A0A087X639_POEFO Loading...

G domain-containing protein

AlphaFold DB , UniProt , Accession A0A087X639, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	31.6	Very low	223 Å²	223	155.8 Å²	155.8	100%	1.099	82%	0.818	S	S	*	*				0	66.2	0	-68.5	-173.7	172.9	0	0	107.2
2	D	32	Very low	31.1	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	82%	0.816	S	S	*	*				62.2	139.2	70.2	-60.1	-57.8	0	0	0	111.4
3	S	31.9	Very low	31.2	Very low	92 Å²	92	150.2 Å²	150.2	64%	0.643	82%	0.818	S	S	*	*			cis	-175.3	146.7	-11	-178.2	0	0	0	0	106.1
4	R	36.2	Very low	31.5	Very low	221 Å²	221	147.9 Å²	147.9	83%	0.834	81%	0.814	S	S	*	*			trans	18.7	142.1	144.3	-59.4	174.6	-177.2	176	0.9	122.4
5	N	32.1	Very low	31.3	Very low	159 Å²	159	144.8 Å²	144.8	85%	0.85	81%	0.808	S	S	*	*				-176.1	124.7	120.7	-89.2	-14.9	0	0	0	107
6	S	30.8	Very low	31.3	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	81%	0.813	S	S	*	*			cis	70.9	101.2	30.5	-164.2	0	0	0	0	116.7
7	V	33.9	Very low	31.2	Very low	143 Å²	143	142.2 Å²	142.2	87%	0.867	81%	0.813	S	S	*	*			trans	-162.5	132.5	140.8	-156.4	0	0	0	0	105.5
8	G	26.8	Very low	31.1	Very low	53 Å²	53	141.2 Å²	141.2	55%	0.546	82%	0.817	S	S	.	*			cis	116.6	108.6	13.5	0	0	0	0	0	109.9
9	F	28.6	Very low	31	Very low	219 Å²	219	139.7 Å²	139.7	96%	0.961	82%	0.815	S	S	*	*			trans	-151.9	144.2	153.4	-101.9	-73.8	0	0	0	111.9
10	L	29.3	Very low	30.9	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	82%	0.818	S	S	*	*			trans	-107.5	149	-154	-107.3	83.8	0	0	0	113.7
11	F	28.4	Very low	31	Very low	202 Å²	202	142.1 Å²	142.1	89%	0.886	82%	0.817	S	S	*	*			trans	68.5	133.7	133.9	-79.9	-116.3	0	0	0	123.7
12	G	26	Very low	30.7	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	80%	0.798	S	S	*	*			trans	165.9	85.5	152	0	0	0	0	0	114.9
13	L	31.3	Very low	30.6	Very low	161 Å²	161	136.9 Å²	136.9	84%	0.843	80%	0.799	S	S	*	*			trans	-91	155.5	158.2	-98.9	162.7	0	0	0	108.4
14	P	36.6	Very low	30.6	Very low	118 Å²	118	137.8 Å²	137.8	77%	0.766	81%	0.805	S	S	*	*				-144	137.3	89.7	29.7	-8.9	0	0	0	116.5
15	S	28.1	Very low	30.5	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	80%	0.802	S	S	*	*			trans	24	126.3	136.3	57.3	0	0	0	0	121.7
16	S	30.9	Very low	30.7	Very low	127 Å²	127	132.4 Å²	132.4	89%	0.888	80%	0.799	S	S	*	*				-151.4	135.6	118	56.9	0	0	0	0	111.6
17	S	29.3	Very low	30.8	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	80%	0.8	S	S	*	*			trans	-88.8	138.4	-175.4	47.5	0	0	0	0	111.9
18	S	30	Very low	31.1	Very low	125 Å²	125	131.2 Å²	131.2	87%	0.874	79%	0.794	S	S	*	*			trans	-156	143.4	139.3	60.7	0	0	0	0	111.2
19	S	29.8	Very low	31.6	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	81%	0.808	S	S	*	*			trans	-96	153.8	-157.9	32.9	0	0	0	0	113.8
20	F	29	Very low	31.8	Very low	200 Å²	200	128.5 Å²	128.5	88%	0.877	80%	0.796	S	S	*	*			trans	-13.3	131.7	160.7	-84.9	-98.5	0	0	0	118.8
21	V	32.1	Very low	32	Very low	130 Å²	130	128 Å²	128	79%	0.788	80%	0.801	S	S	*	*			trans	-137.2	122.3	143.8	-176.9	0	0	0	0	108
22	P	31.6	Very low	32	Very low	110 Å²	110	124.5 Å²	124.5	71%	0.714	80%	0.797	S	S	*	*			trans	-80.7	125.4	173.1	30.4	-27.9	0	0	0	109.8	S24	P22-S24 PolarHBondContact O-N 3.24Å
23	L	29.4	Very low	32.2	Very low	159 Å²	159	129.6 Å²	129.6	83%	0.832	81%	0.805	S	S	*	*			trans	-78.9	104.5	177.5	-154.8	79	0	0	0	109.6
24	S	32.2	Very low	31.9	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75	116.3	168.8	51.4	0	0	0	0	110.2	P22	P22-S24 PolarHBondContact O-N 3.24Å
25	N	35	Very low	31.5	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-72.6	133.9	171.2	-88.9	-14.4	0	0	0	110.7
26	P	35.1	Very low	31.4	Very low	121 Å²	121	126.7 Å²	126.7	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-77.9	132.4	175.3	29.5	-30.5	0	0	0	111.4
27	S	34.6	Very low	31.2	Very low	109 Å²	109	131.4 Å²	131.4	76%	0.762	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.8	144.5	170.1	45	0	0	0	0	112.3
28	P	38.8	Very low	31	Very low	117 Å²	117	135 Å²	135	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.5	148.3	176.3	30.2	-32.8	0	0	0	111.7
29	P	37.6	Very low	30.7	Very low	128 Å²	128	134.6 Å²	134.6	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.6	145.2	179.7	30.3	-32.1	0	0	0	112
30	A	33	Very low	30.6	Very low	86 Å²	86	136.8 Å²	136.8	71%	0.711	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66.7	149	175.6	0	0	0	0	0	112.2	T32	A30-T32 PolarHBondContact O-N 3.15Å
31	P	33.1	Very low	30.4	Very low	129 Å²	129	132.4 Å²	132.4	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-76.6	122.7	179.1	29.6	-31.3	0	0	0	111.4
32	T	28.6	Very low	30.3	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.5	125.3	167.8	12.5	0	0	0	0	110.3	A30 T34	A30-T32 PolarHBondContact O-N 3.15Å; T32-T34 PolarHBondContact O-N 2.88Å
33	L	29.6	Very low	29.9	Very low	183 Å²	183	135.2 Å²	135.2	96%	0.958	79%	0.79	S	S	*	*			trans	-70.3	103.5	169.8	-87.9	147.8	0	0	0	109.9
34	T	26.6	Very low	29.8	Very low	116 Å²	116	135.5 Å²	135.5	71%	0.712	79%	0.792	S	S	*	*			trans	-105.6	109.1	165.1	41	0	0	0	0	110.1	T32 S36	T32-T34 PolarHBondContact O-N 2.88Å; T34-S36 PolarHBondContact O-N 3.39Å; T34-S36 VanDerWaalsContact O-N 3.08Å
35	S	27.4	Very low	29.4	Very low	111 Å²	111	139 Å²	139	78%	0.776	80%	0.796	S	S	*	*			trans	-62.3	103	171.1	154.7	0	0	0	0	110
36	S	26.7	Very low	29	Very low	94 Å²	94	140 Å²	140	66%	0.657	80%	0.802	S	S	*	*			trans	-90.4	102.4	169.5	-53.4	0	0	0	0	109.2	T34 F38	T34-S36 PolarHBondContact O-N 3.39Å; T34-S36 VanDerWaalsContact O-N 3.08Å; S36-F38 PolarHBondContact O-N 3.41Å
37	R	25.7	Very low	28.5	Very low	226 Å²	226	141.1 Å²	141.1	85%	0.853	80%	0.801	S	S	*	*			trans	-70.4	113.8	164.8	-75.6	-177.2	-172.6	177.8	2.4	108	T39	R37-T39 PolarHBondContact O-N 3.39Å
38	F	25	Very low	28.1	Very low	192 Å²	192	139.9 Å²	139.9	84%	0.842	79%	0.792	S	S	*	*			trans	-84.5	106.3	164.1	-90	-84.9	0	0	0	109.4	S36	S36-F38 PolarHBondContact O-N 3.41Å
39	T	24.1	Very low	27.5	Very low	118 Å²	118	139.9 Å²	139.9	72%	0.724	79%	0.79	S	S	*	*			trans	-82	113.7	167	-53.3	0	0	0	0	108	R37 S41	R37-T39 PolarHBondContact O-N 3.39Å; T39-S41 PolarHBondContact O-N 2.91Å
40	I	27.2	Very low	27	Very low	157 Å²	157	143.2 Å²	143.2	81%	0.805	79%	0.791	S	S	*	*			trans	-87.2	107	170.3	-64.2	175.5	0	0	0	107.6
41	S	25.4	Very low	26.7	Very low	108 Å²	108	148.2 Å²	148.2	76%	0.755	80%	0.8	S	S	*	*			trans	-86.6	108.1	169.1	-53	0	0	0	0	108.7	T39	T39-S41 PolarHBondContact O-N 2.91Å
42	S	29.1	Very low	26.7	Very low	108 Å²	108	152 Å²	152	76%	0.755	80%	0.804	S	S	*	*			trans	-96.5	104.1	165.4	57.5	0	0	0	0	109.2
43	Q	24.6	Very low	26.8	Very low	191 Å²	191	156 Å²	156	89%	0.893	81%	0.81	S	S	*	*			trans	-78.1	119	161	-79.2	-171.8	-17.5	0	0	108.7
44	L	26	Very low	27.3	Very low	166 Å²	166	158 Å²	158	87%	0.869	81%	0.811	S	S	*	*			trans	-133.2	110.3	155.4	-89.3	161.4	0	0	0	106.6
45	Q	25.2	Very low	27.4	Very low	183 Å²	183	155.8 Å²	155.8	86%	0.855	81%	0.811	S	S	*	*			trans	-64.7	135.9	161.7	-77.9	172.6	-37.9	0	0	108.3
46	N	25.6	Very low	27.9	Very low	168 Å²	168	159.9 Å²	159.9	90%	0.898	82%	0.815	S	S	*	*				-166	141.5	127.5	-95.3	-14.6	0	0	0	111.5
47	D	25.2	Very low	28.1	Very low	145 Å²	145	161.1 Å²	161.1	78%	0.775	82%	0.821	S	S	*	*			trans	-85.7	155	-177.6	-177.6	33.4	0	0	0	111.9
48	S	25.8	Very low	28.6	Very low	82 Å²	82	156.4 Å²	156.4	57%	0.573	82%	0.817	S	S	*	*			trans	66.7	122.1	152	41	0	0	0	0	124.4
49	T	25.5	Very low	29	Very low	117 Å²	117	155.9 Å²	155.9	72%	0.718	82%	0.817	S	S	*	*			trans	94.8	112.6	139	15.9	0	0	0	0	122.9
50	K	28.1	Very low	29.5	Very low	198 Å²	198	156.9 Å²	156.9	86%	0.861	82%	0.817	S	S	*	*			trans	37.3	129.4	140.2	-63.2	176.7	-177.7	178.4	0	117.8
51	E	26.6	Very low	29.8	Very low	192 Å²	192	154.4 Å²	154.4	90%	0.897	81%	0.811	S	S	*	*				-175	154.2	64.7	-141.4	176.2	-177.1	0	0	111.1
52	K	32.9	Very low	30.2	Very low	209 Å²	209	154.9 Å²	154.9	91%	0.909	81%	0.809	S	S	*	*			trans	-70.7	125.3	-178.2	-84.5	173	172.3	170.7	0	113
53	K	30.9	Very low	30.5	Very low	212 Å²	212	159 Å²	159	92%	0.922	81%	0.814	S	S	*	*			trans	-135.6	127	149.8	-89.6	-176.4	179.1	172.7	0	111.2	G55	K53-G55 PolarHBondContact O-N 3.45Å
54	K	38.8	Very low	31.6	Very low	225 Å²	225	156 Å²	156	98%	0.978	81%	0.808	S	S	*	*			trans	-81.7	99.4	-176.4	-153.7	176.9	-171.8	-178.4	0	108.3
55	G	30.4	Very low	32.3	Very low	70 Å²	70	150.3 Å²	150.3	72%	0.722	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-100.4	136.5	173.8	0	0	0	0	0	111.2	K53	K53-G55 PolarHBondContact O-N 3.45Å
56	K	38.2	Very low	33.4	Very low	196 Å²	196	151.5 Å²	151.5	85%	0.852	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.2	149.5	171.1	-75.5	179.2	175.1	-179.4	0	110	V58	K56-V58 PolarHBondContact O-N 3.12Å; K56-V58 VanDerWaalsContact O-N 3.12Å
57	P	30.9	Very low	34.8	Very low	120 Å²	120	151.1 Å²	151.1	78%	0.779	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-64.6	119.7	175.4	15.4	-9.8	0	0	0	108.5	E59	P57-E59 PolarHBondContact O-N 3.47Å
58	V	36.1	Very low	36.5	Very low	128 Å²	128	146 Å²	146	78%	0.776	76%	0.761	S	S	*	*			trans	-73.7	108.6	163.2	175.1	0	0	0	0	105.3	K56 I60	K56-V58 PolarHBondContact O-N 3.12Å; K56-V58 VanDerWaalsContact O-N 3.12Å; V58-I60 PolarHBondContact O-N 3.43Å
59	E	33.4	Very low	38.5	Very low	180 Å²	180	147.1 Å²	147.1	84%	0.841	76%	0.756	S	S	*	*			trans	-63.7	104.3	165.2	-73.3	-179	172.2	0	0	107.4	P57 P61	P57-E59 PolarHBondContact O-N 3.47Å; E59-P61 WeakPolarHBondContact O-CD 3.46Å
60	I	34.5	Very low	40.9	Very low	140 Å²	140	143.4 Å²	143.4	72%	0.718	73%	0.731	S	S	*	*			trans	-70.1	118.8	165.2	-57.5	170.2	0	0	0	104.7	V58 V62	V58-I60 PolarHBondContact O-N 3.43Å; I60-V62 PolarHBondContact O-N 2.79Å
61	P	31.6	Very low	43.1	Very low	104 Å²	104	143.5 Å²	143.5	68%	0.675	73%	0.734	S	S	*	*			trans	-63.6	112.4	173.8	-4.2	17.3	0	0	0	106.5	E59 F63	E59-P61 WeakPolarHBondContact O-CD 3.46Å; P61-F63 VanDerWaalsContact C-N 3.32Å; P61-F63 PolarHBondContact O-N 3.43Å
62	V	34.3	Very low	45.8	Very low	119 Å²	119	138.5 Å²	138.5	72%	0.721	72%	0.721	S	S	*	*			trans	-65.2	103.9	163.1	-175.5	0	0	0	0	104.7	I60 T64	I60-V62 PolarHBondContact O-N 2.79Å; V62-T64 HydrophobicContact CG1-CG2 3.68Å; V62-T64 PolarHBondContact O-N 2.65Å
63	F	36.5	Very low	48.5	Very low	194 Å²	194	130.7 Å²	130.7	85%	0.851	69%	0.688	S	S	*	*			trans	-70.8	72.1	174.2	-131.8	-87.4	0	0	0	108.4	P61 G65	P61-F63 VanDerWaalsContact C-N 3.32Å; P61-F63 PolarHBondContact O-N 3.43Å; F63-G65 PolarHBondContact O-N 2.93Å
64	T	47.5	Very low	51.3	Low	128 Å²	128	123.9 Å²	123.9	79%	0.785	66%	0.656	S	S	*	*			trans	-76.1	98.1	166.5	48.6	0	0	0	0	108.2	V62	V62-T64 HydrophobicContact CG1-CG2 3.68Å; V62-T64 PolarHBondContact O-N 2.65Å
65	G	41.2	Very low	53.9	Low	46 Å²	46	115.9 Å²	115.9	47%	0.474	62%	0.62	S	S	.	*			trans	147.6	86	168	0	0	0	0	0	112.8	F63 Q67	F63-G65 PolarHBondContact O-N 2.93Å; G65-Q67 PolarHBondContact O-N 3.39Å
66	F	48.2	Very low	56.8	Low	208 Å²	208	119 Å²	119	91%	0.912	62%	0.62	S	S	*	*			trans	-55.7	109.8	147.9	-91.7	-97.7	0	0	0	106	S68	F66-S68 PolarHBondContact O-N 3.48Å
67	Q	53.9	Low	59.4	Low	160 Å²	160	110.6 Å²	110.6	75%	0.748	59%	0.585	S	S	*	*			trans	-64.4	89.1	169	-81.7	179.5	-36.3	0	0	107.2	G65 K69 L285	G65-Q67 PolarHBondContact O-N 3.39Å; Q67-K69 PolarHBondContact O-N 2.93Å; Q67-L285 WeakPolarHBondContact O-CD1 3.12Å
68	S	61.2	Low	62.5	Low	39 Å²	39	110.5 Å²	110.5	27%	0.273	57%	0.574	S	S	.	*			trans	-76.7	-7.1	179.8	56	0	0	0	0	112.8	F66 E273 L285	F66-S68 PolarHBondContact O-N 3.48Å; S68-E273 WeakPolarHBondContact CB-OE1 3.36Å; S68-E273 PolarHBondContact OG-OE1 3.22Å; S68-L285 PolarHBondContact O-N 3.39Å
69	K	67.1	Low	65.3	Low	105 Å²	105	106.7 Å²	106.7	46%	0.457	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-131.3	126.5	-167.5	-167.3	166.5	175.8	165.6	0	110.8	Q67 N280 K283	Q67-K69 PolarHBondContact O-N 2.93Å; K69-N280 WeakPolarHBondContact CE-OD1 3.28Å; K69-N280 PolarHBondContact NZ-OD1 2.75Å; K69-K283 CarbonylContact C-O 3.6Å; K69-K283 WeakPolarHBondContact CA-O 3.22Å; K69-K283 HydrophobicContact CG-CB 4.08Å
70	L	76.3	Confident	68.4	Low	39 Å²	39	100.5 Å²	100.5	20%	0.204	52%	0.52	C	S	.	.			trans	-69.1	148.4	170.4	-71.4	160.5	0	0	0	110.4	S72 W74 K283 L285	L70-S72 VanDerWaalsContact C-N 3.28Å; L70-S72 VanDerWaalsContact CB-O 3.3Å; L70-S72 WeakPolarHBondContact CB-O 3.39Å; L70-S72 PolarHBondContact O-N 3.35Å; L70-W74 HydrophobicContact CD1-CE3 3.39Å; L70-W74 HydrophobicContact CD1-CZ3 3.72Å; L70-K283 WeakPolarHBondContact CB-O 3.37Å; L70-K283 PolarHBondContact N-O 3.49Å; L70-L285 HydrophobicContact CD1-CD2 3.98Å; L70-L285 HydrophobicContact CD2-CD2 3.47Å; L70-L285 VanDerWaalsContact CD2-CD2 3.47Å; L70-L285 HydrophobicContact CD2-CG 4.35Å; L70-L285 HydrophobicContact CG-CD2 3.57Å; L70-L285 HydrophobicContact CG-CG 4.1Å
71	E	75.5	Confident	71.4	Confident	199 Å²	199	97.5 Å²	97.5	93%	0.93	50%	0.503	S	S	*	.	S	Bend	trans	-63.3	-35.5	176.6	-65.4	-177	168	0	0	112
72	S	82.4	Confident	74.5	Confident	87 Å²	87	98.7 Å²	98.7	61%	0.608	50%	0.5	S	S	*	.	S	Bend	trans	-128.5	155.4	176.2	62.8	0	0	0	0	111.7	L70	L70-S72 VanDerWaalsContact C-N 3.28Å; L70-S72 VanDerWaalsContact CB-O 3.3Å; L70-S72 WeakPolarHBondContact CB-O 3.39Å; L70-S72 PolarHBondContact O-N 3.35Å
73	Q	89	Confident	77.5	Confident	46 Å²	46	95.9 Å²	95.9	22%	0.215	48%	0.479	C	S	.	.			trans	-74.6	138.1	174.7	65	-164.5	28.6	0	0	110.6	R75 D76 Y282 K283	Q73-R75 VanDerWaalsContact C-N 3.34Å; Q73-R75 WeakPolarHBondContact CG-O 3.33Å; Q73-D76 PolarHBondContact NE2-OD1 3.48Å; Q73-Y282 CarbonylContact C-O 3.54Å; Q73-Y282 WeakPolarHBondContact CA-O 3.32Å; Q73-K283 HydrophobicContact CB-CG 3.93Å
74	W	91.4	Very high	80.4	Confident	69 Å²	69	88.1 Å²	88.1	26%	0.261	45%	0.445	S	S	.	.	S	Bend	trans	-85.5	-8.5	-179.6	73.1	84.6	0	0	0	113.8	L70 V281 Y282 S284 V287 R288 M291	L70-W74 HydrophobicContact CD1-CE3 3.39Å; L70-W74 HydrophobicContact CD1-CZ3 3.72Å; W74-V281 WeakPolarHBondContact CH2-O 3.31Å; W74-Y282 HydrophobicContact CD2-CD1 4.28Å; W74-Y282 AromaticContact CE2-CD1 3.56Å; W74-Y282 HydrophobicContact CH2-CD1 4.48Å; W74-Y282 AromaticContact CZ2-CD1 3.68Å; W74-Y282 HydrophobicContact CZ2-CD1 3.68Å; W74-Y282 HydrophobicContact CZ2-CE1 4.42Å; W74-Y282 WeakPolarHBondContact CZ3-O 3.05Å; W74-Y282 PolarHBondContact N-O 2.9Å; W74-Y282 AromaticContact NE1-CD1 3.57Å; W74-S284 WeakPolarHBondContact CH2-O 3.41Å; W74-S284 WeakPolarHBondContact CZ3-O 3.31Å; W74-V287 HydrophobicContact CH2-CB 4.13Å; W74-V287 HydrophobicContact CH2-CG1 4.18Å; W74-V287 HydrophobicContact CZ2-CG1 4.27Å; W74-R288 HydrophobicContact CD2-CB 4.37Å; W74-R288 HydrophobicContact CD2-CG 4.16Å; W74-R288 HydrophobicContact CE3-CB 4.13Å; W74-R288 HydrophobicContact CE3-CG 4.26Å; W74-R288 HydrophobicContact CH2-CB 3.63Å; W74-R288 HydrophobicContact CH2-CG 4.4Å; W74-R288 HydrophobicContact CZ2-CB 3.88Å; W74-R288 HydrophobicContact CZ2-CG 4.28Å; W74-R288 HydrophobicContact CZ3-CB 3.75Å; W74-R288 HydrophobicContact CZ3-CG 4.38Å; W74-M291 HydrophobicContact CZ2-SD 4.08Å
75	R	91.8	Very high	82.7	Confident	57 Å²	57	88.2 Å²	88.2	22%	0.215	43%	0.434	C	S	.	.	S	Bend	trans	-139.1	141.6	165.9	-66.1	-169.9	-172.6	162.2	3	109.6	Q73 Y282 T302 I305	Q73-R75 VanDerWaalsContact C-N 3.34Å; Q73-R75 WeakPolarHBondContact CG-O 3.33Å; R75-Y282 HydrophobicContact CB-CD1 3.75Å; R75-Y282 HydrophobicContact CB-CD2 4.32Å; R75-Y282 HydrophobicContact CB-CE1 3.86Å; R75-Y282 HydrophobicContact CB-CE2 4.43Å; R75-Y282 HydrophobicContact CB-CG 3.98Å; R75-Y282 HydrophobicContact CG-CD1 4.1Å; R75-Y282 HydrophobicContact CG-CE1 4.01Å; R75-T302 VanDerWaalsContact NH2-C 3.33Å; R75-T302 PolarHBondContact NH2-O 3.16Å; R75-I305 PolarHBondContact NH1-O 3.19Å; R75-I305 PolarHBondContact NH2-O 2.96Å
76	D	91.4	Very high	85.4	Confident	135 Å²	135	89.4 Å²	89.4	72%	0.722	44%	0.435	S	S	*	.			trans	-84.7	129.4	-179.5	-66.9	-42.9	0	0	0	112.1	Q73	Q73-D76 PolarHBondContact NE2-OD1 3.48Å
77	V	93.3	Very high	87.7	Confident	20 Å²	20	79.9 Å²	79.9	12%	0.121	39%	0.394	C	S	.	.			trans	-136	132.8	172.6	-177.4	0	0	0	0	108.5	W79 Y282 V323	V77-W79 HydrophobicContact CB-CD2 4.22Å; V77-W79 HydrophobicContact CB-CH2 4.09Å; V77-W79 HydrophobicContact CB-CZ2 3.56Å; V77-W79 HydrophobicContact CG1-CD2 3.76Å; V77-W79 HydrophobicContact CG1-CE3 3.81Å; V77-W79 HydrophobicContact CG1-CH2 3.74Å; V77-W79 HydrophobicContact CG1-CZ2 3.66Å; V77-W79 HydrophobicContact CG1-CZ3 3.8Å; V77-W79 HydrophobicContact CG2-CH2 4.32Å; V77-W79 HydrophobicContact CG2-CZ2 3.99Å; V77-W79 PolarHBondContact O-NE1 2.88Å; V77-Y282 HydrophobicContact CG2-CD2 3.59Å; V77-Y282 HydrophobicContact CG2-CE2 3.43Å; V77-Y282 VanDerWaalsContact CG2-CE2 3.43Å; V77-V323 HydrophobicContact CG1-CG1 3.64Å
78	Q	95.1	Very high	89.7	Confident	118 Å²	118	72.7 Å²	72.7	55%	0.551	36%	0.36	S	S	*	.			trans	-89.2	108	173.1	-61.6	-59.5	-40.1	0	0	108.8	T80 Q83	Q78-T80 VanDerWaalsContact C-N 3.28Å; Q78-T80 PolarHBondContact O-N 3.21Å; Q78-T80 VanDerWaalsContact O-N 3.12Å; Q78-Q83 HydrophobicContact CB-CB 4.03Å; Q78-Q83 HydrophobicContact CB-CG 4.05Å; Q78-Q83 WeakPolarHBondContact O-CB 3.26Å; Q78-Q83 VanDerWaalsContact O-CG 3.3Å; Q78-Q83 WeakPolarHBondContact O-CG 3.43Å
79	W	96.2	Very high	91.2	Very high	47 Å²	47	78 Å²	78	18%	0.178	38%	0.378	C	S	.	.			trans	-88.2	60.7	-177.1	-54.6	106.1	0	0	0	111	V77 V278 V281 Y282 N320 V323 L324	V77-W79 HydrophobicContact CB-CD2 4.22Å; V77-W79 HydrophobicContact CB-CH2 4.09Å; V77-W79 HydrophobicContact CB-CZ2 3.56Å; V77-W79 HydrophobicContact CG1-CD2 3.76Å; V77-W79 HydrophobicContact CG1-CE3 3.81Å; V77-W79 HydrophobicContact CG1-CH2 3.74Å; V77-W79 HydrophobicContact CG1-CZ2 3.66Å; V77-W79 HydrophobicContact CG1-CZ3 3.8Å; V77-W79 HydrophobicContact CG2-CH2 4.32Å; V77-W79 HydrophobicContact CG2-CZ2 3.99Å; V77-W79 PolarHBondContact O-NE1 2.88Å; W79-V278 HydrophobicContact CZ3-CG1 4.48Å; W79-V281 HydrophobicContact CH2-CG1 3.93Å; W79-V281 HydrophobicContact CZ2-CG1 4.16Å; W79-Y282 HydrophobicContact CZ2-CD2 4.37Å; W79-N320 WeakPolarHBondContact CB-OD1 3.38Å; W79-N320 HydrophobicContact CE3-CB 3.85Å; W79-N320 HydrophobicContact CZ3-CB 4.15Å; W79-N320 WeakPolarHBondContact CZ3-O 3.24Å; W79-V323 HydrophobicContact CE3-CB 4.22Å; W79-V323 HydrophobicContact CE3-CG1 4.03Å; W79-V323 HydrophobicContact CZ3-CB 4.4Å; W79-V323 HydrophobicContact CZ3-CG1 4.2Å; W79-L324 HydrophobicContact CH2-CD1 4.33Å; W79-L324 HydrophobicContact CZ3-CB 4.3Å
80	T	97.6	Very high	92.5	Very high	50 Å²	50	74.7 Å²	74.7	31%	0.307	37%	0.371	S	S	.	.	S	Bend	trans	-129.2	156.8	-174.1	73.7	0	0	0	0	112.7	Q78 E82 Q83 K84	Q78-T80 VanDerWaalsContact C-N 3.28Å; Q78-T80 PolarHBondContact O-N 3.21Å; Q78-T80 VanDerWaalsContact O-N 3.12Å; T80-E82 WeakPolarHBondContact CB-OE2 3.42Å; T80-E82 PolarHBondContact O-N 2.92Å; T80-E82 PolarHBondContact OG1-OE2 3.45Å; T80-Q83 PolarHBondContact O-N 3Å; T80-Q83 PolarHBondContact OG1-N 2.87Å; T80-Q83 VanDerWaalsContact OG1-N 3.15Å; T80-K84 PolarHBondContact O-N 3.13Å
81	E	97.4	Very high	93.3	Very high	77 Å²	77	72.9 Å²	72.9	36%	0.36	36%	0.361	S	S	.	.	H	α-helix	trans	-62	-33.7	174.6	-77.9	-63.9	157.9	0	0	112	K84 K85 L319	E81-K84 PolarHBondContact O-N 2.87Å; E81-K85 WeakPolarHBondContact O-CB 3.41Å; E81-K85 VanDerWaalsContact O-CG 3.26Å; E81-K85 WeakPolarHBondContact O-CG 3.3Å; E81-K85 PolarHBondContact O-N 3.32Å; E81-L319 HydrophobicContact CG-CD1 4.29Å; E81-L319 HydrophobicContact CG-CD2 4.16Å; E81-L319 WeakPolarHBondContact OE1-CD1 3.43Å
82	E	97.5	Very high	94.1	Very high	130 Å²	130	65.1 Å²	65.1	61%	0.607	33%	0.329	S	S	*	.	H	α-helix	trans	-64.4	-44.3	175.9	-64.3	66.8	-140.8	0	0	110.9	T80 K85 S86	T80-E82 WeakPolarHBondContact CB-OE2 3.42Å; T80-E82 PolarHBondContact O-N 2.92Å; T80-E82 PolarHBondContact OG1-OE2 3.45Å; E82-K85 PolarHBondContact O-N 3.42Å; E82-S86 WeakPolarHBondContact O-CB 3.33Å; E82-S86 PolarHBondContact O-N 3.23Å
83	Q	97.5	Very high	94.6	Very high	59 Å²	59	64.6 Å²	64.6	28%	0.276	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-45.3	177	-178.2	61.9	18.9	0	0	110.9	Q78 T80 K85 S86 L87 V323	Q78-Q83 HydrophobicContact CB-CB 4.03Å; Q78-Q83 HydrophobicContact CB-CG 4.05Å; Q78-Q83 WeakPolarHBondContact O-CB 3.26Å; Q78-Q83 VanDerWaalsContact O-CG 3.3Å; Q78-Q83 WeakPolarHBondContact O-CG 3.43Å; T80-Q83 PolarHBondContact O-N 3Å; T80-Q83 PolarHBondContact OG1-N 2.87Å; T80-Q83 VanDerWaalsContact OG1-N 3.15Å; Q83-K85 PolarHBondContact O-N 2.78Å; Q83-S86 WeakPolarHBondContact O-CB 3.49Å; Q83-S86 PolarHBondContact O-N 2.96Å; Q83-L87 HydrophobicContact CG-CD1 4.01Å; Q83-L87 HydrophobicContact CG-CG 4.46Å; Q83-L87 WeakPolarHBondContact O-CG 3.41Å; Q83-L87 PolarHBondContact O-N 2.84Å; Q83-V323 HydrophobicContact CG-CG1 4.38Å
84	K	97.3	Very high	94.8	Very high	31 Å²	31	63.3 Å²	63.3	14%	0.135	32%	0.319	C	S	.	.	H	α-helix	trans	-54.5	-51.4	174.2	174.6	177.6	164.2	176.1	0	111.1	T80 E81 S86 L87 M88 L319 D322 V323 L326	T80-K84 PolarHBondContact O-N 3.13Å; E81-K84 PolarHBondContact O-N 2.87Å; K84-S86 VanDerWaalsContact C-N 3.33Å; K84-S86 PolarHBondContact O-N 2.89Å; K84-L87 PolarHBondContact O-N 3.48Å; K84-M88 HydrophobicContact CG-CG 4.44Å; K84-M88 HydrophobicContact CG-SD 4.3Å; K84-M88 WeakPolarHBondContact O-CB 3.38Å; K84-M88 VanDerWaalsContact O-CG 3.31Å; K84-M88 WeakPolarHBondContact O-CG 3.12Å; K84-M88 PolarHBondContact O-N 2.81Å; K84-L319 HydrophobicContact CB-CD1 3.8Å; K84-L319 HydrophobicContact CD-CD1 3.56Å; K84-L319 HydrophobicContact CG-CD1 4.31Å; K84-D322 HydrophobicContact CD-CB 3.96Å; K84-D322 WeakPolarHBondContact CE-OD2 3.4Å; K84-D322 HydrophobicContact CG-CB 4.4Å; K84-D322 IonicContact NZ-OD2 2.67Å; K84-D322 PolarHBondContact NZ-OD2 3.04Å; K84-V323 HydrophobicContact CB-CG2 3.84Å; K84-L326 HydrophobicContact CG-CD1 4.13Å
85	K	96.1	Very high	94.8	Very high	131 Å²	131	65.8 Å²	65.8	57%	0.57	33%	0.328	S	S	*	.	H	α-helix	trans	-60.6	-41.1	178.5	-73.8	170.7	-174.9	171.2	0	112.2	E81 E82 Q83 M88 K89	E81-K85 WeakPolarHBondContact O-CB 3.41Å; E81-K85 VanDerWaalsContact O-CG 3.26Å; E81-K85 WeakPolarHBondContact O-CG 3.3Å; E81-K85 PolarHBondContact O-N 3.32Å; E82-K85 PolarHBondContact O-N 3.42Å; Q83-K85 PolarHBondContact O-N 2.78Å; K85-M88 PolarHBondContact O-N 2.84Å; K85-K89 WeakPolarHBondContact O-CB 3.49Å; K85-K89 PolarHBondContact O-N 3.03Å
86	S	96.9	Very high	94.8	Very high	70 Å²	70	63.8 Å²	63.8	49%	0.49	32%	0.323	S	S	.	.	H	α-helix	trans	-60.4	-50.2	176.6	-173.3	0	0	0	0	111.5	E82 Q83 K84 K89 A90	E82-S86 WeakPolarHBondContact O-CB 3.33Å; E82-S86 PolarHBondContact O-N 3.23Å; Q83-S86 WeakPolarHBondContact O-CB 3.49Å; Q83-S86 PolarHBondContact O-N 2.96Å; K84-S86 VanDerWaalsContact C-N 3.33Å; K84-S86 PolarHBondContact O-N 2.89Å; S86-K89 WeakPolarHBondContact O-CB 3.43Å; S86-K89 PolarHBondContact O-N 2.81Å; S86-A90 PolarHBondContact O-N 3.32Å
87	L	96.9	Very high	94.6	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-42.7	178	-68.3	166.2	0	0	0	112.2	Q83 K84 K89 A90 V91 V323 L326 S327 D330	Q83-L87 HydrophobicContact CG-CD1 4.01Å; Q83-L87 HydrophobicContact CG-CG 4.46Å; Q83-L87 WeakPolarHBondContact O-CG 3.41Å; Q83-L87 PolarHBondContact O-N 2.84Å; K84-L87 PolarHBondContact O-N 3.48Å; L87-K89 VanDerWaalsContact C-N 3.26Å; L87-K89 PolarHBondContact O-N 3.31Å; L87-A90 PolarHBondContact O-N 2.96Å; L87-V91 WeakPolarHBondContact O-CG2 3.3Å; L87-V91 PolarHBondContact O-N 3.35Å; L87-V323 HydrophobicContact CD1-CG1 4.34Å; L87-L326 HydrophobicContact CB-CB 3.74Å; L87-L326 HydrophobicContact CB-CD1 4.16Å; L87-L326 HydrophobicContact CD1-CB 3.99Å; L87-L326 HydrophobicContact CG-CB 4.44Å; L87-S327 WeakPolarHBondContact CD1-OG 3.28Å; L87-D330 HydrophobicContact CD2-CB 3.93Å
88	M	94.9	Very high	94.4	Very high	10 Å²	10	61.4 Å²	61.4	5%	0.049	32%	0.317	C	S	.	.	H	α-helix	trans	-58.2	-41.1	174.1	-73.2	-169.1	82.5	0	0	111.3	K84 K85 S92 V126 F127 Q157 L326	K84-M88 HydrophobicContact CG-CG 4.44Å; K84-M88 HydrophobicContact CG-SD 4.3Å; K84-M88 WeakPolarHBondContact O-CB 3.38Å; K84-M88 VanDerWaalsContact O-CG 3.31Å; K84-M88 WeakPolarHBondContact O-CG 3.12Å; K84-M88 PolarHBondContact O-N 2.81Å; K85-M88 PolarHBondContact O-N 2.84Å; M88-S92 VanDerWaalsContact O-CB 3.23Å; M88-S92 WeakPolarHBondContact O-CB 3.42Å; M88-S92 PolarHBondContact O-N 3.49Å; M88-S92 PolarHBondContact O-OG 3.06Å; M88-V126 HydrophobicContact CE-CG1 4.16Å; M88-V126 WeakPolarHBondContact CE-O 3.1Å; M88-V126 HydrophobicContact CG-CG1 4.47Å; M88-V126 HydrophobicContact SD-CG1 4.26Å; M88-F127 HydrophobicContact CB-CE1 4.4Å; M88-F127 HydrophobicContact CE-CD1 3.81Å; M88-F127 HydrophobicContact CE-CE1 4.14Å; M88-F127 HydrophobicContact CE-CG 4.4Å; M88-Q157 HydrophobicContact CE-CG 3.73Å; M88-Q157 PolarHBondContact SD-NE2 2.97Å; M88-Q157 VanDerWaalsContact SD-NE2 3.39Å; M88-L326 HydrophobicContact CG-CD1 3.4Å; M88-L326 VanDerWaalsContact CG-CD1 3.4Å; M88-L326 HydrophobicContact CG-CD2 4.07Å; M88-L326 HydrophobicContact CG-CG 4.4Å
89	K	93.6	Very high	93.8	Very high	149 Å²	149	65.6 Å²	65.6	65%	0.648	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-45.3	175.8	-173.7	179.9	178.7	-177.2	0	111.5	K85 S86 L87 V91 S92 S93	K85-K89 WeakPolarHBondContact O-CB 3.49Å; K85-K89 PolarHBondContact O-N 3.03Å; S86-K89 WeakPolarHBondContact O-CB 3.43Å; S86-K89 PolarHBondContact O-N 2.81Å; L87-K89 VanDerWaalsContact C-N 3.26Å; L87-K89 PolarHBondContact O-N 3.31Å; K89-V91 PolarHBondContact O-N 3.12Å; K89-S92 WeakPolarHBondContact CA-OG 3.3Å; K89-S92 PolarHBondContact O-N 3.35Å; K89-S92 PolarHBondContact O-OG 3Å; K89-S93 VanDerWaalsContact O-CB 3.31Å; K89-S93 WeakPolarHBondContact O-CB 3.23Å; K89-S93 PolarHBondContact O-N 3.12Å; K89-S93 PolarHBondContact O-OG 2.67Å
90	A	93.8	Very high	93.3	Very high	37 Å²	37	70 Å²	70	31%	0.306	36%	0.36	S	S	.	.	H	α-helix	trans	-56.5	-51.3	177.9	0	0	0	0	0	111.3	S86 L87 Y94	S86-A90 PolarHBondContact O-N 3.32Å; L87-A90 PolarHBondContact O-N 2.96Å; A90-Y94 WeakPolarHBondContact O-CB 3.36Å; A90-Y94 PolarHBondContact O-N 3.39Å
91	V	94	Very high	93	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-68	-40.1	-179.9	177	0	0	0	0	112.3	L87 K89 Y94 F127 V329 L333	L87-V91 WeakPolarHBondContact O-CG2 3.3Å; L87-V91 PolarHBondContact O-N 3.35Å; K89-V91 PolarHBondContact O-N 3.12Å; V91-Y94 WeakPolarHBondContact O-CB 3.43Å; V91-Y94 PolarHBondContact O-N 2.67Å; V91-F127 HydrophobicContact CB-CE1 4.49Å; V91-F127 HydrophobicContact CB-CZ 3.76Å; V91-F127 HydrophobicContact CG1-CE1 4.4Å; V91-F127 HydrophobicContact CG1-CE2 3.97Å; V91-F127 HydrophobicContact CG1-CZ 3.46Å; V91-F127 VanDerWaalsContact CG1-CZ 3.46Å; V91-V329 HydrophobicContact CB-CG1 4.49Å; V91-V329 HydrophobicContact CG1-CG1 3.82Å; V91-V329 HydrophobicContact CG2-CB 4.25Å; V91-V329 HydrophobicContact CG2-CG1 3.77Å; V91-L333 HydrophobicContact CB-CD1 4.41Å; V91-L333 HydrophobicContact CG1-CD1 4.46Å; V91-L333 HydrophobicContact CG2-CD1 4.08Å
92	S	92.3	Very high	92.7	Very high	37 Å²	37	68.2 Å²	68.2	26%	0.259	36%	0.356	S	S	.	.	H	α-helix	trans	-71.8	-37.8	-177.7	55.7	0	0	0	0	113.6	M88 K89 Y94 R95	M88-S92 VanDerWaalsContact O-CB 3.23Å; M88-S92 WeakPolarHBondContact O-CB 3.42Å; M88-S92 PolarHBondContact O-N 3.49Å; M88-S92 PolarHBondContact O-OG 3.06Å; K89-S92 WeakPolarHBondContact CA-OG 3.3Å; K89-S92 PolarHBondContact O-N 3.35Å; K89-S92 PolarHBondContact O-OG 3Å; S92-Y94 VanDerWaalsContact C-N 3.34Å; S92-R95 PolarHBondContact O-NH1 3.49Å
93	S	91.8	Very high	92.5	Very high	75 Å²	75	64.5 Å²	64.5	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-83.6	-8.3	177.2	64.7	0	0	0	0	113.8	K89 R95	K89-S93 VanDerWaalsContact O-CB 3.31Å; K89-S93 WeakPolarHBondContact O-CB 3.23Å; K89-S93 PolarHBondContact O-N 3.12Å; K89-S93 PolarHBondContact O-OG 2.67Å; S93-R95 PolarHBondContact O-N 2.93Å
94	Y	93.4	Very high	92.4	Very high	20 Å²	20	61.7 Å²	61.7	8%	0.078	33%	0.326	C	S	.	.			trans	-54.2	131	-179.3	-179.5	-98.9	0	0	0	112.1	A90 V91 S92 P96 A104 G164 L333 V336 D337	A90-Y94 WeakPolarHBondContact O-CB 3.36Å; A90-Y94 PolarHBondContact O-N 3.39Å; V91-Y94 WeakPolarHBondContact O-CB 3.43Å; V91-Y94 PolarHBondContact O-N 2.67Å; S92-Y94 VanDerWaalsContact C-N 3.34Å; Y94-P96 HydrophobicContact CE1-CG 4.14Å; Y94-A104 HydrophobicContact CE1-CB 3.97Å; Y94-G164 VanDerWaalsContact O-CA 3.3Å; Y94-G164 WeakPolarHBondContact O-CA 3.31Å; Y94-G164 PolarHBondContact O-N 3.35Å; Y94-L333 HydrophobicContact CD1-CD1 4.41Å; Y94-L333 HydrophobicContact CD1-CD2 3.62Å; Y94-L333 HydrophobicContact CD2-CB 4.32Å; Y94-L333 HydrophobicContact CD2-CD1 3.99Å; Y94-L333 HydrophobicContact CD2-CD2 4.06Å; Y94-L333 HydrophobicContact CD2-CG 4.36Å; Y94-L333 HydrophobicContact CE1-CD2 3.65Å; Y94-L333 HydrophobicContact CE2-CB 4.27Å; Y94-L333 HydrophobicContact CE2-CD2 4.08Å; Y94-L333 HydrophobicContact CG-CD1 3.85Å; Y94-L333 HydrophobicContact CG-CD2 3.84Å; Y94-L333 HydrophobicContact CG-CG 4.38Å; Y94-V336 WeakPolarHBondContact OH-CG1 3.14Å; Y94-D337 VanDerWaalsContact CE2-OD1 3.24Å; Y94-D337 WeakPolarHBondContact CE2-OD1 3.47Å; Y94-D337 PolarHBondContact OH-OD1 2.91Å
95	R	92.1	Very high	92.5	Very high	121 Å²	121	61.9 Å²	61.9	46%	0.457	33%	0.326	S	S	.	.			trans	-136.4	133.7	170	-66	-62.9	179.8	-88.6	7.1	108.1	S92 S93 S97 N162	S92-R95 PolarHBondContact O-NH1 3.49Å; S93-R95 PolarHBondContact O-N 2.93Å; R95-S97 PolarHBondContact O-N 3.34Å; R95-N162 PolarHBondContact NH2-O 2.97Å
96	P	91.8	Very high	92.6	Very high	15 Å²	15	55.6 Å²	55.6	10%	0.097	30%	0.298	C	S	.	.			trans	-51.9	140.7	173.8	-28.8	37.1	0	0	0	111.7	Y94 C98 V101 A104 F340	Y94-P96 HydrophobicContact CE1-CG 4.14Å; P96-C98 PolarHBondContact O-N 3.02Å; P96-V101 WeakPolarHBondContact CB-O 3.48Å; P96-V101 HydrophobicContact CG-CG1 4.41Å; P96-V101 WeakPolarHBondContact CG-O 3.41Å; P96-A104 HydrophobicContact CG-CB 4.16Å; P96-F340 HydrophobicContact CB-CD2 4.16Å; P96-F340 HydrophobicContact CB-CE2 3.61Å; P96-F340 HydrophobicContact CB-CZ 3.86Å; P96-F340 HydrophobicContact CG-CE2 4.18Å; P96-F340 HydrophobicContact CG-CZ 4.36Å
97	S	87.8	Confident	92.6	Very high	79 Å²	79	52.3 Å²	52.3	55%	0.552	28%	0.275	S	S	*	.	S	Bend	trans	-67.5	-23.5	176.5	58.2	0	0	0	0	112.7	R95 F340	R95-S97 PolarHBondContact O-N 3.34Å; S97-F340 WeakPolarHBondContact OG-CB 3.24Å
98	C	88	Confident	92.7	Very high	25 Å²	25	51.9 Å²	51.9	17%	0.169	27%	0.273	C	S	.	.	S	Bend	trans	-81.6	116.1	176	-175.3	0	0	0	0	111.6	P96 D100 V101 F340	P96-C98 PolarHBondContact O-N 3.02Å; C98-D100 PolarHBondContact O-N 3.32Å; C98-V101 HydrophobicContact CB-CB 4.38Å; C98-V101 HydrophobicContact CB-CG2 4.42Å; C98-V101 PolarHBondContact O-N 2.83Å; C98-F340 HydrophobicContact CB-CD1 3.56Å; C98-F340 HydrophobicContact CB-CE1 3.97Å; C98-F340 HydrophobicContact CB-CG 4.18Å
99	K	84	Confident	92.7	Very high	207 Å²	207	51.4 Å²	51.4	90%	0.9	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.7	-177.3	-66.5	-175.8	180	179.8	0	114.2	V101	K99-V101 PolarHBondContact O-N 2.87Å
100	D	85.4	Confident	92.8	Very high	138 Å²	138	44.3 Å²	44.3	74%	0.738	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.6	-179.8	-59.9	-38.6	0	0	0	112.7	C98	C98-D100 PolarHBondContact O-N 3.32Å
101	V	91.5	Very high	92.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	23%	0.227	C	C	.	.			trans	-118.4	100.2	-178.5	-178.4	0	0	0	0	109.5	P96 C98 K99 Q103 L219 R220 F340	P96-V101 WeakPolarHBondContact CB-O 3.48Å; P96-V101 HydrophobicContact CG-CG1 4.41Å; P96-V101 WeakPolarHBondContact CG-O 3.41Å; C98-V101 HydrophobicContact CB-CB 4.38Å; C98-V101 HydrophobicContact CB-CG2 4.42Å; C98-V101 PolarHBondContact O-N 2.83Å; K99-V101 PolarHBondContact O-N 2.87Å; V101-Q103 WeakPolarHBondContact CG1-O 3.48Å; V101-Q103 PolarHBondContact O-N 2.69Å; V101-L219 HydrophobicContact CG2-CB 4Å; V101-L219 HydrophobicContact CG2-CD2 3.55Å; V101-L219 HydrophobicContact CG2-CG 3.65Å; V101-R220 HydrophobicContact CG2-CB 4.47Å; V101-F340 HydrophobicContact CB-CE1 3.98Å; V101-F340 HydrophobicContact CB-CZ 4.17Å; V101-F340 HydrophobicContact CG1-CE1 3.99Å; V101-F340 HydrophobicContact CG1-CZ 3.75Å; V101-F340 HydrophobicContact CG2-CE1 3.99Å
102	P	89.8	Confident	92.4	Very high	88 Å²	88	45.5 Å²	45.5	57%	0.571	24%	0.243	S	C	*	.	S	Bend	trans	-69.8	-24.5	-178.3	27.9	-34.7	0	0	0	112.6
103	Q	93.8	Very high	92.1	Very high	52 Å²	52	49 Å²	49	24%	0.243	25%	0.251	C	S	.	.	S	Bend	trans	-143.3	131.2	-177.6	-60.6	-177.4	-54.1	0	0	111.2	V101 N153 T163 G164 V166	V101-Q103 WeakPolarHBondContact CG1-O 3.48Å; V101-Q103 PolarHBondContact O-N 2.69Å; Q103-N153 PolarHBondContact NE2-OD1 2.86Å; Q103-N153 PolarHBondContact OE1-OD1 2.65Å; Q103-T163 PolarHBondContact NE2-O 3.44Å; Q103-G164 CarbonylContact C-O 3.56Å; Q103-G164 WeakPolarHBondContact CA-O 3.16Å; Q103-V166 HydrophobicContact CB-CG2 3.93Å; Q103-V166 HydrophobicContact CG-CG2 4.38Å
104	A	96	Very high	92.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	138.3	166.9	0	0	0	0	0	110.4	Y94 P96 G164 L165 V166 V336 F340	Y94-A104 HydrophobicContact CE1-CB 3.97Å; P96-A104 HydrophobicContact CG-CB 4.16Å; A104-G164 WeakPolarHBondContact CB-O 3.46Å; A104-G164 PolarHBondContact N-O 3.41Å; A104-L165 CarbonylContact O-C 3.5Å; A104-V166 PolarHBondContact O-N 2.93Å; A104-V336 HydrophobicContact CB-CG1 3.34Å; A104-V336 HydrophobicContact CB-CG2 4.46Å; A104-F340 HydrophobicContact CB-CE2 4.13Å; A104-F340 HydrophobicContact CB-CZ 4.48Å
105	R	97.8	Very high	92.1	Very high	35 Å²	35	44.8 Å²	44.8	13%	0.132	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.6	178.2	-55	-175.2	75.1	-142.1	6.1	109.9	S151 V166 R220 D221 I223 H224	R105-S151 PolarHBondContact NH2-OG 2.64Å; R105-V166 WeakPolarHBondContact CA-O 3.49Å; R105-V166 HydrophobicContact CG-CB 4.31Å; R105-R220 VanDerWaalsContact CD-O 3.27Å; R105-R220 WeakPolarHBondContact CD-O 3.22Å; R105-D221 PolarHBondContact NH1-O 3.2Å; R105-I223 HydrophobicContact CB-CD1 3.97Å; R105-H224 PolarHBondContact N-ND1 3.31Å; R105-H224 PolarHBondContact O-N 2.82Å
106	V	98.5	Very high	92.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.6	179.4	-179.5	0	0	0	0	109.1	L108 L165 V166 L167 C168 C225 A227 I332 V336	V106-L108 HydrophobicContact CG1-CD2 4.46Å; V106-L165 HydrophobicContact CB-CD1 4.47Å; V106-L165 HydrophobicContact CG2-CD1 3.61Å; V106-V166 PolarHBondContact N-O 2.98Å; V106-L167 HydrophobicContact CB-CD2 3.94Å; V106-L167 HydrophobicContact CG1-CD2 4.39Å; V106-L167 HydrophobicContact CG2-CD2 4.49Å; V106-C168 PolarHBondContact O-N 3.25Å; V106-C225 CarbonylContact C-O 3.49Å; V106-C225 VanDerWaalsContact CA-O 3.28Å; V106-C225 WeakPolarHBondContact CA-O 3.21Å; V106-C225 HydrophobicContact CG1-CB 4.47Å; V106-C225 HydrophobicContact CG2-CB 4.29Å; V106-A227 HydrophobicContact CG1-CB 4.18Å; V106-I332 HydrophobicContact CB-CG2 4.23Å; V106-I332 HydrophobicContact CG1-CG2 3.73Å; V106-I332 HydrophobicContact CG2-CG2 3.55Å; V106-V336 HydrophobicContact CG2-CG2 3.82Å
107	L	98.6	Very high	92.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.4	177.3	-176	64.5	0	0	0	110.7	C168 I170 V189 I190 I223 C225 V226 A227	L107-C168 HydrophobicContact CD1-CB 3.97Å; L107-I170 HydrophobicContact CD1-CD1 3.77Å; L107-I170 HydrophobicContact CD1-CG1 3.89Å; L107-I170 HydrophobicContact CD1-CG2 3.88Å; L107-I170 HydrophobicContact CD2-CD1 4.08Å; L107-I170 HydrophobicContact CG-CD1 4.16Å; L107-V189 HydrophobicContact CD1-CG1 3.9Å; L107-V189 HydrophobicContact CD2-CG1 4.09Å; L107-I190 HydrophobicContact CD2-CD1 4.21Å; L107-I190 HydrophobicContact CD2-CG1 3.7Å; L107-I223 HydrophobicContact CB-CB 4.44Å; L107-I223 HydrophobicContact CB-CD1 3.95Å; L107-I223 HydrophobicContact CB-CG1 3.97Å; L107-I223 HydrophobicContact CB-CG2 3.64Å; L107-C225 PolarHBondContact N-O 3.36Å; L107-V226 HydrophobicContact CB-CG2 4.4Å; L107-A227 PolarHBondContact O-N 2.87Å
108	L	98	Very high	92.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.4	170.8	-53.7	-170.9	0	0	0	109.2	V106 K116 F119 I120 C168 A227 M229	V106-L108 HydrophobicContact CG1-CD2 4.46Å; L108-K116 HydrophobicContact CB-CB 4.14Å; L108-K116 HydrophobicContact CB-CD 4.2Å; L108-K116 HydrophobicContact CB-CG 4.05Å; L108-K116 HydrophobicContact CD1-CB 4.38Å; L108-K116 VanDerWaalsContact O-CD 3.28Å; L108-K116 WeakPolarHBondContact O-CD 3.31Å; L108-F119 HydrophobicContact CD1-CD1 4.03Å; L108-F119 HydrophobicContact CD2-CD1 4.49Å; L108-I120 HydrophobicContact CD1-CD1 3.68Å; L108-I120 HydrophobicContact CD1-CG1 3.43Å; L108-I120 VanDerWaalsContact CD1-CG1 3.43Å; L108-C168 PolarHBondContact N-O 2.95Å; L108-A227 HydrophobicContact CD2-CB 3.85Å; L108-M229 HydrophobicContact CB-SD 3.92Å; L108-M229 HydrophobicContact CD1-SD 3.89Å; L108-M229 HydrophobicContact CD2-SD 4.14Å; L108-M229 HydrophobicContact CG-SD 4.21Å
109	L	95.9	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.5	-174.3	-174.3	62.2	0	0	0	111.1	I170 L173 I186 V226 A227 F228 M229 L249	L109-I170 HydrophobicContact CD1-CD1 3.69Å; L109-L173 HydrophobicContact CD1-CD1 4.44Å; L109-L173 HydrophobicContact CD1-CD2 3.92Å; L109-L173 HydrophobicContact CD1-CG 4.14Å; L109-L173 HydrophobicContact CG-CD1 4.39Å; L109-I186 HydrophobicContact CD1-CD1 4.1Å; L109-I186 HydrophobicContact CD1-CG1 4.24Å; L109-I186 HydrophobicContact CD1-CG2 4.26Å; L109-I186 HydrophobicContact CD2-CG2 3.88Å; L109-V226 HydrophobicContact CB-CG1 3.97Å; L109-V226 HydrophobicContact CD2-CG1 4.25Å; L109-A227 PolarHBondContact N-O 3.02Å; L109-F228 HydrophobicContact CB-CD1 4.35Å; L109-F228 HydrophobicContact CD2-CD1 4.3Å; L109-F228 HydrophobicContact CD2-CE1 3.74Å; L109-F228 HydrophobicContact CG-CD1 4.39Å; L109-F228 HydrophobicContact CG-CE1 4.3Å; L109-F228 CarbonylContact O-C 3.53Å; L109-F228 WeakPolarHBondContact O-CA 3.37Å; L109-M229 PolarHBondContact O-N 3.41Å; L109-L249 HydrophobicContact CD2-CD1 3.95Å; L109-L249 HydrophobicContact CD2-CD2 4.17Å
110	G	94.1	Very high	93.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.136	C	C	.	.			trans	166.4	176.6	177.5	0	0	0	0	0	113.1	K116 G172 L173	G110-K116 PolarHBondContact O-NZ 3.49Å; G110-G172 VanDerWaalsContact O-CA 3.28Å; G110-G172 WeakPolarHBondContact O-CA 3.35Å; G110-L173 PolarHBondContact O-N 3.38Å
111	P	92	Very high	93.8	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.026	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-59.4	161.1	-174	-24.6	37.4	0	0	0	112.8	R113 S114 K116 L173 M229 Y238 F242 F246	P111-R113 PolarHBondContact O-N 3.11Å; P111-S114 VanDerWaalsContact O-CB 3.28Å; P111-S114 WeakPolarHBondContact O-CB 3.3Å; P111-S114 PolarHBondContact O-N 3.41Å; P111-S114 VanDerWaalsContact O-N 3.12Å; P111-S114 PolarHBondContact O-OG 3.44Å; P111-K116 PolarHBondContact O-NZ 2.89Å; P111-L173 WeakPolarHBondContact CA-O 3.44Å; P111-M229 WeakPolarHBondContact CD-O 3.42Å; P111-Y238 HydrophobicContact CB-CE1 4.03Å; P111-Y238 HydrophobicContact CG-CE1 3.97Å; P111-Y238 HydrophobicContact CG-CE2 4.27Å; P111-F242 HydrophobicContact CB-CE1 4.2Å; P111-F242 HydrophobicContact CB-CZ 4.02Å; P111-F242 HydrophobicContact CG-CD1 4.27Å; P111-F242 HydrophobicContact CG-CE1 3.9Å; P111-F242 HydrophobicContact CG-CZ 4.1Å; P111-F246 HydrophobicContact CG-CZ 4.17Å
112	V	87.3	Confident	93.9	Very high	58 Å²	58	19.3 Å²	19.3	35%	0.352	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	134.9	171.5	177.7	0	0	0	0	109.4	S114 L173	V112-S114 VanDerWaalsContact C-N 3.28Å; V112-S114 PolarHBondContact O-N 2.84Å; V112-L173 PolarHBondContact N-O 3.35Å
113	R	87	Confident	94.2	Very high	111 Å²	111	15.1 Å²	15.1	42%	0.419	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	22.9	-176.5	-58.5	169	77	164	7.7	115.5	P111 G115	P111-R113 PolarHBondContact O-N 3.11Å; R113-G115 PolarHBondContact O-N 2.9Å
114	S	91.9	Very high	94.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-75.8	8	171.2	70	0	0	0	0	115.3	P111 V112 K116 M229 T265	P111-S114 VanDerWaalsContact O-CB 3.28Å; P111-S114 WeakPolarHBondContact O-CB 3.3Å; P111-S114 PolarHBondContact O-N 3.41Å; P111-S114 VanDerWaalsContact O-N 3.12Å; P111-S114 PolarHBondContact O-OG 3.44Å; V112-S114 VanDerWaalsContact C-N 3.28Å; V112-S114 PolarHBondContact O-N 2.84Å; S114-K116 PolarHBondContact OG-NZ 2.67Å; S114-M229 WeakPolarHBondContact CB-O 3.28Å; S114-M229 PolarHBondContact OG-O 3.49Å; S114-M229 VanDerWaalsContact OG-O 3.14Å; S114-T265 WeakPolarHBondContact O-CG2 3.49Å; S114-T265 PolarHBondContact O-OG1 3.23Å
115	G	92.8	Very high	94	Very high	5 Å²	5	13.8 Å²	13.8	5%	0.052	7%	0.068	C	C	.	.	S	Bend	trans	85.8	15	176.7	0	0	0	0	0	116.3	R113 S118 F119 N310	R113-G115 PolarHBondContact O-N 2.9Å; G115-S118 PolarHBondContact O-N 2.96Å; G115-F119 WeakPolarHBondContact O-CB 3.22Å; G115-F119 PolarHBondContact O-N 3.3Å; G115-N310 PolarHBondContact O-ND2 3.41Å
116	K	94.1	Very high	93.8	Very high	12 Å²	12	12.2 Å²	12.2	5%	0.052	6%	0.063	C	C	.	.	H	α-helix	trans	-54.5	-63.6	178.8	-62.4	-179.8	-69.5	-68	0	113.9	L108 G110 P111 S114 S118 F119 I120 D169 I170 M229	L108-K116 HydrophobicContact CB-CB 4.14Å; L108-K116 HydrophobicContact CB-CD 4.2Å; L108-K116 HydrophobicContact CB-CG 4.05Å; L108-K116 HydrophobicContact CD1-CB 4.38Å; L108-K116 VanDerWaalsContact O-CD 3.28Å; L108-K116 WeakPolarHBondContact O-CD 3.31Å; G110-K116 PolarHBondContact O-NZ 3.49Å; P111-K116 PolarHBondContact O-NZ 2.89Å; S114-K116 PolarHBondContact OG-NZ 2.67Å; K116-S118 VanDerWaalsContact C-N 3.26Å; K116-S118 PolarHBondContact O-N 3.13Å; K116-F119 WeakPolarHBondContact O-CB 3.38Å; K116-F119 PolarHBondContact O-N 2.99Å; K116-F119 VanDerWaalsContact O-N 3.16Å; K116-I120 PolarHBondContact O-N 3.45Å; K116-D169 VanDerWaalsContact CB-OD1 3.32Å; K116-D169 WeakPolarHBondContact CB-OD1 3.29Å; K116-I170 WeakPolarHBondContact CE-O 3.39Å; K116-M229 WeakPolarHBondContact CA-SD 3.21Å; K116-M229 HydrophobicContact CB-SD 3.97Å; K116-M229 HydrophobicContact CG-CB 4.04Å; K116-M229 HydrophobicContact CG-CG 4.15Å; K116-M229 HydrophobicContact CG-SD 3.66Å
117	S	91.6	Very high	93.4	Very high	17 Å²	17	12.6 Å²	12.6	12%	0.119	6%	0.064	C	C	.	.	H	α-helix	trans	-62.8	-36	-179.3	-35.4	0	0	0	0	111.7	I120 S121 A135 T146 D169	S117-I120 PolarHBondContact O-N 3.35Å; S117-S121 PolarHBondContact O-N 2.94Å; S117-S121 PolarHBondContact O-OG 3.34Å; S117-A135 WeakPolarHBondContact O-CB 3.4Å; S117-T146 PolarHBondContact OG-OG1 3.44Å; S117-T146 VanDerWaalsContact OG-OG1 3.13Å; S117-D169 WeakPolarHBondContact CB-OD2 3.21Å; S117-D169 PolarHBondContact OG-OD2 2.91Å
118	S	93.5	Very high	93	Very high	21 Å²	21	15.5 Å²	15.5	15%	0.147	8%	0.08	C	C	.	.	H	α-helix	trans	-64.7	-38.4	175.9	-55.4	0	0	0	0	112.5	G115 K116 S121 S122	G115-S118 PolarHBondContact O-N 2.96Å; K116-S118 VanDerWaalsContact C-N 3.26Å; K116-S118 PolarHBondContact O-N 3.13Å; S118-S121 PolarHBondContact O-N 3.37Å; S118-S122 WeakPolarHBondContact O-CB 3.41Å; S118-S122 PolarHBondContact O-N 2.68Å; S118-S122 PolarHBondContact O-OG 3.38Å
119	F	96.6	Very high	92.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-45	175.6	176.3	-102	0	0	0	111.2	L108 G115 K116 S121 S122 V123 L167 M229 L263 V308 N310 L325 A328 V329 I332	L108-F119 HydrophobicContact CD1-CD1 4.03Å; L108-F119 HydrophobicContact CD2-CD1 4.49Å; G115-F119 WeakPolarHBondContact O-CB 3.22Å; G115-F119 PolarHBondContact O-N 3.3Å; K116-F119 WeakPolarHBondContact O-CB 3.38Å; K116-F119 PolarHBondContact O-N 2.99Å; K116-F119 VanDerWaalsContact O-N 3.16Å; F119-S121 PolarHBondContact O-N 2.81Å; F119-S122 WeakPolarHBondContact O-CB 3.44Å; F119-S122 PolarHBondContact O-N 3.43Å; F119-S122 VanDerWaalsContact O-N 3.17Å; F119-V123 HydrophobicContact CD1-CG2 4.34Å; F119-V123 HydrophobicContact CD2-CG2 4.38Å; F119-V123 HydrophobicContact CE1-CG2 3.96Å; F119-V123 HydrophobicContact CE2-CG2 4Å; F119-V123 HydrophobicContact CZ-CG2 3.78Å; F119-V123 WeakPolarHBondContact O-CG2 3.25Å; F119-V123 PolarHBondContact O-N 2.9Å; F119-L167 HydrophobicContact CD1-CD1 4.37Å; F119-L167 HydrophobicContact CE1-CD1 4.12Å; F119-M229 HydrophobicContact CB-CE 3.55Å; F119-M229 HydrophobicContact CB-SD 4.4Å; F119-M229 HydrophobicContact CD1-CE 4.4Å; F119-M229 HydrophobicContact CD2-CE 4.48Å; F119-M229 HydrophobicContact CG-CE 3.92Å; F119-L263 HydrophobicContact CD1-CD1 4.25Å; F119-L263 HydrophobicContact CD2-CD1 4.08Å; F119-L263 HydrophobicContact CE1-CD1 3.87Å; F119-L263 HydrophobicContact CE2-CD1 3.68Å; F119-L263 HydrophobicContact CG-CD1 4.35Å; F119-L263 HydrophobicContact CZ-CD1 3.56Å; F119-V308 HydrophobicContact CD2-CG2 4.36Å; F119-V308 HydrophobicContact CE2-CG1 4.34Å; F119-N310 WeakPolarHBondContact CA-OD1 3.49Å; F119-N310 WeakPolarHBondContact CD2-OD1 3.38Å; F119-N310 PolarHBondContact N-ND2 2.69Å; F119-L325 HydrophobicContact CD2-CD2 3.8Å; F119-L325 HydrophobicContact CE2-CD2 3.81Å; F119-A328 HydrophobicContact CE2-CB 4.44Å; F119-V329 HydrophobicContact CE1-CG2 4.49Å; F119-V329 HydrophobicContact CZ-CG2 3.9Å; F119-I332 HydrophobicContact CZ-CD1 4.45Å
120	I	94.9	Very high	92.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.2	-50.8	175.1	-61	-179.6	0	0	0	111	L108 K116 S117 S122 V123 Q124 F152 L167 D169	L108-I120 HydrophobicContact CD1-CD1 3.68Å; L108-I120 HydrophobicContact CD1-CG1 3.43Å; L108-I120 VanDerWaalsContact CD1-CG1 3.43Å; K116-I120 PolarHBondContact O-N 3.45Å; S117-I120 PolarHBondContact O-N 3.35Å; I120-S122 PolarHBondContact O-N 3.41Å; I120-V123 PolarHBondContact O-N 3.14Å; I120-Q124 HydrophobicContact CG2-CG 4.5Å; I120-Q124 WeakPolarHBondContact O-CG 3.36Å; I120-Q124 PolarHBondContact O-N 2.9Å; I120-F152 HydrophobicContact CD1-CD2 3.52Å; I120-F152 HydrophobicContact CD1-CE2 3.95Å; I120-F152 HydrophobicContact CD1-CG 4.21Å; I120-F152 HydrophobicContact CG2-CB 3.59Å; I120-F152 HydrophobicContact CG2-CD1 3.99Å; I120-F152 HydrophobicContact CG2-CD2 3.97Å; I120-F152 HydrophobicContact CG2-CG 3.59Å; I120-L167 HydrophobicContact CD1-CB 4.02Å; I120-L167 HydrophobicContact CG1-CB 4Å; I120-L167 HydrophobicContact CG1-CD1 4.01Å; I120-D169 HydrophobicContact CD1-CB 3.75Å
121	S	93.1	Very high	91.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-57.7	-40.2	177.1	-70.7	0	0	0	0	111.7	S117 S118 F119 Q124 S125 A135	S117-S121 PolarHBondContact O-N 2.94Å; S117-S121 PolarHBondContact O-OG 3.34Å; S118-S121 PolarHBondContact O-N 3.37Å; F119-S121 PolarHBondContact O-N 2.81Å; S121-Q124 PolarHBondContact O-N 3.33Å; S121-S125 WeakPolarHBondContact O-CB 3.49Å; S121-S125 PolarHBondContact O-N 3.15Å; S121-S125 PolarHBondContact O-OG 3.12Å; S121-A135 VanDerWaalsContact OG-CB 3.26Å; S121-A135 WeakPolarHBondContact OG-CB 3.46Å; S121-A135 PolarHBondContact OG-N 3.08Å; S121-A135 VanDerWaalsContact OG-N 3.09Å
122	S	95.1	Very high	90.8	Very high	1 Å²	1	28 Å²	28	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-49.9	179.1	-59.3	0	0	0	0	111.2	S118 F119 I120 Q124 S125 V126 N310 Y311	S118-S122 WeakPolarHBondContact O-CB 3.41Å; S118-S122 PolarHBondContact O-N 2.68Å; S118-S122 PolarHBondContact O-OG 3.38Å; F119-S122 WeakPolarHBondContact O-CB 3.44Å; F119-S122 PolarHBondContact O-N 3.43Å; F119-S122 VanDerWaalsContact O-N 3.17Å; I120-S122 PolarHBondContact O-N 3.41Å; S122-Q124 VanDerWaalsContact C-N 3.34Å; S122-Q124 PolarHBondContact O-N 3.39Å; S122-S125 VanDerWaalsContact O-CB 3.27Å; S122-S125 WeakPolarHBondContact O-CB 3.42Å; S122-S125 PolarHBondContact O-N 3.23Å; S122-V126 WeakPolarHBondContact O-CG2 3.34Å; S122-V126 PolarHBondContact O-N 2.97Å; S122-V126 VanDerWaalsContact O-N 3.12Å; S122-N310 WeakPolarHBondContact OG-CA 3.39Å; S122-N310 WeakPolarHBondContact OG-CB 3.42Å; S122-Y311 PolarHBondContact OG-N 3.17Å
123	V	95.1	Very high	89.6	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-58.2	-47	176.7	174.6	0	0	0	0	110.7	F119 I120 S125 V126 F127 I154 V329	F119-V123 HydrophobicContact CD1-CG2 4.34Å; F119-V123 HydrophobicContact CD2-CG2 4.38Å; F119-V123 HydrophobicContact CE1-CG2 3.96Å; F119-V123 HydrophobicContact CE2-CG2 4Å; F119-V123 HydrophobicContact CZ-CG2 3.78Å; F119-V123 WeakPolarHBondContact O-CG2 3.25Å; F119-V123 PolarHBondContact O-N 2.9Å; I120-V123 PolarHBondContact O-N 3.14Å; V123-S125 VanDerWaalsContact C-N 3.26Å; V123-S125 PolarHBondContact O-N 3.48Å; V123-V126 WeakPolarHBondContact O-CB 3.37Å; V123-V126 PolarHBondContact O-N 3.45Å; V123-F127 HydrophobicContact CG1-CD2 4.21Å; V123-F127 HydrophobicContact CG1-CE2 3.92Å; V123-F127 VanDerWaalsContact O-CD2 3.22Å; V123-F127 WeakPolarHBondContact O-CD2 3.36Å; V123-F127 PolarHBondContact O-N 3.05Å; V123-I154 HydrophobicContact CG1-CD1 3.89Å; V123-I154 HydrophobicContact CG1-CG1 4.35Å; V123-I154 HydrophobicContact CG1-CG2 4.36Å; V123-V329 HydrophobicContact CG1-CG2 4.02Å; V123-V329 HydrophobicContact CG2-CG2 3.66Å
124	Q	92.6	Very high	88.2	Confident	22 Å²	22	32.1 Å²	32.1	10%	0.103	17%	0.166	C	C	.	.	H	α-helix	trans	-61.3	-35.1	176.4	-72.9	-174.8	-23.9	0	0	112.7	I120 S121 S122 F127 N128 N153 I154	I120-Q124 HydrophobicContact CG2-CG 4.5Å; I120-Q124 WeakPolarHBondContact O-CG 3.36Å; I120-Q124 PolarHBondContact O-N 2.9Å; S121-Q124 PolarHBondContact O-N 3.33Å; S122-Q124 VanDerWaalsContact C-N 3.34Å; S122-Q124 PolarHBondContact O-N 3.39Å; Q124-F127 PolarHBondContact O-N 3.06Å; Q124-N128 WeakPolarHBondContact O-CB 3.33Å; Q124-N128 PolarHBondContact O-N 3.35Å; Q124-N128 PolarHBondContact O-ND2 2.74Å; Q124-N128 VanDerWaalsContact O-ND2 3.16Å; Q124-N153 PolarHBondContact NE2-O 3.02Å; Q124-I154 HydrophobicContact CG-CD1 3.96Å
125	S	92.6	Very high	86.5	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-41.8	177.3	-61.2	0	0	0	0	112	S121 S122 V123 F127 N128 G129 R130 T132	S121-S125 WeakPolarHBondContact O-CB 3.49Å; S121-S125 PolarHBondContact O-N 3.15Å; S121-S125 PolarHBondContact O-OG 3.12Å; S122-S125 VanDerWaalsContact O-CB 3.27Å; S122-S125 WeakPolarHBondContact O-CB 3.42Å; S122-S125 PolarHBondContact O-N 3.23Å; V123-S125 VanDerWaalsContact C-N 3.26Å; V123-S125 PolarHBondContact O-N 3.48Å; S125-F127 VanDerWaalsContact C-N 3.31Å; S125-F127 PolarHBondContact O-N 3.14Å; S125-N128 PolarHBondContact O-N 3.05Å; S125-G129 PolarHBondContact O-N 3.05Å; S125-R130 VanDerWaalsContact CA-O 3.27Å; S125-R130 WeakPolarHBondContact CA-O 3.49Å; S125-R130 VanDerWaalsContact CB-O 3.28Å; S125-R130 WeakPolarHBondContact CB-O 3.39Å; S125-R130 PolarHBondContact O-N 3.45Å; S125-T132 PolarHBondContact OG-N 3.02Å; S125-T132 PolarHBondContact OG-O 3.49Å; S125-T132 PolarHBondContact OG-OG1 3.19Å
126	V	94.1	Very high	84.5	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-57.1	-45.1	175.7	-172.7	0	0	0	0	111	M88 S122 V123 G129 Y311 D322 L325 L326	M88-V126 HydrophobicContact CE-CG1 4.16Å; M88-V126 WeakPolarHBondContact CE-O 3.1Å; M88-V126 HydrophobicContact CG-CG1 4.47Å; M88-V126 HydrophobicContact SD-CG1 4.26Å; S122-V126 WeakPolarHBondContact O-CG2 3.34Å; S122-V126 PolarHBondContact O-N 2.97Å; S122-V126 VanDerWaalsContact O-N 3.12Å; V123-V126 WeakPolarHBondContact O-CB 3.37Å; V123-V126 PolarHBondContact O-N 3.45Å; V126-G129 PolarHBondContact O-N 3.2Å; V126-Y311 HydrophobicContact CG2-CE2 4.26Å; V126-D322 HydrophobicContact CG1-CB 4.06Å; V126-D322 HydrophobicContact CG2-CB 4.43Å; V126-D322 WeakPolarHBondContact CG2-OD1 3.25Å; V126-L325 HydrophobicContact CG2-CD1 4.12Å; V126-L326 HydrophobicContact CG1-CD1 3.86Å; V126-L326 HydrophobicContact CG1-CD2 4.13Å; V126-L326 HydrophobicContact CG1-CG 4.03Å
127	F	91.3	Very high	82.3	Confident	7 Å²	7	42.1 Å²	42.1	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-74.1	-30.7	178.5	-70.3	-76.8	0	0	0	113.9	M88 V91 V123 Q124 S125 G129 I154 R155 L326	M88-F127 HydrophobicContact CB-CE1 4.4Å; M88-F127 HydrophobicContact CE-CD1 3.81Å; M88-F127 HydrophobicContact CE-CE1 4.14Å; M88-F127 HydrophobicContact CE-CG 4.4Å; V91-F127 HydrophobicContact CB-CE1 4.49Å; V91-F127 HydrophobicContact CB-CZ 3.76Å; V91-F127 HydrophobicContact CG1-CE1 4.4Å; V91-F127 HydrophobicContact CG1-CE2 3.97Å; V91-F127 HydrophobicContact CG1-CZ 3.46Å; V91-F127 VanDerWaalsContact CG1-CZ 3.46Å; V123-F127 HydrophobicContact CG1-CD2 4.21Å; V123-F127 HydrophobicContact CG1-CE2 3.92Å; V123-F127 VanDerWaalsContact O-CD2 3.22Å; V123-F127 WeakPolarHBondContact O-CD2 3.36Å; V123-F127 PolarHBondContact O-N 3.05Å; Q124-F127 PolarHBondContact O-N 3.06Å; S125-F127 VanDerWaalsContact C-N 3.31Å; S125-F127 PolarHBondContact O-N 3.14Å; F127-G129 PolarHBondContact O-N 2.94Å; F127-I154 HydrophobicContact CD2-CG2 3.54Å; F127-I154 HydrophobicContact CE2-CG2 3.54Å; F127-I154 HydrophobicContact CG-CG2 4.27Å; F127-I154 HydrophobicContact CZ-CG2 4.25Å; F127-R155 WeakPolarHBondContact CB-O 3.47Å; F127-R155 WeakPolarHBondContact CD1-O 3.15Å; F127-R155 VanDerWaalsContact CG-O 3.29Å; F127-R155 WeakPolarHBondContact CG-O 3.12Å; F127-L326 HydrophobicContact CE2-CD2 3.96Å; F127-L326 HydrophobicContact CZ-CD2 3.72Å
128	N	89	Confident	80	Confident	61 Å²	61	42.7 Å²	42.7	33%	0.326	23%	0.228	S	C	.	.	H	α-helix	trans	-76.3	-10.5	176	-68.9	-26.7	0	0	0	113.1	Q124 S125 R130 T132	Q124-N128 WeakPolarHBondContact O-CB 3.33Å; Q124-N128 PolarHBondContact O-N 3.35Å; Q124-N128 PolarHBondContact O-ND2 2.74Å; Q124-N128 VanDerWaalsContact O-ND2 3.16Å; S125-N128 PolarHBondContact O-N 3.05Å; N128-R130 HydrophobicContact CB-CG 4.44Å; N128-R130 PolarHBondContact O-N 2.95Å; N128-T132 HydrophobicContact CB-CG2 4.43Å; N128-T132 PolarHBondContact ND2-OG1 3.19Å
129	G	89.3	Confident	77.5	Confident	57 Å²	57	45.5 Å²	45.5	59%	0.588	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	12	-176	0	0	0	0	0	114.5	S125 V126 F127 L317	S125-G129 PolarHBondContact O-N 3.05Å; V126-G129 PolarHBondContact O-N 3.2Å; F127-G129 PolarHBondContact O-N 2.94Å; G129-L317 VanDerWaalsContact C-CD1 3.43Å
130	R	86.9	Confident	74.6	Confident	165 Å²	165	48.7 Å²	48.7	62%	0.623	27%	0.27	S	S	*	.	S	Bend	trans	-155	151.6	177.9	63.8	179.8	179.1	166	-2.6	110.7	S125 N128 T132	S125-R130 VanDerWaalsContact CA-O 3.27Å; S125-R130 WeakPolarHBondContact CA-O 3.49Å; S125-R130 VanDerWaalsContact CB-O 3.28Å; S125-R130 WeakPolarHBondContact CB-O 3.39Å; S125-R130 PolarHBondContact O-N 3.45Å; N128-R130 HydrophobicContact CB-CG 4.44Å; N128-R130 PolarHBondContact O-N 2.95Å; R130-T132 HydrophobicContact CG-CG2 3.96Å; R130-T132 PolarHBondContact O-N 2.84Å
131	V	84.4	Confident	72	Confident	31 Å²	31	56.6 Å²	56.6	19%	0.188	30%	0.304	C	S	.	.			trans	-63.4	123.5	174.7	-176.6	0	0	0	0	109.9	Y311 E314 L315 L317	V131-Y311 HydrophobicContact CG2-CD1 4.13Å; V131-Y311 HydrophobicContact CG2-CG 4.28Å; V131-E314 WeakPolarHBondContact CG1-O 3.3Å; V131-L315 WeakPolarHBondContact CG2-O 3.32Å; V131-L317 HydrophobicContact CG2-CD2 3.96Å
132	T	73.4	Confident	69.4	Low	15 Å²	15	63.9 Å²	63.9	9%	0.092	34%	0.343	C	S	.	.			trans	-131.9	120.4	179.4	55	0	0	0	0	110.5	S125 N128 R130 R134	S125-T132 PolarHBondContact OG-N 3.02Å; S125-T132 PolarHBondContact OG-O 3.49Å; S125-T132 PolarHBondContact OG-OG1 3.19Å; N128-T132 HydrophobicContact CB-CG2 4.43Å; N128-T132 PolarHBondContact ND2-OG1 3.19Å; R130-T132 HydrophobicContact CG-CG2 3.96Å; R130-T132 PolarHBondContact O-N 2.84Å; T132-R134 PolarHBondContact O-N 2.98Å
133	N	62.8	Low	67	Low	106 Å²	106	67.5 Å²	67.5	57%	0.567	37%	0.365	S	S	*	.			trans	-94.2	74.7	172.8	-87.2	-38.1	0	0	0	110.3
134	R	57.1	Low	65	Low	149 Å²	149	68.7 Å²	68.7	56%	0.562	37%	0.374	S	S	*	.			trans	-87.6	-33.7	-179	-79.5	-174.3	173.2	163.9	1	113.9	T132	T132-R134 PolarHBondContact O-N 2.98Å
135	A	56.5	Low	63.5	Low	5 Å²	5	71.2 Å²	71.2	4%	0.041	38%	0.384	C	S	.	.	S	Bend	trans	-71.7	136.9	168.8	0	0	0	0	0	108.2	S117 S121 V137 F152	S117-A135 WeakPolarHBondContact O-CB 3.4Å; S121-A135 VanDerWaalsContact OG-CB 3.26Å; S121-A135 WeakPolarHBondContact OG-CB 3.46Å; S121-A135 PolarHBondContact OG-N 3.08Å; S121-A135 VanDerWaalsContact OG-N 3.09Å; A135-V137 HydrophobicContact CB-CG2 4.46Å; A135-V137 PolarHBondContact O-N 3.48Å; A135-F152 HydrophobicContact CB-CZ 4.41Å
136	M	50.6	Low	62.2	Low	150 Å²	150	71.8 Å²	71.8	74%	0.739	39%	0.388	S	S	*	.			trans	-67.1	78.8	178.7	-71.7	-154.6	-71.7	0	0	110.6	G138 F145	M136-G138 PolarHBondContact O-N 2.64Å; M136-F145 WeakPolarHBondContact O-CB 3.41Å
137	V	48.7	Very low	61.4	Low	71 Å²	71	76 Å²	76	43%	0.43	41%	0.406	S	S	.	.			trans	-83.4	89	173.7	-175.4	0	0	0	0	107	A135	A135-V137 HydrophobicContact CB-CG2 4.46Å; A135-V137 PolarHBondContact O-N 3.48Å
138	G	41.7	Very low	61.3	Low	29 Å²	29	80.5 Å²	80.5	30%	0.299	43%	0.426	S	S	.	.			trans	-92.4	158.3	168.8	0	0	0	0	0	111.9	M136 F145	M136-G138 PolarHBondContact O-N 2.64Å; G138-F145 VanDerWaalsContact CA-CE1 3.45Å; G138-F145 VanDerWaalsContact CA-CE2 3.46Å; G138-F145 WeakPolarHBondContact O-CD2 3.27Å; G138-F145 WeakPolarHBondContact O-CE2 3.26Å
139	S	40.9	Very low	61.5	Low	81 Å²	81	77.7 Å²	77.7	57%	0.566	41%	0.41	S	S	*	.			trans	-108.4	21.2	-179.6	-174	0	0	0	0	113.6	F141	S139-F141 PolarHBondContact O-N 2.98Å
140	S	36.2	Very low	61.6	Low	66 Å²	66	78 Å²	78	46%	0.462	40%	0.397	S	S	.	.			trans	-68.1	129.6	178	-60.1	0	0	0	0	110.6	N142 F145	S140-N142 VanDerWaalsContact C-N 3.26Å; S140-N142 PolarHBondContact O-N 3.37Å; S140-F145 VanDerWaalsContact N-CE2 3.27Å; S140-F145 WeakPolarHBondContact OG-CZ 3.44Å
141	F	40.2	Very low	61.9	Low	167 Å²	167	71.7 Å²	71.7	73%	0.732	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.2	-169.1	-72.7	-93.9	0	0	0	114.7	S139	S139-F141 PolarHBondContact O-N 2.98Å
142	N	38.7	Very low	62.3	Low	154 Å²	154	71.7 Å²	71.7	82%	0.824	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	0.5	-165.6	-71.7	-7.8	0	0	0	116.8	S140	S140-N142 VanDerWaalsContact C-N 3.26Å; S140-N142 PolarHBondContact O-N 3.37Å
143	T	44	Very low	63.2	Low	76 Å²	76	73.6 Å²	73.6	47%	0.466	39%	0.385	S	S	.	.	S	Bend	trans	-144.2	139.6	-179	61.3	0	0	0	0	113.1	F145	T143-F145 PolarHBondContact O-N 3.24Å
144	S	54.6	Low	64.4	Low	26 Å²	26	68.5 Å²	68.5	18%	0.182	36%	0.358	C	S	.	.			trans	-58.6	129.1	165.8	58.4	0	0	0	0	110.3	K147 M171	S144-K147 WeakPolarHBondContact O-CE 3.08Å; S144-M171 PolarHBondContact OG-SD 3.4Å
145	F	60.2	Low	65.5	Low	75 Å²	75	67.6 Å²	67.6	33%	0.329	35%	0.354	S	S	.	.	S	Bend	trans	-76.2	-46.7	177.5	-78.1	-80.3	0	0	0	111.5	M136 G138 S140 T143 K147	M136-F145 WeakPolarHBondContact O-CB 3.41Å; G138-F145 VanDerWaalsContact CA-CE1 3.45Å; G138-F145 VanDerWaalsContact CA-CE2 3.46Å; G138-F145 WeakPolarHBondContact O-CD2 3.27Å; G138-F145 WeakPolarHBondContact O-CE2 3.26Å; S140-F145 VanDerWaalsContact N-CE2 3.27Å; S140-F145 WeakPolarHBondContact OG-CZ 3.44Å; T143-F145 PolarHBondContact O-N 3.24Å; F145-K147 PolarHBondContact O-N 3.35Å; F145-K147 VanDerWaalsContact O-N 3.12Å
146	T	64.8	Low	66.4	Low	13 Å²	13	67.9 Å²	67.9	8%	0.08	36%	0.357	C	S	.	.			trans	-72.7	105	170.9	-48.9	0	0	0	0	108.8	S117 K148 D169 M171	S117-T146 PolarHBondContact OG-OG1 3.44Å; S117-T146 VanDerWaalsContact OG-OG1 3.13Å; T146-K148 VanDerWaalsContact CG2-O 3.26Å; T146-K148 WeakPolarHBondContact CG2-O 3.35Å; T146-D169 HydrophobicContact CG2-CB 4.4Å; T146-D169 WeakPolarHBondContact CG2-OD2 3.22Å; T146-D169 PolarHBondContact OG1-OD2 3.2Å; T146-M171 VanDerWaalsContact O-CA 3.23Å; T146-M171 WeakPolarHBondContact O-CA 3.39Å; T146-M171 VanDerWaalsContact O-CB 3.28Å; T146-M171 WeakPolarHBondContact O-CB 3.24Å; T146-M171 WeakPolarHBondContact O-CG 2.94Å
147	K	79	Confident	67.2	Low	92 Å²	92	67 Å²	67	40%	0.4	35%	0.351	S	S	.	.			trans	-104.7	-6	173.3	-62.9	-173	178.7	-178.1	0	112.6	S144 F145 K199 F200	S144-K147 WeakPolarHBondContact O-CE 3.08Å; F145-K147 PolarHBondContact O-N 3.35Å; F145-K147 VanDerWaalsContact O-N 3.12Å; K147-K199 HydrophobicContact CB-CG 4.22Å; K147-K199 VanDerWaalsContact O-CA 3.32Å; K147-K199 WeakPolarHBondContact O-CA 3.06Å; K147-K199 WeakPolarHBondContact O-CG 3.27Å; K147-F200 PolarHBondContact O-N 3.16Å
148	K	88.1	Confident	67.8	Low	102 Å²	102	70.1 Å²	70.1	44%	0.443	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-124.7	154.3	-173	-64.1	178.9	174.2	-172.2	0	111.6	T146 Q150 G197 H198 K199	T146-K148 VanDerWaalsContact CG2-O 3.26Å; T146-K148 WeakPolarHBondContact CG2-O 3.35Å; K148-Q150 HydrophobicContact CB-CG 4.21Å; K148-Q150 PolarHBondContact O-N 3.45Å; K148-G197 WeakPolarHBondContact CD-O 3.45Å; K148-G197 WeakPolarHBondContact CG-O 3.49Å; K148-H198 CarbonylContact C-O 3.55Å; K148-H198 WeakPolarHBondContact CA-O 3.49Å; K148-K199 HydrophobicContact CG-CB 4Å; K148-K199 HydrophobicContact CG-CG 4.31Å
149	L	92.8	Very high	68.6	Low	1 Å²	1	70.4 Å²	70.4	1%	0.005	37%	0.369	C	S	.	.			trans	-68.6	122.5	160.6	173.2	61.4	0	0	0	108.6	C168 I170 V189 V194 G197 H198 F200	L149-C168 HydrophobicContact CD1-CB 4.31Å; L149-I170 HydrophobicContact CB-CG2 4.22Å; L149-I170 HydrophobicContact CD1-CG2 3.4Å; L149-I170 HydrophobicContact CG-CG2 4.4Å; L149-V189 HydrophobicContact CD1-CG1 4.08Å; L149-V189 HydrophobicContact CD2-CG1 4.38Å; L149-V194 HydrophobicContact CB-CG1 4.48Å; L149-V194 HydrophobicContact CD2-CB 4.05Å; L149-V194 HydrophobicContact CD2-CG1 3.77Å; L149-G197 VanDerWaalsContact O-CA 3.27Å; L149-G197 WeakPolarHBondContact O-CA 3.46Å; L149-G197 PolarHBondContact O-N 3.15Å; L149-H198 PolarHBondContact N-O 3.25Å; L149-F200 HydrophobicContact CB-CE2 4.01Å; L149-F200 HydrophobicContact CB-CZ 4.17Å
150	Q	93	Very high	69.3	Low	65 Å²	65	75 Å²	75	30%	0.304	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.6	179.3	-63.2	-166.7	-70.3	0	0	111	K148 F152 C168 D169 E196	K148-Q150 HydrophobicContact CB-CG 4.21Å; K148-Q150 PolarHBondContact O-N 3.45Å; Q150-F152 HydrophobicContact CB-CD2 4.34Å; Q150-F152 HydrophobicContact CB-CE2 3.53Å; Q150-F152 HydrophobicContact CB-CZ 3.94Å; Q150-C168 CarbonylContact O-C 3.59Å; Q150-C168 WeakPolarHBondContact O-CA 3.02Å; Q150-D169 PolarHBondContact N-O 3.08Å; Q150-D169 PolarHBondContact O-N 3.39Å; Q150-E196 VanDerWaalsContact CA-OE1 3.25Å; Q150-E196 WeakPolarHBondContact CA-OE1 3.39Å
151	S	93.3	Very high	70.6	Confident	32 Å²	32	77 Å²	77	22%	0.224	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.4	177.4	-62.2	0	0	0	0	110.6	R105 E196	R105-S151 PolarHBondContact NH2-OG 2.64Å; S151-E196 WeakPolarHBondContact CB-OE2 3.44Å; S151-E196 PolarHBondContact N-OE1 3.46Å; S151-E196 PolarHBondContact N-OE2 3.22Å; S151-E196 PolarHBondContact OG-OE2 2.8Å
152	F	92.5	Very high	72.1	Confident	31 Å²	31	72.2 Å²	72.2	14%	0.136	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	110	-179.1	-63.3	-93	0	0	0	110	I120 A135 Q150 I154 V166 L167 D169	I120-F152 HydrophobicContact CD1-CD2 3.52Å; I120-F152 HydrophobicContact CD1-CE2 3.95Å; I120-F152 HydrophobicContact CD1-CG 4.21Å; I120-F152 HydrophobicContact CG2-CB 3.59Å; I120-F152 HydrophobicContact CG2-CD1 3.99Å; I120-F152 HydrophobicContact CG2-CD2 3.97Å; I120-F152 HydrophobicContact CG2-CG 3.59Å; A135-F152 HydrophobicContact CB-CZ 4.41Å; Q150-F152 HydrophobicContact CB-CD2 4.34Å; Q150-F152 HydrophobicContact CB-CE2 3.53Å; Q150-F152 HydrophobicContact CB-CZ 3.94Å; F152-I154 PolarHBondContact O-N 3.22Å; F152-V166 WeakPolarHBondContact O-CA 3.35Å; F152-L167 PolarHBondContact N-O 3.39Å; F152-L167 PolarHBondContact O-N 2.99Å; F152-D169 HydrophobicContact CD2-CB 4.4Å; F152-D169 HydrophobicContact CE2-CB 3.86Å
153	N	90.6	Very high	74.1	Confident	54 Å²	54	65 Å²	65	29%	0.289	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	130.8	169.2	-67.2	-67.3	0	0	0	109.3	Q103 Q124 V166	Q103-N153 PolarHBondContact NE2-OD1 2.86Å; Q103-N153 PolarHBondContact OE1-OD1 2.65Å; Q124-N153 PolarHBondContact NE2-O 3.02Å; N153-V166 WeakPolarHBondContact OD1-CG2 3.48Å
154	I	88.1	Confident	76.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.7	164.1	-53.9	-52.6	0	0	0	106.6	V123 Q124 F127 F152 T163 L165 L167	V123-I154 HydrophobicContact CG1-CD1 3.89Å; V123-I154 HydrophobicContact CG1-CG1 4.35Å; V123-I154 HydrophobicContact CG1-CG2 4.36Å; Q124-I154 HydrophobicContact CG-CD1 3.96Å; F127-I154 HydrophobicContact CD2-CG2 3.54Å; F127-I154 HydrophobicContact CE2-CG2 3.54Å; F127-I154 HydrophobicContact CG-CG2 4.27Å; F127-I154 HydrophobicContact CZ-CG2 4.25Å; F152-I154 PolarHBondContact O-N 3.22Å; I154-T163 HydrophobicContact CB-CG2 4.29Å; I154-T163 WeakPolarHBondContact CB-OG1 3.5Å; I154-T163 HydrophobicContact CG2-CG2 4.05Å; I154-T163 WeakPolarHBondContact O-CG2 3.36Å; I154-T163 PolarHBondContact O-N 3.05Å; I154-T163 PolarHBondContact O-OG1 3.43Å; I154-L165 HydrophobicContact CG1-CD2 4.19Å; I154-L165 HydrophobicContact CG1-CG 4.35Å; I154-L165 PolarHBondContact N-O 2.77Å; I154-L167 HydrophobicContact CD1-CD1 3.99Å; I154-L167 HydrophobicContact CD1-CG 4.21Å; I154-L167 HydrophobicContact CG1-CD1 4.4Å; I154-L167 HydrophobicContact CG1-CG 4.25Å
155	R	81.6	Confident	78.3	Confident	130 Å²	130	60.1 Å²	60.1	49%	0.491	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	145	179.4	-63.5	-172.5	-176.6	-170.2	2.2	108.9	F127	F127-R155 WeakPolarHBondContact CB-O 3.47Å; F127-R155 WeakPolarHBondContact CD1-O 3.15Å; F127-R155 VanDerWaalsContact CG-O 3.29Å; F127-R155 WeakPolarHBondContact CG-O 3.12Å
156	G	75.8	Confident	80	Confident	10 Å²	10	56.8 Å²	56.8	10%	0.103	29%	0.285	C	S	.	.			trans	-65.8	172.2	170.9	0	0	0	0	0	112.3	N158 G159 D161	G156-N158 PolarHBondContact O-N 2.95Å; G156-N158 VanDerWaalsContact O-N 3.12Å; G156-G159 PolarHBondContact O-N 3.03Å; G156-G159 VanDerWaalsContact O-N 3.08Å; G156-D161 PolarHBondContact N-O 3.45Å
157	Q	66.6	Low	81.5	Confident	131 Å²	131	56.2 Å²	56.2	61%	0.612	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.6	-178.8	-79.6	-177.7	7.3	0	0	113.7	M88 G159	M88-Q157 HydrophobicContact CE-CG 3.73Å; M88-Q157 PolarHBondContact SD-NE2 2.97Å; M88-Q157 VanDerWaalsContact SD-NE2 3.39Å; Q157-G159 VanDerWaalsContact C-N 3.32Å; Q157-G159 PolarHBondContact O-N 2.87Å
158	N	60.9	Low	82.4	Confident	137 Å²	137	51.8 Å²	51.8	73%	0.733	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	0.2	-176.7	-64	-7.3	0	0	0	113.7	G156 E160	G156-N158 PolarHBondContact O-N 2.95Å; G156-N158 VanDerWaalsContact O-N 3.12Å; N158-E160 PolarHBondContact O-N 3.08Å
159	G	58.3	Low	82.7	Confident	36 Å²	36	47 Å²	47	37%	0.371	24%	0.242	S	C	.	.	S	Bend	trans	69.7	-16.7	175.3	0	0	0	0	0	116.7	G156 Q157	G156-G159 PolarHBondContact O-N 3.03Å; G156-G159 VanDerWaalsContact O-N 3.08Å; Q157-G159 VanDerWaalsContact C-N 3.32Å; Q157-G159 PolarHBondContact O-N 2.87Å
160	E	55.5	Low	82.6	Confident	177 Å²	177	46.9 Å²	46.9	83%	0.827	24%	0.241	S	C	*	.	S	Bend	trans	-91.9	-33	-177.6	-70.3	-175.9	158.4	0	0	113.5	N158	N158-E160 PolarHBondContact O-N 3.08Å
161	D	63.8	Low	82.4	Confident	107 Å²	107	44.6 Å²	44.6	57%	0.572	23%	0.231	S	C	*	.	S	Bend	trans	-93.7	109.7	178.2	-68	-38.3	0	0	0	111.2	G156 T163	G156-D161 PolarHBondContact N-O 3.45Å; D161-T163 PolarHBondContact O-N 3.42Å
162	N	71.5	Confident	82.1	Confident	67 Å²	67	43.2 Å²	43.2	36%	0.358	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	133.3	163.9	-78.6	-17.4	0	0	0	108.4	R95	R95-N162 PolarHBondContact NH2-O 2.97Å
163	T	81.2	Confident	81.9	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	161.9	168	73.8	0	0	0	0	109	Q103 I154 D161 L165	Q103-T163 PolarHBondContact NE2-O 3.44Å; I154-T163 HydrophobicContact CB-CG2 4.29Å; I154-T163 WeakPolarHBondContact CB-OG1 3.5Å; I154-T163 HydrophobicContact CG2-CG2 4.05Å; I154-T163 WeakPolarHBondContact O-CG2 3.36Å; I154-T163 PolarHBondContact O-N 3.05Å; I154-T163 PolarHBondContact O-OG1 3.43Å; D161-T163 PolarHBondContact O-N 3.42Å; T163-L165 PolarHBondContact O-N 3.03Å; T163-L165 PolarHBondContact OG1-N 3.27Å; T163-L165 PolarHBondContact OG1-O 3.42Å
164	G	91.5	Very high	81.2	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	21.3	170.4	0	0	0	0	0	113.4	Y94 Q103 A104	Y94-G164 VanDerWaalsContact O-CA 3.3Å; Y94-G164 WeakPolarHBondContact O-CA 3.31Å; Y94-G164 PolarHBondContact O-N 3.35Å; Q103-G164 CarbonylContact C-O 3.56Å; Q103-G164 WeakPolarHBondContact CA-O 3.16Å; A104-G164 WeakPolarHBondContact CB-O 3.46Å; A104-G164 PolarHBondContact N-O 3.41Å
165	L	95.2	Very high	80.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.9	-174	176.2	64.7	0	0	0	112.1	A104 V106 I154 T163 L167 V329 L333	A104-L165 CarbonylContact O-C 3.5Å; V106-L165 HydrophobicContact CB-CD1 4.47Å; V106-L165 HydrophobicContact CG2-CD1 3.61Å; I154-L165 HydrophobicContact CG1-CD2 4.19Å; I154-L165 HydrophobicContact CG1-CG 4.35Å; I154-L165 PolarHBondContact N-O 2.77Å; T163-L165 PolarHBondContact O-N 3.03Å; T163-L165 PolarHBondContact OG1-N 3.27Å; T163-L165 PolarHBondContact OG1-O 3.42Å; L165-L167 HydrophobicContact CD1-CD2 4.13Å; L165-L167 HydrophobicContact CD2-CD2 4.24Å; L165-L167 HydrophobicContact CG-CD2 4.26Å; L165-V329 HydrophobicContact CD2-CG1 3.58Å; L165-L333 HydrophobicContact CB-CD2 4.27Å; L165-L333 HydrophobicContact CD1-CD2 3.89Å; L165-L333 HydrophobicContact CD2-CD2 4.07Å; L165-L333 HydrophobicContact CD2-CG 4.49Å; L165-L333 HydrophobicContact CG-CD2 4.29Å
166	V	96	Very high	78.9	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.6	172.3	177.2	0	0	0	0	108.9	Q103 A104 R105 V106 F152 N153	Q103-V166 HydrophobicContact CB-CG2 3.93Å; Q103-V166 HydrophobicContact CG-CG2 4.38Å; A104-V166 PolarHBondContact O-N 2.93Å; R105-V166 WeakPolarHBondContact CA-O 3.49Å; R105-V166 HydrophobicContact CG-CB 4.31Å; V106-V166 PolarHBondContact N-O 2.98Å; F152-V166 WeakPolarHBondContact O-CA 3.35Å; N153-V166 WeakPolarHBondContact OD1-CG2 3.48Å
167	L	97.1	Very high	77.6	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.7	169.9	-58.5	-175.6	0	0	0	109.2	V106 F119 I120 F152 I154 L165	V106-L167 HydrophobicContact CB-CD2 3.94Å; V106-L167 HydrophobicContact CG1-CD2 4.39Å; V106-L167 HydrophobicContact CG2-CD2 4.49Å; F119-L167 HydrophobicContact CD1-CD1 4.37Å; F119-L167 HydrophobicContact CE1-CD1 4.12Å; I120-L167 HydrophobicContact CD1-CB 4.02Å; I120-L167 HydrophobicContact CG1-CB 4Å; I120-L167 HydrophobicContact CG1-CD1 4.01Å; F152-L167 PolarHBondContact N-O 3.39Å; F152-L167 PolarHBondContact O-N 2.99Å; I154-L167 HydrophobicContact CD1-CD1 3.99Å; I154-L167 HydrophobicContact CD1-CG 4.21Å; I154-L167 HydrophobicContact CG1-CD1 4.4Å; I154-L167 HydrophobicContact CG1-CG 4.25Å; L165-L167 HydrophobicContact CD1-CD2 4.13Å; L165-L167 HydrophobicContact CD2-CD2 4.24Å; L165-L167 HydrophobicContact CG-CD2 4.26Å
168	C	96.9	Very high	76.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119	179.9	-62.7	0	0	0	0	109.8	V106 L107 L108 L149 Q150 I223	V106-C168 PolarHBondContact O-N 3.25Å; L107-C168 HydrophobicContact CD1-CB 3.97Å; L108-C168 PolarHBondContact N-O 2.95Å; L149-C168 HydrophobicContact CD1-CB 4.31Å; Q150-C168 CarbonylContact O-C 3.59Å; Q150-C168 WeakPolarHBondContact O-CA 3.02Å; C168-I223 HydrophobicContact CB-CD1 4.28Å
169	D	94.4	Very high	76.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	142.5	171.7	-162	21.7	0	0	0	110.4	K116 S117 I120 T146 Q150 F152	K116-D169 VanDerWaalsContact CB-OD1 3.32Å; K116-D169 WeakPolarHBondContact CB-OD1 3.29Å; S117-D169 WeakPolarHBondContact CB-OD2 3.21Å; S117-D169 PolarHBondContact OG-OD2 2.91Å; I120-D169 HydrophobicContact CD1-CB 3.75Å; T146-D169 HydrophobicContact CG2-CB 4.4Å; T146-D169 WeakPolarHBondContact CG2-OD2 3.22Å; T146-D169 PolarHBondContact OG1-OD2 3.2Å; Q150-D169 PolarHBondContact N-O 3.08Å; Q150-D169 PolarHBondContact O-N 3.39Å; F152-D169 HydrophobicContact CD2-CB 4.4Å; F152-D169 HydrophobicContact CE2-CB 3.86Å
170	I	91.4	Very high	77	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.264	C	S	.	.			trans	-139.2	168.4	177.2	52.3	168.8	0	0	0	109.4	L107 L109 K116 L149 G172 L181 V189 F200	L107-I170 HydrophobicContact CD1-CD1 3.77Å; L107-I170 HydrophobicContact CD1-CG1 3.89Å; L107-I170 HydrophobicContact CD1-CG2 3.88Å; L107-I170 HydrophobicContact CD2-CD1 4.08Å; L107-I170 HydrophobicContact CG-CD1 4.16Å; L109-I170 HydrophobicContact CD1-CD1 3.69Å; K116-I170 WeakPolarHBondContact CE-O 3.39Å; L149-I170 HydrophobicContact CB-CG2 4.22Å; L149-I170 HydrophobicContact CD1-CG2 3.4Å; L149-I170 HydrophobicContact CG-CG2 4.4Å; I170-G172 PolarHBondContact O-N 3.32Å; I170-L181 HydrophobicContact CB-CD1 4.21Å; I170-L181 HydrophobicContact CD1-CD1 3.56Å; I170-L181 HydrophobicContact CG1-CD1 4.13Å; I170-V189 HydrophobicContact CG2-CG1 4.47Å; I170-F200 HydrophobicContact CB-CE2 4.27Å; I170-F200 HydrophobicContact CG2-CE2 4.06Å; I170-F200 HydrophobicContact CG2-CZ 4.26Å
171	M	88.8	Confident	78.3	Confident	17 Å²	17	39 Å²	39	8%	0.084	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-54.7	142.7	172.5	-173.5	168.4	65.9	0	0	111	S144 T146 L181 F200	S144-M171 PolarHBondContact OG-SD 3.4Å; T146-M171 VanDerWaalsContact O-CA 3.23Å; T146-M171 WeakPolarHBondContact O-CA 3.39Å; T146-M171 VanDerWaalsContact O-CB 3.28Å; T146-M171 WeakPolarHBondContact O-CB 3.24Å; T146-M171 WeakPolarHBondContact O-CG 2.94Å; M171-L181 HydrophobicContact CB-CD1 4.4Å; M171-L181 HydrophobicContact CB-CD2 4.34Å; M171-L181 HydrophobicContact CB-CG 4.19Å; M171-L181 HydrophobicContact CE-CD2 3.99Å; M171-L181 HydrophobicContact CE-CG 4.08Å; M171-L181 WeakPolarHBondContact O-CD1 3.37Å; M171-F200 HydrophobicContact CB-CD2 4.41Å; M171-F200 HydrophobicContact CE-CB 3.84Å
172	G	86.9	Confident	79.3	Confident	3 Å²	3	36.2 Å²	36.2	3%	0.031	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-67.1	154.6	178.8	0	0	0	0	0	112.8	G110 I170 G174	G110-G172 VanDerWaalsContact O-CA 3.28Å; G110-G172 WeakPolarHBondContact O-CA 3.35Å; I170-G172 PolarHBondContact O-N 3.32Å; G172-G174 PolarHBondContact O-N 3.38Å
173	L	87.4	Confident	80.1	Confident	7 Å²	7	35.4 Å²	35.4	4%	0.037	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-62.6	132	167.8	-58.9	174.8	0	0	0	109	L109 G110 P111 V112 I186 F242 F246 L249	L109-L173 HydrophobicContact CD1-CD1 4.44Å; L109-L173 HydrophobicContact CD1-CD2 3.92Å; L109-L173 HydrophobicContact CD1-CG 4.14Å; L109-L173 HydrophobicContact CG-CD1 4.39Å; G110-L173 PolarHBondContact O-N 3.38Å; P111-L173 WeakPolarHBondContact CA-O 3.44Å; V112-L173 PolarHBondContact N-O 3.35Å; L173-I186 HydrophobicContact CD2-CD1 3.46Å; L173-I186 VanDerWaalsContact CD2-CD1 3.46Å; L173-F242 HydrophobicContact CB-CE1 3.86Å; L173-F246 HydrophobicContact CD1-CD1 4.32Å; L173-F246 HydrophobicContact CD1-CE1 3.58Å; L173-F246 HydrophobicContact CD1-CZ 4Å; L173-L249 HydrophobicContact CD1-CD1 4.17Å; L173-L249 HydrophobicContact CD2-CD1 4.46Å
174	G	76.1	Confident	80.5	Confident	22 Å²	22	40.1 Å²	40.1	23%	0.227	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-83	169.9	173.6	0	0	0	0	0	112.3	G172 T179 F242	G172-G174 PolarHBondContact O-N 3.38Å; G174-T179 VanDerWaalsContact CA-O 3.3Å; G174-T179 WeakPolarHBondContact CA-O 3.49Å; G174-F242 VanDerWaalsContact O-CE1 3.27Å; G174-F242 WeakPolarHBondContact O-CE1 3.34Å; G174-F242 WeakPolarHBondContact O-CZ 3.45Å
175	D	64.8	Low	80.5	Confident	110 Å²	110	40.2 Å²	40.2	59%	0.588	23%	0.234	S	C	*	.	S	Bend	trans	-90.4	-0.1	-176	55	-3.9	0	0	0	114.1	H239 F242	D175-H239 HydrophobicContact CB-CB 4.39Å; D175-H239 PolarHBondContact O-ND1 3.12Å; D175-F242 HydrophobicContact CB-CE2 4.19Å; D175-F242 HydrophobicContact CB-CZ 4.35Å
176	G	56.3	Low	80.5	Confident	43 Å²	43	40.3 Å²	40.3	44%	0.443	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-175.1	-176.4	179.2	0	0	0	0	0	114.6	T178	G176-T178 PolarHBondContact O-N 3.23Å; G176-T178 VanDerWaalsContact O-N 3.09Å
177	E	47.9	Very low	80.5	Confident	205 Å²	205	41.1 Å²	41.1	96%	0.958	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.6	-167.6	-66.9	-178.6	164.3	0	0	116.3
178	T	48.2	Very low	80.4	Confident	119 Å²	119	41.3 Å²	41.3	73%	0.73	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-5.9	-170.3	54.6	0	0	0	0	114.9	G176	G176-T178 PolarHBondContact O-N 3.23Å; G176-T178 VanDerWaalsContact O-N 3.09Å
179	T	57.2	Low	80.5	Confident	78 Å²	78	41.4 Å²	41.4	48%	0.479	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-143	131.9	178.6	62.7	0	0	0	0	110.8	G174	G174-T179 VanDerWaalsContact CA-O 3.3Å; G174-T179 WeakPolarHBondContact CA-O 3.49Å
180	G	68.9	Low	80.6	Confident	16 Å²	16	41.5 Å²	41.5	17%	0.165	24%	0.241	C	C	.	.	S	Bend	trans	123.3	-177.5	173.1	0	0	0	0	0	114.6
181	L	81.9	Confident	80.9	Confident	17 Å²	17	45.7 Å²	45.7	9%	0.089	26%	0.259	C	S	.	.			trans	-75.1	136.2	175.6	-67.9	173.3	0	0	0	110.5	I170 M171 D185 I186 F200	I170-L181 HydrophobicContact CB-CD1 4.21Å; I170-L181 HydrophobicContact CD1-CD1 3.56Å; I170-L181 HydrophobicContact CG1-CD1 4.13Å; M171-L181 HydrophobicContact CB-CD1 4.4Å; M171-L181 HydrophobicContact CB-CD2 4.34Å; M171-L181 HydrophobicContact CB-CG 4.19Å; M171-L181 HydrophobicContact CE-CD2 3.99Å; M171-L181 HydrophobicContact CE-CG 4.08Å; M171-L181 WeakPolarHBondContact O-CD1 3.37Å; L181-D185 HydrophobicContact CD2-CB 4.13Å; L181-I186 HydrophobicContact CB-CD1 4.1Å; L181-I186 HydrophobicContact CB-CG1 3.92Å; L181-I186 HydrophobicContact CD1-CG1 4Å; L181-F200 HydrophobicContact CD2-CB 3.6Å; L181-F200 HydrophobicContact CD2-CD1 3.23Å; L181-F200 HydrophobicContact CD2-CD2 3.68Å; L181-F200 HydrophobicContact CD2-CE1 3.72Å; L181-F200 HydrophobicContact CD2-CE2 4.11Å; L181-F200 HydrophobicContact CD2-CG 3.2Å; L181-F200 HydrophobicContact CD2-CZ 4.13Å
182	T	86	Confident	81.3	Confident	49 Å²	49	45 Å²	45	30%	0.301	26%	0.257	S	S	.	.			trans	-72.8	158.4	167.6	70.5	0	0	0	0	110	H184 D185 I186	T182-H184 PolarHBondContact O-N 3.3Å; T182-H184 PolarHBondContact OG1-N 3.07Å; T182-D185 WeakPolarHBondContact CB-OD2 3.34Å; T182-D185 PolarHBondContact N-OD2 3.48Å; T182-D185 PolarHBondContact O-N 2.54Å; T182-D185 VanDerWaalsContact O-N 3.16Å; T182-D185 PolarHBondContact OG1-N 3.1Å; T182-D185 VanDerWaalsContact OG1-N 3.09Å; T182-D185 PolarHBondContact OG1-OD1 2.95Å; T182-D185 PolarHBondContact OG1-OD2 3.18Å; T182-I186 PolarHBondContact O-N 3.44Å
183	L	87.7	Confident	81.8	Confident	50 Å²	50	46.4 Å²	46.4	26%	0.262	26%	0.262	S	S	.	.	H	α-helix	trans	-55.2	-39.6	171	178.1	60.6	0	0	0	111.1	D185 I186 L187 L249 Y252	L183-D185 PolarHBondContact O-N 3.21Å; L183-I186 PolarHBondContact O-N 3.07Å; L183-L187 HydrophobicContact CD1-CD1 4.22Å; L183-L187 HydrophobicContact CD1-CG 4.17Å; L183-L187 HydrophobicContact CG-CD1 4.08Å; L183-L187 HydrophobicContact CG-CG 4.41Å; L183-L187 VanDerWaalsContact O-CG 3.31Å; L183-L187 WeakPolarHBondContact O-CG 3.49Å; L183-L187 PolarHBondContact O-N 3.23Å; L183-L249 HydrophobicContact CD1-CD2 3.39Å; L183-L249 HydrophobicContact CD1-CG 3.94Å; L183-Y252 HydrophobicContact CD1-CD2 4.26Å; L183-Y252 HydrophobicContact CD2-CD2 3.87Å; L183-Y252 HydrophobicContact CD2-CE2 3.61Å; L183-Y252 HydrophobicContact CG-CD2 4.49Å
184	H	89.9	Confident	82.2	Confident	101 Å²	101	46.4 Å²	46.4	47%	0.468	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-42.2	177.8	-176.4	-90	0	0	0	112.6	T182 I186 L187 S188 V206	T182-H184 PolarHBondContact O-N 3.3Å; T182-H184 PolarHBondContact OG1-N 3.07Å; H184-I186 PolarHBondContact O-N 3.22Å; H184-L187 PolarHBondContact O-N 2.77Å; H184-S188 PolarHBondContact CE1-OG 3.34Å; H184-S188 WeakPolarHBondContact O-CB 3.36Å; H184-S188 PolarHBondContact O-N 2.92Å; H184-S188 PolarHBondContact O-OG 3.07Å; H184-V206 PolarHBondContact CE1-O 3.42Å; H184-V206 PolarHBondContact ND1-O 3.02Å; H184-V206 VanDerWaalsContact ND1-O 3.08Å
185	D	92.4	Very high	83.1	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-46.3	177.8	-59.6	-39.8	0	0	0	110.9	L181 T182 L183 S188 V189 F200 P205 V206	L181-D185 HydrophobicContact CD2-CB 4.13Å; T182-D185 WeakPolarHBondContact CB-OD2 3.34Å; T182-D185 PolarHBondContact N-OD2 3.48Å; T182-D185 PolarHBondContact O-N 2.54Å; T182-D185 VanDerWaalsContact O-N 3.16Å; T182-D185 PolarHBondContact OG1-N 3.1Å; T182-D185 VanDerWaalsContact OG1-N 3.09Å; T182-D185 PolarHBondContact OG1-OD1 2.95Å; T182-D185 PolarHBondContact OG1-OD2 3.18Å; L183-D185 PolarHBondContact O-N 3.21Å; D185-S188 WeakPolarHBondContact O-CB 3.43Å; D185-S188 PolarHBondContact O-N 3.45Å; D185-V189 WeakPolarHBondContact O-CG2 3.29Å; D185-V189 PolarHBondContact O-N 3.02Å; D185-F200 HydrophobicContact CB-CD1 4.15Å; D185-F200 HydrophobicContact CB-CE1 4.13Å; D185-P205 WeakPolarHBondContact OD1-CA 3.41Å; D185-V206 HydrophobicContact CB-CG2 4.28Å; D185-V206 WeakPolarHBondContact OD1-CB 3.37Å; D185-V206 WeakPolarHBondContact OD1-CG2 3.34Å; D185-V206 PolarHBondContact OD1-N 2.7Å
186	I	94.6	Very high	84.4	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-47.3	-179.7	-62.2	160.1	0	0	0	110.3	L109 L173 L181 T182 L183 H184 S188 V189 I190 L249	L109-I186 HydrophobicContact CD1-CD1 4.1Å; L109-I186 HydrophobicContact CD1-CG1 4.24Å; L109-I186 HydrophobicContact CD1-CG2 4.26Å; L109-I186 HydrophobicContact CD2-CG2 3.88Å; L173-I186 HydrophobicContact CD2-CD1 3.46Å; L173-I186 VanDerWaalsContact CD2-CD1 3.46Å; L181-I186 HydrophobicContact CB-CD1 4.1Å; L181-I186 HydrophobicContact CB-CG1 3.92Å; L181-I186 HydrophobicContact CD1-CG1 4Å; T182-I186 PolarHBondContact O-N 3.44Å; L183-I186 PolarHBondContact O-N 3.07Å; H184-I186 PolarHBondContact O-N 3.22Å; I186-S188 VanDerWaalsContact C-N 3.27Å; I186-S188 PolarHBondContact O-N 3.01Å; I186-V189 WeakPolarHBondContact O-CB 3.15Å; I186-V189 PolarHBondContact O-N 2.82Å; I186-V189 VanDerWaalsContact O-N 3.16Å; I186-I190 HydrophobicContact CG2-CD1 3.93Å; I186-I190 HydrophobicContact CG2-CG1 4.48Å; I186-I190 WeakPolarHBondContact O-CG1 3.14Å; I186-I190 PolarHBondContact O-N 3.45Å; I186-L249 HydrophobicContact CB-CD2 4.2Å; I186-L249 HydrophobicContact CD1-CD1 4.39Å; I186-L249 HydrophobicContact CD1-CD2 3.86Å; I186-L249 HydrophobicContact CG2-CD2 3.74Å
187	L	94.9	Very high	86.1	Confident	21 Å²	21	46 Å²	46	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-35.1	177.7	-64.8	179.6	0	0	0	111.9	L183 H184 I190 K191 Y252 L256	L183-L187 HydrophobicContact CD1-CD1 4.22Å; L183-L187 HydrophobicContact CD1-CG 4.17Å; L183-L187 HydrophobicContact CG-CD1 4.08Å; L183-L187 HydrophobicContact CG-CG 4.41Å; L183-L187 VanDerWaalsContact O-CG 3.31Å; L183-L187 WeakPolarHBondContact O-CG 3.49Å; L183-L187 PolarHBondContact O-N 3.23Å; H184-L187 PolarHBondContact O-N 2.77Å; L187-I190 PolarHBondContact O-N 2.7Å; L187-K191 WeakPolarHBondContact O-CB 3.25Å; L187-K191 VanDerWaalsContact O-CG 3.24Å; L187-K191 WeakPolarHBondContact O-CG 3.19Å; L187-K191 PolarHBondContact O-N 3.36Å; L187-Y252 HydrophobicContact CD1-CD1 4.2Å; L187-Y252 HydrophobicContact CD1-CD2 4.35Å; L187-Y252 HydrophobicContact CD1-CG 3.98Å; L187-Y252 HydrophobicContact CD2-CG 4.39Å; L187-L256 HydrophobicContact CD2-CD1 4.22Å
188	S	96.2	Very high	88.2	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-38.6	174.6	-62.4	0	0	0	0	112	H184 D185 I186 G192 H193	H184-S188 PolarHBondContact CE1-OG 3.34Å; H184-S188 WeakPolarHBondContact O-CB 3.36Å; H184-S188 PolarHBondContact O-N 2.92Å; H184-S188 PolarHBondContact O-OG 3.07Å; D185-S188 WeakPolarHBondContact O-CB 3.43Å; D185-S188 PolarHBondContact O-N 3.45Å; I186-S188 VanDerWaalsContact C-N 3.27Å; I186-S188 PolarHBondContact O-N 3.01Å; S188-G192 PolarHBondContact O-N 2.93Å; S188-H193 WeakPolarHBondContact O-CB 3.31Å; S188-H193 PolarHBondContact O-N 3.43Å
189	V	97.4	Very high	90.2	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-48.3	171.9	174.8	0	0	0	0	110.4	L107 L149 I170 D185 I186 K191 G192 V194 F200 I223	L107-V189 HydrophobicContact CD1-CG1 3.9Å; L107-V189 HydrophobicContact CD2-CG1 4.09Å; L149-V189 HydrophobicContact CD1-CG1 4.08Å; L149-V189 HydrophobicContact CD2-CG1 4.38Å; I170-V189 HydrophobicContact CG2-CG1 4.47Å; D185-V189 WeakPolarHBondContact O-CG2 3.29Å; D185-V189 PolarHBondContact O-N 3.02Å; I186-V189 WeakPolarHBondContact O-CB 3.15Å; I186-V189 PolarHBondContact O-N 2.82Å; I186-V189 VanDerWaalsContact O-N 3.16Å; V189-K191 VanDerWaalsContact C-N 3.31Å; V189-K191 PolarHBondContact O-N 3.08Å; V189-G192 PolarHBondContact O-N 2.87Å; V189-V194 HydrophobicContact CB-CG2 4.46Å; V189-V194 HydrophobicContact CG2-CB 3.97Å; V189-V194 HydrophobicContact CG2-CG1 4.27Å; V189-V194 HydrophobicContact CG2-CG2 3.72Å; V189-F200 HydrophobicContact CG2-CE1 4.06Å; V189-F200 HydrophobicContact CG2-CZ 3.69Å; V189-I223 HydrophobicContact CG1-CG1 4.44Å
190	I	97.8	Very high	91.6	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-41.2	-177.2	-66.9	175.3	0	0	0	111.4	L107 I186 L187 G192 I223 V226 I253 L256 V258	L107-I190 HydrophobicContact CD2-CD1 4.21Å; L107-I190 HydrophobicContact CD2-CG1 3.7Å; I186-I190 HydrophobicContact CG2-CD1 3.93Å; I186-I190 HydrophobicContact CG2-CG1 4.48Å; I186-I190 WeakPolarHBondContact O-CG1 3.14Å; I186-I190 PolarHBondContact O-N 3.45Å; L187-I190 PolarHBondContact O-N 2.7Å; I190-G192 PolarHBondContact O-N 2.82Å; I190-I223 HydrophobicContact CB-CB 4.4Å; I190-I223 HydrophobicContact CG1-CB 4.41Å; I190-I223 HydrophobicContact CG1-CG1 4.41Å; I190-I223 HydrophobicContact CG2-CB 4.25Å; I190-I223 PolarHBondContact O-N 3.27Å; I190-V226 HydrophobicContact CD1-CG2 3.9Å; I190-V226 HydrophobicContact CG1-CG2 4.37Å; I190-I253 HydrophobicContact CD1-CD1 3.92Å; I190-I253 HydrophobicContact CD1-CG1 3.62Å; I190-L256 HydrophobicContact CB-CD1 4.45Å; I190-L256 HydrophobicContact CG2-CD1 3.74Å; I190-V258 HydrophobicContact CG2-CG2 4.19Å
191	K	97.1	Very high	92.3	Very high	87 Å²	87	36.1 Å²	36.1	38%	0.378	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-10.1	175.8	-70.5	172.3	-179.3	179.5	0	113.6	L187 V189 H193 P217 R222 L256	L187-K191 WeakPolarHBondContact O-CB 3.25Å; L187-K191 VanDerWaalsContact O-CG 3.24Å; L187-K191 WeakPolarHBondContact O-CG 3.19Å; L187-K191 PolarHBondContact O-N 3.36Å; V189-K191 VanDerWaalsContact C-N 3.31Å; V189-K191 PolarHBondContact O-N 3.08Å; K191-H193 WeakPolarHBondContact CB-CD2 3.32Å; K191-P217 VanDerWaalsContact O-CB 3.26Å; K191-P217 WeakPolarHBondContact O-CB 3.39Å; K191-P217 WeakPolarHBondContact O-CG 3.35Å; K191-R222 WeakPolarHBondContact O-CG 3.32Å; K191-L256 HydrophobicContact CG-CD1 4.23Å; K191-L256 HydrophobicContact CG-CD2 4.27Å
192	G	97.3	Very high	92	Very high	4 Å²	4	38.3 Å²	38.3	4%	0.041	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	16.4	178.6	0	0	0	0	0	114.9	S188 V189 I190 P217 D221	S188-G192 PolarHBondContact O-N 2.93Å; V189-G192 PolarHBondContact O-N 2.87Å; I190-G192 PolarHBondContact O-N 2.82Å; G192-P217 WeakPolarHBondContact O-CB 3.29Å; G192-D221 WeakPolarHBondContact CA-O 3.29Å
193	H	97.6	Very high	91.7	Very high	31 Å²	31	42.8 Å²	42.8	14%	0.144	23%	0.226	C	C	.	.			trans	-79.3	-22.8	-178.8	-68	-63.9	0	0	0	113.7	S188 K191 Y213 V214 P217	S188-H193 WeakPolarHBondContact O-CB 3.31Å; S188-H193 PolarHBondContact O-N 3.43Å; K191-H193 WeakPolarHBondContact CB-CD2 3.32Å; H193-Y213 HydrophobicContact CB-CD2 4.14Å; H193-Y213 HydrophobicContact CB-CE1 4.37Å; H193-Y213 HydrophobicContact CB-CE2 3.48Å; H193-Y213 VanDerWaalsContact CB-CE2 3.48Å; H193-Y213 AromaticContact CG-CZ 3.7Å; H193-Y213 AromaticContact ND1-CE1 3.97Å; H193-Y213 AromaticContact ND1-CZ 3.72Å; H193-Y213 PolarHBondContact ND1-OH 2.96Å; H193-V214 PolarHBondContact ND1-O 3.23Å; H193-V214 PolarHBondContact O-N 3.4Å; H193-P217 WeakPolarHBondContact CE1-CD 3.48Å; H193-P217 WeakPolarHBondContact ND1-CD 3.5Å
194	V	96.4	Very high	91.5	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	25%	0.247	C	C	.	.	S	Bend	trans	-88.6	125.4	-173.1	-178.1	0	0	0	0	110.3	L149 V189 H198 F200 V206	L149-V194 HydrophobicContact CB-CG1 4.48Å; L149-V194 HydrophobicContact CD2-CB 4.05Å; L149-V194 HydrophobicContact CD2-CG1 3.77Å; V189-V194 HydrophobicContact CB-CG2 4.46Å; V189-V194 HydrophobicContact CG2-CB 3.97Å; V189-V194 HydrophobicContact CG2-CG1 4.27Å; V189-V194 HydrophobicContact CG2-CG2 3.72Å; V194-H198 HydrophobicContact CG1-CB 3.52Å; V194-F200 HydrophobicContact CG1-CE1 4.41Å; V194-F200 HydrophobicContact CG1-CZ 4.26Å; V194-V206 HydrophobicContact CG2-CB 4.36Å; V194-V206 HydrophobicContact CG2-CG1 3.71Å; V194-V206 HydrophobicContact CG2-CG2 3.84Å
195	P	94	Very high	91.3	Very high	27 Å²	27	45.9 Å²	45.9	18%	0.175	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-72	153.1	178.2	28.2	-32.7	0	0	0	112.2	G197 H198 A211 G212	P195-G197 PolarHBondContact O-N 2.91Å; P195-H198 HydrophobicContact CG-CB 4.21Å; P195-H198 WeakPolarHBondContact O-CB 3.47Å; P195-H198 PolarHBondContact O-N 2.85Å; P195-A211 WeakPolarHBondContact CG-O 3.48Å; P195-G212 WeakPolarHBondContact CB-O 3.36Å; P195-G212 WeakPolarHBondContact CG-O 3.03Å
196	E	92.9	Very high	91.2	Very high	108 Å²	108	45.9 Å²	45.9	51%	0.505	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	136.9	173.9	-175.8	62.1	-155.1	0	0	111.3	Q150 S151 H198	Q150-E196 VanDerWaalsContact CA-OE1 3.25Å; Q150-E196 WeakPolarHBondContact CA-OE1 3.39Å; S151-E196 WeakPolarHBondContact CB-OE2 3.44Å; S151-E196 PolarHBondContact N-OE1 3.46Å; S151-E196 PolarHBondContact N-OE2 3.22Å; S151-E196 PolarHBondContact OG-OE2 2.8Å; E196-H198 PolarHBondContact O-N 3.48Å
197	G	90.8	Very high	91.1	Very high	32 Å²	32	47 Å²	47	33%	0.33	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	0.4	-179.4	0	0	0	0	0	115.3	K148 L149 P195 K199	K148-G197 WeakPolarHBondContact CD-O 3.45Å; K148-G197 WeakPolarHBondContact CG-O 3.49Å; L149-G197 VanDerWaalsContact O-CA 3.27Å; L149-G197 WeakPolarHBondContact O-CA 3.46Å; L149-G197 PolarHBondContact O-N 3.15Å; P195-G197 PolarHBondContact O-N 2.91Å; G197-K199 PolarHBondContact O-N 3.09Å
198	H	91.9	Very high	90.9	Very high	30 Å²	30	50.1 Å²	50.1	14%	0.139	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-55	130.9	174.3	176.7	74.8	0	0	0	110.9	K148 L149 V194 P195 E196 F200 T210	K148-H198 CarbonylContact C-O 3.55Å; K148-H198 WeakPolarHBondContact CA-O 3.49Å; L149-H198 PolarHBondContact N-O 3.25Å; V194-H198 HydrophobicContact CG1-CB 3.52Å; P195-H198 HydrophobicContact CG-CB 4.21Å; P195-H198 WeakPolarHBondContact O-CB 3.47Å; P195-H198 PolarHBondContact O-N 2.85Å; E196-H198 PolarHBondContact O-N 3.48Å; H198-F200 AromaticContact CD2-CD1 3.75Å; H198-F200 AromaticContact CD2-CE1 3.74Å; H198-F200 AromaticContact NE2-CD1 3.93Å; H198-T210 WeakPolarHBondContact CE1-CG2 3.4Å; H198-T210 WeakPolarHBondContact ND1-CG2 3.47Å
199	K	90.4	Very high	90.6	Very high	129 Å²	129	58.3 Å²	58.3	56%	0.561	32%	0.315	S	S	*	.	B	Isolated β-bridge	trans	-98.4	119.7	179.6	-173.2	-173.2	174.2	-168.4	0	109.7	K147 K148 G197	K147-K199 HydrophobicContact CB-CG 4.22Å; K147-K199 VanDerWaalsContact O-CA 3.32Å; K147-K199 WeakPolarHBondContact O-CA 3.06Å; K147-K199 WeakPolarHBondContact O-CG 3.27Å; K148-K199 HydrophobicContact CG-CB 4Å; K148-K199 HydrophobicContact CG-CG 4.31Å; G197-K199 PolarHBondContact O-N 3.09Å
200	F	87.8	Confident	90.4	Very high	9 Å²	9	59.3 Å²	59.3	4%	0.039	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-76.9	142.1	-179.3	-60.2	-82.5	0	0	0	111.5	K147 L149 I170 M171 L181 D185 V189 V194 H198 V206	K147-F200 PolarHBondContact O-N 3.16Å; L149-F200 HydrophobicContact CB-CE2 4.01Å; L149-F200 HydrophobicContact CB-CZ 4.17Å; I170-F200 HydrophobicContact CB-CE2 4.27Å; I170-F200 HydrophobicContact CG2-CE2 4.06Å; I170-F200 HydrophobicContact CG2-CZ 4.26Å; M171-F200 HydrophobicContact CB-CD2 4.41Å; M171-F200 HydrophobicContact CE-CB 3.84Å; L181-F200 HydrophobicContact CD2-CB 3.6Å; L181-F200 HydrophobicContact CD2-CD1 3.23Å; L181-F200 HydrophobicContact CD2-CD2 3.68Å; L181-F200 HydrophobicContact CD2-CE1 3.72Å; L181-F200 HydrophobicContact CD2-CE2 4.11Å; L181-F200 HydrophobicContact CD2-CG 3.2Å; L181-F200 HydrophobicContact CD2-CZ 4.13Å; D185-F200 HydrophobicContact CB-CD1 4.15Å; D185-F200 HydrophobicContact CB-CE1 4.13Å; V189-F200 HydrophobicContact CG2-CE1 4.06Å; V189-F200 HydrophobicContact CG2-CZ 3.69Å; V194-F200 HydrophobicContact CG1-CE1 4.41Å; V194-F200 HydrophobicContact CG1-CZ 4.26Å; H198-F200 AromaticContact CD2-CD1 3.75Å; H198-F200 AromaticContact CD2-CE1 3.74Å; H198-F200 AromaticContact NE2-CD1 3.93Å; F200-V206 HydrophobicContact CD1-CG2 4.29Å; F200-V206 HydrophobicContact CE1-CG2 4.07Å
201	S	82.9	Confident	90.1	Very high	41 Å²	41	63.5 Å²	63.5	29%	0.287	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-142.5	132.4	175	-167.7	0	0	0	0	109.5	D203 Q204	S201-D203 PolarHBondContact O-N 3.27Å; S201-Q204 CarbonylContact O-C 3.25Å; S201-Q204 VanDerWaalsContact O-C 3.25Å; S201-Q204 PolarHBondContact O-N 3.45Å; S201-Q204 VanDerWaalsContact O-N 3.08Å
202	P	76	Confident	89.9	Confident	63 Å²	63	62 Å²	62	41%	0.409	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.2	174.7	-25	34.6	0	0	0	113	Q204	P202-Q204 VanDerWaalsContact C-N 3.26Å; P202-Q204 PolarHBondContact O-N 3.36Å
203	D	80.4	Confident	89.8	Confident	143 Å²	143	64 Å²	64	77%	0.765	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-15	-178.7	-50.7	-50.8	0	0	0	113.6	S201	S201-D203 PolarHBondContact O-N 3.27Å
204	Q	82.9	Confident	89.8	Confident	149 Å²	149	64.8 Å²	64.8	70%	0.696	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-137	76.7	-178.5	-66.1	-177.3	-5.7	0	0	109.6	S201 P202	S201-Q204 CarbonylContact O-C 3.25Å; S201-Q204 VanDerWaalsContact O-C 3.25Å; S201-Q204 PolarHBondContact O-N 3.45Å; S201-Q204 VanDerWaalsContact O-N 3.08Å; P202-Q204 VanDerWaalsContact C-N 3.26Å; P202-Q204 PolarHBondContact O-N 3.36Å
205	P	85.6	Confident	89.7	Confident	67 Å²	67	72.2 Å²	72.2	44%	0.435	41%	0.411	S	S	.	.			trans	-57.2	151.7	172	-21.5	33.1	0	0	0	111.1	D185 G207	D185-P205 WeakPolarHBondContact OD1-CA 3.41Å; P205-G207 PolarHBondContact O-N 3.27Å
206	V	91.1	Very high	89.8	Confident	4 Å²	4	77 Å²	77	2%	0.024	44%	0.44	C	S	.	.			trans	-58.5	133.6	176.2	173.6	0	0	0	0	109.5	H184 D185 V194 F200 Y213	H184-V206 PolarHBondContact CE1-O 3.42Å; H184-V206 PolarHBondContact ND1-O 3.02Å; H184-V206 VanDerWaalsContact ND1-O 3.08Å; D185-V206 HydrophobicContact CB-CG2 4.28Å; D185-V206 WeakPolarHBondContact OD1-CB 3.37Å; D185-V206 WeakPolarHBondContact OD1-CG2 3.34Å; D185-V206 PolarHBondContact OD1-N 2.7Å; V194-V206 HydrophobicContact CG2-CB 4.36Å; V194-V206 HydrophobicContact CG2-CG1 3.71Å; V194-V206 HydrophobicContact CG2-CG2 3.84Å; F200-V206 HydrophobicContact CD1-CG2 4.29Å; F200-V206 HydrophobicContact CE1-CG2 4.07Å; V206-Y213 HydrophobicContact CG1-CD2 4.03Å; V206-Y213 HydrophobicContact CG1-CE2 3.89Å
207	G	91.1	Very high	89.9	Confident	24 Å²	24	72.7 Å²	72.7	25%	0.247	42%	0.421	C	S	.	.			trans	-159.3	-177.9	176.5	0	0	0	0	0	111.6	P205 E209 T210 Y213	P205-G207 PolarHBondContact O-N 3.27Å; G207-E209 PolarHBondContact O-N 3.04Å; G207-E209 VanDerWaalsContact O-N 3.15Å; G207-T210 PolarHBondContact N-OG1 2.88Å; G207-T210 WeakPolarHBondContact O-CB 3.5Å; G207-T210 PolarHBondContact O-N 3.23Å; G207-T210 PolarHBondContact O-OG1 3.47Å; G207-T210 VanDerWaalsContact O-OG1 3.08Å; G207-Y213 WeakPolarHBondContact O-CD2 3.28Å
208	T	91.3	Very high	90.1	Very high	88 Å²	88	73.5 Å²	73.5	54%	0.54	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.2	-178.8	51.2	0	0	0	0	113.8	T210 Y213	T208-T210 VanDerWaalsContact C-N 3.29Å; T208-Y213 HydrophobicContact CG2-CD1 4.5Å; T208-Y213 HydrophobicContact CG2-CE1 4.1Å
209	E	90.6	Very high	90.2	Very high	176 Å²	176	72.9 Å²	72.9	82%	0.822	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-7	175.9	-54.7	-49	129	0	0	113.1	G207 A211	G207-E209 PolarHBondContact O-N 3.04Å; G207-E209 VanDerWaalsContact O-N 3.15Å; E209-A211 PolarHBondContact O-N 3.05Å
210	T	92.1	Very high	90.3	Very high	22 Å²	22	73.9 Å²	73.9	14%	0.135	42%	0.419	C	S	.	.	S	Bend	trans	-62.9	127.1	175.2	-64	0	0	0	0	109.7	H198 G207 T208 G212 Y213	H198-T210 WeakPolarHBondContact CE1-CG2 3.4Å; H198-T210 WeakPolarHBondContact ND1-CG2 3.47Å; G207-T210 PolarHBondContact N-OG1 2.88Å; G207-T210 WeakPolarHBondContact O-CB 3.5Å; G207-T210 PolarHBondContact O-N 3.23Å; G207-T210 PolarHBondContact O-OG1 3.47Å; G207-T210 VanDerWaalsContact O-OG1 3.08Å; T208-T210 VanDerWaalsContact C-N 3.29Å; T210-G212 PolarHBondContact O-N 2.87Å; T210-G212 VanDerWaalsContact O-N 3.16Å; T210-Y213 WeakPolarHBondContact O-CB 3.45Å; T210-Y213 PolarHBondContact O-N 3.33Å
211	A	92.3	Very high	90.6	Very high	91 Å²	91	75.5 Å²	75.5	75%	0.752	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	122.6	177.7	0	0	0	0	0	110.9	P195 E209	P195-A211 WeakPolarHBondContact CG-O 3.48Å; E209-A211 PolarHBondContact O-N 3.05Å
212	G	92.3	Very high	91.3	Very high	56 Å²	56	78.3 Å²	78.3	58%	0.577	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	10.5	-177.6	0	0	0	0	0	115.2	P195 T210 V214	P195-G212 WeakPolarHBondContact CB-O 3.36Å; P195-G212 WeakPolarHBondContact CG-O 3.03Å; T210-G212 PolarHBondContact O-N 2.87Å; T210-G212 VanDerWaalsContact O-N 3.16Å; G212-V214 PolarHBondContact O-N 2.87Å
213	Y	95.9	Very high	92.3	Very high	45 Å²	45	75.4 Å²	75.4	18%	0.176	41%	0.414	C	S	.	.			trans	-54.3	126.8	177	-175.2	-92.3	0	0	0	111.9	H193 V206 G207 T208 T210 K215	H193-Y213 HydrophobicContact CB-CD2 4.14Å; H193-Y213 HydrophobicContact CB-CE1 4.37Å; H193-Y213 HydrophobicContact CB-CE2 3.48Å; H193-Y213 VanDerWaalsContact CB-CE2 3.48Å; H193-Y213 AromaticContact CG-CZ 3.7Å; H193-Y213 AromaticContact ND1-CE1 3.97Å; H193-Y213 AromaticContact ND1-CZ 3.72Å; H193-Y213 PolarHBondContact ND1-OH 2.96Å; V206-Y213 HydrophobicContact CG1-CD2 4.03Å; V206-Y213 HydrophobicContact CG1-CE2 3.89Å; G207-Y213 WeakPolarHBondContact O-CD2 3.28Å; T208-Y213 HydrophobicContact CG2-CD1 4.5Å; T208-Y213 HydrophobicContact CG2-CE1 4.1Å; T210-Y213 WeakPolarHBondContact O-CB 3.45Å; T210-Y213 PolarHBondContact O-N 3.33Å; Y213-K215 HydrophobicContact CD1-CG 4.13Å; Y213-K215 HydrophobicContact CE1-CG 4.5Å; Y213-K215 PolarHBondContact O-N 3.46Å
214	V	96.4	Very high	93.1	Very high	49 Å²	49	68.6 Å²	68.6	30%	0.297	38%	0.377	S	S	.	.			trans	-85.9	100.9	179.7	-174.9	0	0	0	0	108.5	H193 G212 T216 P217	H193-V214 PolarHBondContact ND1-O 3.23Å; H193-V214 PolarHBondContact O-N 3.4Å; G212-V214 PolarHBondContact O-N 2.87Å; V214-T216 PolarHBondContact O-N 3.36Å; V214-P217 HydrophobicContact CG1-CB 4.08Å
215	K	95.1	Very high	93.9	Very high	163 Å²	163	61.5 Å²	61.5	71%	0.709	34%	0.344	S	S	*	.	S	Bend	trans	-61.1	-43.2	-176.1	-67.9	-177	178.9	-179	0	113.2	Y213	Y213-K215 HydrophobicContact CD1-CG 4.13Å; Y213-K215 HydrophobicContact CE1-CG 4.5Å; Y213-K215 PolarHBondContact O-N 3.46Å
216	T	95.6	Very high	94.5	Very high	129 Å²	129	58.3 Å²	58.3	79%	0.791	32%	0.323	S	S	*	.	S	Bend	trans	-127.6	83	-177.3	49.6	0	0	0	0	109.5	V214	V214-T216 PolarHBondContact O-N 3.36Å
217	P	95.4	Very high	94.8	Very high	16 Å²	16	58.1 Å²	58.1	10%	0.104	32%	0.322	C	S	.	.			trans	-70	132.7	-178.5	26.9	-32.8	0	0	0	111	K191 G192 H193 V214 D221	K191-P217 VanDerWaalsContact O-CB 3.26Å; K191-P217 WeakPolarHBondContact O-CB 3.39Å; K191-P217 WeakPolarHBondContact O-CG 3.35Å; G192-P217 WeakPolarHBondContact O-CB 3.29Å; H193-P217 WeakPolarHBondContact CE1-CD 3.48Å; H193-P217 WeakPolarHBondContact ND1-CD 3.5Å; V214-P217 HydrophobicContact CG1-CB 4.08Å; P217-D221 HydrophobicContact CB-CB 4.02Å
218	S	94.4	Very high	95.2	Very high	49 Å²	49	57 Å²	57	34%	0.343	31%	0.311	S	S	.	.			trans	-78.7	170	171.6	67.6	0	0	0	0	110.6	R220 D221	S218-R220 VanDerWaalsContact C-N 3.28Å; S218-R220 PolarHBondContact O-N 3.19Å; S218-R220 WeakPolarHBondContact OG-CG 3.4Å; S218-D221 WeakPolarHBondContact CB-OD2 3.15Å; S218-D221 PolarHBondContact N-OD2 3.33Å; S218-D221 WeakPolarHBondContact O-CB 3.42Å; S218-D221 PolarHBondContact O-N 3.06Å; S218-D221 PolarHBondContact OG-OD2 3.19Å
219	L	94	Very high	95.4	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.094	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-57.5	-40.8	-178.3	-172.4	62.6	0	0	0	112.5	V101 D221 R222 H224 F339 F340 Y343	V101-L219 HydrophobicContact CG2-CB 4Å; V101-L219 HydrophobicContact CG2-CD2 3.55Å; V101-L219 HydrophobicContact CG2-CG 3.65Å; L219-D221 PolarHBondContact O-N 2.89Å; L219-D221 VanDerWaalsContact O-N 3.16Å; L219-R222 WeakPolarHBondContact O-CB 3.41Å; L219-R222 PolarHBondContact O-N 3.16Å; L219-H224 PolarHBondContact O-NE2 3.29Å; L219-F339 HydrophobicContact CD1-CE1 4.01Å; L219-F339 HydrophobicContact CD1-CZ 4.05Å; L219-F340 HydrophobicContact CD2-CE1 4.48Å; L219-Y343 HydrophobicContact CD1-CD1 4.24Å; L219-Y343 HydrophobicContact CD1-CD2 3.89Å; L219-Y343 HydrophobicContact CD1-CE1 3.98Å; L219-Y343 HydrophobicContact CD1-CE2 3.57Å; L219-Y343 HydrophobicContact CD1-CG 4.21Å; L219-Y343 HydrophobicContact CD2-CD1 3.47Å; L219-Y343 VanDerWaalsContact CD2-CD1 3.47Å; L219-Y343 HydrophobicContact CD2-CE1 3.27Å; L219-Y343 HydrophobicContact CD2-CE2 4.43Å; L219-Y343 HydrophobicContact CD2-CG 4.17Å; L219-Y343 HydrophobicContact CG-CD1 4.49Å; L219-Y343 HydrophobicContact CG-CE1 4.15Å
220	R	93.8	Very high	95.7	Very high	149 Å²	149	44.4 Å²	44.4	56%	0.562	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-61.6	-22.9	177.6	62.1	166.5	-162.3	-164.6	2.7	113.9	V101 R105 S218	V101-R220 HydrophobicContact CG2-CB 4.47Å; R105-R220 VanDerWaalsContact CD-O 3.27Å; R105-R220 WeakPolarHBondContact CD-O 3.22Å; S218-R220 VanDerWaalsContact C-N 3.28Å; S218-R220 PolarHBondContact O-N 3.19Å; S218-R220 WeakPolarHBondContact OG-CG 3.4Å
221	D	94.2	Very high	96	Very high	44 Å²	44	43.3 Å²	43.3	24%	0.235	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-83.4	-18.4	-179.8	-51.9	-46.1	0	0	0	111.1	R105 G192 P217 S218 L219	R105-D221 PolarHBondContact NH1-O 3.2Å; G192-D221 WeakPolarHBondContact CA-O 3.29Å; P217-D221 HydrophobicContact CB-CB 4.02Å; S218-D221 WeakPolarHBondContact CB-OD2 3.15Å; S218-D221 PolarHBondContact N-OD2 3.33Å; S218-D221 WeakPolarHBondContact O-CB 3.42Å; S218-D221 PolarHBondContact O-N 3.06Å; S218-D221 PolarHBondContact OG-OD2 3.19Å; L219-D221 PolarHBondContact O-N 2.89Å; L219-D221 VanDerWaalsContact O-N 3.16Å
222	R	96.4	Very high	96.2	Very high	100 Å²	100	39.2 Å²	39.2	38%	0.377	21%	0.205	S	C	.	.	S	Bend	trans	-79.5	162.6	-176.9	-59.1	-173.4	-176.6	-168.5	0.9	112.5	K191 L219 H224	K191-R222 WeakPolarHBondContact O-CG 3.32Å; L219-R222 WeakPolarHBondContact O-CB 3.41Å; L219-R222 PolarHBondContact O-N 3.16Å; R222-H224 PolarHBondContact O-CE1 2.66Å; R222-H224 PolarHBondContact O-ND1 3.23Å; R222-H224 VanDerWaalsContact O-ND1 3.15Å
223	I	98	Very high	96.3	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.194	C	C	.	.			trans	-84.9	134.2	166.6	-62.6	-58.7	0	0	0	108.9	R105 L107 C168 V189 I190 C225 V226	R105-I223 HydrophobicContact CB-CD1 3.97Å; L107-I223 HydrophobicContact CB-CB 4.44Å; L107-I223 HydrophobicContact CB-CD1 3.95Å; L107-I223 HydrophobicContact CB-CG1 3.97Å; L107-I223 HydrophobicContact CB-CG2 3.64Å; C168-I223 HydrophobicContact CB-CD1 4.28Å; V189-I223 HydrophobicContact CG1-CG1 4.44Å; I190-I223 HydrophobicContact CB-CB 4.4Å; I190-I223 HydrophobicContact CG1-CB 4.41Å; I190-I223 HydrophobicContact CG1-CG1 4.41Å; I190-I223 HydrophobicContact CG2-CB 4.25Å; I190-I223 PolarHBondContact O-N 3.27Å; I223-C225 WeakPolarHBondContact CG2-O 3.44Å; I223-V226 HydrophobicContact CG2-CG2 4.04Å
224	H	97.7	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-103	-21.7	-174	-54.9	85.5	0	0	0	112	R105 L219 R222 V336 F339 F340	R105-H224 PolarHBondContact N-ND1 3.31Å; R105-H224 PolarHBondContact O-N 2.82Å; L219-H224 PolarHBondContact O-NE2 3.29Å; R222-H224 PolarHBondContact O-CE1 2.66Å; R222-H224 PolarHBondContact O-ND1 3.23Å; R222-H224 VanDerWaalsContact O-ND1 3.15Å; H224-V336 HydrophobicContact CB-CG1 4.35Å; H224-F339 HydrophobicContact CB-CD1 3.97Å; H224-F339 HydrophobicContact CB-CE1 4.3Å; H224-F339 HydrophobicContact CB-CG 4.38Å; H224-F339 AromaticContact CD2-CD1 3.73Å; H224-F339 AromaticContact CD2-CE1 3.4Å; H224-F339 WeakPolarHBondContact CD2-CE1 3.39Å; H224-F339 WeakPolarHBondContact O-CB 3.3Å; H224-F339 WeakPolarHBondContact O-CG 3.18Å; H224-F340 HydrophobicContact CB-CZ 4.33Å; H224-F340 AromaticContact CD2-CE1 3.25Å; H224-F340 WeakPolarHBondContact CD2-CE1 3.14Å; H224-F340 AromaticContact CD2-CZ 3.14Å; H224-F340 WeakPolarHBondContact CD2-CZ 3.45Å; H224-F340 AromaticContact CG-CZ 3.76Å; H224-F340 AromaticContact NE2-CE1 3.62Å; H224-F340 AromaticContact NE2-CZ 3.58Å
225	C	98.1	Very high	96	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	146.6	170.8	179.5	0	0	0	0	109.9	V106 L107 I223 H259 V336	V106-C225 CarbonylContact C-O 3.49Å; V106-C225 VanDerWaalsContact CA-O 3.28Å; V106-C225 WeakPolarHBondContact CA-O 3.21Å; V106-C225 HydrophobicContact CG1-CB 4.47Å; V106-C225 HydrophobicContact CG2-CB 4.29Å; L107-C225 PolarHBondContact N-O 3.36Å; I223-C225 WeakPolarHBondContact CG2-O 3.44Å; C225-H259 WeakPolarHBondContact CA-O 3.44Å; C225-H259 PolarHBondContact SG-O 3Å; C225-H259 VanDerWaalsContact SG-O 3.34Å; C225-V336 HydrophobicContact CB-CG2 3.52Å
226	V	98.5	Very high	95.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.3	171.3	179.4	0	0	0	0	109.4	L107 L109 I190 I223 F228 I253 V258 H259 Q260 V261	L107-V226 HydrophobicContact CB-CG2 4.4Å; L109-V226 HydrophobicContact CB-CG1 3.97Å; L109-V226 HydrophobicContact CD2-CG1 4.25Å; I190-V226 HydrophobicContact CD1-CG2 3.9Å; I190-V226 HydrophobicContact CG1-CG2 4.37Å; I223-V226 HydrophobicContact CG2-CG2 4.04Å; V226-F228 HydrophobicContact CG1-CE1 4.48Å; V226-F228 HydrophobicContact CG1-CZ 4.4Å; V226-I253 HydrophobicContact CB-CD1 4.35Å; V226-I253 HydrophobicContact CB-CG2 4.49Å; V226-I253 HydrophobicContact CG1-CD1 4.18Å; V226-I253 HydrophobicContact CG2-CD1 4.06Å; V226-I253 HydrophobicContact CG2-CG2 3.98Å; V226-V258 HydrophobicContact CG2-CG1 4.07Å; V226-H259 PolarHBondContact N-O 2.78Å; V226-Q260 HydrophobicContact CB-CG 4.39Å; V226-Q260 WeakPolarHBondContact O-CA 3.49Å; V226-V261 PolarHBondContact O-N 2.95Å
227	A	98.4	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.9	171.3	0	0	0	0	0	109.6	V106 L107 L108 L109 V261 I332	V106-A227 HydrophobicContact CG1-CB 4.18Å; L107-A227 PolarHBondContact O-N 2.87Å; L108-A227 HydrophobicContact CD2-CB 3.85Å; L109-A227 PolarHBondContact N-O 3.02Å; A227-V261 CarbonylContact C-O 3.42Å; A227-V261 WeakPolarHBondContact CA-O 3.36Å; A227-V261 HydrophobicContact CB-CG2 3.93Å; A227-I332 HydrophobicContact CB-CD1 4.26Å
228	F	98.2	Very high	95.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132	172.1	-70.2	-71.8	0	0	0	110.6	L109 V226 F246 L249 R250 I253 Q260 V261 A262 L263 L298 M300	L109-F228 HydrophobicContact CB-CD1 4.35Å; L109-F228 HydrophobicContact CD2-CD1 4.3Å; L109-F228 HydrophobicContact CD2-CE1 3.74Å; L109-F228 HydrophobicContact CG-CD1 4.39Å; L109-F228 HydrophobicContact CG-CE1 4.3Å; L109-F228 CarbonylContact O-C 3.53Å; L109-F228 WeakPolarHBondContact O-CA 3.37Å; V226-F228 HydrophobicContact CG1-CE1 4.48Å; V226-F228 HydrophobicContact CG1-CZ 4.4Å; F228-F246 AromaticContact CD1-CD1 3.75Å; F228-F246 HydrophobicContact CD1-CD1 3.75Å; F228-F246 AromaticContact CD1-CE1 3.79Å; F228-F246 HydrophobicContact CD1-CE1 3.79Å; F228-F246 AromaticContact CE1-CD1 3.75Å; F228-F246 HydrophobicContact CE1-CD1 3.75Å; F228-F246 HydrophobicContact CE1-CE1 4.18Å; F228-L249 HydrophobicContact CE1-CB 4.44Å; F228-L249 HydrophobicContact CZ-CB 4.4Å; F228-R250 HydrophobicContact CE2-CG 3.69Å; F228-R250 HydrophobicContact CZ-CG 3.8Å; F228-I253 HydrophobicContact CZ-CD1 3.92Å; F228-Q260 HydrophobicContact CE2-CB 4.12Å; F228-Q260 HydrophobicContact CE2-CG 4.28Å; F228-Q260 VanDerWaalsContact CZ-OE1 3.29Å; F228-V261 PolarHBondContact N-O 2.61Å; F228-A262 HydrophobicContact CB-CB 4.26Å; F228-A262 CarbonylContact O-C 3.53Å; F228-A262 VanDerWaalsContact O-CA 3.29Å; F228-A262 WeakPolarHBondContact O-CA 3.35Å; F228-L263 PolarHBondContact O-N 2.83Å; F228-L298 HydrophobicContact CB-CD1 4.3Å; F228-L298 HydrophobicContact CB-CD2 4.17Å; F228-L298 HydrophobicContact CG-CD2 4.31Å; F228-M300 HydrophobicContact CD2-SD 4.02Å
229	M	97	Very high	94.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.7	-178.5	-58.8	-159.5	67.8	0	0	110.4	L108 L109 P111 S114 K116 F119 L263 T265	L108-M229 HydrophobicContact CB-SD 3.92Å; L108-M229 HydrophobicContact CD1-SD 3.89Å; L108-M229 HydrophobicContact CD2-SD 4.14Å; L108-M229 HydrophobicContact CG-SD 4.21Å; L109-M229 PolarHBondContact O-N 3.41Å; P111-M229 WeakPolarHBondContact CD-O 3.42Å; S114-M229 WeakPolarHBondContact CB-O 3.28Å; S114-M229 PolarHBondContact OG-O 3.49Å; S114-M229 VanDerWaalsContact OG-O 3.14Å; K116-M229 WeakPolarHBondContact CA-SD 3.21Å; K116-M229 HydrophobicContact CB-SD 3.97Å; K116-M229 HydrophobicContact CG-CB 4.04Å; K116-M229 HydrophobicContact CG-CG 4.15Å; K116-M229 HydrophobicContact CG-SD 3.66Å; F119-M229 HydrophobicContact CB-CE 3.55Å; F119-M229 HydrophobicContact CB-SD 4.4Å; F119-M229 HydrophobicContact CD1-CE 4.4Å; F119-M229 HydrophobicContact CD2-CE 4.48Å; F119-M229 HydrophobicContact CG-CE 3.92Å; M229-L263 HydrophobicContact CE-CB 4.4Å; M229-L263 HydrophobicContact CE-CD1 4.24Å; M229-T265 HydrophobicContact CE-CG2 3.42Å; M229-T265 VanDerWaalsContact CE-CG2 3.42Å
230	V	96.8	Very high	94.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.2	179.1	-70.5	0	0	0	0	110.3	Y238 L263 L264 T265 A294 L297 L298	V230-Y238 HydrophobicContact CB-CE2 4.27Å; V230-Y238 HydrophobicContact CG1-CE2 4.22Å; V230-L263 PolarHBondContact N-O 3.16Å; V230-L264 HydrophobicContact CG2-CD1 3.75Å; V230-T265 PolarHBondContact O-N 3.02Å; V230-T265 PolarHBondContact O-OG1 2.6Å; V230-A294 HydrophobicContact CG2-CB 4.17Å; V230-L297 HydrophobicContact CG1-CD2 4.28Å; V230-L298 HydrophobicContact CG1-CD1 4.14Å; V230-L298 HydrophobicContact CG1-CD2 4.08Å; V230-L298 HydrophobicContact CG1-CG 4.3Å; V230-L298 HydrophobicContact CG2-CD1 4.27Å
231	D	96.5	Very high	93.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.7	179.6	-179	-20.8	0	0	0	109	S233 K234 I235 Y238 H266	D231-S233 PolarHBondContact O-N 3.33Å; D231-S233 WeakPolarHBondContact OD1-CB 3.27Å; D231-S233 PolarHBondContact OD1-N 3.17Å; D231-S233 PolarHBondContact OD1-OG 3.47Å; D231-S233 PolarHBondContact OD2-OG 2.94Å; D231-K234 HydrophobicContact CB-CB 4.18Å; D231-K234 PolarHBondContact O-N 2.87Å; D231-K234 VanDerWaalsContact O-N 3.14Å; D231-K234 WeakPolarHBondContact OD2-CD 3.27Å; D231-K234 VanDerWaalsContact OD2-CE 3.31Å; D231-K234 WeakPolarHBondContact OD2-CE 3.36Å; D231-K234 IonicContact OD2-NZ 2.78Å; D231-K234 PolarHBondContact OD2-NZ 3.32Å; D231-I235 PolarHBondContact O-N 3.05Å; D231-I235 VanDerWaalsContact O-N 3.14Å; D231-Y238 WeakPolarHBondContact CB-OH 3.45Å; D231-Y238 PolarHBondContact N-OH 3.22Å; D231-H266 IonicContact OD1-CG 3.94Å; D231-H266 IonicContact OD1-ND1 3.63Å; D231-H266 IonicContact OD2-ND1 2.87Å
232	A	97.1	Very high	93.5	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.033	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.2	-179.7	0	0	0	0	0	112.7	K234 L264 T265 V267 I270 T290	A232-K234 PolarHBondContact O-N 2.89Å; A232-L264 HydrophobicContact CB-CD1 3.8Å; A232-L264 HydrophobicContact CB-CD2 4.32Å; A232-L264 HydrophobicContact CB-CG 3.93Å; A232-T265 WeakPolarHBondContact CB-O 3.25Å; A232-T265 PolarHBondContact N-O 2.96Å; A232-V267 HydrophobicContact CB-CG1 4.35Å; A232-I270 HydrophobicContact CB-CD1 3.89Å; A232-I270 HydrophobicContact CB-CG1 4.15Å; A232-I270 HydrophobicContact CB-CG2 4.12Å; A232-T290 HydrophobicContact CB-CG2 3.95Å
233	S	95.3	Very high	93.2	Very high	51 Å²	51	34.1 Å²	34.1	36%	0.357	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.9	-178.2	73.6	0	0	0	0	113.1	D231 Q269	D231-S233 PolarHBondContact O-N 3.33Å; D231-S233 WeakPolarHBondContact OD1-CB 3.27Å; D231-S233 PolarHBondContact OD1-N 3.17Å; D231-S233 PolarHBondContact OD1-OG 3.47Å; D231-S233 PolarHBondContact OD2-OG 2.94Å; S233-Q269 PolarHBondContact OG-OE1 3.43Å
234	K	93.4	Very high	92.9	Very high	67 Å²	67	37.1 Å²	37.1	29%	0.291	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-0.5	-173.1	-65.9	-178.9	-165.5	131.2	0	114.5	D231 A232 S236 S237 Y238	D231-K234 HydrophobicContact CB-CB 4.18Å; D231-K234 PolarHBondContact O-N 2.87Å; D231-K234 VanDerWaalsContact O-N 3.14Å; D231-K234 WeakPolarHBondContact OD2-CD 3.27Å; D231-K234 VanDerWaalsContact OD2-CE 3.31Å; D231-K234 WeakPolarHBondContact OD2-CE 3.36Å; D231-K234 IonicContact OD2-NZ 2.78Å; D231-K234 PolarHBondContact OD2-NZ 3.32Å; A232-K234 PolarHBondContact O-N 2.89Å; K234-S236 PolarHBondContact O-N 3.29Å; K234-S237 WeakPolarHBondContact CA-OG 3.4Å; K234-S237 WeakPolarHBondContact CB-OG 3.15Å; K234-S237 WeakPolarHBondContact O-CA 3.49Å; K234-S237 PolarHBondContact O-N 3.11Å; K234-S237 PolarHBondContact O-OG 2.82Å; K234-Y238 HydrophobicContact CB-CD1 4.42Å; K234-Y238 HydrophobicContact CB-CE1 3.94Å; K234-Y238 PolarHBondContact O-N 3.15Å; K234-Y238 VanDerWaalsContact O-N 3.17Å
235	I	91.6	Very high	92.5	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.087	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-35.1	-169.9	-149.9	159.7	0	0	0	113.6	D231 Y238 L264 T290 K293 A294 L297	D231-I235 PolarHBondContact O-N 3.05Å; D231-I235 VanDerWaalsContact O-N 3.14Å; I235-Y238 HydrophobicContact CG1-CD2 4.46Å; I235-Y238 HydrophobicContact CG1-CE2 4.48Å; I235-L264 HydrophobicContact CD1-CD1 4.14Å; I235-T290 HydrophobicContact CB-CG2 4.47Å; I235-T290 HydrophobicContact CD1-CG2 4.17Å; I235-T290 HydrophobicContact CG2-CG2 3.9Å; I235-K293 HydrophobicContact CD1-CB 4.27Å; I235-K293 HydrophobicContact CG2-CB 4.08Å; I235-K293 HydrophobicContact CG2-CD 4.08Å; I235-A294 HydrophobicContact CD1-CB 3.41Å; I235-A294 VanDerWaalsContact CD1-CB 3.41Å; I235-A294 VanDerWaalsContact CD1-N 3.34Å; I235-L297 HydrophobicContact CG1-CD2 4.16Å
236	S	88.6	Confident	92.3	Very high	96 Å²	96	39.9 Å²	39.9	67%	0.671	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-14	178.2	-60.9	0	0	0	0	113.6	K234	K234-S236 PolarHBondContact O-N 3.29Å
237	S	89.3	Confident	92.1	Very high	87 Å²	87	45.1 Å²	45.1	61%	0.608	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-6.9	177.3	65.4	0	0	0	0	113.9	K234	K234-S237 WeakPolarHBondContact CA-OG 3.4Å; K234-S237 WeakPolarHBondContact CB-OG 3.15Å; K234-S237 WeakPolarHBondContact O-CA 3.49Å; K234-S237 PolarHBondContact O-N 3.11Å; K234-S237 PolarHBondContact O-OG 2.82Å
238	Y	89.4	Confident	91.9	Very high	32 Å²	32	49.6 Å²	49.6	13%	0.125	28%	0.275	C	S	.	.	S	Bend	trans	-62.1	140.9	177.6	-73.3	-28.9	0	0	0	111.6	P111 V230 D231 K234 I235 K240 F242 L297	P111-Y238 HydrophobicContact CB-CE1 4.03Å; P111-Y238 HydrophobicContact CG-CE1 3.97Å; P111-Y238 HydrophobicContact CG-CE2 4.27Å; V230-Y238 HydrophobicContact CB-CE2 4.27Å; V230-Y238 HydrophobicContact CG1-CE2 4.22Å; D231-Y238 WeakPolarHBondContact CB-OH 3.45Å; D231-Y238 PolarHBondContact N-OH 3.22Å; K234-Y238 HydrophobicContact CB-CD1 4.42Å; K234-Y238 HydrophobicContact CB-CE1 3.94Å; K234-Y238 PolarHBondContact O-N 3.15Å; K234-Y238 VanDerWaalsContact O-N 3.17Å; I235-Y238 HydrophobicContact CG1-CD2 4.46Å; I235-Y238 HydrophobicContact CG1-CE2 4.48Å; Y238-K240 PolarHBondContact O-N 2.88Å; Y238-F242 HydrophobicContact CD1-CE2 4.46Å; Y238-F242 HydrophobicContact CG-CD2 4.3Å; Y238-L297 HydrophobicContact CD2-CD2 3.51Å; Y238-L297 HydrophobicContact CE2-CD2 3.97Å
239	H	85.9	Confident	91.8	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.495	28%	0.275	S	S	.	.			trans	-55.2	139.3	174.8	-175.2	-110.8	0	0	0	110.8	D175 G241 F242	D175-H239 HydrophobicContact CB-CB 4.39Å; D175-H239 PolarHBondContact O-ND1 3.12Å; H239-G241 PolarHBondContact ND1-N 3.47Å; H239-G241 VanDerWaalsContact ND1-N 3.2Å; H239-G241 PolarHBondContact O-N 2.71Å; H239-F242 HydrophobicContact CB-CD2 3.92Å; H239-F242 HydrophobicContact CB-CE2 4.09Å; H239-F242 WeakPolarHBondContact O-CB 3.48Å; H239-F242 WeakPolarHBondContact O-CD2 3.45Å; H239-F242 PolarHBondContact O-N 3.25Å
240	K	83.7	Confident	91.7	Very high	198 Å²	198	51.5 Å²	51.5	86%	0.861	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-27.5	-176.7	-66.4	-177.4	178.8	179.5	0	112.6	Y238 F242 G243	Y238-K240 PolarHBondContact O-N 2.88Å; K240-F242 PolarHBondContact O-N 2.93Å; K240-G243 PolarHBondContact O-N 3.42Å
241	G	85.6	Confident	91.7	Very high	22 Å²	22	55.8 Å²	55.8	23%	0.227	30%	0.302	C	S	.	.	H	α-helix	trans	-68.3	-13.8	175.9	0	0	0	0	0	115.2	H239 G243 S244 T245	H239-G241 PolarHBondContact ND1-N 3.47Å; H239-G241 VanDerWaalsContact ND1-N 3.2Å; H239-G241 PolarHBondContact O-N 2.71Å; G241-G243 VanDerWaalsContact C-N 3.31Å; G241-G243 PolarHBondContact O-N 2.99Å; G241-S244 PolarHBondContact O-N 2.86Å; G241-S244 PolarHBondContact O-OG 3.49Å; G241-T245 WeakPolarHBondContact O-CB 3.4Å; G241-T245 PolarHBondContact O-N 3.41Å; G241-T245 VanDerWaalsContact O-N 3.08Å; G241-T245 PolarHBondContact O-OG1 3.4Å
242	F	88.4	Confident	91.7	Very high	11 Å²	11	60.6 Å²	60.6	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-36.6	175.3	-84.1	-65	0	0	0	112.1	P111 L173 G174 D175 Y238 H239 K240 S244 T245 F246 L297	P111-F242 HydrophobicContact CB-CE1 4.2Å; P111-F242 HydrophobicContact CB-CZ 4.02Å; P111-F242 HydrophobicContact CG-CD1 4.27Å; P111-F242 HydrophobicContact CG-CE1 3.9Å; P111-F242 HydrophobicContact CG-CZ 4.1Å; L173-F242 HydrophobicContact CB-CE1 3.86Å; G174-F242 VanDerWaalsContact O-CE1 3.27Å; G174-F242 WeakPolarHBondContact O-CE1 3.34Å; G174-F242 WeakPolarHBondContact O-CZ 3.45Å; D175-F242 HydrophobicContact CB-CE2 4.19Å; D175-F242 HydrophobicContact CB-CZ 4.35Å; Y238-F242 HydrophobicContact CD1-CE2 4.46Å; Y238-F242 HydrophobicContact CG-CD2 4.3Å; H239-F242 HydrophobicContact CB-CD2 3.92Å; H239-F242 HydrophobicContact CB-CE2 4.09Å; H239-F242 WeakPolarHBondContact O-CB 3.48Å; H239-F242 WeakPolarHBondContact O-CD2 3.45Å; H239-F242 PolarHBondContact O-N 3.25Å; K240-F242 PolarHBondContact O-N 2.93Å; F242-S244 PolarHBondContact O-N 2.97Å; F242-T245 PolarHBondContact O-N 3.09Å; F242-F246 HydrophobicContact CB-CD2 4.12Å; F242-F246 HydrophobicContact CB-CE2 3.9Å; F242-F246 HydrophobicContact CD1-CE2 4.04Å; F242-F246 HydrophobicContact CD1-CZ 4.33Å; F242-F246 HydrophobicContact CG-CE2 4.29Å; F242-F246 WeakPolarHBondContact O-CB 3.42Å; F242-F246 WeakPolarHBondContact O-CD2 3.5Å; F242-F246 WeakPolarHBondContact O-CG 3.28Å; F242-F246 PolarHBondContact O-N 3.27Å; F242-L297 HydrophobicContact CB-CD1 4.14Å
243	G	90.6	Very high	91.6	Very high	24 Å²	24	60.4 Å²	60.4	25%	0.247	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-44.6	179.4	0	0	0	0	0	112.6	K240 G241 K247	K240-G243 PolarHBondContact O-N 3.42Å; G241-G243 VanDerWaalsContact C-N 3.31Å; G241-G243 PolarHBondContact O-N 2.99Å; G243-K247 WeakPolarHBondContact O-CB 3.4Å; G243-K247 PolarHBondContact O-N 2.83Å
244	S	90.3	Very high	91.6	Very high	64 Å²	64	61.4 Å²	61.4	45%	0.448	33%	0.326	S	S	.	.	H	α-helix	trans	-68.8	-39.8	175.7	53.4	0	0	0	0	112.2	G241 F242 K247 Q248	G241-S244 PolarHBondContact O-N 2.86Å; G241-S244 PolarHBondContact O-OG 3.49Å; F242-S244 PolarHBondContact O-N 2.97Å; S244-K247 WeakPolarHBondContact O-CB 3.45Å; S244-K247 PolarHBondContact O-N 3.04Å; S244-Q248 WeakPolarHBondContact O-CG 3.33Å; S244-Q248 PolarHBondContact O-N 3.34Å
245	T	90.5	Very high	91.7	Very high	57 Å²	57	65.2 Å²	65.2	35%	0.35	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-48.8	177.1	-56.8	0	0	0	0	111.4	G241 F242 K247 Q248 L249	G241-T245 WeakPolarHBondContact O-CB 3.4Å; G241-T245 PolarHBondContact O-N 3.41Å; G241-T245 VanDerWaalsContact O-N 3.08Å; G241-T245 PolarHBondContact O-OG1 3.4Å; F242-T245 PolarHBondContact O-N 3.09Å; T245-K247 VanDerWaalsContact C-N 3.31Å; T245-K247 PolarHBondContact O-N 3.46Å; T245-Q248 PolarHBondContact O-N 2.92Å; T245-L249 HydrophobicContact CG2-CD1 4.04Å; T245-L249 WeakPolarHBondContact O-CB 3.38Å; T245-L249 WeakPolarHBondContact O-CG 3.4Å; T245-L249 PolarHBondContact O-N 2.89Å
246	F	93.7	Very high	91.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.7	-39.2	175.4	-72.8	-56.6	0	0	0	111.6	P111 L173 F228 F242 L249 R250 L297 L298	P111-F246 HydrophobicContact CG-CZ 4.17Å; L173-F246 HydrophobicContact CD1-CD1 4.32Å; L173-F246 HydrophobicContact CD1-CE1 3.58Å; L173-F246 HydrophobicContact CD1-CZ 4Å; F228-F246 AromaticContact CD1-CD1 3.75Å; F228-F246 HydrophobicContact CD1-CD1 3.75Å; F228-F246 AromaticContact CD1-CE1 3.79Å; F228-F246 HydrophobicContact CD1-CE1 3.79Å; F228-F246 AromaticContact CE1-CD1 3.75Å; F228-F246 HydrophobicContact CE1-CD1 3.75Å; F228-F246 HydrophobicContact CE1-CE1 4.18Å; F242-F246 HydrophobicContact CB-CD2 4.12Å; F242-F246 HydrophobicContact CB-CE2 3.9Å; F242-F246 HydrophobicContact CD1-CE2 4.04Å; F242-F246 HydrophobicContact CD1-CZ 4.33Å; F242-F246 HydrophobicContact CG-CE2 4.29Å; F242-F246 WeakPolarHBondContact O-CB 3.42Å; F242-F246 WeakPolarHBondContact O-CD2 3.5Å; F242-F246 WeakPolarHBondContact O-CG 3.28Å; F242-F246 PolarHBondContact O-N 3.27Å; F246-L249 HydrophobicContact CD1-CD1 4.46Å; F246-L249 PolarHBondContact O-N 2.81Å; F246-R250 WeakPolarHBondContact O-CB 3.31Å; F246-R250 WeakPolarHBondContact O-CG 3.09Å; F246-R250 PolarHBondContact O-N 3.03Å; F246-R250 PolarHBondContact O-NH1 2.74Å; F246-L297 HydrophobicContact CD2-CD1 4.44Å; F246-L297 HydrophobicContact CD2-CG 4.17Å; F246-L297 HydrophobicContact CE2-CD2 4.21Å; F246-L297 HydrophobicContact CE2-CG 4.27Å; F246-L298 HydrophobicContact CB-CD2 4.24Å; F246-L298 HydrophobicContact CD1-CD2 3.74Å; F246-L298 HydrophobicContact CD2-CD2 3.71Å; F246-L298 HydrophobicContact CE1-CD2 3.94Å; F246-L298 HydrophobicContact CE2-CD2 3.91Å; F246-L298 HydrophobicContact CG-CD2 3.64Å; F246-L298 HydrophobicContact CZ-CD2 4.02Å
247	K	94.1	Very high	92.2	Very high	111 Å²	111	64.9 Å²	64.9	48%	0.483	35%	0.345	S	S	.	.	H	α-helix	trans	-58.5	-52.4	176.9	-176.3	-179.2	171	-175.6	0	111.5	G243 S244 T245 L249 R250 E251	G243-K247 WeakPolarHBondContact O-CB 3.4Å; G243-K247 PolarHBondContact O-N 2.83Å; S244-K247 WeakPolarHBondContact O-CB 3.45Å; S244-K247 PolarHBondContact O-N 3.04Å; T245-K247 VanDerWaalsContact C-N 3.31Å; T245-K247 PolarHBondContact O-N 3.46Å; K247-L249 VanDerWaalsContact C-N 3.35Å; K247-L249 PolarHBondContact O-N 3.38Å; K247-R250 VanDerWaalsContact N-NH1 3.14Å; K247-R250 PolarHBondContact O-N 3.28Å; K247-E251 WeakPolarHBondContact CE-OE1 3.33Å; K247-E251 IonicContact NZ-OE1 3.97Å; K247-E251 WeakPolarHBondContact O-CG 3.45Å; K247-E251 PolarHBondContact O-N 2.95Å
248	Q	93.9	Very high	92.6	Very high	93 Å²	93	61.2 Å²	61.2	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-59.8	-46.3	177.9	-69.8	175.9	39.5	0	0	111.3	S244 T245 R250 E251 Y252	S244-Q248 WeakPolarHBondContact O-CG 3.33Å; S244-Q248 PolarHBondContact O-N 3.34Å; T245-Q248 PolarHBondContact O-N 2.92Å; Q248-R250 VanDerWaalsContact C-N 3.33Å; Q248-R250 PolarHBondContact O-N 2.67Å; Q248-E251 PolarHBondContact O-N 3.08Å; Q248-Y252 WeakPolarHBondContact O-CD2 3.36Å; Q248-Y252 PolarHBondContact O-N 2.93Å
249	L	95.1	Very high	92.9	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-55.4	-48.7	176.1	-78.8	164.6	0	0	0	111.5	L109 L173 L183 I186 F228 T245 F246 K247 E251 Y252 I253	L109-L249 HydrophobicContact CD2-CD1 3.95Å; L109-L249 HydrophobicContact CD2-CD2 4.17Å; L173-L249 HydrophobicContact CD1-CD1 4.17Å; L173-L249 HydrophobicContact CD2-CD1 4.46Å; L183-L249 HydrophobicContact CD1-CD2 3.39Å; L183-L249 HydrophobicContact CD1-CG 3.94Å; I186-L249 HydrophobicContact CB-CD2 4.2Å; I186-L249 HydrophobicContact CD1-CD1 4.39Å; I186-L249 HydrophobicContact CD1-CD2 3.86Å; I186-L249 HydrophobicContact CG2-CD2 3.74Å; F228-L249 HydrophobicContact CE1-CB 4.44Å; F228-L249 HydrophobicContact CZ-CB 4.4Å; T245-L249 HydrophobicContact CG2-CD1 4.04Å; T245-L249 WeakPolarHBondContact O-CB 3.38Å; T245-L249 WeakPolarHBondContact O-CG 3.4Å; T245-L249 PolarHBondContact O-N 2.89Å; F246-L249 HydrophobicContact CD1-CD1 4.46Å; F246-L249 PolarHBondContact O-N 2.81Å; K247-L249 VanDerWaalsContact C-N 3.35Å; K247-L249 PolarHBondContact O-N 3.38Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.47Å; L249-Y252 PolarHBondContact O-N 2.84Å; L249-I253 HydrophobicContact CB-CD1 4.24Å; L249-I253 WeakPolarHBondContact O-CB 3.49Å; L249-I253 WeakPolarHBondContact O-CD1 3.45Å; L249-I253 WeakPolarHBondContact O-CG1 3.32Å; L249-I253 PolarHBondContact O-N 2.86Å
250	R	96.1	Very high	93.4	Very high	39 Å²	39	58 Å²	58	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-41	-179.5	-73.7	-165.8	-42	-67.7	1.1	113	F228 F246 K247 Q248 S254 Q260 L298 G299	F228-R250 HydrophobicContact CE2-CG 3.69Å; F228-R250 HydrophobicContact CZ-CG 3.8Å; F246-R250 WeakPolarHBondContact O-CB 3.31Å; F246-R250 WeakPolarHBondContact O-CG 3.09Å; F246-R250 PolarHBondContact O-N 3.03Å; F246-R250 PolarHBondContact O-NH1 2.74Å; K247-R250 VanDerWaalsContact N-NH1 3.14Å; K247-R250 PolarHBondContact O-N 3.28Å; Q248-R250 VanDerWaalsContact C-N 3.33Å; Q248-R250 PolarHBondContact O-N 2.67Å; R250-S254 WeakPolarHBondContact O-CB 3.45Å; R250-S254 PolarHBondContact O-N 3.36Å; R250-S254 PolarHBondContact O-OG 2.97Å; R250-Q260 VanDerWaalsContact CA-OE1 3.32Å; R250-Q260 PolarHBondContact O-NE2 3.33Å; R250-Q260 VanDerWaalsContact O-NE2 3.08Å; R250-L298 VanDerWaalsContact CD-O 3.22Å; R250-L298 WeakPolarHBondContact CD-O 3.37Å; R250-L298 PolarHBondContact NE-O 3.16Å; R250-L298 VanDerWaalsContact NH1-C 3.34Å; R250-L298 PolarHBondContact NH1-O 2.92Å; R250-L298 PolarHBondContact NH2-O 2.88Å; R250-G299 PolarHBondContact NE-O 3.18Å
251	E	96	Very high	94	Very high	91 Å²	91	48.6 Å²	48.6	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-59.6	-54.5	177.4	-72.5	166.5	176.7	0	0	110	K247 Q248 L249 I253 S254 E255	K247-E251 WeakPolarHBondContact CE-OE1 3.33Å; K247-E251 IonicContact NZ-OE1 3.97Å; K247-E251 WeakPolarHBondContact O-CG 3.45Å; K247-E251 PolarHBondContact O-N 2.95Å; Q248-E251 PolarHBondContact O-N 3.08Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.47Å; E251-I253 PolarHBondContact O-N 3.26Å; E251-S254 WeakPolarHBondContact O-CB 3.29Å; E251-S254 PolarHBondContact O-N 3.16Å; E251-E255 WeakPolarHBondContact O-CG 3.13Å; E251-E255 PolarHBondContact O-N 2.82Å
252	Y	96.3	Very high	94.6	Very high	100 Å²	100	47.5 Å²	47.5	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-38.8	178.5	-74.7	-67.8	0	0	0	113.8	L183 L187 Q248 L249 S254 E255 L256	L183-Y252 HydrophobicContact CD1-CD2 4.26Å; L183-Y252 HydrophobicContact CD2-CD2 3.87Å; L183-Y252 HydrophobicContact CD2-CE2 3.61Å; L183-Y252 HydrophobicContact CG-CD2 4.49Å; L187-Y252 HydrophobicContact CD1-CD1 4.2Å; L187-Y252 HydrophobicContact CD1-CD2 4.35Å; L187-Y252 HydrophobicContact CD1-CG 3.98Å; L187-Y252 HydrophobicContact CD2-CG 4.39Å; Q248-Y252 WeakPolarHBondContact O-CD2 3.36Å; Q248-Y252 PolarHBondContact O-N 2.93Å; L249-Y252 PolarHBondContact O-N 2.84Å; Y252-S254 VanDerWaalsContact C-N 3.29Å; Y252-S254 PolarHBondContact O-N 3.32Å; Y252-E255 WeakPolarHBondContact CD1-OE2 3.44Å; Y252-E255 PolarHBondContact O-N 3.46Å; Y252-L256 VanDerWaalsContact O-CG 3.31Å; Y252-L256 WeakPolarHBondContact O-CG 3.5Å; Y252-L256 PolarHBondContact O-N 3.38Å; Y252-L256 VanDerWaalsContact O-N 3.09Å
253	I	96.7	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-38.1	178	-65.9	165.5	0	0	0	110.3	I190 V226 F228 L249 E251 L256 G257 V258 Q260	I190-I253 HydrophobicContact CD1-CD1 3.92Å; I190-I253 HydrophobicContact CD1-CG1 3.62Å; V226-I253 HydrophobicContact CB-CD1 4.35Å; V226-I253 HydrophobicContact CB-CG2 4.49Å; V226-I253 HydrophobicContact CG1-CD1 4.18Å; V226-I253 HydrophobicContact CG2-CD1 4.06Å; V226-I253 HydrophobicContact CG2-CG2 3.98Å; F228-I253 HydrophobicContact CZ-CD1 3.92Å; L249-I253 HydrophobicContact CB-CD1 4.24Å; L249-I253 WeakPolarHBondContact O-CB 3.49Å; L249-I253 WeakPolarHBondContact O-CD1 3.45Å; L249-I253 WeakPolarHBondContact O-CG1 3.32Å; L249-I253 PolarHBondContact O-N 2.86Å; E251-I253 PolarHBondContact O-N 3.26Å; I253-L256 PolarHBondContact O-N 3.47Å; I253-G257 PolarHBondContact O-N 3.36Å; I253-V258 HydrophobicContact CG2-CB 3.73Å; I253-V258 HydrophobicContact CG2-CG1 3.88Å; I253-V258 WeakPolarHBondContact CG2-O 3.38Å; I253-V258 PolarHBondContact O-N 3.44Å; I253-V258 VanDerWaalsContact O-N 3.09Å; I253-Q260 HydrophobicContact CB-CG 4.23Å; I253-Q260 VanDerWaalsContact CD1-OE1 3.29Å; I253-Q260 HydrophobicContact CG2-CG 3.44Å; I253-Q260 VanDerWaalsContact CG2-CG 3.44Å
254	S	95.5	Very high	95.5	Very high	72 Å²	72	45.9 Å²	45.9	50%	0.503	24%	0.24	S	C	.	.	H	α-helix	trans	-68.3	-38.7	175.4	-53.2	0	0	0	0	111.9	R250 E251 Y252 L256 G257 Q260	R250-S254 WeakPolarHBondContact O-CB 3.45Å; R250-S254 PolarHBondContact O-N 3.36Å; R250-S254 PolarHBondContact O-OG 2.97Å; E251-S254 WeakPolarHBondContact O-CB 3.29Å; E251-S254 PolarHBondContact O-N 3.16Å; Y252-S254 VanDerWaalsContact C-N 3.29Å; Y252-S254 PolarHBondContact O-N 3.32Å; S254-L256 PolarHBondContact O-N 2.71Å; S254-G257 WeakPolarHBondContact O-CA 3.34Å; S254-G257 PolarHBondContact O-N 2.96Å; S254-Q260 PolarHBondContact OG-NE2 3.39Å; S254-Q260 VanDerWaalsContact OG-NE2 3.16Å
255	E	95.4	Very high	95.9	Very high	147 Å²	147	42.9 Å²	42.9	69%	0.687	22%	0.218	S	C	*	.	H	α-helix	trans	-61.4	-30.3	173.3	-72.5	174.2	-176.9	0	0	112.6	E251 Y252 G257	E251-E255 WeakPolarHBondContact O-CG 3.13Å; E251-E255 PolarHBondContact O-N 2.82Å; Y252-E255 WeakPolarHBondContact CD1-OE2 3.44Å; Y252-E255 PolarHBondContact O-N 3.46Å; E255-G257 PolarHBondContact O-N 3.24Å
256	L	95.1	Very high	96.1	Very high	67 Å²	67	41.8 Å²	41.8	35%	0.351	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.2	173.2	-64.3	173.6	0	0	0	113.2	L187 I190 K191 Y252 I253 S254 V258	L187-L256 HydrophobicContact CD2-CD1 4.22Å; I190-L256 HydrophobicContact CB-CD1 4.45Å; I190-L256 HydrophobicContact CG2-CD1 3.74Å; K191-L256 HydrophobicContact CG-CD1 4.23Å; K191-L256 HydrophobicContact CG-CD2 4.27Å; Y252-L256 VanDerWaalsContact O-CG 3.31Å; Y252-L256 WeakPolarHBondContact O-CG 3.5Å; Y252-L256 PolarHBondContact O-N 3.38Å; Y252-L256 VanDerWaalsContact O-N 3.09Å; I253-L256 PolarHBondContact O-N 3.47Å; S254-L256 PolarHBondContact O-N 2.71Å; L256-V258 HydrophobicContact CB-CG2 4.19Å; L256-V258 PolarHBondContact O-N 2.93Å
257	G	94.9	Very high	96.3	Very high	40 Å²	40	41.8 Å²	41.8	41%	0.412	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	17.8	-176.6	0	0	0	0	0	113.6	I253 S254 E255 F339	I253-G257 PolarHBondContact O-N 3.36Å; S254-G257 WeakPolarHBondContact O-CA 3.34Å; S254-G257 PolarHBondContact O-N 2.96Å; E255-G257 PolarHBondContact O-N 3.24Å; G257-F339 VanDerWaalsContact O-CD2 3.31Å; G257-F339 WeakPolarHBondContact O-CD2 3.18Å
258	V	97.1	Very high	96.3	Very high	9 Å²	9	38.3 Å²	38.3	6%	0.055	20%	0.196	C	C	.	.			trans	-93.4	128.7	-177.5	176	0	0	0	0	109.9	I190 V226 I253 L256 F339	I190-V258 HydrophobicContact CG2-CG2 4.19Å; V226-V258 HydrophobicContact CG2-CG1 4.07Å; I253-V258 HydrophobicContact CG2-CB 3.73Å; I253-V258 HydrophobicContact CG2-CG1 3.88Å; I253-V258 WeakPolarHBondContact CG2-O 3.38Å; I253-V258 PolarHBondContact O-N 3.44Å; I253-V258 VanDerWaalsContact O-N 3.09Å; L256-V258 HydrophobicContact CB-CG2 4.19Å; L256-V258 PolarHBondContact O-N 2.93Å; V258-F339 HydrophobicContact CG2-CD2 4.32Å; V258-F339 HydrophobicContact CG2-CE2 3.89Å
259	H	95.6	Very high	96.4	Very high	51 Å²	51	39.3 Å²	39.3	24%	0.236	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	151.9	179.7	-71.7	-69.6	0	0	0	112.5	C225 V226 Y335 I338 F339 D342	C225-H259 WeakPolarHBondContact CA-O 3.44Å; C225-H259 PolarHBondContact SG-O 3Å; C225-H259 VanDerWaalsContact SG-O 3.34Å; V226-H259 PolarHBondContact N-O 2.78Å; H259-Y335 HydrophobicContact CB-CD1 3.83Å; H259-Y335 HydrophobicContact CB-CG 4.32Å; H259-I338 WeakPolarHBondContact NE2-CG2 3.28Å; H259-F339 PolarHBondContact CD2-N 3.38Å; H259-D342 IonicContact CE1-OD2 3.89Å; H259-D342 IonicContact NE2-OD2 3.79Å; H259-D342 PolarHBondContact NE2-OD2 3.47Å
260	Q	96.1	Very high	96.4	Very high	21 Å²	21	41.1 Å²	41.1	10%	0.098	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.7	-168.7	-59.4	176.6	89	0	0	111.5	V226 F228 R250 I253 S254 M300	V226-Q260 HydrophobicContact CB-CG 4.39Å; V226-Q260 WeakPolarHBondContact O-CA 3.49Å; F228-Q260 HydrophobicContact CE2-CB 4.12Å; F228-Q260 HydrophobicContact CE2-CG 4.28Å; F228-Q260 VanDerWaalsContact CZ-OE1 3.29Å; R250-Q260 VanDerWaalsContact CA-OE1 3.32Å; R250-Q260 PolarHBondContact O-NE2 3.33Å; R250-Q260 VanDerWaalsContact O-NE2 3.08Å; I253-Q260 HydrophobicContact CB-CG 4.23Å; I253-Q260 VanDerWaalsContact CD1-OE1 3.29Å; I253-Q260 HydrophobicContact CG2-CG 3.44Å; I253-Q260 VanDerWaalsContact CG2-CG 3.44Å; S254-Q260 PolarHBondContact OG-NE2 3.39Å; S254-Q260 VanDerWaalsContact OG-NE2 3.16Å; Q260-M300 HydrophobicContact CB-CE 4.37Å; Q260-M300 WeakPolarHBondContact O-CE 3.22Å
261	V	97.7	Very high	96.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	168.9	171.6	-59.9	0	0	0	0	110.3	V226 A227 F228 I332 Y335	V226-V261 PolarHBondContact O-N 2.95Å; A227-V261 CarbonylContact C-O 3.42Å; A227-V261 WeakPolarHBondContact CA-O 3.36Å; A227-V261 HydrophobicContact CB-CG2 3.93Å; F228-V261 PolarHBondContact N-O 2.61Å; V261-I332 HydrophobicContact CG2-CG1 3.64Å; V261-Y335 HydrophobicContact CG1-CD1 4.43Å; V261-Y335 HydrophobicContact CG1-CD2 3.13Å; V261-Y335 HydrophobicContact CG1-CE2 3.41Å; V261-Y335 VanDerWaalsContact CG1-CE2 3.41Å; V261-Y335 HydrophobicContact CG1-CG 3.7Å
262	A	98.3	Very high	96.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.8	176.2	0	0	0	0	0	111.9	F228 L298 M300 Y304 I305 V306	F228-A262 HydrophobicContact CB-CB 4.26Å; F228-A262 CarbonylContact O-C 3.53Å; F228-A262 VanDerWaalsContact O-CA 3.29Å; F228-A262 WeakPolarHBondContact O-CA 3.35Å; A262-L298 HydrophobicContact CB-CD1 3.55Å; A262-M300 HydrophobicContact CB-CE 4.35Å; A262-M300 HydrophobicContact CB-SD 4.05Å; A262-Y304 PolarHBondContact N-O 2.99Å; A262-I305 HydrophobicContact CB-CB 4.39Å; A262-I305 HydrophobicContact CB-CG1 4.02Å; A262-I305 HydrophobicContact CB-CG2 4.28Å; A262-I305 CarbonylContact O-C 3.59Å; A262-I305 VanDerWaalsContact O-CA 3.28Å; A262-I305 WeakPolarHBondContact O-CA 3.34Å; A262-V306 PolarHBondContact O-N 3.23Å
263	L	98.6	Very high	96.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.8	173.5	-57.1	-173.5	0	0	0	109.7	F119 F228 M229 V230 V306 V308 A328 I332	F119-L263 HydrophobicContact CD1-CD1 4.25Å; F119-L263 HydrophobicContact CD2-CD1 4.08Å; F119-L263 HydrophobicContact CE1-CD1 3.87Å; F119-L263 HydrophobicContact CE2-CD1 3.68Å; F119-L263 HydrophobicContact CG-CD1 4.35Å; F119-L263 HydrophobicContact CZ-CD1 3.56Å; F228-L263 PolarHBondContact O-N 2.83Å; M229-L263 HydrophobicContact CE-CB 4.4Å; M229-L263 HydrophobicContact CE-CD1 4.24Å; V230-L263 PolarHBondContact N-O 3.16Å; L263-V306 CarbonylContact C-O 3.57Å; L263-V306 VanDerWaalsContact CA-O 3.29Å; L263-V306 WeakPolarHBondContact CA-O 2.96Å; L263-V306 HydrophobicContact CD2-CB 3.85Å; L263-V308 HydrophobicContact CB-CG2 4.28Å; L263-V308 HydrophobicContact CD2-CG1 4.33Å; L263-A328 HydrophobicContact CD2-CB 3.91Å; L263-I332 HydrophobicContact CD1-CD1 4.24Å
264	L	98.3	Very high	96	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	103.8	172.9	-178.1	68.2	0	0	0	108.6	V230 A232 I235 V267 T290 M291 A294 I305 V306 P307 V308	V230-L264 HydrophobicContact CG2-CD1 3.75Å; A232-L264 HydrophobicContact CB-CD1 3.8Å; A232-L264 HydrophobicContact CB-CD2 4.32Å; A232-L264 HydrophobicContact CB-CG 3.93Å; I235-L264 HydrophobicContact CD1-CD1 4.14Å; L264-V267 HydrophobicContact CD2-CG1 4.17Å; L264-V267 HydrophobicContact CG-CG1 4.06Å; L264-V267 WeakPolarHBondContact O-CG1 3.18Å; L264-T290 HydrophobicContact CD1-CG2 4.11Å; L264-T290 HydrophobicContact CD2-CG2 3.95Å; L264-M291 HydrophobicContact CD2-CB 4.45Å; L264-M291 HydrophobicContact CD2-CG 3.61Å; L264-A294 HydrophobicContact CD1-CB 4.36Å; L264-I305 HydrophobicContact CB-CG2 4.18Å; L264-V306 PolarHBondContact N-O 3.45Å; L264-P307 CarbonylContact O-C 3.58Å; L264-P307 WeakPolarHBondContact O-CA 3.26Å; L264-V308 PolarHBondContact O-N 2.97Å
265	T	98.1	Very high	95.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	166.2	-177.1	63.7	0	0	0	0	112.1	S114 M229 V230 A232 V267 V308	S114-T265 WeakPolarHBondContact O-CG2 3.49Å; S114-T265 PolarHBondContact O-OG1 3.23Å; M229-T265 HydrophobicContact CE-CG2 3.42Å; M229-T265 VanDerWaalsContact CE-CG2 3.42Å; V230-T265 PolarHBondContact O-N 3.02Å; V230-T265 PolarHBondContact O-OG1 2.6Å; A232-T265 WeakPolarHBondContact CB-O 3.25Å; A232-T265 PolarHBondContact N-O 2.96Å; T265-V267 VanDerWaalsContact C-N 3.27Å; T265-V267 PolarHBondContact O-N 2.79Å; T265-V308 WeakPolarHBondContact CA-O 3.48Å; T265-V308 HydrophobicContact CG2-CG2 3.79Å
266	H	96.6	Very high	95.8	Very high	34 Å²	34	38.2 Å²	38.2	16%	0.157	20%	0.199	C	C	.	.			trans	60.6	32.8	175	-52.5	91.5	0	0	0	113.6	D231 D268 Q269 V308	D231-H266 IonicContact OD1-CG 3.94Å; D231-H266 IonicContact OD1-ND1 3.63Å; D231-H266 IonicContact OD2-ND1 2.87Å; H266-D268 VanDerWaalsContact C-OD1 3.24Å; H266-D268 VanDerWaalsContact CA-OD1 3.32Å; H266-D268 WeakPolarHBondContact CA-OD1 3.39Å; H266-D268 PolarHBondContact O-N 3.04Å; H266-Q269 HydrophobicContact CB-CG 4.12Å; H266-Q269 PolarHBondContact CD2-NE2 2.79Å; H266-Q269 VanDerWaalsContact CD2-NE2 3.31Å; H266-Q269 WeakPolarHBondContact O-CB 3.41Å; H266-Q269 PolarHBondContact O-N 3.47Å; H266-V308 PolarHBondContact N-O 2.83Å
267	V	96.8	Very high	95.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-65.2	-23.7	-179.7	-63.9	0	0	0	0	113.2	A232 L264 T265 Q269 I270 T274 V281 V287 P307 K309	A232-V267 HydrophobicContact CB-CG1 4.35Å; L264-V267 HydrophobicContact CD2-CG1 4.17Å; L264-V267 HydrophobicContact CG-CG1 4.06Å; L264-V267 WeakPolarHBondContact O-CG1 3.18Å; T265-V267 VanDerWaalsContact C-N 3.27Å; T265-V267 PolarHBondContact O-N 2.79Å; V267-Q269 VanDerWaalsContact C-N 3.27Å; V267-Q269 PolarHBondContact O-N 3.09Å; V267-I270 WeakPolarHBondContact O-CG1 3.3Å; V267-I270 PolarHBondContact O-N 3.37Å; V267-T274 HydrophobicContact CG2-CG2 4.08Å; V267-V281 HydrophobicContact CB-CG2 4.49Å; V267-V281 HydrophobicContact CG2-CG2 4.02Å; V267-V287 HydrophobicContact CB-CG2 4.17Å; V267-V287 HydrophobicContact CG1-CG1 4.33Å; V267-P307 HydrophobicContact CG1-CB 3.76Å; V267-K309 HydrophobicContact CG2-CB 4.37Å
268	D	95.3	Very high	95.9	Very high	38 Å²	38	35.9 Å²	35.9	20%	0.203	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-62.8	-30.9	170.6	56.7	-61.6	0	0	0	112.4	H266 I270 A275 K309	H266-D268 VanDerWaalsContact C-OD1 3.24Å; H266-D268 VanDerWaalsContact CA-OD1 3.32Å; H266-D268 WeakPolarHBondContact CA-OD1 3.39Å; H266-D268 PolarHBondContact O-N 3.04Å; D268-I270 VanDerWaalsContact C-N 3.3Å; D268-I270 PolarHBondContact O-N 3.38Å; D268-A275 HydrophobicContact CB-CB 4.04Å; D268-A275 WeakPolarHBondContact O-CB 3.46Å; D268-K309 HydrophobicContact CB-CD 4.13Å; D268-K309 HydrophobicContact CB-CG 4.21Å
269	Q	95.4	Very high	95.8	Very high	114 Å²	114	36.3 Å²	36.3	53%	0.533	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-76	-18.5	-177.3	-60.8	-173.2	7.7	0	0	113.8	S233 H266 V267	S233-Q269 PolarHBondContact OG-OE1 3.43Å; H266-Q269 HydrophobicContact CB-CG 4.12Å; H266-Q269 PolarHBondContact CD2-NE2 2.79Å; H266-Q269 VanDerWaalsContact CD2-NE2 3.31Å; H266-Q269 WeakPolarHBondContact O-CB 3.41Å; H266-Q269 PolarHBondContact O-N 3.47Å; V267-Q269 VanDerWaalsContact C-N 3.27Å; V267-Q269 PolarHBondContact O-N 3.09Å
270	I	95.5	Very high	95.8	Very high	39 Å²	39	34.6 Å²	34.6	20%	0.2	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-104.4	-6.9	-177.9	61.9	158.1	0	0	0	113.4	A232 V267 D268 V287 T290	A232-I270 HydrophobicContact CB-CD1 3.89Å; A232-I270 HydrophobicContact CB-CG1 4.15Å; A232-I270 HydrophobicContact CB-CG2 4.12Å; V267-I270 WeakPolarHBondContact O-CG1 3.3Å; V267-I270 PolarHBondContact O-N 3.37Å; D268-I270 VanDerWaalsContact C-N 3.3Å; D268-I270 PolarHBondContact O-N 3.38Å; I270-V287 HydrophobicContact CD1-CG2 4.06Å; I270-V287 HydrophobicContact CG1-CG2 4.35Å; I270-T290 HydrophobicContact CD1-CG2 3.97Å; I270-T290 VanDerWaalsContact CD1-OG1 3.3Å; I270-T290 WeakPolarHBondContact CD1-OG1 3.45Å
271	C	94.6	Very high	95.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	17%	0.169	C	C	.	.			trans	-145.7	106.3	-179.1	176.9	0	0	0	0	110.7	E273 T274 A275 S284 V287	C271-E273 PolarHBondContact O-N 2.78Å; C271-E273 PolarHBondContact SG-OE2 2.96Å; C271-T274 WeakPolarHBondContact O-CB 3.09Å; C271-T274 PolarHBondContact O-N 2.96Å; C271-T274 PolarHBondContact SG-N 3.16Å; C271-T274 VanDerWaalsContact SG-N 3.45Å; C271-T274 PolarHBondContact SG-OG1 2.85Å; C271-A275 PolarHBondContact O-N 3.33Å; C271-S284 WeakPolarHBondContact CB-OG 3.44Å; C271-S284 VanDerWaalsContact SG-CB 3.6Å; C271-S284 PolarHBondContact SG-OG 2.91Å; C271-V287 HydrophobicContact CB-CG2 4.19Å
272	P	93.4	Very high	95.8	Very high	77 Å²	77	34.2 Å²	34.2	50%	0.5	17%	0.171	S	C	.	.	H	α-helix	trans	-57.3	-33.9	179.4	-26.5	35.3	0	0	0	114	A275 R276	P272-A275 WeakPolarHBondContact O-CB 3.27Å; P272-A275 PolarHBondContact O-N 3.46Å; P272-R276 WeakPolarHBondContact O-CG 3.21Å; P272-R276 PolarHBondContact O-N 2.96Å; P272-R276 VanDerWaalsContact O-N 3.08Å
273	E	93.1	Very high	95.7	Very high	58 Å²	58	36.9 Å²	36.9	27%	0.271	18%	0.183	S	C	.	.	H	α-helix	trans	-66.8	-39.3	176.4	-59.3	85.9	168	0	0	111.5	S68 C271 R276 D277	S68-E273 WeakPolarHBondContact CB-OE1 3.36Å; S68-E273 PolarHBondContact OG-OE1 3.22Å; C271-E273 PolarHBondContact O-N 2.78Å; C271-E273 PolarHBondContact SG-OE2 2.96Å; E273-R276 PolarHBondContact O-N 3.22Å; E273-D277 PolarHBondContact O-N 2.98Å
274	T	93.9	Very high	95.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.4	-33.9	174.8	-57.2	0	0	0	0	111.2	V267 C271 R276 D277 V278 V281	V267-T274 HydrophobicContact CG2-CG2 4.08Å; C271-T274 WeakPolarHBondContact O-CB 3.09Å; C271-T274 PolarHBondContact O-N 2.96Å; C271-T274 PolarHBondContact SG-N 3.16Å; C271-T274 VanDerWaalsContact SG-N 3.45Å; C271-T274 PolarHBondContact SG-OG1 2.85Å; T274-R276 VanDerWaalsContact C-N 3.35Å; T274-D277 CarbonylContact O-C 3.6Å; T274-V278 PolarHBondContact O-N 3.31Å; T274-V281 HydrophobicContact CG2-CB 3.93Å; T274-V281 HydrophobicContact CG2-CG2 4.16Å
275	A	93.7	Very high	95.3	Very high	44 Å²	44	39.2 Å²	39.2	36%	0.364	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-40.7	174.5	0	0	0	0	0	112.5	D268 C271 P272	D268-A275 HydrophobicContact CB-CB 4.04Å; D268-A275 WeakPolarHBondContact O-CB 3.46Å; C271-A275 PolarHBondContact O-N 3.33Å; P272-A275 WeakPolarHBondContact O-CB 3.27Å; P272-A275 PolarHBondContact O-N 3.46Å
276	R	93.8	Very high	95.2	Very high	208 Å²	208	41.7 Å²	41.7	79%	0.785	21%	0.212	S	C	*	.	H	α-helix	trans	-74.2	-40.2	177.2	-67.7	180	-143.6	156	5.5	112.4	P272 E273 T274	P272-R276 WeakPolarHBondContact O-CG 3.21Å; P272-R276 PolarHBondContact O-N 2.96Å; P272-R276 VanDerWaalsContact O-N 3.08Å; E273-R276 PolarHBondContact O-N 3.22Å; T274-R276 VanDerWaalsContact C-N 3.35Å
277	D	95.1	Very high	95.2	Very high	57 Å²	57	40 Å²	40	31%	0.305	21%	0.205	S	C	.	.			trans	-148.1	107.3	-178.1	169	19.4	0	0	0	110.4	E273 T274 S279 N280 N320	E273-D277 PolarHBondContact O-N 2.98Å; T274-D277 CarbonylContact O-C 3.6Å; D277-S279 PolarHBondContact O-N 3.09Å; D277-S279 VanDerWaalsContact O-N 3.14Å; D277-S279 VanDerWaalsContact OD1-CB 3.28Å; D277-S279 WeakPolarHBondContact OD1-CB 3.46Å; D277-S279 PolarHBondContact OD1-N 3.43Å; D277-S279 PolarHBondContact OD1-OG 3.33Å; D277-S279 PolarHBondContact OD2-OG 3.39Å; D277-N280 WeakPolarHBondContact CB-ND2 3.26Å; D277-N280 VanDerWaalsContact CG-ND2 3.28Å; D277-N280 WeakPolarHBondContact O-CB 3.44Å; D277-N280 PolarHBondContact O-N 2.86Å; D277-N280 PolarHBondContact O-ND2 3.14Å; D277-N280 PolarHBondContact OD2-ND2 2.91Å; D277-N320 PolarHBondContact OD1-ND2 3.44Å; D277-N320 VanDerWaalsContact OD1-ND2 3.13Å
278	V	96.7	Very high	95.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.012	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-60.7	-22.5	-177.5	175.5	0	0	0	0	112.5	W79 T274 N280 V281 K309 N320 T321 L324	W79-V278 HydrophobicContact CZ3-CG1 4.48Å; T274-V278 PolarHBondContact O-N 3.31Å; V278-N280 PolarHBondContact O-N 3.32Å; V278-V281 VanDerWaalsContact O-CB 3.26Å; V278-V281 WeakPolarHBondContact O-CB 3.5Å; V278-V281 VanDerWaalsContact O-CG1 3.27Å; V278-V281 WeakPolarHBondContact O-CG1 3.14Å; V278-V281 PolarHBondContact O-N 2.92Å; V278-K309 HydrophobicContact CG2-CB 4.36Å; V278-K309 HydrophobicContact CG2-CD 3.43Å; V278-K309 VanDerWaalsContact CG2-CD 3.43Å; V278-N320 HydrophobicContact CB-CB 3.96Å; V278-N320 HydrophobicContact CG1-CB 4.42Å; V278-T321 WeakPolarHBondContact CG2-OG1 3.16Å; V278-L324 HydrophobicContact CG1-CB 4.23Å; V278-L324 HydrophobicContact CG1-CD2 3.52Å; V278-L324 HydrophobicContact CG1-CG 4.5Å
279	S	96.1	Very high	95.2	Very high	18 Å²	18	46 Å²	46	13%	0.126	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63	-16.7	176.3	77.4	0	0	0	0	113.2	D277 V281	D277-S279 PolarHBondContact O-N 3.09Å; D277-S279 VanDerWaalsContact O-N 3.14Å; D277-S279 VanDerWaalsContact OD1-CB 3.28Å; D277-S279 WeakPolarHBondContact OD1-CB 3.46Å; D277-S279 PolarHBondContact OD1-N 3.43Å; D277-S279 PolarHBondContact OD1-OG 3.33Å; D277-S279 PolarHBondContact OD2-OG 3.39Å; S279-V281 VanDerWaalsContact C-N 3.31Å
280	N	95.7	Very high	95.3	Very high	14 Å²	14	41.1 Å²	41.1	8%	0.075	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-83	-1.8	174.5	-60.9	-73.9	0	0	0	113.9	K69 D277 V278 Y282 K283 S284	K69-N280 WeakPolarHBondContact CE-OD1 3.28Å; K69-N280 PolarHBondContact NZ-OD1 2.75Å; D277-N280 WeakPolarHBondContact CB-ND2 3.26Å; D277-N280 VanDerWaalsContact CG-ND2 3.28Å; D277-N280 WeakPolarHBondContact O-CB 3.44Å; D277-N280 PolarHBondContact O-N 2.86Å; D277-N280 PolarHBondContact O-ND2 3.14Å; D277-N280 PolarHBondContact OD2-ND2 2.91Å; V278-N280 PolarHBondContact O-N 3.32Å; N280-Y282 PolarHBondContact O-N 2.92Å; N280-K283 CarbonylContact O-C 3.33Å; N280-K283 WeakPolarHBondContact O-CA 3.33Å; N280-K283 PolarHBondContact O-N 3.31Å; N280-S284 PolarHBondContact O-N 3.47Å
281	V	96.9	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-54.1	-41.8	-176	68.1	0	0	0	0	112.2	W74 W79 V267 T274 V278 S279 K283 V287 P307 L324	W74-V281 WeakPolarHBondContact CH2-O 3.31Å; W79-V281 HydrophobicContact CH2-CG1 3.93Å; W79-V281 HydrophobicContact CZ2-CG1 4.16Å; V267-V281 HydrophobicContact CB-CG2 4.49Å; V267-V281 HydrophobicContact CG2-CG2 4.02Å; T274-V281 HydrophobicContact CG2-CB 3.93Å; T274-V281 HydrophobicContact CG2-CG2 4.16Å; V278-V281 VanDerWaalsContact O-CB 3.26Å; V278-V281 WeakPolarHBondContact O-CB 3.5Å; V278-V281 VanDerWaalsContact O-CG1 3.27Å; V278-V281 WeakPolarHBondContact O-CG1 3.14Å; V278-V281 PolarHBondContact O-N 2.92Å; S279-V281 VanDerWaalsContact C-N 3.31Å; V281-K283 VanDerWaalsContact C-N 3.31Å; V281-K283 PolarHBondContact O-N 2.78Å; V281-V287 HydrophobicContact CG2-CG1 3.97Å; V281-P307 HydrophobicContact CG2-CB 3.79Å; V281-P307 HydrophobicContact CG2-CG 3.85Å; V281-L324 HydrophobicContact CG1-CD1 4.27Å; V281-L324 HydrophobicContact CG1-CD2 4.27Å; V281-L324 HydrophobicContact CG2-CD2 4.47Å
282	Y	96.2	Very high	95.4	Very high	13 Å²	13	43.2 Å²	43.2	5%	0.051	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-89.3	10.4	177.9	-66.8	-64.2	0	0	0	114.1	Q73 W74 R75 V77 W79 N280 P307 L324	Q73-Y282 CarbonylContact C-O 3.54Å; Q73-Y282 WeakPolarHBondContact CA-O 3.32Å; W74-Y282 HydrophobicContact CD2-CD1 4.28Å; W74-Y282 AromaticContact CE2-CD1 3.56Å; W74-Y282 HydrophobicContact CH2-CD1 4.48Å; W74-Y282 AromaticContact CZ2-CD1 3.68Å; W74-Y282 HydrophobicContact CZ2-CD1 3.68Å; W74-Y282 HydrophobicContact CZ2-CE1 4.42Å; W74-Y282 WeakPolarHBondContact CZ3-O 3.05Å; W74-Y282 PolarHBondContact N-O 2.9Å; W74-Y282 AromaticContact NE1-CD1 3.57Å; R75-Y282 HydrophobicContact CB-CD1 3.75Å; R75-Y282 HydrophobicContact CB-CD2 4.32Å; R75-Y282 HydrophobicContact CB-CE1 3.86Å; R75-Y282 HydrophobicContact CB-CE2 4.43Å; R75-Y282 HydrophobicContact CB-CG 3.98Å; R75-Y282 HydrophobicContact CG-CD1 4.1Å; R75-Y282 HydrophobicContact CG-CE1 4.01Å; V77-Y282 HydrophobicContact CG2-CD2 3.59Å; V77-Y282 HydrophobicContact CG2-CE2 3.43Å; V77-Y282 VanDerWaalsContact CG2-CE2 3.43Å; W79-Y282 HydrophobicContact CZ2-CD2 4.37Å; N280-Y282 PolarHBondContact O-N 2.92Å; Y282-P307 HydrophobicContact CD1-CG 4.4Å; Y282-P307 HydrophobicContact CE1-CG 3.56Å; Y282-P307 HydrophobicContact CE2-CG 4.48Å; Y282-P307 WeakPolarHBondContact OH-CD 3.32Å; Y282-L324 HydrophobicContact CE2-CD1 4.18Å
283	K	95.2	Very high	95.6	Very high	56 Å²	56	44.6 Å²	44.6	24%	0.243	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-112.7	-11.3	170.4	-61	174.6	-175.8	168	0	111.7	K69 L70 Q73 N280 V281	K69-K283 CarbonylContact C-O 3.6Å; K69-K283 WeakPolarHBondContact CA-O 3.22Å; K69-K283 HydrophobicContact CG-CB 4.08Å; L70-K283 WeakPolarHBondContact CB-O 3.37Å; L70-K283 PolarHBondContact N-O 3.49Å; Q73-K283 HydrophobicContact CB-CG 3.93Å; N280-K283 CarbonylContact O-C 3.33Å; N280-K283 WeakPolarHBondContact O-CA 3.33Å; N280-K283 PolarHBondContact O-N 3.31Å; V281-K283 VanDerWaalsContact C-N 3.31Å; V281-K283 PolarHBondContact O-N 2.78Å
284	S	95.4	Very high	95.8	Very high	4 Å²	4	41.9 Å²	41.9	3%	0.028	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-79.5	119.7	-178.1	175.9	0	0	0	0	112.7	W74 C271 N280 S286 V287 R288	W74-S284 WeakPolarHBondContact CH2-O 3.41Å; W74-S284 WeakPolarHBondContact CZ3-O 3.31Å; C271-S284 WeakPolarHBondContact CB-OG 3.44Å; C271-S284 VanDerWaalsContact SG-CB 3.6Å; C271-S284 PolarHBondContact SG-OG 2.91Å; N280-S284 PolarHBondContact O-N 3.47Å; S284-S286 VanDerWaalsContact C-N 3.31Å; S284-S286 PolarHBondContact O-N 2.62Å; S284-S286 PolarHBondContact OG-N 3.07Å; S284-V287 PolarHBondContact O-N 3.41Å; S284-V287 WeakPolarHBondContact OG-CG2 3.28Å; S284-V287 PolarHBondContact OG-N 3.37Å; S284-R288 PolarHBondContact O-N 2.94Å; S284-R288 VanDerWaalsContact O-N 3.08Å
285	L	94.3	Very high	95.9	Very high	47 Å²	47	42.1 Å²	42.1	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-59.8	-42.6	172.1	-74.7	-178.7	0	0	0	111.9	Q67 S68 L70 V287 R288 D289	Q67-L285 WeakPolarHBondContact O-CD1 3.12Å; S68-L285 PolarHBondContact O-N 3.39Å; L70-L285 HydrophobicContact CD1-CD2 3.98Å; L70-L285 HydrophobicContact CD2-CD2 3.47Å; L70-L285 VanDerWaalsContact CD2-CD2 3.47Å; L70-L285 HydrophobicContact CD2-CG 4.35Å; L70-L285 HydrophobicContact CG-CD2 3.57Å; L70-L285 HydrophobicContact CG-CG 4.1Å; L285-V287 VanDerWaalsContact C-N 3.31Å; L285-V287 PolarHBondContact O-N 3.38Å; L285-R288 WeakPolarHBondContact O-CB 3.31Å; L285-R288 PolarHBondContact O-N 2.95Å; L285-R288 VanDerWaalsContact O-N 3.16Å; L285-D289 WeakPolarHBondContact O-CB 3.36Å; L285-D289 PolarHBondContact O-N 3.41Å
286	S	95.4	Very high	96	Very high	51 Å²	51	44 Å²	44	36%	0.357	22%	0.224	S	C	.	.	H	α-helix	trans	-58.9	-42.5	179.4	-54.4	0	0	0	0	112	S284 T290	S284-S286 VanDerWaalsContact C-N 3.31Å; S284-S286 PolarHBondContact O-N 2.62Å; S284-S286 PolarHBondContact OG-N 3.07Å; S286-T290 VanDerWaalsContact O-CB 3.29Å; S286-T290 WeakPolarHBondContact O-CB 3.33Å; S286-T290 PolarHBondContact O-N 3.26Å; S286-T290 PolarHBondContact O-OG1 3.05Å
287	V	96.6	Very high	96.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-45.1	176.6	175.7	0	0	0	0	110.5	W74 V267 I270 C271 V281 S284 L285 D289 T290 M291 P307	W74-V287 HydrophobicContact CH2-CB 4.13Å; W74-V287 HydrophobicContact CH2-CG1 4.18Å; W74-V287 HydrophobicContact CZ2-CG1 4.27Å; V267-V287 HydrophobicContact CB-CG2 4.17Å; V267-V287 HydrophobicContact CG1-CG1 4.33Å; I270-V287 HydrophobicContact CD1-CG2 4.06Å; I270-V287 HydrophobicContact CG1-CG2 4.35Å; C271-V287 HydrophobicContact CB-CG2 4.19Å; V281-V287 HydrophobicContact CG2-CG1 3.97Å; S284-V287 PolarHBondContact O-N 3.41Å; S284-V287 WeakPolarHBondContact OG-CG2 3.28Å; S284-V287 PolarHBondContact OG-N 3.37Å; L285-V287 VanDerWaalsContact C-N 3.31Å; L285-V287 PolarHBondContact O-N 3.38Å; V287-D289 PolarHBondContact O-N 3.22Å; V287-T290 PolarHBondContact O-N 2.88Å; V287-M291 WeakPolarHBondContact O-CG 3.5Å; V287-M291 PolarHBondContact O-N 3.37Å; V287-P307 HydrophobicContact CG1-CB 4.11Å
288	R	95.9	Very high	96.1	Very high	87 Å²	87	32.9 Å²	32.9	33%	0.328	18%	0.18	S	C	.	.	H	α-helix	trans	-59.1	-46.3	178	-166.9	176.7	67.9	176.5	1.9	112.4	W74 S284 L285 T290 M291 N292	W74-R288 HydrophobicContact CD2-CB 4.37Å; W74-R288 HydrophobicContact CD2-CG 4.16Å; W74-R288 HydrophobicContact CE3-CB 4.13Å; W74-R288 HydrophobicContact CE3-CG 4.26Å; W74-R288 HydrophobicContact CH2-CB 3.63Å; W74-R288 HydrophobicContact CH2-CG 4.4Å; W74-R288 HydrophobicContact CZ2-CB 3.88Å; W74-R288 HydrophobicContact CZ2-CG 4.28Å; W74-R288 HydrophobicContact CZ3-CB 3.75Å; W74-R288 HydrophobicContact CZ3-CG 4.38Å; S284-R288 PolarHBondContact O-N 2.94Å; S284-R288 VanDerWaalsContact O-N 3.08Å; L285-R288 WeakPolarHBondContact O-CB 3.31Å; L285-R288 PolarHBondContact O-N 2.95Å; L285-R288 VanDerWaalsContact O-N 3.16Å; R288-T290 VanDerWaalsContact C-N 3.31Å; R288-T290 PolarHBondContact O-N 3.14Å; R288-M291 WeakPolarHBondContact O-CB 3.42Å; R288-M291 PolarHBondContact O-N 2.8Å; R288-N292 PolarHBondContact O-N 3.23Å; R288-N292 PolarHBondContact O-ND2 2.9Å
289	D	95.9	Very high	96	Very high	75 Å²	75	35 Å²	35	40%	0.401	20%	0.202	S	C	.	.	H	α-helix	trans	-68.3	-35.4	-179.5	-67.9	-14.3	0	0	0	111.4	L285 V287 N292 K293	L285-D289 WeakPolarHBondContact O-CB 3.36Å; L285-D289 PolarHBondContact O-N 3.41Å; V287-D289 PolarHBondContact O-N 3.22Å; D289-N292 WeakPolarHBondContact O-CB 3.33Å; D289-N292 PolarHBondContact O-N 2.71Å; D289-K293 WeakPolarHBondContact O-CG 3.39Å; D289-K293 PolarHBondContact O-N 3.14Å
290	T	97.2	Very high	95.9	Very high	12 Å²	12	35.4 Å²	35.4	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-68.9	-36.5	174.3	-56.2	0	0	0	0	111.5	A232 I235 L264 I270 S286 V287 R288 N292 K293 A294	A232-T290 HydrophobicContact CB-CG2 3.95Å; I235-T290 HydrophobicContact CB-CG2 4.47Å; I235-T290 HydrophobicContact CD1-CG2 4.17Å; I235-T290 HydrophobicContact CG2-CG2 3.9Å; L264-T290 HydrophobicContact CD1-CG2 4.11Å; L264-T290 HydrophobicContact CD2-CG2 3.95Å; I270-T290 HydrophobicContact CD1-CG2 3.97Å; I270-T290 VanDerWaalsContact CD1-OG1 3.3Å; I270-T290 WeakPolarHBondContact CD1-OG1 3.45Å; S286-T290 VanDerWaalsContact O-CB 3.29Å; S286-T290 WeakPolarHBondContact O-CB 3.33Å; S286-T290 PolarHBondContact O-N 3.26Å; S286-T290 PolarHBondContact O-OG1 3.05Å; V287-T290 PolarHBondContact O-N 2.88Å; R288-T290 VanDerWaalsContact C-N 3.31Å; R288-T290 PolarHBondContact O-N 3.14Å; T290-N292 VanDerWaalsContact C-N 3.32Å; T290-N292 PolarHBondContact O-N 3Å; T290-K293 PolarHBondContact O-N 3.24Å; T290-A294 WeakPolarHBondContact O-CB 3.04Å; T290-A294 PolarHBondContact O-N 2.76Å
291	M	96.4	Very high	95.9	Very high	3 Å²	3	38 Å²	38	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-39.1	170.4	-74.2	-175.7	67.3	0	0	112.2	W74 L264 V287 R288 A294 G295 I305 P307	W74-M291 HydrophobicContact CZ2-SD 4.08Å; L264-M291 HydrophobicContact CD2-CB 4.45Å; L264-M291 HydrophobicContact CD2-CG 3.61Å; V287-M291 WeakPolarHBondContact O-CG 3.5Å; V287-M291 PolarHBondContact O-N 3.37Å; R288-M291 WeakPolarHBondContact O-CB 3.42Å; R288-M291 PolarHBondContact O-N 2.8Å; M291-A294 WeakPolarHBondContact O-CB 3.47Å; M291-A294 PolarHBondContact O-N 3.46Å; M291-G295 PolarHBondContact O-N 2.88Å; M291-I305 HydrophobicContact CE-CB 3.86Å; M291-I305 HydrophobicContact CE-CG2 4.07Å; M291-I305 WeakPolarHBondContact CE-O 3.46Å; M291-P307 HydrophobicContact SD-CG 4.09Å
292	N	96.4	Very high	95.6	Very high	81 Å²	81	40.5 Å²	40.5	43%	0.433	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-43.7	174.5	-69	-34	0	0	0	111.4	R288 D289 T290 A294 G295 A296 T302	R288-N292 PolarHBondContact O-N 3.23Å; R288-N292 PolarHBondContact O-ND2 2.9Å; D289-N292 WeakPolarHBondContact O-CB 3.33Å; D289-N292 PolarHBondContact O-N 2.71Å; T290-N292 VanDerWaalsContact C-N 3.32Å; T290-N292 PolarHBondContact O-N 3Å; N292-A294 VanDerWaalsContact C-N 3.3Å; N292-A294 PolarHBondContact O-N 2.98Å; N292-G295 PolarHBondContact O-N 3.49Å; N292-A296 PolarHBondContact O-N 2.91Å; N292-T302 WeakPolarHBondContact OD1-CG2 3.35Å
293	K	96.8	Very high	95.3	Very high	107 Å²	107	42.7 Å²	42.7	47%	0.465	25%	0.254	S	S	.	.	H	α-helix	trans	-61.8	-38.5	174	-67.8	171.6	-175.8	175.6	0	111.8	I235 D289 T290 A296 L297	I235-K293 HydrophobicContact CD1-CB 4.27Å; I235-K293 HydrophobicContact CG2-CB 4.08Å; I235-K293 HydrophobicContact CG2-CD 4.08Å; D289-K293 WeakPolarHBondContact O-CG 3.39Å; D289-K293 PolarHBondContact O-N 3.14Å; T290-K293 PolarHBondContact O-N 3.24Å; K293-A296 PolarHBondContact O-N 2.57Å; K293-L297 WeakPolarHBondContact O-CB 3.48Å; K293-L297 PolarHBondContact O-N 3.13Å
294	A	97.1	Very high	95.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-44.7	174.9	0	0	0	0	0	111.4	V230 I235 L264 T290 M291 N292 A296 L297 L298 I305	V230-A294 HydrophobicContact CG2-CB 4.17Å; I235-A294 HydrophobicContact CD1-CB 3.41Å; I235-A294 VanDerWaalsContact CD1-CB 3.41Å; I235-A294 VanDerWaalsContact CD1-N 3.34Å; L264-A294 HydrophobicContact CD1-CB 4.36Å; T290-A294 WeakPolarHBondContact O-CB 3.04Å; T290-A294 PolarHBondContact O-N 2.76Å; M291-A294 WeakPolarHBondContact O-CB 3.47Å; M291-A294 PolarHBondContact O-N 3.46Å; N292-A294 VanDerWaalsContact C-N 3.3Å; N292-A294 PolarHBondContact O-N 2.98Å; A294-A296 VanDerWaalsContact C-N 3.33Å; A294-A296 PolarHBondContact O-N 3.24Å; A294-L297 PolarHBondContact O-N 3.3Å; A294-L298 VanDerWaalsContact O-CB 3.25Å; A294-L298 WeakPolarHBondContact O-CB 3.34Å; A294-L298 WeakPolarHBondContact O-CG 2.94Å; A294-L298 PolarHBondContact O-N 3.39Å; A294-I305 HydrophobicContact CB-CD1 4Å
295	G	96.8	Very high	95.3	Very high	6 Å²	6	44.4 Å²	44.4	6%	0.062	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-41.3	175.5	0	0	0	0	0	112.7	M291 N292 G299 M300 I305	M291-G295 PolarHBondContact O-N 2.88Å; N292-G295 PolarHBondContact O-N 3.49Å; G295-G299 CarbonylContact O-C 3.47Å; G295-G299 WeakPolarHBondContact O-CA 3.42Å; G295-G299 PolarHBondContact O-N 3.21Å; G295-M300 CarbonylContact C-O 3.56Å; G295-M300 WeakPolarHBondContact CA-O 3.35Å; G295-M300 PolarHBondContact O-N 3.33Å; G295-I305 VanDerWaalsContact CA-CD1 3.47Å; G295-I305 VanDerWaalsContact N-CD1 3.32Å
296	A	95.8	Very high	95.4	Very high	84 Å²	84	42.6 Å²	42.6	69%	0.694	25%	0.25	S	C	*	.	H	α-helix	trans	-64.9	-45.8	175.1	0	0	0	0	0	112.4	N292 K293 A294 G299	N292-A296 PolarHBondContact O-N 2.91Å; K293-A296 PolarHBondContact O-N 2.57Å; A294-A296 VanDerWaalsContact C-N 3.33Å; A294-A296 PolarHBondContact O-N 3.24Å; A296-G299 PolarHBondContact O-N 3.38Å
297	L	95.4	Very high	95.5	Very high	31 Å²	31	40.2 Å²	40.2	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-47.2	178.1	174.7	69.2	0	0	0	112	V230 I235 Y238 F242 F246 K293 A294 G299	V230-L297 HydrophobicContact CG1-CD2 4.28Å; I235-L297 HydrophobicContact CG1-CD2 4.16Å; Y238-L297 HydrophobicContact CD2-CD2 3.51Å; Y238-L297 HydrophobicContact CE2-CD2 3.97Å; F242-L297 HydrophobicContact CB-CD1 4.14Å; F246-L297 HydrophobicContact CD2-CD1 4.44Å; F246-L297 HydrophobicContact CD2-CG 4.17Å; F246-L297 HydrophobicContact CE2-CD2 4.21Å; F246-L297 HydrophobicContact CE2-CG 4.27Å; K293-L297 WeakPolarHBondContact O-CB 3.48Å; K293-L297 PolarHBondContact O-N 3.13Å; A294-L297 PolarHBondContact O-N 3.3Å; L297-G299 VanDerWaalsContact C-N 3.3Å
298	L	95.4	Very high	95.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-85.3	-0.9	-177.7	-64.1	173.5	0	0	0	112.2	F228 V230 F246 R250 A262 A294 M300	F228-L298 HydrophobicContact CB-CD1 4.3Å; F228-L298 HydrophobicContact CB-CD2 4.17Å; F228-L298 HydrophobicContact CG-CD2 4.31Å; V230-L298 HydrophobicContact CG1-CD1 4.14Å; V230-L298 HydrophobicContact CG1-CD2 4.08Å; V230-L298 HydrophobicContact CG1-CG 4.3Å; V230-L298 HydrophobicContact CG2-CD1 4.27Å; F246-L298 HydrophobicContact CB-CD2 4.24Å; F246-L298 HydrophobicContact CD1-CD2 3.74Å; F246-L298 HydrophobicContact CD2-CD2 3.71Å; F246-L298 HydrophobicContact CE1-CD2 3.94Å; F246-L298 HydrophobicContact CE2-CD2 3.91Å; F246-L298 HydrophobicContact CG-CD2 3.64Å; F246-L298 HydrophobicContact CZ-CD2 4.02Å; R250-L298 VanDerWaalsContact CD-O 3.22Å; R250-L298 WeakPolarHBondContact CD-O 3.37Å; R250-L298 PolarHBondContact NE-O 3.16Å; R250-L298 VanDerWaalsContact NH1-C 3.34Å; R250-L298 PolarHBondContact NH1-O 2.92Å; R250-L298 PolarHBondContact NH2-O 2.88Å; A262-L298 HydrophobicContact CB-CD1 3.55Å; A294-L298 VanDerWaalsContact O-CB 3.25Å; A294-L298 WeakPolarHBondContact O-CB 3.34Å; A294-L298 WeakPolarHBondContact O-CG 2.94Å; A294-L298 PolarHBondContact O-N 3.39Å; L298-M300 HydrophobicContact CB-CB 4.32Å; L298-M300 HydrophobicContact CB-CG 4.14Å; L298-M300 HydrophobicContact CB-SD 4.11Å; L298-M300 HydrophobicContact CD1-SD 4.43Å; L298-M300 WeakPolarHBondContact O-CG 3.48Å; L298-M300 PolarHBondContact O-N 2.94Å; L298-M300 VanDerWaalsContact O-N 3.16Å
299	G	94.9	Very high	95.6	Very high	47 Å²	47	36.9 Å²	36.9	49%	0.485	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	43.8	-171.4	0	0	0	0	0	113.9	R250 G295 A296 L297	R250-G299 PolarHBondContact NE-O 3.18Å; G295-G299 CarbonylContact O-C 3.47Å; G295-G299 WeakPolarHBondContact O-CA 3.42Å; G295-G299 PolarHBondContact O-N 3.21Å; A296-G299 PolarHBondContact O-N 3.38Å; L297-G299 VanDerWaalsContact C-N 3.3Å
300	M	94.8	Very high	95.6	Very high	26 Å²	26	33.7 Å²	33.7	13%	0.128	20%	0.204	C	C	.	.			trans	-122.8	147.2	-179.3	-71.8	175.7	83.6	0	0	110	F228 Q260 A262 G295 L298 Y304	F228-M300 HydrophobicContact CD2-SD 4.02Å; Q260-M300 HydrophobicContact CB-CE 4.37Å; Q260-M300 WeakPolarHBondContact O-CE 3.22Å; A262-M300 HydrophobicContact CB-CE 4.35Å; A262-M300 HydrophobicContact CB-SD 4.05Å; G295-M300 CarbonylContact C-O 3.56Å; G295-M300 WeakPolarHBondContact CA-O 3.35Å; G295-M300 PolarHBondContact O-N 3.33Å; L298-M300 HydrophobicContact CB-CB 4.32Å; L298-M300 HydrophobicContact CB-CG 4.14Å; L298-M300 HydrophobicContact CB-SD 4.11Å; L298-M300 HydrophobicContact CD1-SD 4.43Å; L298-M300 WeakPolarHBondContact O-CG 3.48Å; L298-M300 PolarHBondContact O-N 2.94Å; L298-M300 VanDerWaalsContact O-N 3.16Å; M300-Y304 HydrophobicContact CE-CG 4.43Å
301	S	94	Very high	95.4	Very high	68 Å²	68	33.3 Å²	33.3	48%	0.476	20%	0.201	S	C	.	.			trans	-65.3	142.5	170	172.3	0	0	0	0	109.8	S303 Y304	S301-S303 WeakPolarHBondContact CB-OG 3.46Å; S301-S303 PolarHBondContact O-N 2.92Å; S301-S303 VanDerWaalsContact O-N 3.08Å; S301-S303 PolarHBondContact OG-N 2.89Å; S301-S303 PolarHBondContact OG-OG 3.35Å; S301-Y304 PolarHBondContact O-N 3.12Å
302	T	92.1	Very high	94.9	Very high	52 Å²	52	36.7 Å²	36.7	32%	0.319	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-57	-28.1	179.2	51.5	0	0	0	0	112.4	R75 N292 Y304 I305	R75-T302 VanDerWaalsContact NH2-C 3.33Å; R75-T302 PolarHBondContact NH2-O 3.16Å; N292-T302 WeakPolarHBondContact OD1-CG2 3.35Å; T302-Y304 PolarHBondContact O-N 3.35Å; T302-I305 WeakPolarHBondContact O-CB 3.25Å; T302-I305 PolarHBondContact O-N 2.94Å
303	S	90.4	Very high	94.3	Very high	60 Å²	60	37.9 Å²	37.9	42%	0.42	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-53.9	-29.2	173.7	55.7	0	0	0	0	114.4	S301	S301-S303 WeakPolarHBondContact CB-OG 3.46Å; S301-S303 PolarHBondContact O-N 2.92Å; S301-S303 VanDerWaalsContact O-N 3.08Å; S301-S303 PolarHBondContact OG-N 2.89Å; S301-S303 PolarHBondContact OG-OG 3.35Å
304	Y	92.4	Very high	94	Very high	96 Å²	96	35.2 Å²	35.2	38%	0.376	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-90.7	0.9	178.6	-66.9	-103.9	0	0	0	113.4	A262 M300 S301 T302 Y335	A262-Y304 PolarHBondContact N-O 2.99Å; M300-Y304 HydrophobicContact CE-CG 4.43Å; S301-Y304 PolarHBondContact O-N 3.12Å; T302-Y304 PolarHBondContact O-N 3.35Å; Y304-Y335 AromaticContact CD1-CE1 3.98Å; Y304-Y335 HydrophobicContact CD1-CE1 3.98Å; Y304-Y335 AromaticContact CD1-CZ 3.62Å; Y304-Y335 WeakPolarHBondContact CD1-OH 2.87Å; Y304-Y335 AromaticContact CE1-CE1 3.61Å; Y304-Y335 HydrophobicContact CE1-CE1 3.61Å; Y304-Y335 AromaticContact CE1-CZ 3.56Å; Y304-Y335 WeakPolarHBondContact CE1-OH 3.12Å
305	I	96.6	Very high	93.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.4	-176.5	-48.6	179.2	0	0	0	108.5	R75 A262 L264 M291 A294 G295 T302	R75-I305 PolarHBondContact NH1-O 3.19Å; R75-I305 PolarHBondContact NH2-O 2.96Å; A262-I305 HydrophobicContact CB-CB 4.39Å; A262-I305 HydrophobicContact CB-CG1 4.02Å; A262-I305 HydrophobicContact CB-CG2 4.28Å; A262-I305 CarbonylContact O-C 3.59Å; A262-I305 VanDerWaalsContact O-CA 3.28Å; A262-I305 WeakPolarHBondContact O-CA 3.34Å; L264-I305 HydrophobicContact CB-CG2 4.18Å; M291-I305 HydrophobicContact CE-CB 3.86Å; M291-I305 HydrophobicContact CE-CG2 4.07Å; M291-I305 WeakPolarHBondContact CE-O 3.46Å; A294-I305 HydrophobicContact CB-CD1 4Å; G295-I305 VanDerWaalsContact CA-CD1 3.47Å; G295-I305 VanDerWaalsContact N-CD1 3.32Å; T302-I305 WeakPolarHBondContact O-CB 3.25Å; T302-I305 PolarHBondContact O-N 2.94Å
306	V	97.5	Very high	93.3	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.055	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120	177.8	-175.3	0	0	0	0	109.5	A262 L263 L264 V308 A328 H331	A262-V306 PolarHBondContact O-N 3.23Å; L263-V306 CarbonylContact C-O 3.57Å; L263-V306 VanDerWaalsContact CA-O 3.29Å; L263-V306 WeakPolarHBondContact CA-O 2.96Å; L263-V306 HydrophobicContact CD2-CB 3.85Å; L264-V306 PolarHBondContact N-O 3.45Å; V306-V308 HydrophobicContact CG1-CG1 4.4Å; V306-A328 HydrophobicContact CB-CB 4.49Å; V306-A328 HydrophobicContact CG1-CB 3.88Å; V306-H331 HydrophobicContact CG2-CB 4.48Å
307	P	97.7	Very high	93.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	138.8	171	29.6	-33.7	0	0	0	110.6	L264 V267 V281 Y282 V287 M291 L324	L264-P307 CarbonylContact O-C 3.58Å; L264-P307 WeakPolarHBondContact O-CA 3.26Å; V267-P307 HydrophobicContact CG1-CB 3.76Å; V281-P307 HydrophobicContact CG2-CB 3.79Å; V281-P307 HydrophobicContact CG2-CG 3.85Å; Y282-P307 HydrophobicContact CD1-CG 4.4Å; Y282-P307 HydrophobicContact CE1-CG 3.56Å; Y282-P307 HydrophobicContact CE2-CG 4.48Å; Y282-P307 WeakPolarHBondContact OH-CD 3.32Å; V287-P307 HydrophobicContact CG1-CB 4.11Å; M291-P307 HydrophobicContact SD-CG 4.09Å; P307-L324 VanDerWaalsContact O-CD1 3.3Å; P307-L324 WeakPolarHBondContact O-CD1 3.44Å; P307-L324 WeakPolarHBondContact O-CG 3.43Å
308	V	97.8	Very high	93.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.286	C	S	.	.			trans	-137.6	145.5	177.1	-61.8	0	0	0	0	110.9	F119 L263 L264 T265 H266 V306 L325 A328	F119-V308 HydrophobicContact CD2-CG2 4.36Å; F119-V308 HydrophobicContact CE2-CG1 4.34Å; L263-V308 HydrophobicContact CB-CG2 4.28Å; L263-V308 HydrophobicContact CD2-CG1 4.33Å; L264-V308 PolarHBondContact O-N 2.97Å; T265-V308 WeakPolarHBondContact CA-O 3.48Å; T265-V308 HydrophobicContact CG2-CG2 3.79Å; H266-V308 PolarHBondContact N-O 2.83Å; V306-V308 HydrophobicContact CG1-CG1 4.4Å; V308-L325 HydrophobicContact CB-CD2 4.46Å; V308-A328 HydrophobicContact CG1-CB 3.54Å
309	K	96.4	Very high	93.4	Very high	17 Å²	17	49.7 Å²	49.7	7%	0.074	30%	0.296	C	S	.	.			trans	-109	123	165.4	-177.4	-169.9	173.8	-158.1	0	107.6	V267 D268 V278 E314 T321 L325	V267-K309 HydrophobicContact CG2-CB 4.37Å; D268-K309 HydrophobicContact CB-CD 4.13Å; D268-K309 HydrophobicContact CB-CG 4.21Å; V278-K309 HydrophobicContact CG2-CB 4.36Å; V278-K309 HydrophobicContact CG2-CD 3.43Å; V278-K309 VanDerWaalsContact CG2-CD 3.43Å; K309-E314 WeakPolarHBondContact CE-OE1 3.5Å; K309-E314 IonicContact NZ-OE1 2.7Å; K309-E314 PolarHBondContact NZ-OE1 3.43Å; K309-T321 HydrophobicContact CB-CG2 4.48Å; K309-T321 WeakPolarHBondContact O-CG2 3.44Å; K309-L325 WeakPolarHBondContact O-CD2 3.43Å
310	N	95.4	Very high	93.5	Very high	9 Å²	9	48.7 Å²	48.7	5%	0.048	28%	0.28	C	S	.	.			trans	-88	148.6	174.4	-66.5	-25.4	0	0	0	109.2	G115 F119 S122 A312	G115-N310 PolarHBondContact O-ND2 3.41Å; F119-N310 WeakPolarHBondContact CA-OD1 3.49Å; F119-N310 WeakPolarHBondContact CD2-OD1 3.38Å; F119-N310 PolarHBondContact N-ND2 2.69Å; S122-N310 WeakPolarHBondContact OG-CA 3.39Å; S122-N310 WeakPolarHBondContact OG-CB 3.42Å; N310-A312 PolarHBondContact O-N 2.82Å
311	Y	93	Very high	93.7	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.016	27%	0.274	C	S	.	.			trans	-66.4	127.5	164.7	-68.2	-69.9	0	0	0	109.2	S122 V126 V131 E314 L317 D318 T321 D322 L325	S122-Y311 PolarHBondContact OG-N 3.17Å; V126-Y311 HydrophobicContact CG2-CE2 4.26Å; V131-Y311 HydrophobicContact CG2-CD1 4.13Å; V131-Y311 HydrophobicContact CG2-CG 4.28Å; Y311-E314 HydrophobicContact CD1-CB 4.06Å; Y311-E314 HydrophobicContact CD1-CG 4.42Å; Y311-L317 HydrophobicContact CD2-CD2 4.14Å; Y311-L317 HydrophobicContact CE1-CD2 4.23Å; Y311-L317 HydrophobicContact CE2-CD2 3.54Å; Y311-D318 HydrophobicContact CE1-CB 4.48Å; Y311-D318 PolarHBondContact OH-N 3.36Å; Y311-D318 PolarHBondContact OH-O 2.96Å; Y311-T321 HydrophobicContact CD1-CG2 4.32Å; Y311-T321 HydrophobicContact CD2-CG2 4.38Å; Y311-T321 HydrophobicContact CE1-CG2 3.81Å; Y311-T321 HydrophobicContact CE2-CG2 3.87Å; Y311-D322 WeakPolarHBondContact CE2-OD1 3.37Å; Y311-D322 PolarHBondContact OH-OD1 3.49Å; Y311-L325 HydrophobicContact CD2-CD1 3.93Å; Y311-L325 HydrophobicContact CE2-CD1 3.74Å
312	A	86.3	Confident	93.9	Very high	74 Å²	74	44.2 Å²	44.2	61%	0.612	25%	0.252	S	S	*	.	S	Bend	trans	-137.4	-50.9	-176.9	0	0	0	0	0	112.1	N310 E314	N310-A312 PolarHBondContact O-N 2.82Å; A312-E314 PolarHBondContact N-OE2 3.07Å
313	S	84.3	Confident	94.1	Very high	105 Å²	105	41.8 Å²	41.8	73%	0.734	24%	0.236	S	C	*	.	S	Bend	trans	-112.5	-14.9	-177.7	53.6	0	0	0	0	113.1
314	E	89.1	Confident	94.5	Very high	51 Å²	51	39 Å²	39	24%	0.238	22%	0.217	C	C	.	.			trans	-73.4	145.6	-177.5	-57.2	86.3	166.3	0	0	111.7	V131 K309 Y311 A312	V131-E314 WeakPolarHBondContact CG1-O 3.3Å; K309-E314 WeakPolarHBondContact CE-OE1 3.5Å; K309-E314 IonicContact NZ-OE1 2.7Å; K309-E314 PolarHBondContact NZ-OE1 3.43Å; Y311-E314 HydrophobicContact CD1-CB 4.06Å; Y311-E314 HydrophobicContact CD1-CG 4.42Å; A312-E314 PolarHBondContact N-OE2 3.07Å
315	L	87.3	Confident	94.8	Very high	148 Å²	148	34.4 Å²	34.4	78%	0.775	20%	0.199	S	C	*	.	S	Bend	trans	-94.9	-31.6	174.5	-61.4	178	0	0	0	111.9	V131	V131-L315 WeakPolarHBondContact CG2-O 3.32Å
316	D	92.4	Very high	94.8	Very high	130 Å²	130	34.5 Å²	34.5	70%	0.695	20%	0.199	S	C	*	.	S	Bend	trans	-110.5	155.2	-177.1	-61.2	-56.4	0	0	0	111.1
317	L	95.1	Very high	94.8	Very high	45 Å²	45	35.6 Å²	35.6	24%	0.236	21%	0.208	C	C	.	.			trans	-75.3	145.2	172.4	-62	177.9	0	0	0	110.4	G129 V131 Y311	G129-L317 VanDerWaalsContact C-CD1 3.43Å; V131-L317 HydrophobicContact CG2-CD2 3.96Å; Y311-L317 HydrophobicContact CD2-CD2 4.14Å; Y311-L317 HydrophobicContact CE1-CD2 4.23Å; Y311-L317 HydrophobicContact CE2-CD2 3.54Å
318	D	96.5	Very high	94.8	Very high	60 Å²	60	35.6 Å²	35.6	32%	0.321	21%	0.208	S	C	.	.			trans	-115.2	132.7	175.1	166.3	59.3	0	0	0	109.8	Y311 N320 T321 D322	Y311-D318 HydrophobicContact CE1-CB 4.48Å; Y311-D318 PolarHBondContact OH-N 3.36Å; Y311-D318 PolarHBondContact OH-O 2.96Å; D318-N320 VanDerWaalsContact C-N 3.33Å; D318-N320 PolarHBondContact O-N 3.24Å; D318-N320 PolarHBondContact OD2-N 3.49Å; D318-T321 PolarHBondContact O-N 3.08Å; D318-T321 WeakPolarHBondContact OD2-CB 3.39Å; D318-T321 PolarHBondContact OD2-N 3.48Å; D318-T321 PolarHBondContact OD2-OG1 3.43Å; D318-D322 WeakPolarHBondContact O-CB 3.45Å; D318-D322 PolarHBondContact O-N 2.9Å
319	L	97.6	Very high	94.8	Very high	42 Å²	42	35.6 Å²	35.6	22%	0.22	21%	0.208	C	C	.	.	H	α-helix	trans	-56.2	-46.4	-177.8	171.9	58.7	0	0	0	112	E81 K84 D322 V323	E81-L319 HydrophobicContact CG-CD1 4.29Å; E81-L319 HydrophobicContact CG-CD2 4.16Å; E81-L319 WeakPolarHBondContact OE1-CD1 3.43Å; K84-L319 HydrophobicContact CB-CD1 3.8Å; K84-L319 HydrophobicContact CD-CD1 3.56Å; K84-L319 HydrophobicContact CG-CD1 4.31Å; L319-D322 PolarHBondContact O-N 3.33Å; L319-V323 HydrophobicContact CD1-CG2 4.04Å; L319-V323 WeakPolarHBondContact O-CG2 3.27Å; L319-V323 PolarHBondContact O-N 3.06Å
320	N	97.7	Very high	94.8	Very high	27 Å²	27	36.8 Å²	36.8	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-70.4	-39.7	-175	-66	-19.2	0	0	0	111.1	W79 D277 V278 D318 V323 L324	W79-N320 WeakPolarHBondContact CB-OD1 3.38Å; W79-N320 HydrophobicContact CE3-CB 3.85Å; W79-N320 HydrophobicContact CZ3-CB 4.15Å; W79-N320 WeakPolarHBondContact CZ3-O 3.24Å; D277-N320 PolarHBondContact OD1-ND2 3.44Å; D277-N320 VanDerWaalsContact OD1-ND2 3.13Å; V278-N320 HydrophobicContact CB-CB 3.96Å; V278-N320 HydrophobicContact CG1-CB 4.42Å; D318-N320 VanDerWaalsContact C-N 3.33Å; D318-N320 PolarHBondContact O-N 3.24Å; D318-N320 PolarHBondContact OD2-N 3.49Å; N320-V323 PolarHBondContact O-N 3.33Å; N320-L324 WeakPolarHBondContact O-CB 3.34Å; N320-L324 PolarHBondContact O-N 3.29Å
321	T	97.5	Very high	94.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-44.5	174	-55.7	0	0	0	0	111.2	V278 K309 Y311 D318 L324 L325	V278-T321 WeakPolarHBondContact CG2-OG1 3.16Å; K309-T321 HydrophobicContact CB-CG2 4.48Å; K309-T321 WeakPolarHBondContact O-CG2 3.44Å; Y311-T321 HydrophobicContact CD1-CG2 4.32Å; Y311-T321 HydrophobicContact CD2-CG2 4.38Å; Y311-T321 HydrophobicContact CE1-CG2 3.81Å; Y311-T321 HydrophobicContact CE2-CG2 3.87Å; D318-T321 PolarHBondContact O-N 3.08Å; D318-T321 WeakPolarHBondContact OD2-CB 3.39Å; D318-T321 PolarHBondContact OD2-N 3.48Å; D318-T321 PolarHBondContact OD2-OG1 3.43Å; T321-L324 PolarHBondContact O-N 2.91Å; T321-L325 HydrophobicContact CG2-CD1 4Å; T321-L325 WeakPolarHBondContact O-CB 3.45Å; T321-L325 WeakPolarHBondContact O-CG 3.31Å; T321-L325 PolarHBondContact O-N 3.18Å
322	D	97.8	Very high	95.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-49.8	175.5	-71.9	-13.1	0	0	0	111.7	K84 V126 Y311 D318 L319 L324 L325 L326	K84-D322 HydrophobicContact CD-CB 3.96Å; K84-D322 WeakPolarHBondContact CE-OD2 3.4Å; K84-D322 HydrophobicContact CG-CB 4.4Å; K84-D322 IonicContact NZ-OD2 2.67Å; K84-D322 PolarHBondContact NZ-OD2 3.04Å; V126-D322 HydrophobicContact CG1-CB 4.06Å; V126-D322 HydrophobicContact CG2-CB 4.43Å; V126-D322 WeakPolarHBondContact CG2-OD1 3.25Å; Y311-D322 WeakPolarHBondContact CE2-OD1 3.37Å; Y311-D322 PolarHBondContact OH-OD1 3.49Å; D318-D322 WeakPolarHBondContact O-CB 3.45Å; D318-D322 PolarHBondContact O-N 2.9Å; L319-D322 PolarHBondContact O-N 3.33Å; D322-L324 VanDerWaalsContact C-N 3.29Å; D322-L324 PolarHBondContact O-N 2.94Å; D322-L325 PolarHBondContact O-N 3.49Å; D322-L326 VanDerWaalsContact O-CB 3.31Å; D322-L326 WeakPolarHBondContact O-CB 3.44Å; D322-L326 WeakPolarHBondContact O-CD1 3.44Å; D322-L326 WeakPolarHBondContact O-CG 3.48Å; D322-L326 PolarHBondContact O-N 3.37Å
323	V	98.3	Very high	95.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-43.1	178.1	168.6	0	0	0	0	110.7	V77 W79 Q83 K84 L87 L319 N320 S327	V77-V323 HydrophobicContact CG1-CG1 3.64Å; W79-V323 HydrophobicContact CE3-CB 4.22Å; W79-V323 HydrophobicContact CE3-CG1 4.03Å; W79-V323 HydrophobicContact CZ3-CB 4.4Å; W79-V323 HydrophobicContact CZ3-CG1 4.2Å; Q83-V323 HydrophobicContact CG-CG1 4.38Å; K84-V323 HydrophobicContact CB-CG2 3.84Å; L87-V323 HydrophobicContact CD1-CG1 4.34Å; L319-V323 HydrophobicContact CD1-CG2 4.04Å; L319-V323 WeakPolarHBondContact O-CG2 3.27Å; L319-V323 PolarHBondContact O-N 3.06Å; N320-V323 PolarHBondContact O-N 3.33Å; V323-S327 VanDerWaalsContact O-CB 3.25Å; V323-S327 WeakPolarHBondContact O-CB 3.48Å; V323-S327 PolarHBondContact O-N 2.78Å; V323-S327 PolarHBondContact O-OG 3.39Å
324	L	97.8	Very high	96.1	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-44.8	-179.4	-170.8	61.7	0	0	0	112.1	W79 V278 V281 Y282 P307 N320 T321 D322 S327 A328	W79-L324 HydrophobicContact CH2-CD1 4.33Å; W79-L324 HydrophobicContact CZ3-CB 4.3Å; V278-L324 HydrophobicContact CG1-CB 4.23Å; V278-L324 HydrophobicContact CG1-CD2 3.52Å; V278-L324 HydrophobicContact CG1-CG 4.5Å; V281-L324 HydrophobicContact CG1-CD1 4.27Å; V281-L324 HydrophobicContact CG1-CD2 4.27Å; V281-L324 HydrophobicContact CG2-CD2 4.47Å; Y282-L324 HydrophobicContact CE2-CD1 4.18Å; P307-L324 VanDerWaalsContact O-CD1 3.3Å; P307-L324 WeakPolarHBondContact O-CD1 3.44Å; P307-L324 WeakPolarHBondContact O-CG 3.43Å; N320-L324 WeakPolarHBondContact O-CB 3.34Å; N320-L324 PolarHBondContact O-N 3.29Å; T321-L324 PolarHBondContact O-N 2.91Å; D322-L324 VanDerWaalsContact C-N 3.29Å; D322-L324 PolarHBondContact O-N 2.94Å; L324-S327 PolarHBondContact O-N 3.41Å; L324-A328 PolarHBondContact O-N 3.3Å; L324-A328 VanDerWaalsContact O-N 3.13Å
325	L	98.1	Very high	96.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-47.4	176.9	-74.1	167.2	0	0	0	111.6	F119 V126 V308 K309 Y311 T321 D322 S327 A328 V329	F119-L325 HydrophobicContact CD2-CD2 3.8Å; F119-L325 HydrophobicContact CE2-CD2 3.81Å; V126-L325 HydrophobicContact CG2-CD1 4.12Å; V308-L325 HydrophobicContact CB-CD2 4.46Å; K309-L325 WeakPolarHBondContact O-CD2 3.43Å; Y311-L325 HydrophobicContact CD2-CD1 3.93Å; Y311-L325 HydrophobicContact CE2-CD1 3.74Å; T321-L325 HydrophobicContact CG2-CD1 4Å; T321-L325 WeakPolarHBondContact O-CB 3.45Å; T321-L325 WeakPolarHBondContact O-CG 3.31Å; T321-L325 PolarHBondContact O-N 3.18Å; D322-L325 PolarHBondContact O-N 3.49Å; L325-S327 VanDerWaalsContact C-N 3.35Å; L325-S327 PolarHBondContact O-N 3.12Å; L325-A328 WeakPolarHBondContact O-CB 3.42Å; L325-A328 PolarHBondContact O-N 2.92Å; L325-V329 WeakPolarHBondContact O-CG2 3.2Å; L325-V329 PolarHBondContact O-N 3.4Å; L325-V329 VanDerWaalsContact O-N 3.07Å
326	L	97.8	Very high	96.9	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-37.4	180	-69.8	167.3	0	0	0	111.9	K84 L87 M88 V126 F127 D322 A328 V329 D330	K84-L326 HydrophobicContact CG-CD1 4.13Å; L87-L326 HydrophobicContact CB-CB 3.74Å; L87-L326 HydrophobicContact CB-CD1 4.16Å; L87-L326 HydrophobicContact CD1-CB 3.99Å; L87-L326 HydrophobicContact CG-CB 4.44Å; M88-L326 HydrophobicContact CG-CD1 3.4Å; M88-L326 VanDerWaalsContact CG-CD1 3.4Å; M88-L326 HydrophobicContact CG-CD2 4.07Å; M88-L326 HydrophobicContact CG-CG 4.4Å; V126-L326 HydrophobicContact CG1-CD1 3.86Å; V126-L326 HydrophobicContact CG1-CD2 4.13Å; V126-L326 HydrophobicContact CG1-CG 4.03Å; F127-L326 HydrophobicContact CE2-CD2 3.96Å; F127-L326 HydrophobicContact CZ-CD2 3.72Å; D322-L326 VanDerWaalsContact O-CB 3.31Å; D322-L326 WeakPolarHBondContact O-CB 3.44Å; D322-L326 WeakPolarHBondContact O-CD1 3.44Å; D322-L326 WeakPolarHBondContact O-CG 3.48Å; D322-L326 PolarHBondContact O-N 3.37Å; L326-A328 VanDerWaalsContact C-N 3.29Å; L326-A328 PolarHBondContact O-N 2.87Å; L326-V329 PolarHBondContact O-N 3.43Å; L326-D330 WeakPolarHBondContact O-CB 3.09Å; L326-D330 PolarHBondContact O-N 3.42Å
327	S	97.2	Very high	97	Very high	33 Å²	33	22.4 Å²	22.4	23%	0.231	12%	0.116	C	C	.	.	H	α-helix	trans	-62.7	-37.6	174.5	-60.1	0	0	0	0	111.6	L87 V323 L324 L325 H331	L87-S327 WeakPolarHBondContact CD1-OG 3.28Å; V323-S327 VanDerWaalsContact O-CB 3.25Å; V323-S327 WeakPolarHBondContact O-CB 3.48Å; V323-S327 PolarHBondContact O-N 2.78Å; V323-S327 PolarHBondContact O-OG 3.39Å; L324-S327 PolarHBondContact O-N 3.41Å; L325-S327 VanDerWaalsContact C-N 3.35Å; L325-S327 PolarHBondContact O-N 3.12Å; S327-H331 WeakPolarHBondContact O-CB 3.49Å; S327-H331 PolarHBondContact O-N 3.48Å
328	A	97.9	Very high	96.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.1	-41	174.7	0	0	0	0	0	112.2	F119 L263 V306 V308 L324 L325 L326 H331 I332	F119-A328 HydrophobicContact CE2-CB 4.44Å; L263-A328 HydrophobicContact CD2-CB 3.91Å; V306-A328 HydrophobicContact CB-CB 4.49Å; V306-A328 HydrophobicContact CG1-CB 3.88Å; V308-A328 HydrophobicContact CG1-CB 3.54Å; L324-A328 PolarHBondContact O-N 3.3Å; L324-A328 VanDerWaalsContact O-N 3.13Å; L325-A328 WeakPolarHBondContact O-CB 3.42Å; L325-A328 PolarHBondContact O-N 2.92Å; L326-A328 VanDerWaalsContact C-N 3.29Å; L326-A328 PolarHBondContact O-N 2.87Å; A328-H331 PolarHBondContact O-N 3.21Å; A328-I332 WeakPolarHBondContact O-CD1 3.06Å; A328-I332 WeakPolarHBondContact O-CG1 3.27Å; A328-I332 PolarHBondContact O-N 3.21Å
329	V	97.8	Very high	96.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-44	175.6	178	0	0	0	0	111.3	V91 F119 V123 L165 L325 L326 H331 I332 L333	V91-V329 HydrophobicContact CB-CG1 4.49Å; V91-V329 HydrophobicContact CG1-CG1 3.82Å; V91-V329 HydrophobicContact CG2-CB 4.25Å; V91-V329 HydrophobicContact CG2-CG1 3.77Å; F119-V329 HydrophobicContact CE1-CG2 4.49Å; F119-V329 HydrophobicContact CZ-CG2 3.9Å; V123-V329 HydrophobicContact CG1-CG2 4.02Å; V123-V329 HydrophobicContact CG2-CG2 3.66Å; L165-V329 HydrophobicContact CD2-CG1 3.58Å; L325-V329 WeakPolarHBondContact O-CG2 3.2Å; L325-V329 PolarHBondContact O-N 3.4Å; L325-V329 VanDerWaalsContact O-N 3.07Å; L326-V329 PolarHBondContact O-N 3.43Å; V329-H331 VanDerWaalsContact C-N 3.31Å; V329-H331 PolarHBondContact O-N 2.82Å; V329-I332 WeakPolarHBondContact O-CB 3.41Å; V329-I332 PolarHBondContact O-N 3.34Å; V329-L333 HydrophobicContact CG1-CD1 4.39Å; V329-L333 WeakPolarHBondContact O-CG 3.28Å; V329-L333 PolarHBondContact O-N 3.46Å
330	D	96.3	Very high	96.7	Very high	42 Å²	42	19 Å²	19	23%	0.225	10%	0.096	C	C	.	.	H	α-helix	trans	-59.1	-43.9	175.5	-173.5	76.1	0	0	0	111.4	L87 L326 I332 L333 Q334	L87-D330 HydrophobicContact CD2-CB 3.93Å; L326-D330 WeakPolarHBondContact O-CB 3.09Å; L326-D330 PolarHBondContact O-N 3.42Å; D330-I332 VanDerWaalsContact C-N 3.35Å; D330-I332 PolarHBondContact O-N 3.49Å; D330-L333 WeakPolarHBondContact O-CB 3.26Å; D330-L333 PolarHBondContact O-N 3.32Å; D330-L333 VanDerWaalsContact O-N 3.11Å; D330-Q334 WeakPolarHBondContact O-CG 3.36Å; D330-Q334 PolarHBondContact O-N 3.47Å; D330-Q334 PolarHBondContact OD2-NE2 3.23Å
331	H	96.1	Very high	96.4	Very high	39 Å²	39	23.8 Å²	23.8	18%	0.181	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-41.7	175	-167.5	61.8	0	0	0	112.6	V306 S327 A328 V329 L333 Q334 Y335	V306-H331 HydrophobicContact CG2-CB 4.48Å; S327-H331 WeakPolarHBondContact O-CB 3.49Å; S327-H331 PolarHBondContact O-N 3.48Å; A328-H331 PolarHBondContact O-N 3.21Å; V329-H331 VanDerWaalsContact C-N 3.31Å; V329-H331 PolarHBondContact O-N 2.82Å; H331-L333 VanDerWaalsContact C-N 3.33Å; H331-L333 PolarHBondContact O-N 3.16Å; H331-Q334 WeakPolarHBondContact O-CB 3.23Å; H331-Q334 PolarHBondContact O-N 3.08Å; H331-Y335 AromaticContact CE1-CE2 3.62Å; H331-Y335 AromaticContact NE2-CE2 3.51Å; H331-Y335 WeakPolarHBondContact O-CD2 3.39Å; H331-Y335 PolarHBondContact O-N 3.33Å
332	I	97.9	Very high	95.9	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-58.7	-45.7	173	-73.7	160.3	0	0	0	110.8	V106 F119 A227 V261 L263 A328 V329 D330 Q334 Y335 V336	V106-I332 HydrophobicContact CB-CG2 4.23Å; V106-I332 HydrophobicContact CG1-CG2 3.73Å; V106-I332 HydrophobicContact CG2-CG2 3.55Å; F119-I332 HydrophobicContact CZ-CD1 4.45Å; A227-I332 HydrophobicContact CB-CD1 4.26Å; V261-I332 HydrophobicContact CG2-CG1 3.64Å; L263-I332 HydrophobicContact CD1-CD1 4.24Å; A328-I332 WeakPolarHBondContact O-CD1 3.06Å; A328-I332 WeakPolarHBondContact O-CG1 3.27Å; A328-I332 PolarHBondContact O-N 3.21Å; V329-I332 WeakPolarHBondContact O-CB 3.41Å; V329-I332 PolarHBondContact O-N 3.34Å; D330-I332 VanDerWaalsContact C-N 3.35Å; D330-I332 PolarHBondContact O-N 3.49Å; I332-Q334 VanDerWaalsContact C-N 3.29Å; I332-Q334 PolarHBondContact O-N 2.82Å; I332-Y335 PolarHBondContact O-N 3.2Å; I332-Y335 VanDerWaalsContact O-N 3.12Å; I332-V336 HydrophobicContact CG2-CG2 4.42Å; I332-V336 WeakPolarHBondContact O-CG2 3.45Å; I332-V336 PolarHBondContact O-N 3.46Å
333	L	96.7	Very high	95.2	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-35.9	-179.3	-70.7	176.7	0	0	0	112.3	V91 Y94 L165 V329 D330 H331 Y335 V336 D337	V91-L333 HydrophobicContact CB-CD1 4.41Å; V91-L333 HydrophobicContact CG1-CD1 4.46Å; V91-L333 HydrophobicContact CG2-CD1 4.08Å; Y94-L333 HydrophobicContact CD1-CD1 4.41Å; Y94-L333 HydrophobicContact CD1-CD2 3.62Å; Y94-L333 HydrophobicContact CD2-CB 4.32Å; Y94-L333 HydrophobicContact CD2-CD1 3.99Å; Y94-L333 HydrophobicContact CD2-CD2 4.06Å; Y94-L333 HydrophobicContact CD2-CG 4.36Å; Y94-L333 HydrophobicContact CE1-CD2 3.65Å; Y94-L333 HydrophobicContact CE2-CB 4.27Å; Y94-L333 HydrophobicContact CE2-CD2 4.08Å; Y94-L333 HydrophobicContact CG-CD1 3.85Å; Y94-L333 HydrophobicContact CG-CD2 3.84Å; Y94-L333 HydrophobicContact CG-CG 4.38Å; L165-L333 HydrophobicContact CB-CD2 4.27Å; L165-L333 HydrophobicContact CD1-CD2 3.89Å; L165-L333 HydrophobicContact CD2-CD2 4.07Å; L165-L333 HydrophobicContact CD2-CG 4.49Å; L165-L333 HydrophobicContact CG-CD2 4.29Å; V329-L333 HydrophobicContact CG1-CD1 4.39Å; V329-L333 WeakPolarHBondContact O-CG 3.28Å; V329-L333 PolarHBondContact O-N 3.46Å; D330-L333 WeakPolarHBondContact O-CB 3.26Å; D330-L333 PolarHBondContact O-N 3.32Å; D330-L333 VanDerWaalsContact O-N 3.11Å; H331-L333 VanDerWaalsContact C-N 3.33Å; H331-L333 PolarHBondContact O-N 3.16Å; L333-Y335 VanDerWaalsContact C-N 3.3Å; L333-Y335 PolarHBondContact O-N 3.09Å; L333-V336 WeakPolarHBondContact O-CB 3.42Å; L333-V336 PolarHBondContact O-N 3.29Å; L333-D337 PolarHBondContact O-N 3.16Å
334	Q	95.4	Very high	93.7	Very high	96 Å²	96	36.9 Å²	36.9	45%	0.449	19%	0.188	S	C	.	.	H	α-helix	trans	-58.1	-41.6	173.9	-66	169	24.4	0	0	111.7	D330 H331 I332 D337 I338	D330-Q334 WeakPolarHBondContact O-CG 3.36Å; D330-Q334 PolarHBondContact O-N 3.47Å; D330-Q334 PolarHBondContact OD2-NE2 3.23Å; H331-Q334 WeakPolarHBondContact O-CB 3.23Å; H331-Q334 PolarHBondContact O-N 3.08Å; I332-Q334 VanDerWaalsContact C-N 3.29Å; I332-Q334 PolarHBondContact O-N 2.82Å; Q334-D337 PolarHBondContact O-N 3.3Å; Q334-I338 WeakPolarHBondContact O-CG1 3.07Å; Q334-I338 PolarHBondContact O-N 3.15Å; Q334-I338 VanDerWaalsContact O-N 3.15Å
335	Y	95.8	Very high	91.6	Very high	30 Å²	30	40.7 Å²	40.7	12%	0.118	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-31.4	176.9	-77.9	-81.9	0	0	0	113.9	H259 V261 Y304 H331 I332 L333 D337 I338 F339	H259-Y335 HydrophobicContact CB-CD1 3.83Å; H259-Y335 HydrophobicContact CB-CG 4.32Å; V261-Y335 HydrophobicContact CG1-CD1 4.43Å; V261-Y335 HydrophobicContact CG1-CD2 3.13Å; V261-Y335 HydrophobicContact CG1-CE2 3.41Å; V261-Y335 VanDerWaalsContact CG1-CE2 3.41Å; V261-Y335 HydrophobicContact CG1-CG 3.7Å; Y304-Y335 AromaticContact CD1-CE1 3.98Å; Y304-Y335 HydrophobicContact CD1-CE1 3.98Å; Y304-Y335 AromaticContact CD1-CZ 3.62Å; Y304-Y335 WeakPolarHBondContact CD1-OH 2.87Å; Y304-Y335 AromaticContact CE1-CE1 3.61Å; Y304-Y335 HydrophobicContact CE1-CE1 3.61Å; Y304-Y335 AromaticContact CE1-CZ 3.56Å; Y304-Y335 WeakPolarHBondContact CE1-OH 3.12Å; H331-Y335 AromaticContact CE1-CE2 3.62Å; H331-Y335 AromaticContact NE2-CE2 3.51Å; H331-Y335 WeakPolarHBondContact O-CD2 3.39Å; H331-Y335 PolarHBondContact O-N 3.33Å; I332-Y335 PolarHBondContact O-N 3.2Å; I332-Y335 VanDerWaalsContact O-N 3.12Å; L333-Y335 VanDerWaalsContact C-N 3.3Å; L333-Y335 PolarHBondContact O-N 3.09Å; Y335-D337 VanDerWaalsContact C-N 3.28Å; Y335-I338 HydrophobicContact CD1-CD1 4.06Å; Y335-I338 HydrophobicContact CE1-CD1 4.33Å; Y335-I338 PolarHBondContact O-N 3.05Å; Y335-F339 PolarHBondContact O-N 2.95Å
336	V	96.4	Very high	89.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-41.3	169.9	168.8	0	0	0	0	110.3	Y94 A104 V106 H224 C225 I332 L333 F339 F340	Y94-V336 WeakPolarHBondContact OH-CG1 3.14Å; A104-V336 HydrophobicContact CB-CG1 3.34Å; A104-V336 HydrophobicContact CB-CG2 4.46Å; V106-V336 HydrophobicContact CG2-CG2 3.82Å; H224-V336 HydrophobicContact CB-CG1 4.35Å; C225-V336 HydrophobicContact CB-CG2 3.52Å; I332-V336 HydrophobicContact CG2-CG2 4.42Å; I332-V336 WeakPolarHBondContact O-CG2 3.45Å; I332-V336 PolarHBondContact O-N 3.46Å; L333-V336 WeakPolarHBondContact O-CB 3.42Å; L333-V336 PolarHBondContact O-N 3.29Å; V336-F339 WeakPolarHBondContact O-CB 3.33Å; V336-F339 PolarHBondContact O-N 3.49Å; V336-F340 HydrophobicContact CG1-CD2 3.83Å; V336-F340 HydrophobicContact CG1-CE2 3.41Å; V336-F340 VanDerWaalsContact CG1-CE2 3.41Å; V336-F340 HydrophobicContact CG1-CZ 4.45Å; V336-F340 WeakPolarHBondContact O-CD2 3.38Å; V336-F340 PolarHBondContact O-N 2.93Å; V336-F340 VanDerWaalsContact O-N 3.1Å
337	D	94.6	Very high	86.6	Confident	48 Å²	48	60 Å²	60	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-38	178	-74.6	-19.4	0	0	0	112.2	Y94 L333 Q334 Y335 F339 F340 Q341	Y94-D337 VanDerWaalsContact CE2-OD1 3.24Å; Y94-D337 WeakPolarHBondContact CE2-OD1 3.47Å; Y94-D337 PolarHBondContact OH-OD1 2.91Å; L333-D337 PolarHBondContact O-N 3.16Å; Q334-D337 PolarHBondContact O-N 3.3Å; Y335-D337 VanDerWaalsContact C-N 3.28Å; D337-F339 VanDerWaalsContact C-N 3.31Å; D337-F339 PolarHBondContact O-N 3.08Å; D337-F340 PolarHBondContact O-N 3.03Å; D337-Q341 VanDerWaalsContact O-CG 3.25Å; D337-Q341 WeakPolarHBondContact O-CG 3.32Å; D337-Q341 PolarHBondContact O-N 2.78Å
338	I	94.2	Very high	84.1	Confident	61 Å²	61	65 Å²	65	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-60.6	-43.3	172.4	-59.4	167.6	0	0	0	109.9	H259 Q334 Y335 F340 Q341 D342	H259-I338 WeakPolarHBondContact NE2-CG2 3.28Å; Q334-I338 WeakPolarHBondContact O-CG1 3.07Å; Q334-I338 PolarHBondContact O-N 3.15Å; Q334-I338 VanDerWaalsContact O-N 3.15Å; Y335-I338 HydrophobicContact CD1-CD1 4.06Å; Y335-I338 HydrophobicContact CE1-CD1 4.33Å; Y335-I338 PolarHBondContact O-N 3.05Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 3.43Å; I338-Q341 PolarHBondContact O-N 2.7Å; I338-Q341 VanDerWaalsContact O-N 3.14Å; I338-D342 PolarHBondContact O-N 2.96Å
339	F	95.3	Very high	81.4	Confident	11 Å²	11	68.6 Å²	68.6	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-54.9	-47.2	175	172.5	-87.8	0	0	0	111.7	L219 H224 G257 V258 H259 Y335 V336 D337 D342 Y343	L219-F339 HydrophobicContact CD1-CE1 4.01Å; L219-F339 HydrophobicContact CD1-CZ 4.05Å; H224-F339 HydrophobicContact CB-CD1 3.97Å; H224-F339 HydrophobicContact CB-CE1 4.3Å; H224-F339 HydrophobicContact CB-CG 4.38Å; H224-F339 AromaticContact CD2-CD1 3.73Å; H224-F339 AromaticContact CD2-CE1 3.4Å; H224-F339 WeakPolarHBondContact CD2-CE1 3.39Å; H224-F339 WeakPolarHBondContact O-CB 3.3Å; H224-F339 WeakPolarHBondContact O-CG 3.18Å; G257-F339 VanDerWaalsContact O-CD2 3.31Å; G257-F339 WeakPolarHBondContact O-CD2 3.18Å; V258-F339 HydrophobicContact CG2-CD2 4.32Å; V258-F339 HydrophobicContact CG2-CE2 3.89Å; H259-F339 PolarHBondContact CD2-N 3.38Å; Y335-F339 PolarHBondContact O-N 2.95Å; V336-F339 WeakPolarHBondContact O-CB 3.33Å; V336-F339 PolarHBondContact O-N 3.49Å; D337-F339 VanDerWaalsContact C-N 3.31Å; D337-F339 PolarHBondContact O-N 3.08Å; F339-D342 PolarHBondContact O-N 3.46Å; F339-Y343 HydrophobicContact CZ-CD2 4.36Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.38Å; F339-Y343 PolarHBondContact O-N 3.09Å
340	F	94.1	Very high	78.5	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.009	40%	0.398	C	S	.	.	H	α-helix	trans	-70.8	-30.4	179.4	-69.4	-60	0	0	0	113.4	P96 S97 C98 V101 A104 L219 H224 V336 D337 I338 A344	P96-F340 HydrophobicContact CB-CD2 4.16Å; P96-F340 HydrophobicContact CB-CE2 3.61Å; P96-F340 HydrophobicContact CB-CZ 3.86Å; P96-F340 HydrophobicContact CG-CE2 4.18Å; P96-F340 HydrophobicContact CG-CZ 4.36Å; S97-F340 WeakPolarHBondContact OG-CB 3.24Å; C98-F340 HydrophobicContact CB-CD1 3.56Å; C98-F340 HydrophobicContact CB-CE1 3.97Å; C98-F340 HydrophobicContact CB-CG 4.18Å; V101-F340 HydrophobicContact CB-CE1 3.98Å; V101-F340 HydrophobicContact CB-CZ 4.17Å; V101-F340 HydrophobicContact CG1-CE1 3.99Å; V101-F340 HydrophobicContact CG1-CZ 3.75Å; V101-F340 HydrophobicContact CG2-CE1 3.99Å; A104-F340 HydrophobicContact CB-CE2 4.13Å; A104-F340 HydrophobicContact CB-CZ 4.48Å; L219-F340 HydrophobicContact CD2-CE1 4.48Å; H224-F340 HydrophobicContact CB-CZ 4.33Å; H224-F340 AromaticContact CD2-CE1 3.25Å; H224-F340 WeakPolarHBondContact CD2-CE1 3.14Å; H224-F340 AromaticContact CD2-CZ 3.14Å; H224-F340 WeakPolarHBondContact CD2-CZ 3.45Å; H224-F340 AromaticContact CG-CZ 3.76Å; H224-F340 AromaticContact NE2-CE1 3.62Å; H224-F340 AromaticContact NE2-CZ 3.58Å; V336-F340 HydrophobicContact CG1-CD2 3.83Å; V336-F340 HydrophobicContact CG1-CE2 3.41Å; V336-F340 VanDerWaalsContact CG1-CE2 3.41Å; V336-F340 HydrophobicContact CG1-CZ 4.45Å; V336-F340 WeakPolarHBondContact O-CD2 3.38Å; V336-F340 PolarHBondContact O-N 2.93Å; V336-F340 VanDerWaalsContact O-N 3.1Å; D337-F340 PolarHBondContact O-N 3.03Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 3.43Å; F340-A344 VanDerWaalsContact O-CB 3.3Å; F340-A344 WeakPolarHBondContact O-CB 3.46Å; F340-A344 PolarHBondContact O-N 3.08Å
341	Q	91.3	Very high	75.9	Confident	129 Å²	129	82 Å²	82	60%	0.603	43%	0.429	S	S	*	.	H	α-helix	trans	-66.5	-42.1	173.2	-72.2	168.6	25.9	0	0	111.5	D337 I338 Y343	D337-Q341 VanDerWaalsContact O-CG 3.25Å; D337-Q341 WeakPolarHBondContact O-CG 3.32Å; D337-Q341 PolarHBondContact O-N 2.78Å; I338-Q341 PolarHBondContact O-N 2.7Å; I338-Q341 VanDerWaalsContact O-N 3.14Å; Q341-Y343 VanDerWaalsContact C-N 3.34Å
342	D	87.9	Confident	73.3	Confident	110 Å²	110	88.6 Å²	88.6	59%	0.588	46%	0.463	S	S	*	.	H	α-helix	trans	-70.3	-33.4	177.2	-67.1	-26.3	0	0	0	111.7	H259 I338 F339	H259-D342 IonicContact CE1-OD2 3.89Å; H259-D342 IonicContact NE2-OD2 3.79Å; H259-D342 PolarHBondContact NE2-OD2 3.47Å; I338-D342 PolarHBondContact O-N 2.96Å; F339-D342 PolarHBondContact O-N 3.46Å
343	Y	81.4	Confident	70.9	Confident	109 Å²	109	99.8 Å²	99.8	43%	0.427	52%	0.52	S	S	.	.	H	α-helix	trans	-78.5	-31.9	178	-168.8	-86.9	0	0	0	113.1	L219 F339 Q341 P345	L219-Y343 HydrophobicContact CD1-CD1 4.24Å; L219-Y343 HydrophobicContact CD1-CD2 3.89Å; L219-Y343 HydrophobicContact CD1-CE1 3.98Å; L219-Y343 HydrophobicContact CD1-CE2 3.57Å; L219-Y343 HydrophobicContact CD1-CG 4.21Å; L219-Y343 HydrophobicContact CD2-CD1 3.47Å; L219-Y343 VanDerWaalsContact CD2-CD1 3.47Å; L219-Y343 HydrophobicContact CD2-CE1 3.27Å; L219-Y343 HydrophobicContact CD2-CE2 4.43Å; L219-Y343 HydrophobicContact CD2-CG 4.17Å; L219-Y343 HydrophobicContact CG-CD1 4.49Å; L219-Y343 HydrophobicContact CG-CE1 4.15Å; F339-Y343 HydrophobicContact CZ-CD2 4.36Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.38Å; F339-Y343 PolarHBondContact O-N 3.09Å; Q341-Y343 VanDerWaalsContact C-N 3.34Å; Y343-P345 VanDerWaalsContact O-CD 3.29Å; Y343-P345 WeakPolarHBondContact O-CD 3.39Å
344	A	67.8	Low	69.6	Low	55 Å²	55	104.5 Å²	104.5	46%	0.455	55%	0.545	S	S	.	.	S	Bend	trans	-56.6	115.4	176.3	0	0	0	0	0	107.9	F340 R346	F340-A344 VanDerWaalsContact O-CB 3.3Å; F340-A344 WeakPolarHBondContact O-CB 3.46Å; F340-A344 PolarHBondContact O-N 3.08Å; A344-R346 PolarHBondContact O-N 3.08Å
345	P	53.4	Low	68.3	Low	81 Å²	81	104.9 Å²	104.9	53%	0.526	55%	0.55	S	S	.	.			trans	-57.7	145.8	-175.4	20.5	-31	0	0	0	109.2	Y343 H347	Y343-P345 VanDerWaalsContact O-CD 3.29Å; Y343-P345 WeakPolarHBondContact O-CD 3.39Å; P345-H347 HydrophobicContact CB-CB 4.29Å; P345-H347 WeakPolarHBondContact CB-CD2 3.5Å; P345-H347 HydrophobicContact CG-CB 4.28Å; P345-H347 WeakPolarHBondContact CG-CD2 3.42Å; P345-H347 PolarHBondContact O-N 3.39Å
346	R	48.7	Very low	66.7	Low	247 Å²	247	109.1 Å²	109.1	93%	0.932	57%	0.574	S	S	*	*			trans	-64.9	50	161.3	-57.9	-174	-163.6	-173.3	4.6	110.5	A344 T348	A344-R346 PolarHBondContact O-N 3.08Å; R346-T348 PolarHBondContact O-N 3.24Å
347	H	43.4	Very low	65	Low	160 Å²	160	115.5 Å²	115.5	74%	0.741	61%	0.607	S	S	*	*			trans	-81.8	65.9	172	-79.1	-39.2	0	0	0	109.4	P345	P345-H347 HydrophobicContact CB-CB 4.29Å; P345-H347 WeakPolarHBondContact CB-CD2 3.5Å; P345-H347 HydrophobicContact CG-CB 4.28Å; P345-H347 WeakPolarHBondContact CG-CD2 3.42Å; P345-H347 PolarHBondContact O-N 3.39Å
348	T	44	Very low	63.2	Low	140 Å²	140	119.8 Å²	119.8	86%	0.859	63%	0.629	S	S	*	*			trans	-148.5	121.8	151	43.8	0	0	0	0	108.7	R346	R346-T348 PolarHBondContact O-N 3.24Å
349	G	42	Very low	61.1	Low	74 Å²	74	123.7 Å²	123.7	76%	0.763	65%	0.65	S	S	*	*			trans	117	54.1	156.7	0	0	0	0	0	118.8
350	S	35.9	Very low	58.7	Low	119 Å²	119	131.7 Å²	131.7	83%	0.832	69%	0.693	S	S	*	*			trans	-147.4	71.7	142.4	-82.1	0	0	0	0	109.6
351	K	42.2	Very low	55.9	Low	204 Å²	204	141.7 Å²	141.7	89%	0.887	75%	0.746	S	S	*	*			trans	-83.3	97.3	145	-82.4	-174.1	174.9	-178	0	105.3	I353	K351-I353 PolarHBondContact O-N 3.25Å
352	M	40.1	Very low	53	Low	179 Å²	179	142.8 Å²	142.8	88%	0.882	76%	0.758	S	S	*	*			trans	-71.9	120.1	158.1	-71.8	-154.9	-71.2	0	0	106.5
353	I	48.9	Very low	49.8	Very low	235 Å²	235	145.7 Å²	145.7	100%	1.205	77%	0.774	S	S	*	*			trans	-77	0	162.4	-65.4	174.3	0	0	0	107.2	K351	K351-I353 PolarHBondContact O-N 3.25Å

Retrieved 353 of 353 residues in 2390.9 ms (Link to these results)

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