A0A096MNX3_PAPAN Loading...

E3 ubiquitin-protein ligase MARCHF3

E3 ubiquitin-protein ligase which may be involved in endosomal trafficking. E3 ubiquitin ligases accept ubiquitin from an E2 ubiquitin-conjugating enzyme in the form of a thioester and then directly transfer the ubiquitin to targeted substrates.

AlphaFold DB (A0A2K5WT38), UniProt , Accession A0A096MNX3, Species PAPAN (Papio anubis, Olive baboon), Gene MARCHF3, Length 253 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	32.9	Very low	250 Å²	250	158.5 Å²	158.5	100%	1.232	86%	0.855	S	S	*	*				0	107.5	0	-75.2	171.8	170.9	0	0	107.6
2	T	35.1	Very low	32.6	Very low	133 Å²	133	157.8 Å²	157.8	82%	0.816	86%	0.86	S	S	*	*			trans	-109.7	136.8	-176.4	38.2	0	0	0	0	109.7
3	T	32.4	Very low	32.3	Very low	133 Å²	133	157.2 Å²	157.2	82%	0.816	85%	0.854	S	S	*	*			trans	-172.9	119.3	150.8	47.4	0	0	0	0	106.4
4	S	33.3	Very low	33.4	Very low	111 Å²	111	152.7 Å²	152.7	78%	0.776	84%	0.837	S	S	*	*			cis	64.2	109.5	44.6	80.6	0	0	0	0	115.5
5	R	31.7	Very low	32.8	Very low	257 Å²	257	153.7 Å²	153.7	97%	0.97	84%	0.841	S	S	*	*			trans	-160.3	130.7	142.4	-123	177.8	-164.8	-179.1	4.2	113.6
6	C	30.5	Very low	32.6	Very low	117 Å²	117	151.4 Å²	151.4	79%	0.791	84%	0.838	S	S	*	*			trans	-110.4	150.2	173	-116.9	0	0	0	0	109.5
7	S	34.3	Very low	32.3	Very low	97 Å²	97	151.1 Å²	151.1	68%	0.678	84%	0.841	S	S	*	*			trans	57	134.2	144	53	0	0	0	0	122.5
8	H	30.4	Very low	32.3	Very low	194 Å²	194	148.8 Å²	148.8	90%	0.898	84%	0.837	S	S	*	*				-169.2	137.1	127	-95.7	-72	0	0	0	112
9	L	30.8	Very low	32.2	Very low	152 Å²	152	146.6 Å²	146.6	80%	0.796	83%	0.832	S	S	*	*			trans	-102.1	164.5	165.3	-132.4	119	0	0	0	108.6
10	P	36.6	Very low	32.1	Very low	131 Å²	131	144.2 Å²	144.2	85%	0.851	83%	0.831	S	S	*	*				-152.9	179.7	103.8	35.9	-14.3	0	0	0	117.2
11	E	30	Very low	32.1	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	83%	0.829	S	S	*	*			trans	-94.1	154.5	-161.5	177.2	-174.4	130.7	0	0	116.1
12	V	28.8	Very low	32.1	Very low	150 Å²	150	135.5 Å²	135.5	91%	0.909	81%	0.806	S	S	*	*			trans	-152	141.3	159.4	-176.2	0	0	0	0	112.1
13	L	29.1	Very low	31.8	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	81%	0.811	S	S	*	*			trans	-109.7	-163.3	-173.5	-159.8	83.8	0	0	0	112.3
14	P	48	Very low	31.9	Very low	95 Å²	95	135.9 Å²	135.9	62%	0.617	81%	0.808	S	S	*	*				-114.5	-175.1	-104.1	41.8	-24.1	0	0	0	116.2
15	D	24.5	Very low	31.6	Very low	168 Å²	168	139.5 Å²	139.5	90%	0.898	81%	0.81	S	S	*	*			trans	-156.8	148.6	149.6	-106.4	-28.8	0	0	0	114.7
16	C	29.6	Very low	31.5	Very low	116 Å²	116	133.8 Å²	133.8	78%	0.784	80%	0.804	S	S	*	*			trans	-124.1	151.2	-177.7	-61.2	0	0	0	0	111.9
17	T	27.2	Very low	31.8	Very low	146 Å²	146	134.7 Å²	134.7	90%	0.896	81%	0.805	S	S	*	*			trans	-157.8	146.2	155.5	-52.7	0	0	0	0	113.1
18	S	31.4	Very low	31.4	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	82%	0.816	S	S	*	*			trans	-74.7	178.6	-173.8	54.4	0	0	0	0	115.9
19	S	30.6	Very low	31.3	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	81%	0.811	S	S	*	*			cis	-178.8	156.1	37.4	-166	0	0	0	0	114.2
20	A	30.4	Very low	31.3	Very low	98 Å²	98	136.1 Å²	136.1	81%	0.81	82%	0.815	S	S	*	*			trans	51.8	150.4	144.7	0	0	0	0	0	123.4
21	A	31.8	Very low	31.4	Very low	94 Å²	94	132.7 Å²	132.7	78%	0.777	80%	0.804	S	S	*	*			cis	-174.1	-164.9	-13.3	0	0	0	0	0	108.3
22	P	38.1	Very low	31.4	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	81%	0.809	S	S	*	*				-117.3	170.5	-121.4	36.9	-16.9	0	0	0	118.2
23	V	27.9	Very low	31.7	Very low	150 Å²	150	131.9 Å²	131.9	91%	0.909	81%	0.809	S	S	*	*			trans	-143.2	134.6	163.6	176.2	0	0	0	0	111.8
24	V	34.1	Very low	31.8	Very low	124 Å²	124	131.1 Å²	131.1	75%	0.752	81%	0.81	S	S	*	*			trans	-104.8	144.7	178.1	169.1	0	0	0	0	110
25	K	27.6	Very low	31.1	Very low	188 Å²	188	133.7 Å²	133.7	82%	0.817	82%	0.819	S	S	*	*			trans	177.4	128.7	133.9	-101.2	169.4	-173.6	-179.8	0	117.1
26	T	29.1	Very low	32.1	Very low	137 Å²	137	129.9 Å²	129.9	84%	0.84	82%	0.819	S	S	*	*			trans	69.4	139	139.3	43.9	0	0	0	0	123.6
27	V	36.7	Very low	32.4	Very low	135 Å²	135	132 Å²	132	82%	0.818	82%	0.817	S	S	*	*			trans	-83.3	144.5	-176.3	170.8	0	0	0	0	111.6
28	E	26.8	Very low	32.6	Very low	196 Å²	196	130.9 Å²	130.9	92%	0.916	81%	0.812	S	S	*	*			trans	-146.6	134.4	143.1	-102.2	-179.1	148.2	0	0	110.1
29	D	29.1	Very low	32.6	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	81%	0.811	S	S	*	*			trans	-90.4	136.5	178.6	176.3	33.7	0	0	0	109.9
30	C	29.9	Very low	33.3	Very low	129 Å²	129	138 Å²	138	87%	0.872	81%	0.814	S	S	*	*			trans	-154.6	105.6	158.5	-137.4	0	0	0	0	109.3
31	G	38.7	Very low	34	Very low	60 Å²	60	138.4 Å²	138.4	62%	0.619	81%	0.807	S	S	*	*			trans	-68.9	147.7	177.7	0	0	0	0	0	113.4
32	S	29.2	Very low	34.7	Very low	128 Å²	128	141.6 Å²	141.6	90%	0.895	81%	0.807	S	S	*	*			trans	-158.5	126.3	154.6	-80.4	0	0	0	0	111.1
33	L	35.9	Very low	34.9	Very low	173 Å²	173	144.6 Å²	144.6	91%	0.906	81%	0.811	S	S	*	*			trans	-79.8	132.3	171.4	-102.5	83.1	0	0	0	110.6
34	V	31.4	Very low	35.5	Very low	134 Å²	134	142.4 Å²	142.4	81%	0.812	80%	0.798	S	S	*	*			trans	-154.2	134.2	137.6	166.3	0	0	0	0	109
35	N	34	Very low	36	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	80%	0.801	S	S	*	*	S	Bend	trans	76.5	62.5	176.6	-76.9	3.1	0	0	0	119.2	Q37	N35-Q37 PolarHBondContact O-N 3.28Å
36	G	44.1	Very low	36.9	Very low	87 Å²	87	137 Å²	137	90%	0.897	79%	0.794	S	S	*	*				59.2	26	121.2	0	0	0	0	0	120.5
37	Q	36.8	Very low	37.9	Very low	160 Å²	160	139.5 Å²	139.5	75%	0.748	79%	0.793	S	S	*	*			trans	-128.2	129.5	164.2	-85.3	-175.5	-80.6	0	0	110.1	N35 Q39	N35-Q37 PolarHBondContact O-N 3.28Å; Q37-Q39 PolarHBondContact O-N 3.08Å; Q37-Q39 VanDerWaalsContact O-N 3.08Å
38	P	32	Very low	38.5	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	79%	0.792	S	S	*	*			trans	-76.2	93.5	161.2	30.1	-27.2	0	0	0	107.7	Y40	P38-Y40 PolarHBondContact O-N 3.38Å
39	Q	31.4	Very low	39.9	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	78%	0.784	S	S	*	*			trans	-73.8	98.2	159.4	-84.3	-172.5	-20.4	0	0	107.5	Q37 V41	Q37-Q39 PolarHBondContact O-N 3.08Å; Q37-Q39 VanDerWaalsContact O-N 3.08Å; Q39-V41 PolarHBondContact O-N 2.77Å
40	Y	44.4	Very low	40.7	Very low	206 Å²	206	136.5 Å²	136.5	81%	0.808	79%	0.79	S	S	*	*			trans	-82	105.8	161.2	69.6	-86.4	0	0	0	107.1	P38	P38-Y40 PolarHBondContact O-N 3.38Å
41	V	45	Very low	41.3	Very low	107 Å²	107	138.3 Å²	138.3	65%	0.648	79%	0.79	S	S	*	*			trans	-96.8	100.6	166.9	-179.6	0	0	0	0	106	Q39 Q43	Q39-V41 PolarHBondContact O-N 2.77Å; V41-Q43 HydrophobicContact CG1-CG 4.2Å; V41-Q43 PolarHBondContact O-N 2.76Å
42	M	47.2	Very low	41.3	Very low	160 Å²	160	141.9 Å²	141.9	79%	0.788	79%	0.794	S	S	*	*			trans	-80.2	106.9	170.2	-125.6	175.4	95	0	0	107.8	V44	M42-V44 HydrophobicContact CE-CG2 4.31Å
43	Q	40.9	Very low	41.8	Very low	182 Å²	182	141 Å²	141	85%	0.85	79%	0.788	S	S	*	*			trans	-83.8	115.8	166.7	-67.3	-137.4	-33.5	0	0	108.8	V41	V41-Q43 HydrophobicContact CG1-CG 4.2Å; V41-Q43 PolarHBondContact O-N 2.76Å
44	V	40.4	Very low	42.3	Very low	103 Å²	103	137.8 Å²	137.8	62%	0.624	78%	0.776	S	S	*	*			trans	-94.4	108.8	173.1	-176.3	0	0	0	0	107.4	M42	M42-V44 HydrophobicContact CE-CG2 4.31Å
45	S	44.9	Very low	43.1	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	77%	0.774	S	S	*	*			trans	-81	115.8	167.8	-172.5	0	0	0	0	108.5	K47	S45-K47 PolarHBondContact O-N 2.87Å
46	A	47.3	Very low	43.6	Very low	82 Å²	82	135.2 Å²	135.2	68%	0.678	77%	0.765	S	S	*	*			trans	-76.7	111.4	173.2	0	0	0	0	0	109
47	K	49.5	Very low	43.6	Very low	188 Å²	188	141.6 Å²	141.6	82%	0.817	76%	0.762	S	S	*	*	S	Bend	trans	-95.1	115.4	151.5	-134.6	-178.6	178.1	-173.8	0	105.2	S45	S45-K47 PolarHBondContact O-N 2.87Å
48	D	49.9	Very low	43.9	Very low	148 Å²	148	140 Å²	140	79%	0.791	76%	0.763	S	S	*	*	S	Bend	trans	80	97.5	179.4	-41.6	-35.1	0	0	0	113.4	Q50	D48-Q50 PolarHBondContact O-N 2.91Å
49	G	55.6	Low	44.6	Very low	72 Å²	72	141.6 Å²	141.6	74%	0.742	76%	0.764	S	S	*	*			trans	-65	120.3	-169	0	0	0	0	0	114.7
50	Q	46.6	Very low	45.4	Very low	197 Å²	197	138 Å²	138	92%	0.921	76%	0.762	S	S	*	*			trans	-154.9	149.8	144.9	-150.4	135.3	27.7	0	0	111.8	D48	D48-Q50 PolarHBondContact O-N 2.91Å
51	L	41.3	Very low	45.1	Very low	167 Å²	167	134.3 Å²	134.3	87%	0.874	76%	0.761	S	S	*	*			trans	-84.4	134.8	-154.8	-156.2	149.7	0	0	0	113.7
52	L	39.8	Very low	45.2	Very low	135 Å²	135	137.3 Å²	137.3	71%	0.707	77%	0.768	S	S	*	*			trans	-77.7	129.1	176.6	-79.2	162.1	0	0	0	112.1
53	S	39.6	Very low	44.9	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	74%	0.744	S	S	*	*			trans	-103.2	98.3	154.6	63.2	0	0	0	0	109.2	V55	S53-V55 PolarHBondContact O-N 3.42Å
54	T	46.7	Very low	45.3	Very low	104 Å²	104	128.3 Å²	128.3	64%	0.638	74%	0.738	S	S	*	*			trans	-78.8	96.1	170.1	-51.7	0	0	0	0	107.7	V56	T54-V56 HydrophobicContact CG2-CG2 3.54Å; T54-V56 PolarHBondContact O-N 3.22Å
55	V	48	Very low	45.8	Very low	127 Å²	127	132.3 Å²	132.3	77%	0.77	75%	0.748	S	S	*	*			trans	-70.9	91.6	158.8	178.7	0	0	0	0	106.3	S53 R57	S53-V55 PolarHBondContact O-N 3.42Å; V55-R57 VanDerWaalsContact C-N 3.32Å; V55-R57 PolarHBondContact O-N 3.38Å
56	V	43.3	Very low	46.1	Very low	102 Å²	102	133 Å²	133	62%	0.618	74%	0.742	S	S	*	*			trans	-67	96	168.3	-179.6	0	0	0	0	106.7	T54 T58	T54-V56 HydrophobicContact CG2-CG2 3.54Å; T54-V56 PolarHBondContact O-N 3.22Å; V56-T58 HydrophobicContact CG1-CG2 4.18Å; V56-T58 PolarHBondContact O-N 3.16Å; V56-T58 VanDerWaalsContact O-N 3.16Å
57	R	44.8	Very low	46.9	Very low	222 Å²	222	135.1 Å²	135.1	84%	0.838	74%	0.742	S	S	*	*			trans	-74.8	98.3	162.2	-154.8	179.6	-168	104.9	-1.1	105.7	V55 L59	V55-R57 VanDerWaalsContact C-N 3.32Å; V55-R57 PolarHBondContact O-N 3.38Å; R57-L59 VanDerWaalsContact C-N 3.27Å; R57-L59 PolarHBondContact O-N 3.03Å
58	T	42.7	Very low	48.1	Very low	125 Å²	125	135 Å²	135	77%	0.767	74%	0.737	S	S	*	*			trans	-62.4	92.9	169.9	26.2	0	0	0	0	108.1	V56 A60	V56-T58 HydrophobicContact CG1-CG2 4.18Å; V56-T58 PolarHBondContact O-N 3.16Å; V56-T58 VanDerWaalsContact O-N 3.16Å; T58-A60 VanDerWaalsContact C-N 3.33Å; T58-A60 PolarHBondContact O-N 2.88Å
59	L	47.9	Very low	49.7	Very low	157 Å²	157	131.2 Å²	131.2	82%	0.822	72%	0.72	S	S	*	*			trans	-61.2	104.1	156.9	-89.2	158	0	0	0	105.6	R57 T61	R57-L59 VanDerWaalsContact C-N 3.27Å; R57-L59 PolarHBondContact O-N 3.03Å; L59-T61 VanDerWaalsContact C-N 3.26Å; L59-T61 PolarHBondContact O-N 2.97Å
60	A	47.4	Very low	51.3	Low	86 Å²	86	132.4 Å²	132.4	71%	0.711	71%	0.708	S	S	*	*			trans	-59.4	95.8	168.2	0	0	0	0	0	107.6	T58 Q62	T58-A60 VanDerWaalsContact C-N 3.33Å; T58-A60 PolarHBondContact O-N 2.88Å; A60-Q62 VanDerWaalsContact C-N 3.29Å; A60-Q62 PolarHBondContact O-N 2.98Å
61	T	39.1	Very low	53.5	Low	128 Å²	128	123 Å²	123	79%	0.785	66%	0.664	S	S	*	*			trans	-58.9	99.8	157.9	-59.9	0	0	0	0	105.9	L59 S63	L59-T61 VanDerWaalsContact C-N 3.26Å; L59-T61 PolarHBondContact O-N 2.97Å; T61-S63 PolarHBondContact O-N 2.89Å
62	Q	45.6	Very low	55.9	Low	170 Å²	170	117.6 Å²	117.6	79%	0.794	63%	0.631	S	S	*	*			trans	-64.9	92.9	165.4	-68.8	179.8	22.4	0	0	106.5	A60	A60-Q62 VanDerWaalsContact C-N 3.29Å; A60-Q62 PolarHBondContact O-N 2.98Å
63	S	42.5	Very low	58.3	Low	40 Å²	40	114.2 Å²	114.2	28%	0.28	61%	0.613	S	S	.	*			trans	-74.2	132.9	164.4	62.4	0	0	0	0	107.6	T61 F65 N66	T61-S63 PolarHBondContact O-N 2.89Å; S63-F65 PolarHBondContact O-N 2.86Å; S63-N66 PolarHBondContact O-N 3.29Å; S63-N66 PolarHBondContact OG-ND2 3.36Å; S63-N66 VanDerWaalsContact OG-ND2 3.08Å
64	P	49.1	Very low	60.8	Low	113 Å²	113	111.1 Å²	111.1	73%	0.734	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	16.2	-179.3	29.1	-34.9	0	0	0	113.6
65	F	49.3	Very low	62.9	Low	188 Å²	188	112.8 Å²	112.8	83%	0.825	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-7.6	-177.6	-83.1	-85.5	0	0	0	113.8	S63	S63-F65 PolarHBondContact O-N 2.86Å
66	N	52.5	Low	64.9	Low	133 Å²	133	110.7 Å²	110.7	71%	0.711	57%	0.574	S	S	*	*	S	Bend	trans	-101.2	2	179.8	-79.2	-44.5	0	0	0	114.6	S63	S63-N66 PolarHBondContact O-N 3.29Å; S63-N66 PolarHBondContact OG-ND2 3.36Å; S63-N66 VanDerWaalsContact OG-ND2 3.08Å
67	D	63.5	Low	66.9	Low	125 Å²	125	106.7 Å²	106.7	67%	0.668	55%	0.553	S	S	*	*			trans	-94.4	9	-173	-64.7	-36.3	0	0	0	114.5
68	R	75.8	Confident	68.6	Low	186 Å²	186	99 Å²	99	70%	0.702	53%	0.533	S	S	*	.	S	Bend	trans	-79.1	125.4	176.2	-162.3	178.1	-67.6	-98.1	1	109	M70	R68-M70 PolarHBondContact O-N 3.13Å
69	P	82.2	Confident	70.1	Confident	68 Å²	68	97.9 Å²	97.9	44%	0.442	53%	0.53	S	S	.	.			trans	-61.5	131.6	178.3	25.5	-33.8	0	0	0	110	L83 T95	P69-L83 HydrophobicContact CB-CD2 4.23Å; P69-L83 WeakPolarHBondContact O-CD2 3.48Å; P69-T95 HydrophobicContact CB-CG2 4.01Å
70	M	90.3	Very high	71.3	Confident	98 Å²	98	98 Å²	98	48%	0.483	53%	0.526	S	S	.	.			trans	-117	148.6	178.9	-60.7	-169.9	-64.2	0	0	110.1	R68 R72 T95	R68-M70 PolarHBondContact O-N 3.13Å; M70-R72 PolarHBondContact O-N 2.85Å; M70-T95 PolarHBondContact O-OG1 3.16Å
71	C	91.9	Very high	73	Confident	0 Å²	0	96.8 Å²	96.8	0%	0	51%	0.506	C	S	.	.			trans	-70.5	127.4	178.1	175.5	0	0	0	0	109.9	I73 C74 H75 E76 L83 T95 H97	C71-I73 PolarHBondContact O-N 3.04Å; C71-I73 VanDerWaalsContact O-N 3.08Å; C71-C74 WeakPolarHBondContact CB-SG 3.29Å; C71-H75 WeakPolarHBondContact O-CA 3.33Å; C71-H75 PolarHBondContact O-N 2.94Å; C71-E76 WeakPolarHBondContact CB-O 3.27Å; C71-E76 PolarHBondContact N-O 3.18Å; C71-L83 HydrophobicContact CB-CD2 4.35Å; C71-L83 VanDerWaalsContact N-CD2 3.35Å; C71-T95 WeakPolarHBondContact CA-O 3.03Å; C71-H97 VanDerWaalsContact CB-CE1 3.48Å; C71-H97 WeakPolarHBondContact CB-CE1 3.3Å; C71-H97 VanDerWaalsContact CB-ND1 3.32Å; C71-H97 WeakPolarHBondContact CB-ND1 3.16Å; C71-H97 PolarHBondContact SG-N 2.95Å; C71-H97 VanDerWaalsContact SG-N 3.43Å; C71-H97 PolarHBondContact SG-ND1 2.84Å; C71-H97 VanDerWaalsContact SG-ND1 3.4Å
72	R	91.6	Very high	75.2	Confident	52 Å²	52	96.6 Å²	96.6	20%	0.196	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.8	-179.5	86.8	-173.3	177.5	98.7	-0.5	115	M70 L93 T95 I96 E114	M70-R72 PolarHBondContact O-N 2.85Å; R72-L93 VanDerWaalsContact CD-O 3.26Å; R72-L93 WeakPolarHBondContact CD-O 3.29Å; R72-T95 PolarHBondContact N-O 3.02Å; R72-I96 HydrophobicContact CG-CD1 4.21Å; R72-I96 HydrophobicContact CG-CG1 3.94Å; R72-E114 IonicContact CZ-OE1 3.17Å; R72-E114 IonicContact NH1-OE1 3.84Å; R72-E114 PolarHBondContact NH1-OE1 2.93Å; R72-E114 IonicContact NH2-OE1 2.78Å; R72-E114 PolarHBondContact NH2-OE1 3.28Å; R72-E114 VanDerWaalsContact NH2-OE1 3.12Å
73	I	91.1	Very high	77.3	Confident	64 Å²	64	90.2 Å²	90.2	33%	0.328	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-52.5	-174.1	-61.4	178.1	0	0	0	111	C71 I96 C100 W104	C71-I73 PolarHBondContact O-N 3.04Å; C71-I73 VanDerWaalsContact O-N 3.08Å; I73-I96 HydrophobicContact CD1-CG2 3.6Å; I73-I96 HydrophobicContact CG1-CG2 4.05Å; I73-C100 HydrophobicContact CB-CB 4Å; I73-C100 HydrophobicContact CD1-CB 3.84Å; I73-C100 HydrophobicContact CG1-CB 4.43Å; I73-C100 HydrophobicContact CG2-CB 4.14Å; I73-W104 HydrophobicContact CD1-CB 3.98Å; I73-W104 HydrophobicContact CD1-CG 4.37Å
74	C	91.8	Very high	79.5	Confident	46 Å²	46	90.8 Å²	90.8	31%	0.311	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-8.5	-179	62.6	0	0	0	0	113.6	C71 E76 H97	C71-C74 WeakPolarHBondContact CB-SG 3.29Å; C74-E76 PolarHBondContact O-N 3.43Å; C74-H97 PolarHBondContact SG-CE1 2.84Å; C74-H97 PolarHBondContact SG-ND1 2.84Å
75	H	90.9	Very high	81.4	Confident	138 Å²	138	89.5 Å²	89.5	64%	0.639	47%	0.465	S	S	*	.			trans	58.9	21.9	-175.9	-50.8	130.4	0	0	0	114.5	C71	C71-H75 WeakPolarHBondContact O-CA 3.33Å; C71-H75 PolarHBondContact O-N 2.94Å
76	E	89.4	Confident	83.3	Confident	84 Å²	84	82 Å²	82	39%	0.393	44%	0.436	S	S	.	.			trans	-99.1	153.6	174.2	-63.7	-179.6	-162.6	0	0	111.5	C71 C74 Q80	C71-E76 WeakPolarHBondContact CB-O 3.27Å; C71-E76 PolarHBondContact N-O 3.18Å; C74-E76 PolarHBondContact O-N 3.43Å; E76-Q80 PolarHBondContact OE2-NE2 2.67Å
77	G	85.5	Confident	85.1	Confident	18 Å²	18	76.4 Å²	76.4	19%	0.186	41%	0.406	C	S	.	.			trans	-80.5	-162.4	174.4	0	0	0	0	0	113.3	S79 L83 H97	G77-S79 PolarHBondContact O-N 3.32Å; G77-L83 VanDerWaalsContact C-CD1 3.44Å; G77-H97 PolarHBondContact O-CE1 2.81Å; G77-H97 PolarHBondContact O-NE2 3.48Å
78	S	81.4	Confident	86.4	Confident	61 Å²	61	77.6 Å²	77.6	43%	0.427	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	30.4	-177.2	66.5	0	0	0	0	114.2	E81 L83	S78-E81 WeakPolarHBondContact CA-O 3.49Å; S78-L83 VanDerWaalsContact N-CD1 3.27Å
79	S	73.6	Confident	87.1	Confident	100 Å²	100	69.8 Å²	69.8	70%	0.699	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-34.5	-174.1	51	0	0	0	0	113.2	G77	G77-S79 PolarHBondContact O-N 3.32Å
80	Q	72.9	Confident	87.5	Confident	159 Å²	159	72.5 Å²	72.5	74%	0.743	40%	0.397	S	S	*	.	S	Bend	trans	-103.1	-36.6	-178.6	-62.4	-167.8	54.3	0	0	113.2	E76	E76-Q80 PolarHBondContact OE2-NE2 2.67Å
81	E	83.1	Confident	87.3	Confident	61 Å²	61	70.9 Å²	70.9	29%	0.285	41%	0.405	S	S	.	.	S	Bend	trans	-150.3	150.2	-177.1	-179.9	169.7	-138.8	0	0	108.9	S78 H97 R98 S99	S78-E81 WeakPolarHBondContact CA-O 3.49Å; E81-H97 PolarHBondContact O-CD2 3.06Å; E81-H97 PolarHBondContact O-NE2 2.87Å; E81-R98 VanDerWaalsContact OE1-CB 3.28Å; E81-R98 WeakPolarHBondContact OE1-CB 3.14Å; E81-R98 PolarHBondContact OE2-N 3.3Å; E81-S99 VanDerWaalsContact OE2-CB 3.23Å; E81-S99 WeakPolarHBondContact OE2-CB 3.13Å; E81-S99 PolarHBondContact OE2-N 3.29Å; E81-S99 PolarHBondContact OE2-OG 2.78Å
82	D	85.4	Confident	87	Confident	125 Å²	125	75.3 Å²	75.3	67%	0.668	43%	0.433	S	S	*	.			trans	-64.6	141.9	175.9	-69.3	-32.9	0	0	0	111.4
83	L	89.6	Confident	86.8	Confident	35 Å²	35	77 Å²	77	18%	0.183	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.9	174.1	-76.2	82.6	0	0	0	109.7	P69 C71 G77 S78	P69-L83 HydrophobicContact CB-CD2 4.23Å; P69-L83 WeakPolarHBondContact O-CD2 3.48Å; C71-L83 HydrophobicContact CB-CD2 4.35Å; C71-L83 VanDerWaalsContact N-CD2 3.35Å; G77-L83 VanDerWaalsContact C-CD1 3.44Å; S78-L83 VanDerWaalsContact N-CD1 3.27Å
84	L	88.8	Confident	86.7	Confident	52 Å²	52	74 Å²	74	27%	0.272	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	153.6	-180	-59.1	162	0	0	0	109.3	P86 T95 I96 R98 I225	L84-P86 VanDerWaalsContact C-CD 3.41Å; L84-P86 VanDerWaalsContact O-CD 3.29Å; L84-P86 WeakPolarHBondContact O-CD 3.31Å; L84-T95 WeakPolarHBondContact O-CA 3.37Å; L84-I96 PolarHBondContact N-O 3.07Å; L84-I96 PolarHBondContact O-N 2.89Å; L84-R98 HydrophobicContact CD1-CB 3.63Å; L84-R98 HydrophobicContact CD1-CG 4.21Å; L84-I225 HydrophobicContact CD1-CD1 3.48Å; L84-I225 VanDerWaalsContact CD1-CD1 3.48Å; L84-I225 HydrophobicContact CD2-CD1 4.46Å
85	S	88.9	Confident	86.6	Confident	87 Å²	87	72.7 Å²	72.7	61%	0.608	42%	0.42	S	S	*	.			trans	-115.6	74.7	168.8	-59.4	0	0	0	0	110.2	C87 G94	S85-C87 VanDerWaalsContact C-N 3.27Å; S85-C87 PolarHBondContact O-N 3.39Å; S85-G94 WeakPolarHBondContact CA-O 3.45Å
86	P	88.3	Confident	86.7	Confident	31 Å²	31	66.2 Å²	66.2	20%	0.201	39%	0.391	C	S	.	.			trans	-81.8	-2.8	-169.9	32.6	-33.7	0	0	0	113.8	L84 L101 F118 F120	L84-P86 VanDerWaalsContact C-CD 3.41Å; L84-P86 VanDerWaalsContact O-CD 3.29Å; L84-P86 WeakPolarHBondContact O-CD 3.31Å; P86-L101 HydrophobicContact CB-CD2 4.11Å; P86-L101 HydrophobicContact CG-CD2 3.44Å; P86-L101 VanDerWaalsContact CG-CD2 3.44Å; P86-F118 VanDerWaalsContact O-CD1 3.3Å; P86-F118 WeakPolarHBondContact O-CD1 3.41Å; P86-F118 WeakPolarHBondContact O-CE1 3.41Å; P86-F120 HydrophobicContact CB-CD1 4.13Å; P86-F120 HydrophobicContact CB-CE1 3.81Å; P86-F120 HydrophobicContact CG-CE1 3.97Å; P86-F120 WeakPolarHBondContact O-CE1 3.14Å
87	C	91.8	Very high	86.9	Confident	14 Å²	14	62.5 Å²	62.5	10%	0.095	37%	0.373	C	S	.	.	S	Bend	trans	-135.2	172.3	178.9	66.3	0	0	0	0	111.4	S85 C89 C113 F118 F120	S85-C87 VanDerWaalsContact C-N 3.27Å; S85-C87 PolarHBondContact O-N 3.39Å; C87-C89 PolarHBondContact O-N 2.82Å; C87-C89 VanDerWaalsContact SG-SG 3.61Å; C87-C113 HydrophobicContact CB-CB 4.04Å; C87-F118 HydrophobicContact CB-CB 3.99Å; C87-F118 HydrophobicContact CB-CD1 4.21Å; C87-F118 HydrophobicContact CB-CG 4.32Å; C87-F120 HydrophobicContact CB-CE1 3.88Å; C87-F120 HydrophobicContact CB-CZ 4.04Å
88	E	90.8	Very high	87.1	Confident	151 Å²	151	64.9 Å²	64.9	71%	0.706	38%	0.376	S	S	*	.	S	Bend	trans	-83.1	15.6	-176.3	-59.2	179.3	175.7	0	0	114	F118	E88-F118 HydrophobicContact CG-CD2 4.18Å
89	C	90.9	Very high	87.5	Confident	22 Å²	22	65 Å²	65	15%	0.149	38%	0.377	C	S	.	.			trans	-70.1	136.4	175.6	-68	0	0	0	0	110.8	C87 L93 C113	C87-C89 PolarHBondContact O-N 2.82Å; C87-C89 VanDerWaalsContact SG-SG 3.61Å; C89-L93 HydrophobicContact CB-CB 4.23Å; C89-C113 VanDerWaalsContact SG-SG 3.68Å
90	T	89.5	Confident	88.4	Confident	125 Å²	125	61.3 Å²	61.3	77%	0.767	35%	0.351	S	S	*	.			trans	-87.5	149.2	-178.9	54	0	0	0	0	112.7
91	G	86.5	Confident	89.3	Confident	64 Å²	64	53.8 Å²	53.8	66%	0.66	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	68	-147.6	175.7	0	0	0	0	0	113.3	L93 G94	G91-L93 PolarHBondContact O-N 2.96Å; G91-G94 PolarHBondContact O-N 2.84Å; G91-G94 VanDerWaalsContact O-N 3.13Å
92	T	85.2	Confident	89.7	Confident	93 Å²	93	51.9 Å²	51.9	57%	0.571	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15.5	-177.2	52.8	0	0	0	0	114	G94 T95	T92-G94 VanDerWaalsContact C-N 3.29Å; T92-T95 PolarHBondContact O-OG1 3.13Å; T92-T95 VanDerWaalsContact O-OG1 3.06Å
93	L	87.1	Confident	89.9	Confident	88 Å²	88	51.7 Å²	51.7	46%	0.461	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-75.6	-18.4	175.1	-65.1	178.2	0	0	0	113	R72 C89 G91 L115	R72-L93 VanDerWaalsContact CD-O 3.26Å; R72-L93 WeakPolarHBondContact CD-O 3.29Å; C89-L93 HydrophobicContact CB-CB 4.23Å; G91-L93 PolarHBondContact O-N 2.96Å; L93-L115 HydrophobicContact CB-CD1 4.46Å
94	G	88.4	Confident	90	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.01	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-22.9	175.1	0	0	0	0	0	113.5	S85 G91 T92	S85-G94 WeakPolarHBondContact CA-O 3.45Å; G91-G94 PolarHBondContact O-N 2.84Å; G91-G94 VanDerWaalsContact O-N 3.13Å; T92-G94 VanDerWaalsContact C-N 3.29Å
95	T	91.3	Very high	90.1	Very high	17 Å²	17	50.1 Å²	50.1	10%	0.104	29%	0.29	C	S	.	.			trans	-92.1	117.5	-168.5	51.8	0	0	0	0	112.4	P69 M70 C71 R72 L84 T92	P69-T95 HydrophobicContact CB-CG2 4.01Å; M70-T95 PolarHBondContact O-OG1 3.16Å; C71-T95 WeakPolarHBondContact CA-O 3.03Å; R72-T95 PolarHBondContact N-O 3.02Å; L84-T95 WeakPolarHBondContact O-CA 3.37Å; T92-T95 PolarHBondContact O-OG1 3.13Å; T92-T95 VanDerWaalsContact O-OG1 3.06Å
96	I	92.7	Very high	90.1	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	144.8	-176.3	-42.1	176.3	0	0	0	110.6	R72 I73 L84 C100 L101	R72-I96 HydrophobicContact CG-CD1 4.21Å; R72-I96 HydrophobicContact CG-CG1 3.94Å; I73-I96 HydrophobicContact CD1-CG2 3.6Å; I73-I96 HydrophobicContact CG1-CG2 4.05Å; L84-I96 PolarHBondContact N-O 3.07Å; L84-I96 PolarHBondContact O-N 2.89Å; I96-C100 HydrophobicContact CG2-CB 4.03Å; I96-L101 HydrophobicContact CD1-CD1 4.32Å; I96-L101 HydrophobicContact CG2-CB 4.09Å
97	H	92.8	Very high	90	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.028	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	147.5	165.1	-61.1	123.5	0	0	0	112	C71 C74 G77 E81 S99 C100 L101	C71-H97 VanDerWaalsContact CB-CE1 3.48Å; C71-H97 WeakPolarHBondContact CB-CE1 3.3Å; C71-H97 VanDerWaalsContact CB-ND1 3.32Å; C71-H97 WeakPolarHBondContact CB-ND1 3.16Å; C71-H97 PolarHBondContact SG-N 2.95Å; C71-H97 VanDerWaalsContact SG-N 3.43Å; C71-H97 PolarHBondContact SG-ND1 2.84Å; C71-H97 VanDerWaalsContact SG-ND1 3.4Å; C74-H97 PolarHBondContact SG-CE1 2.84Å; C74-H97 PolarHBondContact SG-ND1 2.84Å; G77-H97 PolarHBondContact O-CE1 2.81Å; G77-H97 PolarHBondContact O-NE2 3.48Å; E81-H97 PolarHBondContact O-CD2 3.06Å; E81-H97 PolarHBondContact O-NE2 2.87Å; H97-S99 VanDerWaalsContact C-N 3.34Å; H97-S99 PolarHBondContact O-N 2.95Å; H97-C100 HydrophobicContact CB-CB 4.1Å; H97-C100 PolarHBondContact O-N 2.84Å; H97-L101 PolarHBondContact O-N 3.46Å
98	R	90.3	Very high	89.8	Confident	67 Å²	67	50.8 Å²	50.8	25%	0.253	30%	0.296	S	S	.	.	H	α-helix	trans	-59.5	-46.5	176.5	-173	-168.5	163	94.2	10.7	111.1	E81 L84 L101 E102 L223 I225	E81-R98 VanDerWaalsContact OE1-CB 3.28Å; E81-R98 WeakPolarHBondContact OE1-CB 3.14Å; E81-R98 PolarHBondContact OE2-N 3.3Å; L84-R98 HydrophobicContact CD1-CB 3.63Å; L84-R98 HydrophobicContact CD1-CG 4.21Å; R98-L101 PolarHBondContact O-N 2.75Å; R98-E102 IonicContact CZ-OE1 3.43Å; R98-E102 VanDerWaalsContact CZ-OE1 3.27Å; R98-E102 IonicContact NE-OE1 2.78Å; R98-E102 PolarHBondContact NE-OE1 3.4Å; R98-E102 VanDerWaalsContact NE-OE1 3.07Å; R98-E102 IonicContact NH2-OE1 3.72Å; R98-E102 PolarHBondContact NH2-OE1 2.99Å; R98-E102 WeakPolarHBondContact O-CB 3.46Å; R98-E102 WeakPolarHBondContact O-CG 3.28Å; R98-E102 PolarHBondContact O-N 3.44Å; R98-L223 HydrophobicContact CG-CD1 4.03Å; R98-L223 PolarHBondContact NH1-O 3.12Å; R98-L223 PolarHBondContact NH2-O 3.33Å; R98-I225 HydrophobicContact CG-CD1 4.37Å
99	S	90.6	Very high	89.7	Confident	63 Å²	63	47.8 Å²	47.8	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-43.7	179.2	54.7	0	0	0	0	112.4	E81 H97 E102 H103	E81-S99 VanDerWaalsContact OE2-CB 3.23Å; E81-S99 WeakPolarHBondContact OE2-CB 3.13Å; E81-S99 PolarHBondContact OE2-N 3.29Å; E81-S99 PolarHBondContact OE2-OG 2.78Å; H97-S99 VanDerWaalsContact C-N 3.34Å; H97-S99 PolarHBondContact O-N 2.95Å; S99-E102 PolarHBondContact O-N 2.92Å; S99-H103 VanDerWaalsContact O-CB 3.32Å; S99-H103 WeakPolarHBondContact O-CB 3.42Å; S99-H103 PolarHBondContact O-N 3.36Å
100	C	91.1	Very high	89.7	Confident	23 Å²	23	47.9 Å²	47.9	16%	0.155	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-42.6	176	-63.7	0	0	0	0	111.8	I73 I96 H97 H103 W104	I73-C100 HydrophobicContact CB-CB 4Å; I73-C100 HydrophobicContact CD1-CB 3.84Å; I73-C100 HydrophobicContact CG1-CB 4.43Å; I73-C100 HydrophobicContact CG2-CB 4.14Å; I96-C100 HydrophobicContact CG2-CB 4.03Å; H97-C100 HydrophobicContact CB-CB 4.1Å; H97-C100 PolarHBondContact O-N 2.84Å; C100-H103 PolarHBondContact O-N 3.35Å; C100-W104 WeakPolarHBondContact O-CB 3.28Å; C100-W104 PolarHBondContact O-N 2.64Å
101	L	92	Very high	89.8	Confident	2 Å²	2	43 Å²	43	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-44.4	177.9	-178.4	59.6	0	0	0	112	P86 I96 H97 R98 H103 W104 L105 F120 L223	P86-L101 HydrophobicContact CB-CD2 4.11Å; P86-L101 HydrophobicContact CG-CD2 3.44Å; P86-L101 VanDerWaalsContact CG-CD2 3.44Å; I96-L101 HydrophobicContact CD1-CD1 4.32Å; I96-L101 HydrophobicContact CG2-CB 4.09Å; H97-L101 PolarHBondContact O-N 3.46Å; R98-L101 PolarHBondContact O-N 2.75Å; L101-H103 VanDerWaalsContact C-N 3.29Å; L101-H103 PolarHBondContact O-N 3.08Å; L101-W104 HydrophobicContact CD1-CE3 4.27Å; L101-W104 PolarHBondContact O-N 2.89Å; L101-L105 HydrophobicContact CD1-CD1 3.97Å; L101-L105 HydrophobicContact CD1-CD2 4.5Å; L101-L105 HydrophobicContact CD1-CG 3.93Å; L101-L105 HydrophobicContact CG-CD1 3.86Å; L101-L105 HydrophobicContact CG-CG 4.28Å; L101-L105 WeakPolarHBondContact O-CB 3.41Å; L101-L105 VanDerWaalsContact O-CG 3.28Å; L101-L105 WeakPolarHBondContact O-CG 3.26Å; L101-L105 PolarHBondContact O-N 3.35Å; L101-F120 HydrophobicContact CD1-CE2 4.22Å; L101-F120 HydrophobicContact CD1-CZ 4.35Å; L101-F120 HydrophobicContact CD2-CE1 4.25Å; L101-F120 HydrophobicContact CD2-CZ 4.31Å; L101-L223 HydrophobicContact CB-CD1 3.97Å; L101-L223 HydrophobicContact CD2-CD1 3.63Å; L101-L223 HydrophobicContact CD2-CD2 4.08Å; L101-L223 HydrophobicContact CD2-CG 4.5Å; L101-L223 HydrophobicContact CG-CD1 3.81Å; L101-L223 HydrophobicContact CG-CD2 4.48Å
102	E	91.6	Very high	90.1	Very high	20 Å²	20	44.7 Å²	44.7	9%	0.093	24%	0.242	C	C	.	.	H	α-helix	trans	-58	-43	174.4	-76.2	-176.3	176.2	0	0	111.4	R98 S99 S106 V221 L223	R98-E102 IonicContact CZ-OE1 3.43Å; R98-E102 VanDerWaalsContact CZ-OE1 3.27Å; R98-E102 IonicContact NE-OE1 2.78Å; R98-E102 PolarHBondContact NE-OE1 3.4Å; R98-E102 VanDerWaalsContact NE-OE1 3.07Å; R98-E102 IonicContact NH2-OE1 3.72Å; R98-E102 PolarHBondContact NH2-OE1 2.99Å; R98-E102 WeakPolarHBondContact O-CB 3.46Å; R98-E102 WeakPolarHBondContact O-CG 3.28Å; R98-E102 PolarHBondContact O-N 3.44Å; S99-E102 PolarHBondContact O-N 2.92Å; E102-S106 VanDerWaalsContact O-CB 3.26Å; E102-S106 WeakPolarHBondContact O-CB 3.47Å; E102-S106 PolarHBondContact O-N 2.97Å; E102-S106 PolarHBondContact O-OG 3.34Å; E102-V221 WeakPolarHBondContact CB-O 3.27Å; E102-L223 HydrophobicContact CG-CB 4.2Å; E102-L223 HydrophobicContact CG-CD1 3.78Å; E102-L223 HydrophobicContact CG-CG 3.83Å; E102-L223 PolarHBondContact OE1-N 2.99Å
103	H	89.8	Confident	90.4	Very high	122 Å²	122	40.3 Å²	40.3	57%	0.565	22%	0.216	S	C	*	.	H	α-helix	trans	-65.4	-46.4	177.4	-165.5	84.4	0	0	0	111.6	S99 C100 L101 S106 S107	S99-H103 VanDerWaalsContact O-CB 3.32Å; S99-H103 WeakPolarHBondContact O-CB 3.42Å; S99-H103 PolarHBondContact O-N 3.36Å; C100-H103 PolarHBondContact O-N 3.35Å; L101-H103 VanDerWaalsContact C-N 3.29Å; L101-H103 PolarHBondContact O-N 3.08Å; H103-S106 PolarHBondContact O-N 3.19Å; H103-S107 WeakPolarHBondContact O-CB 3.49Å; H103-S107 PolarHBondContact O-N 3.04Å; H103-S107 PolarHBondContact O-OG 2.96Å; H103-S107 VanDerWaalsContact O-OG 3.09Å
104	W	91.3	Very high	90.7	Very high	54 Å²	54	40.4 Å²	40.4	21%	0.205	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-44.3	178.2	-178.5	90.5	0	0	0	112.3	I73 C100 L101 S106 S107 S108 T110 E114	I73-W104 HydrophobicContact CD1-CB 3.98Å; I73-W104 HydrophobicContact CD1-CG 4.37Å; C100-W104 WeakPolarHBondContact O-CB 3.28Å; C100-W104 PolarHBondContact O-N 2.64Å; L101-W104 HydrophobicContact CD1-CE3 4.27Å; L101-W104 PolarHBondContact O-N 2.89Å; W104-S106 VanDerWaalsContact C-N 3.33Å; W104-S106 PolarHBondContact O-N 2.84Å; W104-S107 PolarHBondContact O-N 3.2Å; W104-S108 WeakPolarHBondContact O-CB 3.41Å; W104-S108 PolarHBondContact O-N 3.14Å; W104-S108 PolarHBondContact O-OG 3.39Å; W104-T110 WeakPolarHBondContact CH2-OG1 3.28Å; W104-T110 VanDerWaalsContact CZ3-OG1 3.28Å; W104-T110 WeakPolarHBondContact CZ3-OG1 3.23Å; W104-E114 HydrophobicContact CH2-CB 4.02Å; W104-E114 HydrophobicContact CH2-CG 4.45Å; W104-E114 HydrophobicContact CZ2-CB 4.09Å; W104-E114 VanDerWaalsContact CZ2-CD 3.49Å; W104-E114 HydrophobicContact CZ2-CG 4.23Å; W104-E114 VanDerWaalsContact CZ2-OE2 3.25Å; W104-E114 WeakPolarHBondContact CZ2-OE2 3.39Å
105	L	91.4	Very high	91	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-37.5	176.2	-68.8	171.2	0	0	0	111.8	L101 N109 T110 F120 V122 V221 L223	L101-L105 HydrophobicContact CD1-CD1 3.97Å; L101-L105 HydrophobicContact CD1-CD2 4.5Å; L101-L105 HydrophobicContact CD1-CG 3.93Å; L101-L105 HydrophobicContact CG-CD1 3.86Å; L101-L105 HydrophobicContact CG-CG 4.28Å; L101-L105 WeakPolarHBondContact O-CB 3.41Å; L101-L105 VanDerWaalsContact O-CG 3.28Å; L101-L105 WeakPolarHBondContact O-CG 3.26Å; L101-L105 PolarHBondContact O-N 3.35Å; L105-N109 VanDerWaalsContact O-CA 3.32Å; L105-N109 WeakPolarHBondContact O-CA 3.49Å; L105-N109 PolarHBondContact O-N 3.44Å; L105-T110 WeakPolarHBondContact CD2-O 3.38Å; L105-T110 PolarHBondContact O-N 2.98Å; L105-F120 HydrophobicContact CD1-CD2 3.92Å; L105-F120 HydrophobicContact CD1-CG 4.45Å; L105-F120 HydrophobicContact CD2-CD2 3.89Å; L105-F120 HydrophobicContact CD2-CE2 4.13Å; L105-V122 HydrophobicContact CD1-CG1 4.03Å; L105-V221 HydrophobicContact CB-CB 4.02Å; L105-V221 HydrophobicContact CB-CG1 3.82Å; L105-V221 HydrophobicContact CB-CG2 4.24Å; L105-V221 HydrophobicContact CD1-CG1 4.21Å; L105-L223 HydrophobicContact CD1-CD2 3.94Å
106	S	88.7	Confident	91	Very high	12 Å²	12	46 Å²	46	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-43.4	175.2	-59.8	0	0	0	0	111.9	E102 H103 W104 V221	E102-S106 VanDerWaalsContact O-CB 3.26Å; E102-S106 WeakPolarHBondContact O-CB 3.47Å; E102-S106 PolarHBondContact O-N 2.97Å; E102-S106 PolarHBondContact O-OG 3.34Å; H103-S106 PolarHBondContact O-N 3.19Å; W104-S106 VanDerWaalsContact C-N 3.33Å; W104-S106 PolarHBondContact O-N 2.84Å; S106-V221 PolarHBondContact OG-N 3.38Å
107	S	86.5	Confident	91	Very high	86 Å²	86	51.7 Å²	51.7	60%	0.601	27%	0.272	S	S	*	.	H	α-helix	trans	-76.7	-35.5	-177.1	-62.6	0	0	0	0	112.9	H103 W104 N109	H103-S107 WeakPolarHBondContact O-CB 3.49Å; H103-S107 PolarHBondContact O-N 3.04Å; H103-S107 PolarHBondContact O-OG 2.96Å; H103-S107 VanDerWaalsContact O-OG 3.09Å; W104-S107 PolarHBondContact O-N 3.2Å; S107-N109 VanDerWaalsContact C-N 3.34Å
108	S	88.4	Confident	91	Very high	47 Å²	47	55.2 Å²	55.2	33%	0.329	29%	0.287	S	S	.	.	H	α-helix	trans	-82.9	-11.9	176.3	62.8	0	0	0	0	113.5	W104 T110	W104-S108 WeakPolarHBondContact O-CB 3.41Å; W104-S108 PolarHBondContact O-N 3.14Å; W104-S108 PolarHBondContact O-OG 3.39Å; S108-T110 PolarHBondContact O-N 2.76Å; S108-T110 VanDerWaalsContact O-N 3.14Å; S108-T110 PolarHBondContact OG-N 3.12Å; S108-T110 PolarHBondContact OG-OG1 2.74Å
109	N	87.4	Confident	91.1	Very high	88 Å²	88	61.1 Å²	61.1	47%	0.471	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	23.4	-170.4	-163.4	21.8	0	0	0	114	L105 S107 R124	L105-N109 VanDerWaalsContact O-CA 3.32Å; L105-N109 WeakPolarHBondContact O-CA 3.49Å; L105-N109 PolarHBondContact O-N 3.44Å; S107-N109 VanDerWaalsContact C-N 3.34Å; N109-R124 PolarHBondContact O-NH2 3.44Å; N109-R124 VanDerWaalsContact O-NH2 3.13Å
110	T	90.5	Very high	91.1	Very high	25 Å²	25	59.1 Å²	59.1	15%	0.153	29%	0.293	C	S	.	.			trans	-95.8	169	178.7	66.1	0	0	0	0	111.9	W104 L105 S108 Y112	W104-T110 WeakPolarHBondContact CH2-OG1 3.28Å; W104-T110 VanDerWaalsContact CZ3-OG1 3.28Å; W104-T110 WeakPolarHBondContact CZ3-OG1 3.23Å; L105-T110 WeakPolarHBondContact CD2-O 3.38Å; L105-T110 PolarHBondContact O-N 2.98Å; S108-T110 PolarHBondContact O-N 2.76Å; S108-T110 VanDerWaalsContact O-N 3.14Å; S108-T110 PolarHBondContact OG-N 3.12Å; S108-T110 PolarHBondContact OG-OG1 2.74Å; T110-Y112 HydrophobicContact CG2-CE1 4.28Å
111	S	91.6	Very high	91	Very high	22 Å²	22	61 Å²	61	15%	0.154	31%	0.31	C	S	.	.	S	Bend	trans	-136	19.1	175.9	52.4	0	0	0	0	111.9	F120	S111-F120 PolarHBondContact O-N 2.91Å
112	Y	92.8	Very high	90.8	Very high	99 Å²	99	62.4 Å²	62.4	39%	0.388	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-139.5	158	-177.6	57.4	-94.1	0	0	0	110	T110 H117 F118 F120	T110-Y112 HydrophobicContact CG2-CE1 4.28Å; Y112-H117 AromaticContact CD2-ND1 3.8Å; Y112-H117 AromaticContact CE2-ND1 3.9Å; Y112-F118 CarbonylContact C-O 3.46Å; Y112-F118 WeakPolarHBondContact CA-O 3.32Å; Y112-F118 WeakPolarHBondContact CB-O 3.49Å; Y112-F120 VanDerWaalsContact C-CE2 3.48Å
113	C	92.8	Very high	90.7	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.014	33%	0.332	C	S	.	.			trans	-69.6	133.1	174.1	-175.4	0	0	0	0	110.6	C87 C89 L115 C116 H117 F118 F120	C87-C113 HydrophobicContact CB-CB 4.04Å; C89-C113 VanDerWaalsContact SG-SG 3.68Å; C113-L115 PolarHBondContact O-N 3.35Å; C113-C116 VanDerWaalsContact SG-SG 3.62Å; C113-H117 WeakPolarHBondContact O-CA 3.48Å; C113-H117 PolarHBondContact O-N 2.89Å; C113-F118 HydrophobicContact CB-CB 4.44Å; C113-F118 PolarHBondContact N-O 2.87Å; C113-F120 HydrophobicContact CB-CE2 4.15Å; C113-F120 HydrophobicContact CB-CZ 3.86Å
114	E	93.5	Very high	90.5	Very high	90 Å²	90	63.8 Å²	63.8	42%	0.421	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.5	178.6	71.1	-161.1	144.6	0	0	114.4	R72 W104	R72-E114 IonicContact CZ-OE1 3.17Å; R72-E114 IonicContact NH1-OE1 3.84Å; R72-E114 PolarHBondContact NH1-OE1 2.93Å; R72-E114 IonicContact NH2-OE1 2.78Å; R72-E114 PolarHBondContact NH2-OE1 3.28Å; R72-E114 VanDerWaalsContact NH2-OE1 3.12Å; W104-E114 HydrophobicContact CH2-CB 4.02Å; W104-E114 HydrophobicContact CH2-CG 4.45Å; W104-E114 HydrophobicContact CZ2-CB 4.09Å; W104-E114 VanDerWaalsContact CZ2-CD 3.49Å; W104-E114 HydrophobicContact CZ2-CG 4.23Å; W104-E114 VanDerWaalsContact CZ2-OE2 3.25Å; W104-E114 WeakPolarHBondContact CZ2-OE2 3.39Å
115	L	93.2	Very high	90.1	Very high	91 Å²	91	65.4 Å²	65.4	48%	0.476	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-56.9	-176.1	-67	158.2	0	0	0	111.5	L93 C113	L93-L115 HydrophobicContact CB-CD1 4.46Å; C113-L115 PolarHBondContact O-N 3.35Å
116	C	92.3	Very high	89.6	Confident	44 Å²	44	68.5 Å²	68.5	30%	0.297	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	0.4	-176.1	67.4	0	0	0	0	113.9	C113 F118	C113-C116 VanDerWaalsContact SG-SG 3.62Å; C116-F118 PolarHBondContact O-N 3.49Å
117	H	93.4	Very high	89.2	Confident	123 Å²	123	70.1 Å²	70.1	57%	0.569	35%	0.354	S	S	*	.			trans	58.5	12.3	179.4	-63	-74.5	0	0	0	116.4	Y112 C113 R119	Y112-H117 AromaticContact CD2-ND1 3.8Å; Y112-H117 AromaticContact CE2-ND1 3.9Å; C113-H117 WeakPolarHBondContact O-CA 3.48Å; C113-H117 PolarHBondContact O-N 2.89Å; H117-R119 PolarHBondContact O-N 2.88Å
118	F	92.1	Very high	88.8	Confident	79 Å²	79	70 Å²	70	35%	0.346	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-57	133.1	172.1	-177.1	-93.1	0	0	0	111.2	P86 C87 E88 Y112 C113 C116 F120	P86-F118 VanDerWaalsContact O-CD1 3.3Å; P86-F118 WeakPolarHBondContact O-CD1 3.41Å; P86-F118 WeakPolarHBondContact O-CE1 3.41Å; C87-F118 HydrophobicContact CB-CB 3.99Å; C87-F118 HydrophobicContact CB-CD1 4.21Å; C87-F118 HydrophobicContact CB-CG 4.32Å; E88-F118 HydrophobicContact CG-CD2 4.18Å; Y112-F118 CarbonylContact C-O 3.46Å; Y112-F118 WeakPolarHBondContact CA-O 3.32Å; Y112-F118 WeakPolarHBondContact CB-O 3.49Å; C113-F118 HydrophobicContact CB-CB 4.44Å; C113-F118 PolarHBondContact N-O 2.87Å; C116-F118 PolarHBondContact O-N 3.49Å; F118-F120 AromaticContact CD1-CD1 3.99Å; F118-F120 HydrophobicContact CD1-CD1 3.99Å; F118-F120 HydrophobicContact CD1-CE1 4.01Å; F118-F120 HydrophobicContact CE1-CD1 4.24Å
119	R	91.3	Very high	88	Confident	192 Å²	192	72.1 Å²	72.1	73%	0.725	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-89.6	123.8	-177.9	-63	-175.7	82.5	123.1	0.3	111.2	H117	H117-R119 PolarHBondContact O-N 2.88Å
120	F	91.2	Very high	87.5	Confident	20 Å²	20	73.4 Å²	73.4	9%	0.088	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-84.7	142.1	177.2	-54.6	-64.9	0	0	0	111.3	P86 C87 L101 L105 S111 Y112 C113 F118 V122 L223	P86-F120 HydrophobicContact CB-CD1 4.13Å; P86-F120 HydrophobicContact CB-CE1 3.81Å; P86-F120 HydrophobicContact CG-CE1 3.97Å; P86-F120 WeakPolarHBondContact O-CE1 3.14Å; C87-F120 HydrophobicContact CB-CE1 3.88Å; C87-F120 HydrophobicContact CB-CZ 4.04Å; L101-F120 HydrophobicContact CD1-CE2 4.22Å; L101-F120 HydrophobicContact CD1-CZ 4.35Å; L101-F120 HydrophobicContact CD2-CE1 4.25Å; L101-F120 HydrophobicContact CD2-CZ 4.31Å; L105-F120 HydrophobicContact CD1-CD2 3.92Å; L105-F120 HydrophobicContact CD1-CG 4.45Å; L105-F120 HydrophobicContact CD2-CD2 3.89Å; L105-F120 HydrophobicContact CD2-CE2 4.13Å; S111-F120 PolarHBondContact O-N 2.91Å; Y112-F120 VanDerWaalsContact C-CE2 3.48Å; C113-F120 HydrophobicContact CB-CE2 4.15Å; C113-F120 HydrophobicContact CB-CZ 3.86Å; F118-F120 AromaticContact CD1-CD1 3.99Å; F118-F120 HydrophobicContact CD1-CD1 3.99Å; F118-F120 HydrophobicContact CD1-CE1 4.01Å; F118-F120 HydrophobicContact CE1-CD1 4.24Å; F120-V122 HydrophobicContact CB-CG1 4Å; F120-V122 PolarHBondContact O-N 2.85Å; F120-L223 HydrophobicContact CB-CD2 4.08Å; F120-L223 HydrophobicContact CG-CD2 4.48Å
121	A	88.8	Confident	87	Confident	63 Å²	63	76.2 Å²	76.2	52%	0.521	38%	0.381	S	S	.	.			trans	-75.5	113.1	167.2	0	0	0	0	0	109.3	L224	A121-L224 HydrophobicContact CB-CB 4.18Å; A121-L224 PolarHBondContact O-N 2.9Å
122	V	89	Confident	86.4	Confident	31 Å²	31	76.3 Å²	76.3	19%	0.188	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	146.1	-174.6	-66.9	0	0	0	0	112.7	L105 F120 V221 I222 L223	L105-V122 HydrophobicContact CD1-CG1 4.03Å; F120-V122 HydrophobicContact CB-CG1 4Å; F120-V122 PolarHBondContact O-N 2.85Å; V122-V221 HydrophobicContact CB-CG1 3.56Å; V122-V221 HydrophobicContact CG1-CG1 3.52Å; V122-V221 HydrophobicContact CG2-CG1 4.06Å; V122-I222 CarbonylContact C-O 3.19Å; V122-I222 VanDerWaalsContact CA-O 3.31Å; V122-I222 WeakPolarHBondContact CA-O 3.36Å; V122-L223 HydrophobicContact CG1-CD2 3.77Å; V122-L223 HydrophobicContact CG1-CG 4.5Å
123	E	87.9	Confident	85.5	Confident	82 Å²	82	77.4 Å²	77.4	38%	0.383	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.8	168.9	-167.6	-173.6	172.9	0	0	109.1	K125 I222 L224	E123-K125 WeakPolarHBondContact OE1-CE 3.32Å; E123-K125 IonicContact OE1-NZ 2.93Å; E123-K125 WeakPolarHBondContact OE2-CE 3.33Å; E123-K125 IonicContact OE2-NZ 2.88Å; E123-K125 PolarHBondContact OE2-NZ 2.94Å; E123-I222 PolarHBondContact N-O 2.66Å; E123-I222 PolarHBondContact O-N 2.89Å; E123-L224 HydrophobicContact CB-CD1 4.18Å; E123-L224 HydrophobicContact CB-CD2 4.22Å; E123-L224 HydrophobicContact CB-CG 4.18Å
124	R	86.6	Confident	84.7	Confident	89 Å²	89	86.7 Å²	86.7	34%	0.336	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.6	176	-71.2	-166.5	174.4	82.7	-6.7	110.1	N109 Q219 R220 V221	N109-R124 PolarHBondContact O-NH2 3.44Å; N109-R124 VanDerWaalsContact O-NH2 3.13Å; R124-Q219 HydrophobicContact CB-CB 4.28Å; R124-R220 WeakPolarHBondContact CA-O 3.41Å; R124-V221 HydrophobicContact CG-CG2 4.12Å
125	K	83.7	Confident	83.7	Confident	89 Å²	89	87.4 Å²	87.4	39%	0.387	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.6	176.8	-63.7	-163.9	-177.4	175.9	0	111.5	E123 R220 I222	E123-K125 WeakPolarHBondContact OE1-CE 3.32Å; E123-K125 IonicContact OE1-NZ 2.93Å; E123-K125 WeakPolarHBondContact OE2-CE 3.33Å; E123-K125 IonicContact OE2-NZ 2.88Å; E123-K125 PolarHBondContact OE2-NZ 2.94Å; K125-R220 PolarHBondContact N-O 2.91Å; K125-R220 PolarHBondContact O-N 3.44Å; K125-I222 HydrophobicContact CB-CD1 4.39Å; K125-I222 HydrophobicContact CD-CD1 3.58Å; K125-I222 HydrophobicContact CG-CD1 3.91Å
126	P	79.8	Confident	82.5	Confident	64 Å²	64	83.5 Å²	83.5	42%	0.416	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	140	175.5	27.9	-32.8	0	0	0	110.5	R215	P126-R215 HydrophobicContact CB-CG 4.15Å
127	R	80.1	Confident	81.5	Confident	47 Å²	47	83.6 Å²	83.6	18%	0.177	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-72.4	146.4	174.2	-74.2	-178.7	-177.2	-113.4	11.3	111.7	E131 W214 N218 R220	R127-E131 WeakPolarHBondContact CD-OE2 3.25Å; R127-E131 IonicContact CZ-OE2 3.27Å; R127-E131 IonicContact NH1-OE1 3.12Å; R127-E131 PolarHBondContact NH1-OE1 2.85Å; R127-E131 IonicContact NH1-OE2 3.07Å; R127-E131 PolarHBondContact NH1-OE2 3.08Å; R127-W214 HydrophobicContact CB-CH2 3.59Å; R127-W214 HydrophobicContact CB-CZ3 3.91Å; R127-W214 HydrophobicContact CG-CH2 4.45Å; R127-N218 VanDerWaalsContact CD-O 3.26Å; R127-N218 WeakPolarHBondContact CD-O 3.24Å; R127-N218 VanDerWaalsContact CG-O 3.27Å; R127-N218 WeakPolarHBondContact CG-O 3.16Å; R127-R220 HydrophobicContact CG-CB 4.29Å
128	P	78.8	Confident	80.6	Confident	82 Å²	82	81 Å²	81	53%	0.532	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-68.9	151.9	178.8	29	-34.3	0	0	0	111.8	V130 E131	P128-V130 PolarHBondContact O-N 3.4Å; P128-E131 HydrophobicContact CG-CB 4.46Å; P128-E131 PolarHBondContact O-N 3.43Å
129	L	72.1	Confident	79.9	Confident	92 Å²	92	83.7 Å²	83.7	48%	0.482	43%	0.427	S	S	.	.	H	α-helix	trans	-52.9	-35.4	177.9	-81.6	160.5	0	0	0	113.6	E131 W132 L133 Y211	L129-E131 PolarHBondContact O-N 3.2Å; L129-W132 WeakPolarHBondContact O-CB 3.26Å; L129-W132 PolarHBondContact O-N 3.45Å; L129-W132 VanDerWaalsContact O-N 3.16Å; L129-L133 WeakPolarHBondContact O-CD1 3.33Å; L129-L133 PolarHBondContact O-N 3.5Å; L129-Y211 HydrophobicContact CD2-CD1 4.06Å; L129-Y211 HydrophobicContact CD2-CD2 3.65Å; L129-Y211 HydrophobicContact CD2-CE1 3.62Å; L129-Y211 HydrophobicContact CD2-CE2 3.19Å; L129-Y211 HydrophobicContact CD2-CG 4.08Å; L129-Y211 HydrophobicContact CG-CE1 4.31Å; L129-Y211 HydrophobicContact CG-CE2 3.95Å; L129-Y211 WeakPolarHBondContact CG-OH 3.27Å
130	V	75.6	Confident	79.2	Confident	116 Å²	116	80.6 Å²	80.6	70%	0.703	42%	0.42	S	S	*	.	H	α-helix	trans	-61.6	-35	-177.1	-173.5	0	0	0	0	111.8	P128 L133 R134	P128-V130 PolarHBondContact O-N 3.4Å; V130-L133 PolarHBondContact O-N 3.43Å; V130-R134 PolarHBondContact O-N 3.25Å; V130-R134 VanDerWaalsContact O-N 3.09Å
131	E	80.5	Confident	78.7	Confident	83 Å²	83	81.7 Å²	81.7	39%	0.388	43%	0.426	S	S	.	.	H	α-helix	trans	-72.3	-35.4	179.8	-162.1	165.9	-156.1	0	0	111.5	R127 P128 L129 R134 N135	R127-E131 WeakPolarHBondContact CD-OE2 3.25Å; R127-E131 IonicContact CZ-OE2 3.27Å; R127-E131 IonicContact NH1-OE1 3.12Å; R127-E131 PolarHBondContact NH1-OE1 2.85Å; R127-E131 IonicContact NH1-OE2 3.07Å; R127-E131 PolarHBondContact NH1-OE2 3.08Å; P128-E131 HydrophobicContact CG-CB 4.46Å; P128-E131 PolarHBondContact O-N 3.43Å; L129-E131 PolarHBondContact O-N 3.2Å; E131-R134 PolarHBondContact O-N 2.88Å; E131-N135 PolarHBondContact O-N 3.14Å
132	W	79.2	Confident	78.3	Confident	25 Å²	25	82.5 Å²	82.5	10%	0.095	42%	0.418	C	S	.	.	H	α-helix	trans	-65.4	-45.1	170.9	178	77.4	0	0	0	111.9	L129 R134 N135 P136 L145 Y211 W214	L129-W132 WeakPolarHBondContact O-CB 3.26Å; L129-W132 PolarHBondContact O-N 3.45Å; L129-W132 VanDerWaalsContact O-N 3.16Å; W132-R134 PolarHBondContact O-N 3.29Å; W132-N135 CarbonylContact O-C 3.55Å; W132-N135 PolarHBondContact O-N 3.07Å; W132-P136 HydrophobicContact CD2-CB 4.37Å; W132-P136 HydrophobicContact CZ2-CB 4.28Å; W132-P136 VanDerWaalsContact O-CA 3.31Å; W132-P136 WeakPolarHBondContact O-CA 3.32Å; W132-P136 WeakPolarHBondContact O-CB 3.36Å; W132-P136 WeakPolarHBondContact O-CD 3.13Å; W132-L145 HydrophobicContact CH2-CD1 3.76Å; W132-L145 HydrophobicContact CH2-CD2 4.15Å; W132-L145 HydrophobicContact CZ2-CD1 3.54Å; W132-L145 HydrophobicContact CZ2-CD2 4.32Å; W132-Y211 HydrophobicContact CB-CD2 4.33Å; W132-Y211 HydrophobicContact CB-CE2 4.29Å; W132-Y211 AromaticContact CD2-CD2 3.88Å; W132-Y211 HydrophobicContact CD2-CD2 3.88Å; W132-Y211 HydrophobicContact CE3-CD2 4.21Å; W132-Y211 AromaticContact CG-CD2 3.94Å; W132-Y211 HydrophobicContact CG-CD2 3.94Å; W132-Y211 HydrophobicContact CG-CE2 4.37Å; W132-W214 HydrophobicContact CB-CD2 4.14Å; W132-W214 HydrophobicContact CB-CE3 3.87Å; W132-W214 HydrophobicContact CB-CH2 3.83Å; W132-W214 HydrophobicContact CB-CZ2 4.09Å; W132-W214 HydrophobicContact CB-CZ3 3.73Å; W132-W214 AromaticContact CD1-CD1 3.78Å; W132-W214 AromaticContact CD1-CD2 3.4Å; W132-W214 AromaticContact CD1-CE2 3.79Å; W132-W214 AromaticContact CD1-CE3 3.81Å; W132-W214 AromaticContact CD1-CG 3.43Å; W132-W214 VanDerWaalsContact CD1-CG 3.43Å; W132-W214 AromaticContact CD1-NE1 3.98Å; W132-W214 HydrophobicContact CG-CD2 4.1Å; W132-W214 HydrophobicContact CG-CE3 4.1Å; W132-W214 HydrophobicContact CG-CG 4.49Å; W132-W214 HydrophobicContact CG-CZ3 4.45Å; W132-W214 AromaticContact NE1-CG 4Å
133	L	74.1	Confident	78.1	Confident	121 Å²	121	90.4 Å²	90.4	63%	0.634	44%	0.444	S	S	*	.	H	α-helix	trans	-59.8	-35.1	176.9	-99.4	106.9	0	0	0	112.5	L129 V130	L129-L133 WeakPolarHBondContact O-CD1 3.33Å; L129-L133 PolarHBondContact O-N 3.5Å; V130-L133 PolarHBondContact O-N 3.43Å
134	R	76	Confident	78.1	Confident	197 Å²	197	89.8 Å²	89.8	74%	0.743	45%	0.446	S	S	*	.	H	α-helix	trans	-69.4	-40.8	179.5	-174.5	175.2	168.1	171.1	-3.9	112.1	V130 E131 W132	V130-R134 PolarHBondContact O-N 3.25Å; V130-R134 VanDerWaalsContact O-N 3.09Å; E131-R134 PolarHBondContact O-N 2.88Å; W132-R134 PolarHBondContact O-N 3.29Å
135	N	71.9	Confident	78	Confident	106 Å²	106	86 Å²	86	57%	0.567	43%	0.433	S	S	*	.	S	Bend	trans	-140.8	77.1	-179.4	-71.2	-49.6	0	0	0	111.4	E131 W132 G137	E131-N135 PolarHBondContact O-N 3.14Å; W132-N135 CarbonylContact O-C 3.55Å; W132-N135 PolarHBondContact O-N 3.07Å; N135-G137 PolarHBondContact O-N 3.39Å
136	P	69.1	Low	78	Confident	9 Å²	9	88.9 Å²	88.9	6%	0.058	45%	0.445	C	S	.	.			trans	-81	92.2	179.1	30.4	-31.1	0	0	0	109.1	W132 K142 L145	W132-P136 HydrophobicContact CD2-CB 4.37Å; W132-P136 HydrophobicContact CZ2-CB 4.28Å; W132-P136 VanDerWaalsContact O-CA 3.31Å; W132-P136 WeakPolarHBondContact O-CA 3.32Å; W132-P136 WeakPolarHBondContact O-CB 3.36Å; W132-P136 WeakPolarHBondContact O-CD 3.13Å; P136-K142 HydrophobicContact CG-CB 4.12Å; P136-K142 HydrophobicContact CG-CD 4.33Å; P136-K142 HydrophobicContact CG-CG 3.89Å; P136-L145 HydrophobicContact CB-CD1 3.53Å; P136-L145 HydrophobicContact CG-CD1 3.92Å
137	G	71	Confident	78.4	Confident	45 Å²	45	87.3 Å²	87.3	46%	0.464	44%	0.44	S	S	.	.	S	Bend	trans	55.2	-151.8	162.8	0	0	0	0	0	116.3	N135	N135-G137 PolarHBondContact O-N 3.39Å
138	P	73.2	Confident	78.8	Confident	68 Å²	68	86.4 Å²	86.4	44%	0.442	44%	0.439	S	S	.	.	S	Bend	trans	-61.1	151.2	178.2	-22.2	33.2	0	0	0	113.7	H140 E141 K142	P138-H140 PolarHBondContact O-N 3.06Å; P138-H140 VanDerWaalsContact O-N 3.08Å; P138-E141 PolarHBondContact O-N 3.26Å; P138-K142 PolarHBondContact O-N 2.86Å
139	Q	77.4	Confident	79.2	Confident	137 Å²	137	87.2 Å²	87.2	64%	0.64	44%	0.437	S	S	*	.	H	α-helix	trans	-57.8	-29.9	-174	-63.6	-65.5	-8.7	0	0	114.8	R143	Q139-R143 WeakPolarHBondContact O-CG 3.3Å; Q139-R143 PolarHBondContact O-N 3.36Å
140	H	77.4	Confident	80	Confident	126 Å²	126	85.5 Å²	85.5	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-73.1	-44.7	-179	75.5	-82.7	0	0	0	111.8	P138 K142 R143 T144	P138-H140 PolarHBondContact O-N 3.06Å; P138-H140 VanDerWaalsContact O-N 3.08Å; H140-K142 VanDerWaalsContact C-N 3.3Å; H140-K142 PolarHBondContact O-N 3.16Å; H140-R143 PolarHBondContact O-N 3.09Å; H140-T144 PolarHBondContact O-N 2.93Å; H140-T144 PolarHBondContact O-OG1 3.18Å
141	E	81.6	Confident	80.7	Confident	43 Å²	43	82 Å²	82	20%	0.201	41%	0.41	C	S	.	.	H	α-helix	trans	-61.1	-42.3	175.9	-63.8	173.8	-161.9	0	0	110.4	P138 R143 T144 L145 L210	P138-E141 PolarHBondContact O-N 3.26Å; E141-R143 VanDerWaalsContact C-N 3.31Å; E141-R143 PolarHBondContact O-N 2.86Å; E141-T144 PolarHBondContact O-N 2.99Å; E141-L145 VanDerWaalsContact O-CG 3.31Å; E141-L145 WeakPolarHBondContact O-CG 3.46Å; E141-L145 PolarHBondContact O-N 3.08Å; E141-L210 HydrophobicContact CB-CD2 4.36Å; E141-L210 WeakPolarHBondContact OE2-CD1 3.46Å
142	K	80.3	Confident	81.2	Confident	81 Å²	81	80.1 Å²	80.1	35%	0.352	40%	0.401	S	S	.	.	H	α-helix	trans	-56	-41.5	176.8	-178.1	173.3	-178.3	177.3	0	113.3	P136 P138 H140 F146	P136-K142 HydrophobicContact CG-CB 4.12Å; P136-K142 HydrophobicContact CG-CD 4.33Å; P136-K142 HydrophobicContact CG-CG 3.89Å; P138-K142 PolarHBondContact O-N 2.86Å; H140-K142 VanDerWaalsContact C-N 3.3Å; H140-K142 PolarHBondContact O-N 3.16Å; K142-F146 WeakPolarHBondContact O-CB 3.33Å; K142-F146 PolarHBondContact O-N 3.34Å
143	R	84.8	Confident	81.7	Confident	196 Å²	196	84.4 Å²	84.4	74%	0.74	43%	0.425	S	S	*	.	H	α-helix	trans	-66.7	-42.5	180	-72	176.8	-177.3	-169.1	0.6	111.5	Q139 H140 E141 F146 G147	Q139-R143 WeakPolarHBondContact O-CG 3.3Å; Q139-R143 PolarHBondContact O-N 3.36Å; H140-R143 PolarHBondContact O-N 3.09Å; E141-R143 VanDerWaalsContact C-N 3.31Å; E141-R143 PolarHBondContact O-N 2.86Å; R143-F146 PolarHBondContact O-N 3.19Å; R143-G147 PolarHBondContact O-N 3.46Å
144	T	85.9	Confident	82.5	Confident	70 Å²	70	84.4 Å²	84.4	43%	0.429	42%	0.42	S	S	.	.	H	α-helix	trans	-64.7	-44.2	176.8	-53.5	0	0	0	0	111.5	H140 E141 F146 G147 D148	H140-T144 PolarHBondContact O-N 2.93Å; H140-T144 PolarHBondContact O-OG1 3.18Å; E141-T144 PolarHBondContact O-N 2.99Å; T144-F146 PolarHBondContact O-N 2.88Å; T144-G147 PolarHBondContact O-N 3.19Å; T144-D148 PolarHBondContact O-N 3.17Å
145	L	84.6	Confident	83.1	Confident	10 Å²	10	78.5 Å²	78.5	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-57.6	-47.6	174.8	-68.3	180	0	0	0	112	W132 P136 E141 G147 D148 M149 H207 L210	W132-L145 HydrophobicContact CH2-CD1 3.76Å; W132-L145 HydrophobicContact CH2-CD2 4.15Å; W132-L145 HydrophobicContact CZ2-CD1 3.54Å; W132-L145 HydrophobicContact CZ2-CD2 4.32Å; P136-L145 HydrophobicContact CB-CD1 3.53Å; P136-L145 HydrophobicContact CG-CD1 3.92Å; E141-L145 VanDerWaalsContact O-CG 3.31Å; E141-L145 WeakPolarHBondContact O-CG 3.46Å; E141-L145 PolarHBondContact O-N 3.08Å; L145-G147 VanDerWaalsContact C-N 3.34Å; L145-D148 PolarHBondContact O-N 2.93Å; L145-M149 WeakPolarHBondContact O-CB 3.28Å; L145-M149 WeakPolarHBondContact O-CG 3.45Å; L145-M149 PolarHBondContact O-N 3.33Å; L145-H207 WeakPolarHBondContact CD2-CE1 3.35Å; L145-H207 WeakPolarHBondContact CD2-ND1 3.17Å; L145-L210 HydrophobicContact CD1-CD2 4.33Å; L145-L210 HydrophobicContact CD2-CD2 4.25Å
146	F	84.9	Confident	84	Confident	149 Å²	149	75.9 Å²	75.9	65%	0.654	39%	0.391	S	S	*	.	H	α-helix	trans	-64	-41.9	-179.7	-174.9	-99.2	0	0	0	111.5	K142 R143 T144 M149 V150	K142-F146 WeakPolarHBondContact O-CB 3.33Å; K142-F146 PolarHBondContact O-N 3.34Å; R143-F146 PolarHBondContact O-N 3.19Å; T144-F146 PolarHBondContact O-N 2.88Å; F146-M149 PolarHBondContact O-N 3.48Å; F146-V150 HydrophobicContact CD1-CG2 4.17Å; F146-V150 HydrophobicContact CE1-CG2 3.78Å; F146-V150 HydrophobicContact CE2-CG2 4.36Å; F146-V150 HydrophobicContact CZ-CG2 3.89Å; F146-V150 VanDerWaalsContact O-CG2 3.3Å; F146-V150 WeakPolarHBondContact O-CG2 3.44Å; F146-V150 PolarHBondContact O-N 3.03Å
147	G	88.2	Confident	85.1	Confident	30 Å²	30	78.2 Å²	78.2	31%	0.309	41%	0.406	S	S	.	.	H	α-helix	trans	-57.3	-52.1	174.4	0	0	0	0	0	112.2	R143 T144 L145 M149 V150 C151	R143-G147 PolarHBondContact O-N 3.46Å; T144-G147 PolarHBondContact O-N 3.19Å; L145-G147 VanDerWaalsContact C-N 3.34Å; G147-M149 VanDerWaalsContact C-N 3.33Å; G147-M149 PolarHBondContact O-N 2.86Å; G147-V150 PolarHBondContact O-N 2.93Å; G147-C151 WeakPolarHBondContact O-CB 3.37Å; G147-C151 PolarHBondContact O-N 3.47Å; G147-C151 PolarHBondContact O-SG 3.38Å; G147-C151 VanDerWaalsContact O-SG 3.32Å
148	D	89	Confident	86	Confident	28 Å²	28	81.5 Å²	81.5	15%	0.15	41%	0.412	C	S	.	.	H	α-helix	trans	-62.1	-39.3	179.9	-76	-0	0	0	0	112.2	T144 L145 C151 F152 S203 H207	T144-D148 PolarHBondContact O-N 3.17Å; L145-D148 PolarHBondContact O-N 2.93Å; D148-C151 WeakPolarHBondContact O-CB 3.46Å; D148-C151 PolarHBondContact O-N 2.94Å; D148-F152 HydrophobicContact CB-CE2 4.17Å; D148-F152 WeakPolarHBondContact O-CD2 3.45Å; D148-F152 WeakPolarHBondContact O-CG 3.4Å; D148-F152 PolarHBondContact O-N 3.26Å; D148-S203 PolarHBondContact OD2-OG 2.98Å; D148-H207 WeakPolarHBondContact CB-NE2 3.33Å; D148-H207 IonicContact OD2-CE1 3.29Å; D148-H207 PolarHBondContact OD2-CE1 3.37Å; D148-H207 IonicContact OD2-NE2 3.41Å; D148-H207 PolarHBondContact OD2-NE2 3.4Å
149	M	86.4	Confident	86.8	Confident	100 Å²	100	79.5 Å²	79.5	49%	0.493	40%	0.402	S	S	.	.	H	α-helix	trans	-64.5	-43.1	176.7	-70.9	-68	150.5	0	0	112.4	L145 F146 G147 F152 L153	L145-M149 WeakPolarHBondContact O-CB 3.28Å; L145-M149 WeakPolarHBondContact O-CG 3.45Å; L145-M149 PolarHBondContact O-N 3.33Å; F146-M149 PolarHBondContact O-N 3.48Å; G147-M149 VanDerWaalsContact C-N 3.33Å; G147-M149 PolarHBondContact O-N 2.86Å; M149-F152 PolarHBondContact O-N 3.32Å; M149-L153 WeakPolarHBondContact O-CB 3.26Å; M149-L153 PolarHBondContact O-N 3.33Å
150	V	89.8	Confident	87.4	Confident	55 Å²	55	76.6 Å²	76.6	33%	0.333	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-43.9	174.3	171.3	0	0	0	0	110	F146 G147 F152 L153 F154	F146-V150 HydrophobicContact CD1-CG2 4.17Å; F146-V150 HydrophobicContact CE1-CG2 3.78Å; F146-V150 HydrophobicContact CE2-CG2 4.36Å; F146-V150 HydrophobicContact CZ-CG2 3.89Å; F146-V150 VanDerWaalsContact O-CG2 3.3Å; F146-V150 WeakPolarHBondContact O-CG2 3.44Å; F146-V150 PolarHBondContact O-N 3.03Å; G147-V150 PolarHBondContact O-N 2.93Å; V150-F152 PolarHBondContact O-N 2.94Å; V150-L153 PolarHBondContact O-N 3.38Å; V150-F154 HydrophobicContact CG1-CD2 3.78Å; V150-F154 HydrophobicContact CG1-CE2 3.95Å; V150-F154 VanDerWaalsContact O-CD2 3.25Å; V150-F154 WeakPolarHBondContact O-CD2 3.27Å; V150-F154 PolarHBondContact O-N 3.3Å; V150-F154 VanDerWaalsContact O-N 3.12Å
151	C	89.8	Confident	88.2	Confident	43 Å²	43	75.1 Å²	75.1	29%	0.291	39%	0.389	S	S	.	.	H	α-helix	trans	-57.7	-48.4	174.3	-74.3	0	0	0	0	111.6	G147 D148 L153 F154 I155 W199	G147-C151 WeakPolarHBondContact O-CB 3.37Å; G147-C151 PolarHBondContact O-N 3.47Å; G147-C151 PolarHBondContact O-SG 3.38Å; G147-C151 VanDerWaalsContact O-SG 3.32Å; D148-C151 WeakPolarHBondContact O-CB 3.46Å; D148-C151 PolarHBondContact O-N 2.94Å; C151-L153 VanDerWaalsContact C-N 3.34Å; C151-L153 PolarHBondContact O-N 3.16Å; C151-F154 PolarHBondContact O-N 3.43Å; C151-I155 HydrophobicContact CB-CD1 3.9Å; C151-I155 WeakPolarHBondContact O-CA 3.45Å; C151-I155 WeakPolarHBondContact O-CB 3.45Å; C151-I155 VanDerWaalsContact O-CG1 3.27Å; C151-I155 WeakPolarHBondContact O-CG1 3.48Å; C151-I155 PolarHBondContact O-N 2.97Å; C151-W199 HydrophobicContact CB-CH2 3.75Å; C151-W199 HydrophobicContact CB-CZ3 4.37Å
152	F	90.1	Very high	88.6	Confident	43 Å²	43	76.2 Å²	76.2	19%	0.189	40%	0.401	C	S	.	.	H	α-helix	trans	-62.8	-39	177	-68.9	-50.3	0	0	0	112.9	D148 M149 V150 F154 T156 W199 T200	D148-F152 HydrophobicContact CB-CE2 4.17Å; D148-F152 WeakPolarHBondContact O-CD2 3.45Å; D148-F152 WeakPolarHBondContact O-CG 3.4Å; D148-F152 PolarHBondContact O-N 3.26Å; M149-F152 PolarHBondContact O-N 3.32Å; V150-F152 PolarHBondContact O-N 2.94Å; F152-F154 VanDerWaalsContact C-N 3.35Å; F152-F154 PolarHBondContact O-N 3.24Å; F152-T156 VanDerWaalsContact O-CB 3.24Å; F152-T156 WeakPolarHBondContact O-CB 3.46Å; F152-T156 PolarHBondContact O-N 3.25Å; F152-T156 PolarHBondContact O-OG1 3.42Å; F152-W199 HydrophobicContact CD1-CZ3 4.01Å; F152-W199 HydrophobicContact CE1-CE3 4.02Å; F152-W199 HydrophobicContact CE1-CH2 4.14Å; F152-W199 AromaticContact CE1-CZ3 3.42Å; F152-W199 HydrophobicContact CE1-CZ3 3.42Å; F152-W199 VanDerWaalsContact CE1-CZ3 3.42Å; F152-W199 HydrophobicContact CZ-CE3 4.48Å; F152-W199 HydrophobicContact CZ-CH2 4.19Å; F152-W199 AromaticContact CZ-CZ3 3.87Å; F152-W199 HydrophobicContact CZ-CZ3 3.87Å; F152-T200 HydrophobicContact CD1-CG2 4.1Å; F152-T200 HydrophobicContact CE1-CG2 3.46Å; F152-T200 VanDerWaalsContact CE1-CG2 3.46Å; F152-T200 HydrophobicContact CZ-CG2 4.48Å
153	L	89.8	Confident	89	Confident	116 Å²	116	73.9 Å²	73.9	61%	0.607	40%	0.4	S	S	*	.	H	α-helix	trans	-62.8	-39.8	-179.6	-178.2	63.2	0	0	0	112.5	M149 V150 C151 P157	M149-L153 WeakPolarHBondContact O-CB 3.26Å; M149-L153 PolarHBondContact O-N 3.33Å; V150-L153 PolarHBondContact O-N 3.38Å; C151-L153 VanDerWaalsContact C-N 3.34Å; C151-L153 PolarHBondContact O-N 3.16Å; L153-P157 VanDerWaalsContact O-CD 3.24Å; L153-P157 WeakPolarHBondContact O-CD 3.17Å; L153-P157 VanDerWaalsContact O-CG 3.23Å; L153-P157 WeakPolarHBondContact O-CG 3.5Å
154	F	91.8	Very high	89.4	Confident	121 Å²	121	71.5 Å²	71.5	53%	0.531	39%	0.391	S	S	.	.	H	α-helix	trans	-101.4	-38.8	-175.1	-66.1	-71.2	0	0	0	113.7	V150 C151 F152 P157 L158	V150-F154 HydrophobicContact CG1-CD2 3.78Å; V150-F154 HydrophobicContact CG1-CE2 3.95Å; V150-F154 VanDerWaalsContact O-CD2 3.25Å; V150-F154 WeakPolarHBondContact O-CD2 3.27Å; V150-F154 PolarHBondContact O-N 3.3Å; V150-F154 VanDerWaalsContact O-N 3.12Å; C151-F154 PolarHBondContact O-N 3.43Å; F152-F154 VanDerWaalsContact C-N 3.35Å; F152-F154 PolarHBondContact O-N 3.24Å; F154-P157 WeakPolarHBondContact O-CD 3.5Å; F154-P157 WeakPolarHBondContact O-CG 3.44Å; F154-L158 WeakPolarHBondContact O-CB 3.37Å; F154-L158 WeakPolarHBondContact O-CD1 3.06Å; F154-L158 WeakPolarHBondContact O-CG 3.41Å; F154-L158 PolarHBondContact O-N 3.09Å
155	I	88.8	Confident	89.6	Confident	72 Å²	72	73.4 Å²	73.4	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-76.4	-37.3	-175.5	-57.2	-179.8	0	0	0	111.3	C151 L158 A159 Y196	C151-I155 HydrophobicContact CB-CD1 3.9Å; C151-I155 WeakPolarHBondContact O-CA 3.45Å; C151-I155 WeakPolarHBondContact O-CB 3.45Å; C151-I155 VanDerWaalsContact O-CG1 3.27Å; C151-I155 WeakPolarHBondContact O-CG1 3.48Å; C151-I155 PolarHBondContact O-N 2.97Å; I155-L158 PolarHBondContact O-N 2.97Å; I155-A159 VanDerWaalsContact O-CB 3.23Å; I155-A159 WeakPolarHBondContact O-CB 3.3Å; I155-A159 PolarHBondContact O-N 2.82Å; I155-Y196 HydrophobicContact CB-CE2 4.28Å; I155-Y196 HydrophobicContact CG2-CD2 4.03Å; I155-Y196 HydrophobicContact CG2-CE2 3.63Å
156	T	89.6	Confident	89.9	Confident	52 Å²	52	74.8 Å²	74.8	32%	0.319	41%	0.408	S	S	.	.	H	α-helix	trans	-56.7	-55.3	177.1	-44.4	0	0	0	0	112.4	F152 L158 A159 T160 Y196	F152-T156 VanDerWaalsContact O-CB 3.24Å; F152-T156 WeakPolarHBondContact O-CB 3.46Å; F152-T156 PolarHBondContact O-N 3.25Å; F152-T156 PolarHBondContact O-OG1 3.42Å; T156-L158 VanDerWaalsContact C-N 3.34Å; T156-L158 PolarHBondContact O-N 3.43Å; T156-A159 PolarHBondContact O-N 2.9Å; T156-T160 WeakPolarHBondContact O-CG2 3.48Å; T156-T160 PolarHBondContact O-N 2.85Å; T156-T160 PolarHBondContact O-OG1 3.32Å; T156-Y196 WeakPolarHBondContact CA-OH 3.25Å; T156-Y196 WeakPolarHBondContact CB-OH 3.4Å; T156-Y196 HydrophobicContact CG2-CE1 4.4Å; T156-Y196 PolarHBondContact N-OH 3.25Å; T156-Y196 PolarHBondContact OG1-OH 2.97Å
157	P	92.6	Very high	89.9	Confident	57 Å²	57	72.4 Å²	72.4	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-41	-178.8	24.4	-33.5	0	0	0	111.5	L153 F154 A159 T160 I161	L153-P157 VanDerWaalsContact O-CD 3.24Å; L153-P157 WeakPolarHBondContact O-CD 3.17Å; L153-P157 VanDerWaalsContact O-CG 3.23Å; L153-P157 WeakPolarHBondContact O-CG 3.5Å; F154-P157 WeakPolarHBondContact O-CD 3.5Å; F154-P157 WeakPolarHBondContact O-CG 3.44Å; P157-A159 PolarHBondContact O-N 3.47Å; P157-T160 WeakPolarHBondContact CA-OG1 3.36Å; P157-T160 PolarHBondContact O-N 3.24Å; P157-T160 PolarHBondContact O-OG1 2.91Å; P157-I161 WeakPolarHBondContact O-CB 3.36Å; P157-I161 VanDerWaalsContact O-CG1 3.27Å; P157-I161 WeakPolarHBondContact O-CG1 3.37Å; P157-I161 PolarHBondContact O-N 3.42Å
158	L	91.1	Very high	89.9	Confident	114 Å²	114	78.2 Å²	78.2	60%	0.597	41%	0.414	S	S	*	.	H	α-helix	trans	-61.2	-43.8	177.4	-70.3	173.9	0	0	0	112.3	F154 I155 T156 I161 S162	F154-L158 WeakPolarHBondContact O-CB 3.37Å; F154-L158 WeakPolarHBondContact O-CD1 3.06Å; F154-L158 WeakPolarHBondContact O-CG 3.41Å; F154-L158 PolarHBondContact O-N 3.09Å; I155-L158 PolarHBondContact O-N 2.97Å; T156-L158 VanDerWaalsContact C-N 3.34Å; T156-L158 PolarHBondContact O-N 3.43Å; L158-I161 PolarHBondContact O-N 3.19Å; L158-S162 WeakPolarHBondContact O-CB 3.41Å; L158-S162 PolarHBondContact O-N 2.94Å
159	A	89.9	Confident	89.8	Confident	27 Å²	27	78.4 Å²	78.4	22%	0.223	42%	0.423	C	S	.	.	H	α-helix	trans	-64.3	-39.9	176.3	0	0	0	0	0	111.7	I155 T156 P157 G163	I155-A159 VanDerWaalsContact O-CB 3.23Å; I155-A159 WeakPolarHBondContact O-CB 3.3Å; I155-A159 PolarHBondContact O-N 2.82Å; T156-A159 PolarHBondContact O-N 2.9Å; P157-A159 PolarHBondContact O-N 3.47Å; A159-G163 PolarHBondContact O-N 3.28Å
160	T	89.2	Confident	89.7	Confident	75 Å²	75	73.7 Å²	73.7	46%	0.46	40%	0.4	S	S	.	.	H	α-helix	trans	-66.9	-42.5	176.8	58.7	0	0	0	0	112.7	T156 P157 W164	T156-T160 WeakPolarHBondContact O-CG2 3.48Å; T156-T160 PolarHBondContact O-N 2.85Å; T156-T160 PolarHBondContact O-OG1 3.32Å; P157-T160 WeakPolarHBondContact CA-OG1 3.36Å; P157-T160 PolarHBondContact O-N 3.24Å; P157-T160 PolarHBondContact O-OG1 2.91Å; T160-W164 WeakPolarHBondContact O-CB 3.47Å; T160-W164 PolarHBondContact O-N 3.34Å
161	I	93.4	Very high	89.5	Confident	96 Å²	96	75.2 Å²	75.2	49%	0.492	41%	0.409	S	S	.	.	H	α-helix	trans	-67.5	-44.5	177.9	-66.9	163.7	0	0	0	110.1	P157 L158 W164 L165	P157-I161 WeakPolarHBondContact O-CB 3.36Å; P157-I161 VanDerWaalsContact O-CG1 3.27Å; P157-I161 WeakPolarHBondContact O-CG1 3.37Å; P157-I161 PolarHBondContact O-N 3.42Å; L158-I161 PolarHBondContact O-N 3.19Å; I161-W164 PolarHBondContact O-N 3.49Å; I161-L165 HydrophobicContact CG2-CD1 3.85Å; I161-L165 HydrophobicContact CG2-CG 4.35Å; I161-L165 WeakPolarHBondContact O-CB 3.22Å; I161-L165 VanDerWaalsContact O-CG 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3.31Å; I161-L165 PolarHBondContact O-N 3.34Å
162	S	91.1	Very high	89.2	Confident	65 Å²	65	78.4 Å²	78.4	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-60.2	-47.8	176.1	174.5	0	0	0	0	111.4	L158 W164 L165 C166	L158-S162 WeakPolarHBondContact O-CB 3.41Å; L158-S162 PolarHBondContact O-N 2.94Å; S162-W164 VanDerWaalsContact C-N 3.33Å; S162-W164 PolarHBondContact O-N 3.32Å; S162-L165 PolarHBondContact O-N 3.01Å; S162-C166 WeakPolarHBondContact O-CB 3.16Å; S162-C166 PolarHBondContact O-N 3.04Å; S162-C166 PolarHBondContact O-SG 3.26Å
163	G	89.2	Confident	88.7	Confident	32 Å²	32	80.2 Å²	80.2	33%	0.33	43%	0.432	S	S	.	.	H	α-helix	trans	-59.7	-42.2	176.1	0	0	0	0	0	112.7	A159 L167	A159-G163 PolarHBondContact O-N 3.28Å; G163-L167 WeakPolarHBondContact O-CB 3.33Å; G163-L167 PolarHBondContact O-N 3.01Å
164	W	92.2	Very high	88.1	Confident	147 Å²	147	78.7 Å²	78.7	56%	0.557	42%	0.424	S	S	*	.	H	α-helix	trans	-63.4	-46.7	176.4	176.4	-98.3	0	0	0	112.9	T160 I161 S162 L167 R168	T160-W164 WeakPolarHBondContact O-CB 3.47Å; T160-W164 PolarHBondContact O-N 3.34Å; I161-W164 PolarHBondContact O-N 3.49Å; S162-W164 VanDerWaalsContact C-N 3.33Å; S162-W164 PolarHBondContact O-N 3.32Å; W164-L167 PolarHBondContact O-N 2.9Å; W164-R168 PolarHBondContact O-N 2.91Å
165	L	91.3	Very high	87.4	Confident	110 Å²	110	80.4 Å²	80.4	58%	0.576	43%	0.433	S	S	*	.	H	α-helix	trans	-63.4	-42.7	178.2	-72.6	170.6	0	0	0	111.4	I161 S162 L167 R168 G169	I161-L165 HydrophobicContact CG2-CD1 3.85Å; I161-L165 HydrophobicContact CG2-CG 4.35Å; I161-L165 WeakPolarHBondContact O-CB 3.22Å; I161-L165 VanDerWaalsContact O-CG 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3.31Å; I161-L165 PolarHBondContact O-N 3.34Å; S162-L165 PolarHBondContact O-N 3.01Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 2.92Å; L165-R168 PolarHBondContact O-N 3.33Å; L165-G169 PolarHBondContact O-N 3.43Å
166	C	89	Confident	86.6	Confident	39 Å²	39	84.9 Å²	84.9	26%	0.264	45%	0.45	S	S	.	.	H	α-helix	trans	-65	-37.5	176.5	-70.7	0	0	0	0	112.4	S162 A170 T189	S162-C166 WeakPolarHBondContact O-CB 3.16Å; S162-C166 PolarHBondContact O-N 3.04Å; S162-C166 PolarHBondContact O-SG 3.26Å; C166-A170 VanDerWaalsContact O-CB 3.27Å; C166-A170 WeakPolarHBondContact O-CB 2.94Å; C166-A170 PolarHBondContact O-N 3.4Å; C166-T189 HydrophobicContact CB-CG2 3.35Å; C166-T189 VanDerWaalsContact SG-CG2 3.52Å
167	L	85.9	Confident	85.5	Confident	98 Å²	98	88.2 Å²	88.2	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-44.3	176.6	-174.2	62.5	0	0	0	111.5	G163 W164 L165 A170 V171	G163-L167 WeakPolarHBondContact O-CB 3.33Å; G163-L167 PolarHBondContact O-N 3.01Å; W164-L167 PolarHBondContact O-N 2.9Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 2.92Å; L167-A170 PolarHBondContact O-N 2.98Å; L167-V171 VanDerWaalsContact O-CG2 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3.36Å; L167-V171 PolarHBondContact O-N 3.44Å; L167-V171 VanDerWaalsContact O-N 3.1Å
168	R	88.6	Confident	84.6	Confident	152 Å²	152	86.9 Å²	86.9	57%	0.574	47%	0.468	S	S	*	.	H	α-helix	trans	-62	-49.2	174.4	-77.7	-157.4	177.1	-163.7	-1.5	112	W164 L165 A170 V171 D172	W164-R168 PolarHBondContact O-N 2.91Å; L165-R168 PolarHBondContact O-N 3.33Å; R168-A170 VanDerWaalsContact C-N 3.29Å; R168-A170 PolarHBondContact O-N 2.85Å; R168-V171 WeakPolarHBondContact O-CB 3.31Å; R168-V171 PolarHBondContact O-N 2.96Å; R168-V171 VanDerWaalsContact O-N 3.12Å; R168-D172 PolarHBondContact O-N 2.78Å
169	G	85.6	Confident	84.1	Confident	33 Å²	33	90.9 Å²	90.9	34%	0.34	48%	0.475	S	S	.	.	H	α-helix	trans	-59.7	-38.5	178.7	0	0	0	0	0	112.7	L165 D172 H173	L165-G169 PolarHBondContact O-N 3.43Å; G169-D172 PolarHBondContact O-N 2.7Å; G169-H173 WeakPolarHBondContact O-CB 3.31Å; G169-H173 PolarHBondContact O-N 3.38Å
170	A	85.2	Confident	83.8	Confident	1 Å²	1	96.9 Å²	96.9	1%	0.008	50%	0.503	C	S	.	.	H	α-helix	trans	-67.3	-37.5	176.2	0	0	0	0	0	112.8	C166 L167 R168 H173 L174 A182 I186	C166-A170 VanDerWaalsContact O-CB 3.27Å; C166-A170 WeakPolarHBondContact O-CB 2.94Å; C166-A170 PolarHBondContact O-N 3.4Å; L167-A170 PolarHBondContact O-N 2.98Å; R168-A170 VanDerWaalsContact C-N 3.29Å; R168-A170 PolarHBondContact O-N 2.85Å; A170-H173 PolarHBondContact O-N 3.17Å; A170-L174 WeakPolarHBondContact O-CB 3.03Å; A170-L174 VanDerWaalsContact O-CG 3.24Å; A170-L174 WeakPolarHBondContact O-CG 3.01Å; A170-L174 PolarHBondContact O-N 3.42Å; A170-A182 HydrophobicContact CB-CB 4.4Å; A170-I186 HydrophobicContact CB-CD1 3.71Å; A170-I186 HydrophobicContact CB-CG1 3.62Å
171	V	84.8	Confident	83.5	Confident	87 Å²	87	98.9 Å²	98.9	53%	0.527	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-43.2	174	170.5	0	0	0	0	110.8	L167 R168 L174 H175	L167-V171 VanDerWaalsContact O-CG2 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3.36Å; L167-V171 PolarHBondContact O-N 3.44Å; L167-V171 VanDerWaalsContact O-N 3.1Å; R168-V171 WeakPolarHBondContact O-CB 3.31Å; R168-V171 PolarHBondContact O-N 2.96Å; R168-V171 VanDerWaalsContact O-N 3.12Å; V171-L174 PolarHBondContact O-N 3.24Å; V171-H175 PolarHBondContact O-N 3.23Å
172	D	83.3	Confident	83.1	Confident	109 Å²	109	94.3 Å²	94.3	58%	0.583	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-39	177.6	-65.4	-26.5	0	0	0	111.6	R168 G169 H175 F176	R168-D172 PolarHBondContact O-N 2.78Å; G169-D172 PolarHBondContact O-N 2.7Å; D172-H175 WeakPolarHBondContact O-CB 3.39Å; D172-H175 PolarHBondContact O-N 3.31Å; D172-F176 PolarHBondContact O-N 3.08Å
173	H	79.7	Confident	82.9	Confident	82 Å²	82	95.5 Å²	95.5	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-70.3	-32.9	178.2	-129.6	-99.7	0	0	0	113.3	G169 A170 H175 F176 S177 S178 E181 A182	G169-H173 WeakPolarHBondContact O-CB 3.31Å; G169-H173 PolarHBondContact O-N 3.38Å; A170-H173 PolarHBondContact O-N 3.17Å; H173-H175 PolarHBondContact O-N 3.21Å; H173-F176 PolarHBondContact O-N 3.41Å; H173-S177 PolarHBondContact O-N 3.01Å; H173-S178 PolarHBondContact CE1-OG 3.42Å; H173-S178 PolarHBondContact ND1-OG 2.99Å; H173-E181 IonicContact CE1-OE2 3.87Å; H173-E181 PolarHBondContact CE1-OE2 2.98Å; H173-E181 VanDerWaalsContact CE1-OE2 3.29Å; H173-E181 IonicContact ND1-OE2 2.74Å; H173-A182 HydrophobicContact CB-CB 4.35Å
174	L	77.3	Confident	82.9	Confident	84 Å²	84	95.9 Å²	95.9	44%	0.44	49%	0.492	S	S	.	.	H	α-helix	trans	-62.8	-26.1	172.7	-80.6	166.9	0	0	0	112.1	A170 V171 R179 A182	A170-L174 WeakPolarHBondContact O-CB 3.03Å; A170-L174 VanDerWaalsContact O-CG 3.24Å; A170-L174 WeakPolarHBondContact O-CG 3.01Å; A170-L174 PolarHBondContact O-N 3.42Å; V171-L174 PolarHBondContact O-N 3.24Å; L174-R179 HydrophobicContact CD2-CB 4.46Å; L174-R179 HydrophobicContact CD2-CG 4.3Å; L174-A182 HydrophobicContact CD2-CB 4.18Å; L174-A182 HydrophobicContact CG-CB 3.93Å
175	H	78.8	Confident	82.6	Confident	157 Å²	157	93.1 Å²	93.1	73%	0.727	49%	0.487	S	S	*	.	H	α-helix	trans	-78.5	-29.7	177.1	-169.3	-85.2	0	0	0	112.8	V171 D172 H173	V171-H175 PolarHBondContact O-N 3.23Å; D172-H175 WeakPolarHBondContact O-CB 3.39Å; D172-H175 PolarHBondContact O-N 3.31Å; H173-H175 PolarHBondContact O-N 3.21Å
176	F	71.6	Confident	82.4	Confident	165 Å²	165	90.7 Å²	90.7	72%	0.724	47%	0.474	S	S	*	.	H	α-helix	trans	-102.8	-41.9	-165.8	-108.6	-87.9	0	0	0	117.6	D172 H173	D172-F176 PolarHBondContact O-N 3.08Å; H173-F176 PolarHBondContact O-N 3.41Å
177	S	65.9	Low	82.5	Confident	122 Å²	122	91.6 Å²	91.6	85%	0.853	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.8	-18.2	175.4	-92.5	0	0	0	0	120.8	H173	H173-S177 PolarHBondContact O-N 3.01Å
178	S	74.6	Confident	82.7	Confident	29 Å²	29	91.7 Å²	91.7	20%	0.203	49%	0.485	C	S	.	.			trans	-134.7	96.5	-172.6	56.1	0	0	0	0	114.2	H173 L180 E181 A182	H173-S178 PolarHBondContact CE1-OG 3.42Å; H173-S178 PolarHBondContact ND1-OG 2.99Å; S178-L180 VanDerWaalsContact C-N 3.31Å; S178-L180 PolarHBondContact O-N 2.71Å; S178-E181 WeakPolarHBondContact CB-OE2 3.2Å; S178-E181 PolarHBondContact O-N 3.31Å; S178-E181 PolarHBondContact OG-OE2 2.99Å; S178-A182 PolarHBondContact O-N 3.39Å
179	R	79.9	Confident	82.7	Confident	198 Å²	198	85.8 Å²	85.8	75%	0.747	47%	0.466	S	S	*	.	H	α-helix	trans	-63.4	-33.1	-179.6	-58.4	-177.9	93	-177.8	6.9	113.1	L174 V183	L174-R179 HydrophobicContact CD2-CB 4.46Å; L174-R179 HydrophobicContact CD2-CG 4.3Å; R179-V183 WeakPolarHBondContact O-CB 3.26Å; R179-V183 WeakPolarHBondContact O-CG2 3.46Å; R179-V183 PolarHBondContact O-N 3.44Å
180	L	83.3	Confident	83	Confident	154 Å²	154	88.1 Å²	88.1	81%	0.806	47%	0.473	S	S	*	.	H	α-helix	trans	-69.8	-37.8	-176.8	-65.5	175.7	0	0	0	112.8	S178 V183 G184	S178-L180 VanDerWaalsContact C-N 3.31Å; S178-L180 PolarHBondContact O-N 2.71Å; L180-V183 PolarHBondContact O-N 2.94Å; L180-G184 PolarHBondContact O-N 2.92Å
181	E	82.6	Confident	83.3	Confident	117 Å²	117	90.2 Å²	90.2	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-69.8	-42.5	178.9	-66	175.3	165.8	0	0	111.2	H173 S178 V183 G184 L185	H173-E181 IonicContact CE1-OE2 3.87Å; H173-E181 PolarHBondContact CE1-OE2 2.98Å; H173-E181 VanDerWaalsContact CE1-OE2 3.29Å; H173-E181 IonicContact ND1-OE2 2.74Å; S178-E181 WeakPolarHBondContact CB-OE2 3.2Å; S178-E181 PolarHBondContact O-N 3.31Å; S178-E181 PolarHBondContact OG-OE2 2.99Å; E181-V183 PolarHBondContact O-N 3.22Å; E181-G184 PolarHBondContact O-N 3.31Å; E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 2.98Å
182	A	86.3	Confident	83.6	Confident	0 Å²	0	91 Å²	91	0%	0	49%	0.492	C	S	.	.	H	α-helix	trans	-61.4	-43.5	174.1	0	0	0	0	0	111.8	A170 H173 L174 S178 G184 L185 I186	A170-A182 HydrophobicContact CB-CB 4.4Å; H173-A182 HydrophobicContact CB-CB 4.35Å; L174-A182 HydrophobicContact CD2-CB 4.18Å; L174-A182 HydrophobicContact CG-CB 3.93Å; S178-A182 PolarHBondContact O-N 3.39Å; A182-G184 VanDerWaalsContact C-N 3.34Å; A182-G184 PolarHBondContact O-N 3.47Å; A182-L185 PolarHBondContact O-N 3.3Å; A182-I186 VanDerWaalsContact O-CG1 3.27Å; A182-I186 WeakPolarHBondContact O-CG1 3.4Å; A182-I186 PolarHBondContact O-N 3.45Å
183	V	86.3	Confident	83.9	Confident	89 Å²	89	90.5 Å²	90.5	54%	0.539	48%	0.484	S	S	.	.	H	α-helix	trans	-62.8	-41.1	176.3	170.1	0	0	0	0	111.1	R179 L180 E181 I186 A187	R179-V183 WeakPolarHBondContact O-CB 3.26Å; R179-V183 WeakPolarHBondContact O-CG2 3.46Å; R179-V183 PolarHBondContact O-N 3.44Å; L180-V183 PolarHBondContact O-N 2.94Å; E181-V183 PolarHBondContact O-N 3.22Å; V183-I186 PolarHBondContact O-N 3.37Å; V183-A187 VanDerWaalsContact O-CB 3.3Å; V183-A187 WeakPolarHBondContact O-CB 3.46Å; V183-A187 PolarHBondContact O-N 3.36Å
184	G	88.1	Confident	84.5	Confident	41 Å²	41	90.2 Å²	90.2	42%	0.423	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-45.2	175.7	0	0	0	0	0	113.2	L180 E181 A182 A187 L188	L180-G184 PolarHBondContact O-N 2.92Å; E181-G184 PolarHBondContact O-N 3.31Å; A182-G184 VanDerWaalsContact C-N 3.34Å; A182-G184 PolarHBondContact O-N 3.47Å; G184-A187 PolarHBondContact O-N 2.86Å; G184-L188 WeakPolarHBondContact O-CB 3.26Å; G184-L188 PolarHBondContact O-N 2.87Å
185	L	86	Confident	85.2	Confident	88 Å²	88	91.5 Å²	91.5	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-41.4	177.2	-71.1	172.5	0	0	0	112.4	E181 A182 L188 T189	E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 2.98Å; A182-L185 PolarHBondContact O-N 3.3Å; L185-L188 PolarHBondContact O-N 3.32Å; L185-T189 WeakPolarHBondContact O-CB 3.36Å; L185-T189 WeakPolarHBondContact O-CG2 3.45Å; L185-T189 PolarHBondContact O-N 2.84Å; L185-T189 PolarHBondContact O-OG1 3.38Å
186	I	88.2	Confident	85.8	Confident	59 Å²	59	85.3 Å²	85.3	30%	0.303	47%	0.465	S	S	.	.	H	α-helix	trans	-64	-46.1	175.3	-67.4	166.1	0	0	0	110.1	A170 A182 V183 L188 T189 V190	A170-I186 HydrophobicContact CB-CD1 3.71Å; A170-I186 HydrophobicContact CB-CG1 3.62Å; A182-I186 VanDerWaalsContact O-CG1 3.27Å; A182-I186 WeakPolarHBondContact O-CG1 3.4Å; A182-I186 PolarHBondContact O-N 3.45Å; V183-I186 PolarHBondContact O-N 3.37Å; I186-L188 PolarHBondContact O-N 3.24Å; I186-T189 WeakPolarHBondContact CA-OG1 3.29Å; I186-T189 PolarHBondContact O-N 3.32Å; I186-T189 PolarHBondContact O-OG1 3.39Å; I186-V190 HydrophobicContact CG2-CG2 4.33Å; I186-V190 WeakPolarHBondContact O-CB 3.46Å; I186-V190 VanDerWaalsContact O-CG2 3.29Å; I186-V190 WeakPolarHBondContact O-CG2 3.44Å; I186-V190 PolarHBondContact O-N 3.26Å
187	A	90.9	Very high	86.7	Confident	58 Å²	58	80.9 Å²	80.9	48%	0.479	45%	0.449	S	S	.	.	H	α-helix	trans	-61.7	-43	179.4	0	0	0	0	0	112	V183 G184 A191	V183-A187 VanDerWaalsContact O-CB 3.3Å; V183-A187 WeakPolarHBondContact O-CB 3.46Å; V183-A187 PolarHBondContact O-N 3.36Å; G184-A187 PolarHBondContact O-N 2.86Å; A187-A191 WeakPolarHBondContact O-CB 3.3Å; A187-A191 PolarHBondContact O-N 2.86Å
188	L	89.4	Confident	88	Confident	101 Å²	101	82 Å²	82	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-64.9	-42.2	177.4	-178	140.5	0	0	0	112.2	G184 L185 I186 A191 L192	G184-L188 WeakPolarHBondContact O-CB 3.26Å; G184-L188 PolarHBondContact O-N 2.87Å; L185-L188 PolarHBondContact O-N 3.32Å; I186-L188 PolarHBondContact O-N 3.24Å; L188-A191 PolarHBondContact O-N 2.96Å; L188-L192 HydrophobicContact CD2-CD1 3.64Å; L188-L192 HydrophobicContact CD2-CG 4.41Å; L188-L192 HydrophobicContact CG-CD1 4.31Å; L188-L192 WeakPolarHBondContact O-CG 3.33Å; L188-L192 PolarHBondContact O-N 3.23Å
189	T	89.9	Confident	88.9	Confident	27 Å²	27	85 Å²	85	17%	0.166	45%	0.445	C	S	.	.	H	α-helix	trans	-67.3	-41.9	178.6	55	0	0	0	0	111.9	C166 L185 I186 L192 F193	C166-T189 HydrophobicContact CB-CG2 3.35Å; C166-T189 VanDerWaalsContact SG-CG2 3.52Å; L185-T189 WeakPolarHBondContact O-CB 3.36Å; L185-T189 WeakPolarHBondContact O-CG2 3.45Å; L185-T189 PolarHBondContact O-N 2.84Å; L185-T189 PolarHBondContact O-OG1 3.38Å; I186-T189 WeakPolarHBondContact CA-OG1 3.29Å; I186-T189 PolarHBondContact O-N 3.32Å; I186-T189 PolarHBondContact O-OG1 3.39Å; T189-L192 PolarHBondContact O-N 3.33Å; T189-F193 VanDerWaalsContact O-CB 3.26Å; T189-F193 WeakPolarHBondContact O-CB 3.41Å; T189-F193 PolarHBondContact O-N 3.43Å
190	V	90.7	Very high	89.4	Confident	82 Å²	82	76.7 Å²	76.7	50%	0.497	42%	0.417	S	S	.	.	H	α-helix	trans	-60.8	-46.3	173	172	0	0	0	0	110.5	I186 F193 T194	I186-V190 HydrophobicContact CG2-CG2 4.33Å; I186-V190 WeakPolarHBondContact O-CB 3.46Å; I186-V190 VanDerWaalsContact O-CG2 3.29Å; I186-V190 WeakPolarHBondContact O-CG2 3.44Å; I186-V190 PolarHBondContact O-N 3.26Å; V190-F193 PolarHBondContact O-N 3.32Å; V190-T194 HydrophobicContact CG1-CG2 4.29Å; V190-T194 VanDerWaalsContact O-CG2 3.26Å; V190-T194 WeakPolarHBondContact O-CG2 3.24Å; V190-T194 PolarHBondContact O-N 2.63Å; V190-T194 PolarHBondContact O-OG1 2.62Å
191	A	92.7	Very high	89.8	Confident	45 Å²	45	73.8 Å²	73.8	37%	0.372	40%	0.401	S	S	.	.	H	α-helix	trans	-59.4	-50.6	178.2	0	0	0	0	0	112	A187 L188 F193 T194 I195	A187-A191 WeakPolarHBondContact O-CB 3.3Å; A187-A191 PolarHBondContact O-N 2.86Å; L188-A191 PolarHBondContact O-N 2.96Å; A191-F193 VanDerWaalsContact C-N 3.32Å; A191-F193 PolarHBondContact O-N 3.01Å; A191-T194 PolarHBondContact O-N 2.97Å; A191-T194 PolarHBondContact O-OG1 3.4Å; A191-I195 WeakPolarHBondContact O-CG1 3.09Å; A191-I195 PolarHBondContact O-N 3.45Å
192	L	89.4	Confident	90.3	Very high	105 Å²	105	72 Å²	72	55%	0.55	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-40.1	178.1	-69.6	176.3	0	0	0	112.3	L188 T189 I195 Y196	L188-L192 HydrophobicContact CD2-CD1 3.64Å; L188-L192 HydrophobicContact CD2-CG 4.41Å; L188-L192 HydrophobicContact CG-CD1 4.31Å; L188-L192 WeakPolarHBondContact O-CG 3.33Å; L188-L192 PolarHBondContact O-N 3.23Å; T189-L192 PolarHBondContact O-N 3.33Å; L192-I195 PolarHBondContact O-N 3.42Å; L192-Y196 WeakPolarHBondContact O-CB 3.4Å; L192-Y196 PolarHBondContact O-N 3.12Å
193	F	90.3	Very high	90.6	Very high	97 Å²	97	72.4 Å²	72.4	43%	0.425	40%	0.401	S	S	.	.	H	α-helix	trans	-65.9	-40.6	176.5	-171.4	-106.7	0	0	0	112	T189 V190 A191 Y196 L197	T189-F193 VanDerWaalsContact O-CB 3.26Å; T189-F193 WeakPolarHBondContact O-CB 3.41Å; T189-F193 PolarHBondContact O-N 3.43Å; V190-F193 PolarHBondContact O-N 3.32Å; A191-F193 VanDerWaalsContact C-N 3.32Å; A191-F193 PolarHBondContact O-N 3.01Å; F193-Y196 WeakPolarHBondContact O-CB 3.39Å; F193-Y196 PolarHBondContact O-N 3.41Å; F193-L197 HydrophobicContact CD1-CD1 3.8Å; F193-L197 HydrophobicContact CD1-CG 4.13Å; F193-L197 HydrophobicContact CE1-CD1 3.38Å; F193-L197 HydrophobicContact CE1-CD2 4.29Å; F193-L197 HydrophobicContact CE1-CG 3.86Å; F193-L197 HydrophobicContact CZ-CD1 3.98Å; F193-L197 HydrophobicContact CZ-CD2 4.04Å; F193-L197 HydrophobicContact CZ-CG 4.07Å; F193-L197 WeakPolarHBondContact O-CG 3.36Å; F193-L197 PolarHBondContact O-N 3.32Å
194	T	91.5	Very high	90.7	Very high	76 Å²	76	74.6 Å²	74.6	47%	0.466	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-41.4	175.8	59.7	0	0	0	0	112.4	V190 A191 Y196 L197 F198	V190-T194 HydrophobicContact CG1-CG2 4.29Å; V190-T194 VanDerWaalsContact O-CG2 3.26Å; V190-T194 WeakPolarHBondContact O-CG2 3.24Å; V190-T194 PolarHBondContact O-N 2.63Å; V190-T194 PolarHBondContact O-OG1 2.62Å; A191-T194 PolarHBondContact O-N 2.97Å; A191-T194 PolarHBondContact O-OG1 3.4Å; T194-Y196 VanDerWaalsContact C-N 3.33Å; T194-L197 PolarHBondContact O-N 3.45Å; T194-F198 WeakPolarHBondContact O-CB 3.24Å; T194-F198 PolarHBondContact O-N 2.73Å
195	I	92.9	Very high	90.9	Very high	111 Å²	111	81.3 Å²	81.3	57%	0.569	42%	0.416	S	S	*	.	H	α-helix	trans	-61.6	-45	174.6	-67.5	165.4	0	0	0	109.9	A191 L192 F198 W199	A191-I195 WeakPolarHBondContact O-CG1 3.09Å; A191-I195 PolarHBondContact O-N 3.45Å; L192-I195 PolarHBondContact O-N 3.42Å; I195-F198 PolarHBondContact O-N 2.92Å; I195-W199 WeakPolarHBondContact O-CB 3.27Å; I195-W199 PolarHBondContact O-N 3.22Å
196	Y	90.4	Very high	91.1	Very high	28 Å²	28	82.4 Å²	82.4	11%	0.11	42%	0.415	C	S	.	.	H	α-helix	trans	-58.8	-51.3	176.4	177.8	-107.8	0	0	0	111.7	I155 T156 L192 F193 T194 F198 W199 T200	I155-Y196 HydrophobicContact CB-CE2 4.28Å; I155-Y196 HydrophobicContact CG2-CD2 4.03Å; I155-Y196 HydrophobicContact CG2-CE2 3.63Å; T156-Y196 WeakPolarHBondContact CA-OH 3.25Å; T156-Y196 WeakPolarHBondContact CB-OH 3.4Å; T156-Y196 HydrophobicContact CG2-CE1 4.4Å; T156-Y196 PolarHBondContact N-OH 3.25Å; T156-Y196 PolarHBondContact OG1-OH 2.97Å; L192-Y196 WeakPolarHBondContact O-CB 3.4Å; L192-Y196 PolarHBondContact O-N 3.12Å; F193-Y196 WeakPolarHBondContact O-CB 3.39Å; F193-Y196 PolarHBondContact O-N 3.41Å; T194-Y196 VanDerWaalsContact C-N 3.33Å; Y196-F198 VanDerWaalsContact C-N 3.33Å; Y196-F198 PolarHBondContact O-N 3.36Å; Y196-W199 HydrophobicContact CD2-CE3 4.49Å; Y196-W199 HydrophobicContact CE2-CE3 4.31Å; Y196-W199 HydrophobicContact CE2-CZ3 4.41Å; Y196-W199 PolarHBondContact O-N 2.89Å; Y196-T200 HydrophobicContact CD1-CG2 3.93Å; Y196-T200 HydrophobicContact CD2-CG2 4.07Å; Y196-T200 HydrophobicContact CE1-CG2 3.54Å; Y196-T200 HydrophobicContact CE2-CG2 3.67Å; Y196-T200 HydrophobicContact CG-CG2 4.17Å; Y196-T200 WeakPolarHBondContact O-CG2 3.35Å; Y196-T200 PolarHBondContact O-N 3.41Å
197	L	90.6	Very high	91.1	Very high	72 Å²	72	80.1 Å²	80.1	38%	0.377	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-40.4	177.7	-71.8	-175.4	0	0	0	112.5	F193 T194 T200 L201	F193-L197 HydrophobicContact CD1-CD1 3.8Å; F193-L197 HydrophobicContact CD1-CG 4.13Å; F193-L197 HydrophobicContact CE1-CD1 3.38Å; F193-L197 HydrophobicContact CE1-CD2 4.29Å; F193-L197 HydrophobicContact CE1-CG 3.86Å; F193-L197 HydrophobicContact CZ-CD1 3.98Å; F193-L197 HydrophobicContact CZ-CD2 4.04Å; F193-L197 HydrophobicContact CZ-CG 4.07Å; F193-L197 WeakPolarHBondContact O-CG 3.36Å; F193-L197 PolarHBondContact O-N 3.32Å; T194-L197 PolarHBondContact O-N 3.45Å; L197-T200 PolarHBondContact O-N 3.48Å; L197-T200 PolarHBondContact O-OG1 3.4Å; L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 WeakPolarHBondContact O-CD1 3.47Å; L197-L201 WeakPolarHBondContact O-CG 3.46Å; L197-L201 PolarHBondContact O-N 2.76Å
198	F	94.4	Very high	90.9	Very high	144 Å²	144	79.5 Å²	79.5	63%	0.632	40%	0.395	S	S	*	.	H	α-helix	trans	-62.5	-47.1	175.9	177.7	-100.5	0	0	0	111.3	T194 I195 Y196 T200 L201 V202	T194-F198 WeakPolarHBondContact O-CB 3.24Å; T194-F198 PolarHBondContact O-N 2.73Å; I195-F198 PolarHBondContact O-N 2.92Å; Y196-F198 VanDerWaalsContact C-N 3.33Å; Y196-F198 PolarHBondContact O-N 3.36Å; F198-T200 PolarHBondContact O-N 3.48Å; F198-L201 PolarHBondContact O-N 2.95Å; F198-V202 HydrophobicContact CD1-CG2 4.42Å; F198-V202 HydrophobicContact CD2-CG2 4.49Å; F198-V202 HydrophobicContact CE1-CG2 3.99Å; F198-V202 HydrophobicContact CE2-CG2 4.07Å; F198-V202 HydrophobicContact CZ-CG2 3.81Å; F198-V202 WeakPolarHBondContact O-CG2 3.48Å; F198-V202 PolarHBondContact O-N 3.39Å
199	W	93	Very high	90.9	Very high	94 Å²	94	83.8 Å²	83.8	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-45.1	176.4	179.4	79.7	0	0	0	111.9	C151 F152 I195 Y196 L201 V202 S203	C151-W199 HydrophobicContact CB-CH2 3.75Å; C151-W199 HydrophobicContact CB-CZ3 4.37Å; F152-W199 HydrophobicContact CD1-CZ3 4.01Å; F152-W199 HydrophobicContact CE1-CE3 4.02Å; F152-W199 HydrophobicContact CE1-CH2 4.14Å; F152-W199 AromaticContact CE1-CZ3 3.42Å; F152-W199 HydrophobicContact CE1-CZ3 3.42Å; F152-W199 VanDerWaalsContact CE1-CZ3 3.42Å; F152-W199 HydrophobicContact CZ-CE3 4.48Å; F152-W199 HydrophobicContact CZ-CH2 4.19Å; F152-W199 AromaticContact CZ-CZ3 3.87Å; F152-W199 HydrophobicContact CZ-CZ3 3.87Å; I195-W199 WeakPolarHBondContact O-CB 3.27Å; I195-W199 PolarHBondContact O-N 3.22Å; Y196-W199 HydrophobicContact CD2-CE3 4.49Å; Y196-W199 HydrophobicContact CE2-CE3 4.31Å; Y196-W199 HydrophobicContact CE2-CZ3 4.41Å; Y196-W199 PolarHBondContact O-N 2.89Å; W199-L201 VanDerWaalsContact C-N 3.34Å; W199-L201 PolarHBondContact O-N 2.95Å; W199-V202 PolarHBondContact O-N 2.86Å; W199-S203 WeakPolarHBondContact O-CB 3.23Å; W199-S203 PolarHBondContact O-N 3.03Å
200	T	91.1	Very high	90.8	Very high	23 Å²	23	84 Å²	84	14%	0.141	40%	0.403	C	S	.	.	H	α-helix	trans	-61.8	-42.3	178.4	71.8	0	0	0	0	111.6	F152 Y196 L197 F198 F204	F152-T200 HydrophobicContact CD1-CG2 4.1Å; F152-T200 HydrophobicContact CE1-CG2 3.46Å; F152-T200 VanDerWaalsContact CE1-CG2 3.46Å; F152-T200 HydrophobicContact CZ-CG2 4.48Å; Y196-T200 HydrophobicContact CD1-CG2 3.93Å; Y196-T200 HydrophobicContact CD2-CG2 4.07Å; Y196-T200 HydrophobicContact CE1-CG2 3.54Å; Y196-T200 HydrophobicContact CE2-CG2 3.67Å; Y196-T200 HydrophobicContact CG-CG2 4.17Å; Y196-T200 WeakPolarHBondContact O-CG2 3.35Å; Y196-T200 PolarHBondContact O-N 3.41Å; L197-T200 PolarHBondContact O-N 3.48Å; L197-T200 PolarHBondContact O-OG1 3.4Å; F198-T200 PolarHBondContact O-N 3.48Å; T200-F204 WeakPolarHBondContact O-CB 3.3Å; T200-F204 PolarHBondContact O-N 2.93Å
201	L	91.6	Very high	90.5	Very high	93 Å²	93	81.6 Å²	81.6	49%	0.487	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-44.2	178.4	-73.8	170.5	0	0	0	111.9	L197 F198 W199 R205	L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 WeakPolarHBondContact O-CD1 3.47Å; L197-L201 WeakPolarHBondContact O-CG 3.46Å; L197-L201 PolarHBondContact O-N 2.76Å; F198-L201 PolarHBondContact O-N 2.95Å; W199-L201 VanDerWaalsContact C-N 3.34Å; W199-L201 PolarHBondContact O-N 2.95Å; L201-R205 VanDerWaalsContact O-CB 3.3Å; L201-R205 WeakPolarHBondContact O-CB 3.41Å; L201-R205 WeakPolarHBondContact O-CG 3.19Å; L201-R205 PolarHBondContact O-N 2.89Å
202	V	93.5	Very high	90.1	Very high	79 Å²	79	83.2 Å²	83.2	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-64.8	-48	177.9	172.1	0	0	0	0	110.7	F198 W199 R205 Y206	F198-V202 HydrophobicContact CD1-CG2 4.42Å; F198-V202 HydrophobicContact CD2-CG2 4.49Å; F198-V202 HydrophobicContact CE1-CG2 3.99Å; F198-V202 HydrophobicContact CE2-CG2 4.07Å; F198-V202 HydrophobicContact CZ-CG2 3.81Å; F198-V202 WeakPolarHBondContact O-CG2 3.48Å; F198-V202 PolarHBondContact O-N 3.39Å; W199-V202 PolarHBondContact O-N 2.86Å; V202-R205 PolarHBondContact O-N 3.33Å; V202-Y206 WeakPolarHBondContact O-CB 3.23Å; V202-Y206 PolarHBondContact O-N 3.27Å
203	S	91.3	Very high	90	Very high	9 Å²	9	82.6 Å²	82.6	6%	0.063	38%	0.383	C	S	.	.	H	α-helix	trans	-60.4	-47	177.1	171.6	0	0	0	0	111.1	D148 W199 R205 Y206 H207	D148-S203 PolarHBondContact OD2-OG 2.98Å; W199-S203 WeakPolarHBondContact O-CB 3.23Å; W199-S203 PolarHBondContact O-N 3.03Å; S203-R205 PolarHBondContact O-N 3.41Å; S203-Y206 WeakPolarHBondContact O-CB 3.33Å; S203-Y206 PolarHBondContact O-N 2.92Å; S203-H207 PolarHBondContact O-CD2 3.33Å; S203-H207 VanDerWaalsContact O-CG 3.25Å; S203-H207 PolarHBondContact O-N 2.83Å; S203-H207 PolarHBondContact OG-CD2 3.43Å; S203-H207 PolarHBondContact OG-NE2 3.1Å
204	F	89.3	Confident	89.7	Confident	134 Å²	134	79.5 Å²	79.5	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-60.4	-44.6	175.8	-177.5	-104.2	0	0	0	112.7	T200 Y206 H207 C208	T200-F204 WeakPolarHBondContact O-CB 3.3Å; T200-F204 PolarHBondContact O-N 2.93Å; F204-Y206 VanDerWaalsContact C-N 3.31Å; F204-Y206 PolarHBondContact O-N 3.45Å; F204-H207 PolarHBondContact O-N 3.4Å; F204-C208 WeakPolarHBondContact CE1-SG 3.37Å; F204-C208 WeakPolarHBondContact CZ-SG 3.42Å; F204-C208 WeakPolarHBondContact O-CB 3.32Å; F204-C208 PolarHBondContact O-N 3.45Å; F204-C208 PolarHBondContact O-SG 2.98Å
205	R	91.7	Very high	89.3	Confident	183 Å²	183	81.1 Å²	81.1	69%	0.691	37%	0.366	S	S	*	.	H	α-helix	trans	-59.9	-41.6	175.9	-73.5	-105.9	169.1	77.6	-1.1	111.7	L201 V202 S203 R209	L201-R205 VanDerWaalsContact O-CB 3.3Å; L201-R205 WeakPolarHBondContact O-CB 3.41Å; L201-R205 WeakPolarHBondContact O-CG 3.19Å; L201-R205 PolarHBondContact O-N 2.89Å; V202-R205 PolarHBondContact O-N 3.33Å; S203-R205 PolarHBondContact O-N 3.41Å; R205-R209 WeakPolarHBondContact O-CB 3.49Å; R205-R209 PolarHBondContact O-N 3.32Å
206	Y	89.9	Confident	88.8	Confident	110 Å²	110	83.9 Å²	83.9	43%	0.431	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-48.6	174.9	173.1	-97.7	0	0	0	111.3	V202 S203 F204 C208 R209 L210	V202-Y206 WeakPolarHBondContact O-CB 3.23Å; V202-Y206 PolarHBondContact O-N 3.27Å; S203-Y206 WeakPolarHBondContact O-CB 3.33Å; S203-Y206 PolarHBondContact O-N 2.92Å; F204-Y206 VanDerWaalsContact C-N 3.31Å; F204-Y206 PolarHBondContact O-N 3.45Å; Y206-C208 PolarHBondContact O-N 3.04Å; Y206-R209 WeakPolarHBondContact O-CB 3.36Å; Y206-R209 PolarHBondContact O-N 3.49Å; Y206-L210 PolarHBondContact O-N 3.31Å
207	H	87.8	Confident	88.2	Confident	12 Å²	12	86.2 Å²	86.2	6%	0.056	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-42.2	178.8	-64.4	-35.4	0	0	0	112.8	L145 D148 S203 F204 R209 L210 Y211	L145-H207 WeakPolarHBondContact CD2-CE1 3.35Å; L145-H207 WeakPolarHBondContact CD2-ND1 3.17Å; D148-H207 WeakPolarHBondContact CB-NE2 3.33Å; D148-H207 IonicContact OD2-CE1 3.29Å; D148-H207 PolarHBondContact OD2-CE1 3.37Å; D148-H207 IonicContact OD2-NE2 3.41Å; D148-H207 PolarHBondContact OD2-NE2 3.4Å; S203-H207 PolarHBondContact O-CD2 3.33Å; S203-H207 VanDerWaalsContact O-CG 3.25Å; S203-H207 PolarHBondContact O-N 2.83Å; S203-H207 PolarHBondContact OG-CD2 3.43Å; S203-H207 PolarHBondContact OG-NE2 3.1Å; F204-H207 PolarHBondContact O-N 3.4Å; H207-R209 VanDerWaalsContact C-N 3.32Å; H207-R209 PolarHBondContact O-N 2.91Å; H207-L210 PolarHBondContact O-N 2.97Å; H207-Y211 WeakPolarHBondContact O-CB 3.46Å; H207-Y211 PolarHBondContact O-N 3.44Å
208	C	87	Confident	87.7	Confident	45 Å²	45	85.6 Å²	85.6	30%	0.304	38%	0.383	S	S	.	.	H	α-helix	trans	-62.1	-40.3	174.8	-72.5	0	0	0	0	112	F204 Y206 N212	F204-C208 WeakPolarHBondContact CE1-SG 3.37Å; F204-C208 WeakPolarHBondContact CZ-SG 3.42Å; F204-C208 WeakPolarHBondContact O-CB 3.32Å; F204-C208 PolarHBondContact O-N 3.45Å; F204-C208 PolarHBondContact O-SG 2.98Å; Y206-C208 PolarHBondContact O-N 3.04Å; C208-N212 WeakPolarHBondContact O-CB 3.49Å; C208-N212 VanDerWaalsContact O-CG 3.31Å; C208-N212 PolarHBondContact O-N 3.4Å
209	R	89.3	Confident	87.2	Confident	190 Å²	190	81.8 Å²	81.8	72%	0.717	37%	0.368	S	S	*	.	H	α-helix	trans	-63.4	-47.6	175.9	-177.8	-177.5	173.2	-176.5	-2.3	110.6	R205 Y206 H207 Y211 N212 E213	R205-R209 WeakPolarHBondContact O-CB 3.49Å; R205-R209 PolarHBondContact O-N 3.32Å; Y206-R209 WeakPolarHBondContact O-CB 3.36Å; Y206-R209 PolarHBondContact O-N 3.49Å; H207-R209 VanDerWaalsContact C-N 3.32Å; H207-R209 PolarHBondContact O-N 2.91Å; R209-Y211 VanDerWaalsContact C-N 3.35Å; R209-Y211 PolarHBondContact O-N 2.9Å; R209-N212 PolarHBondContact O-N 3.45Å; R209-E213 PolarHBondContact O-N 3.01Å
210	L	87.6	Confident	86.8	Confident	31 Å²	31	83.7 Å²	83.7	16%	0.162	38%	0.375	C	S	.	.	H	α-helix	trans	-62	-43.6	179.6	-172.7	62.7	0	0	0	111.7	E141 L145 Y206 H207 E213 W214	E141-L210 HydrophobicContact CB-CD2 4.36Å; E141-L210 WeakPolarHBondContact OE2-CD1 3.46Å; L145-L210 HydrophobicContact CD1-CD2 4.33Å; L145-L210 HydrophobicContact CD2-CD2 4.25Å; Y206-L210 PolarHBondContact O-N 3.31Å; H207-L210 PolarHBondContact O-N 2.97Å; L210-E213 PolarHBondContact O-N 3.48Å; L210-W214 WeakPolarHBondContact O-CB 3.31Å; L210-W214 PolarHBondContact O-N 2.86Å
211	Y	84.2	Confident	86.5	Confident	32 Å²	32	82.6 Å²	82.6	13%	0.125	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-44.1	175.1	173.8	-107.5	0	0	0	112.2	L129 W132 H207 R209 E213 W214 R215	L129-Y211 HydrophobicContact CD2-CD1 4.06Å; L129-Y211 HydrophobicContact CD2-CD2 3.65Å; L129-Y211 HydrophobicContact CD2-CE1 3.62Å; L129-Y211 HydrophobicContact CD2-CE2 3.19Å; L129-Y211 HydrophobicContact CD2-CG 4.08Å; L129-Y211 HydrophobicContact CG-CE1 4.31Å; L129-Y211 HydrophobicContact CG-CE2 3.95Å; L129-Y211 WeakPolarHBondContact CG-OH 3.27Å; W132-Y211 HydrophobicContact CB-CD2 4.33Å; W132-Y211 HydrophobicContact CB-CE2 4.29Å; W132-Y211 AromaticContact CD2-CD2 3.88Å; W132-Y211 HydrophobicContact CD2-CD2 3.88Å; W132-Y211 HydrophobicContact CE3-CD2 4.21Å; W132-Y211 AromaticContact CG-CD2 3.94Å; W132-Y211 HydrophobicContact CG-CD2 3.94Å; W132-Y211 HydrophobicContact CG-CE2 4.37Å; H207-Y211 WeakPolarHBondContact O-CB 3.46Å; H207-Y211 PolarHBondContact O-N 3.44Å; R209-Y211 VanDerWaalsContact C-N 3.35Å; R209-Y211 PolarHBondContact O-N 2.9Å; Y211-E213 VanDerWaalsContact C-N 3.34Å; Y211-E213 PolarHBondContact O-N 3.26Å; Y211-W214 HydrophobicContact CD2-CE3 4.47Å; Y211-W214 HydrophobicContact CE2-CE3 4.18Å; Y211-W214 HydrophobicContact CE2-CZ3 4.34Å; Y211-W214 PolarHBondContact O-N 3.06Å; Y211-R215 VanDerWaalsContact O-CB 3.3Å; Y211-R215 WeakPolarHBondContact O-CB 3.45Å; Y211-R215 PolarHBondContact O-N 2.96Å
212	N	85.6	Confident	86.3	Confident	80 Å²	80	80 Å²	80	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-38.4	178.5	-81	-10.3	0	0	0	112.3	C208 R209 R215 R216	C208-N212 WeakPolarHBondContact O-CB 3.49Å; C208-N212 VanDerWaalsContact O-CG 3.31Å; C208-N212 PolarHBondContact O-N 3.4Å; R209-N212 PolarHBondContact O-N 3.45Å; N212-R215 PolarHBondContact O-N 2.97Å; N212-R216 WeakPolarHBondContact O-CG 3.37Å; N212-R216 PolarHBondContact O-N 3.37Å; N212-R216 VanDerWaalsContact O-N 3.14Å
213	E	86.5	Confident	86	Confident	92 Å²	92	76.6 Å²	76.6	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-51.1	174.7	-162.8	62.6	-115.1	0	0	110.3	R209 L210 Y211 R215 R216 T217	R209-E213 PolarHBondContact O-N 3.01Å; L210-E213 PolarHBondContact O-N 3.48Å; Y211-E213 VanDerWaalsContact C-N 3.34Å; Y211-E213 PolarHBondContact O-N 3.26Å; E213-R215 VanDerWaalsContact C-N 3.28Å; E213-R215 PolarHBondContact O-N 2.9Å; E213-R216 WeakPolarHBondContact O-CB 3.27Å; E213-R216 PolarHBondContact O-N 3.43Å; E213-T217 PolarHBondContact O-N 3.2Å; E213-T217 VanDerWaalsContact O-N 3.07Å; E213-T217 PolarHBondContact O-OG1 2.96Å
214	W	84.2	Confident	85.7	Confident	31 Å²	31	80.5 Å²	80.5	12%	0.117	35%	0.353	C	S	.	.	H	α-helix	trans	-57.3	-41	176.7	179.5	92.2	0	0	0	112.5	R127 W132 L210 Y211 R216 T217 N218	R127-W214 HydrophobicContact CB-CH2 3.59Å; R127-W214 HydrophobicContact CB-CZ3 3.91Å; R127-W214 HydrophobicContact CG-CH2 4.45Å; W132-W214 HydrophobicContact CB-CD2 4.14Å; W132-W214 HydrophobicContact CB-CE3 3.87Å; W132-W214 HydrophobicContact CB-CH2 3.83Å; W132-W214 HydrophobicContact CB-CZ2 4.09Å; W132-W214 HydrophobicContact CB-CZ3 3.73Å; W132-W214 AromaticContact CD1-CD1 3.78Å; W132-W214 AromaticContact CD1-CD2 3.4Å; W132-W214 AromaticContact CD1-CE2 3.79Å; W132-W214 AromaticContact CD1-CE3 3.81Å; W132-W214 AromaticContact CD1-CG 3.43Å; W132-W214 VanDerWaalsContact CD1-CG 3.43Å; W132-W214 AromaticContact CD1-NE1 3.98Å; W132-W214 HydrophobicContact CG-CD2 4.1Å; W132-W214 HydrophobicContact CG-CE3 4.1Å; W132-W214 HydrophobicContact CG-CG 4.49Å; W132-W214 HydrophobicContact CG-CZ3 4.45Å; W132-W214 AromaticContact NE1-CG 4Å; L210-W214 WeakPolarHBondContact O-CB 3.31Å; L210-W214 PolarHBondContact O-N 2.86Å; Y211-W214 HydrophobicContact CD2-CE3 4.47Å; Y211-W214 HydrophobicContact CE2-CE3 4.18Å; Y211-W214 HydrophobicContact CE2-CZ3 4.34Å; Y211-W214 PolarHBondContact O-N 3.06Å; W214-R216 VanDerWaalsContact C-N 3.28Å; W214-R216 PolarHBondContact O-N 3.33Å; W214-T217 PolarHBondContact O-N 3.45Å; W214-T217 PolarHBondContact O-OG1 3.49Å; W214-N218 HydrophobicContact CD2-CB 4.12Å; W214-N218 HydrophobicContact CH2-CB 4.42Å; W214-N218 HydrophobicContact CZ2-CB 3.97Å; W214-N218 PolarHBondContact NE1-ND2 2.97Å; W214-N218 VanDerWaalsContact O-CB 3.28Å; W214-N218 WeakPolarHBondContact O-CB 3.15Å; W214-N218 PolarHBondContact O-N 3.46Å; W214-N218 PolarHBondContact O-ND2 3.5Å
215	R	84	Confident	85.1	Confident	110 Å²	110	77.4 Å²	77.4	42%	0.415	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-32.3	179.3	-169.2	-177.9	-157.1	-124.7	3.2	112.3	P126 Y211 N212 E213	P126-R215 HydrophobicContact CB-CG 4.15Å; Y211-R215 VanDerWaalsContact O-CB 3.3Å; Y211-R215 WeakPolarHBondContact O-CB 3.45Å; Y211-R215 PolarHBondContact O-N 2.96Å; N212-R215 PolarHBondContact O-N 2.97Å; E213-R215 VanDerWaalsContact C-N 3.28Å; E213-R215 PolarHBondContact O-N 2.9Å
216	R	80.8	Confident	83.5	Confident	169 Å²	169	74 Å²	74	64%	0.638	34%	0.344	S	S	*	.	H	α-helix	trans	-73.7	-40.4	175.9	-74.5	173.8	176.7	161	-1.6	111.5	N212 E213 W214	N212-R216 WeakPolarHBondContact O-CG 3.37Å; N212-R216 PolarHBondContact O-N 3.37Å; N212-R216 VanDerWaalsContact O-N 3.14Å; E213-R216 WeakPolarHBondContact O-CB 3.27Å; E213-R216 PolarHBondContact O-N 3.43Å; W214-R216 VanDerWaalsContact C-N 3.28Å; W214-R216 PolarHBondContact O-N 3.33Å
217	T	78.8	Confident	81.4	Confident	78 Å²	78	78.3 Å²	78.3	48%	0.479	37%	0.365	S	S	.	.	H	α-helix	trans	-82.6	-25.2	-177.2	59.6	0	0	0	0	113.6	E213 W214	E213-T217 PolarHBondContact O-N 3.2Å; E213-T217 VanDerWaalsContact O-N 3.07Å; E213-T217 PolarHBondContact O-OG1 2.96Å; W214-T217 PolarHBondContact O-N 3.45Å; W214-T217 PolarHBondContact O-OG1 3.49Å
218	N	80.8	Confident	79.7	Confident	58 Å²	58	82.5 Å²	82.5	31%	0.31	40%	0.395	S	S	.	.			trans	-109.9	53.6	-175	-65.7	-92.5	0	0	0	112.3	R127 W214	R127-N218 VanDerWaalsContact CD-O 3.26Å; R127-N218 WeakPolarHBondContact CD-O 3.24Å; R127-N218 VanDerWaalsContact CG-O 3.27Å; R127-N218 WeakPolarHBondContact CG-O 3.16Å; W214-N218 HydrophobicContact CD2-CB 4.12Å; W214-N218 HydrophobicContact CH2-CB 4.42Å; W214-N218 HydrophobicContact CZ2-CB 3.97Å; W214-N218 PolarHBondContact NE1-ND2 2.97Å; W214-N218 VanDerWaalsContact O-CB 3.28Å; W214-N218 WeakPolarHBondContact O-CB 3.15Å; W214-N218 PolarHBondContact O-N 3.46Å; W214-N218 PolarHBondContact O-ND2 3.5Å
219	Q	83.4	Confident	77.5	Confident	65 Å²	65	86.2 Å²	86.2	30%	0.304	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	139.6	173.1	-64.4	-175.9	-29.1	0	0	110.5	R124	R124-Q219 HydrophobicContact CB-CB 4.28Å
220	R	83.6	Confident	75.3	Confident	133 Å²	133	84 Å²	84	50%	0.502	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123.4	172.8	-175.1	175.9	170.5	175	-3.1	108.9	R124 K125 R127	R124-R220 WeakPolarHBondContact CA-O 3.41Å; K125-R220 PolarHBondContact N-O 2.91Å; K125-R220 PolarHBondContact O-N 3.44Å; R127-R220 HydrophobicContact CG-CB 4.29Å
221	V	86.6	Confident	73	Confident	0 Å²	0	88.2 Å²	88.2	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.8	177	-176.9	0	0	0	0	108.6	E102 L105 S106 V122 R124	E102-V221 WeakPolarHBondContact CB-O 3.27Å; L105-V221 HydrophobicContact CB-CB 4.02Å; L105-V221 HydrophobicContact CB-CG1 3.82Å; L105-V221 HydrophobicContact CB-CG2 4.24Å; L105-V221 HydrophobicContact CD1-CG1 4.21Å; S106-V221 PolarHBondContact OG-N 3.38Å; V122-V221 HydrophobicContact CB-CG1 3.56Å; V122-V221 HydrophobicContact CG1-CG1 3.52Å; V122-V221 HydrophobicContact CG2-CG1 4.06Å; R124-V221 HydrophobicContact CG-CG2 4.12Å
222	I	87.1	Confident	70.6	Confident	39 Å²	39	92 Å²	92	20%	0.2	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.7	176.5	-57.8	178.4	0	0	0	108	V122 E123 K125	V122-I222 CarbonylContact C-O 3.19Å; V122-I222 VanDerWaalsContact CA-O 3.31Å; V122-I222 WeakPolarHBondContact CA-O 3.36Å; E123-I222 PolarHBondContact N-O 2.66Å; E123-I222 PolarHBondContact O-N 2.89Å; K125-I222 HydrophobicContact CB-CD1 4.39Å; K125-I222 HydrophobicContact CD-CD1 3.58Å; K125-I222 HydrophobicContact CG-CD1 3.91Å
223	L	87.6	Confident	68.4	Low	8 Å²	8	93.4 Å²	93.4	4%	0.042	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.8	-179.7	-75	161.4	0	0	0	111	R98 L101 E102 L105 F120 V122 I225	R98-L223 HydrophobicContact CG-CD1 4.03Å; R98-L223 PolarHBondContact NH1-O 3.12Å; R98-L223 PolarHBondContact NH2-O 3.33Å; L101-L223 HydrophobicContact CB-CD1 3.97Å; L101-L223 HydrophobicContact CD2-CD1 3.63Å; L101-L223 HydrophobicContact CD2-CD2 4.08Å; L101-L223 HydrophobicContact CD2-CG 4.5Å; L101-L223 HydrophobicContact CG-CD1 3.81Å; L101-L223 HydrophobicContact CG-CD2 4.48Å; E102-L223 HydrophobicContact CG-CB 4.2Å; E102-L223 HydrophobicContact CG-CD1 3.78Å; E102-L223 HydrophobicContact CG-CG 3.83Å; E102-L223 PolarHBondContact OE1-N 2.99Å; L105-L223 HydrophobicContact CD1-CD2 3.94Å; F120-L223 HydrophobicContact CB-CD2 4.08Å; F120-L223 HydrophobicContact CG-CD2 4.48Å; V122-L223 HydrophobicContact CG1-CD2 3.77Å; V122-L223 HydrophobicContact CG1-CG 4.5Å; L223-I225 VanDerWaalsContact C-N 3.29Å; L223-I225 HydrophobicContact CB-CD1 4.45Å; L223-I225 HydrophobicContact CB-CG1 4.04Å; L223-I225 PolarHBondContact O-N 3.5Å; L223-I225 VanDerWaalsContact O-N 3.16Å
224	L	85.1	Confident	66	Low	91 Å²	91	95.9 Å²	95.9	48%	0.476	51%	0.506	S	S	.	.			trans	-89.3	72.4	170.6	-62.7	175.4	0	0	0	108.3	A121 E123 P226	A121-L224 HydrophobicContact CB-CB 4.18Å; A121-L224 PolarHBondContact O-N 2.9Å; E123-L224 HydrophobicContact CB-CD1 4.18Å; E123-L224 HydrophobicContact CB-CD2 4.22Å; E123-L224 HydrophobicContact CB-CG 4.18Å; L224-P226 WeakPolarHBondContact O-CD 3.41Å
225	I	76	Confident	63.8	Low	68 Å²	68	102.8 Å²	102.8	35%	0.349	54%	0.54	S	S	.	.			trans	-78.1	123.1	168.7	-50.7	178.7	0	0	0	105.9	L84 R98 L223 K227	L84-I225 HydrophobicContact CD1-CD1 3.48Å; L84-I225 VanDerWaalsContact CD1-CD1 3.48Å; L84-I225 HydrophobicContact CD2-CD1 4.46Å; R98-I225 HydrophobicContact CG-CD1 4.37Å; L223-I225 VanDerWaalsContact C-N 3.29Å; L223-I225 HydrophobicContact CB-CD1 4.45Å; L223-I225 HydrophobicContact CB-CG1 4.04Å; L223-I225 PolarHBondContact O-N 3.5Å; L223-I225 VanDerWaalsContact O-N 3.16Å; I225-K227 PolarHBondContact O-N 3.5Å
226	P	58.8	Low	61.7	Low	113 Å²	113	106.3 Å²	106.3	73%	0.734	56%	0.561	S	S	*	*			trans	-54.2	119.3	167.3	-16.7	28.3	0	0	0	106.5	L224 S228	L224-P226 WeakPolarHBondContact O-CD 3.41Å; P226-S228 PolarHBondContact O-N 3.34Å
227	K	45.5	Very low	59.7	Low	200 Å²	200	103.9 Å²	103.9	87%	0.87	57%	0.57	S	S	*	*			trans	-51.5	113.8	167.8	-90	179.2	173.7	177.2	0	105.3	I225 V229	I225-K227 PolarHBondContact O-N 3.5Å; K227-V229 VanDerWaalsContact C-N 3.31Å; K227-V229 PolarHBondContact O-N 2.57Å
228	S	50.8	Low	58	Low	100 Å²	100	107.5 Å²	107.5	70%	0.699	59%	0.586	S	S	*	*			trans	-54.3	109.8	161.9	50.3	0	0	0	0	104.4	P226 N230	P226-S228 PolarHBondContact O-N 3.34Å; S228-N230 PolarHBondContact O-N 3.07Å
229	V	42.2	Very low	56	Low	122 Å²	122	113.2 Å²	113.2	74%	0.739	62%	0.615	S	S	*	*			trans	-50.6	114.2	173	172.1	0	0	0	0	104.9	K227 V231	K227-V229 VanDerWaalsContact C-N 3.31Å; K227-V229 PolarHBondContact O-N 2.57Å; V229-V231 PolarHBondContact O-N 3.21Å
230	N	41.4	Very low	53.8	Low	145 Å²	145	113.5 Å²	113.5	78%	0.775	64%	0.635	S	S	*	*			trans	-60.9	90.8	168.2	-79.8	-41.3	0	0	0	105.7	S228 P232	S228-N230 PolarHBondContact O-N 3.07Å; N230-P232 VanDerWaalsContact O-CD 3.27Å; N230-P232 WeakPolarHBondContact O-CD 3.47Å
231	V	41.4	Very low	51.8	Low	119 Å²	119	115.1 Å²	115.1	72%	0.721	65%	0.653	S	S	*	*			trans	-62.7	116.9	159.8	177.7	0	0	0	0	104.2	V229 S233	V229-V231 PolarHBondContact O-N 3.21Å; V231-S233 PolarHBondContact O-N 3.29Å; V231-S233 VanDerWaalsContact O-N 3.08Å
232	P	32.8	Very low	49.9	Very low	112 Å²	112	123.4 Å²	123.4	73%	0.727	69%	0.691	S	S	*	*			trans	-56.6	122.2	176	-19.2	30.8	0	0	0	107.7	N230 N234	N230-P232 VanDerWaalsContact O-CD 3.27Å; N230-P232 WeakPolarHBondContact O-CD 3.47Å; P232-N234 PolarHBondContact O-N 3.48Å
233	S	40	Very low	47.5	Very low	109 Å²	109	127.2 Å²	127.2	76%	0.762	72%	0.721	S	S	*	*	S	Bend	trans	-67.7	80.4	172.9	-162.2	0	0	0	0	108.4	V231	V231-S233 PolarHBondContact O-N 3.29Å; V231-S233 VanDerWaalsContact O-N 3.08Å
234	N	35.3	Very low	45.1	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	75%	0.751	S	S	*	*	S	Bend	trans	-153.5	56.5	166.2	-154.5	12.3	0	0	0	110.4	P232	P232-N234 PolarHBondContact O-N 3.48Å
235	Q	37.6	Very low	42.7	Very low	177 Å²	177	136 Å²	136	83%	0.827	77%	0.765	S	S	*	*			trans	-174.9	33.1	156.3	-106.8	174.4	46.9	0	0	114.2	S237	Q235-S237 PolarHBondContact O-N 3.24Å
236	Q	40.3	Very low	40.7	Very low	183 Å²	183	144.4 Å²	144.4	86%	0.855	79%	0.792	S	S	*	*	S	Bend	trans	-81.4	6.6	169.8	-88	-177.4	-13.5	0	0	114.3
237	S	39.5	Very low	39.4	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	79%	0.786	S	S	*	*	S	Bend	trans	-111.8	52.2	172.3	-63.5	0	0	0	0	112.1	Q235	Q235-S237 PolarHBondContact O-N 3.24Å
238	L	42.9	Very low	39	Very low	154 Å²	154	140.9 Å²	140.9	81%	0.806	79%	0.786	S	S	*	*	S	Bend	trans	-166	25.8	161.2	-118.8	161.1	0	0	0	116.9
239	L	38	Very low	38.5	Very low	178 Å²	178	145.4 Å²	145.4	93%	0.932	79%	0.793	S	S	*	*			trans	-132.4	51.9	165.7	-84.2	168.1	0	0	0	110.7
240	G	37.8	Very low	38.5	Very low	70 Å²	70	148.4 Å²	148.4	72%	0.722	80%	0.799	S	S	*	*			trans	-78.5	139.6	147.4	0	0	0	0	0	108.7
241	L	41.8	Very low	38.8	Very low	168 Å²	168	147.9 Å²	147.9	88%	0.88	80%	0.801	S	S	*	*	S	Bend	trans	91.5	62.7	158.6	-141	79.7	0	0	0	118.5
242	H	45.9	Very low	38.5	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.806	80%	0.804	S	S	*	*				-172.7	107	128.2	-125.1	-109.6	0	0	0	111.3
243	S	36	Very low	39.1	Very low	118 Å²	118	153 Å²	153	83%	0.825	83%	0.83	S	S	*	*			trans	-160.2	80	144.4	-159.1	0	0	0	0	110.6
244	V	39.1	Very low	39.1	Very low	112 Å²	112	155.3 Å²	155.3	68%	0.679	83%	0.834	S	S	*	*			trans	32.9	102	131.8	-173.9	0	0	0	0	117	R246	V244-R246 PolarHBondContact O-N 3.49Å
245	K	33.6	Very low	39.3	Very low	173 Å²	173	155.9 Å²	155.9	75%	0.752	84%	0.837	S	S	*	*			trans	-31.7	112.4	147	-175.4	177.9	-173.3	176.2	0	112.4	N247	K245-N247 VanDerWaalsContact CE-OD1 3.29Å; K245-N247 WeakPolarHBondContact CE-OD1 3.39Å
246	R	33.6	Very low	39.4	Very low	243 Å²	243	154.7 Å²	154.7	92%	0.917	84%	0.838	S	S	*	*			trans	-97	98.5	165.8	-148.8	176.5	-157.1	154.9	4.2	108.7	V244	V244-R246 PolarHBondContact O-N 3.49Å
247	N	31.4	Very low	39.3	Very low	114 Å²	114	153.1 Å²	153.1	61%	0.61	84%	0.837	S	S	*	*			trans	-67.9	127.2	166.2	-80.2	-14.8	0	0	0	108.8	K245	K245-N247 VanDerWaalsContact CE-OD1 3.29Å; K245-N247 WeakPolarHBondContact CE-OD1 3.39Å
248	S	37.3	Very low	39.3	Very low	125 Å²	125	155.2 Å²	155.2	87%	0.874	84%	0.837	S	S	*	*			trans	-72.6	127.4	159.2	-69.5	0	0	0	0	109.1
249	K	39.9	Very low	39.1	Very low	195 Å²	195	155.3 Å²	155.3	85%	0.848	84%	0.839	S	S	*	*			trans	-131.2	132.1	159.1	-82.5	-170.9	175.5	-173.4	0	108.9
250	E	43.2	Very low	39.1	Very low	185 Å²	185	153.6 Å²	153.6	86%	0.864	83%	0.833	S	S	*	*			trans	-66.8	158.1	172	-62.4	161.9	130.3	0	0	112.1
251	T	46.5	Very low	39.2	Very low	134 Å²	134	160.1 Å²	160.1	82%	0.822	84%	0.841	S	S	*	*			trans	-175.1	113.3	160.3	7.4	0	0	0	0	104.1
252	V	36.3	Very low	39	Very low	128 Å²	128	159.4 Å²	159.4	78%	0.776	84%	0.838	S	S	*	*				39.1	92.8	54.6	-168	0	0	0	0	112.3
253	V	45.6	Very low	38.4	Very low	212 Å²	212	158.1 Å²	158.1	100%	1.285	84%	0.841	S	S	*	*				-152.4	0	110.3	175	0	0	0	0	107.5

Retrieved 253 of 253 residues in 62.2 ms (Link to these results)

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