Å; V178-V180 HydrophobicContact CG1-CG2 4.05Å; V180-L182 HydrophobicContact CG1-CD2 3.83Å; V180-L182 HydrophobicContact CG1-CG 4.14Å
181	V	96.4	Very high	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.6	178.2	-171.4	0	0	0	0	108.5	Y110 F136 A137 M138 I169 E170 F172	Y110-V181 HydrophobicContact CE1-CG1 4.24Å; Y110-V181 HydrophobicContact CE2-CG2 4.14Å; F136-V181 HydrophobicContact CB-CG1 3.66Å; F136-V181 HydrophobicContact CD1-CG1 4.4Å; F136-V181 HydrophobicContact CG-CG1 4.02Å; A137-V181 CarbonylContact O-C 3.5Å; A137-V181 WeakPolarHBondContact O-CA 3.4Å; M138-V181 HydrophobicContact CE-CG2 3.75Å; M138-V181 HydrophobicContact CG-CG2 4.42Å; I169-V181 WeakPolarHBondContact CA-O 3.27Å; I169-V181 HydrophobicContact CB-CB 4.27Å; I169-V181 HydrophobicContact CB-CG1 4.05Å; I169-V181 WeakPolarHBondContact CB-O 3.47Å; I169-V181 HydrophobicContact CG1-CG1 4.46Å; I169-V181 HydrophobicContact CG2-CG1 4.4Å; I169-V181 PolarHBondContact N-O 3.21Å; E170-V181 HydrophobicContact CG-CB 3.82Å; E170-V181 HydrophobicContact CG-CG2 3.73Å; E170-V181 PolarHBondContact N-O 2.83Å; E170-V181 PolarHBondContact O-N 3.43Å; F172-V181 HydrophobicContact CD2-CG2 4.35Å; F172-V181 HydrophobicContact CE2-CG2 3.97Å
182	L	96.8	Very high	89.6	Confident	20 Å²	20	37 Å²	37	11%	0.105	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	158.4	-173.8	-59.2	174.8	0	0	0	110.2	F136 A137 L157 Q167 L168 V180 L184	F136-L182 WeakPolarHBondContact CB-O 3.33Å; A137-L182 HydrophobicContact CB-CB 4.43Å; A137-L182 PolarHBondContact N-O 3.25Å; A137-L182 PolarHBondContact O-N 3.47Å; L157-L182 HydrophobicContact CD1-CD2 4.13Å; L157-L182 HydrophobicContact CD2-CD2 4.31Å; Q167-L182 WeakPolarHBondContact O-CA 3.3Å; L168-L182 HydrophobicContact CB-CD2 4.4Å; L168-L182 HydrophobicContact CD1-CD2 3.87Å; V180-L182 HydrophobicContact CG1-CD2 3.83Å; V180-L182 HydrophobicContact CG1-CG 4.14Å; L182-L184 PolarHBondContact O-N 3.03Å
183	E	95.9	Very high	89	Confident	53 Å²	53	37.8 Å²	37.8	25%	0.248	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.7	134.3	165.1	-175.3	176.2	-175.7	0	0	110.5	Q167 K244 M246	Q167-E183 HydrophobicContact CB-CB 4.31Å; Q167-E183 PolarHBondContact O-N 3.15Å; E183-K244 WeakPolarHBondContact OE1-CE 3.49Å; E183-K244 IonicContact OE1-NZ 3.02Å; E183-K244 PolarHBondContact OE1-NZ 3.47Å; E183-K244 IonicContact OE2-NZ 2.72Å; E183-M246 HydrophobicContact CG-SD 4.38Å
184	L	95.5	Very high	88.4	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.12	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-89	118.6	178.5	-178.5	64.9	0	0	0	110.7	I116 K126 A135 A137 L182 T186	I116-L184 HydrophobicContact CD1-CD1 3.87Å; K126-L184 HydrophobicContact CD-CD2 4.18Å; K126-L184 HydrophobicContact CG-CD2 4.03Å; A135-L184 HydrophobicContact CB-CD2 3.8Å; A137-L184 HydrophobicContact CB-CD1 3.95Å; L182-L184 PolarHBondContact O-N 3.03Å; L184-T186 HydrophobicContact CD2-CG2 3.82Å; L184-T186 HydrophobicContact CG-CG2 3.87Å
185	A	94.2	Very high	87.9	Confident	23 Å²	23	35.3 Å²	35.3	19%	0.19	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-81.4	125	164.3	0	0	0	0	0	110.2	L235 Y236 M246	A185-L235 HydrophobicContact CB-CB 3.43Å; A185-L235 VanDerWaalsContact CB-CB 3.43Å; A185-L235 HydrophobicContact CB-CD1 3.76Å; A185-L235 HydrophobicContact CB-CG 4.24Å; A185-Y236 WeakPolarHBondContact CB-O 3.19Å; A185-M246 HydrophobicContact CB-CE 3.54Å
186	T	91.7	Very high	87.5	Confident	83 Å²	83	35.4 Å²	35.4	51%	0.509	19%	0.193	S	C	.	.			trans	-112.2	-5.6	-179.4	59.8	0	0	0	0	113.6	L184 G188 Y236 A237	L184-T186 HydrophobicContact CD2-CG2 3.82Å; L184-T186 HydrophobicContact CG-CG2 3.87Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.42Å; T186-Y236 PolarHBondContact N-O 3.3Å; T186-A237 PolarHBondContact N-O 2.89Å; T186-A237 PolarHBondContact OG1-O 3.37Å
187	G	89.6	Confident	87	Confident	11 Å²	11	37 Å²	37	11%	0.113	19%	0.193	C	C	.	.	S	Bend	trans	-85.9	3.2	-175.3	0	0	0	0	0	116.2	R193 Y236 T238	G187-R193 PolarHBondContact O-NE 2.97Å; G187-R193 PolarHBondContact O-NH2 3.31Å; G187-Y236 VanDerWaalsContact CA-O 3.24Å; G187-Y236 WeakPolarHBondContact CA-O 3.48Å; G187-Y236 PolarHBondContact N-O 3.09Å; G187-T238 WeakPolarHBondContact CA-O 3.43Å
188	G	88.6	Confident	86.2	Confident	32 Å²	32	35.2 Å²	35.2	33%	0.33	19%	0.192	S	C	.	.			trans	77.3	177.4	-174.9	0	0	0	0	0	113.6	T186 Y236	T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.42Å; G188-Y236 PolarHBondContact O-N 3.42Å
189	E	89.3	Confident	85.6	Confident	67 Å²	67	36 Å²	36	31%	0.313	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-74.5	151.8	176.5	-64.3	174.9	-162.1	0	0	111	Y191 D192 R193 L235	E189-Y191 PolarHBondContact O-N 3.12Å; E189-D192 PolarHBondContact O-N 2.96Å; E189-R193 PolarHBondContact O-N 2.96Å; E189-L235 HydrophobicContact CB-CD2 4.21Å; E189-L235 HydrophobicContact CG-CD2 3.52Å
190	L	86	Confident	85.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.8	-39.6	169.6	179.6	61.6	0	0	0	110.6	D192 R193 I194 Y200 I212 L234 Y236 L245 I296 L300	L190-D192 PolarHBondContact O-N 3.24Å; L190-R193 PolarHBondContact O-N 3.17Å; L190-I194 HydrophobicContact CD1-CD1 4.39Å; L190-I194 HydrophobicContact CD1-CG1 4.4Å; L190-I194 HydrophobicContact CG-CD1 3.94Å; L190-I194 HydrophobicContact CG-CG1 4.41Å; L190-I194 WeakPolarHBondContact O-CG1 3.18Å; L190-I194 PolarHBondContact O-N 3.36Å; L190-Y200 HydrophobicContact CD1-CE2 4.17Å; L190-I212 HydrophobicContact CD2-CD1 4.1Å; L190-L234 HydrophobicContact CB-CB 3.91Å; L190-L234 WeakPolarHBondContact CB-O 3.27Å; L190-L234 HydrophobicContact CD2-CB 4.19Å; L190-L234 HydrophobicContact CD2-CD1 3.65Å; L190-L234 PolarHBondContact N-O 2.91Å; L190-Y236 HydrophobicContact CB-CE2 4.39Å; L190-Y236 HydrophobicContact CD1-CE2 3.73Å; L190-Y236 WeakPolarHBondContact CD1-OH 3.49Å; L190-L245 HydrophobicContact CB-CD2 4.31Å; L190-L245 HydrophobicContact CD1-CD1 4.3Å; L190-L245 HydrophobicContact CD1-CD2 4.38Å; L190-I296 HydrophobicContact CD2-CG2 4.14Å; L190-L300 HydrophobicContact CD1-CD2 4.04Å; L190-L300 HydrophobicContact CD2-CD2 4.33Å; L190-L300 HydrophobicContact CG-CD2 4.39Å
191	Y	78.7	Confident	84.8	Confident	11 Å²	11	39.2 Å²	39.2	4%	0.043	22%	0.216	C	C	.	.	H	α-helix	trans	-51	-51.1	175.3	176.8	-97.1	0	0	0	112.9	E189 R193 I194 T195 I400 A404	E189-Y191 PolarHBondContact O-N 3.12Å; Y191-R193 VanDerWaalsContact C-N 3.3Å; Y191-R193 PolarHBondContact O-N 2.81Å; Y191-I194 PolarHBondContact O-N 3.21Å; Y191-T195 WeakPolarHBondContact CE1-OG1 3.47Å; Y191-T195 VanDerWaalsContact CZ-OG1 3.28Å; Y191-T195 WeakPolarHBondContact O-CB 3.4Å; Y191-T195 PolarHBondContact O-N 2.99Å; Y191-T195 PolarHBondContact O-OG1 3.33Å; Y191-I400 HydrophobicContact CD2-CD1 3.54Å; Y191-I400 HydrophobicContact CD2-CG1 4.1Å; Y191-I400 HydrophobicContact CE2-CB 4.43Å; Y191-I400 HydrophobicContact CE2-CD1 3.67Å; Y191-I400 HydrophobicContact CE2-CG1 3.75Å; Y191-I400 HydrophobicContact CE2-CG2 4.28Å; Y191-I400 PolarHBondContact OH-O 3.37Å; Y191-A404 HydrophobicContact CD2-CB 3.94Å; Y191-A404 HydrophobicContact CE1-CB 4.33Å; Y191-A404 HydrophobicContact CE2-CB 3.22Å; Y191-A404 VanDerWaalsContact CZ-CB 3.47Å
192	D	80.6	Confident	84.6	Confident	59 Å²	59	41.1 Å²	41.1	32%	0.316	23%	0.225	S	C	.	.	H	α-helix	trans	-62.9	-39.9	-176.3	-74.4	-32.5	0	0	0	111.3	E189 L190 T195 Q196	E189-D192 PolarHBondContact O-N 2.96Å; L190-D192 PolarHBondContact O-N 3.24Å; D192-T195 PolarHBondContact O-N 3.13Å; D192-Q196 WeakPolarHBondContact O-CB 3.35Å; D192-Q196 WeakPolarHBondContact O-CG 3.41Å; D192-Q196 PolarHBondContact O-N 3.48Å
193	R	80.2	Confident	84.3	Confident	37 Å²	37	41.5 Å²	41.5	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-40.9	178.1	-64.2	-151.5	-170.2	-174	-2.8	112.4	G187 E189 L190 Y191 K197 Y200 Y236 T238 S240	G187-R193 PolarHBondContact O-NE 2.97Å; G187-R193 PolarHBondContact O-NH2 3.31Å; E189-R193 PolarHBondContact O-N 2.96Å; L190-R193 PolarHBondContact O-N 3.17Å; Y191-R193 VanDerWaalsContact C-N 3.3Å; Y191-R193 PolarHBondContact O-N 2.81Å; R193-K197 PolarHBondContact O-N 2.99Å; R193-Y200 HydrophobicContact CB-CE1 4.44Å; R193-Y200 WeakPolarHBondContact CB-OH 3.35Å; R193-Y236 HydrophobicContact CB-CE2 4.21Å; R193-Y236 HydrophobicContact CG-CD2 4.05Å; R193-Y236 HydrophobicContact CG-CE2 3.79Å; R193-Y236 VanDerWaalsContact CZ-CG 3.45Å; R193-T238 PolarHBondContact NH2-O 3.11Å; R193-S240 PolarHBondContact NH1-O 3.29Å
194	I	76.3	Confident	84	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-48.5	174.2	-60.8	166.9	0	0	0	109.5	L190 Y191 Q196 K197 G198 Y200 I299 L300 I400	L190-I194 HydrophobicContact CD1-CD1 4.39Å; L190-I194 HydrophobicContact CD1-CG1 4.4Å; L190-I194 HydrophobicContact CG-CD1 3.94Å; L190-I194 HydrophobicContact CG-CG1 4.41Å; L190-I194 WeakPolarHBondContact O-CG1 3.18Å; L190-I194 PolarHBondContact O-N 3.36Å; Y191-I194 PolarHBondContact O-N 3.21Å; I194-Q196 VanDerWaalsContact C-N 3.3Å; I194-Q196 PolarHBondContact O-N 2.87Å; I194-K197 CarbonylContact O-C 3.59Å; I194-K197 PolarHBondContact O-N 2.91Å; I194-K197 VanDerWaalsContact O-N 3.11Å; I194-G198 CarbonylContact O-C 3.41Å; I194-G198 WeakPolarHBondContact O-CA 3.48Å; I194-G198 PolarHBondContact O-N 2.93Å; I194-Y200 HydrophobicContact CB-CE1 4.41Å; I194-Y200 HydrophobicContact CG1-CD1 4.25Å; I194-Y200 HydrophobicContact CG1-CE1 3.8Å; I194-I299 HydrophobicContact CD1-CG2 4.36Å; I194-L300 HydrophobicContact CD1-CD2 3.39Å; I194-L300 HydrophobicContact CD1-CG 4.1Å; I194-L300 HydrophobicContact CG1-CD2 3.62Å; I194-I400 HydrophobicContact CG2-CD1 4.41Å
195	T	73.9	Confident	83.9	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-36	-174	-56.2	0	0	0	0	112.8	Y191 D192 R401	Y191-T195 WeakPolarHBondContact CE1-OG1 3.47Å; Y191-T195 VanDerWaalsContact CZ-OG1 3.28Å; Y191-T195 WeakPolarHBondContact O-CB 3.4Å; Y191-T195 PolarHBondContact O-N 2.99Å; Y191-T195 PolarHBondContact O-OG1 3.33Å; D192-T195 PolarHBondContact O-N 3.13Å; T195-R401 HydrophobicContact CG2-CG 3.47Å; T195-R401 VanDerWaalsContact CG2-CG 3.47Å; T195-R401 PolarHBondContact O-NE 3.19Å; T195-R401 PolarHBondContact O-NH2 3.02Å
196	Q	75.3	Confident	83.9	Confident	155 Å²	155	39.6 Å²	39.6	72%	0.724	22%	0.216	S	C	*	.	H	α-helix	trans	-69.5	-37.1	175	-72.8	170.2	27.7	0	0	112.5	D192 I194	D192-Q196 WeakPolarHBondContact O-CB 3.35Å; D192-Q196 WeakPolarHBondContact O-CG 3.41Å; D192-Q196 PolarHBondContact O-N 3.48Å; I194-Q196 VanDerWaalsContact C-N 3.3Å; I194-Q196 PolarHBondContact O-N 2.87Å
197	K	73.1	Confident	84	Confident	114 Å²	114	39.6 Å²	39.6	50%	0.496	21%	0.209	S	C	.	.	H	α-helix	trans	-87.9	-23.3	-178.9	-70.7	-175.6	174.8	-178	0	114.3	R193 I194 C199 Y200 E204	R193-K197 PolarHBondContact O-N 2.99Å; I194-K197 CarbonylContact O-C 3.59Å; I194-K197 PolarHBondContact O-N 2.91Å; I194-K197 VanDerWaalsContact O-N 3.11Å; K197-C199 PolarHBondContact O-N 3.38Å; K197-Y200 HydrophobicContact CD-CD1 4.39Å; K197-Y200 HydrophobicContact CD-CE1 4.18Å; K197-E204 IonicContact NZ-OE1 3.67Å; K197-E204 PolarHBondContact NZ-OE1 3.37Å
198	G	70.7	Confident	84.2	Confident	20 Å²	20	39.1 Å²	39.1	21%	0.206	20%	0.204	C	C	.	.	S	Bend	trans	90.4	-63.7	-169.1	0	0	0	0	0	111.5	I194 G303	I194-G198 CarbonylContact O-C 3.41Å; I194-G198 WeakPolarHBondContact O-CA 3.48Å; I194-G198 PolarHBondContact O-N 2.93Å; G198-G303 WeakPolarHBondContact O-CA 3.45Å
199	C	76.2	Confident	84.6	Confident	18 Å²	18	37.6 Å²	37.6	12%	0.122	19%	0.188	C	C	.	.	S	Bend	trans	-145.3	163.7	175.1	63.8	0	0	0	0	110.6	K197 H382	K197-C199 PolarHBondContact O-N 3.38Å; C199-H382 PolarHBondContact SG-ND1 3.46Å
200	Y	83.2	Confident	85	Confident	12 Å²	12	37.5 Å²	37.5	5%	0.047	19%	0.186	C	C	.	.			trans	-91	144.2	174.2	-81.3	22.3	0	0	0	109.9	L190 R193 I194 K197 E204 A208 Y236 L300	L190-Y200 HydrophobicContact CD1-CE2 4.17Å; R193-Y200 HydrophobicContact CB-CE1 4.44Å; R193-Y200 WeakPolarHBondContact CB-OH 3.35Å; I194-Y200 HydrophobicContact CB-CE1 4.41Å; I194-Y200 HydrophobicContact CG1-CD1 4.25Å; I194-Y200 HydrophobicContact CG1-CE1 3.8Å; K197-Y200 HydrophobicContact CD-CD1 4.39Å; K197-Y200 HydrophobicContact CD-CE1 4.18Å; Y200-E204 HydrophobicContact CD2-CB 3.64Å; Y200-E204 HydrophobicContact CE2-CB 4.36Å; Y200-E204 HydrophobicContact CG-CB 3.93Å; Y200-A208 HydrophobicContact CD2-CB 4.47Å; Y200-A208 HydrophobicContact CE2-CB 4.15Å; Y200-Y236 PolarHBondContact OH-OH 3.11Å; Y200-L300 WeakPolarHBondContact CB-O 3.43Å; Y200-L300 HydrophobicContact CD1-CD2 4.42Å; Y200-L300 HydrophobicContact CD2-CD2 3.64Å; Y200-L300 HydrophobicContact CE2-CD2 3.76Å; Y200-L300 HydrophobicContact CG-CD2 4Å; Y200-L300 PolarHBondContact N-O 3.4Å
201	T	88.6	Confident	85.5	Confident	62 Å²	62	38.2 Å²	38.2	38%	0.38	19%	0.19	S	C	.	.			trans	-65.3	159.9	161.5	60.6	0	0	0	0	109.8	E204 G205	T201-E204 PolarHBondContact N-OE2 3.25Å; T201-E204 PolarHBondContact O-N 3.48Å; T201-E204 VanDerWaalsContact O-N 3.11Å; T201-E204 VanDerWaalsContact OG1-CD 3.28Å; T201-E204 VanDerWaalsContact OG1-CG 3.3Å; T201-E204 WeakPolarHBondContact OG1-CG 3.2Å; T201-E204 PolarHBondContact OG1-OE2 3.44Å; T201-G205 PolarHBondContact O-N 2.99Å
202	E	91.5	Very high	86.4	Confident	40 Å²	40	37.7 Å²	37.7	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-43.9	178.6	-75.1	-166.4	-138.5	0	0	114	E204 G205 I206 L301 V334 S335 W364	E202-E204 VanDerWaalsContact C-N 3.29Å; E202-E204 PolarHBondContact O-N 2.76Å; E202-G205 CarbonylContact O-C 3.6Å; E202-G205 PolarHBondContact O-N 3.39Å; E202-G205 VanDerWaalsContact O-N 3.13Å; E202-I206 WeakPolarHBondContact O-CB 3.22Å; E202-I206 VanDerWaalsContact O-CG1 3.23Å; E202-I206 WeakPolarHBondContact O-CG1 3.47Å; E202-I206 PolarHBondContact O-N 2.83Å; E202-L301 HydrophobicContact CG-CD2 4.2Å; E202-V334 WeakPolarHBondContact OE1-CA 3.37Å; E202-S335 VanDerWaalsContact CD-OG 3.28Å; E202-S335 VanDerWaalsContact OE1-CB 3.3Å; E202-S335 WeakPolarHBondContact OE1-CB 3.48Å; E202-S335 PolarHBondContact OE1-N 3.21Å; E202-S335 PolarHBondContact OE1-OG 2.92Å; E202-S335 VanDerWaalsContact OE1-OG 3.06Å; E202-S335 PolarHBondContact OE2-OG 3.33Å; E202-W364 PolarHBondContact OE2-NE1 3.34Å
203	P	90.8	Very high	87.3	Confident	28 Å²	28	34.9 Å²	34.9	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-57.8	-39.4	175	-27.4	36.3	0	0	0	113.5	F207 P369 L374	P203-F207 WeakPolarHBondContact O-CB 3.22Å; P203-F207 PolarHBondContact O-N 2.94Å; P203-P369 HydrophobicContact CG-CG 4.26Å; P203-L374 HydrophobicContact CB-CD1 4.5Å; P203-L374 HydrophobicContact CB-CD2 4.29Å; P203-L374 HydrophobicContact CB-CG 4.21Å
204	E	90.1	Very high	88.2	Confident	52 Å²	52	36 Å²	36	24%	0.243	18%	0.18	C	C	.	.	H	α-helix	trans	-68.8	-41.7	175.6	-66.7	168.4	133.4	0	0	111.5	K197 Y200 T201 E202 F207 A208	K197-E204 IonicContact NZ-OE1 3.67Å; K197-E204 PolarHBondContact NZ-OE1 3.37Å; Y200-E204 HydrophobicContact CD2-CB 3.64Å; Y200-E204 HydrophobicContact CE2-CB 4.36Å; Y200-E204 HydrophobicContact CG-CB 3.93Å; T201-E204 PolarHBondContact N-OE2 3.25Å; T201-E204 PolarHBondContact O-N 3.48Å; T201-E204 VanDerWaalsContact O-N 3.11Å; T201-E204 VanDerWaalsContact OG1-CD 3.28Å; T201-E204 VanDerWaalsContact OG1-CG 3.3Å; T201-E204 WeakPolarHBondContact OG1-CG 3.2Å; T201-E204 PolarHBondContact OG1-OE2 3.44Å; E202-E204 VanDerWaalsContact C-N 3.29Å; E202-E204 PolarHBondContact O-N 2.76Å; E204-F207 PolarHBondContact O-N 3.38Å; E204-A208 WeakPolarHBondContact O-CB 3.41Å; E204-A208 PolarHBondContact O-N 2.87Å
205	G	92.6	Very high	89.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-48	175.8	0	0	0	0	0	111.9	T201 E202 F207 A208 V209	T201-G205 PolarHBondContact O-N 2.99Å; E202-G205 CarbonylContact O-C 3.6Å; E202-G205 PolarHBondContact O-N 3.39Å; E202-G205 VanDerWaalsContact O-N 3.13Å; G205-F207 PolarHBondContact O-N 3.25Å; G205-A208 PolarHBondContact O-N 3.26Å; G205-V209 VanDerWaalsContact O-CB 3.31Å; G205-V209 WeakPolarHBondContact O-CB 3.17Å; G205-V209 VanDerWaalsContact O-CG2 3.26Å; G205-V209 WeakPolarHBondContact O-CG2 3.47Å; G205-V209 PolarHBondContact O-N 3.34Å
206	I	94.9	Very high	90.4	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.036	17%	0.173	C	C	.	.	H	α-helix	trans	-57.1	-49.9	173.9	-69.4	166.1	0	0	0	109.7	E202 A208 K210 W364 L365	E202-I206 WeakPolarHBondContact O-CB 3.22Å; E202-I206 VanDerWaalsContact O-CG1 3.23Å; E202-I206 WeakPolarHBondContact O-CG1 3.47Å; E202-I206 PolarHBondContact O-N 2.83Å; I206-A208 VanDerWaalsContact C-N 3.32Å; I206-A208 PolarHBondContact O-N 2.82Å; I206-K210 WeakPolarHBondContact O-CB 3.46Å; I206-K210 PolarHBondContact O-N 3.31Å; I206-W364 HydrophobicContact CD1-CZ2 4.45Å; I206-W364 VanDerWaalsContact CD1-O 3.31Å; I206-W364 WeakPolarHBondContact CD1-O 3.11Å; I206-W364 HydrophobicContact CG1-CD2 4Å; I206-W364 HydrophobicContact CG1-CE3 4.38Å; I206-W364 HydrophobicContact CG1-CH2 3.96Å; I206-W364 HydrophobicContact CG1-CZ2 3.52Å; I206-W364 HydrophobicContact CG1-CZ3 4.37Å; I206-L365 HydrophobicContact CB-CD2 4.33Å; I206-L365 HydrophobicContact CG1-CD2 4.32Å; I206-L365 HydrophobicContact CG2-CD2 4.04Å
207	F	93.2	Very high	91.5	Very high	84 Å²	84	27.9 Å²	27.9	37%	0.368	14%	0.141	S	C	.	.	H	α-helix	trans	-59.1	-42.3	-179.9	-179.1	-105	0	0	0	112.4	P203 E204 G205 Q211	P203-F207 WeakPolarHBondContact O-CB 3.22Å; P203-F207 PolarHBondContact O-N 2.94Å; E204-F207 PolarHBondContact O-N 3.38Å; G205-F207 PolarHBondContact O-N 3.25Å; F207-Q211 WeakPolarHBondContact O-CG 3.28Å; F207-Q211 PolarHBondContact O-NE2 3.36Å
208	A	94.3	Very high	92.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.1	-53	178.8	0	0	0	0	0	112.2	Y200 E204 G205 I206 K210 Q211 I212 L245 L300	Y200-A208 HydrophobicContact CD2-CB 4.47Å; Y200-A208 HydrophobicContact CE2-CB 4.15Å; E204-A208 WeakPolarHBondContact O-CB 3.41Å; E204-A208 PolarHBondContact O-N 2.87Å; G205-A208 PolarHBondContact O-N 3.26Å; I206-A208 VanDerWaalsContact C-N 3.32Å; I206-A208 PolarHBondContact O-N 2.82Å; A208-K210 VanDerWaalsContact C-N 3.33Å; A208-K210 PolarHBondContact O-N 2.88Å; A208-Q211 PolarHBondContact O-N 3.11Å; A208-I212 VanDerWaalsContact O-CG1 3.32Å; A208-I212 WeakPolarHBondContact O-CG1 3.19Å; A208-I212 PolarHBondContact O-N 2.93Å; A208-L245 HydrophobicContact CB-CD1 3.69Å; A208-L300 HydrophobicContact CB-CD1 4.16Å
209	V	96.9	Very high	94.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-39.7	-176.7	172.5	0	0	0	0	111.7	G205 Q211 I212 L213 V293 A297 L300 F341 W364 L365	G205-V209 VanDerWaalsContact O-CB 3.31Å; G205-V209 WeakPolarHBondContact O-CB 3.17Å; G205-V209 VanDerWaalsContact O-CG2 3.26Å; G205-V209 WeakPolarHBondContact O-CG2 3.47Å; G205-V209 PolarHBondContact O-N 3.34Å; V209-Q211 VanDerWaalsContact C-N 3.32Å; V209-Q211 PolarHBondContact O-N 3.25Å; V209-I212 PolarHBondContact O-N 3.32Å; V209-L213 HydrophobicContact CG1-CD1 3.98Å; V209-L213 HydrophobicContact CG1-CG 4.34Å; V209-L213 WeakPolarHBondContact O-CB 3.27Å; V209-L213 PolarHBondContact O-N 3.27Å; V209-V293 HydrophobicContact CG1-CG1 4.38Å; V209-A297 HydrophobicContact CG2-CB 3.97Å; V209-L300 HydrophobicContact CG2-CD1 3.66Å; V209-F341 HydrophobicContact CG1-CE1 3.66Å; V209-F341 HydrophobicContact CG1-CZ 3.54Å; V209-W364 HydrophobicContact CB-CH2 4.48Å; V209-W364 HydrophobicContact CB-CZ3 4.18Å; V209-W364 HydrophobicContact CG1-CZ3 4.19Å; V209-W364 HydrophobicContact CG2-CH2 4.26Å; V209-W364 HydrophobicContact CG2-CZ3 4.28Å; V209-L365 HydrophobicContact CB-CD2 4.41Å; V209-L365 HydrophobicContact CG1-CD1 4.44Å; V209-L365 HydrophobicContact CG1-CD2 4.25Å
210	K	97	Very high	95.1	Very high	65 Å²	65	23.8 Å²	23.8	28%	0.283	12%	0.115	S	C	.	.	H	α-helix	trans	-60.6	-42.7	177.9	-168.5	167.7	-169.5	160.6	0	111.6	I206 A208 L213 Q214 L360 L365	I206-K210 WeakPolarHBondContact O-CB 3.46Å; I206-K210 PolarHBondContact O-N 3.31Å; A208-K210 VanDerWaalsContact C-N 3.33Å; A208-K210 PolarHBondContact O-N 2.88Å; K210-L213 PolarHBondContact O-N 2.63Å; K210-Q214 WeakPolarHBondContact O-CB 3.16Å; K210-Q214 WeakPolarHBondContact O-CG 3.45Å; K210-Q214 PolarHBondContact O-N 3.44Å; K210-L360 HydrophobicContact CG-CD2 4.03Å; K210-L365 HydrophobicContact CB-CD2 4.48Å; K210-L365 PolarHBondContact NZ-O 2.98Å
211	Q	97.5	Very high	95.7	Very high	15 Å²	15	31.8 Å²	31.8	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-67.3	-41	177	-73.6	-172	80.2	0	0	113	N164 F207 A208 V209 Q214 G215 L245	N164-Q211 WeakPolarHBondContact CB-O 3.41Å; N164-Q211 WeakPolarHBondContact ND2-CB 3.35Å; N164-Q211 PolarHBondContact ND2-OE1 2.74Å; N164-Q211 VanDerWaalsContact ND2-OE1 3.1Å; F207-Q211 WeakPolarHBondContact O-CG 3.28Å; F207-Q211 PolarHBondContact O-NE2 3.36Å; A208-Q211 PolarHBondContact O-N 3.11Å; V209-Q211 VanDerWaalsContact C-N 3.32Å; V209-Q211 PolarHBondContact O-N 3.25Å; Q211-Q214 PolarHBondContact O-N 2.66Å; Q211-G215 PolarHBondContact O-N 3.01Å; Q211-L245 HydrophobicContact CB-CB 4.17Å
212	I	98.3	Very high	96	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-51	174.7	-62.9	162.4	0	0	0	109.2	L190 A208 V209 Q214 G215 V216 L234 L245 V293 I296	L190-I212 HydrophobicContact CD2-CD1 4.1Å; A208-I212 VanDerWaalsContact O-CG1 3.32Å; A208-I212 WeakPolarHBondContact O-CG1 3.19Å; A208-I212 PolarHBondContact O-N 2.93Å; V209-I212 PolarHBondContact O-N 3.32Å; I212-Q214 VanDerWaalsContact C-N 3.33Å; I212-Q214 PolarHBondContact O-N 2.84Å; I212-G215 PolarHBondContact O-N 3.11Å; I212-G215 VanDerWaalsContact O-N 3.15Å; I212-V216 HydrophobicContact CG2-CG2 4.3Å; I212-V216 WeakPolarHBondContact O-CG2 3.43Å; I212-V216 PolarHBondContact O-N 2.79Å; I212-L234 HydrophobicContact CD1-CD1 3.6Å; I212-L234 HydrophobicContact CG1-CD1 3.95Å; I212-L234 HydrophobicContact CG1-CD2 4.09Å; I212-L234 HydrophobicContact CG2-CD2 4.47Å; I212-L245 HydrophobicContact CD1-CD1 4.45Å; I212-L245 HydrophobicContact CG1-CD1 4.3Å; I212-V293 HydrophobicContact CG2-CG2 3.77Å; I212-I296 HydrophobicContact CD1-CG2 4.04Å
213	L	98.7	Very high	96.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-33.5	179	-79.2	174.9	0	0	0	113.6	V209 K210 V216 S217 V293 F341 A356 L360 L365	V209-L213 HydrophobicContact CG1-CD1 3.98Å; V209-L213 HydrophobicContact CG1-CG 4.34Å; V209-L213 WeakPolarHBondContact O-CB 3.27Å; V209-L213 PolarHBondContact O-N 3.27Å; K210-L213 PolarHBondContact O-N 2.63Å; L213-V216 PolarHBondContact O-N 2.67Å; L213-S217 VanDerWaalsContact O-CB 3.24Å; L213-S217 WeakPolarHBondContact O-CB 3.34Å; L213-S217 PolarHBondContact O-N 2.64Å; L213-V293 HydrophobicContact CD2-CG1 3.94Å; L213-V293 HydrophobicContact CG-CG1 4.07Å; L213-F341 HydrophobicContact CD1-CE2 4.24Å; L213-F341 HydrophobicContact CD1-CZ 3.9Å; L213-A356 HydrophobicContact CD2-CB 4.25Å; L213-L360 HydrophobicContact CB-CD1 4.47Å; L213-L360 HydrophobicContact CB-CD2 3.57Å; L213-L360 HydrophobicContact CB-CG 3.81Å; L213-L360 HydrophobicContact CD1-CD2 4.28Å; L213-L360 HydrophobicContact CD1-CG 4.4Å; L213-L365 HydrophobicContact CD1-CD1 3.57Å
214	Q	98.5	Very high	96.5	Very high	60 Å²	60	29 Å²	29	28%	0.28	13%	0.133	S	C	.	.	H	α-helix	trans	-62.7	-45.8	172.4	-77.7	168.3	-22.3	0	0	111.1	N164 K210 Q211 I212 Y218 L360	N164-Q214 PolarHBondContact OD1-OE1 3.35Å; K210-Q214 WeakPolarHBondContact O-CB 3.16Å; K210-Q214 WeakPolarHBondContact O-CG 3.45Å; K210-Q214 PolarHBondContact O-N 3.44Å; Q211-Q214 PolarHBondContact O-N 2.66Å; I212-Q214 VanDerWaalsContact C-N 3.33Å; I212-Q214 PolarHBondContact O-N 2.84Å; Q214-Y218 WeakPolarHBondContact O-CB 3.35Å; Q214-Y218 PolarHBondContact O-N 3.39Å; Q214-Y218 VanDerWaalsContact O-N 3.08Å; Q214-L360 HydrophobicContact CG-CD1 4.32Å; Q214-L360 HydrophobicContact CG-CD2 4.08Å
215	G	98.5	Very high	96.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.6	-46.8	173.2	0	0	0	0	0	112.4	Q211 I212 Y218 L219	Q211-G215 PolarHBondContact O-N 3.01Å; I212-G215 PolarHBondContact O-N 3.11Å; I212-G215 VanDerWaalsContact O-N 3.15Å; G215-Y218 WeakPolarHBondContact O-CB 3.46Å; G215-Y218 PolarHBondContact O-N 3.44Å; G215-L219 VanDerWaalsContact O-CG 3.3Å; G215-L219 WeakPolarHBondContact O-CG 3.33Å; G215-L219 PolarHBondContact O-N 3.45Å
216	V	98.7	Very high	97	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-43.6	179.5	176.4	0	0	0	0	112	I212 L213 Y218 L219 H220 L229 I247 D289 I290 V293 A356	I212-V216 HydrophobicContact CG2-CG2 4.3Å; I212-V216 WeakPolarHBondContact O-CG2 3.43Å; I212-V216 PolarHBondContact O-N 2.79Å; L213-V216 PolarHBondContact O-N 2.67Å; V216-Y218 VanDerWaalsContact C-N 3.32Å; V216-Y218 PolarHBondContact O-N 3.4Å; V216-L219 PolarHBondContact O-N 3.27Å; V216-H220 WeakPolarHBondContact CG1-CE1 3.38Å; V216-H220 WeakPolarHBondContact CG1-NE2 3.22Å; V216-H220 WeakPolarHBondContact O-CB 3.32Å; V216-H220 PolarHBondContact O-CD2 3.02Å; V216-H220 VanDerWaalsContact O-CG 3.28Å; V216-H220 PolarHBondContact O-N 3.18Å; V216-L229 HydrophobicContact CG2-CD1 3.58Å; V216-I247 HydrophobicContact CG2-CD1 3.86Å; V216-D289 HydrophobicContact CG1-CB 4.06Å; V216-I290 HydrophobicContact CG1-CD1 4.07Å; V216-V293 HydrophobicContact CG2-CG2 4.26Å; V216-A356 HydrophobicContact CB-CB 4.38Å; V216-A356 HydrophobicContact CG1-CB 4.01Å
217	S	98.6	Very high	97	Very high	7 Å²	7	27.9 Å²	27.9	5%	0.049	13%	0.126	C	C	.	.	H	α-helix	trans	-57.1	-47.1	174.9	163.5	0	0	0	0	110.9	L213 H220 R221 D357	L213-S217 VanDerWaalsContact O-CB 3.24Å; L213-S217 WeakPolarHBondContact O-CB 3.34Å; L213-S217 PolarHBondContact O-N 2.64Å; S217-H220 PolarHBondContact O-N 2.88Å; S217-R221 WeakPolarHBondContact O-CB 3.22Å; S217-R221 PolarHBondContact O-N 3.42Å; S217-D357 VanDerWaalsContact OG-CG 3.3Å; S217-D357 PolarHBondContact OG-OD1 3.17Å; S217-D357 PolarHBondContact OG-OD2 3.04Å
218	Y	98.6	Very high	97	Very high	44 Å²	44	24 Å²	24	17%	0.173	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-51.8	175.4	168.2	-99.1	0	0	0	111.8	I160 R161 H162 V165 Q214 G215 V216 H220 R221 V222	I160-Y218 WeakPolarHBondContact CA-OH 3.19Å; I160-Y218 HydrophobicContact CB-CE1 3.98Å; I160-Y218 HydrophobicContact CG2-CE1 4.24Å; R161-Y218 PolarHBondContact N-OH 2.83Å; R161-Y218 PolarHBondContact O-OH 3.31Å; H162-Y218 HydrophobicContact CB-CD1 3.42Å; H162-Y218 VanDerWaalsContact CB-CD1 3.42Å; H162-Y218 HydrophobicContact CB-CD2 4.17Å; H162-Y218 HydrophobicContact CB-CE1 3.67Å; H162-Y218 HydrophobicContact CB-CE2 4.39Å; H162-Y218 HydrophobicContact CB-CG 3.69Å; H162-Y218 AromaticContact CD2-CG 3.81Å; H162-Y218 AromaticContact CG-CD1 3.91Å; H162-Y218 AromaticContact CG-CG 3.75Å; V165-Y218 HydrophobicContact CG2-CD1 4.24Å; Q214-Y218 WeakPolarHBondContact O-CB 3.35Å; Q214-Y218 PolarHBondContact O-N 3.39Å; Q214-Y218 VanDerWaalsContact O-N 3.08Å; G215-Y218 WeakPolarHBondContact O-CB 3.46Å; G215-Y218 PolarHBondContact O-N 3.44Å; V216-Y218 VanDerWaalsContact C-N 3.32Å; V216-Y218 PolarHBondContact O-N 3.4Å; Y218-H220 VanDerWaalsContact C-N 3.35Å; Y218-H220 PolarHBondContact O-N 3.31Å; Y218-R221 WeakPolarHBondContact O-CB 3.48Å; Y218-R221 PolarHBondContact O-N 2.88Å; Y218-V222 HydrophobicContact CD2-CG1 4.34Å; Y218-V222 HydrophobicContact CE1-CG2 4.24Å; Y218-V222 HydrophobicContact CE2-CG1 3.75Å; Y218-V222 WeakPolarHBondContact O-CG2 3.39Å; Y218-V222 PolarHBondContact O-N 3.43Å; Y218-V222 VanDerWaalsContact O-N 3.08Å
219	L	98.4	Very high	97.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56.4	-48.8	179.8	-70.4	175.5	0	0	0	111.4	I160 V165 G215 V216 R221 V222 G223 V224 I247 F250	I160-L219 HydrophobicContact CD1-CD2 4.31Å; I160-L219 HydrophobicContact CG2-CD2 4.01Å; V165-L219 HydrophobicContact CG1-CD2 4.39Å; V165-L219 HydrophobicContact CG2-CD1 4.4Å; V165-L219 HydrophobicContact CG2-CD2 4.17Å; V165-L219 HydrophobicContact CG2-CG 4.15Å; G215-L219 VanDerWaalsContact O-CG 3.3Å; G215-L219 WeakPolarHBondContact O-CG 3.33Å; G215-L219 PolarHBondContact O-N 3.45Å; V216-L219 PolarHBondContact O-N 3.27Å; L219-R221 VanDerWaalsContact C-N 3.29Å; L219-R221 PolarHBondContact O-N 3.23Å; L219-V222 CarbonylContact O-C 3.56Å; L219-V222 WeakPolarHBondContact O-CG2 3.34Å; L219-V222 PolarHBondContact O-N 3.34Å; L219-G223 PolarHBondContact O-N 2.71Å; L219-V224 CarbonylContact C-O 3.58Å; L219-V224 HydrophobicContact CB-CB 4.21Å; L219-V224 HydrophobicContact CB-CG1 4.42Å; L219-V224 HydrophobicContact CD2-CB 4.18Å; L219-V224 HydrophobicContact CD2-CG1 4.03Å; L219-V224 WeakPolarHBondContact O-CA 3.24Å; L219-V224 PolarHBondContact O-N 3.08Å; L219-V224 VanDerWaalsContact O-O 3.06Å; L219-I247 HydrophobicContact CD1-CD1 4.07Å; L219-I247 HydrophobicContact CD1-CG2 4.3Å; L219-F250 HydrophobicContact CD1-CE1 3.83Å; L219-F250 HydrophobicContact CD1-CZ 4.04Å; L219-F250 HydrophobicContact CD2-CE1 3.67Å; L219-F250 HydrophobicContact CD2-CZ 3.99Å; L219-F250 HydrophobicContact CG-CE1 4.42Å
220	H	97.6	Very high	96.8	Very high	23 Å²	23	24.9 Å²	24.9	11%	0.106	11%	0.113	C	C	.	.	H	α-helix	trans	-61.4	-38.7	180	-72.5	-171	0	0	0	112.1	V216 S217 Y218 V222 G223 V224 N286 D289	V216-H220 WeakPolarHBondContact CG1-CE1 3.38Å; V216-H220 WeakPolarHBondContact CG1-NE2 3.22Å; V216-H220 WeakPolarHBondContact O-CB 3.32Å; V216-H220 PolarHBondContact O-CD2 3.02Å; V216-H220 VanDerWaalsContact O-CG 3.28Å; V216-H220 PolarHBondContact O-N 3.18Å; S217-H220 PolarHBondContact O-N 2.88Å; Y218-H220 VanDerWaalsContact C-N 3.35Å; Y218-H220 PolarHBondContact O-N 3.31Å; H220-V222 VanDerWaalsContact C-N 3.35Å; H220-G223 PolarHBondContact O-N 3.4Å; H220-G223 VanDerWaalsContact O-N 3.14Å; H220-V224 PolarHBondContact CD2-O 2.96Å; H220-V224 PolarHBondContact N-O 3.18Å; H220-N286 WeakPolarHBondContact CB-ND2 3.48Å; H220-N286 PolarHBondContact CE1-O 3.34Å; H220-N286 VanDerWaalsContact CG-ND2 3.33Å; H220-N286 PolarHBondContact ND1-ND2 3.32Å; H220-N286 PolarHBondContact NE2-O 3.39Å; H220-D289 IonicContact CD2-OD2 3.46Å; H220-D289 IonicContact CE1-OD2 3.12Å; H220-D289 IonicContact NE2-OD2 3.8Å; H220-D289 PolarHBondContact NE2-OD2 3.38Å
221	R	96.1	Very high	96.4	Very high	179 Å²	179	21.8 Å²	21.8	68%	0.675	10%	0.1	S	C	*	.	H	α-helix	trans	-65.8	-35.8	177.7	-169.4	179.5	-56.6	-176.5	3	112.7	S217 Y218 L219 G223 D357	S217-R221 WeakPolarHBondContact O-CB 3.22Å; S217-R221 PolarHBondContact O-N 3.42Å; Y218-R221 WeakPolarHBondContact O-CB 3.48Å; Y218-R221 PolarHBondContact O-N 2.88Å; L219-R221 VanDerWaalsContact C-N 3.29Å; L219-R221 PolarHBondContact O-N 3.23Å; R221-G223 PolarHBondContact O-N 3.06Å; R221-D357 IonicContact NH2-OD1 2.78Å; R221-D357 PolarHBondContact NH2-OD1 2.85Å; R221-D357 VanDerWaalsContact NH2-OD1 3.12Å
222	V	95.3	Very high	95.9	Very high	58 Å²	58	22.8 Å²	22.8	35%	0.352	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	11.9	174.9	-56.8	0	0	0	0	113.1	I160 Y218 L219 H220 V224	I160-V222 HydrophobicContact CG2-CG2 4.16Å; Y218-V222 HydrophobicContact CD2-CG1 4.34Å; Y218-V222 HydrophobicContact CE1-CG2 4.24Å; Y218-V222 HydrophobicContact CE2-CG1 3.75Å; Y218-V222 WeakPolarHBondContact O-CG2 3.39Å; Y218-V222 PolarHBondContact O-N 3.43Å; Y218-V222 VanDerWaalsContact O-N 3.08Å; L219-V222 CarbonylContact O-C 3.56Å; L219-V222 WeakPolarHBondContact O-CG2 3.34Å; L219-V222 PolarHBondContact O-N 3.34Å; H220-V222 VanDerWaalsContact C-N 3.35Å; V222-V224 VanDerWaalsContact C-N 3.33Å; V222-V224 HydrophobicContact CG2-CB 4.36Å; V222-V224 HydrophobicContact CG2-CG2 4.03Å; V222-V224 PolarHBondContact O-N 3.09Å
223	G	95.5	Very high	95.6	Very high	14 Å²	14	23.4 Å²	23.4	14%	0.144	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	15.4	175.7	0	0	0	0	0	114.6	L219 H220 R221 K256	L219-G223 PolarHBondContact O-N 2.71Å; H220-G223 PolarHBondContact O-N 3.4Å; H220-G223 VanDerWaalsContact O-N 3.14Å; R221-G223 PolarHBondContact O-N 3.06Å; G223-K256 WeakPolarHBondContact O-CG 3.4Å; G223-K256 PolarHBondContact O-N 2.91Å
224	V	96.5	Very high	95.4	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.2	176.8	177.7	0	0	0	0	110.1	I156 I160 L219 H220 V222 F250 A253 H254 L255	I156-V224 HydrophobicContact CG1-CG2 4.45Å; I156-V224 HydrophobicContact CG2-CG1 3.92Å; I156-V224 HydrophobicContact CG2-CG2 4.01Å; I160-V224 HydrophobicContact CG2-CG2 4.2Å; L219-V224 CarbonylContact C-O 3.58Å; L219-V224 HydrophobicContact CB-CB 4.21Å; L219-V224 HydrophobicContact CB-CG1 4.42Å; L219-V224 HydrophobicContact CD2-CB 4.18Å; L219-V224 HydrophobicContact CD2-CG1 4.03Å; L219-V224 WeakPolarHBondContact O-CA 3.24Å; L219-V224 PolarHBondContact O-N 3.08Å; L219-V224 VanDerWaalsContact O-O 3.06Å; H220-V224 PolarHBondContact CD2-O 2.96Å; H220-V224 PolarHBondContact N-O 3.18Å; V222-V224 VanDerWaalsContact C-N 3.33Å; V222-V224 HydrophobicContact CG2-CB 4.36Å; V222-V224 HydrophobicContact CG2-CG2 4.03Å; V222-V224 PolarHBondContact O-N 3.09Å; V224-F250 HydrophobicContact CG1-CD1 4.33Å; V224-F250 HydrophobicContact CG1-CE1 4.24Å; V224-A253 HydrophobicContact CG1-CB 4.27Å; V224-H254 CarbonylContact C-O 3.56Å; V224-H254 VanDerWaalsContact CA-O 3.28Å; V224-H254 WeakPolarHBondContact CA-O 3.46Å; V224-L255 HydrophobicContact CG2-CD1 3.72Å
225	T	97	Very high	95.3	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.1	167.5	-52.2	0	0	0	0	108.6	R227 A253 H254 M264 N286 V288 D289	T225-R227 HydrophobicContact CG2-CG 3.66Å; T225-A253 CarbonylContact O-C 3.54Å; T225-A253 WeakPolarHBondContact O-CA 3.4Å; T225-A253 WeakPolarHBondContact O-CB 3.17Å; T225-H254 PolarHBondContact N-O 2.98Å; T225-H254 PolarHBondContact O-N 3.03Å; T225-M264 HydrophobicContact CG2-CE 4.07Å; T225-M264 HydrophobicContact CG2-SD 4.23Å; T225-N286 HydrophobicContact CG2-CB 3.96Å; T225-N286 VanDerWaalsContact OG1-CB 3.3Å; T225-N286 WeakPolarHBondContact OG1-CB 3.34Å; T225-V288 HydrophobicContact CG2-CG2 3.93Å; T225-D289 WeakPolarHBondContact CG2-OD2 3.47Å
226	H	96.5	Very high	95.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.106	C	C	.	.			trans	-75	-43.9	-173.1	-170.5	-86.7	0	0	0	112.8	D228 L229 I247 T248 D249 F250 A253 D289	H226-D228 PolarHBondContact CE1-O 3.23Å; H226-D228 VanDerWaalsContact CE1-O 3.31Å; H226-D228 PolarHBondContact ND1-N 2.76Å; H226-D228 PolarHBondContact ND1-O 2.91Å; H226-D228 PolarHBondContact O-N 3.27Å; H226-L229 HydrophobicContact CB-CD1 4.5Å; H226-L229 HydrophobicContact CB-CD2 4.13Å; H226-L229 HydrophobicContact CB-CG 3.95Å; H226-L229 PolarHBondContact ND1-N 3.18Å; H226-I247 VanDerWaalsContact CD2-CG2 3.46Å; H226-I247 WeakPolarHBondContact CD2-CG2 3.48Å; H226-T248 PolarHBondContact NE2-O 2.78Å; H226-D249 PolarHBondContact CE1-O 3.46Å; H226-D249 PolarHBondContact NE2-O 3.37Å; H226-F250 AromaticContact CD2-CE1 3.81Å; H226-A253 WeakPolarHBondContact O-CA 3.42Å; H226-D289 PolarHBondContact N-OD1 3.29Å; H226-D289 PolarHBondContact N-OD2 3.22Å
227	R	94.9	Very high	94.9	Very high	33 Å²	33	23.4 Å²	23.4	13%	0.125	11%	0.11	C	C	.	.	S	Bend	trans	64.4	-5.5	177.5	-53.8	-168.5	-67.2	-176.9	-7.6	117.2	T225 L252 G269 Y284 V288 D289	T225-R227 HydrophobicContact CG2-CG 3.66Å; R227-L252 PolarHBondContact NE-O 2.69Å; R227-L252 PolarHBondContact NH2-O 3.39Å; R227-G269 WeakPolarHBondContact O-CA 3.38Å; R227-Y284 WeakPolarHBondContact CD-OH 3.5Å; R227-Y284 PolarHBondContact NH1-OH 3.36Å; R227-V288 HydrophobicContact CG-CG2 4.34Å; R227-D289 PolarHBondContact N-OD1 3.24Å
228	D	93.6	Very high	94.6	Very high	4 Å²	4	26 Å²	26	2%	0.021	13%	0.126	C	C	.	.			trans	-138.1	43.6	175.5	-157.1	30.8	0	0	0	112.2	H226 K230 N233 L252 T270	H226-D228 PolarHBondContact CE1-O 3.23Å; H226-D228 VanDerWaalsContact CE1-O 3.31Å; H226-D228 PolarHBondContact ND1-N 2.76Å; H226-D228 PolarHBondContact ND1-O 2.91Å; H226-D228 PolarHBondContact O-N 3.27Å; D228-K230 PolarHBondContact O-N 3.1Å; D228-K230 IonicContact OD2-NZ 3.69Å; D228-N233 PolarHBondContact O-ND2 2.95Å; D228-L252 HydrophobicContact CB-CB 4.25Å; D228-L252 HydrophobicContact CB-CD1 3.86Å; D228-T270 WeakPolarHBondContact OD1-CB 3.49Å; D228-T270 PolarHBondContact OD1-N 3.49Å; D228-T270 VanDerWaalsContact OD1-N 3.17Å; D228-T270 PolarHBondContact OD1-OG1 3.22Å
229	L	95.5	Very high	94	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.153	C	C	.	.			trans	-70.7	123.6	174.8	-72.1	172.8	0	0	0	110	V216 H226 I247 D289 A292 V293 I296	V216-L229 HydrophobicContact CG2-CD1 3.58Å; H226-L229 HydrophobicContact CB-CD1 4.5Å; H226-L229 HydrophobicContact CB-CD2 4.13Å; H226-L229 HydrophobicContact CB-CG 3.95Å; H226-L229 PolarHBondContact ND1-N 3.18Å; L229-I247 HydrophobicContact CD2-CD1 4.35Å; L229-I247 HydrophobicContact CD2-CG1 4.36Å; L229-I247 HydrophobicContact CD2-CG2 3.82Å; L229-D289 HydrophobicContact CD1-CB 3.68Å; L229-A292 HydrophobicContact CB-CB 3.83Å; L229-V293 HydrophobicContact CD1-CG2 4.04Å; L229-I296 HydrophobicContact CB-CD1 4.33Å
230	K	91.4	Very high	93.5	Very high	15 Å²	15	31 Å²	31	7%	0.065	17%	0.167	C	C	.	.			trans	-159.6	161.7	177.1	58.1	-177.7	176.2	-176.5	0	110.1	D228 E232 N233 T270 Y273 A408	D228-K230 PolarHBondContact O-N 3.1Å; D228-K230 IonicContact OD2-NZ 3.69Å; K230-E232 WeakPolarHBondContact CB-OE2 3.34Å; K230-E232 WeakPolarHBondContact CD-OE2 3.5Å; K230-E232 HydrophobicContact CG-CB 4.48Å; K230-E232 VanDerWaalsContact CG-OE2 3.22Å; K230-E232 WeakPolarHBondContact CG-OE2 3.48Å; K230-E232 PolarHBondContact O-N 3.08Å; K230-E232 VanDerWaalsContact O-N 3.13Å; K230-N233 HydrophobicContact CG-CB 4.22Å; K230-N233 PolarHBondContact O-N 3.26Å; K230-T270 HydrophobicContact CD-CG2 4.17Å; K230-T270 PolarHBondContact NZ-OG1 2.63Å; K230-Y273 HydrophobicContact CB-CD1 4.17Å; K230-Y273 HydrophobicContact CB-CD2 3.74Å; K230-Y273 HydrophobicContact CB-CE1 4.19Å; K230-Y273 HydrophobicContact CB-CE2 3.75Å; K230-Y273 HydrophobicContact CB-CG 3.97Å; K230-A408 PolarHBondContact NZ-O 3.14Å
231	P	89.6	Confident	92.6	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-53.3	-32.3	-176.8	-30.1	38.8	0	0	0	115.2	N233 L234 Y273 I296	P231-N233 VanDerWaalsContact C-N 3.32Å; P231-L234 PolarHBondContact O-N 3.12Å; P231-Y273 VanDerWaalsContact CD-CE1 3.46Å; P231-Y273 WeakPolarHBondContact CD-OH 3.44Å; P231-Y273 HydrophobicContact CG-CE1 4.24Å; P231-I296 HydrophobicContact CG-CG1 4.42Å
232	E	86.4	Confident	92.1	Very high	36 Å²	36	31.7 Å²	31.7	17%	0.168	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-70.7	-27.9	179.1	-55.5	92.1	146.9	0	0	112.4	K230 L234	K230-E232 WeakPolarHBondContact CB-OE2 3.34Å; K230-E232 WeakPolarHBondContact CD-OE2 3.5Å; K230-E232 HydrophobicContact CG-CB 4.48Å; K230-E232 VanDerWaalsContact CG-OE2 3.22Å; K230-E232 WeakPolarHBondContact CG-OE2 3.48Å; K230-E232 PolarHBondContact O-N 3.08Å; K230-E232 VanDerWaalsContact O-N 3.13Å; E232-L234 VanDerWaalsContact C-N 3.3Å
233	N	91.7	Very high	91.9	Very high	13 Å²	13	29.1 Å²	29.1	7%	0.07	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-90.4	5.5	178	-72.6	-13.4	0	0	0	112.5	D228 K230 P231 T248	D228-N233 PolarHBondContact O-ND2 2.95Å; K230-N233 HydrophobicContact CG-CB 4.22Å; K230-N233 PolarHBondContact O-N 3.26Å; P231-N233 VanDerWaalsContact C-N 3.32Å; N233-T248 PolarHBondContact O-N 3Å; N233-T248 PolarHBondContact O-OG1 2.75Å
234	L	95.3	Very high	91.8	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	107.1	179.5	-66.2	172.9	0	0	0	109.7	L190 I212 P231 E232 I247 I296	L190-L234 HydrophobicContact CB-CB 3.91Å; L190-L234 WeakPolarHBondContact CB-O 3.27Å; L190-L234 HydrophobicContact CD2-CB 4.19Å; L190-L234 HydrophobicContact CD2-CD1 3.65Å; L190-L234 PolarHBondContact N-O 2.91Å; I212-L234 HydrophobicContact CD1-CD1 3.6Å; I212-L234 HydrophobicContact CG1-CD1 3.95Å; I212-L234 HydrophobicContact CG1-CD2 4.09Å; I212-L234 HydrophobicContact CG2-CD2 4.47Å; P231-L234 PolarHBondContact O-N 3.12Å; E232-L234 VanDerWaalsContact C-N 3.3Å; L234-I247 HydrophobicContact CD2-CB 4.46Å; L234-I247 HydrophobicContact CD2-CG1 3.78Å; L234-I296 HydrophobicContact CD1-CD1 3.9Å; L234-I296 HydrophobicContact CD1-CG2 4.39Å
235	L	95	Very high	91.8	Very high	41 Å²	41	31.6 Å²	31.6	22%	0.215	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.2	-174.4	-52.2	-175.5	0	0	0	111.4	A185 E189 M246 T248	A185-L235 HydrophobicContact CB-CB 3.43Å; A185-L235 VanDerWaalsContact CB-CB 3.43Å; A185-L235 HydrophobicContact CB-CD1 3.76Å; A185-L235 HydrophobicContact CB-CG 4.24Å; E189-L235 HydrophobicContact CB-CD2 4.21Å; E189-L235 HydrophobicContact CG-CD2 3.52Å; L235-M246 PolarHBondContact N-O 3.32Å; L235-M246 PolarHBondContact O-N 3.14Å; L235-T248 HydrophobicContact CB-CG2 4.26Å; L235-T248 HydrophobicContact CD1-CG2 3.83Å; L235-T248 HydrophobicContact CG-CG2 3.85Å
236	Y	94.9	Very high	91.8	Very high	7 Å²	7	31.6 Å²	31.6	3%	0.027	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	132.5	169.3	-73.7	-81.9	0	0	0	110.4	A185 T186 G187 G188 L190 R193 Y200 T238 K244 L245	A185-Y236 WeakPolarHBondContact CB-O 3.19Å; T186-Y236 PolarHBondContact N-O 3.3Å; G187-Y236 VanDerWaalsContact CA-O 3.24Å; G187-Y236 WeakPolarHBondContact CA-O 3.48Å; G187-Y236 PolarHBondContact N-O 3.09Å; G188-Y236 PolarHBondContact O-N 3.42Å; L190-Y236 HydrophobicContact CB-CE2 4.39Å; L190-Y236 HydrophobicContact CD1-CE2 3.73Å; L190-Y236 WeakPolarHBondContact CD1-OH 3.49Å; R193-Y236 HydrophobicContact CB-CE2 4.21Å; R193-Y236 HydrophobicContact CG-CD2 4.05Å; R193-Y236 HydrophobicContact CG-CE2 3.79Å; R193-Y236 VanDerWaalsContact CZ-CG 3.45Å; Y200-Y236 PolarHBondContact OH-OH 3.11Å; Y236-T238 PolarHBondContact O-N 3.33Å; Y236-K244 WeakPolarHBondContact CA-O 3.42Å; Y236-L245 HydrophobicContact CD1-CD2 3.67Å; Y236-L245 HydrophobicContact CD1-CG 3.79Å; Y236-L245 HydrophobicContact CD2-CD2 3.74Å; Y236-L245 HydrophobicContact CE1-CD1 4.07Å; Y236-L245 HydrophobicContact CE1-CD2 3.6Å; Y236-L245 HydrophobicContact CE1-CG 3.47Å; Y236-L245 VanDerWaalsContact CE1-CG 3.47Å; Y236-L245 HydrophobicContact CE2-CD2 3.65Å; Y236-L245 HydrophobicContact CE2-CG 4.39Å; Y236-L245 HydrophobicContact CG-CD2 3.76Å; Y236-L245 HydrophobicContact CG-CG 4.39Å
237	A	93.7	Very high	91.9	Very high	11 Å²	11	31.6 Å²	31.6	9%	0.091	19%	0.19	C	C	.	.	S	Bend	trans	-60.5	-35.9	-179.2	0	0	0	0	0	112.9	T186 S243 K244 M246	T186-A237 PolarHBondContact N-O 2.89Å; T186-A237 PolarHBondContact OG1-O 3.37Å; A237-S243 PolarHBondContact N-OG 3.36Å; A237-K244 HydrophobicContact CB-CD 4.19Å; A237-K244 HydrophobicContact CB-CG 3.52Å; A237-K244 PolarHBondContact N-O 2.72Å; A237-M246 HydrophobicContact CB-CE 3.81Å; A237-M246 HydrophobicContact CB-SD 4.14Å
238	T	92.7	Very high	91.8	Very high	61 Å²	61	31 Å²	31	37%	0.374	19%	0.19	S	C	.	.	S	Bend	trans	-142.7	162.5	-174.5	63.5	0	0	0	0	110.8	G187 R193 Y236 S240 S243	G187-T238 WeakPolarHBondContact CA-O 3.43Å; R193-T238 PolarHBondContact NH2-O 3.11Å; Y236-T238 PolarHBondContact O-N 3.33Å; T238-S240 PolarHBondContact O-N 2.96Å; T238-S240 PolarHBondContact OG1-OG 2.91Å; T238-S243 WeakPolarHBondContact CA-OG 3.35Å; T238-S243 PolarHBondContact N-OG 2.61Å; T238-S243 WeakPolarHBondContact O-CB 3.4Å; T238-S243 PolarHBondContact O-OG 2.91Å; T238-S243 VanDerWaalsContact OG1-CB 3.22Å; T238-S243 WeakPolarHBondContact OG1-CB 3.5Å; T238-S243 PolarHBondContact OG1-OG 3.47Å
239	S	87.1	Confident	91.6	Very high	106 Å²	106	32.8 Å²	32.8	74%	0.741	20%	0.199	S	C	*	.	S	Bend	trans	-71.4	-4.8	176.8	53.8	0	0	0	0	114.2
240	S	87.2	Confident	91.5	Very high	44 Å²	44	32.7 Å²	32.7	31%	0.308	20%	0.199	S	C	.	.	S	Bend	trans	-65.9	153.3	-179.3	72	0	0	0	0	111.8	R193 T238 D242 S243	R193-S240 PolarHBondContact NH1-O 3.29Å; T238-S240 PolarHBondContact O-N 2.96Å; T238-S240 PolarHBondContact OG1-OG 2.91Å; S240-D242 VanDerWaalsContact C-N 3.27Å; S240-D242 WeakPolarHBondContact CB-OD1 3.42Å; S240-D242 PolarHBondContact O-N 3.18Å; S240-D242 PolarHBondContact OG-OD1 2.88Å; S240-S243 WeakPolarHBondContact O-CB 2.94Å; S240-S243 PolarHBondContact O-N 3.46Å; S240-S243 PolarHBondContact OG-N 2.94Å
241	A	79.2	Confident	91.2	Very high	95 Å²	95	33.3 Å²	33.3	79%	0.785	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-31	-179.6	0	0	0	0	0	112.2	S243	A241-S243 VanDerWaalsContact C-N 3.32Å
242	D	84.8	Confident	91.2	Very high	121 Å²	121	34.7 Å²	34.7	65%	0.647	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	11.7	177.7	65.9	-20.2	0	0	0	113.3	S240	S240-D242 VanDerWaalsContact C-N 3.27Å; S240-D242 WeakPolarHBondContact CB-OD1 3.42Å; S240-D242 PolarHBondContact O-N 3.18Å; S240-D242 PolarHBondContact OG-OD1 2.88Å
243	S	91.7	Very high	91.5	Very high	4 Å²	4	33 Å²	33	3%	0.028	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-61.2	141.8	-175.7	-166.4	0	0	0	0	112.6	A237 T238 S240 A241	A237-S243 PolarHBondContact N-OG 3.36Å; T238-S243 WeakPolarHBondContact CA-OG 3.35Å; T238-S243 PolarHBondContact N-OG 2.61Å; T238-S243 WeakPolarHBondContact O-CB 3.4Å; T238-S243 PolarHBondContact O-OG 2.91Å; T238-S243 VanDerWaalsContact OG1-CB 3.22Å; T238-S243 WeakPolarHBondContact OG1-CB 3.5Å; T238-S243 PolarHBondContact OG1-OG 3.47Å; S240-S243 WeakPolarHBondContact O-CB 2.94Å; S240-S243 PolarHBondContact O-N 3.46Å; S240-S243 PolarHBondContact OG-N 2.94Å; A241-S243 VanDerWaalsContact C-N 3.32Å
244	K	93.8	Very high	91.5	Very high	65 Å²	65	33.9 Å²	33.9	28%	0.283	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-67.6	138	175.6	69.2	-179.4	-173.6	161.3	0	111.2	Q163 E183 Y236 A237 M246	Q163-K244 WeakPolarHBondContact O-CD 3.36Å; E183-K244 WeakPolarHBondContact OE1-CE 3.49Å; E183-K244 IonicContact OE1-NZ 3.02Å; E183-K244 PolarHBondContact OE1-NZ 3.47Å; E183-K244 IonicContact OE2-NZ 2.72Å; Y236-K244 WeakPolarHBondContact CA-O 3.42Å; A237-K244 HydrophobicContact CB-CD 4.19Å; A237-K244 HydrophobicContact CB-CG 3.52Å; A237-K244 PolarHBondContact N-O 2.72Å; K244-M246 VanDerWaalsContact CE-SD 3.58Å; K244-M246 HydrophobicContact CG-CG 4.35Å
245	L	95.7	Very high	91.4	Very high	2 Å²	2	35 Å²	35	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	135.2	168.7	-84.6	169.9	0	0	0	110.2	N164 L190 A208 Q211 I212 Y236	N164-L245 VanDerWaalsContact CA-O 3.22Å; N164-L245 WeakPolarHBondContact CA-O 3.48Å; N164-L245 WeakPolarHBondContact CB-O 3.4Å; N164-L245 PolarHBondContact ND2-O 2.82Å; L190-L245 HydrophobicContact CB-CD2 4.31Å; L190-L245 HydrophobicContact CD1-CD1 4.3Å; L190-L245 HydrophobicContact CD1-CD2 4.38Å; A208-L245 HydrophobicContact CB-CD1 3.69Å; Q211-L245 HydrophobicContact CB-CB 4.17Å; I212-L245 HydrophobicContact CD1-CD1 4.45Å; I212-L245 HydrophobicContact CG1-CD1 4.3Å; Y236-L245 HydrophobicContact CD1-CD2 3.67Å; Y236-L245 HydrophobicContact CD1-CG 3.79Å; Y236-L245 HydrophobicContact CD2-CD2 3.74Å; Y236-L245 HydrophobicContact CE1-CD1 4.07Å; Y236-L245 HydrophobicContact CE1-CD2 3.6Å; Y236-L245 HydrophobicContact CE1-CG 3.47Å; Y236-L245 VanDerWaalsContact CE1-CG 3.47Å; Y236-L245 HydrophobicContact CE2-CD2 3.65Å; Y236-L245 HydrophobicContact CE2-CG 4.39Å; Y236-L245 HydrophobicContact CG-CD2 3.76Å; Y236-L245 HydrophobicContact CG-CG 4.39Å
246	M	97	Very high	91.2	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.1	179.9	-59.9	-175.9	-60.6	0	0	110.4	E183 A185 L235 A237 K244 T248	E183-M246 HydrophobicContact CG-SD 4.38Å; A185-M246 HydrophobicContact CB-CE 3.54Å; L235-M246 PolarHBondContact N-O 3.32Å; L235-M246 PolarHBondContact O-N 3.14Å; A237-M246 HydrophobicContact CB-CE 3.81Å; A237-M246 HydrophobicContact CB-SD 4.14Å; K244-M246 VanDerWaalsContact CE-SD 3.58Å; K244-M246 HydrophobicContact CG-CG 4.35Å; M246-T248 HydrophobicContact CB-CG2 4.49Å
247	I	98.1	Very high	90.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.6	168.9	-59	169.7	0	0	0	108.6	N164 V165 T166 V216 L219 H226 L229 L234 F250	N164-I247 PolarHBondContact O-N 3.26Å; V165-I247 HydrophobicContact CG2-CB 4.48Å; T166-I247 PolarHBondContact N-O 2.78Å; V216-I247 HydrophobicContact CG2-CD1 3.86Å; L219-I247 HydrophobicContact CD1-CD1 4.07Å; L219-I247 HydrophobicContact CD1-CG2 4.3Å; H226-I247 VanDerWaalsContact CD2-CG2 3.46Å; H226-I247 WeakPolarHBondContact CD2-CG2 3.48Å; L229-I247 HydrophobicContact CD2-CD1 4.35Å; L229-I247 HydrophobicContact CD2-CG1 4.36Å; L229-I247 HydrophobicContact CD2-CG2 3.82Å; L234-I247 HydrophobicContact CD2-CB 4.46Å; L234-I247 HydrophobicContact CD2-CG1 3.78Å; I247-F250 HydrophobicContact CG2-CZ 4.13Å
248	T	94.1	Very high	90.5	Very high	19 Å²	19	46.9 Å²	46.9	12%	0.117	28%	0.277	C	S	.	.			trans	-135.4	173	-175.7	72.5	0	0	0	0	111.3	T166 H226 N233 L235 M246	T166-T248 HydrophobicContact CG2-CG2 4.32Å; H226-T248 PolarHBondContact NE2-O 2.78Å; N233-T248 PolarHBondContact O-N 3Å; N233-T248 PolarHBondContact O-OG1 2.75Å; L235-T248 HydrophobicContact CB-CG2 4.26Å; L235-T248 HydrophobicContact CD1-CG2 3.83Å; L235-T248 HydrophobicContact CG-CG2 3.85Å; M246-T248 HydrophobicContact CB-CG2 4.49Å
249	D	89.7	Confident	89.9	Confident	42 Å²	42	49.7 Å²	49.7	23%	0.225	30%	0.299	C	S	.	.			trans	58.2	78.8	-178	-163.8	23.5	0	0	0	115.8	K139 H226 G251 R411	K139-D249 IonicContact NZ-OD1 3.22Å; K139-D249 PolarHBondContact NZ-OD1 2.93Å; K139-D249 VanDerWaalsContact NZ-OD1 3.13Å; H226-D249 PolarHBondContact CE1-O 3.46Å; H226-D249 PolarHBondContact NE2-O 3.37Å; D249-G251 PolarHBondContact O-N 3.49Å; D249-G251 PolarHBondContact OD1-N 2.72Å; D249-R411 IonicContact OD2-NH2 3.57Å
250	F	91.9	Very high	89.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-83.6	17.4	177	-70.4	-94	0	0	0	113.3	E153 I156 L157 I160 V165 T166 L219 V224 H226 I247 L252 A253	E153-F250 HydrophobicContact CG-CB 4.06Å; I156-F250 HydrophobicContact CG2-CB 4.35Å; I156-F250 HydrophobicContact CG2-CD1 3.65Å; I156-F250 HydrophobicContact CG2-CE1 4.3Å; I156-F250 HydrophobicContact CG2-CG 4.16Å; L157-F250 HydrophobicContact CD2-CD2 3.78Å; L157-F250 HydrophobicContact CD2-CE2 4.31Å; L157-F250 HydrophobicContact CD2-CG 4.41Å; L157-F250 HydrophobicContact CG-CD2 4.5Å; I160-F250 HydrophobicContact CD1-CD1 4.23Å; I160-F250 HydrophobicContact CD1-CD2 4.25Å; I160-F250 HydrophobicContact CD1-CE1 3.79Å; I160-F250 HydrophobicContact CD1-CE2 3.82Å; I160-F250 HydrophobicContact CD1-CG 4.45Å; I160-F250 HydrophobicContact CD1-CZ 3.58Å; V165-F250 HydrophobicContact CG1-CE2 3.86Å; V165-F250 HydrophobicContact CG1-CZ 3.54Å; T166-F250 HydrophobicContact CG2-CD2 4.42Å; T166-F250 HydrophobicContact CG2-CE2 4.06Å; L219-F250 HydrophobicContact CD1-CE1 3.83Å; L219-F250 HydrophobicContact CD1-CZ 4.04Å; L219-F250 HydrophobicContact CD2-CE1 3.67Å; L219-F250 HydrophobicContact CD2-CZ 3.99Å; L219-F250 HydrophobicContact CG-CE1 4.42Å; V224-F250 HydrophobicContact CG1-CD1 4.33Å; V224-F250 HydrophobicContact CG1-CE1 4.24Å; H226-F250 AromaticContact CD2-CE1 3.81Å; I247-F250 HydrophobicContact CG2-CZ 4.13Å; F250-L252 PolarHBondContact O-N 3.1Å; F250-L252 VanDerWaalsContact O-N 3.15Å; F250-A253 HydrophobicContact CB-CB 3.95Å; F250-A253 HydrophobicContact CD1-CB 3.69Å; F250-A253 HydrophobicContact CG-CB 4.31Å; F250-A253 WeakPolarHBondContact O-CB 3.48Å; F250-A253 PolarHBondContact O-N 3.46Å
251	G	86.8	Confident	89.7	Confident	28 Å²	28	48.6 Å²	48.6	29%	0.289	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-64.9	-17.2	-175.7	0	0	0	0	0	115.2	D249	D249-G251 PolarHBondContact O-N 3.49Å; D249-G251 PolarHBondContact OD1-N 2.72Å
252	L	87.6	Confident	89.9	Confident	30 Å²	30	49.3 Å²	49.3	16%	0.157	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-113.7	2.6	171.8	-67.6	-177.4	0	0	0	113	R227 D228 F250 C268 R411	R227-L252 PolarHBondContact NE-O 2.69Å; R227-L252 PolarHBondContact NH2-O 3.39Å; D228-L252 HydrophobicContact CB-CB 4.25Å; D228-L252 HydrophobicContact CB-CD1 3.86Å; F250-L252 PolarHBondContact O-N 3.1Å; F250-L252 VanDerWaalsContact O-N 3.15Å; L252-C268 HydrophobicContact CD1-CB 4.27Å; L252-C268 HydrophobicContact CD2-CB 4.36Å; L252-R411 HydrophobicContact CD1-CG 4.22Å
253	A	93	Very high	90.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.263	C	S	.	.			trans	-66.4	150	-175	0	0	0	0	0	111.7	N152 I156 V224 T225 H226 F250	N152-A253 PolarHBondContact ND2-O 2.89Å; I156-A253 HydrophobicContact CD1-CB 3.62Å; V224-A253 HydrophobicContact CG1-CB 4.27Å; T225-A253 CarbonylContact O-C 3.54Å; T225-A253 WeakPolarHBondContact O-CA 3.4Å; T225-A253 WeakPolarHBondContact O-CB 3.17Å; H226-A253 WeakPolarHBondContact O-CA 3.42Å; F250-A253 HydrophobicContact CB-CB 3.95Å; F250-A253 HydrophobicContact CD1-CB 3.69Å; F250-A253 HydrophobicContact CG-CB 4.31Å; F250-A253 WeakPolarHBondContact O-CB 3.48Å; F250-A253 PolarHBondContact O-N 3.46Å
254	H	93.3	Very high	90.2	Very high	33 Å²	33	47.8 Å²	47.8	15%	0.153	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.5	174.9	-172.3	62	0	0	0	110	V224 T225 E261 M264	V224-H254 CarbonylContact C-O 3.56Å; V224-H254 VanDerWaalsContact CA-O 3.28Å; V224-H254 WeakPolarHBondContact CA-O 3.46Å; T225-H254 PolarHBondContact N-O 2.98Å; T225-H254 PolarHBondContact O-N 3.03Å; H254-E261 IonicContact CD2-OE1 2.71Å; H254-E261 IonicContact CE1-OE1 3.03Å; H254-E261 PolarHBondContact CE1-OE1 3.33Å; H254-E261 IonicContact NE2-OE1 2.83Å; H254-E261 PolarHBondContact NE2-OE1 2.78Å; H254-M264 HydrophobicContact CB-CG 4.39Å; H254-M264 HydrophobicContact CB-SD 3.74Å; H254-M264 VanDerWaalsContact CD2-CG 3.48Å; H254-M264 WeakPolarHBondContact CD2-CG 3.34Å
255	L	92.4	Very high	89.8	Confident	25 Å²	25	49.2 Å²	49.2	13%	0.131	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.5	170.1	-179.7	64.7	0	0	0	108.6	L155 I156 R159 V224 Q257	L155-L255 HydrophobicContact CD2-CD2 4Å; L155-L255 HydrophobicContact CG-CD2 4.13Å; I156-L255 HydrophobicContact CD1-CB 4.11Å; I156-L255 HydrophobicContact CG1-CB 3.82Å; R159-L255 VanDerWaalsContact NH1-CD2 3.29Å; V224-L255 HydrophobicContact CG2-CD1 3.72Å; L255-Q257 PolarHBondContact O-N 2.83Å
256	K	91.6	Very high	89.3	Confident	66 Å²	66	54 Å²	54	29%	0.287	30%	0.304	S	S	.	.			trans	-56.6	131.1	172.2	-70.1	-178.7	174.4	-156.9	0	110.7	G223 E261	G223-K256 WeakPolarHBondContact O-CG 3.4Å; G223-K256 PolarHBondContact O-N 2.91Å; K256-E261 WeakPolarHBondContact CD-O 3.46Å; K256-E261 WeakPolarHBondContact CE-O 3.02Å; K256-E261 PolarHBondContact NZ-O 2.83Å
257	Q	85.9	Confident	88.7	Confident	179 Å²	179	55.6 Å²	55.6	84%	0.836	31%	0.314	S	S	*	.	S	Bend	trans	-83.8	-23.5	176.6	-58.7	-169.2	-25.6	0	0	112.2	L255 E261	L255-Q257 PolarHBondContact O-N 2.83Å; Q257-E261 WeakPolarHBondContact CB-OE2 3.28Å; Q257-E261 PolarHBondContact N-OE2 2.91Å
258	S	86.5	Confident	88.1	Confident	62 Å²	62	56.2 Å²	56.2	43%	0.434	32%	0.318	S	S	.	.	S	Bend	trans	-146.5	160.8	175.3	71.3	0	0	0	0	111.3	A260 E261	S258-A260 PolarHBondContact O-N 2.94Å; S258-A260 PolarHBondContact OG-N 3.45Å; S258-E261 WeakPolarHBondContact O-CB 3.46Å; S258-E261 PolarHBondContact O-N 2.88Å; S258-E261 VanDerWaalsContact O-N 3.14Å; S258-E261 PolarHBondContact OG-N 2.85Å
259	S	81.4	Confident	87.7	Confident	121 Å²	121	55.4 Å²	55.4	85%	0.846	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.1	173.2	50.7	0	0	0	0	112.9	E261	S259-E261 VanDerWaalsContact C-N 3.33Å
260	A	83.1	Confident	87.6	Confident	81 Å²	81	53.5 Å²	53.5	67%	0.669	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.7	176.3	0	0	0	0	0	113.1	S258 Q262	S258-A260 PolarHBondContact O-N 2.94Å; S258-A260 PolarHBondContact OG-N 3.45Å; A260-Q262 PolarHBondContact O-N 3.37Å
261	E	85.8	Confident	87.5	Confident	45 Å²	45	53.5 Å²	53.5	21%	0.21	30%	0.304	C	S	.	.			trans	-74	110.3	177.4	-167.1	-174.7	166.6	0	0	110.2	H254 K256 Q257 S258 S259	H254-E261 IonicContact CD2-OE1 2.71Å; H254-E261 IonicContact CE1-OE1 3.03Å; H254-E261 PolarHBondContact CE1-OE1 3.33Å; H254-E261 IonicContact NE2-OE1 2.83Å; H254-E261 PolarHBondContact NE2-OE1 2.78Å; K256-E261 WeakPolarHBondContact CD-O 3.46Å; K256-E261 WeakPolarHBondContact CE-O 3.02Å; K256-E261 PolarHBondContact NZ-O 2.83Å; Q257-E261 WeakPolarHBondContact CB-OE2 3.28Å; Q257-E261 PolarHBondContact N-OE2 2.91Å; S258-E261 WeakPolarHBondContact O-CB 3.46Å; S258-E261 PolarHBondContact O-N 2.88Å; S258-E261 VanDerWaalsContact O-N 3.14Å; S258-E261 PolarHBondContact OG-N 2.85Å; S259-E261 VanDerWaalsContact C-N 3.33Å
262	Q	84.7	Confident	87.6	Confident	110 Å²	110	53 Å²	53	51%	0.514	29%	0.294	S	S	.	.			trans	-111.9	-24.4	178.6	-65.9	-173.9	-30.1	0	0	112.8	A260	A260-Q262 PolarHBondContact O-N 3.37Å
263	Y	90.7	Very high	87.9	Confident	82 Å²	82	52.2 Å²	52.2	32%	0.322	29%	0.289	S	S	.	.			trans	-113.7	143.9	-169.5	-58.1	-77	0	0	0	112.1	P283 Y284 T285	Y263-P283 HydrophobicContact CD1-CB 3.92Å; Y263-P283 HydrophobicContact CG-CB 3.97Å; Y263-Y284 CarbonylContact C-O 3.59Å; Y263-Y284 WeakPolarHBondContact CA-O 3.3Å; Y263-T285 HydrophobicContact CD1-CG2 3.93Å; Y263-T285 HydrophobicContact CE1-CG2 3.93Å
264	M	91.1	Very high	87.9	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.054	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-116.8	153.6	169.8	-66.1	157.7	-73.9	0	0	108.5	T225 H254 P283 Y284 T285	T225-M264 HydrophobicContact CG2-CE 4.07Å; T225-M264 HydrophobicContact CG2-SD 4.23Å; H254-M264 HydrophobicContact CB-CG 4.39Å; H254-M264 HydrophobicContact CB-SD 3.74Å; H254-M264 VanDerWaalsContact CD2-CG 3.48Å; H254-M264 WeakPolarHBondContact CD2-CG 3.34Å; M264-P283 CarbonylContact O-C 3.53Å; M264-P283 VanDerWaalsContact O-CA 3.31Å; M264-P283 WeakPolarHBondContact O-CA 3.33Å; M264-Y284 HydrophobicContact CB-CD2 4.14Å; M264-Y284 HydrophobicContact CB-CE1 4.02Å; M264-Y284 HydrophobicContact CB-CE2 3.63Å; M264-Y284 HydrophobicContact CE-CD2 3.8Å; M264-Y284 HydrophobicContact CE-CE2 3.68Å; M264-Y284 HydrophobicContact CG-CE2 4.4Å; M264-Y284 PolarHBondContact N-O 3.32Å; M264-Y284 VanDerWaalsContact O-CD1 3.28Å; M264-Y284 WeakPolarHBondContact O-CD1 3.45Å; M264-Y284 PolarHBondContact O-N 3.37Å; M264-Y284 HydrophobicContact SD-CE2 3.93Å; M264-T285 WeakPolarHBondContact CE-O 3.5Å
265	V	86	Confident	88	Confident	96 Å²	96	50.9 Å²	50.9	58%	0.582	28%	0.283	S	S	*	.			trans	-124.7	-19.7	-176.5	-64.5	0	0	0	0	113.8	P267 P283	V265-P267 WeakPolarHBondContact O-CD 2.96Å; V265-P283 HydrophobicContact CG1-CB 4.24Å; V265-P283 HydrophobicContact CG1-CG 4.32Å
266	D	85.5	Confident	88	Confident	103 Å²	103	49.8 Å²	49.8	55%	0.551	28%	0.278	S	S	*	.			trans	-78.3	116	-173.8	-63.2	-65	0	0	0	112.5	C268 Y284	D266-C268 PolarHBondContact O-N 2.82Å; D266-Y284 PolarHBondContact O-OH 3.39Å
267	P	83.8	Confident	88.1	Confident	34 Å²	34	47.6 Å²	47.6	22%	0.221	27%	0.268	C	S	.	.			trans	-68.9	123.1	179	28.2	-33.5	0	0	0	110.9	V265 I278 K414 V417	V265-P267 WeakPolarHBondContact O-CD 2.96Å; P267-I278 HydrophobicContact CB-CG2 3.98Å; P267-K414 HydrophobicContact CG-CB 4.47Å; P267-K414 HydrophobicContact CG-CG 4.35Å; P267-V417 HydrophobicContact CB-CG2 3.92Å; P267-V417 HydrophobicContact CG-CG2 4.37Å
268	C	85.5	Confident	88.3	Confident	13 Å²	13	39.4 Å²	39.4	9%	0.088	23%	0.23	C	C	.	.			trans	-153.1	172.6	178.4	59	0	0	0	0	111	L252 D266	L252-C268 HydrophobicContact CD1-CB 4.27Å; L252-C268 HydrophobicContact CD2-CB 4.36Å; D266-C268 PolarHBondContact O-N 2.82Å
269	G	85.3	Confident	88.4	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	112.6	178.9	179.9	0	0	0	0	0	113.6	R227 R411 I412	R227-G269 WeakPolarHBondContact O-CA 3.38Å; G269-R411 WeakPolarHBondContact O-CA 3.49Å; G269-I412 PolarHBondContact O-N 3.22Å
270	T	88.2	Confident	88.6	Confident	2 Å²	2	32 Å²	32	1%	0.012	18%	0.177	C	C	.	.			trans	-94	128	179.5	-60.7	0	0	0	0	109.7	D228 K230 E272 Y273 I274 A408	D228-T270 WeakPolarHBondContact OD1-CB 3.49Å; D228-T270 PolarHBondContact OD1-N 3.49Å; D228-T270 VanDerWaalsContact OD1-N 3.17Å; D228-T270 PolarHBondContact OD1-OG1 3.22Å; K230-T270 HydrophobicContact CD-CG2 4.17Å; K230-T270 PolarHBondContact NZ-OG1 2.63Å; T270-E272 VanDerWaalsContact C-N 3.27Å; T270-E272 VanDerWaalsContact CG2-OE2 3.27Å; T270-E272 WeakPolarHBondContact CG2-OE2 3.13Å; T270-E272 PolarHBondContact O-N 3.14Å; T270-E272 VanDerWaalsContact O-N 3.1Å; T270-Y273 HydrophobicContact CG2-CD2 3.84Å; T270-Y273 HydrophobicContact CG2-CE2 4.34Å; T270-Y273 CarbonylContact O-C 3.54Å; T270-Y273 PolarHBondContact O-N 3.34Å; T270-I274 PolarHBondContact O-N 3.08Å; T270-A408 WeakPolarHBondContact CG2-O 3.41Å
271	P	88.3	Confident	88.3	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-51.1	-38.5	-168.3	-30.2	36.4	0	0	0	115.9	Y273 I274 R312 L315 Y316 I319 R410	P271-Y273 VanDerWaalsContact C-N 3.29Å; P271-Y273 PolarHBondContact O-N 3.18Å; P271-I274 WeakPolarHBondContact O-CG2 3.21Å; P271-I274 PolarHBondContact O-N 3.43Å; P271-R312 VanDerWaalsContact CG-CZ 3.47Å; P271-L315 HydrophobicContact CB-CD2 4.23Å; P271-Y316 HydrophobicContact CB-CE1 4.03Å; P271-I319 WeakPolarHBondContact O-CD1 3.47Å; P271-R410 VanDerWaalsContact CD-O 3.28Å; P271-R410 WeakPolarHBondContact CD-O 3.42Å
272	E	90.3	Very high	88.1	Confident	17 Å²	17	35.6 Å²	35.6	8%	0.079	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-77.8	-17.3	-175.4	-56.8	79.2	-179.1	0	0	112.8	T270 M305 L315 V403	T270-E272 VanDerWaalsContact C-N 3.27Å; T270-E272 VanDerWaalsContact CG2-OE2 3.27Å; T270-E272 WeakPolarHBondContact CG2-OE2 3.13Å; T270-E272 PolarHBondContact O-N 3.14Å; T270-E272 VanDerWaalsContact O-N 3.1Å; E272-M305 HydrophobicContact CB-CE 3.42Å; E272-M305 VanDerWaalsContact CB-CE 3.42Å; E272-M305 HydrophobicContact CB-SD 4.4Å; E272-M305 HydrophobicContact CG-CE 4.08Å; E272-M305 HydrophobicContact CG-SD 4.44Å; E272-L315 HydrophobicContact CG-CD2 4.31Å; E272-V403 HydrophobicContact CG-CG1 4.12Å
273	Y	93.5	Very high	88.3	Confident	14 Å²	14	32.8 Å²	32.8	6%	0.055	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-111.1	1.6	178.5	-57.6	-87.6	0	0	0	112	K230 P231 T270 P271 V295 I296 I299 M305	K230-Y273 HydrophobicContact CB-CD1 4.17Å; K230-Y273 HydrophobicContact CB-CD2 3.74Å; K230-Y273 HydrophobicContact CB-CE1 4.19Å; K230-Y273 HydrophobicContact CB-CE2 3.75Å; K230-Y273 HydrophobicContact CB-CG 3.97Å; P231-Y273 VanDerWaalsContact CD-CE1 3.46Å; P231-Y273 WeakPolarHBondContact CD-OH 3.44Å; P231-Y273 HydrophobicContact CG-CE1 4.24Å; T270-Y273 HydrophobicContact CG2-CD2 3.84Å; T270-Y273 HydrophobicContact CG2-CE2 4.34Å; T270-Y273 CarbonylContact O-C 3.54Å; T270-Y273 PolarHBondContact O-N 3.34Å; P271-Y273 VanDerWaalsContact C-N 3.29Å; P271-Y273 PolarHBondContact O-N 3.18Å; Y273-V295 HydrophobicContact CD1-CB 4Å; Y273-V295 HydrophobicContact CD1-CG1 3.52Å; Y273-V295 HydrophobicContact CE1-CB 4.47Å; Y273-V295 HydrophobicContact CE1-CG1 3.66Å; Y273-V295 HydrophobicContact CG-CG1 4.41Å; Y273-I296 HydrophobicContact CD1-CG1 4.3Å; Y273-I296 HydrophobicContact CE1-CG1 4.14Å; Y273-I299 HydrophobicContact CE1-CD1 3.84Å; Y273-M305 HydrophobicContact CE2-CE 4.35Å
274	I	93.3	Very high	88.3	Confident	4 Å²	4	29.1 Å²	29.1	2%	0.021	16%	0.155	C	C	.	.			trans	-72.8	136	-172.6	-154.2	172	0	0	0	110.7	T270 P271 I278 L279 W291 Y316 I319 I412	T270-I274 PolarHBondContact O-N 3.08Å; P271-I274 WeakPolarHBondContact O-CG2 3.21Å; P271-I274 PolarHBondContact O-N 3.43Å; I274-I278 HydrophobicContact CD1-CB 4.13Å; I274-I278 HydrophobicContact CD1-CG2 3.71Å; I274-I278 HydrophobicContact CG1-CB 3.99Å; I274-I278 HydrophobicContact CG1-CD1 3.77Å; I274-I278 HydrophobicContact CG1-CG1 4.47Å; I274-I278 HydrophobicContact CG1-CG2 4.07Å; I274-L279 HydrophobicContact CD1-CD2 4.01Å; I274-L279 HydrophobicContact CG2-CD1 4.03Å; I274-L279 HydrophobicContact CG2-CD2 4.14Å; I274-L279 HydrophobicContact CG2-CG 4.14Å; I274-W291 PolarHBondContact O-NE1 3.33Å; I274-Y316 HydrophobicContact CG2-CD1 4.4Å; I274-Y316 HydrophobicContact CG2-CE1 4.09Å; I274-I319 HydrophobicContact CG2-CD1 4.06Å; I274-I412 HydrophobicContact CD1-CB 4.25Å; I274-I412 HydrophobicContact CD1-CD1 3.54Å; I274-I412 HydrophobicContact CD1-CG2 3.83Å
275	A	94.4	Very high	88.5	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.008	16%	0.159	C	C	.	.			trans	-74	145.3	176.1	0	0	0	0	0	111	E277 I278 V288 W291	A275-E277 VanDerWaalsContact C-N 3.29Å; A275-E277 HydrophobicContact CB-CG 4.41Å; A275-E277 PolarHBondContact O-N 2.94Å; A275-I278 HydrophobicContact CB-CD1 4.2Å; A275-I278 HydrophobicContact CB-CG1 4.42Å; A275-I278 WeakPolarHBondContact O-CB 3.3Å; A275-I278 PolarHBondContact O-N 3.32Å; A275-I278 VanDerWaalsContact O-N 3.13Å; A275-V288 HydrophobicContact CB-CB 3.83Å; A275-V288 HydrophobicContact CB-CG1 3.75Å; A275-W291 HydrophobicContact CB-CB 3.89Å; A275-W291 HydrophobicContact CB-CG 3.91Å
276	P	93.8	Very high	89	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.013	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-60.5	-36.3	-176.8	20.5	-30.7	0	0	0	112.8	I278 L279 T280 W291 I319 L320 V348	P276-I278 PolarHBondContact O-N 3.25Å; P276-L279 WeakPolarHBondContact O-CB 3.45Å; P276-L279 PolarHBondContact O-N 3.47Å; P276-T280 WeakPolarHBondContact O-CG2 3.42Å; P276-T280 PolarHBondContact O-N 2.87Å; P276-W291 HydrophobicContact CG-CD2 4.48Å; P276-W291 HydrophobicContact CG-CE3 4.09Å; P276-W291 HydrophobicContact CG-CH2 4.04Å; P276-W291 HydrophobicContact CG-CZ2 4.43Å; P276-W291 HydrophobicContact CG-CZ3 3.86Å; P276-I319 HydrophobicContact CB-CG2 4.05Å; P276-L320 HydrophobicContact CB-CD2 4.34Å; P276-V348 HydrophobicContact CB-CG1 3.73Å; P276-V348 HydrophobicContact CG-CB 4.29Å; P276-V348 HydrophobicContact CG-CG1 3.59Å
277	E	92.7	Very high	89.6	Confident	20 Å²	20	23.1 Å²	23.1	9%	0.093	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-64.6	-23.5	178.3	63.2	-88.9	-156.9	0	0	114	A275 L279 T280 V288 A350 R353	A275-E277 VanDerWaalsContact C-N 3.29Å; A275-E277 HydrophobicContact CB-CG 4.41Å; A275-E277 PolarHBondContact O-N 2.94Å; E277-L279 VanDerWaalsContact C-N 3.27Å; E277-L279 PolarHBondContact O-N 3.43Å; E277-T280 PolarHBondContact O-N 2.96Å; E277-T280 PolarHBondContact O-OG1 3.43Å; E277-V288 HydrophobicContact CG-CG1 4.04Å; E277-V288 WeakPolarHBondContact OE1-CG1 3.32Å; E277-A350 HydrophobicContact CG-CB 4.4Å; E277-R353 IonicContact OE1-CZ 2.92Å; E277-R353 IonicContact OE1-NH1 3.67Å; E277-R353 PolarHBondContact OE1-NH1 3.23Å; E277-R353 IonicContact OE1-NH2 3.52Å; E277-R353 IonicContact OE2-CZ 2.69Å; E277-R353 IonicContact OE2-NH1 3.57Å; E277-R353 IonicContact OE2-NH2 3.97Å; E277-R353 PolarHBondContact OE2-NH2 2.91Å
278	I	90.5	Very high	90.2	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.036	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-69.7	-32.6	172.7	-62.1	169.4	0	0	0	110.3	P267 I274 A275 P276 T280 Y284 V288	P267-I278 HydrophobicContact CB-CG2 3.98Å; I274-I278 HydrophobicContact CD1-CB 4.13Å; I274-I278 HydrophobicContact CD1-CG2 3.71Å; I274-I278 HydrophobicContact CG1-CB 3.99Å; I274-I278 HydrophobicContact CG1-CD1 3.77Å; I274-I278 HydrophobicContact CG1-CG1 4.47Å; I274-I278 HydrophobicContact CG1-CG2 4.07Å; A275-I278 HydrophobicContact CB-CD1 4.2Å; A275-I278 HydrophobicContact CB-CG1 4.42Å; A275-I278 WeakPolarHBondContact O-CB 3.3Å; A275-I278 PolarHBondContact O-N 3.32Å; A275-I278 VanDerWaalsContact O-N 3.13Å; P276-I278 PolarHBondContact O-N 3.25Å; I278-T280 VanDerWaalsContact C-N 3.29Å; I278-T280 PolarHBondContact O-N 3.24Å; I278-Y284 HydrophobicContact CG1-CD1 4.15Å; I278-Y284 HydrophobicContact CG1-CD2 4.31Å; I278-Y284 HydrophobicContact CG1-CE1 4.23Å; I278-Y284 HydrophobicContact CG1-CE2 4.36Å; I278-Y284 HydrophobicContact CG1-CG 4.19Å; I278-V288 HydrophobicContact CD1-CB 4.04Å; I278-V288 HydrophobicContact CD1-CG1 3.78Å; I278-V288 HydrophobicContact CG1-CG1 3.81Å
279	L	89.3	Confident	90.8	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-78.4	-11.8	-179.7	-58.1	173.5	0	0	0	112.8	I274 P276 E277 Y316 I319 L320 I412 L420 H421	I274-L279 HydrophobicContact CD1-CD2 4.01Å; I274-L279 HydrophobicContact CG2-CD1 4.03Å; I274-L279 HydrophobicContact CG2-CD2 4.14Å; I274-L279 HydrophobicContact CG2-CG 4.14Å; P276-L279 WeakPolarHBondContact O-CB 3.45Å; P276-L279 PolarHBondContact O-N 3.47Å; E277-L279 VanDerWaalsContact C-N 3.27Å; E277-L279 PolarHBondContact O-N 3.43Å; L279-Y316 HydrophobicContact CD1-CD1 3.55Å; L279-Y316 HydrophobicContact CD1-CE1 4.36Å; L279-Y316 HydrophobicContact CD1-CG 4.02Å; L279-Y316 HydrophobicContact CD2-CD1 3.74Å; L279-Y316 HydrophobicContact CD2-CE1 3.85Å; L279-Y316 HydrophobicContact CD2-CG 4.18Å; L279-Y316 HydrophobicContact CG-CD1 4.31Å; L279-I319 HydrophobicContact CD1-CB 4.32Å; L279-I319 HydrophobicContact CD1-CG2 3.88Å; L279-L320 HydrophobicContact CB-CD1 4.48Å; L279-L320 HydrophobicContact CB-CD2 3.96Å; L279-L320 HydrophobicContact CB-CG 4.29Å; L279-L320 HydrophobicContact CD1-CG 4.13Å; L279-I412 HydrophobicContact CD2-CD1 3.76Å; L279-L420 HydrophobicContact CD2-CD1 4.13Å; L279-H421 PolarHBondContact O-CE1 3.08Å
280	T	84.5	Confident	91.5	Very high	26 Å²	26	21.1 Å²	21.1	16%	0.16	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-90.2	-6.1	178.9	69.2	0	0	0	0	113.6	P276 E277 I278 L282 L320 L430	P276-T280 WeakPolarHBondContact O-CG2 3.42Å; P276-T280 PolarHBondContact O-N 2.87Å; E277-T280 PolarHBondContact O-N 2.96Å; E277-T280 PolarHBondContact O-OG1 3.43Å; I278-T280 VanDerWaalsContact C-N 3.29Å; I278-T280 PolarHBondContact O-N 3.24Å; T280-L282 PolarHBondContact O-N 3.34Å; T280-L282 VanDerWaalsContact O-N 3.14Å; T280-L282 WeakPolarHBondContact OG1-CB 3.42Å; T280-L282 WeakPolarHBondContact OG1-CG 3.28Å; T280-L282 PolarHBondContact OG1-N 3.22Å; T280-L320 HydrophobicContact CG2-CD2 3.94Å; T280-L430 HydrophobicContact CG2-CD2 3.45Å; T280-L430 VanDerWaalsContact CG2-CD2 3.45Å
281	R	78.1	Confident	92	Very high	112 Å²	112	21 Å²	21	42%	0.423	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	13.4	-171.2	-60.3	170.1	176	-110.8	-47.8	114.6	V417 H421	R281-V417 HydrophobicContact CG-CG1 3.75Å; R281-V417 VanDerWaalsContact NH2-C 3.28Å; R281-H421 VanDerWaalsContact CD-CE1 3.45Å; R281-H421 WeakPolarHBondContact CD-CE1 3.46Å; R281-H421 WeakPolarHBondContact CD-NE2 3.25Å; R281-H421 VanDerWaalsContact CG-CE1 3.46Å; R281-H421 WeakPolarHBondContact CG-CE1 3.25Å; R281-H421 PolarHBondContact NE-CE1 3.08Å; R281-H421 PolarHBondContact NE-ND1 2.8Å
282	L	81.7	Confident	92.4	Very high	90 Å²	90	21.1 Å²	21.1	47%	0.471	11%	0.106	S	C	.	.	S	Bend	trans	-81.2	151.2	172.7	-62.3	176.3	0	0	0	109.3	T280 Y284	T280-L282 PolarHBondContact O-N 3.34Å; T280-L282 VanDerWaalsContact O-N 3.14Å; T280-L282 WeakPolarHBondContact OG1-CB 3.42Å; T280-L282 WeakPolarHBondContact OG1-CG 3.28Å; T280-L282 PolarHBondContact OG1-N 3.22Å; L282-Y284 PolarHBondContact O-N 3.11Å
283	P	87.2	Confident	92.8	Very high	50 Å²	50	20.3 Å²	20.3	33%	0.325	10%	0.102	S	C	.	.			trans	-56.1	132.9	170.7	-19.4	30.3	0	0	0	110	Y263 M264 V265	Y263-P283 HydrophobicContact CD1-CB 3.92Å; Y263-P283 HydrophobicContact CG-CB 3.97Å; M264-P283 CarbonylContact O-C 3.53Å; M264-P283 VanDerWaalsContact O-CA 3.31Å; M264-P283 WeakPolarHBondContact O-CA 3.33Å; V265-P283 HydrophobicContact CG1-CB 4.24Å; V265-P283 HydrophobicContact CG1-CG 4.32Å
284	Y	92.4	Very high	93	Very high	6 Å²	6	19.7 Å²	19.7	2%	0.024	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-124.1	159.4	-174.6	64.9	-93.3	0	0	0	111.3	R227 Y263 M264 D266 I278 L282 V288	R227-Y284 WeakPolarHBondContact CD-OH 3.5Å; R227-Y284 PolarHBondContact NH1-OH 3.36Å; Y263-Y284 CarbonylContact C-O 3.59Å; Y263-Y284 WeakPolarHBondContact CA-O 3.3Å; M264-Y284 HydrophobicContact CB-CD2 4.14Å; M264-Y284 HydrophobicContact CB-CE1 4.02Å; M264-Y284 HydrophobicContact CB-CE2 3.63Å; M264-Y284 HydrophobicContact CE-CD2 3.8Å; M264-Y284 HydrophobicContact CE-CE2 3.68Å; M264-Y284 HydrophobicContact CG-CE2 4.4Å; M264-Y284 PolarHBondContact N-O 3.32Å; M264-Y284 VanDerWaalsContact O-CD1 3.28Å; M264-Y284 WeakPolarHBondContact O-CD1 3.45Å; M264-Y284 PolarHBondContact O-N 3.37Å; M264-Y284 HydrophobicContact SD-CE2 3.93Å; D266-Y284 PolarHBondContact O-OH 3.39Å; I278-Y284 HydrophobicContact CG1-CD1 4.15Å; I278-Y284 HydrophobicContact CG1-CD2 4.31Å; I278-Y284 HydrophobicContact CG1-CE1 4.23Å; I278-Y284 HydrophobicContact CG1-CE2 4.36Å; I278-Y284 HydrophobicContact CG1-CG 4.19Å; L282-Y284 PolarHBondContact O-N 3.11Å; Y284-V288 HydrophobicContact CD2-CB 4.44Å; Y284-V288 HydrophobicContact CD2-CG1 3.38Å; Y284-V288 HydrophobicContact CD2-CG2 4.21Å; Y284-V288 HydrophobicContact CE2-CG1 3.99Å; Y284-V288 HydrophobicContact CE2-CG2 4.15Å; Y284-V288 HydrophobicContact CG-CG1 4.04Å
285	T	95	Very high	93.2	Very high	23 Å²	23	19.5 Å²	19.5	14%	0.141	10%	0.098	C	C	.	.			trans	-107.7	-174.3	-176.1	67.6	0	0	0	0	111.5	Y263 M264 K287 V288	Y263-T285 HydrophobicContact CD1-CG2 3.93Å; Y263-T285 HydrophobicContact CE1-CG2 3.93Å; M264-T285 WeakPolarHBondContact CE-O 3.5Å; T285-K287 PolarHBondContact O-N 2.81Å; T285-K287 WeakPolarHBondContact OG1-CB 3.38Å; T285-K287 WeakPolarHBondContact OG1-CG 3.4Å; T285-K287 PolarHBondContact OG1-N 3.17Å; T285-V288 PolarHBondContact O-N 3.35Å
286	N	96.2	Very high	93.2	Very high	34 Å²	34	19.4 Å²	19.4	18%	0.182	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-6	175.2	66.6	-4.6	0	0	0	114.2	H220 T225 V288 D289	H220-N286 WeakPolarHBondContact CB-ND2 3.48Å; H220-N286 PolarHBondContact CE1-O 3.34Å; H220-N286 VanDerWaalsContact CG-ND2 3.33Å; H220-N286 PolarHBondContact ND1-ND2 3.32Å; H220-N286 PolarHBondContact NE2-O 3.39Å; T225-N286 HydrophobicContact CG2-CB 3.96Å; T225-N286 VanDerWaalsContact OG1-CB 3.3Å; T225-N286 WeakPolarHBondContact OG1-CB 3.34Å; N286-V288 PolarHBondContact O-N 3.46Å; N286-V288 VanDerWaalsContact O-N 3.13Å; N286-D289 PolarHBondContact O-N 3.27Å; N286-D289 VanDerWaalsContact O-N 3.15Å
287	K	97.5	Very high	93.4	Very high	26 Å²	26	19.3 Å²	19.3	11%	0.113	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-17.9	175.1	-64.1	-76.2	-177.6	153.2	0	113.5	T285 D289 I290 W291 A350 R353 P354	T285-K287 PolarHBondContact O-N 2.81Å; T285-K287 WeakPolarHBondContact OG1-CB 3.38Å; T285-K287 WeakPolarHBondContact OG1-CG 3.4Å; T285-K287 PolarHBondContact OG1-N 3.17Å; K287-D289 PolarHBondContact O-N 3.46Å; K287-I290 HydrophobicContact CD-CG1 4.49Å; K287-I290 WeakPolarHBondContact O-CB 3.2Å; K287-I290 PolarHBondContact O-N 3.15Å; K287-W291 PolarHBondContact O-N 3.37Å; K287-A350 HydrophobicContact CB-CB 4.27Å; K287-R353 HydrophobicContact CD-CB 4.47Å; K287-R353 PolarHBondContact NZ-O 3.12Å; K287-R353 PolarHBondContact O-NH1 2.76Å; K287-P354 WeakPolarHBondContact CD-O 3.25Å; K287-P354 VanDerWaalsContact NZ-C 3.29Å; K287-P354 PolarHBondContact NZ-O 2.88Å
288	V	97.1	Very high	93.5	Very high	6 Å²	6	18.4 Å²	18.4	4%	0.036	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-34.7	173.7	-60.5	0	0	0	0	112.3	T225 R227 A275 E277 I278 Y284 T285 N286 I290 W291 A292	T225-V288 HydrophobicContact CG2-CG2 3.93Å; R227-V288 HydrophobicContact CG-CG2 4.34Å; A275-V288 HydrophobicContact CB-CB 3.83Å; A275-V288 HydrophobicContact CB-CG1 3.75Å; E277-V288 HydrophobicContact CG-CG1 4.04Å; E277-V288 WeakPolarHBondContact OE1-CG1 3.32Å; I278-V288 HydrophobicContact CD1-CB 4.04Å; I278-V288 HydrophobicContact CD1-CG1 3.78Å; I278-V288 HydrophobicContact CG1-CG1 3.81Å; Y284-V288 HydrophobicContact CD2-CB 4.44Å; Y284-V288 HydrophobicContact CD2-CG1 3.38Å; Y284-V288 HydrophobicContact CD2-CG2 4.21Å; Y284-V288 HydrophobicContact CE2-CG1 3.99Å; Y284-V288 HydrophobicContact CE2-CG2 4.15Å; Y284-V288 HydrophobicContact CG-CG1 4.04Å; T285-V288 PolarHBondContact O-N 3.35Å; N286-V288 PolarHBondContact O-N 3.46Å; N286-V288 VanDerWaalsContact O-N 3.13Å; V288-I290 VanDerWaalsContact C-N 3.29Å; V288-I290 PolarHBondContact O-N 3.03Å; V288-W291 PolarHBondContact O-N 3.36Å; V288-A292 PolarHBondContact O-N 3.47Å
289	D	98.4	Very high	93.6	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-67.7	-34	175.8	-72.5	-18.2	0	0	0	111.1	V216 H220 T225 H226 R227 L229 N286 K287 A292 V293	V216-D289 HydrophobicContact CG1-CB 4.06Å; H220-D289 IonicContact CD2-OD2 3.46Å; H220-D289 IonicContact CE1-OD2 3.12Å; H220-D289 IonicContact NE2-OD2 3.8Å; H220-D289 PolarHBondContact NE2-OD2 3.38Å; T225-D289 WeakPolarHBondContact CG2-OD2 3.47Å; H226-D289 PolarHBondContact N-OD1 3.29Å; H226-D289 PolarHBondContact N-OD2 3.22Å; R227-D289 PolarHBondContact N-OD1 3.24Å; L229-D289 HydrophobicContact CD1-CB 3.68Å; N286-D289 PolarHBondContact O-N 3.27Å; N286-D289 VanDerWaalsContact O-N 3.15Å; K287-D289 PolarHBondContact O-N 3.46Å; D289-A292 PolarHBondContact O-N 3.28Å; D289-V293 WeakPolarHBondContact O-CG2 3.43Å; D289-V293 PolarHBondContact O-N 3.06Å
290	I	98.7	Very high	93.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-68.1	-38.3	179.7	-53	-55.7	0	0	0	110.9	V216 K287 V288 V293 G294 L345 R353 P354 A356	V216-I290 HydrophobicContact CG1-CD1 4.07Å; K287-I290 HydrophobicContact CD-CG1 4.49Å; K287-I290 WeakPolarHBondContact O-CB 3.2Å; K287-I290 PolarHBondContact O-N 3.15Å; V288-I290 VanDerWaalsContact C-N 3.29Å; V288-I290 PolarHBondContact O-N 3.03Å; I290-V293 PolarHBondContact O-N 2.8Å; I290-G294 PolarHBondContact O-N 2.83Å; I290-L345 HydrophobicContact CG2-CD2 3.23Å; I290-L345 HydrophobicContact CG2-CG 4.49Å; I290-R353 HydrophobicContact CB-CG 4.31Å; I290-R353 HydrophobicContact CG2-CG 3.82Å; I290-P354 HydrophobicContact CG2-CG 4.49Å; I290-A356 HydrophobicContact CD1-CB 3.76Å
291	W	98.4	Very high	94.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.3	-49.1	171.4	174.6	-87.3	0	0	0	111.5	I274 A275 P276 K287 V288 V293 G294 V295 F307 I319 L346 V348	I274-W291 PolarHBondContact O-NE1 3.33Å; A275-W291 HydrophobicContact CB-CB 3.89Å; A275-W291 HydrophobicContact CB-CG 3.91Å; P276-W291 HydrophobicContact CG-CD2 4.48Å; P276-W291 HydrophobicContact CG-CE3 4.09Å; P276-W291 HydrophobicContact CG-CH2 4.04Å; P276-W291 HydrophobicContact CG-CZ2 4.43Å; P276-W291 HydrophobicContact CG-CZ3 3.86Å; K287-W291 PolarHBondContact O-N 3.37Å; V288-W291 PolarHBondContact O-N 3.36Å; W291-V293 VanDerWaalsContact C-N 3.27Å; W291-V293 PolarHBondContact O-N 2.89Å; W291-G294 CarbonylContact O-C 3.56Å; W291-G294 WeakPolarHBondContact O-CA 3.47Å; W291-G294 PolarHBondContact O-N 3.45Å; W291-V295 PolarHBondContact O-N 2.87Å; W291-F307 AromaticContact CH2-CE2 3.78Å; W291-F307 HydrophobicContact CH2-CE2 3.78Å; W291-F307 AromaticContact CH2-CZ 3.68Å; W291-F307 HydrophobicContact CH2-CZ 3.68Å; W291-F307 HydrophobicContact CZ2-CD2 4.11Å; W291-F307 AromaticContact CZ2-CE2 3.29Å; W291-F307 HydrophobicContact CZ2-CE2 3.29Å; W291-F307 AromaticContact CZ2-CZ 3.68Å; W291-F307 HydrophobicContact CZ2-CZ 3.68Å; W291-I319 HydrophobicContact CZ2-CG2 3.9Å; W291-L346 HydrophobicContact CD2-CD2 4.01Å; W291-L346 HydrophobicContact CE3-CD2 4.13Å; W291-L346 HydrophobicContact CH2-CD2 4.44Å; W291-L346 HydrophobicContact CZ2-CD2 4.32Å; W291-L346 HydrophobicContact CZ3-CB 4.3Å; W291-L346 HydrophobicContact CZ3-CD2 4.35Å; W291-L346 WeakPolarHBondContact CZ3-O 3.45Å; W291-V348 HydrophobicContact CZ3-CG2 4.35Å
292	A	97.9	Very high	94.7	Very high	4 Å²	4	11.9 Å²	11.9	3%	0.033	7%	0.067	C	C	.	.	H	α-helix	trans	-59.6	-38.7	178.7	0	0	0	0	0	111.9	L229 V288 D289 G294 V295 I296	L229-A292 HydrophobicContact CB-CB 3.83Å; V288-A292 PolarHBondContact O-N 3.47Å; D289-A292 PolarHBondContact O-N 3.28Å; A292-G294 VanDerWaalsContact C-N 3.32Å; A292-G294 PolarHBondContact O-N 2.71Å; A292-V295 PolarHBondContact O-N 3.46Å; A292-I296 WeakPolarHBondContact O-CD1 3.46Å; A292-I296 VanDerWaalsContact O-CG1 3.28Å; A292-I296 WeakPolarHBondContact O-CG1 3.45Å; A292-I296 PolarHBondContact O-N 2.94Å
293	V	98.5	Very high	95	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62	-38.3	171.1	174.8	0	0	0	0	111.8	V209 I212 L213 V216 L229 D289 I290 W291 I296 A297 L345	V209-V293 HydrophobicContact CG1-CG1 4.38Å; I212-V293 HydrophobicContact CG2-CG2 3.77Å; L213-V293 HydrophobicContact CD2-CG1 3.94Å; L213-V293 HydrophobicContact CG-CG1 4.07Å; V216-V293 HydrophobicContact CG2-CG2 4.26Å; L229-V293 HydrophobicContact CD1-CG2 4.04Å; D289-V293 WeakPolarHBondContact O-CG2 3.43Å; D289-V293 PolarHBondContact O-N 3.06Å; I290-V293 PolarHBondContact O-N 2.8Å; W291-V293 VanDerWaalsContact C-N 3.27Å; W291-V293 PolarHBondContact O-N 2.89Å; V293-I296 PolarHBondContact O-N 3.35Å; V293-A297 WeakPolarHBondContact O-CB 3.48Å; V293-A297 PolarHBondContact O-N 3.24Å; V293-L345 HydrophobicContact CG1-CD1 4.22Å
294	G	98.4	Very high	95	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-60	-44.1	172.7	0	0	0	0	0	112.9	I290 W291 A292 A297 Y298	I290-G294 PolarHBondContact O-N 2.83Å; W291-G294 CarbonylContact O-C 3.56Å; W291-G294 WeakPolarHBondContact O-CA 3.47Å; W291-G294 PolarHBondContact O-N 3.45Å; A292-G294 VanDerWaalsContact C-N 3.32Å; A292-G294 PolarHBondContact O-N 2.71Å; G294-A297 PolarHBondContact O-N 2.84Å; G294-Y298 PolarHBondContact O-N 3.3Å
295	V	96.5	Very high	94.9	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62	-45.9	175	177	0	0	0	0	110.5	Y273 W291 A292 A297 Y298 I299 P306 L346	Y273-V295 HydrophobicContact CD1-CB 4Å; Y273-V295 HydrophobicContact CD1-CG1 3.52Å; Y273-V295 HydrophobicContact CE1-CB 4.47Å; Y273-V295 HydrophobicContact CE1-CG1 3.66Å; Y273-V295 HydrophobicContact CG-CG1 4.41Å; W291-V295 PolarHBondContact O-N 2.87Å; A292-V295 PolarHBondContact O-N 3.46Å; V295-A297 PolarHBondContact O-N 3.48Å; V295-Y298 PolarHBondContact O-N 3.13Å; V295-I299 HydrophobicContact CG1-CD1 3.86Å; V295-I299 WeakPolarHBondContact O-CD1 3.33Å; V295-I299 VanDerWaalsContact O-CG1 3.25Å; V295-I299 WeakPolarHBondContact O-CG1 3.3Å; V295-I299 PolarHBondContact O-N 2.83Å; V295-P306 HydrophobicContact CB-CG 4.35Å; V295-P306 HydrophobicContact CG1-CG 3.97Å; V295-P306 HydrophobicContact CG2-CG 4.21Å; V295-L346 HydrophobicContact CG2-CD2 3.8Å
296	I	95.4	Very high	94.8	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-62	-43.8	177.5	-66.9	158.9	0	0	0	111.1	L190 I212 L229 P231 L234 Y273 A292 V293 I299 L300	L190-I296 HydrophobicContact CD2-CG2 4.14Å; I212-I296 HydrophobicContact CD1-CG2 4.04Å; L229-I296 HydrophobicContact CB-CD1 4.33Å; P231-I296 HydrophobicContact CG-CG1 4.42Å; L234-I296 HydrophobicContact CD1-CD1 3.9Å; L234-I296 HydrophobicContact CD1-CG2 4.39Å; Y273-I296 HydrophobicContact CD1-CG1 4.3Å; Y273-I296 HydrophobicContact CE1-CG1 4.14Å; A292-I296 WeakPolarHBondContact O-CD1 3.46Å; A292-I296 VanDerWaalsContact O-CG1 3.28Å; A292-I296 WeakPolarHBondContact O-CG1 3.45Å; A292-I296 PolarHBondContact O-N 2.94Å; V293-I296 PolarHBondContact O-N 3.35Å; I296-I299 PolarHBondContact O-N 2.98Å; I296-L300 HydrophobicContact CG2-CD1 3.83Å; I296-L300 HydrophobicContact CG2-CG 4.25Å; I296-L300 WeakPolarHBondContact O-CB 3.27Å; I296-L300 VanDerWaalsContact O-CG 3.25Å; I296-L300 WeakPolarHBondContact O-CG 3.06Å; I296-L300 PolarHBondContact O-N 3.1Å
297	A	96.4	Very high	94.7	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-63	-42.2	178.2	0	0	0	0	0	112	V209 V293 G294 V295 I299 L300 L301 F341 V342	V209-A297 HydrophobicContact CG2-CB 3.97Å; V293-A297 WeakPolarHBondContact O-CB 3.48Å; V293-A297 PolarHBondContact O-N 3.24Å; G294-A297 PolarHBondContact O-N 2.84Å; V295-A297 PolarHBondContact O-N 3.48Å; A297-I299 VanDerWaalsContact C-N 3.33Å; A297-I299 PolarHBondContact O-N 3.11Å; A297-L300 PolarHBondContact O-N 3.31Å; A297-L301 WeakPolarHBondContact O-CG 3.47Å; A297-L301 PolarHBondContact O-N 2.78Å; A297-L301 VanDerWaalsContact O-N 3.17Å; A297-F341 HydrophobicContact CB-CE1 4.07Å; A297-V342 HydrophobicContact CB-CG2 4.01Å
298	Y	95.2	Very high	94.1	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-58.2	-47	174.1	-174.9	-77.9	0	0	0	111.2	G294 V295 L301 S302 I304 P306 Y324 H325 F326 W331 V342	G294-Y298 PolarHBondContact O-N 3.3Å; V295-Y298 PolarHBondContact O-N 3.13Å; Y298-L301 PolarHBondContact O-N 2.88Å; Y298-S302 WeakPolarHBondContact CD1-OG 3.35Å; Y298-S302 WeakPolarHBondContact CE1-OG 3.48Å; Y298-S302 WeakPolarHBondContact O-CB 3.48Å; Y298-S302 PolarHBondContact O-N 3.3Å; Y298-S302 VanDerWaalsContact O-N 3.11Å; Y298-S302 PolarHBondContact O-OG 3.49Å; Y298-I304 VanDerWaalsContact CD1-O 3.3Å; Y298-I304 WeakPolarHBondContact CD1-O 3.24Å; Y298-I304 HydrophobicContact CE1-CD1 4.21Å; Y298-I304 HydrophobicContact CE1-CG1 3.96Å; Y298-I304 WeakPolarHBondContact CE1-O 3.43Å; Y298-P306 HydrophobicContact CD1-CB 3.75Å; Y298-P306 VanDerWaalsContact CD1-CD 3.48Å; Y298-P306 HydrophobicContact CD1-CG 4.01Å; Y298-P306 HydrophobicContact CD2-CB 3.86Å; Y298-P306 HydrophobicContact CE1-CB 3.97Å; Y298-P306 HydrophobicContact CE2-CB 4.11Å; Y298-P306 HydrophobicContact CG-CB 3.7Å; Y298-P306 HydrophobicContact CG-CG 4.02Å; Y298-Y324 HydrophobicContact CD2-CD2 4.14Å; Y298-Y324 HydrophobicContact CD2-CE2 4.43Å; Y298-Y324 AromaticContact CE2-CD2 3.83Å; Y298-Y324 HydrophobicContact CE2-CD2 3.83Å; Y298-Y324 HydrophobicContact CE2-CE2 4.4Å; Y298-H325 PolarHBondContact OH-O 3.38Å; Y298-F326 HydrophobicContact CD2-CE1 4.13Å; Y298-F326 HydrophobicContact CE2-CD1 4.02Å; Y298-F326 HydrophobicContact CE2-CE1 4.07Å; Y298-W331 HydrophobicContact CD1-CZ2 4.23Å; Y298-W331 HydrophobicContact CD2-CH2 4.17Å; Y298-W331 AromaticContact CD2-CZ2 3.48Å; Y298-W331 HydrophobicContact CD2-CZ2 3.48Å; Y298-W331 VanDerWaalsContact CD2-CZ2 3.48Å; Y298-W331 HydrophobicContact CE1-CZ2 4.32Å; Y298-W331 AromaticContact CE2-CE2 3.89Å; Y298-W331 AromaticContact CE2-CZ2 3.56Å; Y298-W331 HydrophobicContact CE2-CZ2 3.56Å; Y298-W331 AromaticContact CE2-NE1 3.81Å; Y298-W331 AromaticContact CG-CZ2 3.81Å; Y298-W331 HydrophobicContact CG-CZ2 3.81Å; Y298-W331 AromaticContact CZ-CZ2 3.99Å; Y298-W331 AromaticContact CZ-NE1 3.61Å; Y298-V342 HydrophobicContact CD2-CG1 3.97Å; Y298-V342 HydrophobicContact CG-CG1 4.47Å
299	I	92.5	Very high	93.6	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-63.9	-43.6	179.4	-67.8	164.6	0	0	0	111.2	I194 Y273 V295 I296 A297 L301 S302 G303 I304 M305 I400	I194-I299 HydrophobicContact CD1-CG2 4.36Å; Y273-I299 HydrophobicContact CE1-CD1 3.84Å; V295-I299 HydrophobicContact CG1-CD1 3.86Å; V295-I299 WeakPolarHBondContact O-CD1 3.33Å; V295-I299 VanDerWaalsContact O-CG1 3.25Å; V295-I299 WeakPolarHBondContact O-CG1 3.3Å; V295-I299 PolarHBondContact O-N 2.83Å; I296-I299 PolarHBondContact O-N 2.98Å; A297-I299 VanDerWaalsContact C-N 3.33Å; A297-I299 PolarHBondContact O-N 3.11Å; I299-L301 VanDerWaalsContact C-N 3.28Å; I299-L301 PolarHBondContact O-N 3.11Å; I299-S302 PolarHBondContact O-N 2.78Å; I299-G303 WeakPolarHBondContact O-CA 3.35Å; I299-G303 PolarHBondContact O-N 2.92Å; I299-I304 WeakPolarHBondContact CA-O 3.31Å; I299-I304 WeakPolarHBondContact CG1-O 3.47Å; I299-M305 HydrophobicContact CD1-CE 4.02Å; I299-M305 HydrophobicContact CD1-CG 4.37Å; I299-M305 HydrophobicContact CG1-CG 4.44Å; I299-I400 HydrophobicContact CG2-CB 4.47Å; I299-I400 HydrophobicContact CG2-CD1 3.38Å; I299-I400 HydrophobicContact CG2-CG1 3.93Å
300	L	92.4	Very high	92.8	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-57.7	-42.4	179.3	-76.5	167.9	0	0	0	111.7	L190 I194 Y200 A208 V209 I296 A297	L190-L300 HydrophobicContact CD1-CD2 4.04Å; L190-L300 HydrophobicContact CD2-CD2 4.33Å; L190-L300 HydrophobicContact CG-CD2 4.39Å; I194-L300 HydrophobicContact CD1-CD2 3.39Å; I194-L300 HydrophobicContact CD1-CG 4.1Å; I194-L300 HydrophobicContact CG1-CD2 3.62Å; Y200-L300 WeakPolarHBondContact CB-O 3.43Å; Y200-L300 HydrophobicContact CD1-CD2 4.42Å; Y200-L300 HydrophobicContact CD2-CD2 3.64Å; Y200-L300 HydrophobicContact CE2-CD2 3.76Å; Y200-L300 HydrophobicContact CG-CD2 4Å; Y200-L300 PolarHBondContact N-O 3.4Å; A208-L300 HydrophobicContact CB-CD1 4.16Å; V209-L300 HydrophobicContact CG2-CD1 3.66Å; I296-L300 HydrophobicContact CG2-CD1 3.83Å; I296-L300 HydrophobicContact CG2-CG 4.25Å; I296-L300 WeakPolarHBondContact O-CB 3.27Å; I296-L300 VanDerWaalsContact O-CG 3.25Å; I296-L300 WeakPolarHBondContact O-CG 3.06Å; I296-L300 PolarHBondContact O-N 3.1Å; A297-L300 PolarHBondContact O-N 3.31Å
301	L	92.5	Very high	92.2	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-85.1	-20.7	-173.5	-64.8	173.7	0	0	0	114.1	E202 A297 Y298 I299 W331 V334 A338 V342 W364	E202-L301 HydrophobicContact CG-CD2 4.2Å; A297-L301 WeakPolarHBondContact O-CG 3.47Å; A297-L301 PolarHBondContact O-N 2.78Å; A297-L301 VanDerWaalsContact O-N 3.17Å; Y298-L301 PolarHBondContact O-N 2.88Å; I299-L301 VanDerWaalsContact C-N 3.28Å; I299-L301 PolarHBondContact O-N 3.11Å; L301-W331 HydrophobicContact CB-CH2 3.71Å; L301-W331 HydrophobicContact CB-CZ2 4.36Å; L301-W331 HydrophobicContact CB-CZ3 3.97Å; L301-W331 HydrophobicContact CD1-CH2 4.06Å; L301-W331 HydrophobicContact CD1-CZ3 4.05Å; L301-V334 HydrophobicContact CD1-CG1 4.38Å; L301-A338 HydrophobicContact CD1-CB 3.9Å; L301-V342 HydrophobicContact CD1-CG2 4.26Å; L301-W364 HydrophobicContact CD1-CH2 4.19Å; L301-W364 HydrophobicContact CD1-CZ2 3.98Å; L301-W364 HydrophobicContact CD2-CH2 4.46Å; L301-W364 HydrophobicContact CD2-CZ2 3.95Å; L301-W364 HydrophobicContact CG-CZ2 4.49Å
302	S	90.5	Very high	91.6	Very high	8 Å²	8	19 Å²	19	6%	0.056	10%	0.097	C	C	.	.	H	α-helix	trans	-122.3	-19.9	-174.1	67.9	0	0	0	0	115.4	Y298 I299 I304 W331	Y298-S302 WeakPolarHBondContact CD1-OG 3.35Å; Y298-S302 WeakPolarHBondContact CE1-OG 3.48Å; Y298-S302 WeakPolarHBondContact O-CB 3.48Å; Y298-S302 PolarHBondContact O-N 3.3Å; Y298-S302 VanDerWaalsContact O-N 3.11Å; Y298-S302 PolarHBondContact O-OG 3.49Å; I299-S302 PolarHBondContact O-N 2.78Å; S302-I304 PolarHBondContact O-N 2.92Å; S302-I304 WeakPolarHBondContact OG-CG1 3.46Å; S302-I304 PolarHBondContact OG-N 3.26Å; S302-I304 PolarHBondContact OG-O 3.37Å; S302-W331 VanDerWaalsContact CB-NE1 3.3Å
303	G	87.7	Confident	91.1	Very high	9 Å²	9	20.8 Å²	20.8	9%	0.093	11%	0.107	C	C	.	.	S	Bend	trans	74.5	2.2	-174.3	0	0	0	0	0	115.2	G198 I299 I400	G198-G303 WeakPolarHBondContact O-CA 3.45Å; I299-G303 WeakPolarHBondContact O-CA 3.35Å; I299-G303 PolarHBondContact O-N 2.92Å; G303-I400 PolarHBondContact O-N 3.45Å
304	I	88.2	Confident	90.6	Very high	5 Å²	5	21.6 Å²	21.6	3%	0.026	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-123.2	163.2	179.3	55.4	154.7	0	0	0	111	Y298 I299 S302 Y327 F330	Y298-I304 VanDerWaalsContact CD1-O 3.3Å; Y298-I304 WeakPolarHBondContact CD1-O 3.24Å; Y298-I304 HydrophobicContact CE1-CD1 4.21Å; Y298-I304 HydrophobicContact CE1-CG1 3.96Å; Y298-I304 WeakPolarHBondContact CE1-O 3.43Å; I299-I304 WeakPolarHBondContact CA-O 3.31Å; I299-I304 WeakPolarHBondContact CG1-O 3.47Å; S302-I304 PolarHBondContact O-N 2.92Å; S302-I304 WeakPolarHBondContact OG-CG1 3.46Å; S302-I304 PolarHBondContact OG-N 3.26Å; S302-I304 PolarHBondContact OG-O 3.37Å; I304-Y327 HydrophobicContact CD1-CD2 3.81Å; I304-Y327 HydrophobicContact CD1-CE2 4.43Å; I304-F330 HydrophobicContact CD1-CD2 3.5Å; I304-F330 HydrophobicContact CD1-CE2 3.83Å; I304-F330 HydrophobicContact CD1-CG 4.08Å; I304-F330 HydrophobicContact CG1-CD2 4.13Å; I304-F330 HydrophobicContact CG1-CE2 4.49Å; I304-F330 HydrophobicContact CG1-CG 4.23Å; I304-F330 HydrophobicContact CG2-CD1 4.34Å; I304-F330 HydrophobicContact CG2-CE1 3.95Å; I304-F330 HydrophobicContact CG2-CE2 4.22Å; I304-F330 HydrophobicContact CG2-CZ 3.9Å
305	M	90.6	Very high	90.2	Very high	5 Å²	5	21.8 Å²	21.8	3%	0.025	12%	0.115	C	C	.	.			trans	-85.6	144.5	177.8	-58.1	-159.7	73.8	0	0	111.4	E272 Y273 I299 D308 V403	E272-M305 HydrophobicContact CB-CE 3.42Å; E272-M305 VanDerWaalsContact CB-CE 3.42Å; E272-M305 HydrophobicContact CB-SD 4.4Å; E272-M305 HydrophobicContact CG-CE 4.08Å; E272-M305 HydrophobicContact CG-SD 4.44Å; Y273-M305 HydrophobicContact CE2-CE 4.35Å; I299-M305 HydrophobicContact CD1-CE 4.02Å; I299-M305 HydrophobicContact CD1-CG 4.37Å; I299-M305 HydrophobicContact CG1-CG 4.44Å; M305-D308 HydrophobicContact CB-CB 4.27Å; M305-V403 HydrophobicContact CG-CG2 4.47Å; M305-V403 HydrophobicContact SD-CB 3.74Å; M305-V403 HydrophobicContact SD-CG1 3.57Å; M305-V403 VanDerWaalsContact SD-CG1 3.57Å; M305-V403 HydrophobicContact SD-CG2 3.77Å
306	P	92.9	Very high	89.9	Confident	9 Å²	9	21.8 Å²	21.8	6%	0.058	12%	0.115	C	C	.	.	S	Bend	trans	-71.6	-32.1	176.2	26.3	-30.7	0	0	0	112.6	V295 Y298 Y324 L346	V295-P306 HydrophobicContact CB-CG 4.35Å; V295-P306 HydrophobicContact CG1-CG 3.97Å; V295-P306 HydrophobicContact CG2-CG 4.21Å; Y298-P306 HydrophobicContact CD1-CB 3.75Å; Y298-P306 VanDerWaalsContact CD1-CD 3.48Å; Y298-P306 HydrophobicContact CD1-CG 4.01Å; Y298-P306 HydrophobicContact CD2-CB 3.86Å; Y298-P306 HydrophobicContact CE1-CB 3.97Å; Y298-P306 HydrophobicContact CE2-CB 4.11Å; Y298-P306 HydrophobicContact CG-CB 3.7Å; Y298-P306 HydrophobicContact CG-CG 4.02Å; P306-Y324 HydrophobicContact CB-CD2 4.49Å; P306-Y324 HydrophobicContact CB-CG 4.27Å; P306-Y324 VanDerWaalsContact O-CB 3.23Å; P306-Y324 WeakPolarHBondContact O-CB 3.47Å; P306-L346 HydrophobicContact CB-CD1 4.12Å; P306-L346 HydrophobicContact CG-CD1 4.35Å
307	F	92.3	Very high	89.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-129.3	126.1	177.6	-47.1	-74.5	0	0	0	108.2	W291 L315 Q318 I319 Y324 L346	W291-F307 AromaticContact CH2-CE2 3.78Å; W291-F307 HydrophobicContact CH2-CE2 3.78Å; W291-F307 AromaticContact CH2-CZ 3.68Å; W291-F307 HydrophobicContact CH2-CZ 3.68Å; W291-F307 HydrophobicContact CZ2-CD2 4.11Å; W291-F307 AromaticContact CZ2-CE2 3.29Å; W291-F307 HydrophobicContact CZ2-CE2 3.29Å; W291-F307 AromaticContact CZ2-CZ 3.68Å; W291-F307 HydrophobicContact CZ2-CZ 3.68Å; F307-L315 HydrophobicContact CB-CD1 3.71Å; F307-Q318 HydrophobicContact CD1-CB 4.02Å; F307-I319 HydrophobicContact CB-CD1 4.5Å; F307-I319 HydrophobicContact CB-CG1 3.85Å; F307-I319 HydrophobicContact CD1-CG1 4.26Å; F307-I319 HydrophobicContact CD2-CG1 3.96Å; F307-I319 HydrophobicContact CG-CG1 3.75Å; F307-Y324 AromaticContact CE1-CD1 3.91Å; F307-Y324 HydrophobicContact CE1-CD1 3.91Å; F307-Y324 HydrophobicContact CE1-CG 4.32Å; F307-Y324 AromaticContact CZ-CD1 3.66Å; F307-Y324 HydrophobicContact CZ-CD1 3.66Å; F307-Y324 HydrophobicContact CZ-CG 4.25Å; F307-L346 HydrophobicContact CE2-CD1 4.46Å; F307-L346 HydrophobicContact CE2-CD2 4.32Å
308	D	86.3	Confident	89.4	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.053	14%	0.138	C	C	.	.			trans	-157	135	-178.4	175.4	43.5	0	0	0	109.9	M305 Q318 R398	M305-D308 HydrophobicContact CB-CB 4.27Å; D308-Q318 PolarHBondContact O-NE2 2.9Å; D308-R398 WeakPolarHBondContact OD1-CD 3.41Å; D308-R398 IonicContact OD1-NH1 3.73Å; D308-R398 WeakPolarHBondContact OD2-CA 3.45Å; D308-R398 WeakPolarHBondContact OD2-CB 3.48Å; D308-R398 WeakPolarHBondContact OD2-CD 3.42Å; D308-R398 WeakPolarHBondContact OD2-CG 3.31Å; D308-R398 PolarHBondContact OD2-N 3.27Å
309	D	85.3	Confident	89.3	Confident	58 Å²	58	27.3 Å²	27.3	31%	0.31	14%	0.138	S	C	.	.			trans	-162.8	144.5	175.1	-152.6	-64.1	0	0	0	109.5	N311 A314 L315 Q318	D309-N311 PolarHBondContact O-N 3.12Å; D309-N311 WeakPolarHBondContact OD1-CB 3.25Å; D309-N311 PolarHBondContact OD1-N 3.19Å; D309-A314 HydrophobicContact CB-CB 4.18Å; D309-A314 VanDerWaalsContact CG-CB 3.46Å; D309-A314 VanDerWaalsContact OD2-CB 3.25Å; D309-A314 WeakPolarHBondContact OD2-CB 3.46Å; D309-L315 HydrophobicContact CB-CB 3.95Å; D309-Q318 PolarHBondContact OD2-NE2 3.03Å
310	E	82.5	Confident	89.3	Confident	153 Å²	153	27.4 Å²	27.4	72%	0.715	14%	0.138	S	C	*	.	S	Bend	trans	-63.7	-34.9	170.4	-81.8	179	-167.8	0	0	112	R398	E310-R398 IonicContact OE1-CZ 2.83Å; E310-R398 IonicContact OE1-NE 3.91Å; E310-R398 IonicContact OE1-NH2 3.89Å; E310-R398 PolarHBondContact OE1-NH2 3.12Å
311	N	85.9	Confident	89.3	Confident	84 Å²	84	33.2 Å²	33.2	45%	0.449	16%	0.16	S	C	.	.	S	Bend	trans	-90	111.9	178.9	-174.1	-58.6	0	0	0	109.6	D309 T313 A314 L315	D309-N311 PolarHBondContact O-N 3.12Å; D309-N311 WeakPolarHBondContact OD1-CB 3.25Å; D309-N311 PolarHBondContact OD1-N 3.19Å; N311-T313 PolarHBondContact O-N 3.41Å; N311-T313 WeakPolarHBondContact OD1-CA 3.48Å; N311-T313 VanDerWaalsContact OD1-CB 3.24Å; N311-T313 WeakPolarHBondContact OD1-CB 3.19Å; N311-T313 PolarHBondContact OD1-N 3.46Å; N311-A314 HydrophobicContact CB-CB 3.93Å; N311-A314 WeakPolarHBondContact O-CA 3.38Å; N311-A314 WeakPolarHBondContact O-CB 3.35Å; N311-A314 PolarHBondContact O-N 2.8Å; N311-A314 PolarHBondContact OD1-N 3.39Å; N311-A314 VanDerWaalsContact OD1-N 3.11Å; N311-L315 PolarHBondContact O-N 3.23Å
312	R	85.5	Confident	89.3	Confident	53 Å²	53	33.9 Å²	33.9	20%	0.2	17%	0.168	C	C	.	.	H	α-helix	trans	-54.3	-38.7	179.6	-69.8	179.9	63.3	130.9	-5.4	113.2	P271 A314 L315 Y316 E416	P271-R312 VanDerWaalsContact CG-CZ 3.47Å; R312-A314 VanDerWaalsContact C-N 3.33Å; R312-A314 PolarHBondContact O-N 3.39Å; R312-L315 WeakPolarHBondContact O-CB 3.28Å; R312-L315 PolarHBondContact O-N 3.01Å; R312-Y316 HydrophobicContact CB-CE2 4.12Å; R312-Y316 PolarHBondContact NH2-OH 2.7Å; R312-Y316 WeakPolarHBondContact O-CD2 3.36Å; R312-Y316 PolarHBondContact O-N 3.35Å; R312-E416 IonicContact CZ-OE1 3.58Å; R312-E416 IonicContact CZ-OE2 2.61Å; R312-E416 VanDerWaalsContact CZ-OE2 3.3Å; R312-E416 IonicContact NE-OE1 3.66Å; R312-E416 PolarHBondContact NE-OE1 2.93Å; R312-E416 IonicContact NE-OE2 3.46Å; R312-E416 IonicContact NH2-OE1 2.7Å; R312-E416 PolarHBondContact NH2-OE1 3.24Å; R312-E416 IonicContact NH2-OE2 2.75Å; R312-E416 PolarHBondContact NH2-OE2 3.27Å
313	T	87.4	Confident	89.2	Confident	41 Å²	41	39.7 Å²	39.7	25%	0.252	19%	0.192	S	C	.	.	H	α-helix	trans	-63.6	-40.9	175.6	-52.2	0	0	0	0	111.3	N311 Y316 R317 L420 D423	N311-T313 PolarHBondContact O-N 3.41Å; N311-T313 WeakPolarHBondContact OD1-CA 3.48Å; N311-T313 VanDerWaalsContact OD1-CB 3.24Å; N311-T313 WeakPolarHBondContact OD1-CB 3.19Å; N311-T313 PolarHBondContact OD1-N 3.46Å; T313-Y316 PolarHBondContact O-N 3.37Å; T313-R317 WeakPolarHBondContact O-CG 3.09Å; T313-R317 PolarHBondContact O-N 3Å; T313-L420 HydrophobicContact CG2-CD2 3.91Å; T313-D423 HydrophobicContact CG2-CB 4.32Å; T313-D423 WeakPolarHBondContact CG2-OD2 3.22Å
314	A	88	Confident	89.5	Confident	17 Å²	17	41.1 Å²	41.1	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-42.2	175.7	0	0	0	0	0	112.3	D309 N311 R312 Y316 R317 Q318	D309-A314 HydrophobicContact CB-CB 4.18Å; D309-A314 VanDerWaalsContact CG-CB 3.46Å; D309-A314 VanDerWaalsContact OD2-CB 3.25Å; D309-A314 WeakPolarHBondContact OD2-CB 3.46Å; N311-A314 HydrophobicContact CB-CB 3.93Å; N311-A314 WeakPolarHBondContact O-CA 3.38Å; N311-A314 WeakPolarHBondContact O-CB 3.35Å; N311-A314 PolarHBondContact O-N 2.8Å; N311-A314 PolarHBondContact OD1-N 3.39Å; N311-A314 VanDerWaalsContact OD1-N 3.11Å; R312-A314 VanDerWaalsContact C-N 3.33Å; R312-A314 PolarHBondContact O-N 3.39Å; A314-Y316 VanDerWaalsContact C-N 3.33Å; A314-Y316 PolarHBondContact O-N 3.01Å; A314-R317 WeakPolarHBondContact O-CB 3.39Å; A314-R317 PolarHBondContact O-N 3.02Å; A314-R317 VanDerWaalsContact O-N 3.13Å; A314-Q318 WeakPolarHBondContact O-CG 3.45Å; A314-Q318 PolarHBondContact O-N 3.13Å
315	L	89.9	Confident	89.7	Confident	4 Å²	4	45 Å²	45	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-53.5	-49.7	171.2	172.1	64.1	0	0	0	111	P271 E272 F307 D309 N311 R312 R317 Q318 I319	P271-L315 HydrophobicContact CB-CD2 4.23Å; E272-L315 HydrophobicContact CG-CD2 4.31Å; F307-L315 HydrophobicContact CB-CD1 3.71Å; D309-L315 HydrophobicContact CB-CB 3.95Å; N311-L315 PolarHBondContact O-N 3.23Å; R312-L315 WeakPolarHBondContact O-CB 3.28Å; R312-L315 PolarHBondContact O-N 3.01Å; L315-R317 VanDerWaalsContact C-N 3.32Å; L315-R317 PolarHBondContact O-N 3.29Å; L315-Q318 WeakPolarHBondContact O-CB 3.38Å; L315-Q318 PolarHBondContact O-N 3.4Å; L315-I319 HydrophobicContact CD1-CD1 3.99Å; L315-I319 HydrophobicContact CD1-CG1 4.37Å; L315-I319 HydrophobicContact CG-CD1 3.94Å; L315-I319 WeakPolarHBondContact O-CG1 3.3Å; L315-I319 PolarHBondContact O-N 2.99Å
316	Y	90.7	Very high	89.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-33.9	178.5	-63.7	-40.5	0	0	0	113.4	P271 I274 L279 R312 T313 A314 Q318 I319 L320 I412 E416 L420	P271-Y316 HydrophobicContact CB-CE1 4.03Å; I274-Y316 HydrophobicContact CG2-CD1 4.4Å; I274-Y316 HydrophobicContact CG2-CE1 4.09Å; L279-Y316 HydrophobicContact CD1-CD1 3.55Å; L279-Y316 HydrophobicContact CD1-CE1 4.36Å; L279-Y316 HydrophobicContact CD1-CG 4.02Å; L279-Y316 HydrophobicContact CD2-CD1 3.74Å; L279-Y316 HydrophobicContact CD2-CE1 3.85Å; L279-Y316 HydrophobicContact CD2-CG 4.18Å; L279-Y316 HydrophobicContact CG-CD1 4.31Å; R312-Y316 HydrophobicContact CB-CE2 4.12Å; R312-Y316 PolarHBondContact NH2-OH 2.7Å; R312-Y316 WeakPolarHBondContact O-CD2 3.36Å; R312-Y316 PolarHBondContact O-N 3.35Å; T313-Y316 PolarHBondContact O-N 3.37Å; A314-Y316 VanDerWaalsContact C-N 3.33Å; A314-Y316 PolarHBondContact O-N 3.01Å; Y316-Q318 VanDerWaalsContact C-N 3.34Å; Y316-I319 HydrophobicContact CD1-CD1 4.28Å; Y316-I319 PolarHBondContact O-N 3.41Å; Y316-L320 VanDerWaalsContact O-CB 3.32Å; Y316-L320 WeakPolarHBondContact O-CB 3.35Å; Y316-L320 VanDerWaalsContact O-CG 3.31Å; Y316-L320 WeakPolarHBondContact O-CG 3.23Å; Y316-L320 PolarHBondContact O-N 3.48Å; Y316-I412 HydrophobicContact CE1-CD1 4.46Å; Y316-E416 VanDerWaalsContact CE2-OE1 3.27Å; Y316-E416 WeakPolarHBondContact CE2-OE1 3.18Å; Y316-E416 PolarHBondContact OH-OE1 3.13Å; Y316-E416 VanDerWaalsContact OH-OE1 3.11Å; Y316-L420 HydrophobicContact CD2-CD1 3.19Å; Y316-L420 HydrophobicContact CD2-CD2 3.41Å; Y316-L420 VanDerWaalsContact CD2-CD2 3.41Å; Y316-L420 HydrophobicContact CD2-CG 3.86Å; Y316-L420 HydrophobicContact CE2-CD1 3.48Å; Y316-L420 VanDerWaalsContact CE2-CD1 3.48Å; Y316-L420 HydrophobicContact CE2-CD2 4.13Å; Y316-L420 HydrophobicContact CE2-CG 4.27Å; Y316-L420 HydrophobicContact CG-CD1 3.82Å; Y316-L420 HydrophobicContact CG-CD2 4.29Å
317	R	90	Very high	89.8	Confident	65 Å²	65	49.4 Å²	49.4	25%	0.245	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-39.2	171.1	-69.5	-176.6	-149.8	117.9	-3.9	111.7	T313 A314 L315 R321 D423 I426 I429	T313-R317 WeakPolarHBondContact O-CG 3.09Å; T313-R317 PolarHBondContact O-N 3Å; A314-R317 WeakPolarHBondContact O-CB 3.39Å; A314-R317 PolarHBondContact O-N 3.02Å; A314-R317 VanDerWaalsContact O-N 3.13Å; L315-R317 VanDerWaalsContact C-N 3.32Å; L315-R317 PolarHBondContact O-N 3.29Å; R317-R321 WeakPolarHBondContact O-CB 3.32Å; R317-R321 VanDerWaalsContact O-CG 3.25Å; R317-R321 WeakPolarHBondContact O-CG 3.32Å; R317-R321 PolarHBondContact O-N 3.23Å; R317-R321 VanDerWaalsContact O-N 3.13Å; R317-D423 IonicContact CZ-OD2 2.93Å; R317-D423 IonicContact NE-OD1 3.51Å; R317-D423 PolarHBondContact NE-OD1 3.42Å; R317-D423 IonicContact NE-OD2 3.7Å; R317-D423 IonicContact NH2-OD1 3.13Å; R317-D423 IonicContact NH2-OD2 3.57Å; R317-D423 PolarHBondContact NH2-OD2 3.35Å; R317-I426 HydrophobicContact CB-CD1 4.37Å; R317-I426 HydrophobicContact CG-CD1 3.46Å; R317-I426 VanDerWaalsContact CG-CD1 3.46Å; R317-I426 HydrophobicContact CG-CG1 4.1Å; R317-I429 HydrophobicContact CB-CD1 4.46Å; R317-I429 HydrophobicContact CG-CD1 4.41Å
318	Q	91.5	Very high	89.7	Confident	50 Å²	50	53.9 Å²	53.9	23%	0.234	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-47.3	175.8	-61.7	178.3	28.2	0	0	110.9	F307 D308 D309 A314 L315 Y316 R321 G322 K323	F307-Q318 HydrophobicContact CD1-CB 4.02Å; D308-Q318 PolarHBondContact O-NE2 2.9Å; D309-Q318 PolarHBondContact OD2-NE2 3.03Å; A314-Q318 WeakPolarHBondContact O-CG 3.45Å; A314-Q318 PolarHBondContact O-N 3.13Å; L315-Q318 WeakPolarHBondContact O-CB 3.38Å; L315-Q318 PolarHBondContact O-N 3.4Å; Y316-Q318 VanDerWaalsContact C-N 3.34Å; Q318-R321 PolarHBondContact O-N 3.49Å; Q318-G322 PolarHBondContact O-N 3.13Å; Q318-K323 PolarHBondContact O-N 2.79Å; Q318-K323 VanDerWaalsContact O-N 3.17Å
319	I	93.1	Very high	89.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-50.1	178.8	-68.2	170.9	0	0	0	111.2	P271 I274 P276 L279 W291 F307 L315 Y316 R321 G322	P271-I319 WeakPolarHBondContact O-CD1 3.47Å; I274-I319 HydrophobicContact CG2-CD1 4.06Å; P276-I319 HydrophobicContact CB-CG2 4.05Å; L279-I319 HydrophobicContact CD1-CB 4.32Å; L279-I319 HydrophobicContact CD1-CG2 3.88Å; W291-I319 HydrophobicContact CZ2-CG2 3.9Å; F307-I319 HydrophobicContact CB-CD1 4.5Å; F307-I319 HydrophobicContact CB-CG1 3.85Å; F307-I319 HydrophobicContact CD1-CG1 4.26Å; F307-I319 HydrophobicContact CD2-CG1 3.96Å; F307-I319 HydrophobicContact CG-CG1 3.75Å; L315-I319 HydrophobicContact CD1-CD1 3.99Å; L315-I319 HydrophobicContact CD1-CG1 4.37Å; L315-I319 HydrophobicContact CG-CD1 3.94Å; L315-I319 WeakPolarHBondContact O-CG1 3.3Å; L315-I319 PolarHBondContact O-N 2.99Å; Y316-I319 HydrophobicContact CD1-CD1 4.28Å; Y316-I319 PolarHBondContact O-N 3.41Å; I319-R321 PolarHBondContact O-N 3.14Å; I319-G322 PolarHBondContact O-N 3.28Å
320	L	92.4	Very high	89.9	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-27	179.1	-76.4	167.2	0	0	0	113.3	P276 L279 T280 Y316 I426 I429 L430 R433	P276-L320 HydrophobicContact CB-CD2 4.34Å; L279-L320 HydrophobicContact CB-CD1 4.48Å; L279-L320 HydrophobicContact CB-CD2 3.96Å; L279-L320 HydrophobicContact CB-CG 4.29Å; L279-L320 HydrophobicContact CD1-CG 4.13Å; T280-L320 HydrophobicContact CG2-CD2 3.94Å; Y316-L320 VanDerWaalsContact O-CB 3.32Å; Y316-L320 WeakPolarHBondContact O-CB 3.35Å; Y316-L320 VanDerWaalsContact O-CG 3.31Å; Y316-L320 WeakPolarHBondContact O-CG 3.23Å; Y316-L320 PolarHBondContact O-N 3.48Å; L320-I426 HydrophobicContact CD1-CD1 3.39Å; L320-I426 HydrophobicContact CD1-CG2 3.98Å; L320-I429 HydrophobicContact CB-CG2 3.99Å; L320-L430 HydrophobicContact CD2-CD2 4.14Å; L320-R433 PolarHBondContact O-NE 3.01Å; L320-R433 PolarHBondContact O-NH2 3.21Å
321	R	91.7	Very high	90.4	Very high	122 Å²	122	48 Å²	48	46%	0.46	23%	0.229	S	C	.	.	H	α-helix	trans	-82.9	-17.7	172.9	-72.3	174	177.2	161	1.9	112.5	R317 Q318 I319 K323 E425 I429	R317-R321 WeakPolarHBondContact O-CB 3.32Å; R317-R321 VanDerWaalsContact O-CG 3.25Å; R317-R321 WeakPolarHBondContact O-CG 3.32Å; R317-R321 PolarHBondContact O-N 3.23Å; R317-R321 VanDerWaalsContact O-N 3.13Å; Q318-R321 PolarHBondContact O-N 3.49Å; I319-R321 PolarHBondContact O-N 3.14Å; R321-K323 HydrophobicContact CB-CB 4.12Å; R321-K323 PolarHBondContact O-N 3.31Å; R321-E425 IonicContact NH2-OE2 2.82Å; R321-E425 PolarHBondContact NH2-OE2 2.77Å; R321-I429 HydrophobicContact CG-CD1 3.97Å; R321-I429 HydrophobicContact CG-CG1 4.31Å
322	G	92.6	Very high	90.6	Very high	17 Å²	17	48.4 Å²	48.4	18%	0.175	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	28.1	-169.9	0	0	0	0	0	112.6	Q318 I319 Y324	Q318-G322 PolarHBondContact O-N 3.13Å; I319-G322 PolarHBondContact O-N 3.28Å; G322-Y324 WeakPolarHBondContact O-CD1 3.44Å; G322-Y324 PolarHBondContact O-N 2.97Å
323	K	88.3	Confident	90.7	Very high	129 Å²	129	48.7 Å²	48.7	56%	0.561	26%	0.257	S	S	*	.			trans	-92.7	100.3	-174.6	-172.7	-178.2	-178.4	-178.2	0	110.1	Q318 R321	Q318-K323 PolarHBondContact O-N 2.79Å; Q318-K323 VanDerWaalsContact O-N 3.17Å; R321-K323 HydrophobicContact CB-CB 4.12Å; R321-K323 PolarHBondContact O-N 3.31Å
324	Y	93.5	Very high	91	Very high	39 Å²	39	47.3 Å²	47.3	15%	0.153	25%	0.248	C	C	.	.			trans	-131.3	164.5	169.8	63.9	-81.5	0	0	0	109.1	Y298 P306 F307 G322 F326 S343 L346	Y298-Y324 HydrophobicContact CD2-CD2 4.14Å; Y298-Y324 HydrophobicContact CD2-CE2 4.43Å; Y298-Y324 AromaticContact CE2-CD2 3.83Å; Y298-Y324 HydrophobicContact CE2-CD2 3.83Å; Y298-Y324 HydrophobicContact CE2-CE2 4.4Å; P306-Y324 HydrophobicContact CB-CD2 4.49Å; P306-Y324 HydrophobicContact CB-CG 4.27Å; P306-Y324 VanDerWaalsContact O-CB 3.23Å; P306-Y324 WeakPolarHBondContact O-CB 3.47Å; F307-Y324 AromaticContact CE1-CD1 3.91Å; F307-Y324 HydrophobicContact CE1-CD1 3.91Å; F307-Y324 HydrophobicContact CE1-CG 4.32Å; F307-Y324 AromaticContact CZ-CD1 3.66Å; F307-Y324 HydrophobicContact CZ-CD1 3.66Å; F307-Y324 HydrophobicContact CZ-CG 4.25Å; G322-Y324 WeakPolarHBondContact O-CD1 3.44Å; G322-Y324 PolarHBondContact O-N 2.97Å; Y324-F326 HydrophobicContact CE2-CE1 4.08Å; Y324-F326 AromaticContact CE2-CE2 3.84Å; Y324-F326 HydrophobicContact CE2-CE2 3.84Å; Y324-F326 AromaticContact CE2-CZ 3.59Å; Y324-F326 HydrophobicContact CE2-CZ 3.59Å; Y324-S343 VanDerWaalsContact OH-CA 3.24Å; Y324-S343 WeakPolarHBondContact OH-CA 3.26Å; Y324-S343 PolarHBondContact OH-OG 3.41Å; Y324-L346 HydrophobicContact CD1-CD1 4.17Å; Y324-L346 HydrophobicContact CD2-CD1 4.29Å; Y324-L346 HydrophobicContact CE1-CB 3.75Å; Y324-L346 HydrophobicContact CE1-CD1 3.93Å; Y324-L346 HydrophobicContact CE2-CD1 4.05Å; Y324-L346 HydrophobicContact CG-CD1 4.36Å
325	H	93.5	Very high	91.3	Very high	87 Å²	87	48 Å²	48	40%	0.403	25%	0.252	S	S	.	.			trans	-126.6	144.1	-178.2	-55.1	92.8	0	0	0	111.3	Y298 Y327	Y298-H325 PolarHBondContact OH-O 3.38Å; H325-Y327 VanDerWaalsContact C-N 3.32Å; H325-Y327 HydrophobicContact CB-CD1 4.44Å; H325-Y327 HydrophobicContact CB-CD2 4.15Å; H325-Y327 HydrophobicContact CB-CE1 4.17Å; H325-Y327 HydrophobicContact CB-CE2 3.87Å; H325-Y327 HydrophobicContact CB-CG 4.41Å; H325-Y327 WeakPolarHBondContact O-CD2 3.49Å; H325-Y327 PolarHBondContact O-N 3Å
326	F	93.8	Very high	91.6	Very high	58 Å²	58	52.4 Å²	52.4	25%	0.254	28%	0.276	S	S	.	.			trans	-87.6	77.2	165.9	-62.9	-68.4	0	0	0	108.9	Y298 Y324 P328 W331 K339 V342 S343	Y298-F326 HydrophobicContact CD2-CE1 4.13Å; Y298-F326 HydrophobicContact CE2-CD1 4.02Å; Y298-F326 HydrophobicContact CE2-CE1 4.07Å; Y324-F326 HydrophobicContact CE2-CE1 4.08Å; Y324-F326 AromaticContact CE2-CE2 3.84Å; Y324-F326 HydrophobicContact CE2-CE2 3.84Å; Y324-F326 AromaticContact CE2-CZ 3.59Å; Y324-F326 HydrophobicContact CE2-CZ 3.59Å; F326-P328 WeakPolarHBondContact O-CD 3.46Å; F326-W331 HydrophobicContact CB-CB 4.27Å; F326-W331 HydrophobicContact CB-CD2 4.37Å; F326-W331 HydrophobicContact CB-CG 4.03Å; F326-W331 AromaticContact CD1-CD2 3.54Å; F326-W331 HydrophobicContact CD1-CD2 3.54Å; F326-W331 AromaticContact CD1-CE2 3.55Å; F326-W331 AromaticContact CD1-CE3 3.72Å; F326-W331 HydrophobicContact CD1-CE3 3.72Å; F326-W331 HydrophobicContact CD1-CG 4.08Å; F326-W331 HydrophobicContact CD1-CH2 4.02Å; F326-W331 AromaticContact CD1-CZ2 3.83Å; F326-W331 HydrophobicContact CD1-CZ2 3.83Å; F326-W331 AromaticContact CD1-CZ3 3.95Å; F326-W331 HydrophobicContact CD1-CZ3 3.95Å; F326-W331 HydrophobicContact CE1-CD2 4.31Å; F326-W331 HydrophobicContact CE1-CE3 4.16Å; F326-W331 AromaticContact CE1-CH2 3.82Å; F326-W331 HydrophobicContact CE1-CH2 3.82Å; F326-W331 AromaticContact CE1-CZ2 3.95Å; F326-W331 HydrophobicContact CE1-CZ2 3.95Å; F326-W331 AromaticContact CE1-CZ3 3.9Å; F326-W331 HydrophobicContact CE1-CZ3 3.9Å; F326-W331 HydrophobicContact CG-CD2 4.41Å; F326-K339 HydrophobicContact CD1-CG 4.09Å; F326-K339 HydrophobicContact CD2-CB 4.5Å; F326-K339 HydrophobicContact CE1-CB 4.17Å; F326-K339 HydrophobicContact CE1-CG 4.14Å; F326-K339 HydrophobicContact CE2-CB 4.14Å; F326-K339 HydrophobicContact CG-CD 4.37Å; F326-K339 HydrophobicContact CG-CG 4.29Å; F326-K339 HydrophobicContact CZ-CB 3.95Å; F326-K339 HydrophobicContact CZ-CG 4.39Å; F326-K339 WeakPolarHBondContact CZ-O 3.38Å; F326-V342 HydrophobicContact CE1-CB 4.4Å; F326-V342 HydrophobicContact CE1-CG1 4.19Å; F326-V342 HydrophobicContact CZ-CB 4.39Å; F326-V342 HydrophobicContact CZ-CG1 4.28Å; F326-S343 WeakPolarHBondContact CE2-OG 3.31Å; F326-S343 WeakPolarHBondContact CZ-OG 3.42Å
327	Y	90.6	Very high	91.8	Very high	48 Å²	48	56.7 Å²	56.7	19%	0.188	30%	0.296	C	S	.	.			trans	-52.7	116.9	179.4	-71.6	-73.8	0	0	0	111.4	I304 H325 E329 F330 W331 S396 S397	I304-Y327 HydrophobicContact CD1-CD2 3.81Å; I304-Y327 HydrophobicContact CD1-CE2 4.43Å; H325-Y327 VanDerWaalsContact C-N 3.32Å; H325-Y327 HydrophobicContact CB-CD1 4.44Å; H325-Y327 HydrophobicContact CB-CD2 4.15Å; H325-Y327 HydrophobicContact CB-CE1 4.17Å; H325-Y327 HydrophobicContact CB-CE2 3.87Å; H325-Y327 HydrophobicContact CB-CG 4.41Å; H325-Y327 WeakPolarHBondContact O-CD2 3.49Å; H325-Y327 PolarHBondContact O-N 3Å; Y327-E329 WeakPolarHBondContact CB-OE2 3.43Å; Y327-E329 PolarHBondContact O-N 3.07Å; Y327-E329 VanDerWaalsContact O-N 3.09Å; Y327-F330 PolarHBondContact O-N 2.92Å; Y327-W331 PolarHBondContact O-N 3.13Å; Y327-S396 PolarHBondContact OH-OG 2.93Å; Y327-S397 WeakPolarHBondContact CE2-OG 3.5Å
328	P	90.4	Very high	92.1	Very high	94 Å²	94	53.6 Å²	53.6	61%	0.61	28%	0.284	S	S	*	.	H	α-helix	trans	-53.7	-32.9	-174.9	-29.2	36.1	0	0	0	113.9	F326 F330 W331 C332	F326-P328 WeakPolarHBondContact O-CD 3.46Å; P328-F330 PolarHBondContact O-N 3.46Å; P328-W331 PolarHBondContact O-N 3.05Å; P328-C332 WeakPolarHBondContact O-CB 3.4Å; P328-C332 PolarHBondContact O-N 2.84Å
329	E	89	Confident	92.4	Very high	63 Å²	63	53.3 Å²	53.3	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-21.2	177.7	66.2	-90.2	-147.9	0	0	114.3	Y327 Y385	Y327-E329 WeakPolarHBondContact CB-OE2 3.43Å; Y327-E329 PolarHBondContact O-N 3.07Å; Y327-E329 VanDerWaalsContact O-N 3.09Å; E329-Y385 HydrophobicContact CB-CE1 4.29Å
330	F	88.3	Confident	92.6	Very high	31 Å²	31	58.7 Å²	58.7	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-110.7	-23.9	176.6	-58.4	-73.4	0	0	0	112.8	I304 Y327 P328 V389	I304-F330 HydrophobicContact CD1-CD2 3.5Å; I304-F330 HydrophobicContact CD1-CE2 3.83Å; I304-F330 HydrophobicContact CD1-CG 4.08Å; I304-F330 HydrophobicContact CG1-CD2 4.13Å; I304-F330 HydrophobicContact CG1-CE2 4.49Å; I304-F330 HydrophobicContact CG1-CG 4.23Å; I304-F330 HydrophobicContact CG2-CD1 4.34Å; I304-F330 HydrophobicContact CG2-CE1 3.95Å; I304-F330 HydrophobicContact CG2-CE2 4.22Å; I304-F330 HydrophobicContact CG2-CZ 3.9Å; Y327-F330 PolarHBondContact O-N 2.92Å; P328-F330 PolarHBondContact O-N 3.46Å; F330-V389 HydrophobicContact CD1-CG2 4.43Å; F330-V389 HydrophobicContact CE1-CB 4.34Å; F330-V389 HydrophobicContact CE1-CG1 3.77Å; F330-V389 HydrophobicContact CE1-CG2 3.51Å; F330-V389 HydrophobicContact CZ-CG1 3.86Å; F330-V389 HydrophobicContact CZ-CG2 3.98Å
331	W	91.8	Very high	92.9	Very high	3 Å²	3	58.6 Å²	58.6	1%	0.011	31%	0.307	C	S	.	.	H	α-helix	trans	-113.8	2.1	-170.2	-70.5	87.5	0	0	0	114.9	Y298 L301 S302 F326 Y327 P328 G333 V334 K339 V342	Y298-W331 HydrophobicContact CD1-CZ2 4.23Å; Y298-W331 HydrophobicContact CD2-CH2 4.17Å; Y298-W331 AromaticContact CD2-CZ2 3.48Å; Y298-W331 HydrophobicContact CD2-CZ2 3.48Å; Y298-W331 VanDerWaalsContact CD2-CZ2 3.48Å; Y298-W331 HydrophobicContact CE1-CZ2 4.32Å; Y298-W331 AromaticContact CE2-CE2 3.89Å; Y298-W331 AromaticContact CE2-CZ2 3.56Å; Y298-W331 HydrophobicContact CE2-CZ2 3.56Å; Y298-W331 AromaticContact CE2-NE1 3.81Å; Y298-W331 AromaticContact CG-CZ2 3.81Å; Y298-W331 HydrophobicContact CG-CZ2 3.81Å; Y298-W331 AromaticContact CZ-CZ2 3.99Å; Y298-W331 AromaticContact CZ-NE1 3.61Å; L301-W331 HydrophobicContact CB-CH2 3.71Å; L301-W331 HydrophobicContact CB-CZ2 4.36Å; L301-W331 HydrophobicContact CB-CZ3 3.97Å; L301-W331 HydrophobicContact CD1-CH2 4.06Å; L301-W331 HydrophobicContact CD1-CZ3 4.05Å; S302-W331 VanDerWaalsContact CB-NE1 3.3Å; F326-W331 HydrophobicContact CB-CB 4.27Å; F326-W331 HydrophobicContact CB-CD2 4.37Å; F326-W331 HydrophobicContact CB-CG 4.03Å; F326-W331 AromaticContact CD1-CD2 3.54Å; F326-W331 HydrophobicContact CD1-CD2 3.54Å; F326-W331 AromaticContact CD1-CE2 3.55Å; F326-W331 AromaticContact CD1-CE3 3.72Å; F326-W331 HydrophobicContact CD1-CE3 3.72Å; F326-W331 HydrophobicContact CD1-CG 4.08Å; F326-W331 HydrophobicContact CD1-CH2 4.02Å; F326-W331 AromaticContact CD1-CZ2 3.83Å; F326-W331 HydrophobicContact CD1-CZ2 3.83Å; F326-W331 AromaticContact CD1-CZ3 3.95Å; F326-W331 HydrophobicContact CD1-CZ3 3.95Å; F326-W331 HydrophobicContact CE1-CD2 4.31Å; F326-W331 HydrophobicContact CE1-CE3 4.16Å; F326-W331 AromaticContact CE1-CH2 3.82Å; F326-W331 HydrophobicContact CE1-CH2 3.82Å; F326-W331 AromaticContact CE1-CZ2 3.95Å; F326-W331 HydrophobicContact CE1-CZ2 3.95Å; F326-W331 AromaticContact CE1-CZ3 3.9Å; F326-W331 HydrophobicContact CE1-CZ3 3.9Å; F326-W331 HydrophobicContact CG-CD2 4.41Å; Y327-W331 PolarHBondContact O-N 3.13Å; P328-W331 PolarHBondContact O-N 3.05Å; W331-G333 PolarHBondContact O-N 3.41Å; W331-V334 HydrophobicContact CE3-CB 3.73Å; W331-V334 HydrophobicContact CE3-CG1 3.61Å; W331-V334 HydrophobicContact CE3-CG2 4.05Å; W331-V334 HydrophobicContact CZ3-CB 4.27Å; W331-V334 HydrophobicContact CZ3-CG1 3.64Å; W331-V334 PolarHBondContact O-N 3.43Å; W331-V334 VanDerWaalsContact O-N 3.16Å; W331-K339 HydrophobicContact CE3-CG 3.79Å; W331-K339 HydrophobicContact CZ3-CG 4.05Å; W331-V342 HydrophobicContact CH2-CG2 4.25Å
332	C	89.6	Confident	93.2	Very high	93 Å²	93	52.8 Å²	52.8	63%	0.628	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.6	-177.6	63.3	0	0	0	0	114.5	P328	P328-C332 WeakPolarHBondContact O-CB 3.4Å; P328-C332 PolarHBondContact O-N 2.84Å
333	G	88.8	Confident	93.5	Very high	60 Å²	60	54.2 Å²	54.2	62%	0.619	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	3.7	179.7	0	0	0	0	0	114.7	W331	W331-G333 PolarHBondContact O-N 3.41Å
334	V	92.8	Very high	93.9	Very high	11 Å²	11	49.7 Å²	49.7	7%	0.067	28%	0.277	C	S	.	.	S	Bend	trans	-100.6	131.1	-177	-178.8	0	0	0	0	109.5	E202 L301 W331 A338 K339	E202-V334 WeakPolarHBondContact OE1-CA 3.37Å; L301-V334 HydrophobicContact CD1-CG1 4.38Å; W331-V334 HydrophobicContact CE3-CB 3.73Å; W331-V334 HydrophobicContact CE3-CG1 3.61Å; W331-V334 HydrophobicContact CE3-CG2 4.05Å; W331-V334 HydrophobicContact CZ3-CB 4.27Å; W331-V334 HydrophobicContact CZ3-CG1 3.64Å; W331-V334 PolarHBondContact O-N 3.43Å; W331-V334 VanDerWaalsContact O-N 3.16Å; V334-A338 HydrophobicContact CG1-CB 3.59Å; V334-K339 WeakPolarHBondContact O-CE 3.34Å; V334-K339 PolarHBondContact O-NZ 3.3Å
335	S	95.2	Very high	94.2	Very high	32 Å²	32	47.9 Å²	47.9	22%	0.224	27%	0.269	C	S	.	.			trans	-58	152.3	-178.4	66.7	0	0	0	0	112.5	E202 E337 A338 K339	E202-S335 VanDerWaalsContact CD-OG 3.28Å; E202-S335 VanDerWaalsContact OE1-CB 3.3Å; E202-S335 WeakPolarHBondContact OE1-CB 3.48Å; E202-S335 PolarHBondContact OE1-N 3.21Å; E202-S335 PolarHBondContact OE1-OG 2.92Å; E202-S335 VanDerWaalsContact OE1-OG 3.06Å; E202-S335 PolarHBondContact OE2-OG 3.33Å; S335-E337 PolarHBondContact O-N 2.97Å; S335-A338 PolarHBondContact O-N 3.41Å; S335-A338 PolarHBondContact OG-N 3.2Å; S335-K339 PolarHBondContact O-N 3.35Å
336	D	95.5	Very high	94.4	Very high	96 Å²	96	44 Å²	44	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-69.4	-28.3	177	-68.7	-28.7	0	0	0	111.1	A338 K339 Q340	D336-A338 VanDerWaalsContact C-N 3.32Å; D336-A338 PolarHBondContact O-N 3.45Å; D336-K339 PolarHBondContact O-N 3.15Å; D336-K339 IonicContact OD1-NZ 3.3Å; D336-K339 PolarHBondContact OD1-NZ 3.43Å; D336-Q340 WeakPolarHBondContact O-CB 3.24Å; D336-Q340 WeakPolarHBondContact O-CG 3.33Å; D336-Q340 PolarHBondContact O-N 3.11Å
337	E	96.1	Very high	94.5	Very high	90 Å²	90	42.8 Å²	42.8	42%	0.421	25%	0.25	S	S	.	.	H	α-helix	trans	-60.4	-40	170.8	-68.1	76.3	-171.1	0	0	112	S335 F341 H362 W364	S335-E337 PolarHBondContact O-N 2.97Å; E337-F341 WeakPolarHBondContact O-CB 3.46Å; E337-F341 PolarHBondContact O-N 3.35Å; E337-H362 PolarHBondContact O-CE1 3.42Å; E337-W364 HydrophobicContact CB-CB 4.11Å
338	A	96.2	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-40.8	176.1	0	0	0	0	0	111.5	L301 V334 S335 D336 F341 V342 W364	L301-A338 HydrophobicContact CD1-CB 3.9Å; V334-A338 HydrophobicContact CG1-CB 3.59Å; S335-A338 PolarHBondContact O-N 3.41Å; S335-A338 PolarHBondContact OG-N 3.2Å; D336-A338 VanDerWaalsContact C-N 3.32Å; D336-A338 PolarHBondContact O-N 3.45Å; A338-F341 WeakPolarHBondContact O-CB 3.34Å; A338-F341 PolarHBondContact O-N 3.05Å; A338-V342 WeakPolarHBondContact O-CG2 3.4Å; A338-V342 PolarHBondContact O-N 2.95Å; A338-W364 HydrophobicContact CB-CD2 4.11Å; A338-W364 HydrophobicContact CB-CG 4.05Å; A338-W364 HydrophobicContact CB-CZ2 4.29Å
339	K	97.4	Very high	94.8	Very high	45 Å²	45	39.8 Å²	39.8	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-41.7	175.6	-64.2	173.4	-159.4	147.4	0	111.4	F326 W331 V334 S335 D336 V342 S343	F326-K339 HydrophobicContact CD1-CG 4.09Å; F326-K339 HydrophobicContact CD2-CB 4.5Å; F326-K339 HydrophobicContact CE1-CB 4.17Å; F326-K339 HydrophobicContact CE1-CG 4.14Å; F326-K339 HydrophobicContact CE2-CB 4.14Å; F326-K339 HydrophobicContact CG-CD 4.37Å; F326-K339 HydrophobicContact CG-CG 4.29Å; F326-K339 HydrophobicContact CZ-CB 3.95Å; F326-K339 HydrophobicContact CZ-CG 4.39Å; F326-K339 WeakPolarHBondContact CZ-O 3.38Å; W331-K339 HydrophobicContact CE3-CG 3.79Å; W331-K339 HydrophobicContact CZ3-CG 4.05Å; V334-K339 WeakPolarHBondContact O-CE 3.34Å; V334-K339 PolarHBondContact O-NZ 3.3Å; S335-K339 PolarHBondContact O-N 3.35Å; D336-K339 PolarHBondContact O-N 3.15Å; D336-K339 IonicContact OD1-NZ 3.3Å; D336-K339 PolarHBondContact OD1-NZ 3.43Å; K339-V342 PolarHBondContact O-N 3.41Å; K339-S343 WeakPolarHBondContact O-CB 3.44Å; K339-S343 PolarHBondContact O-N 3.18Å; K339-S343 PolarHBondContact O-OG 3Å
340	Q	97.6	Very high	95.1	Very high	113 Å²	113	37.5 Å²	37.5	53%	0.528	23%	0.225	S	C	.	.	H	α-helix	trans	-62.9	-42.9	174.6	-74	171.5	30.6	0	0	111.4	D336 S343 S344	D336-Q340 WeakPolarHBondContact O-CB 3.24Å; D336-Q340 WeakPolarHBondContact O-CG 3.33Å; D336-Q340 PolarHBondContact O-N 3.11Å; Q340-S343 PolarHBondContact O-N 3.44Å; Q340-S344 PolarHBondContact O-N 2.62Å
341	F	98.3	Very high	95.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.7	-53	175.2	174.9	-102.1	0	0	0	111.4	V209 L213 A297 E337 A338 S343 S344 L345 H362 W364 L365	V209-F341 HydrophobicContact CG1-CE1 3.66Å; V209-F341 HydrophobicContact CG1-CZ 3.54Å; L213-F341 HydrophobicContact CD1-CE2 4.24Å; L213-F341 HydrophobicContact CD1-CZ 3.9Å; A297-F341 HydrophobicContact CB-CE1 4.07Å; E337-F341 WeakPolarHBondContact O-CB 3.46Å; E337-F341 PolarHBondContact O-N 3.35Å; A338-F341 WeakPolarHBondContact O-CB 3.34Å; A338-F341 PolarHBondContact O-N 3.05Å; F341-S343 VanDerWaalsContact C-N 3.28Å; F341-S343 PolarHBondContact O-N 2.87Å; F341-S344 PolarHBondContact O-N 3.36Å; F341-S344 PolarHBondContact O-OG 3.05Å; F341-L345 HydrophobicContact CD1-CD1 3.97Å; F341-L345 HydrophobicContact CE1-CD1 3.35Å; F341-L345 HydrophobicContact CE1-CG 4.49Å; F341-L345 HydrophobicContact CE2-CD1 4.08Å; F341-L345 HydrophobicContact CZ-CD1 3.45Å; F341-L345 VanDerWaalsContact CZ-CD1 3.45Å; F341-L345 HydrophobicContact CZ-CG 4.37Å; F341-L345 PolarHBondContact O-N 3.48Å; F341-H362 HydrophobicContact CD2-CB 3.68Å; F341-H362 AromaticContact CD2-CG 3.58Å; F341-H362 AromaticContact CD2-ND1 3.73Å; F341-H362 HydrophobicContact CE2-CB 4.16Å; F341-W364 HydrophobicContact CB-CB 4.11Å; F341-W364 HydrophobicContact CB-CD2 4.38Å; F341-W364 HydrophobicContact CB-CE3 4.04Å; F341-W364 HydrophobicContact CB-CG 4.42Å; F341-W364 HydrophobicContact CD1-CD2 4.37Å; F341-W364 AromaticContact CD1-CE3 3.36Å; F341-W364 HydrophobicContact CD1-CE3 3.36Å; F341-W364 AromaticContact CD1-CZ3 3.51Å; F341-W364 HydrophobicContact CD1-CZ3 3.51Å; F341-W364 HydrophobicContact CD2-CE3 4.16Å; F341-W364 AromaticContact CE1-CE3 3.76Å; F341-W364 HydrophobicContact CE1-CE3 3.76Å; F341-W364 AromaticContact CE1-CZ3 3.54Å; F341-W364 HydrophobicContact CE1-CZ3 3.54Å; F341-W364 HydrophobicContact CE2-CE3 4.46Å; F341-W364 HydrophobicContact CG-CD2 4.38Å; F341-W364 AromaticContact CG-CE3 3.57Å; F341-W364 HydrophobicContact CG-CE3 3.57Å; F341-W364 HydrophobicContact CG-CZ3 4.2Å; F341-W364 HydrophobicContact CZ-CE3 4.26Å; F341-W364 HydrophobicContact CZ-CZ3 4.21Å; F341-L365 HydrophobicContact CE2-CD1 3.69Å; F341-L365 HydrophobicContact CE2-CG 4.07Å; F341-L365 HydrophobicContact CZ-CD1 3.87Å; F341-L365 HydrophobicContact CZ-CG 4.31Å
342	V	98.2	Very high	95.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-41.7	177.5	172.6	0	0	0	0	110.9	A297 Y298 L301 F326 W331 A338 K339 S344 L345 L346	A297-V342 HydrophobicContact CB-CG2 4.01Å; Y298-V342 HydrophobicContact CD2-CG1 3.97Å; Y298-V342 HydrophobicContact CG-CG1 4.47Å; L301-V342 HydrophobicContact CD1-CG2 4.26Å; F326-V342 HydrophobicContact CE1-CB 4.4Å; F326-V342 HydrophobicContact CE1-CG1 4.19Å; F326-V342 HydrophobicContact CZ-CB 4.39Å; F326-V342 HydrophobicContact CZ-CG1 4.28Å; W331-V342 HydrophobicContact CH2-CG2 4.25Å; A338-V342 WeakPolarHBondContact O-CG2 3.4Å; A338-V342 PolarHBondContact O-N 2.95Å; K339-V342 PolarHBondContact O-N 3.41Å; V342-S344 VanDerWaalsContact C-N 3.34Å; V342-S344 PolarHBondContact O-N 2.99Å; V342-L345 PolarHBondContact O-N 3.36Å; V342-L346 HydrophobicContact CG1-CD1 3.79Å; V342-L346 HydrophobicContact CG1-CG 4.26Å; V342-L346 WeakPolarHBondContact O-CB 3.4Å; V342-L346 PolarHBondContact O-N 3.38Å
343	S	98.2	Very high	95.8	Very high	46 Å²	46	44 Å²	44	32%	0.322	25%	0.25	S	S	.	.	H	α-helix	trans	-64	-36.9	178.6	-56.3	0	0	0	0	113.4	Y324 F326 K339 Q340 F341 L345 C347	Y324-S343 VanDerWaalsContact OH-CA 3.24Å; Y324-S343 WeakPolarHBondContact OH-CA 3.26Å; Y324-S343 PolarHBondContact OH-OG 3.41Å; F326-S343 WeakPolarHBondContact CE2-OG 3.31Å; F326-S343 WeakPolarHBondContact CZ-OG 3.42Å; K339-S343 WeakPolarHBondContact O-CB 3.44Å; K339-S343 PolarHBondContact O-N 3.18Å; K339-S343 PolarHBondContact O-OG 3Å; Q340-S343 PolarHBondContact O-N 3.44Å; F341-S343 VanDerWaalsContact C-N 3.28Å; F341-S343 PolarHBondContact O-N 2.87Å; S343-L345 VanDerWaalsContact C-N 3.31Å; S343-L345 PolarHBondContact O-N 2.96Å; S343-C347 PolarHBondContact O-N 3.43Å
344	S	98	Very high	96.3	Very high	35 Å²	35	42 Å²	42	25%	0.245	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-36.7	176.1	78.1	0	0	0	0	112.2	Q340 F341 V342 C347 P354	Q340-S344 PolarHBondContact O-N 2.62Å; F341-S344 PolarHBondContact O-N 3.36Å; F341-S344 PolarHBondContact O-OG 3.05Å; V342-S344 VanDerWaalsContact C-N 3.34Å; V342-S344 PolarHBondContact O-N 2.99Å; S344-C347 WeakPolarHBondContact O-CB 3.3Å; S344-P354 WeakPolarHBondContact O-CD 3.07Å
345	L	98.5	Very high	96.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-77.9	-40.5	179.7	-64	170.9	0	0	0	112.2	I290 V293 F341 V342 S343 C347 R353 P354 S359	I290-L345 HydrophobicContact CG2-CD2 3.23Å; I290-L345 HydrophobicContact CG2-CG 4.49Å; V293-L345 HydrophobicContact CG1-CD1 4.22Å; F341-L345 HydrophobicContact CD1-CD1 3.97Å; F341-L345 HydrophobicContact CE1-CD1 3.35Å; F341-L345 HydrophobicContact CE1-CG 4.49Å; F341-L345 HydrophobicContact CE2-CD1 4.08Å; F341-L345 HydrophobicContact CZ-CD1 3.45Å; F341-L345 VanDerWaalsContact CZ-CD1 3.45Å; F341-L345 HydrophobicContact CZ-CG 4.37Å; F341-L345 PolarHBondContact O-N 3.48Å; V342-L345 PolarHBondContact O-N 3.36Å; S343-L345 VanDerWaalsContact C-N 3.31Å; S343-L345 PolarHBondContact O-N 2.96Å; L345-C347 PolarHBondContact O-N 3Å; L345-C347 VanDerWaalsContact O-N 3.1Å; L345-R353 VanDerWaalsContact O-CD 3.25Å; L345-R353 WeakPolarHBondContact O-CD 3.23Å; L345-R353 WeakPolarHBondContact O-CG 3.31Å; L345-R353 PolarHBondContact O-NE 2.82Å; L345-P354 HydrophobicContact CD2-CG 4.19Å; L345-S359 WeakPolarHBondContact CD2-OG 3.29Å
346	L	98.1	Very high	96.7	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	31.5	175.4	-62.7	-176.3	0	0	0	112.5	W291 V295 P306 F307 Y324 V342	W291-L346 HydrophobicContact CD2-CD2 4.01Å; W291-L346 HydrophobicContact CE3-CD2 4.13Å; W291-L346 HydrophobicContact CH2-CD2 4.44Å; W291-L346 HydrophobicContact CZ2-CD2 4.32Å; W291-L346 HydrophobicContact CZ3-CB 4.3Å; W291-L346 HydrophobicContact CZ3-CD2 4.35Å; W291-L346 WeakPolarHBondContact CZ3-O 3.45Å; V295-L346 HydrophobicContact CG2-CD2 3.8Å; P306-L346 HydrophobicContact CB-CD1 4.12Å; P306-L346 HydrophobicContact CG-CD1 4.35Å; F307-L346 HydrophobicContact CE2-CD1 4.46Å; F307-L346 HydrophobicContact CE2-CD2 4.32Å; Y324-L346 HydrophobicContact CD1-CD1 4.17Å; Y324-L346 HydrophobicContact CD2-CD1 4.29Å; Y324-L346 HydrophobicContact CE1-CB 3.75Å; Y324-L346 HydrophobicContact CE1-CD1 3.93Å; Y324-L346 HydrophobicContact CE2-CD1 4.05Å; Y324-L346 HydrophobicContact CG-CD1 4.36Å; V342-L346 HydrophobicContact CG1-CD1 3.79Å; V342-L346 HydrophobicContact CG1-CG 4.26Å; V342-L346 WeakPolarHBondContact O-CB 3.4Å; V342-L346 PolarHBondContact O-N 3.38Å
347	C	96.4	Very high	96.8	Very high	34 Å²	34	40.1 Å²	40.1	23%	0.23	22%	0.215	C	C	.	.			trans	-76	123.7	171	-170.2	0	0	0	0	109.5	S343 S344 L345 D349 R353	S343-C347 PolarHBondContact O-N 3.43Å; S344-C347 WeakPolarHBondContact O-CB 3.3Å; L345-C347 PolarHBondContact O-N 3Å; L345-C347 VanDerWaalsContact O-N 3.1Å; C347-D349 VanDerWaalsContact C-N 3.33Å; C347-R353 HydrophobicContact CB-CB 4.21Å; C347-R353 HydrophobicContact CB-CG 4.45Å; C347-R353 VanDerWaalsContact O-CZ 3.3Å; C347-R353 PolarHBondContact O-NE 3.42Å; C347-R353 PolarHBondContact O-NH2 3.23Å
348	V	94.5	Very high	96.9	Very high	25 Å²	25	40.5 Å²	40.5	15%	0.152	22%	0.218	C	C	.	.	S	Bend	trans	-69	-35.4	-178.7	-174.1	0	0	0	0	111.8	P276 W291 A350	P276-V348 HydrophobicContact CB-CG1 3.73Å; P276-V348 HydrophobicContact CG-CB 4.29Å; P276-V348 HydrophobicContact CG-CG1 3.59Å; W291-V348 HydrophobicContact CZ3-CG2 4.35Å; V348-A350 PolarHBondContact O-N 2.69Å
349	D	92.9	Very high	97	Very high	54 Å²	54	40.6 Å²	40.6	29%	0.289	22%	0.219	S	C	.	.	S	Bend	trans	-74	111.3	172.8	-170.6	-20.2	0	0	0	109.5	C347 E351 L352 R353	C347-D349 VanDerWaalsContact C-N 3.33Å; D349-E351 PolarHBondContact O-N 2.79Å; D349-E351 WeakPolarHBondContact OD1-CB 3.47Å; D349-E351 PolarHBondContact OD1-N 2.7Å; D349-L352 HydrophobicContact CB-CB 4.19Å; D349-L352 HydrophobicContact CB-CD1 4.03Å; D349-L352 HydrophobicContact CB-CG 4.09Å; D349-L352 PolarHBondContact O-N 3.11Å; D349-R353 PolarHBondContact O-N 3.42Å
350	A	94.2	Very high	97	Very high	14 Å²	14	39.8 Å²	39.8	12%	0.116	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26	-177.4	0	0	0	0	0	112.9	E277 K287 V348	E277-A350 HydrophobicContact CG-CB 4.4Å; K287-A350 HydrophobicContact CB-CB 4.27Å; V348-A350 PolarHBondContact O-N 2.69Å
351	E	92.7	Very high	97	Very high	134 Å²	134	41.7 Å²	41.7	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-35.8	178.4	-63.9	-56.9	131.8	0	0	111.4	D349	D349-E351 PolarHBondContact O-N 2.79Å; D349-E351 WeakPolarHBondContact OD1-CB 3.47Å; D349-E351 PolarHBondContact OD1-N 2.7Å
352	L	95.6	Very high	97	Very high	130 Å²	130	43.2 Å²	43.2	68%	0.681	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-24	175.6	-61.7	-179.1	0	0	0	112.9	D349	D349-L352 HydrophobicContact CB-CB 4.19Å; D349-L352 HydrophobicContact CB-CD1 4.03Å; D349-L352 HydrophobicContact CB-CG 4.09Å; D349-L352 PolarHBondContact O-N 3.11Å
353	R	97.7	Very high	96.9	Very high	1 Å²	1	46.3 Å²	46.3	0%	0.004	25%	0.246	C	C	.	.	S	Bend	trans	-60.3	136.5	176	-163.8	-178.7	-58	142	6.8	109.6	E277 K287 I290 L345 C347 D349	E277-R353 IonicContact OE1-CZ 2.92Å; E277-R353 IonicContact OE1-NH1 3.67Å; E277-R353 PolarHBondContact OE1-NH1 3.23Å; E277-R353 IonicContact OE1-NH2 3.52Å; E277-R353 IonicContact OE2-CZ 2.69Å; E277-R353 IonicContact OE2-NH1 3.57Å; E277-R353 IonicContact OE2-NH2 3.97Å; E277-R353 PolarHBondContact OE2-NH2 2.91Å; K287-R353 HydrophobicContact CD-CB 4.47Å; K287-R353 PolarHBondContact NZ-O 3.12Å; K287-R353 PolarHBondContact O-NH1 2.76Å; I290-R353 HydrophobicContact CB-CG 4.31Å; I290-R353 HydrophobicContact CG2-CG 3.82Å; L345-R353 VanDerWaalsContact O-CD 3.25Å; L345-R353 WeakPolarHBondContact O-CD 3.23Å; L345-R353 WeakPolarHBondContact O-CG 3.31Å; L345-R353 PolarHBondContact O-NE 2.82Å; C347-R353 HydrophobicContact CB-CB 4.21Å; C347-R353 HydrophobicContact CB-CG 4.45Å; C347-R353 VanDerWaalsContact O-CZ 3.3Å; C347-R353 PolarHBondContact O-NE 3.42Å; C347-R353 PolarHBondContact O-NH2 3.23Å; D349-R353 PolarHBondContact O-N 3.42Å
354	P	98.1	Very high	96.8	Very high	18 Å²	18	44.5 Å²	44.5	12%	0.117	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-67.3	164.2	-178.9	27.4	-35	0	0	0	112.6	K287 I290 S344 L345 M358 S359	K287-P354 WeakPolarHBondContact CD-O 3.25Å; K287-P354 VanDerWaalsContact NZ-C 3.29Å; K287-P354 PolarHBondContact NZ-O 2.88Å; I290-P354 HydrophobicContact CG2-CG 4.49Å; S344-P354 WeakPolarHBondContact O-CD 3.07Å; L345-P354 HydrophobicContact CD2-CG 4.19Å; P354-M358 HydrophobicContact CB-CB 3.86Å; P354-S359 WeakPolarHBondContact CG-OG 3.44Å
355	T	98.4	Very high	96.7	Very high	48 Å²	48	42.8 Å²	42.8	29%	0.294	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-79	168.4	164.5	65.8	0	0	0	0	110.5	D357 M358 S359	T355-D357 VanDerWaalsContact C-N 3.31Å; T355-D357 PolarHBondContact O-N 2.78Å; T355-M358 HydrophobicContact CG2-SD 4.23Å; T355-M358 PolarHBondContact O-N 3.12Å; T355-M358 VanDerWaalsContact OG1-CG 3.31Å; T355-M358 WeakPolarHBondContact OG1-CG 3.35Å; T355-M358 PolarHBondContact OG1-N 3.15Å; T355-M358 VanDerWaalsContact OG1-N 3.16Å; T355-S359 WeakPolarHBondContact O-CB 3.44Å; T355-S359 PolarHBondContact O-N 2.95Å; T355-S359 PolarHBondContact O-OG 3Å
356	A	98.4	Very high	96.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-58.2	-43.3	173.7	0	0	0	0	0	111.9	L213 V216 I290 M358 S359 L360	L213-A356 HydrophobicContact CD2-CB 4.25Å; V216-A356 HydrophobicContact CB-CB 4.38Å; V216-A356 HydrophobicContact CG1-CB 4.01Å; I290-A356 HydrophobicContact CD1-CB 3.76Å; A356-M358 PolarHBondContact O-N 2.97Å; A356-S359 PolarHBondContact O-N 3.22Å; A356-L360 WeakPolarHBondContact O-CG 3.31Å; A356-L360 PolarHBondContact O-N 3.46Å
357	D	97.9	Very high	95.7	Very high	50 Å²	50	53.2 Å²	53.2	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-38.8	176.5	-64.9	-70.6	0	0	0	112.8	S217 R221 T355 R361	S217-D357 VanDerWaalsContact OG-CG 3.3Å; S217-D357 PolarHBondContact OG-OD1 3.17Å; S217-D357 PolarHBondContact OG-OD2 3.04Å; R221-D357 IonicContact NH2-OD1 2.78Å; R221-D357 PolarHBondContact NH2-OD1 2.85Å; R221-D357 VanDerWaalsContact NH2-OD1 3.12Å; T355-D357 VanDerWaalsContact C-N 3.31Å; T355-D357 PolarHBondContact O-N 2.78Å; D357-R361 VanDerWaalsContact O-CZ 3.3Å; D357-R361 PolarHBondContact O-NH1 3.17Å; D357-R361 VanDerWaalsContact O-NH1 3.11Å
358	M	98.2	Very high	94.3	Very high	98 Å²	98	54.7 Å²	54.7	48%	0.483	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-43.1	174	-70.6	171.7	77.1	0	0	111.3	P354 T355 A356 L360 R361	P354-M358 HydrophobicContact CB-CB 3.86Å; T355-M358 HydrophobicContact CG2-SD 4.23Å; T355-M358 PolarHBondContact O-N 3.12Å; T355-M358 VanDerWaalsContact OG1-CG 3.31Å; T355-M358 WeakPolarHBondContact OG1-CG 3.35Å; T355-M358 PolarHBondContact OG1-N 3.15Å; T355-M358 VanDerWaalsContact OG1-N 3.16Å; A356-M358 PolarHBondContact O-N 2.97Å; M358-L360 VanDerWaalsContact C-N 3.29Å; M358-L360 PolarHBondContact O-N 3.06Å; M358-R361 VanDerWaalsContact CG-NH2 3.29Å; M358-R361 WeakPolarHBondContact O-CB 3.34Å; M358-R361 PolarHBondContact O-N 3.14Å
359	S	98.5	Very high	92.4	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-40.2	179.3	-54.1	0	0	0	0	111.3	L345 P354 T355 A356 R361 H362 L365	L345-S359 WeakPolarHBondContact CD2-OG 3.29Å; P354-S359 WeakPolarHBondContact CG-OG 3.44Å; T355-S359 WeakPolarHBondContact O-CB 3.44Å; T355-S359 PolarHBondContact O-N 2.95Å; T355-S359 PolarHBondContact O-OG 3Å; A356-S359 PolarHBondContact O-N 3.22Å; S359-R361 PolarHBondContact O-N 3.3Å; S359-H362 WeakPolarHBondContact O-CB 3.34Å; S359-H362 PolarHBondContact O-N 3.04Å; S359-L365 WeakPolarHBondContact O-CD1 3.5Å
360	L	97.9	Very high	90.3	Very high	27 Å²	27	56.9 Å²	56.9	14%	0.141	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-26.9	175.2	-77.5	168.4	0	0	0	113.3	K210 L213 Q214 A356 M358 Q366	K210-L360 HydrophobicContact CG-CD2 4.03Å; L213-L360 HydrophobicContact CB-CD1 4.47Å; L213-L360 HydrophobicContact CB-CD2 3.57Å; L213-L360 HydrophobicContact CB-CG 3.81Å; L213-L360 HydrophobicContact CD1-CD2 4.28Å; L213-L360 HydrophobicContact CD1-CG 4.4Å; Q214-L360 HydrophobicContact CG-CD1 4.32Å; Q214-L360 HydrophobicContact CG-CD2 4.08Å; A356-L360 WeakPolarHBondContact O-CG 3.31Å; A356-L360 PolarHBondContact O-N 3.46Å; M358-L360 VanDerWaalsContact C-N 3.29Å; M358-L360 PolarHBondContact O-N 3.06Å; L360-Q366 PolarHBondContact O-NE2 3.3Å
361	R	97.5	Very high	88.1	Confident	154 Å²	154	65.3 Å²	65.3	58%	0.581	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-0.5	178.9	-65	-175.2	-67.9	-95.4	7.9	113.7	D357 M358 S359	D357-R361 VanDerWaalsContact O-CZ 3.3Å; D357-R361 PolarHBondContact O-NH1 3.17Å; D357-R361 VanDerWaalsContact O-NH1 3.11Å; M358-R361 VanDerWaalsContact CG-NH2 3.29Å; M358-R361 WeakPolarHBondContact O-CB 3.34Å; M358-R361 PolarHBondContact O-N 3.14Å; S359-R361 PolarHBondContact O-N 3.3Å
362	H	97.7	Very high	85.7	Confident	32 Å²	32	63 Å²	63	15%	0.148	34%	0.335	C	S	.	.	S	Bend	trans	-62.3	139.7	-179.6	-169.7	-86.2	0	0	0	111.4	E337 F341 S359 W364 L365 Q366	E337-H362 PolarHBondContact O-CE1 3.42Å; F341-H362 HydrophobicContact CD2-CB 3.68Å; F341-H362 AromaticContact CD2-CG 3.58Å; F341-H362 AromaticContact CD2-ND1 3.73Å; F341-H362 HydrophobicContact CE2-CB 4.16Å; S359-H362 WeakPolarHBondContact O-CB 3.34Å; S359-H362 PolarHBondContact O-N 3.04Å; H362-W364 VanDerWaalsContact C-N 3.26Å; H362-W364 PolarHBondContact ND1-N 3.34Å; H362-W364 PolarHBondContact O-N 3.47Å; H362-W364 VanDerWaalsContact O-N 3.13Å; H362-L365 PolarHBondContact O-N 3.41Å; H362-Q366 WeakPolarHBondContact O-CG 3.31Å; H362-Q366 PolarHBondContact O-N 3.4Å
363	P	96.1	Very high	82.9	Confident	65 Å²	65	61 Å²	61	42%	0.422	33%	0.325	S	S	.	.	H	α-helix	trans	-49.1	-42.7	-177.2	-31.6	36	0	0	0	114.5	L365 Q366 N367	P363-L365 VanDerWaalsContact C-N 3.28Å; P363-L365 PolarHBondContact O-N 2.88Å; P363-Q366 PolarHBondContact O-N 2.9Å; P363-N367 WeakPolarHBondContact O-CB 3.32Å; P363-N367 PolarHBondContact O-N 3.19Å
364	W	96.1	Very high	80.4	Confident	7 Å²	7	65.1 Å²	65.1	3%	0.027	35%	0.347	C	S	.	.	H	α-helix	trans	-53.7	-39.1	176.3	-176.1	64.1	0	0	0	114.2	E202 I206 V209 L301 E337 A338 F341 H362	E202-W364 PolarHBondContact OE2-NE1 3.34Å; I206-W364 HydrophobicContact CD1-CZ2 4.45Å; I206-W364 VanDerWaalsContact CD1-O 3.31Å; I206-W364 WeakPolarHBondContact CD1-O 3.11Å; I206-W364 HydrophobicContact CG1-CD2 4Å; I206-W364 HydrophobicContact CG1-CE3 4.38Å; I206-W364 HydrophobicContact CG1-CH2 3.96Å; I206-W364 HydrophobicContact CG1-CZ2 3.52Å; I206-W364 HydrophobicContact CG1-CZ3 4.37Å; V209-W364 HydrophobicContact CB-CH2 4.48Å; V209-W364 HydrophobicContact CB-CZ3 4.18Å; V209-W364 HydrophobicContact CG1-CZ3 4.19Å; V209-W364 HydrophobicContact CG2-CH2 4.26Å; V209-W364 HydrophobicContact CG2-CZ3 4.28Å; L301-W364 HydrophobicContact CD1-CH2 4.19Å; L301-W364 HydrophobicContact CD1-CZ2 3.98Å; L301-W364 HydrophobicContact CD2-CH2 4.46Å; L301-W364 HydrophobicContact CD2-CZ2 3.95Å; L301-W364 HydrophobicContact CG-CZ2 4.49Å; E337-W364 HydrophobicContact CB-CB 4.11Å; A338-W364 HydrophobicContact CB-CD2 4.11Å; A338-W364 HydrophobicContact CB-CG 4.05Å; A338-W364 HydrophobicContact CB-CZ2 4.29Å; F341-W364 HydrophobicContact CB-CB 4.11Å; F341-W364 HydrophobicContact CB-CD2 4.38Å; F341-W364 HydrophobicContact CB-CE3 4.04Å; F341-W364 HydrophobicContact CB-CG 4.42Å; F341-W364 HydrophobicContact CD1-CD2 4.37Å; F341-W364 AromaticContact CD1-CE3 3.36Å; F341-W364 HydrophobicContact CD1-CE3 3.36Å; F341-W364 AromaticContact CD1-CZ3 3.51Å; F341-W364 HydrophobicContact CD1-CZ3 3.51Å; F341-W364 HydrophobicContact CD2-CE3 4.16Å; F341-W364 AromaticContact CE1-CE3 3.76Å; F341-W364 HydrophobicContact CE1-CE3 3.76Å; F341-W364 AromaticContact CE1-CZ3 3.54Å; F341-W364 HydrophobicContact CE1-CZ3 3.54Å; F341-W364 HydrophobicContact CE2-CE3 4.46Å; F341-W364 HydrophobicContact CG-CD2 4.38Å; F341-W364 AromaticContact CG-CE3 3.57Å; F341-W364 HydrophobicContact CG-CE3 3.57Å; F341-W364 HydrophobicContact CG-CZ3 4.2Å; F341-W364 HydrophobicContact CZ-CE3 4.26Å; F341-W364 HydrophobicContact CZ-CZ3 4.21Å; H362-W364 VanDerWaalsContact C-N 3.26Å; H362-W364 PolarHBondContact ND1-N 3.34Å; H362-W364 PolarHBondContact O-N 3.47Å; H362-W364 VanDerWaalsContact O-N 3.13Å
365	L	95.9	Very high	77.8	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-85.6	-15.3	179.2	-66	-177.6	0	0	0	113.9	I206 V209 K210 L213 F341 S359 H362 P363	I206-L365 HydrophobicContact CB-CD2 4.33Å; I206-L365 HydrophobicContact CG1-CD2 4.32Å; I206-L365 HydrophobicContact CG2-CD2 4.04Å; V209-L365 HydrophobicContact CB-CD2 4.41Å; V209-L365 HydrophobicContact CG1-CD1 4.44Å; V209-L365 HydrophobicContact CG1-CD2 4.25Å; K210-L365 HydrophobicContact CB-CD2 4.48Å; K210-L365 PolarHBondContact NZ-O 2.98Å; L213-L365 HydrophobicContact CD1-CD1 3.57Å; F341-L365 HydrophobicContact CE2-CD1 3.69Å; F341-L365 HydrophobicContact CE2-CG 4.07Å; F341-L365 HydrophobicContact CZ-CD1 3.87Å; F341-L365 HydrophobicContact CZ-CG 4.31Å; S359-L365 WeakPolarHBondContact O-CD1 3.5Å; H362-L365 PolarHBondContact O-N 3.41Å; P363-L365 VanDerWaalsContact C-N 3.28Å; P363-L365 PolarHBondContact O-N 2.88Å
366	Q	93.3	Very high	74.9	Confident	105 Å²	105	76 Å²	76	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-91.4	-41.1	179.9	-65	-60.4	-43.9	0	0	111.4	L360 H362 P363 S368	L360-Q366 PolarHBondContact O-NE2 3.3Å; H362-Q366 WeakPolarHBondContact O-CG 3.31Å; H362-Q366 PolarHBondContact O-N 3.4Å; P363-Q366 PolarHBondContact O-N 2.9Å; Q366-S368 PolarHBondContact O-N 3.27Å
367	N	82.3	Confident	72.1	Confident	119 Å²	119	81 Å²	81	64%	0.636	43%	0.431	S	S	*	.	S	Bend	trans	-84.7	37.5	-175.6	-64.3	-17.6	0	0	0	112.9	P363 P369	P363-N367 WeakPolarHBondContact O-CB 3.32Å; P363-N367 PolarHBondContact O-N 3.19Å; N367-P369 WeakPolarHBondContact O-CD 3.43Å; N367-P369 VanDerWaalsContact O-N 3.14Å
368	S	66.2	Low	69.3	Low	64 Å²	64	83.2 Å²	83.2	45%	0.448	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-51.2	124.1	179.3	-177	0	0	0	0	109.5	Q366 S370	Q366-S368 PolarHBondContact O-N 3.27Å; S368-S370 PolarHBondContact O-N 3.13Å; S368-S370 VanDerWaalsContact O-N 3.12Å
369	P	55.7	Low	66.8	Low	50 Å²	50	88.5 Å²	88.5	33%	0.325	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-53.5	127	168.6	-20.1	30.2	0	0	0	107.2	P203 N367 N373	P203-P369 HydrophobicContact CG-CG 4.26Å; N367-P369 WeakPolarHBondContact O-CD 3.43Å; N367-P369 VanDerWaalsContact O-N 3.14Å; P369-N373 HydrophobicContact CB-CB 4.09Å
370	S	48	Very low	64	Low	75 Å²	75	91.6 Å²	91.6	52%	0.524	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-50.3	146.4	173.9	42.5	0	0	0	0	109	S368 S372 N373	S368-S370 PolarHBondContact O-N 3.13Å; S368-S370 VanDerWaalsContact O-N 3.12Å; S370-S372 PolarHBondContact O-N 3.26Å; S370-S372 PolarHBondContact OG-OG 2.99Å; S370-N373 PolarHBondContact O-N 2.94Å
371	K	48.3	Very low	61.5	Low	191 Å²	191	94 Å²	94	83%	0.83	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-47.9	-23.6	-174.1	-76.5	-176.7	177.7	-179.6	0	114.2	N373 L374	K371-N373 PolarHBondContact O-N 3.17Å; K371-L374 HydrophobicContact CB-CD1 4.21Å; K371-L374 HydrophobicContact CG-CD1 4.34Å; K371-L374 VanDerWaalsContact O-CD1 3.27Å; K371-L374 WeakPolarHBondContact O-CD1 3.25Å; K371-L374 PolarHBondContact O-N 2.93Å
372	S	42.9	Very low	58.9	Low	85 Å²	85	90.1 Å²	90.1	59%	0.594	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-58.9	-24.7	175.8	54.7	0	0	0	0	115	S370	S370-S372 PolarHBondContact O-N 3.26Å; S370-S372 PolarHBondContact OG-OG 2.99Å
373	N	36.8	Very low	56.1	Low	88 Å²	88	96.2 Å²	96.2	47%	0.471	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-92.1	0.7	-176.9	-69	-8.3	0	0	0	114	P369 S370 K371 E375	P369-N373 HydrophobicContact CB-CB 4.09Å; S370-N373 PolarHBondContact O-N 2.94Å; K371-N373 PolarHBondContact O-N 3.17Å; N373-E375 PolarHBondContact O-N 2.83Å
374	L	45	Very low	53.4	Low	88 Å²	88	96 Å²	96	46%	0.461	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-67.5	-17.6	-178.5	-89.9	111.3	0	0	0	114.2	P203 K371	P203-L374 HydrophobicContact CB-CD1 4.5Å; P203-L374 HydrophobicContact CB-CD2 4.29Å; P203-L374 HydrophobicContact CB-CG 4.21Å; K371-L374 HydrophobicContact CB-CD1 4.21Å; K371-L374 HydrophobicContact CG-CD1 4.34Å; K371-L374 VanDerWaalsContact O-CD1 3.27Å; K371-L374 WeakPolarHBondContact O-CD1 3.25Å; K371-L374 PolarHBondContact O-N 2.93Å
375	E	43.1	Very low	50.6	Low	188 Å²	188	100 Å²	100	88%	0.879	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-93	-16.6	-177	-63.9	-166.6	161.1	0	0	114	N373	N373-E375 PolarHBondContact O-N 2.83Å
376	T	37.3	Very low	48	Very low	107 Å²	107	102.7 Å²	102.7	66%	0.656	55%	0.552	S	S	*	*			trans	-102.3	-3.3	-163.1	-22.3	0	0	0	0	115.7	P378	T376-P378 VanDerWaalsContact O-CD 3.3Å; T376-P378 WeakPolarHBondContact O-CD 3.37Å
377	V	39.9	Very low	45.5	Very low	107 Å²	107	104.2 Å²	104.2	65%	0.648	56%	0.563	S	S	*	*	S	Bend	trans	-85	115.8	176.5	-170.4	0	0	0	0	109.5	R379	V377-R379 PolarHBondContact O-N 2.69Å
378	P	38.8	Very low	43.6	Very low	95 Å²	95	103.2 Å²	103.2	62%	0.617	56%	0.558	S	S	*	*			trans	-63.1	105.5	-172.7	-21.8	33.7	0	0	0	112.2	T376 A380 V381	T376-P378 VanDerWaalsContact O-CD 3.3Å; T376-P378 WeakPolarHBondContact O-CD 3.37Å; P378-A380 PolarHBondContact O-N 2.83Å; P378-V381 PolarHBondContact O-N 3.4Å
379	R	45.3	Very low	42.5	Very low	209 Å²	209	101.5 Å²	101.5	79%	0.789	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-15.7	172	-70	176.4	174.1	148.3	-0.2	114.3	V377 K383	V377-R379 PolarHBondContact O-N 2.69Å; R379-K383 PolarHBondContact O-N 3.44Å
380	A	40.6	Very low	42	Very low	67 Å²	67	105 Å²	105	55%	0.554	56%	0.557	S	S	*	*	H	α-helix	trans	-69	-31.2	-173.1	0	0	0	0	0	113.7	P378 S384	P378-A380 PolarHBondContact O-N 2.83Å; A380-S384 PolarHBondContact O-N 3.1Å; A380-S384 PolarHBondContact O-OG 3.31Å
381	V	44.5	Very low	41.7	Very low	77 Å²	77	106.3 Å²	106.3	47%	0.467	57%	0.566	S	S	.	*	H	α-helix	trans	-71	-40.6	-178.2	-172	0	0	0	0	110.6	P378 S384 Y385	P378-V381 PolarHBondContact O-N 3.4Å; V381-S384 PolarHBondContact O-OG 2.95Å; V381-S384 VanDerWaalsContact O-OG 3.1Å; V381-Y385 HydrophobicContact CG1-CD2 4.21Å; V381-Y385 WeakPolarHBondContact O-CB 3.47Å; V381-Y385 WeakPolarHBondContact O-CD2 3.18Å; V381-Y385 PolarHBondContact O-N 3.24Å; V381-Y385 VanDerWaalsContact O-N 3.11Å
382	H	43.6	Very low	41.3	Very low	74 Å²	74	103.9 Å²	103.9	34%	0.343	56%	0.555	S	S	.	*	H	α-helix	trans	-75.1	-34.1	180	-82.9	-81	0	0	0	114	C199 S386	C199-H382 PolarHBondContact SG-ND1 3.46Å; H382-S386 VanDerWaalsContact O-CB 3.24Å; H382-S386 WeakPolarHBondContact O-CB 3.49Å; H382-S386 PolarHBondContact O-N 2.88Å; H382-S386 PolarHBondContact O-OG 3.36Å
383	K	39	Very low	41.5	Very low	159 Å²	159	106 Å²	106	69%	0.691	55%	0.55	S	S	*	.	H	α-helix	trans	-67.6	-43	176.7	-87.6	-172.8	176.9	-177.4	0	112.3	R379 S386 L387	R379-K383 PolarHBondContact O-N 3.44Å; K383-S386 PolarHBondContact O-N 3.24Å; K383-L387 PolarHBondContact O-N 2.91Å
384	S	37.8	Very low	42	Very low	61 Å²	61	105.1 Å²	105.1	43%	0.427	55%	0.548	S	S	.	.	H	α-helix	trans	-67.8	-37.4	178.1	52.1	0	0	0	0	111.7	A380 V381 N388	A380-S384 PolarHBondContact O-N 3.1Å; A380-S384 PolarHBondContact O-OG 3.31Å; V381-S384 PolarHBondContact O-OG 2.95Å; V381-S384 VanDerWaalsContact O-OG 3.1Å; S384-N388 WeakPolarHBondContact O-CB 3.25Å; S384-N388 PolarHBondContact O-N 3.47Å
385	Y	39	Very low	42.2	Very low	92 Å²	92	111.7 Å²	111.7	36%	0.361	57%	0.573	S	S	.	*	H	α-helix	trans	-70	-44.9	171.9	-94.4	-93.2	0	0	0	112.6	E329 V381 L387 N388 V389	E329-Y385 HydrophobicContact CB-CE1 4.29Å; V381-Y385 HydrophobicContact CG1-CD2 4.21Å; V381-Y385 WeakPolarHBondContact O-CB 3.47Å; V381-Y385 WeakPolarHBondContact O-CD2 3.18Å; V381-Y385 PolarHBondContact O-N 3.24Å; V381-Y385 VanDerWaalsContact O-N 3.11Å; Y385-L387 PolarHBondContact O-N 3.21Å; Y385-N388 CarbonylContact O-C 3.57Å; Y385-N388 WeakPolarHBondContact O-CA 3.41Å; Y385-N388 PolarHBondContact O-N 3.26Å; Y385-V389 WeakPolarHBondContact O-CB 3.46Å; Y385-V389 WeakPolarHBondContact O-CG2 3.33Å; Y385-V389 PolarHBondContact O-N 3.43Å
386	S	41	Very low	42.7	Very low	56 Å²	56	105.4 Å²	105.4	39%	0.392	55%	0.55	S	S	.	.	H	α-helix	trans	-59.1	-33.9	-178.5	-60.5	0	0	0	0	113.4	H382 K383	H382-S386 VanDerWaalsContact O-CB 3.24Å; H382-S386 WeakPolarHBondContact O-CB 3.49Å; H382-S386 PolarHBondContact O-N 2.88Å; H382-S386 PolarHBondContact O-OG 3.36Å; K383-S386 PolarHBondContact O-N 3.24Å
387	L	41.4	Very low	43.6	Very low	137 Å²	137	101.1 Å²	101.1	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-76	-34.1	173.8	-66.9	174.1	0	0	0	112.4	K383 Y385	K383-L387 PolarHBondContact O-N 2.91Å; Y385-L387 PolarHBondContact O-N 3.21Å
388	N	41.9	Very low	44.6	Very low	98 Å²	98	99.8 Å²	99.8	52%	0.524	51%	0.507	S	S	.	.	H	α-helix	trans	-82.9	-12.9	175.9	-79.8	-16.4	0	0	0	114.2	S384 Y385 E390 S391 K392	S384-N388 WeakPolarHBondContact O-CB 3.25Å; S384-N388 PolarHBondContact O-N 3.47Å; Y385-N388 CarbonylContact O-C 3.57Å; Y385-N388 WeakPolarHBondContact O-CA 3.41Å; Y385-N388 PolarHBondContact O-N 3.26Å; N388-E390 PolarHBondContact O-N 2.74Å; N388-S391 PolarHBondContact O-N 3.41Å; N388-S391 VanDerWaalsContact O-N 3.11Å; N388-K392 PolarHBondContact O-N 2.85Å
389	V	43.5	Very low	45.8	Very low	28 Å²	28	96.4 Å²	96.4	17%	0.17	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.6	179.3	158.4	0	0	0	0	111	F330 Y385 S391 R393	F330-V389 HydrophobicContact CD1-CG2 4.43Å; F330-V389 HydrophobicContact CE1-CB 4.34Å; F330-V389 HydrophobicContact CE1-CG1 3.77Å; F330-V389 HydrophobicContact CE1-CG2 3.51Å; F330-V389 HydrophobicContact CZ-CG1 3.86Å; F330-V389 HydrophobicContact CZ-CG2 3.98Å; Y385-V389 WeakPolarHBondContact O-CB 3.46Å; Y385-V389 WeakPolarHBondContact O-CG2 3.33Å; Y385-V389 PolarHBondContact O-N 3.43Å; V389-S391 PolarHBondContact O-N 3.16Å; V389-R393 WeakPolarHBondContact O-CG 3.46Å
390	E	45.2	Very low	46.7	Very low	124 Å²	124	86.6 Å²	86.6	58%	0.579	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.9	172.2	-103.6	170.6	178	0	0	112.8	N388 R393	N388-E390 PolarHBondContact O-N 2.74Å; E390-R393 VanDerWaalsContact CG-CZ 3.42Å; E390-R393 IonicContact OE1-NH2 2.77Å; E390-R393 PolarHBondContact OE1-NH2 3.23Å
391	S	40.5	Very low	47.6	Very low	102 Å²	102	90.4 Å²	90.4	71%	0.713	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.6	-175	-44.2	0	0	0	0	113.7	N388 V389	N388-S391 PolarHBondContact O-N 3.41Å; N388-S391 VanDerWaalsContact O-N 3.11Å; V389-S391 PolarHBondContact O-N 3.16Å
392	K	40.7	Very low	48.2	Very low	139 Å²	139	89.1 Å²	89.1	60%	0.604	44%	0.444	S	S	*	.	S	Bend	trans	-94.9	12.7	179.8	-70.6	-170.7	178.3	-178.6	0	114.1	N388 T394	N388-K392 PolarHBondContact O-N 2.85Å; K392-T394 PolarHBondContact O-N 3.09Å
393	R	46.9	Very low	48.6	Very low	129 Å²	129	86 Å²	86	49%	0.487	43%	0.43	S	S	.	.			trans	-57.1	110.4	-180	-67.2	-173.9	173.2	150.5	0.5	110.4	V389 E390	V389-R393 WeakPolarHBondContact O-CG 3.46Å; E390-R393 VanDerWaalsContact CG-CZ 3.42Å; E390-R393 IonicContact OE1-NH2 2.77Å; E390-R393 PolarHBondContact OE1-NH2 3.23Å
394	T	46.3	Very low	49.3	Very low	70 Å²	70	79.5 Å²	79.5	43%	0.429	41%	0.406	S	S	.	.			trans	-64.2	147.3	153.8	62.2	0	0	0	0	106.9	K392 S396	K392-T394 PolarHBondContact O-N 3.09Å; T394-S396 PolarHBondContact O-N 2.98Å; T394-S396 PolarHBondContact OG1-OG 3.3Å
395	K	50.3	Low	49.8	Very low	227 Å²	227	86.7 Å²	86.7	99%	0.987	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-6.9	-179.9	-72.3	-177.7	176.1	179.5	0	114.1
396	S	52.2	Low	50	Low	56 Å²	56	86.5 Å²	86.5	39%	0.392	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-3.9	-166.4	72.5	0	0	0	0	116.9	Y327 T394	Y327-S396 PolarHBondContact OH-OG 2.93Å; T394-S396 PolarHBondContact O-N 2.98Å; T394-S396 PolarHBondContact OG1-OG 3.3Å
397	S	57.1	Low	50.3	Low	17 Å²	17	88.6 Å²	88.6	12%	0.119	44%	0.443	C	S	.	.			trans	-135.3	88.7	-174.6	-57.5	0	0	0	0	111.1	Y327	Y327-S397 WeakPolarHBondContact CE2-OG 3.5Å
398	R	60.9	Low	50.5	Low	78 Å²	78	82.3 Å²	82.3	29%	0.294	41%	0.41	S	S	.	.			trans	-66.7	142.9	173.8	-68.2	166.8	168.6	-171.2	-25.8	110.2	D308 E310 S402 V403	D308-R398 WeakPolarHBondContact OD1-CD 3.41Å; D308-R398 IonicContact OD1-NH1 3.73Å; D308-R398 WeakPolarHBondContact OD2-CA 3.45Å; D308-R398 WeakPolarHBondContact OD2-CB 3.48Å; D308-R398 WeakPolarHBondContact OD2-CD 3.42Å; D308-R398 WeakPolarHBondContact OD2-CG 3.31Å; D308-R398 PolarHBondContact OD2-N 3.27Å; E310-R398 IonicContact OE1-CZ 2.83Å; E310-R398 IonicContact OE1-NE 3.91Å; E310-R398 IonicContact OE1-NH2 3.89Å; E310-R398 PolarHBondContact OE1-NH2 3.12Å; R398-S402 WeakPolarHBondContact CB-OG 3.4Å; R398-V403 HydrophobicContact CB-CG2 3.62Å
399	S	64	Low	50.9	Low	24 Å²	24	80.6 Å²	80.6	17%	0.168	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-64.9	151	170.1	177.2	0	0	0	0	109.4	R401 S402 V403	S399-R401 PolarHBondContact O-N 2.98Å; S399-R401 PolarHBondContact OG-N 3.06Å; S399-S402 PolarHBondContact N-OG 3.25Å; S399-S402 PolarHBondContact O-N 2.95Å; S399-S402 PolarHBondContact O-OG 3.46Å; S399-V403 PolarHBondContact O-N 3.11Å
400	I	65.1	Low	51.9	Low	4 Å²	4	85.8 Å²	85.8	2%	0.021	43%	0.432	C	S	.	.	H	α-helix	trans	-50.9	-31.1	170.6	-150.3	-163.5	0	0	0	111.8	Y191 I194 I299 G303 S402 V403 A404	Y191-I400 HydrophobicContact CD2-CD1 3.54Å; Y191-I400 HydrophobicContact CD2-CG1 4.1Å; Y191-I400 HydrophobicContact CE2-CB 4.43Å; Y191-I400 HydrophobicContact CE2-CD1 3.67Å; Y191-I400 HydrophobicContact CE2-CG1 3.75Å; Y191-I400 HydrophobicContact CE2-CG2 4.28Å; Y191-I400 PolarHBondContact OH-O 3.37Å; I194-I400 HydrophobicContact CG2-CD1 4.41Å; I299-I400 HydrophobicContact CG2-CB 4.47Å; I299-I400 HydrophobicContact CG2-CD1 3.38Å; I299-I400 HydrophobicContact CG2-CG1 3.93Å; G303-I400 PolarHBondContact O-N 3.45Å; I400-S402 VanDerWaalsContact C-N 3.28Å; I400-S402 PolarHBondContact O-N 3.39Å; I400-V403 PolarHBondContact O-N 2.97Å; I400-A404 PolarHBondContact O-N 3.18Å
401	R	59.5	Low	53.3	Low	146 Å²	146	84.3 Å²	84.3	55%	0.551	42%	0.421	S	S	*	.	H	α-helix	trans	-56.8	-36.5	174.8	-74.9	178	-178.1	-178.5	2.8	113.9	T195 S399	T195-R401 HydrophobicContact CG2-CG 3.47Å; T195-R401 VanDerWaalsContact CG2-CG 3.47Å; T195-R401 PolarHBondContact O-NE 3.19Å; T195-R401 PolarHBondContact O-NH2 3.02Å; S399-R401 PolarHBondContact O-N 2.98Å; S399-R401 PolarHBondContact OG-N 3.06Å
402	S	55.4	Low	55.2	Low	51 Å²	51	79.9 Å²	79.9	36%	0.357	39%	0.39	S	S	.	.	H	α-helix	trans	-87.4	-26.6	-176.1	29.9	0	0	0	0	113.6	R398 S399 I400	R398-S402 WeakPolarHBondContact CB-OG 3.4Å; S399-S402 PolarHBondContact N-OG 3.25Å; S399-S402 PolarHBondContact O-N 2.95Å; S399-S402 PolarHBondContact O-OG 3.46Å; I400-S402 VanDerWaalsContact C-N 3.28Å; I400-S402 PolarHBondContact O-N 3.39Å
403	V	53.3	Low	56.9	Low	9 Å²	9	78.7 Å²	78.7	6%	0.055	39%	0.385	C	S	.	.	H	α-helix	trans	-88.8	-39.1	-172.2	-172.5	0	0	0	0	112.3	E272 M305 R398 S399 I400 R405	E272-V403 HydrophobicContact CG-CG1 4.12Å; M305-V403 HydrophobicContact CG-CG2 4.47Å; M305-V403 HydrophobicContact SD-CB 3.74Å; M305-V403 HydrophobicContact SD-CG1 3.57Å; M305-V403 VanDerWaalsContact SD-CG1 3.57Å; M305-V403 HydrophobicContact SD-CG2 3.77Å; R398-V403 HydrophobicContact CB-CG2 3.62Å; S399-V403 PolarHBondContact O-N 3.11Å; I400-V403 PolarHBondContact O-N 2.97Å; V403-R405 VanDerWaalsContact C-N 3.32Å; V403-R405 PolarHBondContact O-N 3.16Å
404	A	52.5	Low	58.4	Low	22 Å²	22	78.8 Å²	78.8	18%	0.182	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.4	-166.9	0	0	0	0	0	115.3	Y191 I400	Y191-A404 HydrophobicContact CD2-CB 3.94Å; Y191-A404 HydrophobicContact CE1-CB 4.33Å; Y191-A404 HydrophobicContact CE2-CB 3.22Å; Y191-A404 VanDerWaalsContact CZ-CB 3.47Å; I400-A404 PolarHBondContact O-N 3.18Å
405	R	48	Very low	60	Low	211 Å²	211	79.9 Å²	79.9	80%	0.796	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-26.6	-172.9	-71.5	-172.8	177.3	173.3	0.6	115.7	V403	V403-R405 VanDerWaalsContact C-N 3.32Å; V403-R405 PolarHBondContact O-N 3.16Å
406	S	44.4	Very low	61.5	Low	88 Å²	88	70.1 Å²	70.1	62%	0.615	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-30.4	-170.4	54.7	0	0	0	0	115
407	D	46.1	Very low	62.8	Low	101 Å²	101	67.4 Å²	67.4	54%	0.54	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.5	-14.8	-177.7	-91.6	-45.4	0	0	0	115.8	G409 R410	D407-G409 PolarHBondContact O-N 3.18Å; D407-R410 WeakPolarHBondContact O-CB 3.42Å; D407-R410 PolarHBondContact O-N 3.21Å
408	A	45.6	Very low	64	Low	4 Å²	4	70.3 Å²	70.3	3%	0.033	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.1	-171.2	0	0	0	0	0	115.8	K230 T270	K230-A408 PolarHBondContact NZ-O 3.14Å; T270-A408 WeakPolarHBondContact CG2-O 3.41Å
409	G	51	Low	65.1	Low	62 Å²	62	74.2 Å²	74.2	64%	0.639	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-14.4	172.6	0	0	0	0	0	114	D407 R411	D407-G409 PolarHBondContact O-N 3.18Å; G409-R411 PolarHBondContact O-N 3.26Å; G409-R411 VanDerWaalsContact O-N 3.11Å
410	R	64.6	Low	65.9	Low	137 Å²	137	73.3 Å²	73.3	52%	0.517	35%	0.351	S	S	.	.			trans	-85.5	93.9	-169.9	-158.7	179.8	-164.3	-148.5	8	111.2	P271 D407	P271-R410 VanDerWaalsContact CD-O 3.28Å; P271-R410 WeakPolarHBondContact CD-O 3.42Å; D407-R410 WeakPolarHBondContact O-CB 3.42Å; D407-R410 PolarHBondContact O-N 3.21Å
411	R	75.1	Confident	66.7	Low	93 Å²	93	75 Å²	75	35%	0.351	36%	0.358	S	S	.	.			trans	-49.4	139.2	170.4	-65.7	173.3	176.4	-179	3	111.1	D249 L252 G269 G409	D249-R411 IonicContact OD2-NH2 3.57Å; L252-R411 HydrophobicContact CD1-CG 4.22Å; G269-R411 WeakPolarHBondContact O-CA 3.49Å; G409-R411 PolarHBondContact O-N 3.26Å; G409-R411 VanDerWaalsContact O-N 3.11Å
412	I	79.7	Confident	67.9	Low	10 Å²	10	75.9 Å²	75.9	5%	0.051	37%	0.366	C	S	.	.			trans	-58.3	139.7	174.3	-165.7	167.2	0	0	0	110.3	G269 I274 L279 Y316 E416 V417	G269-I412 PolarHBondContact O-N 3.22Å; I274-I412 HydrophobicContact CD1-CB 4.25Å; I274-I412 HydrophobicContact CD1-CD1 3.54Å; I274-I412 HydrophobicContact CD1-CG2 3.83Å; L279-I412 HydrophobicContact CD2-CD1 3.76Å; Y316-I412 HydrophobicContact CE1-CD1 4.46Å; I412-E416 HydrophobicContact CG1-CB 4.45Å; I412-V417 HydrophobicContact CD1-CG2 3.43Å; I412-V417 VanDerWaalsContact CD1-CG2 3.43Å; I412-V417 HydrophobicContact CG1-CG2 3.89Å
413	K	77.9	Confident	69.2	Low	114 Å²	114	74.9 Å²	74.9	50%	0.496	36%	0.357	S	S	.	.			trans	-104.4	149.7	174.5	-65.7	-173.7	177.8	-172.1	0	110.3	D415 E416 V417	K413-D415 VanDerWaalsContact C-N 3.3Å; K413-D415 PolarHBondContact O-N 3.24Å; K413-E416 HydrophobicContact CB-CB 4.48Å; K413-E416 WeakPolarHBondContact O-CA 3.21Å; K413-E416 WeakPolarHBondContact O-CB 3.46Å; K413-E416 PolarHBondContact O-N 3.44Å; K413-V417 PolarHBondContact O-N 3.26Å
414	K	77.1	Confident	70.7	Confident	131 Å²	131	79 Å²	79	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-52.5	-47.3	177	-169.9	176	177.5	176.8	0	112.2	P267 E416 V417 E418	P267-K414 HydrophobicContact CG-CB 4.47Å; P267-K414 HydrophobicContact CG-CG 4.35Å; K414-E416 PolarHBondContact O-N 2.84Å; K414-E416 VanDerWaalsContact O-N 3.14Å; K414-V417 WeakPolarHBondContact O-CB 3.39Å; K414-V417 PolarHBondContact O-N 3.45Å; K414-V417 VanDerWaalsContact O-N 3.09Å; K414-E418 WeakPolarHBondContact O-CG 3.48Å; K414-E418 PolarHBondContact O-N 2.71Å
415	D	81.2	Confident	72.1	Confident	93 Å²	93	81.8 Å²	81.8	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-22.3	178.7	-36.9	-23.2	0	0	0	113.3	K413 R419	K413-D415 VanDerWaalsContact C-N 3.3Å; K413-D415 PolarHBondContact O-N 3.24Å; D415-R419 WeakPolarHBondContact O-CG 3.5Å; D415-R419 PolarHBondContact O-N 3.06Å; D415-R419 VanDerWaalsContact O-N 3.12Å; D415-R419 PolarHBondContact O-NE 2.84Å; D415-R419 VanDerWaalsContact O-NE 3.14Å
416	E	81.6	Confident	73.7	Confident	21 Å²	21	71.8 Å²	71.8	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-75.3	-46.2	175.3	-163.7	-179.3	155.9	0	0	111	R312 Y316 I412 K413 K414 E418 R419 L420	R312-E416 IonicContact CZ-OE1 3.58Å; R312-E416 IonicContact CZ-OE2 2.61Å; R312-E416 VanDerWaalsContact CZ-OE2 3.3Å; R312-E416 IonicContact NE-OE1 3.66Å; R312-E416 PolarHBondContact NE-OE1 2.93Å; R312-E416 IonicContact NE-OE2 3.46Å; R312-E416 IonicContact NH2-OE1 2.7Å; R312-E416 PolarHBondContact NH2-OE1 3.24Å; R312-E416 IonicContact NH2-OE2 2.75Å; R312-E416 PolarHBondContact NH2-OE2 3.27Å; Y316-E416 VanDerWaalsContact CE2-OE1 3.27Å; Y316-E416 WeakPolarHBondContact CE2-OE1 3.18Å; Y316-E416 PolarHBondContact OH-OE1 3.13Å; Y316-E416 VanDerWaalsContact OH-OE1 3.11Å; I412-E416 HydrophobicContact CG1-CB 4.45Å; K413-E416 HydrophobicContact CB-CB 4.48Å; K413-E416 WeakPolarHBondContact O-CA 3.21Å; K413-E416 WeakPolarHBondContact O-CB 3.46Å; K413-E416 PolarHBondContact O-N 3.44Å; K414-E416 PolarHBondContact O-N 2.84Å; K414-E416 VanDerWaalsContact O-N 3.14Å; E416-E418 PolarHBondContact O-N 2.81Å; E416-R419 PolarHBondContact O-N 2.72Å; E416-R419 VanDerWaalsContact O-N 3.08Å; E416-L420 WeakPolarHBondContact O-CG 3.17Å; E416-L420 PolarHBondContact O-N 3.06Å
417	V	79.7	Confident	75.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-33.8	171	-172.2	0	0	0	0	110.4	P267 R281 I412 K413 K414 L420 H421	P267-V417 HydrophobicContact CB-CG2 3.92Å; P267-V417 HydrophobicContact CG-CG2 4.37Å; R281-V417 HydrophobicContact CG-CG1 3.75Å; R281-V417 VanDerWaalsContact NH2-C 3.28Å; I412-V417 HydrophobicContact CD1-CG2 3.43Å; I412-V417 VanDerWaalsContact CD1-CG2 3.43Å; I412-V417 HydrophobicContact CG1-CG2 3.89Å; K413-V417 PolarHBondContact O-N 3.26Å; K414-V417 WeakPolarHBondContact O-CB 3.39Å; K414-V417 PolarHBondContact O-N 3.45Å; K414-V417 VanDerWaalsContact O-N 3.09Å; V417-L420 PolarHBondContact O-N 2.96Å; V417-H421 PolarHBondContact O-N 3.49Å; V417-H421 PolarHBondContact O-ND1 2.92Å
418	E	81.5	Confident	77.4	Confident	78 Å²	78	72.7 Å²	72.7	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-64.6	-41.8	175.7	-69.2	179	-178.7	0	0	112	K414 E416 L420 H421	K414-E418 WeakPolarHBondContact O-CG 3.48Å; K414-E418 PolarHBondContact O-N 2.71Å; E416-E418 PolarHBondContact O-N 2.81Å; E418-L420 VanDerWaalsContact C-N 3.35Å; E418-H421 PolarHBondContact O-N 3.37Å
419	R	83.4	Confident	79.1	Confident	159 Å²	159	73.1 Å²	73.1	60%	0.6	35%	0.348	S	S	*	.	H	α-helix	trans	-68.6	-33.8	177.2	-75.2	178.8	-74.4	176.3	1.2	112.3	D415 E416 H421 K422	D415-R419 WeakPolarHBondContact O-CG 3.5Å; D415-R419 PolarHBondContact O-N 3.06Å; D415-R419 VanDerWaalsContact O-N 3.12Å; D415-R419 PolarHBondContact O-NE 2.84Å; D415-R419 VanDerWaalsContact O-NE 3.14Å; E416-R419 PolarHBondContact O-N 2.72Å; E416-R419 VanDerWaalsContact O-N 3.08Å; R419-H421 VanDerWaalsContact C-N 3.31Å; R419-H421 PolarHBondContact O-N 3.03Å; R419-K422 WeakPolarHBondContact O-CB 3.49Å; R419-K422 PolarHBondContact O-N 2.98Å; R419-K422 VanDerWaalsContact O-N 3.12Å
420	L	82.1	Confident	80.4	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-35.6	176.7	-67.4	169.5	0	0	0	113.2	L279 T313 Y316 E416 V417 E418 K422 D423 I426	L279-L420 HydrophobicContact CD2-CD1 4.13Å; T313-L420 HydrophobicContact CG2-CD2 3.91Å; Y316-L420 HydrophobicContact CD2-CD1 3.19Å; Y316-L420 HydrophobicContact CD2-CD2 3.41Å; Y316-L420 VanDerWaalsContact CD2-CD2 3.41Å; Y316-L420 HydrophobicContact CD2-CG 3.86Å; Y316-L420 HydrophobicContact CE2-CD1 3.48Å; Y316-L420 VanDerWaalsContact CE2-CD1 3.48Å; Y316-L420 HydrophobicContact CE2-CD2 4.13Å; Y316-L420 HydrophobicContact CE2-CG 4.27Å; Y316-L420 HydrophobicContact CG-CD1 3.82Å; Y316-L420 HydrophobicContact CG-CD2 4.29Å; E416-L420 WeakPolarHBondContact O-CG 3.17Å; E416-L420 PolarHBondContact O-N 3.06Å; V417-L420 PolarHBondContact O-N 2.96Å; E418-L420 VanDerWaalsContact C-N 3.35Å; L420-K422 PolarHBondContact O-N 3.31Å; L420-D423 VanDerWaalsContact O-CB 3.31Å; L420-D423 WeakPolarHBondContact O-CB 3.3Å; L420-D423 PolarHBondContact O-N 3.34Å; L420-I426 WeakPolarHBondContact O-CB 3.39Å; L420-I426 WeakPolarHBondContact O-CG2 3.44Å
421	H	81.5	Confident	81.1	Confident	39 Å²	39	68.5 Å²	68.5	18%	0.181	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-3.6	177.9	-71.2	68.9	0	0	0	113.3	L279 R281 V417 E418 R419 L427	L279-H421 PolarHBondContact O-CE1 3.08Å; R281-H421 VanDerWaalsContact CD-CE1 3.45Å; R281-H421 WeakPolarHBondContact CD-CE1 3.46Å; R281-H421 WeakPolarHBondContact CD-NE2 3.25Å; R281-H421 VanDerWaalsContact CG-CE1 3.46Å; R281-H421 WeakPolarHBondContact CG-CE1 3.25Å; R281-H421 PolarHBondContact NE-CE1 3.08Å; R281-H421 PolarHBondContact NE-ND1 2.8Å; V417-H421 PolarHBondContact O-N 3.49Å; V417-H421 PolarHBondContact O-ND1 2.92Å; E418-H421 PolarHBondContact O-N 3.37Å; R419-H421 VanDerWaalsContact C-N 3.31Å; R419-H421 PolarHBondContact O-N 3.03Å; H421-L427 WeakPolarHBondContact O-CD1 3.32Å; H421-L427 WeakPolarHBondContact O-CD2 3.24Å; H421-L427 WeakPolarHBondContact O-CG 3.48Å
422	K	84	Confident	81.1	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.717	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-10.4	169.8	-59.1	-179.3	-179.6	-178.2	0	112.3	R419 L420 P424	R419-K422 WeakPolarHBondContact O-CB 3.49Å; R419-K422 PolarHBondContact O-N 2.98Å; R419-K422 VanDerWaalsContact O-N 3.12Å; L420-K422 PolarHBondContact O-N 3.31Å; K422-P424 WeakPolarHBondContact O-CD 3.45Å
423	D	83.2	Confident	80.5	Confident	29 Å²	29	71.5 Å²	71.5	16%	0.155	34%	0.342	C	S	.	.			trans	-77.7	122.3	178.4	-176.1	-75.9	0	0	0	110.1	T313 R317 L420 E425 I426 L427	T313-D423 HydrophobicContact CG2-CB 4.32Å; T313-D423 WeakPolarHBondContact CG2-OD2 3.22Å; R317-D423 IonicContact CZ-OD2 2.93Å; R317-D423 IonicContact NE-OD1 3.51Å; R317-D423 PolarHBondContact NE-OD1 3.42Å; R317-D423 IonicContact NE-OD2 3.7Å; R317-D423 IonicContact NH2-OD1 3.13Å; R317-D423 IonicContact NH2-OD2 3.57Å; R317-D423 PolarHBondContact NH2-OD2 3.35Å; L420-D423 VanDerWaalsContact O-CB 3.31Å; L420-D423 WeakPolarHBondContact O-CB 3.3Å; L420-D423 PolarHBondContact O-N 3.34Å; D423-E425 VanDerWaalsContact C-N 3.29Å; D423-E425 PolarHBondContact O-N 2.86Å; D423-E425 WeakPolarHBondContact OD1-CA 3.4Å; D423-E425 WeakPolarHBondContact OD1-CB 3.46Å; D423-E425 PolarHBondContact OD1-N 3.38Å; D423-I426 HydrophobicContact CB-CB 3.99Å; D423-I426 HydrophobicContact CB-CG1 3.7Å; D423-I426 PolarHBondContact O-N 2.82Å; D423-I426 PolarHBondContact OD1-N 3.15Å; D423-L427 PolarHBondContact O-N 3.03Å
424	P	83.9	Confident	79.3	Confident	97 Å²	97	72.5 Å²	72.5	63%	0.63	35%	0.348	S	S	*	.	H	α-helix	trans	-60.8	-34.7	-176.2	-25.5	34.4	0	0	0	114	K422 L427 K428	K422-P424 WeakPolarHBondContact O-CD 3.45Å; P424-L427 PolarHBondContact O-N 3.4Å; P424-K428 WeakPolarHBondContact O-CB 3.47Å; P424-K428 PolarHBondContact O-N 2.72Å
425	E	82.1	Confident	77.5	Confident	80 Å²	80	72.2 Å²	72.2	37%	0.374	36%	0.357	S	S	.	.	H	α-helix	trans	-72.1	-39	179.2	-75.7	-70.4	123.1	0	0	111	R321 D423 K428 I429	R321-E425 IonicContact NH2-OE2 2.82Å; R321-E425 PolarHBondContact NH2-OE2 2.77Å; D423-E425 VanDerWaalsContact C-N 3.29Å; D423-E425 PolarHBondContact O-N 2.86Å; D423-E425 WeakPolarHBondContact OD1-CA 3.4Å; D423-E425 WeakPolarHBondContact OD1-CB 3.46Å; D423-E425 PolarHBondContact OD1-N 3.38Å; E425-K428 WeakPolarHBondContact O-CB 3.11Å; E425-K428 PolarHBondContact O-N 2.99Å; E425-I429 WeakPolarHBondContact O-CD1 3.48Å; E425-I429 WeakPolarHBondContact O-CG1 3.42Å; E425-I429 PolarHBondContact O-N 3.05Å
426	I	82.9	Confident	75.4	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-49.2	172.7	-62.2	-74.6	0	0	0	109.8	R317 L320 L420 D423 K428 I429 L430	R317-I426 HydrophobicContact CB-CD1 4.37Å; R317-I426 HydrophobicContact CG-CD1 3.46Å; R317-I426 VanDerWaalsContact CG-CD1 3.46Å; R317-I426 HydrophobicContact CG-CG1 4.1Å; L320-I426 HydrophobicContact CD1-CD1 3.39Å; L320-I426 HydrophobicContact CD1-CG2 3.98Å; L420-I426 WeakPolarHBondContact O-CB 3.39Å; L420-I426 WeakPolarHBondContact O-CG2 3.44Å; D423-I426 HydrophobicContact CB-CB 3.99Å; D423-I426 HydrophobicContact CB-CG1 3.7Å; D423-I426 PolarHBondContact O-N 2.82Å; D423-I426 PolarHBondContact OD1-N 3.15Å; I426-K428 VanDerWaalsContact C-N 3.27Å; I426-K428 PolarHBondContact O-N 3.31Å; I426-I429 PolarHBondContact O-N 3.28Å; I426-I429 VanDerWaalsContact O-N 3.08Å; I426-L430 HydrophobicContact CG2-CD1 3.81Å; I426-L430 HydrophobicContact CG2-CG 4.13Å; I426-L430 VanDerWaalsContact O-CG 3.29Å; I426-L430 WeakPolarHBondContact O-CG 3.49Å; I426-L430 PolarHBondContact O-N 3.26Å
427	L	82.9	Confident	73	Confident	66 Å²	66	77.5 Å²	77.5	35%	0.346	39%	0.393	S	S	.	.	H	α-helix	trans	-56.6	-41.7	176.6	-75.2	172.6	0	0	0	112	H421 D423 P424 L430 N431	H421-L427 WeakPolarHBondContact O-CD1 3.32Å; H421-L427 WeakPolarHBondContact O-CD2 3.24Å; H421-L427 WeakPolarHBondContact O-CG 3.48Å; D423-L427 PolarHBondContact O-N 3.03Å; P424-L427 PolarHBondContact O-N 3.4Å; L427-L430 PolarHBondContact O-N 3.29Å; L427-N431 VanDerWaalsContact O-CB 3.26Å; L427-N431 WeakPolarHBondContact O-CB 3.26Å; L427-N431 PolarHBondContact O-N 3.2Å; L427-N431 PolarHBondContact O-ND2 2.92Å
428	K	84	Confident	70.9	Confident	141 Å²	141	83.8 Å²	83.8	61%	0.613	42%	0.42	S	S	*	.	H	α-helix	trans	-61.1	-44.9	175.2	-171	-179.9	-178.9	179.7	0	112.1	P424 E425 I426 S432	P424-K428 WeakPolarHBondContact O-CB 3.47Å; P424-K428 PolarHBondContact O-N 2.72Å; E425-K428 WeakPolarHBondContact O-CB 3.11Å; E425-K428 PolarHBondContact O-N 2.99Å; I426-K428 VanDerWaalsContact C-N 3.27Å; I426-K428 PolarHBondContact O-N 3.31Å; K428-S432 WeakPolarHBondContact O-CB 3.21Å; K428-S432 PolarHBondContact O-N 3.46Å; K428-S432 PolarHBondContact O-OG 2.59Å
429	I	81.6	Confident	68.5	Low	13 Å²	13	86.7 Å²	86.7	7%	0.067	44%	0.443	C	S	.	.	H	α-helix	trans	-62.7	-45.6	176.9	-64	158.3	0	0	0	110.3	R317 L320 R321 E425 I426 S432 R433	R317-I429 HydrophobicContact CB-CD1 4.46Å; R317-I429 HydrophobicContact CG-CD1 4.41Å; L320-I429 HydrophobicContact CB-CG2 3.99Å; R321-I429 HydrophobicContact CG-CD1 3.97Å; R321-I429 HydrophobicContact CG-CG1 4.31Å; E425-I429 WeakPolarHBondContact O-CD1 3.48Å; E425-I429 WeakPolarHBondContact O-CG1 3.42Å; E425-I429 PolarHBondContact O-N 3.05Å; I426-I429 PolarHBondContact O-N 3.28Å; I426-I429 VanDerWaalsContact O-N 3.08Å; I429-S432 PolarHBondContact O-N 2.82Å; I429-S432 PolarHBondContact O-OG 3.28Å; I429-R433 PolarHBondContact O-N 3.43Å
430	L	79.4	Confident	66	Low	12 Å²	12	88.1 Å²	88.1	6%	0.063	45%	0.449	C	S	.	.	H	α-helix	trans	-64.3	-46.1	179.2	-65	177.6	0	0	0	111.7	T280 L320 I426 L427 S432 R433 Q434	T280-L430 HydrophobicContact CG2-CD2 3.45Å; T280-L430 VanDerWaalsContact CG2-CD2 3.45Å; L320-L430 HydrophobicContact CD2-CD2 4.14Å; I426-L430 HydrophobicContact CG2-CD1 3.81Å; I426-L430 HydrophobicContact CG2-CG 4.13Å; I426-L430 VanDerWaalsContact O-CG 3.29Å; I426-L430 WeakPolarHBondContact O-CG 3.49Å; I426-L430 PolarHBondContact O-N 3.26Å; L427-L430 PolarHBondContact O-N 3.29Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 2.72Å; L430-R433 WeakPolarHBondContact O-CB 3.38Å; L430-R433 PolarHBondContact O-N 2.69Å; L430-Q434 PolarHBondContact O-N 2.87Å; L430-Q434 VanDerWaalsContact O-N 3.15Å
431	N	79	Confident	63.6	Low	90 Å²	90	95.7 Å²	95.7	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-64.7	-36.4	179.7	-70.3	-12.4	0	0	0	112.2	L427 R433 Q434	L427-N431 VanDerWaalsContact O-CB 3.26Å; L427-N431 WeakPolarHBondContact O-CB 3.26Å; L427-N431 PolarHBondContact O-N 3.2Å; L427-N431 PolarHBondContact O-ND2 2.92Å; N431-R433 PolarHBondContact O-N 3.36Å; N431-Q434 PolarHBondContact O-N 2.82Å
432	S	75.2	Confident	61.3	Low	81 Å²	81	101.1 Å²	101.1	57%	0.566	51%	0.509	S	S	*	.	H	α-helix	trans	-64.4	-18.7	174	67.6	0	0	0	0	113.9	K428 I429 L430 T435	K428-S432 WeakPolarHBondContact O-CB 3.21Å; K428-S432 PolarHBondContact O-N 3.46Å; K428-S432 PolarHBondContact O-OG 2.59Å; I429-S432 PolarHBondContact O-N 2.82Å; I429-S432 PolarHBondContact O-OG 3.28Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 2.72Å; S432-T435 PolarHBondContact O-OG1 3.35Å
433	R	65.7	Low	58.7	Low	85 Å²	85	96 Å²	96	32%	0.321	50%	0.504	S	S	.	.	H	α-helix	trans	-96.2	-22.4	178.4	-69.6	175.2	175.8	-85.5	-4.6	113.3	L320 I429 L430 N431 T435 L436	L320-R433 PolarHBondContact O-NE 3.01Å; L320-R433 PolarHBondContact O-NH2 3.21Å; I429-R433 PolarHBondContact O-N 3.43Å; L430-R433 WeakPolarHBondContact O-CB 3.38Å; L430-R433 PolarHBondContact O-N 2.69Å; N431-R433 PolarHBondContact O-N 3.36Å; R433-T435 PolarHBondContact O-N 3.46Å; R433-T435 VanDerWaalsContact O-N 3.09Å; R433-L436 PolarHBondContact O-N 3.47Å; R433-L436 VanDerWaalsContact O-N 3.14Å
434	Q	53.8	Low	56.1	Low	135 Å²	135	103.5 Å²	103.5	63%	0.631	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-2.6	179.8	-76.8	-175.8	3.3	0	0	114.3	L430 N431 L436	L430-Q434 PolarHBondContact O-N 2.87Å; L430-Q434 VanDerWaalsContact O-N 3.15Å; N431-Q434 PolarHBondContact O-N 2.82Å; Q434-L436 PolarHBondContact O-N 3.31Å
435	T	38.4	Very low	53.7	Low	125 Å²	125	109.1 Å²	109.1	77%	0.767	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-3.6	166.6	50.1	0	0	0	0	113.3	S432 R433	S432-T435 PolarHBondContact O-OG1 3.35Å; R433-T435 PolarHBondContact O-N 3.46Å; R433-T435 VanDerWaalsContact O-N 3.09Å
436	L	37.4	Very low	52.3	Low	107 Å²	107	110.6 Å²	110.6	56%	0.56	58%	0.584	S	S	*	*	S	Bend	trans	-89.2	129	167.3	-67	167.5	0	0	0	109.9	R433 Q434 F438	R433-L436 PolarHBondContact O-N 3.47Å; R433-L436 VanDerWaalsContact O-N 3.14Å; Q434-L436 PolarHBondContact O-N 3.31Å; L436-F438 PolarHBondContact O-N 3.28Å
437	P	31.8	Very low	50.7	Low	119 Å²	119	116.3 Å²	116.3	77%	0.773	62%	0.615	S	S	*	*	S	Bend	trans	-73.5	95.8	-160.2	30	-34.7	0	0	0	111.3
438	F	35.3	Very low	48.9	Very low	131 Å²	131	119.1 Å²	119.1	58%	0.575	63%	0.63	S	S	*	*			trans	-142.6	53.5	170.1	-119.9	-88.3	0	0	0	112.2	L436 R440	L436-F438 PolarHBondContact O-N 3.28Å; F438-R440 VanDerWaalsContact C-N 3.34Å; F438-R440 PolarHBondContact O-N 3.14Å
439	T	31	Very low	46.8	Very low	139 Å²	139	117.8 Å²	117.8	85%	0.853	63%	0.631	S	S	*	*			trans	-90.1	73.6	155.6	53.3	0	0	0	0	108.9
440	R	30.6	Very low	44.7	Very low	190 Å²	190	124.4 Å²	124.4	72%	0.717	67%	0.666	S	S	*	*			trans	-99.1	104.6	150	-94.9	-176	174.4	173.5	-0.7	106.1	F438 Y442	F438-R440 VanDerWaalsContact C-N 3.34Å; F438-R440 PolarHBondContact O-N 3.14Å; R440-Y442 VanDerWaalsContact C-N 3.26Å; R440-Y442 HydrophobicContact CB-CD2 4.29Å; R440-Y442 HydrophobicContact CB-CE2 3.85Å; R440-Y442 VanDerWaalsContact O-CD2 3.25Å; R440-Y442 WeakPolarHBondContact O-CD2 3.47Å; R440-Y442 PolarHBondContact O-N 3.09Å
441	N	31.3	Very low	42.3	Very low	164 Å²	164	131.9 Å²	131.9	88%	0.877	71%	0.706	S	S	*	*			trans	-50.3	92.5	165.9	-79.6	-29.9	0	0	0	108.7	G443	N441-G443 VanDerWaalsContact C-N 3.26Å; N441-G443 PolarHBondContact O-N 2.93Å
442	Y	33.3	Very low	39.7	Very low	154 Å²	154	134.9 Å²	134.9	60%	0.604	72%	0.722	S	S	*	*			trans	-81	90.7	159	-72.2	-80.1	0	0	0	105.3	R440	R440-Y442 VanDerWaalsContact C-N 3.26Å; R440-Y442 HydrophobicContact CB-CD2 4.29Å; R440-Y442 HydrophobicContact CB-CE2 3.85Å; R440-Y442 VanDerWaalsContact O-CD2 3.25Å; R440-Y442 WeakPolarHBondContact O-CD2 3.47Å; R440-Y442 PolarHBondContact O-N 3.09Å
443	G	30.4	Very low	37	Very low	58 Å²	58	139 Å²	139	60%	0.598	73%	0.734	S	S	*	*			trans	-53	140.5	169.2	0	0	0	0	0	109.4	N441 V445	N441-G443 VanDerWaalsContact C-N 3.26Å; N441-G443 PolarHBondContact O-N 2.93Å; G443-V445 PolarHBondContact O-N 3.47Å; G443-V445 VanDerWaalsContact O-N 3.12Å
444	L	28.5	Very low	34.6	Very low	185 Å²	185	143.5 Å²	143.5	97%	0.969	77%	0.769	S	S	*	*			trans	-48	116.9	165.5	-71.5	152.1	0	0	0	108.3
445	V	33.3	Very low	32.9	Very low	215 Å²	215	144.3 Å²	144.3	100%	1.303	78%	0.781	S	S	*	*			trans	-106.7	0	160.6	-176.1	0	0	0	0	107.4	G443	G443-V445 PolarHBondContact O-N 3.47Å; G443-V445 VanDerWaalsContact O-N 3.12Å

Retrieved 445 of 445 residues in 124.4 ms (Link to these results)

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