A0A060WZQ9_ONCMY Loading...

N-acetylglutamate synthase, mitochondrial

Plays a role in the regulation of ureagenesis by producing the essential cofactor N-acetylglutamate (NAG), thus modulating carbamoylphosphate synthase I (CPS1) activity.

AlphaFold DB , UniProt , Accession A0A060WZQ9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene nags, Length 522 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	27.7	Very low	244 Å²	244	135.2 Å²	135.2	100%	1.202	84%	0.84	S	S	*	*				0	127.9	0	-90.9	-178.9	162.7	0	0	108.6
2	A	27.1	Very low	27.6	Very low	104 Å²	104	141.8 Å²	141.8	86%	0.86	84%	0.837	S	S	*	*			trans	62.7	141.9	169.6	0	0	0	0	0	117.9
3	K	26.8	Very low	27.5	Very low	203 Å²	203	140.6 Å²	140.6	88%	0.883	83%	0.832	S	S	*	*			cis	-166.8	134	-22.7	-150.9	175.4	-174.5	179.6	0	105.1
4	V	29.4	Very low	27.4	Very low	116 Å²	116	142.1 Å²	142.1	70%	0.703	83%	0.829	S	S	*	*			trans	3.5	129.5	158.8	-174.7	0	0	0	0	119.7
5	N	24.3	Very low	27.4	Very low	172 Å²	172	141.6 Å²	141.6	92%	0.92	83%	0.828	S	S	*	*			trans	-150.9	101	133.2	-96.2	-18.7	0	0	0	109.7
6	S	27.7	Very low	27.5	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	83%	0.833	S	S	*	*			trans	-93.3	106.3	175.5	50.7	0	0	0	0	110.2
7	G	24.5	Very low	27.4	Very low	82 Å²	82	141.6 Å²	141.6	85%	0.845	83%	0.832	S	S	*	*			trans	-105.1	90.8	165.8	0	0	0	0	0	109.9
8	T	29.1	Very low	27.4	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	83%	0.831	S	S	*	*			trans	-88.4	112.4	176	41.7	0	0	0	0	110.9	S10	T8-S10 PolarHBondContact O-N 2.88Å
9	S	28.8	Very low	27.3	Very low	130 Å²	130	141.4 Å²	141.4	91%	0.909	83%	0.833	S	S	*	*			trans	-83.5	89.7	159.2	155.9	0	0	0	0	108.2
10	S	27.8	Very low	27.3	Very low	94 Å²	94	145.9 Å²	145.9	66%	0.657	84%	0.837	S	S	*	*			trans	-103.4	118.5	174.3	172.1	0	0	0	0	109.8	T8 R12	T8-S10 PolarHBondContact O-N 2.88Å; S10-R12 PolarHBondContact O-N 3.32Å
11	C	27	Very low	27.2	Very low	118 Å²	118	146.7 Å²	146.7	80%	0.797	84%	0.837	S	S	*	*			trans	-72.6	111.6	175.4	-149.3	0	0	0	0	109
12	R	26.8	Very low	27	Very low	214 Å²	214	141.5 Å²	141.5	81%	0.808	82%	0.82	S	S	*	*			trans	-114.4	102.5	165.5	-86.3	-173.2	174.4	-175.4	-0.6	108.7	S10 M14	S10-R12 PolarHBondContact O-N 3.32Å; R12-M14 PolarHBondContact O-N 2.97Å
13	V	26.5	Very low	27	Very low	127 Å²	127	143.9 Å²	143.9	77%	0.77	82%	0.818	S	S	*	*			trans	-84.7	97.6	164.4	176.3	0	0	0	0	107.2	V15	V13-V15 HydrophobicContact CG1-CG2 4.46Å
14	M	26.6	Very low	27.6	Very low	162 Å²	162	139.6 Å²	139.6	80%	0.798	81%	0.811	S	S	*	*			trans	-93.1	120.6	160.7	-92	-176.5	168.7	0	0	107.7	R12 M16	R12-M14 PolarHBondContact O-N 2.97Å; M14-M16 PolarHBondContact O-N 3.49Å
15	V	27.3	Very low	27.6	Very low	134 Å²	134	138.8 Å²	138.8	81%	0.812	81%	0.811	S	S	*	*			trans	-80.1	104.5	168.4	175.5	0	0	0	0	108	V13	V13-V15 HydrophobicContact CG1-CG2 4.46Å
16	M	28.6	Very low	28.3	Very low	185 Å²	185	136.5 Å²	136.5	91%	0.911	81%	0.805	S	S	*	*			trans	-95.6	116.2	162.6	-92.1	-89.2	-156	0	0	107.8	M14	M14-M16 PolarHBondContact O-N 3.49Å
17	A	25.6	Very low	28.2	Very low	99 Å²	99	135 Å²	135	82%	0.818	81%	0.806	S	S	*	*			trans	-154.3	122.8	161.3	0	0	0	0	0	109.9
18	G	27.1	Very low	28.2	Very low	78 Å²	78	139.7 Å²	139.7	80%	0.804	81%	0.81	S	S	*	*			trans	138.9	36.7	167.9	0	0	0	0	0	117.8
19	K	25.2	Very low	28.2	Very low	201 Å²	201	139.9 Å²	139.9	87%	0.874	81%	0.811	S	S	*	*			trans	-136.9	95.2	157.7	-82.3	-170.5	178.6	-179.5	0	110.1
20	Y	27.5	Very low	28.9	Very low	230 Å²	230	138.5 Å²	138.5	90%	0.902	80%	0.799	S	S	*	*			trans	-134.9	148.1	151.4	-84.3	-78.8	0	0	0	107.3
21	L	26.7	Very low	28.8	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	81%	0.809	S	S	*	*			trans	83.9	82.2	-166.5	-49.6	175	0	0	0	113.5
22	T	27.4	Very low	28.9	Very low	136 Å²	136	142.1 Å²	142.1	83%	0.834	81%	0.807	S	S	*	*				173	124	116.9	32.4	0	0	0	0	110.6
23	N	26.4	Very low	28.8	Very low	153 Å²	153	137.3 Å²	137.3	82%	0.818	81%	0.805	S	S	*	*			trans	174.8	152.7	147.7	-94.1	-6.2	0	0	0	108.8
24	P	38.9	Very low	28.8	Very low	114 Å²	114	139 Å²	139	74%	0.74	81%	0.805	S	S	*	*			cis	-133.5	141.6	39	23.2	1.7	0	0	0	116.1
25	S	29.5	Very low	28.9	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	80%	0.801	S	S	*	*				89.5	161	95.1	-57.1	0	0	0	0	115.2
26	P	40.3	Very low	28.8	Very low	124 Å²	124	143.1 Å²	143.1	81%	0.805	80%	0.797	S	S	*	*			cis	-136.4	159.2	-44.5	36.9	-19.9	0	0	0	114.8
27	G	24.5	Very low	28.6	Very low	68 Å²	68	141.8 Å²	141.8	70%	0.701	79%	0.79	S	S	*	*			trans	79.5	105.3	131.3	0	0	0	0	0	121.2
28	L	25.1	Very low	28.6	Very low	179 Å²	179	143.4 Å²	143.4	94%	0.937	78%	0.784	S	S	*	*				-164.5	135.8	127	-101	148.3	0	0	0	109.2
29	V	27.9	Very low	28.6	Very low	129 Å²	129	148.3 Å²	148.3	78%	0.782	78%	0.784	S	S	*	*			trans	-133.6	165	-172.9	-175.7	0	0	0	0	106.1
30	P	45	Very low	28.7	Very low	101 Å²	101	146.2 Å²	146.2	66%	0.656	78%	0.781	S	S	*	*			cis	-121	176.7	-35.1	30.3	-14	0	0	0	111.4
31	N	25.5	Very low	28.6	Very low	162 Å²	162	143.5 Å²	143.5	87%	0.866	78%	0.777	S	S	*	*			trans	-152	128.4	132	-103.2	-19.1	0	0	0	112.4
32	T	27.6	Very low	28.6	Very low	126 Å²	126	146.6 Å²	146.6	77%	0.773	78%	0.777	S	S	*	*			trans	-64.1	142.2	170.7	42.9	0	0	0	0	112
33	C	26.2	Very low	28.5	Very low	113 Å²	113	150.8 Å²	150.8	76%	0.764	78%	0.778	S	S	*	*				178.6	156.5	115.5	-142.3	0	0	0	0	113.5
34	H	26.3	Very low	28.4	Very low	163 Å²	163	150.9 Å²	150.9	76%	0.755	78%	0.777	S	S	*	*			trans	-20.8	134.8	175.8	-68	-53.2	0	0	0	120.6
35	R	27.5	Very low	27.8	Very low	194 Å²	194	149.9 Å²	149.9	73%	0.732	78%	0.778	S	S	*	*				74.2	113.4	75.7	-128.1	-165.4	-169.1	-176.2	4.3	114.3
36	R	25.8	Very low	27.6	Very low	188 Å²	188	150.5 Å²	150.5	71%	0.709	78%	0.783	S	S	*	*			trans	82.6	124.4	143	-86.9	178.1	-175	-169	0.1	120.9
37	M	24.9	Very low	26.9	Very low	157 Å²	157	148.6 Å²	148.6	77%	0.773	77%	0.773	S	S	*	*			trans	73.8	142.6	133.8	-79.1	-168.8	155.8	0	0	115.9
38	L	25.6	Very low	27	Very low	134 Å²	134	154.8 Å²	154.8	70%	0.702	78%	0.78	S	S	*	*			cis	-162.4	157.5	30.2	-111.6	137.3	0	0	0	109.6
39	K	26.5	Very low	27.2	Very low	181 Å²	181	150.3 Å²	150.3	79%	0.787	77%	0.769	S	S	*	*			trans	-4.5	141.6	153.4	-61.9	172.3	-177.9	178	0	119.6
40	L	26.8	Very low	27.2	Very low	156 Å²	156	151.3 Å²	151.3	82%	0.817	78%	0.775	S	S	*	*				-174.9	117.7	118.2	-121.9	81	0	0	0	108.7
41	Q	26.9	Very low	26.5	Very low	174 Å²	174	150.2 Å²	150.2	81%	0.813	78%	0.782	S	S	*	*				48.4	96.4	92	-90.8	-177.8	-21.2	0	0	116.8
42	R	25.6	Very low	26.6	Very low	228 Å²	228	152.4 Å²	152.4	86%	0.86	79%	0.787	S	S	*	*				54.4	137.2	118.5	-116.3	-180	-172.2	179	2.7	121.2
43	R	25.6	Very low	26.6	Very low	224 Å²	224	150.4 Å²	150.4	85%	0.845	79%	0.792	S	S	*	*			trans	87.2	149.7	157.1	-65.6	-173.1	175.1	-160.2	-0.9	115.9
44	L	25.4	Very low	26.6	Very low	154 Å²	154	148.5 Å²	148.5	81%	0.806	79%	0.791	S	S	*	*			cis	-179	151.1	-32.1	-130.6	157.9	0	0	0	103
45	A	24.7	Very low	26.7	Very low	93 Å²	93	151 Å²	151	77%	0.769	80%	0.8	S	S	*	*			trans	70.7	151.9	164.7	0	0	0	0	0	116.2
46	S	25.3	Very low	26.7	Very low	112 Å²	112	148.2 Å²	148.2	78%	0.783	81%	0.805	S	S	*	*			cis	176.2	155.2	-11.1	169.7	0	0	0	0	105.8
47	S	26.5	Very low	27.2	Very low	85 Å²	85	145.1 Å²	145.1	59%	0.594	81%	0.809	S	S	*	*			trans	97.1	113.7	142.1	-172.3	0	0	0	0	121
48	K	26.5	Very low	27.2	Very low	197 Å²	197	142.1 Å²	142.1	86%	0.857	81%	0.809	S	S	*	*			trans	64.6	146.3	132.4	-67	179.1	-176.6	179.6	0	118.2
49	A	29.3	Very low	27.5	Very low	86 Å²	86	143.5 Å²	143.5	71%	0.711	82%	0.816	S	S	*	*			cis	-164	150.4	8.6	0	0	0	0	0	111.1
50	V	27.9	Very low	27.4	Very low	149 Å²	149	139.4 Å²	139.4	90%	0.903	82%	0.816	S	S	*	*			trans	34.4	124.1	136.6	-169.8	0	0	0	0	121.3
51	G	29.6	Very low	27.5	Very low	78 Å²	78	140.7 Å²	140.7	80%	0.804	82%	0.818	S	S	*	*			trans	-176.7	101.8	153.1	0	0	0	0	0	111.6
52	Q	29	Very low	27.5	Very low	208 Å²	208	140.3 Å²	140.3	97%	0.972	82%	0.817	S	S	*	*			trans	-80.9	145	178.7	-87.4	-178.4	-15.8	0	0	112.4
53	G	27.6	Very low	27.6	Very low	84 Å²	84	138.6 Å²	138.6	87%	0.866	82%	0.818	S	S	*	*			trans	160.3	92.7	151.9	0	0	0	0	0	116.8
54	G	25.4	Very low	27.6	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	81%	0.814	S	S	*	*			trans	114.4	103.5	139.1	0	0	0	0	0	120.9
55	K	28.6	Very low	27.9	Very low	215 Å²	215	133.7 Å²	133.7	94%	0.935	81%	0.807	S	S	*	*			trans	79.4	114.1	143.6	-58.8	-177.7	179.5	178.8	0	120.3
56	T	26.6	Very low	28.3	Very low	136 Å²	136	135.3 Å²	135.3	83%	0.834	80%	0.803	S	S	*	*			trans	-67.7	166.6	171.7	12.8	0	0	0	0	113.4
57	P	37.6	Very low	28.8	Very low	123 Å²	123	139.5 Å²	139.5	80%	0.799	81%	0.808	S	S	*	*			cis	-149.9	179.3	40.5	38.2	-14.8	0	0	0	118.8
58	A	24.2	Very low	29.5	Very low	93 Å²	93	140.6 Å²	140.6	77%	0.769	80%	0.802	S	S	*	*			trans	107.8	106.9	152.4	0	0	0	0	0	118.4
59	L	31.3	Very low	30.6	Very low	163 Å²	163	133.6 Å²	133.6	85%	0.853	78%	0.778	S	S	*	*			trans	10.9	109.7	162.4	-84.1	84.9	0	0	0	119.1
60	A	26	Very low	31.6	Very low	96 Å²	96	133 Å²	133	79%	0.793	77%	0.772	S	S	*	*			trans	-117.7	114.5	141.5	0	0	0	0	0	107.4	Q62	A60-Q62 PolarHBondContact O-N 2.79Å; A60-Q62 VanDerWaalsContact O-N 3.1Å
61	Q	28.6	Very low	32.4	Very low	183 Å²	183	129.8 Å²	129.8	86%	0.855	76%	0.757	S	S	*	*			trans	-61.5	110.5	169	-77.6	174.3	-34.4	0	0	107.8	E63	Q61-E63 PolarHBondContact O-N 3.02Å
62	Q	27	Very low	33	Very low	166 Å²	166	129.9 Å²	129.9	78%	0.776	74%	0.739	S	S	*	*			trans	-62.9	118.7	164.3	-82.7	176.4	-36.5	0	0	108.2	A60 F64	A60-Q62 PolarHBondContact O-N 2.79Å; A60-Q62 VanDerWaalsContact O-N 3.1Å; Q62-F64 PolarHBondContact O-N 3.41Å; Q62-F64 VanDerWaalsContact O-N 3.08Å
63	E	26	Very low	33.9	Very low	192 Å²	192	127.3 Å²	127.3	90%	0.897	72%	0.72	S	S	*	*			trans	-61.2	107.4	162.2	-72	-177.5	152.8	0	0	108.2	Q61	Q61-E63 PolarHBondContact O-N 3.02Å
64	F	25.7	Very low	35.1	Very low	171 Å²	171	130.8 Å²	130.8	75%	0.75	71%	0.709	S	S	*	*			trans	-63.5	128.6	162.6	-75	-88.9	0	0	0	107.8	Q62 N66	Q62-F64 PolarHBondContact O-N 3.41Å; Q62-F64 VanDerWaalsContact O-N 3.08Å; F64-N66 PolarHBondContact O-N 2.94Å
65	P	32.3	Very low	36.4	Very low	103 Å²	103	130.6 Å²	130.6	67%	0.669	69%	0.692	S	S	*	*			trans	-64.5	108	165.7	25.8	-28.5	0	0	0	106.5	F67	P65-F67 PolarHBondContact O-N 3.41Å
66	N	33.8	Very low	37.4	Very low	127 Å²	127	124.7 Å²	124.7	68%	0.679	67%	0.671	S	S	*	*			trans	-52.7	103.5	173.9	-81.1	-27.4	0	0	0	108.7	F64 F68	F64-N66 PolarHBondContact O-N 2.94Å; N66-F68 HydrophobicContact CB-CD2 4.36Å; N66-F68 HydrophobicContact CB-CE2 3.99Å; N66-F68 HydrophobicContact CB-CZ 4.31Å; N66-F68 WeakPolarHBondContact O-CD2 3.3Å; N66-F68 PolarHBondContact O-N 3.24Å
67	F	34.8	Very low	39	Very low	201 Å²	201	121.3 Å²	121.3	88%	0.882	65%	0.653	S	S	*	*			trans	-68.7	88.4	167.1	-97.9	-95.4	0	0	0	107.2	P65 S69	P65-F67 PolarHBondContact O-N 3.41Å; F67-S69 PolarHBondContact O-N 3.44Å
68	F	41.3	Very low	40.3	Very low	107 Å²	107	118.3 Å²	118.3	47%	0.469	63%	0.63	S	S	.	*			trans	-62.3	123.6	166.8	-69.9	-78.5	0	0	0	108.3	N66 D72 R73 L76	N66-F68 HydrophobicContact CB-CD2 4.36Å; N66-F68 HydrophobicContact CB-CE2 3.99Å; N66-F68 HydrophobicContact CB-CZ 4.31Å; N66-F68 WeakPolarHBondContact O-CD2 3.3Å; N66-F68 PolarHBondContact O-N 3.24Å; F68-D72 HydrophobicContact CB-CB 4.33Å; F68-D72 HydrophobicContact CD1-CB 4.17Å; F68-R73 HydrophobicContact CB-CG 4.04Å; F68-L76 HydrophobicContact CD1-CD1 4.4Å; F68-L76 HydrophobicContact CE1-CD1 4.45Å
69	S	50.8	Low	42.4	Very low	50 Å²	50	122.7 Å²	122.7	35%	0.35	63%	0.626	S	S	.	*			trans	-60.5	157.4	174.4	74.6	0	0	0	0	110	F67 S71 D72 R73	F67-S69 PolarHBondContact O-N 3.44Å; S69-S71 PolarHBondContact O-N 3.22Å; S69-S71 PolarHBondContact OG-N 3.5Å; S69-D72 WeakPolarHBondContact CB-OD2 3.31Å; S69-D72 PolarHBondContact N-OD2 3.06Å; S69-D72 PolarHBondContact O-N 3.35Å; S69-D72 VanDerWaalsContact O-N 3.1Å; S69-D72 VanDerWaalsContact OG-CG 3.24Å; S69-D72 PolarHBondContact OG-N 3.25Å; S69-D72 PolarHBondContact OG-OD2 3.28Å; S69-R73 PolarHBondContact O-N 3.02Å; S69-R73 VanDerWaalsContact O-N 3.08Å
70	A	49.3	Very low	44.7	Very low	73 Å²	73	119.3 Å²	119.3	60%	0.603	61%	0.613	S	S	*	*	H	α-helix	trans	-56	-33.5	173.5	0	0	0	0	0	111.5	R73 Y74	A70-R73 PolarHBondContact O-N 2.95Å; A70-Y74 WeakPolarHBondContact O-CB 3.2Å; A70-Y74 PolarHBondContact O-N 3.46Å
71	S	45.8	Very low	47.3	Very low	83 Å²	83	116.3 Å²	116.3	58%	0.58	58%	0.583	S	S	*	*	H	α-helix	trans	-64.9	-42.4	174.5	-51.5	0	0	0	0	112.6	S69 Y74 V75	S69-S71 PolarHBondContact O-N 3.22Å; S69-S71 PolarHBondContact OG-N 3.5Å; S71-Y74 WeakPolarHBondContact O-CB 3.45Å; S71-Y74 PolarHBondContact O-N 2.68Å; S71-V75 VanDerWaalsContact O-CG2 3.3Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.19Å
72	D	41.4	Very low	49.8	Very low	79 Å²	79	112.7 Å²	112.7	42%	0.422	57%	0.569	S	S	.	*	H	α-helix	trans	-67.3	-38.9	177.1	-65.7	-50	0	0	0	111.9	F68 S69 Y74 V75 L76	F68-D72 HydrophobicContact CB-CB 4.33Å; F68-D72 HydrophobicContact CD1-CB 4.17Å; S69-D72 WeakPolarHBondContact CB-OD2 3.31Å; S69-D72 PolarHBondContact N-OD2 3.06Å; S69-D72 PolarHBondContact O-N 3.35Å; S69-D72 VanDerWaalsContact O-N 3.1Å; S69-D72 VanDerWaalsContact OG-CG 3.24Å; S69-D72 PolarHBondContact OG-N 3.25Å; S69-D72 PolarHBondContact OG-OD2 3.28Å; D72-Y74 VanDerWaalsContact C-N 3.32Å; D72-Y74 PolarHBondContact O-N 2.95Å; D72-V75 PolarHBondContact O-N 3.18Å; D72-L76 WeakPolarHBondContact O-CB 3.34Å; D72-L76 WeakPolarHBondContact O-CD1 3.47Å; D72-L76 PolarHBondContact O-N 3.4Å
73	R	48.4	Very low	52.5	Low	155 Å²	155	112.7 Å²	112.7	59%	0.585	56%	0.562	S	S	*	*	H	α-helix	trans	-63.4	-38.7	173.7	-73.3	-175.2	-77	-156.9	-2.4	111.7	F68 S69 A70 S77	F68-R73 HydrophobicContact CB-CG 4.04Å; S69-R73 PolarHBondContact O-N 3.02Å; S69-R73 VanDerWaalsContact O-N 3.08Å; A70-R73 PolarHBondContact O-N 2.95Å; R73-S77 VanDerWaalsContact O-CB 3.3Å; R73-S77 WeakPolarHBondContact O-CB 3.43Å; R73-S77 PolarHBondContact O-N 3.39Å; R73-S77 PolarHBondContact O-OG 3.17Å
74	Y	52.5	Low	55.3	Low	157 Å²	157	107.4 Å²	107.4	62%	0.616	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-43.2	176.3	-168.2	-100.5	0	0	0	112	A70 S71 D72 S77 N78	A70-Y74 WeakPolarHBondContact O-CB 3.2Å; A70-Y74 PolarHBondContact O-N 3.46Å; S71-Y74 WeakPolarHBondContact O-CB 3.45Å; S71-Y74 PolarHBondContact O-N 2.68Å; D72-Y74 VanDerWaalsContact C-N 3.32Å; D72-Y74 PolarHBondContact O-N 2.95Å; Y74-S77 PolarHBondContact O-N 2.96Å; Y74-N78 WeakPolarHBondContact CE1-ND2 3.38Å; Y74-N78 WeakPolarHBondContact O-CB 3.21Å; Y74-N78 PolarHBondContact O-N 2.89Å
75	V	52.8	Low	58.2	Low	70 Å²	70	99.8 Å²	99.8	42%	0.424	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-41.9	176.2	173.9	0	0	0	0	111.9	S71 D72 N78 R79	S71-V75 VanDerWaalsContact O-CG2 3.3Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.19Å; D72-V75 PolarHBondContact O-N 3.18Å; V75-N78 PolarHBondContact O-N 3.45Å; V75-R79 WeakPolarHBondContact O-CB 3.37Å; V75-R79 WeakPolarHBondContact O-CG 3.38Å; V75-R79 PolarHBondContact O-N 3.02Å
76	L	48.6	Very low	60.8	Low	91 Å²	91	98.4 Å²	98.4	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-40.8	174.3	-88.1	148.1	0	0	0	112.2	F68 D72 R79 T80	F68-L76 HydrophobicContact CD1-CD1 4.4Å; F68-L76 HydrophobicContact CE1-CD1 4.45Å; D72-L76 WeakPolarHBondContact O-CB 3.34Å; D72-L76 WeakPolarHBondContact O-CD1 3.47Å; D72-L76 PolarHBondContact O-N 3.4Å; L76-R79 PolarHBondContact O-N 2.95Å; L76-T80 WeakPolarHBondContact O-CB 3.44Å; L76-T80 PolarHBondContact O-N 3.27Å; L76-T80 PolarHBondContact O-OG1 2.85Å
77	S	61.8	Low	63.3	Low	65 Å²	65	97.7 Å²	97.7	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-65.7	-44.6	177.4	-58.2	0	0	0	0	111	R73 Y74 T80 L81	R73-S77 VanDerWaalsContact O-CB 3.3Å; R73-S77 WeakPolarHBondContact O-CB 3.43Å; R73-S77 PolarHBondContact O-N 3.39Å; R73-S77 PolarHBondContact O-OG 3.17Å; Y74-S77 PolarHBondContact O-N 2.96Å; S77-T80 PolarHBondContact O-N 3.41Å; S77-L81 WeakPolarHBondContact O-CG 3.44Å; S77-L81 PolarHBondContact O-N 2.82Å
78	N	64.6	Low	65.6	Low	60 Å²	60	88.7 Å²	88.7	32%	0.321	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-41.9	175.9	-78.6	-7.1	0	0	0	112.6	Y74 V75 T80 L81 I82	Y74-N78 WeakPolarHBondContact CE1-ND2 3.38Å; Y74-N78 WeakPolarHBondContact O-CB 3.21Å; Y74-N78 PolarHBondContact O-N 2.89Å; V75-N78 PolarHBondContact O-N 3.45Å; N78-T80 VanDerWaalsContact C-N 3.3Å; N78-T80 PolarHBondContact O-N 3.03Å; N78-L81 PolarHBondContact O-N 3.2Å; N78-I82 VanDerWaalsContact O-CG1 3.26Å; N78-I82 WeakPolarHBondContact O-CG1 3.3Å; N78-I82 PolarHBondContact O-N 2.74Å
79	R	68.6	Low	67.8	Low	184 Å²	184	84.6 Å²	84.6	69%	0.694	43%	0.427	S	S	*	.	H	α-helix	trans	-62.3	-38.7	175.1	-77.3	-179.4	176.6	-174.5	0.5	112.3	V75 L76 Y83	V75-R79 WeakPolarHBondContact O-CB 3.37Å; V75-R79 WeakPolarHBondContact O-CG 3.38Å; V75-R79 PolarHBondContact O-N 3.02Å; L76-R79 PolarHBondContact O-N 2.95Å; R79-Y83 WeakPolarHBondContact O-CB 3.49Å; R79-Y83 PolarHBondContact O-N 3.1Å
80	T	78.7	Confident	69.4	Low	93 Å²	93	87.7 Å²	87.7	57%	0.571	44%	0.439	S	S	*	.	H	α-helix	trans	-67.9	-39.9	178.2	-52	0	0	0	0	111.2	L76 S77 N78 R84	L76-T80 WeakPolarHBondContact O-CB 3.44Å; L76-T80 PolarHBondContact O-N 3.27Å; L76-T80 PolarHBondContact O-OG1 2.85Å; S77-T80 PolarHBondContact O-N 3.41Å; N78-T80 VanDerWaalsContact C-N 3.3Å; N78-T80 PolarHBondContact O-N 3.03Å; T80-R84 WeakPolarHBondContact O-CB 3.34Å; T80-R84 PolarHBondContact O-N 3.47Å
81	L	80.2	Confident	71.2	Confident	33 Å²	33	89.6 Å²	89.6	17%	0.173	44%	0.439	C	S	.	.	H	α-helix	trans	-64.6	-48.6	175.2	-73.4	169.7	0	0	0	111.9	S77 N78 Y83 R84 D85	S77-L81 WeakPolarHBondContact O-CG 3.44Å; S77-L81 PolarHBondContact O-N 2.82Å; N78-L81 PolarHBondContact O-N 3.2Å; L81-Y83 VanDerWaalsContact C-N 3.33Å; L81-Y83 PolarHBondContact O-N 3.25Å; L81-R84 WeakPolarHBondContact O-CB 3.43Å; L81-R84 PolarHBondContact O-N 2.85Å; L81-R84 VanDerWaalsContact O-N 3.15Å; L81-D85 VanDerWaalsContact O-CG 3.23Å; L81-D85 PolarHBondContact O-N 2.97Å
82	I	81.4	Confident	73.1	Confident	107 Å²	107	88.1 Å²	88.1	55%	0.549	42%	0.423	S	S	.	.	H	α-helix	trans	-59.1	-45.9	177.5	-67.1	164.2	0	0	0	110.5	N78 R84 D85 V86	N78-I82 VanDerWaalsContact O-CG1 3.26Å; N78-I82 WeakPolarHBondContact O-CG1 3.3Å; N78-I82 PolarHBondContact O-N 2.74Å; I82-R84 VanDerWaalsContact C-N 3.33Å; I82-R84 PolarHBondContact O-N 3.18Å; I82-D85 PolarHBondContact O-N 3.36Å; I82-V86 HydrophobicContact CG2-CG2 4.27Å; I82-V86 WeakPolarHBondContact O-CB 3.15Å; I82-V86 VanDerWaalsContact O-CG2 3.31Å; I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 2.99Å
83	Y	83.4	Confident	75	Confident	165 Å²	165	85.3 Å²	85.3	65%	0.647	41%	0.407	S	S	*	.	H	α-helix	trans	-61.3	-42.5	177.5	-178.4	-94.4	0	0	0	112	R79 L81 D85 K87	R79-Y83 WeakPolarHBondContact O-CB 3.49Å; R79-Y83 PolarHBondContact O-N 3.1Å; L81-Y83 VanDerWaalsContact C-N 3.33Å; L81-Y83 PolarHBondContact O-N 3.25Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-K87 HydrophobicContact CE1-CD 4.3Å; Y83-K87 VanDerWaalsContact O-CB 3.23Å; Y83-K87 WeakPolarHBondContact O-CB 3.27Å; Y83-K87 PolarHBondContact O-N 2.94Å
84	R	85.8	Confident	76	Confident	81 Å²	81	79.6 Å²	79.6	31%	0.306	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-44.6	176.1	-175.4	-179.1	71	159.8	9	111.3	T80 L81 I82 K87 A88 F139 H191	T80-R84 WeakPolarHBondContact O-CB 3.34Å; T80-R84 PolarHBondContact O-N 3.47Å; L81-R84 WeakPolarHBondContact O-CB 3.43Å; L81-R84 PolarHBondContact O-N 2.85Å; L81-R84 VanDerWaalsContact O-N 3.15Å; I82-R84 VanDerWaalsContact C-N 3.33Å; I82-R84 PolarHBondContact O-N 3.18Å; R84-K87 PolarHBondContact O-N 3.38Å; R84-A88 WeakPolarHBondContact O-CB 3.32Å; R84-A88 PolarHBondContact O-N 3.25Å; R84-F139 HydrophobicContact CG-CE2 3.92Å; R84-F139 HydrophobicContact CG-CZ 4.35Å; R84-H191 PolarHBondContact NH1-ND1 3.42Å
85	D	86.1	Confident	76.9	Confident	11 Å²	11	76.4 Å²	76.4	6%	0.059	41%	0.412	C	S	.	.	H	α-helix	trans	-69.6	-45.4	-178.2	-68.2	-16.7	0	0	0	111.8	L81 I82 Y83 K87 A88 F89 F143 R146	L81-D85 VanDerWaalsContact O-CG 3.23Å; L81-D85 PolarHBondContact O-N 2.97Å; I82-D85 PolarHBondContact O-N 3.36Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; D85-K87 VanDerWaalsContact C-N 3.31Å; D85-K87 PolarHBondContact O-N 3.21Å; D85-A88 PolarHBondContact O-N 3.38Å; D85-F89 WeakPolarHBondContact O-CB 3.4Å; D85-F89 PolarHBondContact O-N 3.48Å; D85-F143 HydrophobicContact CB-CD2 3.71Å; D85-F143 HydrophobicContact CB-CE2 3.78Å; D85-F143 WeakPolarHBondContact O-CE2 3.43Å; D85-R146 IonicContact OD1-CZ 3.99Å; D85-R146 IonicContact OD1-NE 2.93Å; D85-R146 IonicContact OD1-NH2 3.43Å; D85-R146 PolarHBondContact OD1-NH2 2.7Å; D85-R146 IonicContact OD2-CZ 3.87Å; D85-R146 IonicContact OD2-NE 2.85Å; D85-R146 PolarHBondContact OD2-NE 2.94Å; D85-R146 IonicContact OD2-NH2 3.79Å; D85-R146 PolarHBondContact OD2-NH2 3.21Å
86	V	85.9	Confident	77.8	Confident	75 Å²	75	75.1 Å²	75.1	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-59.8	-44.7	174.5	171.5	0	0	0	0	110.4	I82 A88 F89 L90	I82-V86 HydrophobicContact CG2-CG2 4.27Å; I82-V86 WeakPolarHBondContact O-CB 3.15Å; I82-V86 VanDerWaalsContact O-CG2 3.31Å; I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 2.99Å; V86-A88 PolarHBondContact O-N 2.98Å; V86-F89 PolarHBondContact O-N 3.46Å; V86-L90 HydrophobicContact CG1-CD1 3.81Å; V86-L90 HydrophobicContact CG1-CG 4.32Å; V86-L90 WeakPolarHBondContact O-CB 3.42Å; V86-L90 VanDerWaalsContact O-CG 3.25Å; V86-L90 WeakPolarHBondContact O-CG 3.41Å; V86-L90 PolarHBondContact O-N 3.08Å
87	K	86.7	Confident	79.1	Confident	112 Å²	112	75.8 Å²	75.8	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-62	-43.3	176.9	-176.8	178.5	177.8	-178.1	0	111.6	Y83 R84 D85 N91	Y83-K87 HydrophobicContact CE1-CD 4.3Å; Y83-K87 VanDerWaalsContact O-CB 3.23Å; Y83-K87 WeakPolarHBondContact O-CB 3.27Å; Y83-K87 PolarHBondContact O-N 2.94Å; R84-K87 PolarHBondContact O-N 3.38Å; D85-K87 VanDerWaalsContact C-N 3.31Å; D85-K87 PolarHBondContact O-N 3.21Å; K87-N91 WeakPolarHBondContact O-CB 3.48Å; K87-N91 PolarHBondContact O-N 2.91Å; K87-N91 PolarHBondContact O-ND2 3.34Å; K87-N91 PolarHBondContact O-OD1 3.08Å
88	A	84	Confident	79.7	Confident	12 Å²	12	81.4 Å²	81.4	10%	0.099	42%	0.423	C	S	.	.	H	α-helix	trans	-61.7	-52.5	176.3	0	0	0	0	0	110.9	R84 D85 V86 L90 N91 E92 F139	R84-A88 WeakPolarHBondContact O-CB 3.32Å; R84-A88 PolarHBondContact O-N 3.25Å; D85-A88 PolarHBondContact O-N 3.38Å; V86-A88 PolarHBondContact O-N 2.98Å; A88-L90 VanDerWaalsContact C-N 3.31Å; A88-L90 PolarHBondContact O-N 3.1Å; A88-N91 WeakPolarHBondContact O-CB 3.37Å; A88-N91 PolarHBondContact O-N 2.84Å; A88-E92 WeakPolarHBondContact O-CG 3.34Å; A88-E92 PolarHBondContact O-N 3.41Å; A88-F139 HydrophobicContact CB-CE1 3.67Å; A88-F139 HydrophobicContact CB-CZ 3.5Å
89	F	86.1	Confident	80.3	Confident	20 Å²	20	78.8 Å²	78.8	9%	0.088	41%	0.409	C	S	.	.	H	α-helix	trans	-53.1	-46.1	177.3	178	-113	0	0	0	113	D85 V86 N91 E92 I93 W103 L104 F107 F143 F343	D85-F89 WeakPolarHBondContact O-CB 3.4Å; D85-F89 PolarHBondContact O-N 3.48Å; V86-F89 PolarHBondContact O-N 3.46Å; F89-N91 VanDerWaalsContact C-N 3.32Å; F89-N91 PolarHBondContact O-N 2.94Å; F89-E92 PolarHBondContact O-N 3.04Å; F89-I93 HydrophobicContact CD1-CD1 3.77Å; F89-I93 HydrophobicContact CD2-CD1 3.58Å; F89-I93 HydrophobicContact CD2-CG1 4.27Å; F89-I93 HydrophobicContact CE1-CD1 3.29Å; F89-I93 HydrophobicContact CE2-CD1 3.06Å; F89-I93 HydrophobicContact CE2-CG1 4Å; F89-I93 HydrophobicContact CG-CD1 3.93Å; F89-I93 HydrophobicContact CZ-CD1 2.93Å; F89-I93 HydrophobicContact CZ-CG1 4.26Å; F89-I93 PolarHBondContact O-N 3.04Å; F89-W103 HydrophobicContact CE2-CB 3.79Å; F89-W103 HydrophobicContact CE2-CG 4.49Å; F89-W103 HydrophobicContact CZ-CB 3.93Å; F89-L104 HydrophobicContact CE1-CD2 4.23Å; F89-L104 HydrophobicContact CZ-CD2 4.36Å; F89-L104 HydrophobicContact CZ-CG 4.42Å; F89-F107 AromaticContact CD2-CE2 3.85Å; F89-F107 HydrophobicContact CD2-CE2 3.85Å; F89-F107 AromaticContact CD2-CZ 3.76Å; F89-F107 HydrophobicContact CD2-CZ 3.76Å; F89-F107 HydrophobicContact CE1-CE2 4.24Å; F89-F107 AromaticContact CE2-CE2 3.24Å; F89-F107 HydrophobicContact CE2-CE2 3.24Å; F89-F107 AromaticContact CE2-CZ 3.33Å; F89-F107 HydrophobicContact CE2-CZ 3.33Å; F89-F107 HydrophobicContact CZ-CD2 4.44Å; F89-F107 AromaticContact CZ-CE2 3.44Å; F89-F107 HydrophobicContact CZ-CE2 3.44Å; F89-F107 VanDerWaalsContact CZ-CE2 3.44Å; F89-F107 HydrophobicContact CZ-CZ 4.03Å; F89-F143 HydrophobicContact CB-CE2 4.18Å; F89-F143 HydrophobicContact CB-CZ 4.04Å; F89-F143 HydrophobicContact CD2-CZ 4.27Å; F89-F343 HydrophobicContact CD2-CD2 4.31Å; F89-F343 HydrophobicContact CD2-CE2 4.47Å
90	L	85.6	Confident	80.9	Confident	115 Å²	115	71.3 Å²	71.3	60%	0.602	39%	0.387	S	S	*	.	H	α-helix	trans	-70.3	-25.1	178.1	-68.3	175.7	0	0	0	113.9	V86 A88	V86-L90 HydrophobicContact CG1-CD1 3.81Å; V86-L90 HydrophobicContact CG1-CG 4.32Å; V86-L90 WeakPolarHBondContact O-CB 3.42Å; V86-L90 VanDerWaalsContact O-CG 3.25Å; V86-L90 WeakPolarHBondContact O-CG 3.41Å; V86-L90 PolarHBondContact O-N 3.08Å; A88-L90 VanDerWaalsContact C-N 3.31Å; A88-L90 PolarHBondContact O-N 3.1Å
91	N	86.6	Confident	81	Confident	114 Å²	114	76.1 Å²	76.1	61%	0.61	40%	0.395	S	S	*	.	H	α-helix	trans	-77.2	-31.3	173.8	-73.2	-16.4	0	0	0	112	K87 A88 F89	K87-N91 WeakPolarHBondContact O-CB 3.48Å; K87-N91 PolarHBondContact O-N 2.91Å; K87-N91 PolarHBondContact O-ND2 3.34Å; K87-N91 PolarHBondContact O-OD1 3.08Å; A88-N91 WeakPolarHBondContact O-CB 3.37Å; A88-N91 PolarHBondContact O-N 2.84Å; F89-N91 VanDerWaalsContact C-N 3.32Å; F89-N91 PolarHBondContact O-N 2.94Å
92	E	85.6	Confident	81.2	Confident	51 Å²	51	80.1 Å²	80.1	24%	0.238	41%	0.408	C	S	.	.	H	α-helix	trans	-84.3	-37.3	-178.3	-62	-52.6	149.2	0	0	112.9	A88 F89 G94 L339 T340 F343	A88-E92 WeakPolarHBondContact O-CG 3.34Å; A88-E92 PolarHBondContact O-N 3.41Å; F89-E92 PolarHBondContact O-N 3.04Å; E92-G94 PolarHBondContact O-N 2.78Å; E92-L339 HydrophobicContact CG-CB 3.85Å; E92-T340 WeakPolarHBondContact OE2-CA 3.34Å; E92-T340 VanDerWaalsContact OE2-CB 3.23Å; E92-T340 WeakPolarHBondContact OE2-CB 3.26Å; E92-T340 PolarHBondContact OE2-N 2.85Å; E92-T340 PolarHBondContact OE2-OG1 3.16Å; E92-F343 HydrophobicContact CB-CB 4.24Å; E92-F343 HydrophobicContact CB-CD2 4.24Å
93	I	80.6	Confident	81.3	Confident	20 Å²	20	75.6 Å²	75.6	10%	0.103	38%	0.384	C	S	.	.	S	Bend	trans	-67.7	132.2	175.5	-72.2	166.4	0	0	0	109.8	F89 E99 A100 F343	F89-I93 HydrophobicContact CD1-CD1 3.77Å; F89-I93 HydrophobicContact CD2-CD1 3.58Å; F89-I93 HydrophobicContact CD2-CG1 4.27Å; F89-I93 HydrophobicContact CE1-CD1 3.29Å; F89-I93 HydrophobicContact CE2-CD1 3.06Å; F89-I93 HydrophobicContact CE2-CG1 4Å; F89-I93 HydrophobicContact CG-CD1 3.93Å; F89-I93 HydrophobicContact CZ-CD1 2.93Å; F89-I93 HydrophobicContact CZ-CG1 4.26Å; F89-I93 PolarHBondContact O-N 3.04Å; I93-E99 HydrophobicContact CG2-CB 4.38Å; I93-E99 HydrophobicContact CG2-CG 4.03Å; I93-A100 HydrophobicContact CD1-CB 4.24Å; I93-A100 HydrophobicContact CG2-CB 4.08Å; I93-F343 HydrophobicContact CG1-CB 4.15Å
94	G	71	Confident	81.3	Confident	35 Å²	35	72 Å²	72	36%	0.361	38%	0.376	S	S	.	.			trans	-68.8	-179.4	175.4	0	0	0	0	0	112.7	E92 D96 E99	E92-G94 PolarHBondContact O-N 2.78Å; G94-D96 PolarHBondContact O-N 2.6Å; G94-E99 WeakPolarHBondContact CA-OE2 3.34Å; G94-E99 PolarHBondContact N-OE2 2.93Å
95	G	70.2	Confident	81.3	Confident	90 Å²	90	70.5 Å²	70.5	93%	0.928	38%	0.376	S	S	*	.	S	Bend	trans	-70.8	5.3	178.3	0	0	0	0	0	115.6	P97	G95-P97 WeakPolarHBondContact O-CD 3.43Å
96	D	71.9	Confident	81.2	Confident	44 Å²	44	71 Å²	71	24%	0.235	38%	0.378	C	S	.	.			trans	-89.9	113.6	-178.7	-168.6	-21.2	0	0	0	110.8	G94 R98 E99	G94-D96 PolarHBondContact O-N 2.6Å; D96-R98 PolarHBondContact O-N 2.95Å; D96-R98 VanDerWaalsContact OD1-CB 3.32Å; D96-R98 WeakPolarHBondContact OD1-CB 3.25Å; D96-R98 IonicContact OD1-CZ 3.15Å; D96-R98 PolarHBondContact OD1-N 2.92Å; D96-R98 IonicContact OD1-NE 3.77Å; D96-R98 PolarHBondContact OD1-NE 3.13Å; D96-R98 VanDerWaalsContact OD1-NE 3.12Å; D96-R98 IonicContact OD1-NH2 3.85Å; D96-R98 IonicContact OD2-CZ 3.87Å; D96-R98 IonicContact OD2-NE 2.76Å; D96-R98 PolarHBondContact OD2-NE 2.85Å; D96-R98 IonicContact OD2-NH2 2.88Å; D96-R98 PolarHBondContact OD2-NH2 2.81Å; D96-E99 HydrophobicContact CB-CB 4.4Å; D96-E99 WeakPolarHBondContact O-CB 3.47Å; D96-E99 PolarHBondContact O-N 2.84Å; D96-E99 VanDerWaalsContact O-N 3.1Å
97	P	75.5	Confident	81.1	Confident	104 Å²	104	68 Å²	68	68%	0.675	36%	0.359	S	S	*	.	H	α-helix	trans	-59.8	-22.5	179.1	-24	34.7	0	0	0	114.4	G95 E99 R101	G95-P97 WeakPolarHBondContact O-CD 3.43Å; P97-E99 VanDerWaalsContact C-N 3.34Å; P97-R101 WeakPolarHBondContact O-CB 3.36Å; P97-R101 PolarHBondContact O-N 2.97Å; P97-R101 VanDerWaalsContact O-N 3.13Å
98	R	74.8	Confident	81	Confident	184 Å²	184	69.5 Å²	69.5	69%	0.694	37%	0.367	S	S	*	.	H	α-helix	trans	-69.3	-35.2	178.5	-65.1	175.8	-69.2	-175.5	3	111.9	D96 R101 Y102	D96-R98 PolarHBondContact O-N 2.95Å; D96-R98 VanDerWaalsContact OD1-CB 3.32Å; D96-R98 WeakPolarHBondContact OD1-CB 3.25Å; D96-R98 IonicContact OD1-CZ 3.15Å; D96-R98 PolarHBondContact OD1-N 2.92Å; D96-R98 IonicContact OD1-NE 3.77Å; D96-R98 PolarHBondContact OD1-NE 3.13Å; D96-R98 VanDerWaalsContact OD1-NE 3.12Å; D96-R98 IonicContact OD1-NH2 3.85Å; D96-R98 IonicContact OD2-CZ 3.87Å; D96-R98 IonicContact OD2-NE 2.76Å; D96-R98 PolarHBondContact OD2-NE 2.85Å; D96-R98 IonicContact OD2-NH2 2.88Å; D96-R98 PolarHBondContact OD2-NH2 2.81Å; R98-R101 PolarHBondContact O-N 2.93Å; R98-Y102 WeakPolarHBondContact O-CB 3.43Å; R98-Y102 PolarHBondContact O-N 3.43Å
99	E	77.1	Confident	80.9	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.019	39%	0.388	C	S	.	.	H	α-helix	trans	-65.8	-48.7	177.2	177.9	172.2	-118.2	0	0	110.9	I93 G94 D96 P97 R101 Y102 W103 F343 S344 H345	I93-E99 HydrophobicContact CG2-CB 4.38Å; I93-E99 HydrophobicContact CG2-CG 4.03Å; G94-E99 WeakPolarHBondContact CA-OE2 3.34Å; G94-E99 PolarHBondContact N-OE2 2.93Å; D96-E99 HydrophobicContact CB-CB 4.4Å; D96-E99 WeakPolarHBondContact O-CB 3.47Å; D96-E99 PolarHBondContact O-N 2.84Å; D96-E99 VanDerWaalsContact O-N 3.1Å; P97-E99 VanDerWaalsContact C-N 3.34Å; E99-R101 VanDerWaalsContact C-N 3.32Å; E99-R101 PolarHBondContact O-N 2.96Å; E99-Y102 WeakPolarHBondContact O-CB 3.2Å; E99-Y102 PolarHBondContact O-N 2.88Å; E99-W103 PolarHBondContact O-N 3.37Å; E99-F343 VanDerWaalsContact CG-O 3.26Å; E99-F343 WeakPolarHBondContact CG-O 3.38Å; E99-S344 WeakPolarHBondContact OE1-CA 3.32Å; E99-H345 IonicContact OE1-CD2 3.86Å; E99-H345 PolarHBondContact OE1-CD2 3.48Å; E99-H345 IonicContact OE1-CG 3.75Å; E99-H345 PolarHBondContact OE1-N 2.92Å; E99-H345 IonicContact OE1-NE2 2.7Å
100	A	81.1	Confident	80.6	Confident	28 Å²	28	75.5 Å²	75.5	23%	0.231	39%	0.39	C	S	.	.	H	α-helix	trans	-56.6	-46.8	174.8	0	0	0	0	0	111.6	I93 Y102 W103 L104	I93-A100 HydrophobicContact CD1-CB 4.24Å; I93-A100 HydrophobicContact CG2-CB 4.08Å; A100-Y102 VanDerWaalsContact C-N 3.34Å; A100-Y102 PolarHBondContact O-N 2.76Å; A100-W103 PolarHBondContact O-N 3.36Å; A100-L104 WeakPolarHBondContact O-CB 3.49Å; A100-L104 VanDerWaalsContact O-CG 3.27Å; A100-L104 WeakPolarHBondContact O-CG 3.36Å; A100-L104 PolarHBondContact O-N 2.92Å
101	R	81.6	Confident	80.2	Confident	194 Å²	194	73.7 Å²	73.7	73%	0.732	39%	0.386	S	S	*	.	H	α-helix	trans	-64.6	-38.2	179.7	-168.7	174.5	-177.6	173.9	0.7	112.4	P97 R98 E99 T105	P97-R101 WeakPolarHBondContact O-CB 3.36Å; P97-R101 PolarHBondContact O-N 2.97Å; P97-R101 VanDerWaalsContact O-N 3.13Å; R98-R101 PolarHBondContact O-N 2.93Å; E99-R101 VanDerWaalsContact C-N 3.32Å; E99-R101 PolarHBondContact O-N 2.96Å; R101-T105 PolarHBondContact O-N 2.77Å; R101-T105 VanDerWaalsContact O-N 3.13Å; R101-T105 PolarHBondContact O-OG1 3.33Å
102	Y	83.4	Confident	79.8	Confident	116 Å²	116	73.6 Å²	73.6	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-59	-53.5	174.4	174.6	-94.8	0	0	0	110.8	R98 E99 A100 L104 T105 Q106	R98-Y102 WeakPolarHBondContact O-CB 3.43Å; R98-Y102 PolarHBondContact O-N 3.43Å; E99-Y102 WeakPolarHBondContact O-CB 3.2Å; E99-Y102 PolarHBondContact O-N 2.88Å; A100-Y102 VanDerWaalsContact C-N 3.34Å; A100-Y102 PolarHBondContact O-N 2.76Å; Y102-L104 PolarHBondContact O-N 2.91Å; Y102-T105 WeakPolarHBondContact O-CB 3.38Å; Y102-T105 PolarHBondContact O-N 2.63Å; Y102-T105 VanDerWaalsContact O-N 3.1Å; Y102-Q106 HydrophobicContact CD1-CG 4.21Å; Y102-Q106 HydrophobicContact CE1-CG 3.78Å; Y102-Q106 HydrophobicContact CE2-CG 4.4Å; Y102-Q106 WeakPolarHBondContact O-CG 3.41Å; Y102-Q106 PolarHBondContact O-N 3.15Å; Y102-Q106 PolarHBondContact OH-NE2 3.48Å
103	W	84.1	Confident	78.6	Confident	13 Å²	13	76 Å²	76	5%	0.049	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-38.5	-177.6	-75.6	111.8	0	0	0	113.9	F89 E99 A100 T105 Q106 F107 F118 M149 L342 F343	F89-W103 HydrophobicContact CE2-CB 3.79Å; F89-W103 HydrophobicContact CE2-CG 4.49Å; F89-W103 HydrophobicContact CZ-CB 3.93Å; E99-W103 PolarHBondContact O-N 3.37Å; A100-W103 PolarHBondContact O-N 3.36Å; W103-T105 PolarHBondContact O-N 2.81Å; W103-Q106 HydrophobicContact CE3-CB 4.06Å; W103-Q106 HydrophobicContact CE3-CG 4.24Å; W103-Q106 HydrophobicContact CZ3-CB 4.35Å; W103-Q106 HydrophobicContact CZ3-CG 4.4Å; W103-Q106 PolarHBondContact O-N 3.42Å; W103-F107 HydrophobicContact CB-CE2 4.39Å; W103-F107 HydrophobicContact CB-CZ 4.33Å; W103-F107 HydrophobicContact CE3-CE1 4.46Å; W103-F107 WeakPolarHBondContact O-CD2 3.37Å; W103-F107 VanDerWaalsContact O-CG 3.27Å; W103-F107 WeakPolarHBondContact O-CG 3.36Å; W103-F107 PolarHBondContact O-N 3.32Å; W103-F118 HydrophobicContact CH2-CE2 4.41Å; W103-F118 HydrophobicContact CH2-CZ 4.16Å; W103-F118 HydrophobicContact CZ3-CE2 4.07Å; W103-F118 AromaticContact CZ3-CZ 3.98Å; W103-F118 HydrophobicContact CZ3-CZ 3.98Å; W103-M149 HydrophobicContact CE3-CE 4.24Å; W103-M149 HydrophobicContact CZ3-CE 3.76Å; W103-L342 WeakPolarHBondContact CZ2-O 3.38Å; W103-F343 AromaticContact CD2-CD1 3.45Å; W103-F343 HydrophobicContact CD2-CD1 3.45Å; W103-F343 VanDerWaalsContact CD2-CD1 3.45Å; W103-F343 AromaticContact CD2-CE1 3.89Å; W103-F343 HydrophobicContact CD2-CE1 3.89Å; W103-F343 AromaticContact CE2-CD1 3.6Å; W103-F343 AromaticContact CE3-CD1 3.73Å; W103-F343 HydrophobicContact CE3-CD1 3.73Å; W103-F343 AromaticContact CE3-CE1 3.66Å; W103-F343 HydrophobicContact CE3-CE1 3.66Å; W103-F343 AromaticContact CG-CD1 3.85Å; W103-F343 HydrophobicContact CG-CD1 3.85Å; W103-F343 HydrophobicContact CG-CE1 4.49Å; W103-F343 HydrophobicContact CH2-CD1 4.28Å; W103-F343 HydrophobicContact CH2-CE1 4.38Å; W103-F343 HydrophobicContact CZ2-CD1 4.07Å; W103-F343 HydrophobicContact CZ3-CD1 4.13Å; W103-F343 AromaticContact CZ3-CE1 3.92Å; W103-F343 HydrophobicContact CZ3-CE1 3.92Å; W103-F343 AromaticContact NE1-CD1 3.94Å; W103-F343 PolarHBondContact NE1-O 2.77Å
104	L	84.3	Confident	78	Confident	90 Å²	90	83.8 Å²	83.8	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-58.6	-38.5	172.1	-71	172.2	0	0	0	111.9	F89 A100 Y102 F107 Q108	F89-L104 HydrophobicContact CE1-CD2 4.23Å; F89-L104 HydrophobicContact CZ-CD2 4.36Å; F89-L104 HydrophobicContact CZ-CG 4.42Å; A100-L104 WeakPolarHBondContact O-CB 3.49Å; A100-L104 VanDerWaalsContact O-CG 3.27Å; A100-L104 WeakPolarHBondContact O-CG 3.36Å; A100-L104 PolarHBondContact O-N 2.92Å; Y102-L104 PolarHBondContact O-N 2.91Å; L104-F107 HydrophobicContact CD2-CD2 4.32Å; L104-Q108 WeakPolarHBondContact O-CG 3.49Å; L104-Q108 PolarHBondContact O-N 2.76Å
105	T	85	Confident	78.1	Confident	49 Å²	49	82.7 Å²	82.7	30%	0.301	44%	0.438	S	S	.	.	H	α-helix	trans	-67.1	-39.2	175.1	-52.7	0	0	0	0	111.1	R101 Y102 W103 Q108 R109	R101-T105 PolarHBondContact O-N 2.77Å; R101-T105 VanDerWaalsContact O-N 3.13Å; R101-T105 PolarHBondContact O-OG1 3.33Å; Y102-T105 WeakPolarHBondContact O-CB 3.38Å; Y102-T105 PolarHBondContact O-N 2.63Å; Y102-T105 VanDerWaalsContact O-N 3.1Å; W103-T105 PolarHBondContact O-N 2.81Å; T105-Q108 PolarHBondContact O-N 2.92Å; T105-R109 WeakPolarHBondContact O-CG 3.46Å; T105-R109 PolarHBondContact O-N 3.02Å; T105-R109 VanDerWaalsContact O-N 3.08Å
106	Q	83.6	Confident	78.6	Confident	21 Å²	21	82.4 Å²	82.4	10%	0.098	42%	0.419	C	S	.	.	H	α-helix	trans	-66.5	-41.5	177	-63.1	-55	-27.6	0	0	112.2	Y102 W103 Q108 R109 A110	Y102-Q106 HydrophobicContact CD1-CG 4.21Å; Y102-Q106 HydrophobicContact CE1-CG 3.78Å; Y102-Q106 HydrophobicContact CE2-CG 4.4Å; Y102-Q106 WeakPolarHBondContact O-CG 3.41Å; Y102-Q106 PolarHBondContact O-N 3.15Å; Y102-Q106 PolarHBondContact OH-NE2 3.48Å; W103-Q106 HydrophobicContact CE3-CB 4.06Å; W103-Q106 HydrophobicContact CE3-CG 4.24Å; W103-Q106 HydrophobicContact CZ3-CB 4.35Å; W103-Q106 HydrophobicContact CZ3-CG 4.4Å; W103-Q106 PolarHBondContact O-N 3.42Å; Q106-Q108 VanDerWaalsContact C-N 3.3Å; Q106-Q108 PolarHBondContact O-N 2.94Å; Q106-R109 WeakPolarHBondContact O-CB 3.47Å; Q106-R109 PolarHBondContact O-N 3.29Å; Q106-R109 VanDerWaalsContact O-N 3.13Å; Q106-A110 WeakPolarHBondContact O-CB 2.97Å; Q106-A110 PolarHBondContact O-N 3.38Å
107	F	84.4	Confident	79.4	Confident	13 Å²	13	80.4 Å²	80.4	6%	0.057	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-41.9	175.1	-58.4	-35	0	0	0	111.7	F89 W103 L104 R109 A110 S111 F143 M147 M149 F343	F89-F107 AromaticContact CD2-CE2 3.85Å; F89-F107 HydrophobicContact CD2-CE2 3.85Å; F89-F107 AromaticContact CD2-CZ 3.76Å; F89-F107 HydrophobicContact CD2-CZ 3.76Å; F89-F107 HydrophobicContact CE1-CE2 4.24Å; F89-F107 AromaticContact CE2-CE2 3.24Å; F89-F107 HydrophobicContact CE2-CE2 3.24Å; F89-F107 AromaticContact CE2-CZ 3.33Å; F89-F107 HydrophobicContact CE2-CZ 3.33Å; F89-F107 HydrophobicContact CZ-CD2 4.44Å; F89-F107 AromaticContact CZ-CE2 3.44Å; F89-F107 HydrophobicContact CZ-CE2 3.44Å; F89-F107 VanDerWaalsContact CZ-CE2 3.44Å; F89-F107 HydrophobicContact CZ-CZ 4.03Å; W103-F107 HydrophobicContact CB-CE2 4.39Å; W103-F107 HydrophobicContact CB-CZ 4.33Å; W103-F107 HydrophobicContact CE3-CE1 4.46Å; W103-F107 WeakPolarHBondContact O-CD2 3.37Å; W103-F107 VanDerWaalsContact O-CG 3.27Å; W103-F107 WeakPolarHBondContact O-CG 3.36Å; W103-F107 PolarHBondContact O-N 3.32Å; L104-F107 HydrophobicContact CD2-CD2 4.32Å; F107-R109 VanDerWaalsContact C-N 3.3Å; F107-R109 PolarHBondContact O-N 2.82Å; F107-A110 PolarHBondContact O-N 3.45Å; F107-S111 PolarHBondContact O-N 2.96Å; F107-S111 PolarHBondContact O-OG 2.68Å; F107-F143 HydrophobicContact CZ-CE1 4.41Å; F107-F143 HydrophobicContact CZ-CZ 4.35Å; F107-M147 HydrophobicContact CB-CE 4.01Å; F107-M147 HydrophobicContact CD1-CB 4.11Å; F107-M147 HydrophobicContact CD1-CE 3.98Å; F107-M147 HydrophobicContact CD2-CE 3.32Å; F107-M147 HydrophobicContact CE1-CB 4.29Å; F107-M147 HydrophobicContact CE1-CE 4.26Å; F107-M147 HydrophobicContact CE1-CG 4.47Å; F107-M147 HydrophobicContact CE2-CE 3.61Å; F107-M147 HydrophobicContact CG-CE 3.52Å; F107-M147 HydrophobicContact CZ-CE 4.08Å; F107-M149 HydrophobicContact CD1-CE 4.23Å; F107-M149 HydrophobicContact CD1-CG 4.1Å; F107-M149 HydrophobicContact CD1-SD 3.57Å; F107-M149 VanDerWaalsContact CD1-SD 3.57Å; F107-M149 HydrophobicContact CE1-CE 4.1Å; F107-M149 HydrophobicContact CE1-CG 4.39Å; F107-M149 HydrophobicContact CE1-SD 3.32Å; F107-M149 WeakPolarHBondContact CE1-SD 3.49Å; F107-F343 HydrophobicContact CE1-CE1 4.14Å; F107-F343 HydrophobicContact CE1-CZ 4.27Å; F107-F343 HydrophobicContact CZ-CE1 4.17Å; F107-F343 HydrophobicContact CZ-CZ 4.23Å
108	Q	84.4	Confident	80.4	Confident	142 Å²	142	76.1 Å²	76.1	66%	0.664	38%	0.379	S	S	*	.	H	α-helix	trans	-62.4	-36.9	175.4	-72	174.9	-13.6	0	0	112.8	L104 T105 Q106	L104-Q108 WeakPolarHBondContact O-CG 3.49Å; L104-Q108 PolarHBondContact O-N 2.76Å; T105-Q108 PolarHBondContact O-N 2.92Å; Q106-Q108 VanDerWaalsContact C-N 3.3Å; Q106-Q108 PolarHBondContact O-N 2.94Å
109	R	82.6	Confident	81.4	Confident	145 Å²	145	67.3 Å²	67.3	55%	0.547	35%	0.346	S	S	.	.	H	α-helix	trans	-70.5	-37	175.3	-71.7	174.6	177.9	-174.3	-1.6	112.3	T105 Q106 F107 S111 L112	T105-R109 WeakPolarHBondContact O-CG 3.46Å; T105-R109 PolarHBondContact O-N 3.02Å; T105-R109 VanDerWaalsContact O-N 3.08Å; Q106-R109 WeakPolarHBondContact O-CB 3.47Å; Q106-R109 PolarHBondContact O-N 3.29Å; Q106-R109 VanDerWaalsContact O-N 3.13Å; F107-R109 VanDerWaalsContact C-N 3.3Å; F107-R109 PolarHBondContact O-N 2.82Å; R109-S111 VanDerWaalsContact C-N 3.26Å; R109-S111 PolarHBondContact O-N 2.92Å; R109-L112 WeakPolarHBondContact O-CB 3.36Å; R109-L112 WeakPolarHBondContact O-CG 3.33Å; R109-L112 PolarHBondContact O-N 3.08Å
110	A	79.4	Confident	82.4	Confident	14 Å²	14	67.1 Å²	67.1	12%	0.116	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-34.5	179.2	0	0	0	0	0	111.7	Q106 F107 L112 A115 M149	Q106-A110 WeakPolarHBondContact O-CB 2.97Å; Q106-A110 PolarHBondContact O-N 3.38Å; F107-A110 PolarHBondContact O-N 3.45Å; A110-L112 PolarHBondContact O-N 3.4Å; A110-L112 VanDerWaalsContact O-N 3.1Å; A110-A115 WeakPolarHBondContact O-CB 3.33Å; A110-M149 HydrophobicContact CB-CG 4.28Å
111	S	77.2	Confident	83.3	Confident	76 Å²	76	65.8 Å²	65.8	53%	0.531	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	3	176.9	-53.5	0	0	0	0	115.9	F107 R109 D148	F107-S111 PolarHBondContact O-N 2.96Å; F107-S111 PolarHBondContact O-OG 2.68Å; R109-S111 VanDerWaalsContact C-N 3.26Å; R109-S111 PolarHBondContact O-N 2.92Å; S111-D148 WeakPolarHBondContact CA-OD2 3.38Å
112	L	77.1	Confident	84	Confident	112 Å²	112	56.6 Å²	56.6	59%	0.586	30%	0.3	S	S	*	.	S	Bend	trans	-80.7	139.2	176.9	-63.2	173.7	0	0	0	110.2	R109 A110 Q114 A115	R109-L112 WeakPolarHBondContact O-CB 3.36Å; R109-L112 WeakPolarHBondContact O-CG 3.33Å; R109-L112 PolarHBondContact O-N 3.08Å; A110-L112 PolarHBondContact O-N 3.4Å; A110-L112 VanDerWaalsContact O-N 3.1Å; L112-Q114 PolarHBondContact O-N 3.13Å; L112-A115 PolarHBondContact O-N 2.87Å
113	A	60.6	Low	84.7	Confident	101 Å²	101	51.1 Å²	51.1	84%	0.835	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-7	-171.1	0	0	0	0	0	116.5
114	Q	69.3	Low	85.2	Confident	185 Å²	185	51.4 Å²	51.4	86%	0.864	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	26.5	178	-65	-176.1	-6.1	0	0	112.6	L112	L112-Q114 PolarHBondContact O-N 3.13Å
115	A	72.4	Confident	85.6	Confident	12 Å²	12	50.8 Å²	50.8	10%	0.099	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-60.7	130.9	177	0	0	0	0	0	110.5	A110 L112 K150	A110-A115 WeakPolarHBondContact O-CB 3.33Å; L112-A115 PolarHBondContact O-N 2.87Å; A115-K150 PolarHBondContact O-NZ 2.97Å
116	P	80.4	Confident	86	Confident	83 Å²	83	48.7 Å²	48.7	54%	0.539	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-65.1	172.8	174.4	29.7	-35.3	0	0	0	110.6	F118	P116-F118 PolarHBondContact O-N 3.23Å
117	A	90	Very high	86.5	Confident	2 Å²	2	47.7 Å²	47.7	2%	0.017	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-54.9	131.8	170.6	0	0	0	0	0	109.8	L231 L266 P268	A117-L231 HydrophobicContact CB-CD1 3.95Å; A117-L266 HydrophobicContact CB-CB 3.97Å; A117-L266 HydrophobicContact CB-CD1 4.08Å; A117-P268 WeakPolarHBondContact O-CA 3.41Å
118	F	94.6	Very high	87	Confident	14 Å²	14	49 Å²	49	6%	0.061	26%	0.263	C	S	.	.			trans	-75.1	-49.2	177.2	169.9	-110.3	0	0	0	110.7	W103 P116 L144 M149 K150 L269 K270 L342	W103-F118 HydrophobicContact CH2-CE2 4.41Å; W103-F118 HydrophobicContact CH2-CZ 4.16Å; W103-F118 HydrophobicContact CZ3-CE2 4.07Å; W103-F118 AromaticContact CZ3-CZ 3.98Å; W103-F118 HydrophobicContact CZ3-CZ 3.98Å; P116-F118 PolarHBondContact O-N 3.23Å; F118-L144 HydrophobicContact CD1-CD1 4.27Å; F118-L144 HydrophobicContact CD1-CD2 4.47Å; F118-L144 HydrophobicContact CE1-CD1 4.23Å; F118-L144 HydrophobicContact CE1-CD2 4.1Å; F118-M149 HydrophobicContact CB-CB 4.05Å; F118-M149 HydrophobicContact CD1-CB 3.83Å; F118-M149 HydrophobicContact CD1-CE 3.75Å; F118-M149 HydrophobicContact CD1-SD 4.47Å; F118-M149 HydrophobicContact CD2-CE 3.45Å; F118-M149 VanDerWaalsContact CD2-CE 3.45Å; F118-M149 HydrophobicContact CE1-CE 3.46Å; F118-M149 VanDerWaalsContact CE1-CE 3.46Å; F118-M149 HydrophobicContact CE1-SD 4.33Å; F118-M149 HydrophobicContact CE2-CE 3.14Å; F118-M149 HydrophobicContact CG-CB 3.91Å; F118-M149 HydrophobicContact CG-CE 3.74Å; F118-M149 HydrophobicContact CZ-CE 3.15Å; F118-M149 HydrophobicContact CZ-SD 4.48Å; F118-K150 PolarHBondContact N-O 3.4Å; F118-L269 HydrophobicContact CD2-CB 4.38Å; F118-L269 HydrophobicContact CD2-CD1 4.19Å; F118-L269 HydrophobicContact CE2-CB 4.41Å; F118-L269 HydrophobicContact CE2-CD1 4.37Å; F118-L269 PolarHBondContact O-N 3.28Å; F118-L269 VanDerWaalsContact O-N 3.14Å; F118-K270 HydrophobicContact CE2-CG 4.43Å; F118-K270 HydrophobicContact CZ-CG 4.1Å; F118-K270 PolarHBondContact O-N 2.88Å; F118-K270 VanDerWaalsContact O-N 3.1Å; F118-L342 HydrophobicContact CE1-CD1 4.25Å; F118-L342 HydrophobicContact CE1-CD2 4.14Å; F118-L342 HydrophobicContact CZ-CD2 4.06Å
119	A	96.9	Very high	87.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145	-175	0	0	0	0	0	113.1	L121 K150 P151 V152 K270	A119-L121 HydrophobicContact CB-CD1 3.77Å; A119-L121 HydrophobicContact CB-CG 4.34Å; A119-K150 PolarHBondContact N-O 2.75Å; A119-P151 CarbonylContact O-C 3.58Å; A119-P151 WeakPolarHBondContact O-CA 3.25Å; A119-V152 PolarHBondContact O-N 2.79Å; A119-K270 CarbonylContact C-O 3.11Å; A119-K270 WeakPolarHBondContact CA-O 3.41Å; A119-K270 HydrophobicContact CB-CB 4.04Å
120	V	98.4	Very high	88	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.1	165.5	-177.2	0	0	0	0	107.5	V152 V154 T259 I262 L266 P268 K270 V271 M272	V120-V152 CarbonylContact C-O 3.55Å; V120-V152 WeakPolarHBondContact CA-O 3.45Å; V120-V152 HydrophobicContact CG1-CB 4.49Å; V120-V152 HydrophobicContact CG2-CB 4.28Å; V120-V154 HydrophobicContact CG1-CG2 4.35Å; V120-T259 HydrophobicContact CG1-CG2 4Å; V120-I262 HydrophobicContact CG1-CB 4.39Å; V120-I262 HydrophobicContact CG1-CG2 3.95Å; V120-I262 HydrophobicContact CG2-CG2 4Å; V120-L266 HydrophobicContact CG2-CD1 4.4Å; V120-P268 HydrophobicContact CB-CG 4.35Å; V120-P268 HydrophobicContact CG2-CB 4.14Å; V120-P268 HydrophobicContact CG2-CG 3.78Å; V120-K270 PolarHBondContact N-O 3.16Å; V120-V271 CarbonylContact O-C 3.52Å; V120-V271 WeakPolarHBondContact O-CA 3.23Å; V120-M272 PolarHBondContact O-N 3.15Å
121	L	98.4	Very high	88.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.9	-170	-54.5	96	0	0	0	111.3	A119 L141 P151 V152 V153 V154 M272 L274 M338	A119-L121 HydrophobicContact CB-CD1 3.77Å; A119-L121 HydrophobicContact CB-CG 4.34Å; L121-L141 HydrophobicContact CD1-CD2 4.29Å; L121-L141 HydrophobicContact CD2-CD2 4.34Å; L121-P151 HydrophobicContact CD1-CB 3.86Å; L121-V152 WeakPolarHBondContact CD1-O 3.33Å; L121-V152 PolarHBondContact N-O 2.89Å; L121-V153 CarbonylContact O-C 3.58Å; L121-V153 WeakPolarHBondContact O-CA 3.43Å; L121-V154 PolarHBondContact O-N 3.48Å; L121-M272 CarbonylContact C-O 3.56Å; L121-M272 VanDerWaalsContact CA-O 3.27Å; L121-M272 WeakPolarHBondContact CA-O 3.37Å; L121-M272 HydrophobicContact CB-CB 4.35Å; L121-M272 HydrophobicContact CD2-CB 3.94Å; L121-M272 HydrophobicContact CD2-CG 4.13Å; L121-M272 HydrophobicContact CD2-SD 3.61Å; L121-M272 HydrophobicContact CG-CB 3.97Å; L121-M272 HydrophobicContact CG-CG 4.26Å; L121-M272 HydrophobicContact CG-SD 4.31Å; L121-L274 HydrophobicContact CD2-CD1 3.95Å; L121-M338 HydrophobicContact CD2-CE 3.41Å; L121-M338 VanDerWaalsContact CD2-CE 3.41Å; L121-M338 HydrophobicContact CD2-SD 3.82Å
122	E	97.9	Very high	89.6	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.9	166.7	-169.3	-95.7	146.5	0	0	109.4	V154 G156 S255 T259 M272 F273 L274 R313	E122-V154 WeakPolarHBondContact CA-O 3.26Å; E122-G156 WeakPolarHBondContact OE1-CA 3.47Å; E122-S255 PolarHBondContact OE1-OG 2.98Å; E122-T259 HydrophobicContact CB-CG2 4.3Å; E122-M272 PolarHBondContact N-O 3.43Å; E122-F273 HydrophobicContact CB-CD1 3.63Å; E122-F273 HydrophobicContact CB-CE1 4.09Å; E122-F273 HydrophobicContact CB-CG 4.46Å; E122-F273 HydrophobicContact CG-CD1 4.17Å; E122-L274 WeakPolarHBondContact O-CB 3.41Å; E122-L274 PolarHBondContact O-N 3.15Å; E122-R313 IonicContact OE2-CZ 3.27Å; E122-R313 IonicContact OE2-NH1 2.74Å; E122-R313 PolarHBondContact OE2-NH1 3.4Å; E122-R313 IonicContact OE2-NH2 3.64Å
123	V	97.7	Very high	90.5	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	106.8	179.2	-176	0	0	0	0	109.9	V127 F128 L137 V153 V154 G156 L274	V123-V127 HydrophobicContact CG1-CB 3.98Å; V123-V127 HydrophobicContact CG1-CG1 4.13Å; V123-V127 HydrophobicContact CG1-CG2 4.03Å; V123-F128 HydrophobicContact CG1-CE2 3.77Å; V123-F128 HydrophobicContact CG1-CZ 4.31Å; V123-L137 HydrophobicContact CG1-CD2 3.7Å; V123-L137 HydrophobicContact CG2-CD2 4.01Å; V123-V153 HydrophobicContact CG2-CG1 3.62Å; V123-V154 PolarHBondContact N-O 2.85Å; V123-G156 VanDerWaalsContact O-CA 3.22Å; V123-G156 WeakPolarHBondContact O-CA 3.47Å; V123-G156 PolarHBondContact O-N 2.9Å; V123-L274 HydrophobicContact CG2-CD1 4.33Å
124	D	94.4	Very high	92.2	Very high	18 Å²	18	49 Å²	49	10%	0.096	24%	0.235	C	C	.	.			trans	-63	152.3	179	-177.4	-99.4	0	0	0	112	S126 V127 L274 N275	D124-S126 PolarHBondContact O-N 2.86Å; D124-S126 WeakPolarHBondContact OD1-CB 3.3Å; D124-S126 PolarHBondContact OD1-N 3.4Å; D124-S126 PolarHBondContact OD1-OG 3.17Å; D124-V127 WeakPolarHBondContact O-CB 3.38Å; D124-V127 PolarHBondContact O-N 2.82Å; D124-L274 WeakPolarHBondContact CB-O 3.25Å; D124-L274 PolarHBondContact N-O 3.45Å; D124-N275 HydrophobicContact CB-CB 4.12Å
125	K	92.7	Very high	93.5	Very high	77 Å²	77	43.1 Å²	43.1	34%	0.335	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-57	-32.8	179.7	73.7	-178.9	-178.4	-176.2	0	113	V127 F128 S158	K125-V127 PolarHBondContact O-N 3.35Å; K125-V127 VanDerWaalsContact O-N 3.14Å; K125-F128 WeakPolarHBondContact O-CB 3.48Å; K125-F128 PolarHBondContact O-N 3.1Å; K125-S158 VanDerWaalsContact CD-OG 3.24Å; K125-S158 WeakPolarHBondContact CD-OG 3.33Å
126	S	92.9	Very high	94.6	Very high	6 Å²	6	45 Å²	45	4%	0.042	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-62.1	-23.7	-176	61	0	0	0	0	113.1	D124 F128 E129 S276 W277	D124-S126 PolarHBondContact O-N 2.86Å; D124-S126 WeakPolarHBondContact OD1-CB 3.3Å; D124-S126 PolarHBondContact OD1-N 3.4Å; D124-S126 PolarHBondContact OD1-OG 3.17Å; S126-F128 PolarHBondContact O-N 3.07Å; S126-E129 WeakPolarHBondContact O-CB 3.48Å; S126-E129 PolarHBondContact O-N 3.21Å; S126-S276 WeakPolarHBondContact CB-OG 3.37Å; S126-S276 PolarHBondContact OG-N 3.3Å; S126-S276 VanDerWaalsContact OG-N 3.16Å; S126-S276 PolarHBondContact OG-OG 3.04Å; S126-W277 WeakPolarHBondContact OG-CZ3 3.17Å
127	V	95.1	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-63.4	-29.7	176.5	178.5	0	0	0	0	111.7	V123 D124 K125 E129 M133 L137 A335	V123-V127 HydrophobicContact CG1-CB 3.98Å; V123-V127 HydrophobicContact CG1-CG1 4.13Å; V123-V127 HydrophobicContact CG1-CG2 4.03Å; D124-V127 WeakPolarHBondContact O-CB 3.38Å; D124-V127 PolarHBondContact O-N 2.82Å; K125-V127 PolarHBondContact O-N 3.35Å; K125-V127 VanDerWaalsContact O-N 3.14Å; V127-E129 VanDerWaalsContact C-N 3.3Å; V127-E129 PolarHBondContact O-N 3.08Å; V127-M133 HydrophobicContact CB-SD 4.3Å; V127-M133 HydrophobicContact CG1-CG 4.06Å; V127-M133 HydrophobicContact CG1-SD 4.15Å; V127-M133 HydrophobicContact CG2-SD 4.22Å; V127-L137 HydrophobicContact CG1-CD2 3.91Å; V127-A335 HydrophobicContact CB-CB 4.31Å; V127-A335 HydrophobicContact CG1-CB 3.63Å; V127-A335 HydrophobicContact CG2-CB 3.65Å
128	F	95.2	Very high	95.7	Very high	40 Å²	40	41 Å²	41	18%	0.175	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-80.9	-11.4	-177.6	-65.2	-95.9	0	0	0	113.2	V123 K125 S126 S130 L134 M155 R180 L184	V123-F128 HydrophobicContact CG1-CE2 3.77Å; V123-F128 HydrophobicContact CG1-CZ 4.31Å; K125-F128 WeakPolarHBondContact O-CB 3.48Å; K125-F128 PolarHBondContact O-N 3.1Å; S126-F128 PolarHBondContact O-N 3.07Å; F128-S130 VanDerWaalsContact C-N 3.27Å; F128-S130 PolarHBondContact O-N 3.4Å; F128-L134 HydrophobicContact CD1-CD1 4.1Å; F128-L134 HydrophobicContact CD1-CD2 4.27Å; F128-L134 HydrophobicContact CE1-CD1 3.88Å; F128-L134 HydrophobicContact CZ-CD1 4.39Å; F128-M155 HydrophobicContact CE1-CE 4.25Å; F128-M155 HydrophobicContact CE2-CE 4.07Å; F128-M155 HydrophobicContact CZ-CE 3.45Å; F128-M155 VanDerWaalsContact CZ-CE 3.45Å; F128-R180 HydrophobicContact CB-CG 4.48Å; F128-R180 HydrophobicContact CD1-CB 4Å; F128-R180 HydrophobicContact CD1-CG 3.99Å; F128-R180 HydrophobicContact CD2-CG 4.29Å; F128-R180 HydrophobicContact CE1-CB 3.81Å; F128-R180 HydrophobicContact CE1-CG 4.31Å; F128-R180 VanDerWaalsContact CE1-O 3.29Å; F128-R180 WeakPolarHBondContact CE1-O 3.36Å; F128-R180 HydrophobicContact CE2-CB 4.35Å; F128-R180 HydrophobicContact CG-CB 4.36Å; F128-R180 HydrophobicContact CG-CG 3.99Å; F128-R180 HydrophobicContact CZ-CB 4.02Å; F128-L184 HydrophobicContact CE1-CB 3.99Å; F128-L184 HydrophobicContact CZ-CB 4.2Å; F128-L184 HydrophobicContact CZ-CD2 4.46Å
129	E	93.1	Very high	95.8	Very high	152 Å²	152	42.1 Å²	42.1	71%	0.71	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-73.7	-22.3	176.5	-60.2	175.8	177.5	0	0	111.8	S126 V127	S126-E129 WeakPolarHBondContact O-CB 3.48Å; S126-E129 PolarHBondContact O-N 3.21Å; V127-E129 VanDerWaalsContact C-N 3.3Å; V127-E129 PolarHBondContact O-N 3.08Å
130	S	94.6	Very high	95.7	Very high	44 Å²	44	42.1 Å²	42.1	31%	0.308	20%	0.199	S	C	.	.			trans	-116.5	113.6	178.7	176	0	0	0	0	111.6	F128 E132 M133 L134	F128-S130 VanDerWaalsContact C-N 3.27Å; F128-S130 PolarHBondContact O-N 3.4Å; S130-E132 VanDerWaalsContact C-N 3.27Å; S130-E132 PolarHBondContact O-N 3.01Å; S130-M133 PolarHBondContact O-N 3.36Å; S130-M133 PolarHBondContact OG-N 3.3Å; S130-L134 PolarHBondContact O-N 2.93Å
131	R	95.1	Very high	95.7	Very high	202 Å²	202	42.1 Å²	42.1	76%	0.762	20%	0.199	S	C	*	.	H	α-helix	trans	-59.7	-38.5	175.8	-174.5	176.1	-179.9	170.6	3.2	112.2	M133 L134 Q135	R131-M133 VanDerWaalsContact C-N 3.35Å; R131-L134 PolarHBondContact O-N 3.31Å; R131-Q135 WeakPolarHBondContact O-CG 3.14Å; R131-Q135 PolarHBondContact O-N 3.42Å
132	E	95.4	Very high	95.5	Very high	160 Å²	160	42.1 Å²	42.1	75%	0.748	20%	0.199	S	C	*	.	H	α-helix	trans	-64.3	-42.8	179.3	-65.8	-177.6	176.1	0	0	111.2	S130 Q135 S136	S130-E132 VanDerWaalsContact C-N 3.27Å; S130-E132 PolarHBondContact O-N 3.01Å; E132-Q135 WeakPolarHBondContact O-CB 3.4Å; E132-Q135 PolarHBondContact O-N 3.49Å; E132-S136 PolarHBondContact O-N 2.89Å; E132-S136 PolarHBondContact O-OG 2.97Å
133	M	95.1	Very high	95.4	Very high	23 Å²	23	42.2 Å²	42.2	11%	0.113	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-43.2	177.4	-169.9	177.2	-71.8	0	0	112	V127 S130 R131 Q135 S136 L137 S276 A335	V127-M133 HydrophobicContact CB-SD 4.3Å; V127-M133 HydrophobicContact CG1-CG 4.06Å; V127-M133 HydrophobicContact CG1-SD 4.15Å; V127-M133 HydrophobicContact CG2-SD 4.22Å; S130-M133 PolarHBondContact O-N 3.36Å; S130-M133 PolarHBondContact OG-N 3.3Å; R131-M133 VanDerWaalsContact C-N 3.35Å; M133-Q135 VanDerWaalsContact C-N 3.27Å; M133-Q135 PolarHBondContact O-N 2.92Å; M133-S136 PolarHBondContact O-N 3.48Å; M133-S136 VanDerWaalsContact O-N 3.17Å; M133-L137 PolarHBondContact O-N 3.26Å; M133-S276 WeakPolarHBondContact CE-O 3.48Å; M133-S276 VanDerWaalsContact SD-CA 3.57Å; M133-A335 HydrophobicContact CG-CB 3.84Å; M133-A335 HydrophobicContact SD-CB 4.09Å
134	L	96.5	Very high	95.2	Very high	9 Å²	9	42.1 Å²	42.1	5%	0.047	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-36.6	175.8	-172	63.1	0	0	0	112	F128 S130 R131 A138 T183 L184 V187	F128-L134 HydrophobicContact CD1-CD1 4.1Å; F128-L134 HydrophobicContact CD1-CD2 4.27Å; F128-L134 HydrophobicContact CE1-CD1 3.88Å; F128-L134 HydrophobicContact CZ-CD1 4.39Å; S130-L134 PolarHBondContact O-N 2.93Å; R131-L134 PolarHBondContact O-N 3.31Å; L134-A138 WeakPolarHBondContact O-CB 3.38Å; L134-A138 PolarHBondContact O-N 2.93Å; L134-T183 HydrophobicContact CD2-CG2 3.84Å; L134-L184 HydrophobicContact CD1-CD1 3.79Å; L134-V187 HydrophobicContact CD2-CG2 3.95Å; L134-V187 HydrophobicContact CG-CG1 4.47Å; L134-V187 HydrophobicContact CG-CG2 4.29Å
135	Q	96.3	Very high	95.1	Very high	62 Å²	62	42.7 Å²	42.7	29%	0.29	20%	0.201	S	C	.	.	H	α-helix	trans	-66.4	-42.2	173.5	-69.1	-69.9	-33.6	0	0	112	R131 E132 M133 A138 F139 H191	R131-Q135 WeakPolarHBondContact O-CG 3.14Å; R131-Q135 PolarHBondContact O-N 3.42Å; E132-Q135 WeakPolarHBondContact O-CB 3.4Å; E132-Q135 PolarHBondContact O-N 3.49Å; M133-Q135 VanDerWaalsContact C-N 3.27Å; M133-Q135 PolarHBondContact O-N 2.92Å; Q135-A138 PolarHBondContact O-N 2.74Å; Q135-F139 WeakPolarHBondContact O-CB 3.37Å; Q135-F139 PolarHBondContact O-N 3.03Å; Q135-H191 PolarHBondContact OE1-NE2 3.44Å
136	S	95.4	Very high	95	Very high	52 Å²	52	42.5 Å²	42.5	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-64	-42.2	175.4	-64.1	0	0	0	0	112.2	E132 M133 F139 G140	E132-S136 PolarHBondContact O-N 2.89Å; E132-S136 PolarHBondContact O-OG 2.97Å; M133-S136 PolarHBondContact O-N 3.48Å; M133-S136 VanDerWaalsContact O-N 3.17Å; S136-F139 WeakPolarHBondContact O-CB 3.45Å; S136-F139 PolarHBondContact O-N 2.92Å; S136-G140 PolarHBondContact O-N 2.69Å
137	L	97.2	Very high	94.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-50.1	175.3	175.5	58.3	0	0	0	111.3	V123 V127 M133 F139 G140 L141 L184 L274 A335 M338	V123-L137 HydrophobicContact CG1-CD2 3.7Å; V123-L137 HydrophobicContact CG2-CD2 4.01Å; V127-L137 HydrophobicContact CG1-CD2 3.91Å; M133-L137 PolarHBondContact O-N 3.26Å; L137-F139 VanDerWaalsContact C-N 3.29Å; L137-F139 PolarHBondContact O-N 3.47Å; L137-G140 PolarHBondContact O-N 2.95Å; L137-G140 VanDerWaalsContact O-N 3.14Å; L137-L141 HydrophobicContact CD1-CD1 3.85Å; L137-L141 HydrophobicContact CD1-CG 3.98Å; L137-L141 HydrophobicContact CG-CD1 3.94Å; L137-L141 HydrophobicContact CG-CG 4.47Å; L137-L141 WeakPolarHBondContact O-CG 3.29Å; L137-L141 PolarHBondContact O-N 3.3Å; L137-L184 HydrophobicContact CD2-CD1 4.34Å; L137-L274 HydrophobicContact CD1-CD1 3.52Å; L137-A335 HydrophobicContact CB-CB 4.29Å; L137-A335 HydrophobicContact CD2-CB 4.45Å; L137-M338 HydrophobicContact CD1-SD 3.94Å
138	A	97.4	Very high	94.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-38.5	179.3	0	0	0	0	0	111.9	L134 Q135 S142 V187 L188	L134-A138 WeakPolarHBondContact O-CB 3.38Å; L134-A138 PolarHBondContact O-N 2.93Å; Q135-A138 PolarHBondContact O-N 2.74Å; A138-S142 WeakPolarHBondContact O-CB 3.33Å; A138-S142 PolarHBondContact O-N 3.16Å; A138-S142 PolarHBondContact O-OG 3.12Å; A138-V187 HydrophobicContact CB-CB 4.33Å; A138-V187 HydrophobicContact CB-CG1 3.47Å; A138-V187 VanDerWaalsContact CB-CG1 3.47Å; A138-L188 HydrophobicContact CB-CD2 3.94Å; A138-L188 HydrophobicContact CB-CG 4.26Å
139	F	95.4	Very high	94.5	Very high	37 Å²	37	45.8 Å²	45.8	16%	0.162	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-51.2	171.2	173.5	-104.8	0	0	0	111.2	R84 A88 Q135 S136 L137 S142 F143 L339	R84-F139 HydrophobicContact CG-CE2 3.92Å; R84-F139 HydrophobicContact CG-CZ 4.35Å; A88-F139 HydrophobicContact CB-CE1 3.67Å; A88-F139 HydrophobicContact CB-CZ 3.5Å; Q135-F139 WeakPolarHBondContact O-CB 3.37Å; Q135-F139 PolarHBondContact O-N 3.03Å; S136-F139 WeakPolarHBondContact O-CB 3.45Å; S136-F139 PolarHBondContact O-N 2.92Å; L137-F139 VanDerWaalsContact C-N 3.29Å; L137-F139 PolarHBondContact O-N 3.47Å; F139-S142 PolarHBondContact O-N 2.97Å; F139-S142 PolarHBondContact O-OG 3.26Å; F139-F143 WeakPolarHBondContact O-CB 3.35Å; F139-F143 PolarHBondContact O-N 2.91Å; F139-L339 HydrophobicContact CD1-CD1 4.19Å; F139-L339 HydrophobicContact CE1-CD1 3.83Å
140	G	95.8	Very high	94.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-46.4	-179.8	0	0	0	0	0	113.9	S136 L137 F143 L144	S136-G140 PolarHBondContact O-N 2.69Å; L137-G140 PolarHBondContact O-N 2.95Å; L137-G140 VanDerWaalsContact O-N 3.14Å; G140-F143 WeakPolarHBondContact O-CB 3.35Å; G140-F143 PolarHBondContact O-N 2.95Å; G140-L144 WeakPolarHBondContact O-CG 3.38Å; G140-L144 PolarHBondContact O-N 3.34Å
141	L	97.2	Very high	94.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-42.9	175.6	-73.1	172.4	0	0	0	112.1	L121 L137 F143 L144 Q145 P151 V153 L188 I236 M338	L121-L141 HydrophobicContact CD1-CD2 4.29Å; L121-L141 HydrophobicContact CD2-CD2 4.34Å; L137-L141 HydrophobicContact CD1-CD1 3.85Å; L137-L141 HydrophobicContact CD1-CG 3.98Å; L137-L141 HydrophobicContact CG-CD1 3.94Å; L137-L141 HydrophobicContact CG-CG 4.47Å; L137-L141 WeakPolarHBondContact O-CG 3.29Å; L137-L141 PolarHBondContact O-N 3.3Å; L141-F143 VanDerWaalsContact C-N 3.29Å; L141-F143 PolarHBondContact O-N 3.1Å; L141-L144 PolarHBondContact O-N 3.03Å; L141-Q145 PolarHBondContact O-N 2.81Å; L141-Q145 VanDerWaalsContact O-N 3.07Å; L141-P151 HydrophobicContact CD2-CB 4.24Å; L141-V153 HydrophobicContact CD1-CG2 3.91Å; L141-V153 HydrophobicContact CD2-CG2 3.78Å; L141-L188 HydrophobicContact CB-CD2 3.72Å; L141-L188 HydrophobicContact CD1-CD1 4.4Å; L141-L188 HydrophobicContact CD1-CD2 4.08Å; L141-I236 HydrophobicContact CB-CD1 4.05Å; L141-M338 HydrophobicContact CD2-CE 4.19Å
142	S	95.6	Very high	94.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-34.7	176.5	81.3	0	0	0	0	112.1	A138 F139 R146	A138-S142 WeakPolarHBondContact O-CB 3.33Å; A138-S142 PolarHBondContact O-N 3.16Å; A138-S142 PolarHBondContact O-OG 3.12Å; F139-S142 PolarHBondContact O-N 2.97Å; F139-S142 PolarHBondContact O-OG 3.26Å; S142-R146 WeakPolarHBondContact O-CG 3.5Å; S142-R146 VanDerWaalsContact O-CZ 3.31Å; S142-R146 PolarHBondContact O-N 2.7Å; S142-R146 VanDerWaalsContact O-N 3.08Å; S142-R146 PolarHBondContact O-NH1 3.22Å; S142-R146 VanDerWaalsContact O-NH1 3.17Å; S142-R146 PolarHBondContact OG-NH1 2.85Å; S142-R146 PolarHBondContact OG-NH2 3.25Å
143	F	94.4	Very high	95	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.009	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-49.3	174.3	171.7	-83.2	0	0	0	110.3	D85 F89 F107 F139 G140 L141 Q145 R146 M147 L339 F343	D85-F143 HydrophobicContact CB-CD2 3.71Å; D85-F143 HydrophobicContact CB-CE2 3.78Å; D85-F143 WeakPolarHBondContact O-CE2 3.43Å; F89-F143 HydrophobicContact CB-CE2 4.18Å; F89-F143 HydrophobicContact CB-CZ 4.04Å; F89-F143 HydrophobicContact CD2-CZ 4.27Å; F107-F143 HydrophobicContact CZ-CE1 4.41Å; F107-F143 HydrophobicContact CZ-CZ 4.35Å; F139-F143 WeakPolarHBondContact O-CB 3.35Å; F139-F143 PolarHBondContact O-N 2.91Å; G140-F143 WeakPolarHBondContact O-CB 3.35Å; G140-F143 PolarHBondContact O-N 2.95Å; L141-F143 VanDerWaalsContact C-N 3.29Å; L141-F143 PolarHBondContact O-N 3.1Å; F143-Q145 VanDerWaalsContact C-N 3.35Å; F143-Q145 PolarHBondContact O-N 2.75Å; F143-R146 PolarHBondContact O-N 2.95Å; F143-M147 HydrophobicContact CD1-CG 4.3Å; F143-M147 HydrophobicContact CE1-CG 3.81Å; F143-M147 HydrophobicContact CE2-CG 4.23Å; F143-M147 HydrophobicContact CZ-CG 3.78Å; F143-M147 WeakPolarHBondContact O-CG 3.41Å; F143-M147 PolarHBondContact O-N 3.27Å; F143-L339 HydrophobicContact CD1-CD2 4.13Å; F143-F343 HydrophobicContact CD1-CE2 4.08Å; F143-F343 HydrophobicContact CD1-CZ 4.2Å; F143-F343 AromaticContact CE1-CE2 3.44Å; F143-F343 HydrophobicContact CE1-CE2 3.44Å; F143-F343 VanDerWaalsContact CE1-CE2 3.44Å; F143-F343 AromaticContact CE1-CZ 3.49Å; F143-F343 HydrophobicContact CE1-CZ 3.49Å; F143-F343 VanDerWaalsContact CE1-CZ 3.49Å; F143-F343 HydrophobicContact CZ-CE2 4.08Å; F143-F343 HydrophobicContact CZ-CZ 4.36Å
144	L	93.9	Very high	95.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-57.1	-48.1	178	-68.8	-173.4	0	0	0	111.7	F118 G140 L141 R146 M147 D148 M149 P151 M338 L342 F343	F118-L144 HydrophobicContact CD1-CD1 4.27Å; F118-L144 HydrophobicContact CD1-CD2 4.47Å; F118-L144 HydrophobicContact CE1-CD1 4.23Å; F118-L144 HydrophobicContact CE1-CD2 4.1Å; G140-L144 WeakPolarHBondContact O-CG 3.38Å; G140-L144 PolarHBondContact O-N 3.34Å; L141-L144 PolarHBondContact O-N 3.03Å; L144-R146 PolarHBondContact O-N 2.9Å; L144-M147 CarbonylContact O-C 3.53Å; L144-M147 PolarHBondContact O-N 3.46Å; L144-M147 VanDerWaalsContact O-N 3.1Å; L144-D148 PolarHBondContact O-N 3.05Å; L144-M149 HydrophobicContact CB-CB 4.06Å; L144-M149 HydrophobicContact CD2-CB 4.15Å; L144-M149 HydrophobicContact CD2-CE 4.48Å; L144-M149 HydrophobicContact CD2-SD 3.57Å; L144-M149 VanDerWaalsContact CD2-SD 3.57Å; L144-M149 WeakPolarHBondContact O-CA 3.24Å; L144-M149 WeakPolarHBondContact O-CB 3.26Å; L144-M149 PolarHBondContact O-N 3.14Å; L144-P151 HydrophobicContact CB-CG 4.23Å; L144-P151 HydrophobicContact CD1-CB 4.3Å; L144-M338 HydrophobicContact CD1-CE 3.31Å; L144-M338 HydrophobicContact CG-CE 4.19Å; L144-L342 HydrophobicContact CD1-CD1 4.08Å; L144-L342 HydrophobicContact CD2-CD1 4.03Å; L144-F343 HydrophobicContact CD2-CZ 4.09Å
145	Q	93.2	Very high	95.2	Very high	30 Å²	30	18.7 Å²	18.7	14%	0.14	9%	0.092	C	C	.	.	H	α-helix	trans	-58	-44.2	177.3	177.3	-179	35.1	0	0	112.8	L141 F143 M147 D148 S194 G234 I236	L141-Q145 PolarHBondContact O-N 2.81Å; L141-Q145 VanDerWaalsContact O-N 3.07Å; F143-Q145 VanDerWaalsContact C-N 3.35Å; F143-Q145 PolarHBondContact O-N 2.75Å; Q145-M147 PolarHBondContact O-N 3.4Å; Q145-D148 PolarHBondContact O-N 2.63Å; Q145-S194 VanDerWaalsContact NE2-N 3.1Å; Q145-S194 PolarHBondContact NE2-O 2.97Å; Q145-S194 VanDerWaalsContact OE1-N 3.15Å; Q145-G234 PolarHBondContact NE2-O 2.88Å; Q145-I236 HydrophobicContact CB-CD1 4.05Å; Q145-I236 HydrophobicContact CB-CG1 4.16Å; Q145-I236 HydrophobicContact CG-CG1 4.37Å
146	R	90.9	Very high	94.9	Very high	72 Å²	72	15.8 Å²	15.8	27%	0.272	8%	0.079	S	C	.	.	H	α-helix	trans	-67.1	-24.8	178.4	-74.2	-170.6	-61.6	-79.2	-4.7	113.1	D85 S142 F143 L144 H191	D85-R146 IonicContact OD1-CZ 3.99Å; D85-R146 IonicContact OD1-NE 2.93Å; D85-R146 IonicContact OD1-NH2 3.43Å; D85-R146 PolarHBondContact OD1-NH2 2.7Å; D85-R146 IonicContact OD2-CZ 3.87Å; D85-R146 IonicContact OD2-NE 2.85Å; D85-R146 PolarHBondContact OD2-NE 2.94Å; D85-R146 IonicContact OD2-NH2 3.79Å; D85-R146 PolarHBondContact OD2-NH2 3.21Å; S142-R146 WeakPolarHBondContact O-CG 3.5Å; S142-R146 VanDerWaalsContact O-CZ 3.31Å; S142-R146 PolarHBondContact O-N 2.7Å; S142-R146 VanDerWaalsContact O-N 3.08Å; S142-R146 PolarHBondContact O-NH1 3.22Å; S142-R146 VanDerWaalsContact O-NH1 3.17Å; S142-R146 PolarHBondContact OG-NH1 2.85Å; S142-R146 PolarHBondContact OG-NH2 3.25Å; F143-R146 PolarHBondContact O-N 2.95Å; L144-R146 PolarHBondContact O-N 2.9Å; R146-H191 PolarHBondContact NH1-O 3.44Å
147	M	89.3	Confident	94.2	Very high	55 Å²	55	15 Å²	15	27%	0.271	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	12.6	173.1	-60.9	-56.1	-67.7	0	0	112.9	F107 F143 L144 Q145 M149	F107-M147 HydrophobicContact CB-CE 4.01Å; F107-M147 HydrophobicContact CD1-CB 4.11Å; F107-M147 HydrophobicContact CD1-CE 3.98Å; F107-M147 HydrophobicContact CD2-CE 3.32Å; F107-M147 HydrophobicContact CE1-CB 4.29Å; F107-M147 HydrophobicContact CE1-CE 4.26Å; F107-M147 HydrophobicContact CE1-CG 4.47Å; F107-M147 HydrophobicContact CE2-CE 3.61Å; F107-M147 HydrophobicContact CG-CE 3.52Å; F107-M147 HydrophobicContact CZ-CE 4.08Å; F143-M147 HydrophobicContact CD1-CG 4.3Å; F143-M147 HydrophobicContact CE1-CG 3.81Å; F143-M147 HydrophobicContact CE2-CG 4.23Å; F143-M147 HydrophobicContact CZ-CG 3.78Å; F143-M147 WeakPolarHBondContact O-CG 3.41Å; F143-M147 PolarHBondContact O-N 3.27Å; L144-M147 CarbonylContact O-C 3.53Å; L144-M147 PolarHBondContact O-N 3.46Å; L144-M147 VanDerWaalsContact O-N 3.1Å; Q145-M147 PolarHBondContact O-N 3.4Å; M147-M149 HydrophobicContact CB-CG 4.03Å; M147-M149 HydrophobicContact CB-SD 4.34Å; M147-M149 PolarHBondContact O-N 3.02Å; M147-M149 VanDerWaalsContact O-N 3.15Å
148	D	90.3	Very high	92.6	Very high	60 Å²	60	16.9 Å²	16.9	32%	0.321	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	21.2	-175.4	-151.7	18.3	0	0	0	114.2	S111 L144 Q145 K150	S111-D148 WeakPolarHBondContact CA-OD2 3.38Å; L144-D148 PolarHBondContact O-N 3.05Å; Q145-D148 PolarHBondContact O-N 2.63Å; D148-K150 PolarHBondContact O-N 2.74Å; D148-K150 VanDerWaalsContact O-N 3.16Å
149	M	92.1	Very high	90.7	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.105	C	C	.	.			trans	-87.3	86	176.6	-58.1	-176.2	90.5	0	0	109.5	W103 F107 A110 F118 L144 M147 P151	W103-M149 HydrophobicContact CE3-CE 4.24Å; W103-M149 HydrophobicContact CZ3-CE 3.76Å; F107-M149 HydrophobicContact CD1-CE 4.23Å; F107-M149 HydrophobicContact CD1-CG 4.1Å; F107-M149 HydrophobicContact CD1-SD 3.57Å; F107-M149 VanDerWaalsContact CD1-SD 3.57Å; F107-M149 HydrophobicContact CE1-CE 4.1Å; F107-M149 HydrophobicContact CE1-CG 4.39Å; F107-M149 HydrophobicContact CE1-SD 3.32Å; F107-M149 WeakPolarHBondContact CE1-SD 3.49Å; A110-M149 HydrophobicContact CB-CG 4.28Å; F118-M149 HydrophobicContact CB-CB 4.05Å; F118-M149 HydrophobicContact CD1-CB 3.83Å; F118-M149 HydrophobicContact CD1-CE 3.75Å; F118-M149 HydrophobicContact CD1-SD 4.47Å; F118-M149 HydrophobicContact CD2-CE 3.45Å; F118-M149 VanDerWaalsContact CD2-CE 3.45Å; F118-M149 HydrophobicContact CE1-CE 3.46Å; F118-M149 VanDerWaalsContact CE1-CE 3.46Å; F118-M149 HydrophobicContact CE1-SD 4.33Å; F118-M149 HydrophobicContact CE2-CE 3.14Å; F118-M149 HydrophobicContact CG-CB 3.91Å; F118-M149 HydrophobicContact CG-CE 3.74Å; F118-M149 HydrophobicContact CZ-CE 3.15Å; F118-M149 HydrophobicContact CZ-SD 4.48Å; L144-M149 HydrophobicContact CB-CB 4.06Å; L144-M149 HydrophobicContact CD2-CB 4.15Å; L144-M149 HydrophobicContact CD2-CE 4.48Å; L144-M149 HydrophobicContact CD2-SD 3.57Å; L144-M149 VanDerWaalsContact CD2-SD 3.57Å; L144-M149 WeakPolarHBondContact O-CA 3.24Å; L144-M149 WeakPolarHBondContact O-CB 3.26Å; L144-M149 PolarHBondContact O-N 3.14Å; M147-M149 HydrophobicContact CB-CG 4.03Å; M147-M149 HydrophobicContact CB-SD 4.34Å; M147-M149 PolarHBondContact O-N 3.02Å; M147-M149 VanDerWaalsContact O-N 3.15Å; M149-P151 WeakPolarHBondContact O-CD 3.35Å; M149-P151 VanDerWaalsContact O-N 3.08Å
150	K	94.5	Very high	88.4	Confident	18 Å²	18	23.8 Å²	23.8	8%	0.078	12%	0.116	C	C	.	.			trans	-50.7	99.7	-176.6	-73	174.6	175.8	-170.4	0	113.8	A115 F118 A119 D148 L231 D232	A115-K150 PolarHBondContact O-NZ 2.97Å; F118-K150 PolarHBondContact N-O 3.4Å; A119-K150 PolarHBondContact N-O 2.75Å; D148-K150 PolarHBondContact O-N 2.74Å; D148-K150 VanDerWaalsContact O-N 3.16Å; K150-L231 HydrophobicContact CB-CB 4.47Å; K150-L231 HydrophobicContact CB-CD1 4.36Å; K150-L231 HydrophobicContact CB-CD2 3.9Å; K150-L231 HydrophobicContact CB-CG 4.46Å; K150-L231 HydrophobicContact CD-CB 4.06Å; K150-L231 HydrophobicContact CG-CB 4.26Å; K150-L231 HydrophobicContact CG-CD2 4.41Å; K150-D232 IonicContact NZ-OD1 2.96Å; K150-D232 PolarHBondContact NZ-OD1 2.8Å
151	P	97.4	Very high	86	Confident	3 Å²	3	33 Å²	33	2%	0.019	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	142.9	178	29.3	-13.3	0	0	0	111.5	A119 L121 L141 L144 M149 I236 P237	A119-P151 CarbonylContact O-C 3.58Å; A119-P151 WeakPolarHBondContact O-CA 3.25Å; L121-P151 HydrophobicContact CD1-CB 3.86Å; L141-P151 HydrophobicContact CD2-CB 4.24Å; L144-P151 HydrophobicContact CB-CG 4.23Å; L144-P151 HydrophobicContact CD1-CB 4.3Å; M149-P151 WeakPolarHBondContact O-CD 3.35Å; M149-P151 VanDerWaalsContact O-N 3.08Å; P151-I236 HydrophobicContact CG-CD1 4.17Å; P151-I236 HydrophobicContact CG-CG1 4.03Å; P151-I236 HydrophobicContact CG-CG2 4.27Å; P151-P237 WeakPolarHBondContact O-CD 3.39Å
152	V	98.4	Very high	83.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132	168.5	178.6	0	0	0	0	108.7	A119 V120 L121 L227 L231 P237 V239 I262 L266	A119-V152 PolarHBondContact O-N 2.79Å; V120-V152 CarbonylContact C-O 3.55Å; V120-V152 WeakPolarHBondContact CA-O 3.45Å; V120-V152 HydrophobicContact CG1-CB 4.49Å; V120-V152 HydrophobicContact CG2-CB 4.28Å; L121-V152 WeakPolarHBondContact CD1-O 3.33Å; L121-V152 PolarHBondContact N-O 2.89Å; V152-L227 HydrophobicContact CG1-CD2 4.49Å; V152-L231 HydrophobicContact CG2-CD1 3.99Å; V152-L231 HydrophobicContact CG2-CD2 4.08Å; V152-L231 HydrophobicContact CG2-CG 4.37Å; V152-P237 HydrophobicContact CB-CG 4.1Å; V152-P237 HydrophobicContact CG1-CG 3.99Å; V152-P237 HydrophobicContact CG2-CG 3.74Å; V152-V239 HydrophobicContact CG1-CG2 4.34Å; V152-I262 HydrophobicContact CG1-CG2 4.21Å; V152-L266 HydrophobicContact CG2-CD1 3.72Å
153	V	98.6	Very high	80.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130	-178.8	-179	0	0	0	0	110	L121 V123 L141 M155 L184 I236 P237 L238 V239	L121-V153 CarbonylContact O-C 3.58Å; L121-V153 WeakPolarHBondContact O-CA 3.43Å; V123-V153 HydrophobicContact CG2-CG1 3.62Å; L141-V153 HydrophobicContact CD1-CG2 3.91Å; L141-V153 HydrophobicContact CD2-CG2 3.78Å; V153-M155 HydrophobicContact CG1-SD 4.48Å; V153-L184 HydrophobicContact CG1-CD2 4.22Å; V153-I236 HydrophobicContact CG2-CG2 3.92Å; V153-P237 PolarHBondContact N-O 2.86Å; V153-L238 HydrophobicContact CB-CD2 3.57Å; V153-L238 HydrophobicContact CG1-CD2 4Å; V153-L238 HydrophobicContact CG2-CD2 3.92Å; V153-L238 CarbonylContact O-C 3.55Å; V153-L238 WeakPolarHBondContact O-CA 3.34Å; V153-V239 PolarHBondContact O-N 3.3Å
154	V	98.3	Very high	78.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.2	173.7	-176.7	0	0	0	0	108.4	V120 L121 E122 V123 V239 V258 T259 I262	V120-V154 HydrophobicContact CG1-CG2 4.35Å; L121-V154 PolarHBondContact O-N 3.48Å; E122-V154 WeakPolarHBondContact CA-O 3.26Å; V123-V154 PolarHBondContact N-O 2.85Å; V154-V239 WeakPolarHBondContact CA-O 3.4Å; V154-V239 HydrophobicContact CG2-CB 4.5Å; V154-V258 HydrophobicContact CG1-CB 4.34Å; V154-V258 HydrophobicContact CG1-CG1 3.9Å; V154-V258 HydrophobicContact CG2-CG1 4.44Å; V154-T259 WeakPolarHBondContact CB-OG1 3.37Å; V154-I262 HydrophobicContact CG2-CD1 3.82Å
155	M	97.4	Very high	75.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.5	-179.5	-56.3	-60	-61.9	0	0	110.4	F128 V153 I177 R180 C181 L184 V239 P241	F128-M155 HydrophobicContact CE1-CE 4.25Å; F128-M155 HydrophobicContact CE2-CE 4.07Å; F128-M155 HydrophobicContact CZ-CE 3.45Å; F128-M155 VanDerWaalsContact CZ-CE 3.45Å; V153-M155 HydrophobicContact CG1-SD 4.48Å; M155-I177 HydrophobicContact CB-CG2 3.89Å; M155-R180 HydrophobicContact CE-CB 3.92Å; M155-C181 HydrophobicContact CE-CB 4.19Å; M155-C181 HydrophobicContact CG-CB 4.21Å; M155-C181 HydrophobicContact SD-CB 4.39Å; M155-L184 HydrophobicContact CE-CD2 4.41Å; M155-L184 HydrophobicContact SD-CD2 3.99Å; M155-V239 PolarHBondContact N-O 3.37Å; M155-P241 VanDerWaalsContact O-CD 3.25Å; M155-P241 WeakPolarHBondContact O-CD 3.28Å; M155-P241 WeakPolarHBondContact O-CG 3.17Å
156	G	91.3	Very high	72.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-68.8	146.8	178.7	0	0	0	0	0	113.6	E122 V123 R180	E122-G156 WeakPolarHBondContact OE1-CA 3.47Å; V123-G156 VanDerWaalsContact O-CA 3.22Å; V123-G156 WeakPolarHBondContact O-CA 3.47Å; V123-G156 PolarHBondContact O-N 2.9Å; G156-R180 PolarHBondContact O-NH2 3.32Å
157	L	80.6	Confident	70.5	Confident	36 Å²	36	63.4 Å²	63.4	19%	0.188	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-91.3	145.4	176.4	-69.5	-171.2	0	0	0	112.8	R159 I177 P241 V252 L253	L157-R159 PolarHBondContact O-N 3.48Å; L157-I177 HydrophobicContact CD2-CD1 3.08Å; L157-I177 HydrophobicContact CD2-CG1 3.78Å; L157-P241 HydrophobicContact CD2-CG 3.76Å; L157-P241 HydrophobicContact CG-CG 3.96Å; L157-V252 HydrophobicContact CD1-CG1 3.65Å; L157-V252 HydrophobicContact CD2-CG1 3.64Å; L157-V252 HydrophobicContact CG-CG1 4.33Å; L157-L253 WeakPolarHBondContact CD1-O 3.47Å
158	S	63.3	Low	68.3	Low	39 Å²	39	63.8 Å²	63.8	27%	0.273	36%	0.361	S	S	.	.			trans	-82.3	96.6	165.9	-51.6	0	0	0	0	109.2	K125 D176 R180	K125-S158 VanDerWaalsContact CD-OG 3.24Å; K125-S158 WeakPolarHBondContact CD-OG 3.33Å; S158-D176 PolarHBondContact OG-OD2 2.88Å; S158-R180 PolarHBondContact OG-NH1 3.22Å; S158-R180 PolarHBondContact OG-NH2 3.33Å
159	R	57.6	Low	66.4	Low	123 Å²	123	66 Å²	66	46%	0.464	37%	0.368	S	S	.	.			trans	-84.4	132.1	164.7	-154.2	173.8	173.8	144	-1.1	108.7	L157 D163	L157-R159 PolarHBondContact O-N 3.48Å; R159-D163 IonicContact CZ-OD1 3.73Å; R159-D163 IonicContact NE-OD1 2.68Å; R159-D163 IonicContact NH2-OD1 3.38Å; R159-D163 PolarHBondContact NH2-OD1 3.46Å
160	P	46.7	Very low	64.5	Low	59 Å²	59	71.6 Å²	71.6	38%	0.383	40%	0.402	S	S	.	.			trans	-67	142.9	161.3	15.3	-8.4	0	0	0	108.7	D162 F169	P160-D162 PolarHBondContact O-N 2.84Å; P160-F169 HydrophobicContact CG-CE1 3.6Å; P160-F169 HydrophobicContact CG-CZ 3.52Å
161	E	46.1	Very low	62.6	Low	195 Å²	195	74.7 Å²	74.7	91%	0.911	43%	0.426	S	S	*	.	S	Bend	trans	-69	-11.5	-177.2	-62.6	-165.3	151.5	0	0	113.2
162	D	41.6	Very low	60.9	Low	134 Å²	134	81.3 Å²	81.3	72%	0.717	46%	0.461	S	S	*	.			trans	-98.1	111.6	-179.3	-62	-41.3	0	0	0	111.4	P160 D164	P160-D162 PolarHBondContact O-N 2.84Å; D162-D164 PolarHBondContact O-N 3.47Å
163	D	43.1	Very low	59.8	Low	96 Å²	96	82.7 Å²	82.7	51%	0.513	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	22.7	-178.1	-137	16.3	0	0	0	113.4	R159 R312	R159-D163 IonicContact CZ-OD1 3.73Å; R159-D163 IonicContact NE-OD1 2.68Å; R159-D163 IonicContact NH2-OD1 3.38Å; R159-D163 PolarHBondContact NH2-OD1 3.46Å; D163-R312 IonicContact OD2-NH2 2.71Å
164	D	37.9	Very low	59.2	Low	158 Å²	158	86.7 Å²	86.7	85%	0.845	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	7	-168.1	-98.9	-14.6	0	0	0	115.8	D162	D162-D164 PolarHBondContact O-N 3.47Å
165	A	37.1	Very low	58.8	Low	59 Å²	59	89.6 Å²	89.6	49%	0.488	51%	0.51	S	S	.	.			trans	-88.9	121.9	177	0	0	0	0	0	112	D167 F169	A165-D167 PolarHBondContact O-N 2.92Å; A165-F169 HydrophobicContact CB-CE2 3.94Å; A165-F169 HydrophobicContact CB-CZ 4.3Å
166	P	39.1	Very low	58.4	Low	117 Å²	117	92.2 Å²	92.2	76%	0.76	52%	0.524	S	S	*	.			trans	-71.8	128.8	-179.5	29.5	-32.4	0	0	0	111	G168	P166-G168 VanDerWaalsContact C-N 3.31Å; P166-G168 PolarHBondContact O-N 3.37Å
167	D	40.1	Very low	58.5	Low	179 Å²	179	92.3 Å²	92.3	96%	0.957	52%	0.524	S	S	*	.	S	Bend	trans	28.1	48.8	154.3	-89.8	-15.2	0	0	0	118.7	A165	A165-D167 PolarHBondContact O-N 2.92Å
168	G	41.9	Very low	59.1	Low	63 Å²	63	92 Å²	92	65%	0.649	52%	0.524	S	S	*	.			trans	-125.4	22.9	-179.3	0	0	0	0	0	115.5	P166	P166-G168 VanDerWaalsContact C-N 3.31Å; P166-G168 PolarHBondContact O-N 3.37Å
169	F	50.5	Low	60.6	Low	107 Å²	107	96 Å²	96	47%	0.469	54%	0.539	S	S	.	.			trans	-94.6	0.9	-159.1	-90.2	-81.9	0	0	0	118.6	P160 A165 S173	P160-F169 HydrophobicContact CG-CE1 3.6Å; P160-F169 HydrophobicContact CG-CZ 3.52Å; A165-F169 HydrophobicContact CB-CE2 3.94Å; A165-F169 HydrophobicContact CB-CZ 4.3Å; F169-S173 PolarHBondContact O-OG 3.24Å
170	T	52.5	Low	62.4	Low	118 Å²	118	91.1 Å²	91.1	72%	0.724	52%	0.52	S	S	*	.	S	Bend	trans	-76.1	-43.4	-158.7	54.6	0	0	0	0	117.1
171	S	54.9	Low	64.8	Low	83 Å²	83	88.3 Å²	88.3	58%	0.58	50%	0.502	S	S	*	.	H	α-helix	trans	-93.4	-54.3	-160.9	-179.3	0	0	0	0	114.3	S173 R174 A175	S171-S173 VanDerWaalsContact C-N 3.34Å; S171-S173 PolarHBondContact O-N 3.48Å; S171-R174 PolarHBondContact O-N 2.85Å; S171-A175 PolarHBondContact O-N 3.43Å
172	N	62.4	Low	67.2	Low	141 Å²	141	83.5 Å²	83.5	75%	0.754	48%	0.479	S	S	*	.	H	α-helix	trans	-69.1	-32.9	-173.4	-73.2	-5.4	0	0	0	112.5	D176	N172-D176 VanDerWaalsContact O-CB 3.28Å; N172-D176 WeakPolarHBondContact O-CB 3.45Å; N172-D176 PolarHBondContact O-N 3.35Å
173	S	75.3	Confident	69.9	Low	30 Å²	30	79.5 Å²	79.5	21%	0.21	46%	0.46	C	S	.	.	H	α-helix	trans	-65.9	-42.5	177.3	61.3	0	0	0	0	111.8	F169 S171 D176 I177	F169-S173 PolarHBondContact O-OG 3.24Å; S171-S173 VanDerWaalsContact C-N 3.34Å; S171-S173 PolarHBondContact O-N 3.48Å; S173-D176 PolarHBondContact O-N 2.87Å; S173-I177 WeakPolarHBondContact O-CD1 3.42Å; S173-I177 WeakPolarHBondContact O-CG1 3.35Å; S173-I177 PolarHBondContact O-N 2.97Å
174	R	85.8	Confident	72.5	Confident	83 Å²	83	74.9 Å²	74.9	31%	0.313	44%	0.435	S	S	.	.	H	α-helix	trans	-65.1	-46.5	179.3	-175.7	177.7	169.8	137.4	8.3	112	S171 D176 I177 V178 S200 V252	S171-R174 PolarHBondContact O-N 2.85Å; R174-D176 VanDerWaalsContact C-N 3.31Å; R174-D176 PolarHBondContact O-N 3.4Å; R174-I177 PolarHBondContact O-N 3.07Å; R174-V178 WeakPolarHBondContact O-CG2 3.44Å; R174-V178 PolarHBondContact O-N 3.31Å; R174-S200 PolarHBondContact NH2-OG 2.86Å; R174-V252 HydrophobicContact CB-CG2 4.48Å
175	A	88.7	Confident	75.4	Confident	61 Å²	61	68 Å²	68	50%	0.504	40%	0.399	S	S	.	.	H	α-helix	trans	-60.5	-42.9	178.5	0	0	0	0	0	111.7	S171 V178 Q179	S171-A175 PolarHBondContact O-N 3.43Å; A175-V178 PolarHBondContact O-N 2.93Å; A175-Q179 WeakPolarHBondContact O-CB 3.4Å; A175-Q179 PolarHBondContact O-N 3.06Å
176	D	89.9	Confident	78.3	Confident	55 Å²	55	70.6 Å²	70.6	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-61.4	-45.9	177.6	176.9	37.8	0	0	0	112.3	S158 N172 S173 R174 V178 Q179 R180	S158-D176 PolarHBondContact OG-OD2 2.88Å; N172-D176 VanDerWaalsContact O-CB 3.28Å; N172-D176 WeakPolarHBondContact O-CB 3.45Å; N172-D176 PolarHBondContact O-N 3.35Å; S173-D176 PolarHBondContact O-N 2.87Å; R174-D176 VanDerWaalsContact C-N 3.31Å; R174-D176 PolarHBondContact O-N 3.4Å; D176-V178 PolarHBondContact O-N 3.49Å; D176-Q179 PolarHBondContact O-N 2.77Å; D176-R180 WeakPolarHBondContact O-CG 3.49Å; D176-R180 PolarHBondContact O-N 3.48Å; D176-R180 IonicContact OD1-CZ 2.69Å; D176-R180 IonicContact OD1-NH1 2.98Å; D176-R180 PolarHBondContact OD1-NH1 3.32Å; D176-R180 IonicContact OD2-CZ 2.81Å; D176-R180 IonicContact OD2-NH1 3.46Å; D176-R180 PolarHBondContact OD2-NH1 3.4Å; D176-R180 IonicContact OD2-NH2 2.85Å
177	I	92.4	Very high	81.1	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-61.8	-44.7	175.7	-61.3	152.3	0	0	0	111.2	M155 L157 S173 R174 Q179 R180 C181 C240 V252	M155-I177 HydrophobicContact CB-CG2 3.89Å; L157-I177 HydrophobicContact CD2-CD1 3.08Å; L157-I177 HydrophobicContact CD2-CG1 3.78Å; S173-I177 WeakPolarHBondContact O-CD1 3.42Å; S173-I177 WeakPolarHBondContact O-CG1 3.35Å; S173-I177 PolarHBondContact O-N 2.97Å; R174-I177 PolarHBondContact O-N 3.07Å; I177-Q179 VanDerWaalsContact C-N 3.33Å; I177-Q179 PolarHBondContact O-N 3.07Å; I177-R180 PolarHBondContact O-N 3.42Å; I177-C181 WeakPolarHBondContact O-CB 3.32Å; I177-C181 PolarHBondContact O-N 2.92Å; I177-C240 HydrophobicContact CG2-CB 3.84Å; I177-V252 HydrophobicContact CD1-CG1 4.33Å
178	V	93.9	Very high	83.8	Confident	31 Å²	31	57.2 Å²	57.2	19%	0.188	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-43.6	179	168.6	0	0	0	0	110.5	R174 A175 D176 R180 C181 Q182 F199	R174-V178 WeakPolarHBondContact O-CG2 3.44Å; R174-V178 PolarHBondContact O-N 3.31Å; A175-V178 PolarHBondContact O-N 2.93Å; D176-V178 PolarHBondContact O-N 3.49Å; V178-R180 PolarHBondContact O-N 3.11Å; V178-C181 WeakPolarHBondContact O-CB 3.36Å; V178-C181 PolarHBondContact O-N 3.39Å; V178-Q182 WeakPolarHBondContact O-CG 3.39Å; V178-Q182 PolarHBondContact O-N 3Å; V178-F199 HydrophobicContact CB-CD1 4.41Å; V178-F199 HydrophobicContact CG1-CD1 3.82Å; V178-F199 HydrophobicContact CG1-CE1 4.24Å; V178-F199 HydrophobicContact CG1-CG 4.45Å; V178-F199 HydrophobicContact CG2-CB 4.28Å; V178-F199 HydrophobicContact CG2-CD1 4.32Å
179	Q	94.8	Very high	86.4	Confident	123 Å²	123	59.7 Å²	59.7	58%	0.575	32%	0.318	S	S	*	.	H	α-helix	trans	-61.4	-43.4	176.6	-176.4	-178.8	-6.3	0	0	111.9	A175 D176 I177 Q182 T183	A175-Q179 WeakPolarHBondContact O-CB 3.4Å; A175-Q179 PolarHBondContact O-N 3.06Å; D176-Q179 PolarHBondContact O-N 2.77Å; I177-Q179 VanDerWaalsContact C-N 3.33Å; I177-Q179 PolarHBondContact O-N 3.07Å; Q179-Q182 PolarHBondContact O-N 2.89Å; Q179-T183 PolarHBondContact O-N 3.26Å; Q179-T183 PolarHBondContact O-OG1 3.1Å
180	R	95.4	Very high	88.5	Confident	20 Å²	20	62 Å²	62	8%	0.075	33%	0.33	C	S	.	.	H	α-helix	trans	-63.3	-41.8	173.8	-73.1	-164.4	-65.8	-96.5	5.6	112.1	F128 M155 G156 S158 D176 I177 V178 Q182 T183 L184	F128-R180 HydrophobicContact CB-CG 4.48Å; F128-R180 HydrophobicContact CD1-CB 4Å; F128-R180 HydrophobicContact CD1-CG 3.99Å; F128-R180 HydrophobicContact CD2-CG 4.29Å; F128-R180 HydrophobicContact CE1-CB 3.81Å; F128-R180 HydrophobicContact CE1-CG 4.31Å; F128-R180 VanDerWaalsContact CE1-O 3.29Å; F128-R180 WeakPolarHBondContact CE1-O 3.36Å; F128-R180 HydrophobicContact CE2-CB 4.35Å; F128-R180 HydrophobicContact CG-CB 4.36Å; F128-R180 HydrophobicContact CG-CG 3.99Å; F128-R180 HydrophobicContact CZ-CB 4.02Å; M155-R180 HydrophobicContact CE-CB 3.92Å; G156-R180 PolarHBondContact O-NH2 3.32Å; S158-R180 PolarHBondContact OG-NH1 3.22Å; S158-R180 PolarHBondContact OG-NH2 3.33Å; D176-R180 WeakPolarHBondContact O-CG 3.49Å; D176-R180 PolarHBondContact O-N 3.48Å; D176-R180 IonicContact OD1-CZ 2.69Å; D176-R180 IonicContact OD1-NH1 2.98Å; D176-R180 PolarHBondContact OD1-NH1 3.32Å; D176-R180 IonicContact OD2-CZ 2.81Å; D176-R180 IonicContact OD2-NH1 3.46Å; D176-R180 PolarHBondContact OD2-NH1 3.4Å; D176-R180 IonicContact OD2-NH2 2.85Å; I177-R180 PolarHBondContact O-N 3.42Å; V178-R180 PolarHBondContact O-N 3.11Å; R180-Q182 VanDerWaalsContact C-N 3.33Å; R180-Q182 PolarHBondContact O-N 3.02Å; R180-T183 PolarHBondContact O-N 2.87Å; R180-L184 PolarHBondContact O-N 3.13Å
181	C	97.1	Very high	90.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-41.5	176.6	-172.3	0	0	0	0	111.5	M155 I177 V178 L184 T185 F199	M155-C181 HydrophobicContact CE-CB 4.19Å; M155-C181 HydrophobicContact CG-CB 4.21Å; M155-C181 HydrophobicContact SD-CB 4.39Å; I177-C181 WeakPolarHBondContact O-CB 3.32Å; I177-C181 PolarHBondContact O-N 2.92Å; V178-C181 WeakPolarHBondContact O-CB 3.36Å; V178-C181 PolarHBondContact O-N 3.39Å; C181-L184 PolarHBondContact O-N 3.47Å; C181-T185 WeakPolarHBondContact O-CB 3.47Å; C181-T185 PolarHBondContact O-N 2.99Å; C181-T185 PolarHBondContact O-OG1 3.17Å; C181-F199 HydrophobicContact CB-CD1 4.17Å; C181-F199 HydrophobicContact CB-CE1 3.99Å
182	Q	97.6	Very high	92.2	Very high	93 Å²	93	57.4 Å²	57.4	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-60.1	-49.5	172.9	-72.7	172.6	-21.3	0	0	110.9	V178 Q179 R180 L184 T185 E186 F199	V178-Q182 WeakPolarHBondContact O-CG 3.39Å; V178-Q182 PolarHBondContact O-N 3Å; Q179-Q182 PolarHBondContact O-N 2.89Å; R180-Q182 VanDerWaalsContact C-N 3.33Å; R180-Q182 PolarHBondContact O-N 3.02Å; Q182-L184 PolarHBondContact O-N 3.26Å; Q182-T185 WeakPolarHBondContact O-CB 3.28Å; Q182-T185 PolarHBondContact O-N 2.76Å; Q182-T185 VanDerWaalsContact O-N 3.11Å; Q182-E186 WeakPolarHBondContact O-CG 3.3Å; Q182-E186 PolarHBondContact O-N 2.94Å; Q182-F199 HydrophobicContact CG-CE1 3.78Å; Q182-F199 HydrophobicContact CG-CZ 3.98Å
183	T	97.6	Very high	93.8	Very high	50 Å²	50	51 Å²	51	31%	0.307	27%	0.267	S	S	.	.	H	α-helix	trans	-57.9	-46.7	178.9	-52.7	0	0	0	0	111.5	L134 Q179 R180 T185 E186 V187	L134-T183 HydrophobicContact CD2-CG2 3.84Å; Q179-T183 PolarHBondContact O-N 3.26Å; Q179-T183 PolarHBondContact O-OG1 3.1Å; R180-T183 PolarHBondContact O-N 2.87Å; T183-T185 VanDerWaalsContact C-N 3.34Å; T183-T185 PolarHBondContact O-N 3.19Å; T183-E186 PolarHBondContact O-N 3.29Å; T183-V187 VanDerWaalsContact O-CG2 3.29Å; T183-V187 WeakPolarHBondContact O-CG2 3.31Å; T183-V187 PolarHBondContact O-N 2.96Å
184	L	97.8	Very high	94.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-38.9	177	-179	59.1	0	0	0	111.7	F128 L134 L137 V153 M155 R180 C181 Q182 V187 L188 L238	F128-L184 HydrophobicContact CE1-CB 3.99Å; F128-L184 HydrophobicContact CZ-CB 4.2Å; F128-L184 HydrophobicContact CZ-CD2 4.46Å; L134-L184 HydrophobicContact CD1-CD1 3.79Å; L137-L184 HydrophobicContact CD2-CD1 4.34Å; V153-L184 HydrophobicContact CG1-CD2 4.22Å; M155-L184 HydrophobicContact CE-CD2 4.41Å; M155-L184 HydrophobicContact SD-CD2 3.99Å; R180-L184 PolarHBondContact O-N 3.13Å; C181-L184 PolarHBondContact O-N 3.47Å; Q182-L184 PolarHBondContact O-N 3.26Å; L184-V187 PolarHBondContact O-N 3.17Å; L184-L188 HydrophobicContact CD1-CD1 4.05Å; L184-L188 HydrophobicContact CD1-CG 4.06Å; L184-L188 HydrophobicContact CD2-CD1 4.48Å; L184-L188 HydrophobicContact CG-CD1 3.82Å; L184-L188 HydrophobicContact CG-CG 4.31Å; L184-L188 VanDerWaalsContact O-CB 3.31Å; L184-L188 WeakPolarHBondContact O-CB 3.34Å; L184-L188 VanDerWaalsContact O-CG 3.3Å; L184-L188 WeakPolarHBondContact O-CG 3.27Å; L184-L188 PolarHBondContact O-N 3.32Å; L184-L238 HydrophobicContact CB-CD1 4.44Å; L184-L238 HydrophobicContact CD2-CD1 4.24Å; L184-L238 HydrophobicContact CD2-CD2 4.1Å; L184-L238 HydrophobicContact CG-CD1 4.2Å
185	T	98.1	Very high	95.4	Very high	13 Å²	13	49.5 Å²	49.5	8%	0.08	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-49.3	176.2	-57.6	0	0	0	0	110.9	C181 Q182 T183 V187 L188 Q189 V195 L238	C181-T185 WeakPolarHBondContact O-CB 3.47Å; C181-T185 PolarHBondContact O-N 2.99Å; C181-T185 PolarHBondContact O-OG1 3.17Å; Q182-T185 WeakPolarHBondContact O-CB 3.28Å; Q182-T185 PolarHBondContact O-N 2.76Å; Q182-T185 VanDerWaalsContact O-N 3.11Å; T183-T185 VanDerWaalsContact C-N 3.34Å; T183-T185 PolarHBondContact O-N 3.19Å; T185-V187 PolarHBondContact O-N 3.35Å; T185-L188 PolarHBondContact O-N 3.26Å; T185-Q189 WeakPolarHBondContact O-CB 3.47Å; T185-Q189 VanDerWaalsContact O-CG 3.28Å; T185-Q189 WeakPolarHBondContact O-CG 3.29Å; T185-Q189 PolarHBondContact O-N 2.93Å; T185-V195 HydrophobicContact CG2-CB 4.47Å; T185-V195 HydrophobicContact CG2-CG1 4.3Å; T185-L238 WeakPolarHBondContact OG1-CD1 3.44Å
186	E	97.8	Very high	95.8	Very high	114 Å²	114	48.6 Å²	48.6	53%	0.533	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-45.8	178.8	-70.7	174	-176.1	0	0	111.6	Q182 T183 Q189 H190	Q182-E186 WeakPolarHBondContact O-CG 3.3Å; Q182-E186 PolarHBondContact O-N 2.94Å; T183-E186 PolarHBondContact O-N 3.29Å; E186-Q189 PolarHBondContact O-N 2.69Å; E186-H190 PolarHBondContact O-CD2 3.4Å; E186-H190 PolarHBondContact O-N 3.3Å
187	V	97.8	Very high	96.2	Very high	15 Å²	15	48 Å²	48	9%	0.091	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-41.5	179.3	-179.3	0	0	0	0	111.1	L134 A138 T183 L184 T185 H190 H191	L134-V187 HydrophobicContact CD2-CG2 3.95Å; L134-V187 HydrophobicContact CG-CG1 4.47Å; L134-V187 HydrophobicContact CG-CG2 4.29Å; A138-V187 HydrophobicContact CB-CB 4.33Å; A138-V187 HydrophobicContact CB-CG1 3.47Å; A138-V187 VanDerWaalsContact CB-CG1 3.47Å; T183-V187 VanDerWaalsContact O-CG2 3.29Å; T183-V187 WeakPolarHBondContact O-CG2 3.31Å; T183-V187 PolarHBondContact O-N 2.96Å; L184-V187 PolarHBondContact O-N 3.17Å; T185-V187 PolarHBondContact O-N 3.35Å; V187-H190 WeakPolarHBondContact O-CB 3.33Å; V187-H190 PolarHBondContact O-N 3.3Å; V187-H191 PolarHBondContact O-CD2 3.4Å; V187-H191 PolarHBondContact O-N 2.99Å
188	L	97.5	Very high	96.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-43.5	175.2	-79.9	169.8	0	0	0	112.1	A138 L141 L184 T185 H190 H191 S192 A193 V195 I236 L238	A138-L188 HydrophobicContact CB-CD2 3.94Å; A138-L188 HydrophobicContact CB-CG 4.26Å; L141-L188 HydrophobicContact CB-CD2 3.72Å; L141-L188 HydrophobicContact CD1-CD1 4.4Å; L141-L188 HydrophobicContact CD1-CD2 4.08Å; L184-L188 HydrophobicContact CD1-CD1 4.05Å; L184-L188 HydrophobicContact CD1-CG 4.06Å; L184-L188 HydrophobicContact CD2-CD1 4.48Å; L184-L188 HydrophobicContact CG-CD1 3.82Å; L184-L188 HydrophobicContact CG-CG 4.31Å; L184-L188 VanDerWaalsContact O-CB 3.31Å; L184-L188 WeakPolarHBondContact O-CB 3.34Å; L184-L188 VanDerWaalsContact O-CG 3.3Å; L184-L188 WeakPolarHBondContact O-CG 3.27Å; L184-L188 PolarHBondContact O-N 3.32Å; T185-L188 PolarHBondContact O-N 3.26Å; L188-H190 VanDerWaalsContact C-N 3.3Å; L188-H190 PolarHBondContact O-N 3.09Å; L188-H191 CarbonylContact O-C 3.58Å; L188-H191 WeakPolarHBondContact O-CA 3.39Å; L188-H191 PolarHBondContact O-N 3.27Å; L188-S192 PolarHBondContact O-N 2.98Å; L188-A193 HydrophobicContact CB-CB 4.06Å; L188-A193 HydrophobicContact CD2-CB 4.14Å; L188-A193 WeakPolarHBondContact O-CB 3.42Å; L188-A193 PolarHBondContact O-N 2.89Å; L188-V195 HydrophobicContact CB-CG2 3.62Å; L188-V195 HydrophobicContact CD1-CG1 4.32Å; L188-V195 HydrophobicContact CD1-CG2 3.78Å; L188-V195 HydrophobicContact CG-CG2 4.29Å; L188-I236 HydrophobicContact CD2-CD1 4.42Å; L188-L238 HydrophobicContact CD1-CD1 4.21Å; L188-L238 HydrophobicContact CD1-CD2 4.01Å
189	Q	95.6	Very high	96.4	Very high	114 Å²	114	51.1 Å²	51.1	53%	0.533	27%	0.265	S	S	.	.	H	α-helix	trans	-61.3	-38.6	175.5	-74	175.1	-11.3	0	0	111.8	T185 E186 H191 S192	T185-Q189 WeakPolarHBondContact O-CB 3.47Å; T185-Q189 VanDerWaalsContact O-CG 3.28Å; T185-Q189 WeakPolarHBondContact O-CG 3.29Å; T185-Q189 PolarHBondContact O-N 2.93Å; E186-Q189 PolarHBondContact O-N 2.69Å; Q189-H191 PolarHBondContact O-N 3.27Å; Q189-S192 WeakPolarHBondContact O-CA 3.37Å; Q189-S192 PolarHBondContact O-N 2.74Å
190	H	94.8	Very high	96.2	Very high	155 Å²	155	47.2 Å²	47.2	72%	0.718	25%	0.251	S	S	*	.	H	α-helix	trans	-62.1	-27.7	171.9	-76.7	-55.4	0	0	0	113.4	E186 V187 L188 S192	E186-H190 PolarHBondContact O-CD2 3.4Å; E186-H190 PolarHBondContact O-N 3.3Å; V187-H190 WeakPolarHBondContact O-CB 3.33Å; V187-H190 PolarHBondContact O-N 3.3Å; L188-H190 VanDerWaalsContact C-N 3.3Å; L188-H190 PolarHBondContact O-N 3.09Å; H190-S192 PolarHBondContact O-N 2.89Å
191	H	92.9	Very high	96	Very high	23 Å²	23	46.2 Å²	46.2	11%	0.106	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	15.7	171.2	-78.1	-91.3	0	0	0	113.7	R84 Q135 R146 V187 L188 Q189 A193	R84-H191 PolarHBondContact NH1-ND1 3.42Å; Q135-H191 PolarHBondContact OE1-NE2 3.44Å; R146-H191 PolarHBondContact NH1-O 3.44Å; V187-H191 PolarHBondContact O-CD2 3.4Å; V187-H191 PolarHBondContact O-N 2.99Å; L188-H191 CarbonylContact O-C 3.58Å; L188-H191 WeakPolarHBondContact O-CA 3.39Å; L188-H191 PolarHBondContact O-N 3.27Å; Q189-H191 PolarHBondContact O-N 3.27Å; H191-A193 PolarHBondContact O-N 3.15Å
192	S	93.4	Very high	95.8	Very high	82 Å²	82	47.6 Å²	47.6	57%	0.573	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	31.2	179.8	-51	0	0	0	0	113.6	L188 Q189 H190	L188-S192 PolarHBondContact O-N 2.98Å; Q189-S192 WeakPolarHBondContact O-CA 3.37Å; Q189-S192 PolarHBondContact O-N 2.74Å; H190-S192 PolarHBondContact O-N 2.89Å
193	A	95.4	Very high	95.5	Very high	7 Å²	7	46.1 Å²	46.1	6%	0.058	26%	0.257	C	S	.	.			trans	-88.6	139.5	172.6	0	0	0	0	0	111.3	L188 H191 V195 I236	L188-A193 HydrophobicContact CB-CB 4.06Å; L188-A193 HydrophobicContact CD2-CB 4.14Å; L188-A193 WeakPolarHBondContact O-CB 3.42Å; L188-A193 PolarHBondContact O-N 2.89Å; H191-A193 PolarHBondContact O-N 3.15Å; A193-V195 HydrophobicContact CB-CG2 4.22Å; A193-I236 HydrophobicContact CB-CD1 4.29Å
194	S	97.1	Very high	95.3	Very high	65 Å²	65	43.8 Å²	43.8	46%	0.455	24%	0.243	S	C	.	.			trans	-85.3	131.3	167.6	-176	0	0	0	0	109.4	Q145 A235 I236	Q145-S194 VanDerWaalsContact NE2-N 3.1Å; Q145-S194 PolarHBondContact NE2-O 2.97Å; Q145-S194 VanDerWaalsContact OE1-N 3.15Å; S194-A235 WeakPolarHBondContact O-CA 3.29Å; S194-I236 PolarHBondContact O-N 2.89Å
195	V	97.5	Very high	95.3	Very high	17 Å²	17	43.8 Å²	43.8	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	139.8	-168.8	-174.9	0	0	0	0	110	T185 L188 A193 I236 L238	T185-V195 HydrophobicContact CG2-CB 4.47Å; T185-V195 HydrophobicContact CG2-CG1 4.3Å; L188-V195 HydrophobicContact CB-CG2 3.62Å; L188-V195 HydrophobicContact CD1-CG1 4.32Å; L188-V195 HydrophobicContact CD1-CG2 3.78Å; L188-V195 HydrophobicContact CG-CG2 4.29Å; A193-V195 HydrophobicContact CB-CG2 4.22Å; V195-I236 WeakPolarHBondContact CA-O 3.49Å; V195-I236 WeakPolarHBondContact CG1-O 3.25Å; V195-L238 HydrophobicContact CG1-CD1 3.5Å; V195-L238 VanDerWaalsContact CG1-CD1 3.5Å; V195-L238 HydrophobicContact CG1-CD2 4.19Å; V195-L238 HydrophobicContact CG1-CG 3.45Å; V195-L238 VanDerWaalsContact CG1-CG 3.45Å
196	I	97.6	Very high	95.1	Very high	41 Å²	41	46.9 Å²	46.9	21%	0.21	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	105.8	173.7	-64.3	174	0	0	0	108.6	F198 W229 A235 I236 P237 L238	I196-F198 HydrophobicContact CB-CE2 4.37Å; I196-F198 HydrophobicContact CG2-CD2 4.39Å; I196-F198 HydrophobicContact CG2-CE2 3.72Å; I196-F198 HydrophobicContact CG2-CZ 3.82Å; I196-W229 HydrophobicContact CD1-CH2 4.17Å; I196-W229 HydrophobicContact CD1-CZ3 3.82Å; I196-A235 HydrophobicContact CD1-CB 3.71Å; I196-A235 HydrophobicContact CG1-CB 3.75Å; I196-I236 PolarHBondContact N-O 3.14Å; I196-P237 WeakPolarHBondContact O-CA 3.16Å; I196-L238 PolarHBondContact O-N 2.98Å
197	P	97.3	Very high	94.9	Very high	42 Å²	42	42.6 Å²	42.6	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	125.5	178.3	31.5	-32.6	0	0	0	112.2	F199	P197-F199 HydrophobicContact CB-CD1 4.46Å; P197-F199 HydrophobicContact CB-CD2 4.34Å; P197-F199 HydrophobicContact CB-CE1 3.97Å; P197-F199 HydrophobicContact CB-CE2 3.84Å; P197-F199 HydrophobicContact CB-CZ 3.64Å; P197-F199 HydrophobicContact CG-CD2 4.48Å; P197-F199 HydrophobicContact CG-CE2 3.69Å; P197-F199 HydrophobicContact CG-CZ 3.75Å
198	F	96.4	Very high	94.4	Very high	26 Å²	26	46.5 Å²	46.5	11%	0.114	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	80.5	169.3	-61.9	-89.5	0	0	0	109.1	I196 S200 A201 L204 L226 L227 S230 P237 L238 V239 C240	I196-F198 HydrophobicContact CB-CE2 4.37Å; I196-F198 HydrophobicContact CG2-CD2 4.39Å; I196-F198 HydrophobicContact CG2-CE2 3.72Å; I196-F198 HydrophobicContact CG2-CZ 3.82Å; F198-S200 PolarHBondContact O-N 3.36Å; F198-A201 HydrophobicContact CB-CB 4.47Å; F198-L204 HydrophobicContact CB-CD2 4.42Å; F198-L204 HydrophobicContact CD1-CD2 3.7Å; F198-L204 HydrophobicContact CE1-CD2 4.12Å; F198-L204 HydrophobicContact CG-CD2 4.05Å; F198-L226 HydrophobicContact CE1-CB 4.13Å; F198-L226 HydrophobicContact CE1-CD1 4.33Å; F198-L226 HydrophobicContact CZ-CB 4.31Å; F198-L227 HydrophobicContact CE2-CD2 4.47Å; F198-S230 WeakPolarHBondContact CZ-OG 3.04Å; F198-P237 HydrophobicContact CD2-CB 4.17Å; F198-P237 HydrophobicContact CE2-CB 3.66Å; F198-L238 PolarHBondContact N-O 3.48Å; F198-V239 HydrophobicContact CD2-CG2 4.34Å; F198-C240 WeakPolarHBondContact O-CB 3.19Å; F198-C240 PolarHBondContact O-N 3.13Å
199	F	93.9	Very high	93.7	Very high	74 Å²	74	51.4 Å²	51.4	33%	0.325	28%	0.284	S	S	.	.	S	Bend	trans	-63.6	-27.2	179.5	-61.5	-64.7	0	0	0	113.5	V178 C181 Q182 P197	V178-F199 HydrophobicContact CB-CD1 4.41Å; V178-F199 HydrophobicContact CG1-CD1 3.82Å; V178-F199 HydrophobicContact CG1-CE1 4.24Å; V178-F199 HydrophobicContact CG1-CG 4.45Å; V178-F199 HydrophobicContact CG2-CB 4.28Å; V178-F199 HydrophobicContact CG2-CD1 4.32Å; C181-F199 HydrophobicContact CB-CD1 4.17Å; C181-F199 HydrophobicContact CB-CE1 3.99Å; Q182-F199 HydrophobicContact CG-CE1 3.78Å; Q182-F199 HydrophobicContact CG-CZ 3.98Å; P197-F199 HydrophobicContact CB-CD1 4.46Å; P197-F199 HydrophobicContact CB-CD2 4.34Å; P197-F199 HydrophobicContact CB-CE1 3.97Å; P197-F199 HydrophobicContact CB-CE2 3.84Å; P197-F199 HydrophobicContact CB-CZ 3.64Å; P197-F199 HydrophobicContact CG-CD2 4.48Å; P197-F199 HydrophobicContact CG-CE2 3.69Å; P197-F199 HydrophobicContact CG-CZ 3.75Å
200	S	90.6	Very high	92.7	Very high	40 Å²	40	48.5 Å²	48.5	28%	0.28	28%	0.275	S	S	.	.	S	Bend	trans	-131.5	114.9	166	-142.4	0	0	0	0	106.9	R174 F198 E202	R174-S200 PolarHBondContact NH2-OG 2.86Å; F198-S200 PolarHBondContact O-N 3.36Å; S200-E202 PolarHBondContact O-N 3.19Å; S200-E202 PolarHBondContact OG-OE1 3.48Å
201	A	91.7	Very high	91.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.27	C	S	.	.			trans	-93	25	-177.5	0	0	0	0	0	111.7	F198 A203 L204 L205 V239 C240 V242	F198-A201 HydrophobicContact CB-CB 4.47Å; A201-A203 PolarHBondContact O-N 3.28Å; A201-L204 HydrophobicContact CB-CD1 4.09Å; A201-L204 HydrophobicContact CB-CD2 3.78Å; A201-L204 HydrophobicContact CB-CG 3.81Å; A201-L204 CarbonylContact O-C 3.54Å; A201-L204 WeakPolarHBondContact O-CG 3.19Å; A201-L204 PolarHBondContact O-N 2.88Å; A201-L205 HydrophobicContact CB-CD1 3.62Å; A201-L205 HydrophobicContact CB-CG 3.86Å; A201-L205 WeakPolarHBondContact O-CB 3.44Å; A201-L205 PolarHBondContact O-N 3.46Å; A201-V239 HydrophobicContact CB-CG1 3.78Å; A201-C240 WeakPolarHBondContact CB-O 3.41Å; A201-V242 CarbonylContact C-O 3.56Å; A201-V242 VanDerWaalsContact CA-O 3.25Å; A201-V242 WeakPolarHBondContact CA-O 3.01Å; A201-V242 WeakPolarHBondContact CB-O 3.33Å; A201-V242 PolarHBondContact N-O 3.46Å
202	E	93.3	Very high	90.1	Very high	28 Å²	28	54.5 Å²	54.5	13%	0.131	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.5	-178.4	-75.9	177.6	-132	0	0	115	S200 V242 R244 S250	S200-E202 PolarHBondContact O-N 3.19Å; S200-E202 PolarHBondContact OG-OE1 3.48Å; E202-V242 PolarHBondContact N-O 3.35Å; E202-R244 HydrophobicContact CB-CG 3.65Å; E202-R244 HydrophobicContact CG-CG 3.64Å; E202-R244 IonicContact OE2-CZ 3.02Å; E202-R244 IonicContact OE2-NE 3.27Å; E202-R244 PolarHBondContact OE2-NE 3.37Å; E202-R244 IonicContact OE2-NH2 3.52Å; E202-R244 PolarHBondContact OE2-NH2 3.45Å; E202-S250 VanDerWaalsContact OE1-CB 3.32Å; E202-S250 WeakPolarHBondContact OE1-CB 3.27Å; E202-S250 PolarHBondContact OE1-OG 3.05Å; E202-S250 PolarHBondContact OE2-OG 2.92Å
203	A	91.3	Very high	88.4	Confident	62 Å²	62	55 Å²	55	51%	0.512	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-18.4	175.9	0	0	0	0	0	112.5	A201 L226	A201-A203 PolarHBondContact O-N 3.28Å; A203-L226 HydrophobicContact CB-CD1 3.87Å
204	L	94.4	Very high	86.8	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-19.2	-176	69.5	107.6	0	0	0	114	F198 A201 V222 D223 L227 V239	F198-L204 HydrophobicContact CB-CD2 4.42Å; F198-L204 HydrophobicContact CD1-CD2 3.7Å; F198-L204 HydrophobicContact CE1-CD2 4.12Å; F198-L204 HydrophobicContact CG-CD2 4.05Å; A201-L204 HydrophobicContact CB-CD1 4.09Å; A201-L204 HydrophobicContact CB-CD2 3.78Å; A201-L204 HydrophobicContact CB-CG 3.81Å; A201-L204 CarbonylContact O-C 3.54Å; A201-L204 WeakPolarHBondContact O-CG 3.19Å; A201-L204 PolarHBondContact O-N 2.88Å; L204-V222 CarbonylContact O-C 3.56Å; L204-V222 WeakPolarHBondContact O-CA 3.37Å; L204-D223 PolarHBondContact O-N 2.94Å; L204-L227 HydrophobicContact CD1-CD1 4.24Å; L204-L227 HydrophobicContact CD1-CD2 4.4Å; L204-L227 HydrophobicContact CD1-CG 4.38Å; L204-V239 HydrophobicContact CD1-CG1 4.29Å
205	L	96	Very high	84.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	114.5	-178.7	-58.2	-179.8	0	0	0	110.7	A201 I220 V222 V239 G243 R244 L253 V258	A201-L205 HydrophobicContact CB-CD1 3.62Å; A201-L205 HydrophobicContact CB-CG 3.86Å; A201-L205 WeakPolarHBondContact O-CB 3.44Å; A201-L205 PolarHBondContact O-N 3.46Å; L205-I220 HydrophobicContact CB-CG2 4.46Å; L205-I220 HydrophobicContact CD2-CG2 4.13Å; L205-V222 HydrophobicContact CD2-CG2 3.9Å; L205-V239 HydrophobicContact CD1-CG1 4.32Å; L205-G243 CarbonylContact O-C 3.47Å; L205-G243 VanDerWaalsContact O-CA 3.26Å; L205-G243 WeakPolarHBondContact O-CA 3.33Å; L205-R244 PolarHBondContact O-N 2.92Å; L205-L253 HydrophobicContact CB-CD1 4.06Å; L205-L253 HydrophobicContact CD1-CD1 4.17Å; L205-V258 HydrophobicContact CD1-CG1 3.83Å; L205-V258 HydrophobicContact CD1-CG2 3.99Å; L205-V258 HydrophobicContact CD2-CG1 4.08Å
206	L	94.9	Very high	83.1	Confident	79 Å²	79	62.4 Å²	62.4	41%	0.414	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.8	179.7	-58.8	174.3	0	0	0	109.7	A221 R244	L206-A221 HydrophobicContact CB-CB 4.43Å; L206-A221 PolarHBondContact N-O 2.88Å; L206-A221 PolarHBondContact O-N 2.7Å; L206-R244 HydrophobicContact CD2-CB 4.15Å
207	V	92.7	Very high	81.7	Confident	23 Å²	23	63.3 Å²	63.3	14%	0.139	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.6	172.8	-173.6	0	0	0	0	108.8	R244 T246 V251 L253	V207-R244 PolarHBondContact N-O 3.3Å; V207-T246 VanDerWaalsContact O-CG2 3.32Å; V207-T246 WeakPolarHBondContact O-CG2 3.31Å; V207-V251 HydrophobicContact CG2-CG1 4.11Å; V207-L253 HydrophobicContact CG2-CD1 4.29Å; V207-L253 HydrophobicContact CG2-CD2 3.44Å; V207-L253 VanDerWaalsContact CG2-CD2 3.44Å; V207-L253 HydrophobicContact CG2-CG 4.49Å
208	Q	88.5	Confident	80.8	Confident	98 Å²	98	65.3 Å²	65.3	46%	0.458	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.4	174.9	-62.2	-173	-12.4	0	0	109.4	S218 S219 A221	Q208-S218 WeakPolarHBondContact O-CA 3.23Å; Q208-S219 PolarHBondContact N-O 3.15Å; Q208-S219 PolarHBondContact O-N 2.98Å; Q208-A221 HydrophobicContact CG-CB 4.04Å
209	D	81.3	Confident	80.5	Confident	103 Å²	103	66.8 Å²	66.8	55%	0.551	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-65.6	148.4	171	-70.1	-37.2	0	0	0	110.1	T246	D209-T246 HydrophobicContact CB-CG2 4.43Å; D209-T246 VanDerWaalsContact OD2-CG2 3.27Å; D209-T246 WeakPolarHBondContact OD2-CG2 3.48Å; D209-T246 PolarHBondContact OD2-OG1 3.33Å; D209-T246 VanDerWaalsContact OD2-OG1 3.04Å
210	P	75.8	Confident	80.5	Confident	53 Å²	53	64.8 Å²	64.8	34%	0.344	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-61.4	145.4	178.6	25.7	-33.5	0	0	0	110.9	Q212 A216	P210-Q212 PolarHBondContact O-N 2.86Å; P210-A216 WeakPolarHBondContact CB-O 3.4Å
211	P	70.3	Confident	80.7	Confident	95 Å²	95	64.1 Å²	64.1	62%	0.617	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-58.6	137.3	174.6	22.4	-30.2	0	0	0	110	G213 S214	P211-G213 PolarHBondContact O-N 3.38Å; P211-G213 VanDerWaalsContact O-N 3.16Å; P211-S214 WeakPolarHBondContact O-CB 3.34Å; P211-S214 PolarHBondContact O-N 3.31Å
212	Q	61.9	Low	80.9	Confident	209 Å²	209	65.1 Å²	65.1	98%	0.977	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	121.8	-176.2	-71.6	-176.3	-3.5	0	0	111	P210	P210-Q212 PolarHBondContact O-N 2.86Å
213	G	58.4	Low	80.9	Confident	91 Å²	91	68.2 Å²	68.2	94%	0.938	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	0.2	-179.9	0	0	0	0	0	115.7	P211	P211-G213 PolarHBondContact O-N 3.38Å; P211-G213 VanDerWaalsContact O-N 3.16Å
214	S	61.4	Low	81	Confident	57 Å²	57	70.7 Å²	70.7	40%	0.399	45%	0.445	S	S	.	.			trans	-95.3	136.1	173	-175.7	0	0	0	0	111.8	P211 A216	P211-S214 WeakPolarHBondContact O-CB 3.34Å; P211-S214 PolarHBondContact O-N 3.31Å; S214-A216 PolarHBondContact O-N 3.5Å; S214-A216 VanDerWaalsContact OG-CB 3.23Å; S214-A216 WeakPolarHBondContact OG-CB 3.37Å; S214-A216 PolarHBondContact OG-N 2.72Å; S214-A216 VanDerWaalsContact OG-N 3.13Å
215	S	57.1	Low	81	Confident	134 Å²	134	72.6 Å²	72.6	94%	0.937	46%	0.464	S	S	*	.			trans	-77.6	3.9	168.5	-56.4	0	0	0	0	113.2
216	A	61.3	Low	80.9	Confident	54 Å²	54	75.8 Å²	75.8	45%	0.446	48%	0.481	S	S	.	.			trans	-67	144.3	176.5	0	0	0	0	0	110.7	P210 S214	P210-A216 WeakPolarHBondContact CB-O 3.4Å; S214-A216 PolarHBondContact O-N 3.5Å; S214-A216 VanDerWaalsContact OG-CB 3.23Å; S214-A216 WeakPolarHBondContact OG-CB 3.37Å; S214-A216 PolarHBondContact OG-N 2.72Å; S214-A216 VanDerWaalsContact OG-N 3.13Å
217	G	68	Low	80.9	Confident	61 Å²	61	72 Å²	72	63%	0.629	46%	0.461	S	S	*	.			trans	-66.9	174.8	172.5	0	0	0	0	0	112.6
218	S	77.9	Confident	81	Confident	83 Å²	83	73.6 Å²	73.6	58%	0.58	47%	0.467	S	S	*	.			trans	-56.6	145	170.7	50	0	0	0	0	110.9	Q208	Q208-S218 WeakPolarHBondContact O-CA 3.23Å
219	S	88.9	Confident	81.2	Confident	57 Å²	57	75.7 Å²	75.7	40%	0.399	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	155.6	179.9	72.1	0	0	0	0	111.2	Q208	Q208-S219 PolarHBondContact N-O 3.15Å; Q208-S219 PolarHBondContact O-N 2.98Å
220	I	94.5	Very high	81.9	Confident	33 Å²	33	70.8 Å²	70.8	17%	0.169	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.8	179.9	-56.9	169.2	0	0	0	108.1	L205 V222 L253 D257 V258 A261	L205-I220 HydrophobicContact CB-CG2 4.46Å; L205-I220 HydrophobicContact CD2-CG2 4.13Å; I220-V222 HydrophobicContact CG2-CG2 4.34Å; I220-L253 HydrophobicContact CD1-CB 4.31Å; I220-L253 HydrophobicContact CD1-CD1 4.11Å; I220-L253 HydrophobicContact CG1-CD1 4.36Å; I220-L253 HydrophobicContact CG2-CD1 4.33Å; I220-D257 HydrophobicContact CD1-CB 3.8Å; I220-V258 HydrophobicContact CD1-CG2 3.77Å; I220-A261 HydrophobicContact CB-CB 3.86Å; I220-A261 HydrophobicContact CG2-CB 4.01Å; I220-A261 WeakPolarHBondContact O-CB 3.48Å
221	A	94.4	Very high	82.8	Confident	26 Å²	26	68.4 Å²	68.4	22%	0.215	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	138.9	168.9	0	0	0	0	0	110.3	L206 Q208	L206-A221 HydrophobicContact CB-CB 4.43Å; L206-A221 PolarHBondContact N-O 2.88Å; L206-A221 PolarHBondContact O-N 2.7Å; Q208-A221 HydrophobicContact CG-CB 4.04Å
222	V	96.2	Very high	83.8	Confident	21 Å²	21	68.3 Å²	68.3	13%	0.127	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121	-177	-177	0	0	0	0	110.8	L204 L205 I220 K224 L227 A261 I262 V265	L204-V222 CarbonylContact O-C 3.56Å; L204-V222 WeakPolarHBondContact O-CA 3.37Å; L205-V222 HydrophobicContact CD2-CG2 3.9Å; I220-V222 HydrophobicContact CG2-CG2 4.34Å; V222-K224 PolarHBondContact O-N 3.12Å; V222-L227 HydrophobicContact CG1-CD1 4.1Å; V222-A261 HydrophobicContact CG2-CB 3.65Å; V222-I262 HydrophobicContact CG1-CG1 4.12Å; V222-I262 HydrophobicContact CG2-CG1 4.17Å; V222-V265 HydrophobicContact CB-CG2 4.02Å
223	D	93.4	Very high	85.2	Confident	93 Å²	93	61.9 Å²	61.9	50%	0.497	40%	0.4	S	S	.	.			trans	-81.6	109.9	164.4	-172.9	-16.4	0	0	0	109.4	L204 G225	L204-D223 PolarHBondContact O-N 2.94Å; D223-G225 VanDerWaalsContact C-N 3.29Å; D223-G225 PolarHBondContact O-N 3.45Å; D223-G225 PolarHBondContact OD1-N 2.67Å
224	K	93.1	Very high	86.9	Confident	114 Å²	114	59.1 Å²	59.1	50%	0.496	37%	0.372	S	S	.	.			trans	-74.8	-12.1	-178.6	63.8	177.8	-177.7	-176	0	114.8	V222 L226 L227 Q228 V265 L266	V222-K224 PolarHBondContact O-N 3.12Å; K224-L226 PolarHBondContact O-N 3.19Å; K224-L227 PolarHBondContact O-N 3.41Å; K224-L227 VanDerWaalsContact O-N 3.17Å; K224-Q228 WeakPolarHBondContact O-CB 3.25Å; K224-Q228 PolarHBondContact O-N 2.99Å; K224-V265 HydrophobicContact CB-CG1 3.58Å; K224-V265 HydrophobicContact CD-CG1 3.67Å; K224-V265 HydrophobicContact CG-CG1 3.92Å; K224-L266 HydrophobicContact CB-CD2 4.13Å
225	G	93.9	Very high	88.5	Confident	40 Å²	40	56.5 Å²	56.5	41%	0.412	35%	0.354	S	S	.	.	H	α-helix	trans	-55	-48.8	-170.4	0	0	0	0	0	113.1	D223 W229	D223-G225 VanDerWaalsContact C-N 3.29Å; D223-G225 PolarHBondContact O-N 3.45Å; D223-G225 PolarHBondContact OD1-N 2.67Å; G225-W229 VanDerWaalsContact O-CB 3.3Å; G225-W229 WeakPolarHBondContact O-CB 3.45Å; G225-W229 PolarHBondContact O-N 2.76Å
226	L	94.2	Very high	90.5	Very high	68 Å²	68	50.1 Å²	50.1	36%	0.356	31%	0.309	S	S	.	.	H	α-helix	trans	-70.1	-36.1	179.5	-68.5	176.6	0	0	0	113.2	F198 A203 K224 S230	F198-L226 HydrophobicContact CE1-CB 4.13Å; F198-L226 HydrophobicContact CE1-CD1 4.33Å; F198-L226 HydrophobicContact CZ-CB 4.31Å; A203-L226 HydrophobicContact CB-CD1 3.87Å; K224-L226 PolarHBondContact O-N 3.19Å; L226-S230 WeakPolarHBondContact O-CB 3.48Å; L226-S230 PolarHBondContact O-N 3.36Å; L226-S230 PolarHBondContact O-OG 3.1Å
227	L	95.3	Very high	92.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-48.3	176.8	-65.4	178.3	0	0	0	110.4	V152 F198 L204 V222 K224 W229 S230 L231 P237 V239 I262 L266	V152-L227 HydrophobicContact CG1-CD2 4.49Å; F198-L227 HydrophobicContact CE2-CD2 4.47Å; L204-L227 HydrophobicContact CD1-CD1 4.24Å; L204-L227 HydrophobicContact CD1-CD2 4.4Å; L204-L227 HydrophobicContact CD1-CG 4.38Å; V222-L227 HydrophobicContact CG1-CD1 4.1Å; K224-L227 PolarHBondContact O-N 3.41Å; K224-L227 VanDerWaalsContact O-N 3.17Å; L227-W229 PolarHBondContact O-N 2.83Å; L227-S230 WeakPolarHBondContact O-CB 3.24Å; L227-S230 PolarHBondContact O-N 3.07Å; L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.4Å; L227-P237 HydrophobicContact CD2-CB 4.07Å; L227-P237 HydrophobicContact CD2-CG 4.39Å; L227-V239 HydrophobicContact CD2-CG2 3.85Å; L227-I262 HydrophobicContact CD1-CD1 4.36Å; L227-I262 HydrophobicContact CD1-CG1 4.16Å; L227-I262 HydrophobicContact CD1-CG2 4Å; L227-L266 HydrophobicContact CD1-CD1 4.29Å
228	Q	94.5	Very high	93.7	Very high	55 Å²	55	44.7 Å²	44.7	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-46	178.6	-171.4	61	55.6	0	0	111.2	K224 S230 L231 D232	K224-Q228 WeakPolarHBondContact O-CB 3.25Å; K224-Q228 PolarHBondContact O-N 2.99Å; Q228-S230 VanDerWaalsContact C-N 3.31Å; Q228-S230 PolarHBondContact O-N 2.83Å; Q228-L231 PolarHBondContact O-N 2.8Å; Q228-D232 PolarHBondContact NE2-OD1 3.18Å; Q228-D232 PolarHBondContact NE2-OD2 3.39Å; Q228-D232 WeakPolarHBondContact O-CB 3.44Å; Q228-D232 PolarHBondContact O-N 2.95Å
229	W	94.2	Very high	94.6	Very high	143 Å²	143	40.7 Å²	40.7	54%	0.542	23%	0.231	S	C	.	.	H	α-helix	trans	-56.8	-43.8	174.7	170.9	76.3	0	0	0	112.3	I196 G225 L227 L231 D232 C233	I196-W229 HydrophobicContact CD1-CH2 4.17Å; I196-W229 HydrophobicContact CD1-CZ3 3.82Å; G225-W229 VanDerWaalsContact O-CB 3.3Å; G225-W229 WeakPolarHBondContact O-CB 3.45Å; G225-W229 PolarHBondContact O-N 2.76Å; L227-W229 PolarHBondContact O-N 2.83Å; W229-L231 VanDerWaalsContact C-N 3.33Å; W229-L231 PolarHBondContact O-N 3.14Å; W229-D232 PolarHBondContact O-N 2.91Å; W229-C233 PolarHBondContact O-N 2.97Å; W229-C233 PolarHBondContact O-SG 3.49Å; W229-C233 VanDerWaalsContact O-SG 3.41Å
230	S	94.8	Very high	95	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-43.7	177.8	-59	0	0	0	0	111.8	F198 L226 L227 Q228 C233 A235	F198-S230 WeakPolarHBondContact CZ-OG 3.04Å; L226-S230 WeakPolarHBondContact O-CB 3.48Å; L226-S230 PolarHBondContact O-N 3.36Å; L226-S230 PolarHBondContact O-OG 3.1Å; L227-S230 WeakPolarHBondContact O-CB 3.24Å; L227-S230 PolarHBondContact O-N 3.07Å; Q228-S230 VanDerWaalsContact C-N 3.31Å; Q228-S230 PolarHBondContact O-N 2.83Å; S230-C233 PolarHBondContact O-N 3.41Å; S230-A235 PolarHBondContact O-N 2.85Å
231	L	94.2	Very high	95	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-36.3	177.3	-66.2	177.2	0	0	0	112.2	A117 K150 V152 L227 Q228 W229 C233 G234 P237	A117-L231 HydrophobicContact CB-CD1 3.95Å; K150-L231 HydrophobicContact CB-CB 4.47Å; K150-L231 HydrophobicContact CB-CD1 4.36Å; K150-L231 HydrophobicContact CB-CD2 3.9Å; K150-L231 HydrophobicContact CB-CG 4.46Å; K150-L231 HydrophobicContact CD-CB 4.06Å; K150-L231 HydrophobicContact CG-CB 4.26Å; K150-L231 HydrophobicContact CG-CD2 4.41Å; V152-L231 HydrophobicContact CG2-CD1 3.99Å; V152-L231 HydrophobicContact CG2-CD2 4.08Å; V152-L231 HydrophobicContact CG2-CG 4.37Å; L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.4Å; Q228-L231 PolarHBondContact O-N 2.8Å; W229-L231 VanDerWaalsContact C-N 3.33Å; W229-L231 PolarHBondContact O-N 3.14Å; L231-C233 VanDerWaalsContact C-N 3.34Å; L231-G234 WeakPolarHBondContact O-CA 3.39Å; L231-G234 PolarHBondContact O-N 2.86Å; L231-P237 HydrophobicContact CD2-CG 4.05Å; L231-P237 HydrophobicContact CG-CG 4.46Å
232	D	92	Very high	95	Very high	93 Å²	93	35.3 Å²	35.3	50%	0.497	19%	0.194	S	C	.	.	H	α-helix	trans	-73.5	-27.4	178.3	-65.1	-19.9	0	0	0	112.3	K150 Q228 W229 G234	K150-D232 IonicContact NZ-OD1 2.96Å; K150-D232 PolarHBondContact NZ-OD1 2.8Å; Q228-D232 PolarHBondContact NE2-OD1 3.18Å; Q228-D232 PolarHBondContact NE2-OD2 3.39Å; Q228-D232 WeakPolarHBondContact O-CB 3.44Å; Q228-D232 PolarHBondContact O-N 2.95Å; W229-D232 PolarHBondContact O-N 2.91Å; D232-G234 PolarHBondContact O-N 2.81Å
233	C	92.4	Very high	94.9	Very high	74 Å²	74	34.3 Å²	34.3	50%	0.5	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-0.3	165	-69.5	0	0	0	0	113.3	W229 S230 L231 A235	W229-C233 PolarHBondContact O-N 2.97Å; W229-C233 PolarHBondContact O-SG 3.49Å; W229-C233 VanDerWaalsContact O-SG 3.41Å; S230-C233 PolarHBondContact O-N 3.41Å; L231-C233 VanDerWaalsContact C-N 3.34Å; C233-A235 PolarHBondContact O-N 3.41Å
234	G	92.6	Very high	94.9	Very high	33 Å²	33	34.9 Å²	34.9	34%	0.34	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	22.6	-176.8	0	0	0	0	0	113	Q145 L231 D232	Q145-G234 PolarHBondContact NE2-O 2.88Å; L231-G234 WeakPolarHBondContact O-CA 3.39Å; L231-G234 PolarHBondContact O-N 2.86Å; D232-G234 PolarHBondContact O-N 2.81Å
235	A	96.3	Very high	94.8	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.025	17%	0.167	C	C	.	.			trans	-100.4	154.7	178.2	0	0	0	0	0	111.8	S194 I196 S230 C233 P237	S194-A235 WeakPolarHBondContact O-CA 3.29Å; I196-A235 HydrophobicContact CD1-CB 3.71Å; I196-A235 HydrophobicContact CG1-CB 3.75Å; S230-A235 PolarHBondContact O-N 2.85Å; C233-A235 PolarHBondContact O-N 3.41Å; A235-P237 WeakPolarHBondContact O-CD 3.22Å
236	I	98.1	Very high	94.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	110.6	173.9	-52.5	179.8	0	0	0	108.5	L141 Q145 P151 V153 L188 A193 S194 V195 I196 L238	L141-I236 HydrophobicContact CB-CD1 4.05Å; Q145-I236 HydrophobicContact CB-CD1 4.05Å; Q145-I236 HydrophobicContact CB-CG1 4.16Å; Q145-I236 HydrophobicContact CG-CG1 4.37Å; P151-I236 HydrophobicContact CG-CD1 4.17Å; P151-I236 HydrophobicContact CG-CG1 4.03Å; P151-I236 HydrophobicContact CG-CG2 4.27Å; V153-I236 HydrophobicContact CG2-CG2 3.92Å; L188-I236 HydrophobicContact CD2-CD1 4.42Å; A193-I236 HydrophobicContact CB-CD1 4.29Å; S194-I236 PolarHBondContact O-N 2.89Å; V195-I236 WeakPolarHBondContact CA-O 3.49Å; V195-I236 WeakPolarHBondContact CG1-O 3.25Å; I196-I236 PolarHBondContact N-O 3.14Å; I236-L238 HydrophobicContact CG2-CD2 4.12Å; I236-L238 PolarHBondContact O-N 3.4Å
237	P	98	Very high	94.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.7	171.9	27.8	-34.6	0	0	0	110.7	P151 V152 V153 I196 F198 L227 L231 A235	P151-P237 WeakPolarHBondContact O-CD 3.39Å; V152-P237 HydrophobicContact CB-CG 4.1Å; V152-P237 HydrophobicContact CG1-CG 3.99Å; V152-P237 HydrophobicContact CG2-CG 3.74Å; V153-P237 PolarHBondContact N-O 2.86Å; I196-P237 WeakPolarHBondContact O-CA 3.16Å; F198-P237 HydrophobicContact CD2-CB 4.17Å; F198-P237 HydrophobicContact CE2-CB 3.66Å; L227-P237 HydrophobicContact CD2-CB 4.07Å; L227-P237 HydrophobicContact CD2-CG 4.39Å; L231-P237 HydrophobicContact CD2-CG 4.05Å; L231-P237 HydrophobicContact CG-CG 4.46Å; A235-P237 WeakPolarHBondContact O-CD 3.22Å
238	L	98.3	Very high	94.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.7	169.7	-53.3	-175.9	0	0	0	109.3	V153 L184 T185 L188 V195 I196 F198 I236	V153-L238 HydrophobicContact CB-CD2 3.57Å; V153-L238 HydrophobicContact CG1-CD2 4Å; V153-L238 HydrophobicContact CG2-CD2 3.92Å; V153-L238 CarbonylContact O-C 3.55Å; V153-L238 WeakPolarHBondContact O-CA 3.34Å; L184-L238 HydrophobicContact CB-CD1 4.44Å; L184-L238 HydrophobicContact CD2-CD1 4.24Å; L184-L238 HydrophobicContact CD2-CD2 4.1Å; L184-L238 HydrophobicContact CG-CD1 4.2Å; T185-L238 WeakPolarHBondContact OG1-CD1 3.44Å; L188-L238 HydrophobicContact CD1-CD1 4.21Å; L188-L238 HydrophobicContact CD1-CD2 4.01Å; V195-L238 HydrophobicContact CG1-CD1 3.5Å; V195-L238 VanDerWaalsContact CG1-CD1 3.5Å; V195-L238 HydrophobicContact CG1-CD2 4.19Å; V195-L238 HydrophobicContact CG1-CG 3.45Å; V195-L238 VanDerWaalsContact CG1-CG 3.45Å; I196-L238 PolarHBondContact O-N 2.98Å; F198-L238 PolarHBondContact N-O 3.48Å; I236-L238 HydrophobicContact CG2-CD2 4.12Å; I236-L238 PolarHBondContact O-N 3.4Å
239	V	98.1	Very high	93.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	111.8	-173.4	-175.8	0	0	0	0	109.7	V152 V153 V154 M155 F198 A201 L204 L205 L227 I262	V152-V239 HydrophobicContact CG1-CG2 4.34Å; V153-V239 PolarHBondContact O-N 3.3Å; V154-V239 WeakPolarHBondContact CA-O 3.4Å; V154-V239 HydrophobicContact CG2-CB 4.5Å; M155-V239 PolarHBondContact N-O 3.37Å; F198-V239 HydrophobicContact CD2-CG2 4.34Å; A201-V239 HydrophobicContact CB-CG1 3.78Å; L204-V239 HydrophobicContact CD1-CG1 4.29Å; L205-V239 HydrophobicContact CD1-CG1 4.32Å; L227-V239 HydrophobicContact CD2-CG2 3.85Å; V239-I262 HydrophobicContact CG1-CD1 4.27Å; V239-I262 HydrophobicContact CG2-CD1 4.37Å
240	C	96.6	Very high	93.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.			trans	-75.8	129.3	163.3	-62.2	0	0	0	0	108	I177 F198 A201 V242	I177-C240 HydrophobicContact CG2-CB 3.84Å; F198-C240 WeakPolarHBondContact O-CB 3.19Å; F198-C240 PolarHBondContact O-N 3.13Å; A201-C240 WeakPolarHBondContact CB-O 3.41Å; C240-V242 HydrophobicContact CB-CG2 4.49Å; C240-V242 PolarHBondContact O-N 3.05Å
241	P	95.3	Very high	93.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-77	66.4	-173.5	34.1	-38.8	0	0	0	111.1	M155 L157 L253 V258	M155-P241 VanDerWaalsContact O-CD 3.25Å; M155-P241 WeakPolarHBondContact O-CD 3.28Å; M155-P241 WeakPolarHBondContact O-CG 3.17Å; L157-P241 HydrophobicContact CD2-CG 3.76Å; L157-P241 HydrophobicContact CG-CG 3.96Å; P241-L253 WeakPolarHBondContact CB-O 3.4Å; P241-L253 PolarHBondContact O-N 3.46Å; P241-V258 HydrophobicContact CB-CB 4.23Å; P241-V258 HydrophobicContact CB-CG1 4.36Å; P241-V258 HydrophobicContact CB-CG2 3.8Å
242	V	94.2	Very high	93.3	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	110.6	178.3	-178.2	0	0	0	0	107.5	A201 E202 C240 V251 V252	A201-V242 CarbonylContact C-O 3.56Å; A201-V242 VanDerWaalsContact CA-O 3.25Å; A201-V242 WeakPolarHBondContact CA-O 3.01Å; A201-V242 WeakPolarHBondContact CB-O 3.33Å; A201-V242 PolarHBondContact N-O 3.46Å; E202-V242 PolarHBondContact N-O 3.35Å; C240-V242 HydrophobicContact CB-CG2 4.49Å; C240-V242 PolarHBondContact O-N 3.05Å; V242-V251 CarbonylContact C-O 3.54Å; V242-V251 WeakPolarHBondContact CA-O 3.43Å; V242-V252 HydrophobicContact CG2-CG2 4.41Å
243	G	93.6	Very high	93.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-171	-178.1	0	0	0	0	0	112.8	L205 S250 V251	L205-G243 CarbonylContact O-C 3.47Å; L205-G243 VanDerWaalsContact O-CA 3.26Å; L205-G243 WeakPolarHBondContact O-CA 3.33Å; G243-S250 CarbonylContact O-C 3.57Å; G243-S250 WeakPolarHBondContact O-CA 3.16Å; G243-V251 PolarHBondContact N-O 3.21Å; G243-V251 PolarHBondContact O-N 3.49Å
244	R	93.9	Very high	93.3	Very high	106 Å²	106	37.8 Å²	37.8	40%	0.4	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.1	171.7	-66.3	-174.1	178.6	150.3	8.3	111.3	E202 L205 L206 V207 R249	E202-R244 HydrophobicContact CB-CG 3.65Å; E202-R244 HydrophobicContact CG-CG 3.64Å; E202-R244 IonicContact OE2-CZ 3.02Å; E202-R244 IonicContact OE2-NE 3.27Å; E202-R244 PolarHBondContact OE2-NE 3.37Å; E202-R244 IonicContact OE2-NH2 3.52Å; E202-R244 PolarHBondContact OE2-NH2 3.45Å; L205-R244 PolarHBondContact O-N 2.92Å; L206-R244 HydrophobicContact CD2-CB 4.15Å; V207-R244 PolarHBondContact N-O 3.3Å; R244-R249 WeakPolarHBondContact CA-O 3.36Å
245	D	91.1	Very high	93.3	Very high	29 Å²	29	36.5 Å²	36.5	16%	0.155	20%	0.202	C	C	.	.			trans	-75.9	175	168.1	75	8.2	0	0	0	111.8	T247 G248 R249 V251	D245-T247 PolarHBondContact O-N 3.37Å; D245-T247 VanDerWaalsContact O-N 3.16Å; D245-T247 VanDerWaalsContact OD1-CA 3.31Å; D245-T247 WeakPolarHBondContact OD1-CA 3.48Å; D245-T247 WeakPolarHBondContact OD1-CB 3.16Å; D245-T247 PolarHBondContact OD1-N 3.13Å; D245-T247 PolarHBondContact OD1-OG1 2.84Å; D245-T247 PolarHBondContact OD2-OG1 3.43Å; D245-G248 PolarHBondContact O-N 3.22Å; D245-G248 PolarHBondContact OD1-N 2.9Å; D245-R249 PolarHBondContact N-O 2.92Å; D245-R249 PolarHBondContact OD1-N 2.92Å; D245-R249 IonicContact OD2-CZ 3.25Å; D245-R249 IonicContact OD2-NE 3.96Å; D245-R249 PolarHBondContact OD2-NE 2.84Å; D245-R249 VanDerWaalsContact OD2-NE 3.13Å; D245-R249 IonicContact OD2-NH2 3.12Å; D245-R249 PolarHBondContact OD2-NH2 3.32Å; D245-V251 HydrophobicContact CB-CG1 4.07Å
246	T	89.1	Confident	93.3	Very high	83 Å²	83	36.9 Å²	36.9	51%	0.509	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.7	178.8	52.7	0	0	0	0	113.5	V207 D209	V207-T246 VanDerWaalsContact O-CG2 3.32Å; V207-T246 WeakPolarHBondContact O-CG2 3.31Å; D209-T246 HydrophobicContact CB-CG2 4.43Å; D209-T246 VanDerWaalsContact OD2-CG2 3.27Å; D209-T246 WeakPolarHBondContact OD2-CG2 3.48Å; D209-T246 PolarHBondContact OD2-OG1 3.33Å; D209-T246 VanDerWaalsContact OD2-OG1 3.04Å
247	T	90.5	Very high	93.1	Very high	93 Å²	93	40.4 Å²	40.4	57%	0.571	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-0.9	173.1	73.3	0	0	0	0	113.1	D245 R249	D245-T247 PolarHBondContact O-N 3.37Å; D245-T247 VanDerWaalsContact O-N 3.16Å; D245-T247 VanDerWaalsContact OD1-CA 3.31Å; D245-T247 WeakPolarHBondContact OD1-CA 3.48Å; D245-T247 WeakPolarHBondContact OD1-CB 3.16Å; D245-T247 PolarHBondContact OD1-N 3.13Å; D245-T247 PolarHBondContact OD1-OG1 2.84Å; D245-T247 PolarHBondContact OD2-OG1 3.43Å; T247-R249 VanDerWaalsContact C-N 3.35Å; T247-R249 WeakPolarHBondContact OG1-CG 3.35Å; T247-R249 PolarHBondContact OG1-NE 3.43Å
248	G	88	Confident	93	Very high	48 Å²	48	40.4 Å²	40.4	50%	0.495	22%	0.223	S	C	.	.	S	Bend	trans	80.3	9.9	-178	0	0	0	0	0	114.5	D245	D245-G248 PolarHBondContact O-N 3.22Å; D245-G248 PolarHBondContact OD1-N 2.9Å
249	R	90.3	Very high	93	Very high	165 Å²	165	40.4 Å²	40.4	62%	0.623	22%	0.223	S	C	*	.			trans	-84.8	142.9	177.8	-63.5	179.6	-58.9	167.7	7.3	110.8	R244 D245 T247 V251	R244-R249 WeakPolarHBondContact CA-O 3.36Å; D245-R249 PolarHBondContact N-O 2.92Å; D245-R249 PolarHBondContact OD1-N 2.92Å; D245-R249 IonicContact OD2-CZ 3.25Å; D245-R249 IonicContact OD2-NE 3.96Å; D245-R249 PolarHBondContact OD2-NE 2.84Å; D245-R249 VanDerWaalsContact OD2-NE 3.13Å; D245-R249 IonicContact OD2-NH2 3.12Å; D245-R249 PolarHBondContact OD2-NH2 3.32Å; T247-R249 VanDerWaalsContact C-N 3.35Å; T247-R249 WeakPolarHBondContact OG1-CG 3.35Å; T247-R249 PolarHBondContact OG1-NE 3.43Å; R249-V251 PolarHBondContact O-N 3.46Å
250	S	90.8	Very high	93	Very high	60 Å²	60	40.6 Å²	40.6	42%	0.42	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	126.7	173	-44.7	0	0	0	0	110.5	E202 G243	E202-S250 VanDerWaalsContact OE1-CB 3.32Å; E202-S250 WeakPolarHBondContact OE1-CB 3.27Å; E202-S250 PolarHBondContact OE1-OG 3.05Å; E202-S250 PolarHBondContact OE2-OG 2.92Å; G243-S250 CarbonylContact O-C 3.57Å; G243-S250 WeakPolarHBondContact O-CA 3.16Å
251	V	90.3	Very high	93	Very high	52 Å²	52	41 Å²	41	32%	0.315	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141.6	-178.6	56.4	0	0	0	0	110.3	V207 V242 G243 D245 R249 L253	V207-V251 HydrophobicContact CG2-CG1 4.11Å; V242-V251 CarbonylContact C-O 3.54Å; V242-V251 WeakPolarHBondContact CA-O 3.43Å; G243-V251 PolarHBondContact N-O 3.21Å; G243-V251 PolarHBondContact O-N 3.49Å; D245-V251 HydrophobicContact CB-CG1 4.07Å; R249-V251 PolarHBondContact O-N 3.46Å; V251-L253 HydrophobicContact CG1-CD2 3.84Å; V251-L253 HydrophobicContact CG2-CD2 4.46Å
252	V	90.8	Very high	93.1	Very high	45 Å²	45	41 Å²	41	27%	0.273	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.4	172.5	178.1	0	0	0	0	108.3	L157 R174 I177 V242	L157-V252 HydrophobicContact CD1-CG1 3.65Å; L157-V252 HydrophobicContact CD2-CG1 3.64Å; L157-V252 HydrophobicContact CG-CG1 4.33Å; R174-V252 HydrophobicContact CB-CG2 4.48Å; I177-V252 HydrophobicContact CD1-CG1 4.33Å; V242-V252 HydrophobicContact CG2-CG2 4.41Å
253	L	91.6	Very high	93.3	Very high	16 Å²	16	41 Å²	41	8%	0.084	23%	0.227	C	C	.	.			trans	-110.1	150.3	-174	-58.5	178.1	0	0	0	111	L157 L205 V207 I220 P241 V251 S255 V258	L157-L253 WeakPolarHBondContact CD1-O 3.47Å; L205-L253 HydrophobicContact CB-CD1 4.06Å; L205-L253 HydrophobicContact CD1-CD1 4.17Å; V207-L253 HydrophobicContact CG2-CD1 4.29Å; V207-L253 HydrophobicContact CG2-CD2 3.44Å; V207-L253 VanDerWaalsContact CG2-CD2 3.44Å; V207-L253 HydrophobicContact CG2-CG 4.49Å; I220-L253 HydrophobicContact CD1-CB 4.31Å; I220-L253 HydrophobicContact CD1-CD1 4.11Å; I220-L253 HydrophobicContact CG1-CD1 4.36Å; I220-L253 HydrophobicContact CG2-CD1 4.33Å; P241-L253 WeakPolarHBondContact CB-O 3.4Å; P241-L253 PolarHBondContact O-N 3.46Å; V251-L253 HydrophobicContact CG1-CD2 3.84Å; V251-L253 HydrophobicContact CG2-CD2 4.46Å; L253-S255 PolarHBondContact O-N 2.82Å; L253-V258 HydrophobicContact CB-CG2 3.62Å; L253-V258 HydrophobicContact CD1-CG2 4.04Å; L253-V258 HydrophobicContact CG-CG2 4.49Å
254	D	91.5	Very high	93.4	Very high	58 Å²	58	44.7 Å²	44.7	31%	0.31	24%	0.243	S	C	.	.			trans	-57.9	128.2	175.2	-173.2	-81	0	0	0	111.4	V256 D257 V258	D254-V256 VanDerWaalsContact C-N 3.29Å; D254-V256 PolarHBondContact O-N 2.94Å; D254-V256 WeakPolarHBondContact OD1-CA 3.5Å; D254-V256 VanDerWaalsContact OD1-CB 3.24Å; D254-V256 WeakPolarHBondContact OD1-CB 3.29Å; D254-V256 PolarHBondContact OD1-N 3.48Å; D254-D257 HydrophobicContact CB-CB 4.15Å; D254-D257 PolarHBondContact O-N 2.76Å; D254-D257 PolarHBondContact OD1-N 3.39Å; D254-D257 VanDerWaalsContact OD1-N 3.15Å; D254-V258 WeakPolarHBondContact O-CG2 3.39Å; D254-V258 PolarHBondContact O-N 2.9Å
255	S	94.2	Very high	93.5	Very high	7 Å²	7	42 Å²	42	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-67.3	-29.9	-174.9	55.9	0	0	0	0	112.6	E122 L253 T259	E122-S255 PolarHBondContact OE1-OG 2.98Å; L253-S255 PolarHBondContact O-N 2.82Å; S255-T259 VanDerWaalsContact O-CB 3.25Å; S255-T259 WeakPolarHBondContact O-CB 3.49Å; S255-T259 PolarHBondContact O-N 3.36Å; S255-T259 PolarHBondContact O-OG1 2.85Å
256	V	94.9	Very high	93.7	Very high	11 Å²	11	41.2 Å²	41.2	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-71.6	-43.3	177.3	-177.6	0	0	0	0	109.7	D254 T259 A260 F273 R313 T316	D254-V256 VanDerWaalsContact C-N 3.29Å; D254-V256 PolarHBondContact O-N 2.94Å; D254-V256 WeakPolarHBondContact OD1-CA 3.5Å; D254-V256 VanDerWaalsContact OD1-CB 3.24Å; D254-V256 WeakPolarHBondContact OD1-CB 3.29Å; D254-V256 PolarHBondContact OD1-N 3.48Å; V256-T259 WeakPolarHBondContact O-CB 2.81Å; V256-T259 PolarHBondContact O-N 3.22Å; V256-A260 WeakPolarHBondContact O-CB 3.44Å; V256-A260 PolarHBondContact O-N 3.39Å; V256-F273 HydrophobicContact CB-CE1 4.37Å; V256-F273 HydrophobicContact CG1-CE1 3.84Å; V256-F273 HydrophobicContact CG1-CZ 4.24Å; V256-F273 HydrophobicContact CG2-CE1 4.3Å; V256-R313 HydrophobicContact CG1-CB 4.49Å; V256-R313 HydrophobicContact CG1-CG 4.04Å; V256-R313 HydrophobicContact CG2-CG 4.23Å; V256-T316 HydrophobicContact CG1-CG2 3.9Å
257	D	94.7	Very high	94	Very high	74 Å²	74	40.8 Å²	40.8	40%	0.396	23%	0.227	S	C	.	.	H	α-helix	trans	-66.7	-40.5	177.3	-66.5	-27.4	0	0	0	111.9	I220 D254 A260 A261	I220-D257 HydrophobicContact CD1-CB 3.8Å; D254-D257 HydrophobicContact CB-CB 4.15Å; D254-D257 PolarHBondContact O-N 2.76Å; D254-D257 PolarHBondContact OD1-N 3.39Å; D254-D257 VanDerWaalsContact OD1-N 3.15Å; D257-A260 PolarHBondContact O-N 3.38Å; D257-A261 WeakPolarHBondContact O-CB 3.27Å; D257-A261 PolarHBondContact O-N 3.19Å
258	V	96.5	Very high	94.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-45	172.6	170.3	0	0	0	0	110.9	V154 L205 I220 P241 L253 D254 A260 A261 I262	V154-V258 HydrophobicContact CG1-CB 4.34Å; V154-V258 HydrophobicContact CG1-CG1 3.9Å; V154-V258 HydrophobicContact CG2-CG1 4.44Å; L205-V258 HydrophobicContact CD1-CG1 3.83Å; L205-V258 HydrophobicContact CD1-CG2 3.99Å; L205-V258 HydrophobicContact CD2-CG1 4.08Å; I220-V258 HydrophobicContact CD1-CG2 3.77Å; P241-V258 HydrophobicContact CB-CB 4.23Å; P241-V258 HydrophobicContact CB-CG1 4.36Å; P241-V258 HydrophobicContact CB-CG2 3.8Å; L253-V258 HydrophobicContact CB-CG2 3.62Å; L253-V258 HydrophobicContact CD1-CG2 4.04Å; L253-V258 HydrophobicContact CG-CG2 4.49Å; D254-V258 WeakPolarHBondContact O-CG2 3.39Å; D254-V258 PolarHBondContact O-N 2.9Å; V258-A260 VanDerWaalsContact C-N 3.32Å; V258-A260 PolarHBondContact O-N 3.14Å; V258-A261 PolarHBondContact O-N 2.98Å; V258-I262 HydrophobicContact CG1-CD1 3.76Å; V258-I262 HydrophobicContact CG1-CG1 4.39Å; V258-I262 WeakPolarHBondContact O-CB 3.49Å; V258-I262 WeakPolarHBondContact O-CG1 3.49Å; V258-I262 PolarHBondContact O-N 2.82Å
259	T	97.7	Very high	94.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-44.1	177	-62.9	0	0	0	0	111.1	V120 E122 V154 S255 V256 S263 V271 F273	V120-T259 HydrophobicContact CG1-CG2 4Å; E122-T259 HydrophobicContact CB-CG2 4.3Å; V154-T259 WeakPolarHBondContact CB-OG1 3.37Å; S255-T259 VanDerWaalsContact O-CB 3.25Å; S255-T259 WeakPolarHBondContact O-CB 3.49Å; S255-T259 PolarHBondContact O-N 3.36Å; S255-T259 PolarHBondContact O-OG1 2.85Å; V256-T259 WeakPolarHBondContact O-CB 2.81Å; V256-T259 PolarHBondContact O-N 3.22Å; T259-S263 VanDerWaalsContact O-CB 3.26Å; T259-S263 WeakPolarHBondContact O-CB 3.38Å; T259-S263 PolarHBondContact O-N 3.02Å; T259-S263 PolarHBondContact O-OG 3.46Å; T259-V271 HydrophobicContact CG2-CG1 3.99Å; T259-F273 HydrophobicContact CG2-CE1 3.93Å; T259-F273 HydrophobicContact CG2-CZ 3.99Å
260	A	97.2	Very high	94.5	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.033	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-44.2	176.3	0	0	0	0	0	111.8	V256 D257 V258 S263 K264 T316 L320	V256-A260 WeakPolarHBondContact O-CB 3.44Å; V256-A260 PolarHBondContact O-N 3.39Å; D257-A260 PolarHBondContact O-N 3.38Å; V258-A260 VanDerWaalsContact C-N 3.32Å; V258-A260 PolarHBondContact O-N 3.14Å; A260-S263 PolarHBondContact O-N 3.35Å; A260-K264 VanDerWaalsContact O-CG 3.29Å; A260-K264 WeakPolarHBondContact O-CG 3.38Å; A260-K264 PolarHBondContact O-N 3.36Å; A260-T316 HydrophobicContact CB-CG2 3.69Å; A260-L320 HydrophobicContact CB-CB 4.47Å; A260-L320 HydrophobicContact CB-CD1 4.35Å; A260-L320 HydrophobicContact CB-CD2 4.18Å; A260-L320 WeakPolarHBondContact O-CD1 3.41Å
261	A	97.1	Very high	94.8	Very high	9 Å²	9	27.9 Å²	27.9	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-45	179	0	0	0	0	0	112.3	I220 V222 D257 V258 S263 K264 V265	I220-A261 HydrophobicContact CB-CB 3.86Å; I220-A261 HydrophobicContact CG2-CB 4.01Å; I220-A261 WeakPolarHBondContact O-CB 3.48Å; V222-A261 HydrophobicContact CG2-CB 3.65Å; D257-A261 WeakPolarHBondContact O-CB 3.27Å; D257-A261 PolarHBondContact O-N 3.19Å; V258-A261 PolarHBondContact O-N 2.98Å; A261-S263 VanDerWaalsContact C-N 3.33Å; A261-S263 PolarHBondContact O-N 2.86Å; A261-K264 PolarHBondContact O-N 3.39Å; A261-V265 PolarHBondContact O-N 3.49Å
262	I	97.9	Very high	95.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-43.8	174.4	-69.6	171.9	0	0	0	110.3	V120 V152 V154 V222 L227 V239 V258 K264 V265 L266	V120-I262 HydrophobicContact CG1-CB 4.39Å; V120-I262 HydrophobicContact CG1-CG2 3.95Å; V120-I262 HydrophobicContact CG2-CG2 4Å; V152-I262 HydrophobicContact CG1-CG2 4.21Å; V154-I262 HydrophobicContact CG2-CD1 3.82Å; V222-I262 HydrophobicContact CG1-CG1 4.12Å; V222-I262 HydrophobicContact CG2-CG1 4.17Å; L227-I262 HydrophobicContact CD1-CD1 4.36Å; L227-I262 HydrophobicContact CD1-CG1 4.16Å; L227-I262 HydrophobicContact CD1-CG2 4Å; V239-I262 HydrophobicContact CG1-CD1 4.27Å; V239-I262 HydrophobicContact CG2-CD1 4.37Å; V258-I262 HydrophobicContact CG1-CD1 3.76Å; V258-I262 HydrophobicContact CG1-CG1 4.39Å; V258-I262 WeakPolarHBondContact O-CB 3.49Å; V258-I262 WeakPolarHBondContact O-CG1 3.49Å; V258-I262 PolarHBondContact O-N 2.82Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.4Å; I262-V265 PolarHBondContact O-N 2.93Å; I262-V265 VanDerWaalsContact O-N 3.15Å; I262-L266 HydrophobicContact CG2-CD1 3.61Å; I262-L266 HydrophobicContact CG2-CG 4.16Å; I262-L266 WeakPolarHBondContact O-CB 3.45Å; I262-L266 PolarHBondContact O-N 2.86Å
263	S	97.8	Very high	95.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.5	-39.2	179.6	-61.1	0	0	0	0	112.3	T259 A260 A261 V265 Q267 P268 L324	T259-S263 VanDerWaalsContact O-CB 3.26Å; T259-S263 WeakPolarHBondContact O-CB 3.38Å; T259-S263 PolarHBondContact O-N 3.02Å; T259-S263 PolarHBondContact O-OG 3.46Å; A260-S263 PolarHBondContact O-N 3.35Å; A261-S263 VanDerWaalsContact C-N 3.33Å; A261-S263 PolarHBondContact O-N 2.86Å; S263-V265 PolarHBondContact O-N 3.36Å; S263-Q267 WeakPolarHBondContact O-CA 3.43Å; S263-Q267 PolarHBondContact O-N 3.2Å; S263-P268 VanDerWaalsContact O-CD 3.24Å; S263-P268 WeakPolarHBondContact O-CD 3.47Å; S263-L324 WeakPolarHBondContact O-CD2 3.26Å
264	K	96.3	Very high	95.8	Very high	78 Å²	78	22.6 Å²	22.6	34%	0.339	12%	0.117	S	C	.	.	H	α-helix	trans	-61	-33.8	175.4	-71.6	169.2	-170	-166.7	0	112.6	A260 A261 I262 Q267 L320 Q323	A260-K264 VanDerWaalsContact O-CG 3.29Å; A260-K264 WeakPolarHBondContact O-CG 3.38Å; A260-K264 PolarHBondContact O-N 3.36Å; A261-K264 PolarHBondContact O-N 3.39Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.4Å; K264-Q267 PolarHBondContact O-NE2 3.28Å; K264-L320 HydrophobicContact CG-CD1 3.74Å; K264-Q323 VanDerWaalsContact NZ-OE1 3.14Å
265	V	96	Very high	95.9	Very high	51 Å²	51	20 Å²	20	31%	0.309	10%	0.104	S	C	.	.	H	α-helix	trans	-87.3	-36.4	-177.7	-179.1	0	0	0	0	112.2	V222 K224 A261 I262 S263	V222-V265 HydrophobicContact CB-CG2 4.02Å; K224-V265 HydrophobicContact CB-CG1 3.58Å; K224-V265 HydrophobicContact CD-CG1 3.67Å; K224-V265 HydrophobicContact CG-CG1 3.92Å; A261-V265 PolarHBondContact O-N 3.49Å; I262-V265 PolarHBondContact O-N 2.93Å; I262-V265 VanDerWaalsContact O-N 3.15Å; S263-V265 PolarHBondContact O-N 3.36Å
266	L	95.6	Very high	95.9	Very high	12 Å²	12	21.7 Å²	21.7	6%	0.063	12%	0.115	C	C	.	.	H	α-helix	trans	-89.1	-18	-178.5	-63.5	-175.5	0	0	0	114.3	A117 V120 V152 K224 L227 I262	A117-L266 HydrophobicContact CB-CB 3.97Å; A117-L266 HydrophobicContact CB-CD1 4.08Å; V120-L266 HydrophobicContact CG2-CD1 4.4Å; V152-L266 HydrophobicContact CG2-CD1 3.72Å; K224-L266 HydrophobicContact CB-CD2 4.13Å; L227-L266 HydrophobicContact CD1-CD1 4.29Å; I262-L266 HydrophobicContact CG2-CD1 3.61Å; I262-L266 HydrophobicContact CG2-CG 4.16Å; I262-L266 WeakPolarHBondContact O-CB 3.45Å; I262-L266 PolarHBondContact O-N 2.86Å
267	Q	94.5	Very high	95.6	Very high	73 Å²	73	26.1 Å²	26.1	34%	0.341	13%	0.131	S	C	.	.			trans	49.4	57	178.4	-60.3	-80.2	-54.9	0	0	113	S263 K264 Q323	S263-Q267 WeakPolarHBondContact O-CA 3.43Å; S263-Q267 PolarHBondContact O-N 3.2Å; K264-Q267 PolarHBondContact O-NE2 3.28Å; Q267-Q323 PolarHBondContact NE2-O 3.43Å; Q267-Q323 VanDerWaalsContact NE2-O 3.12Å
268	P	95.2	Very high	95.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.114	C	C	.	.			trans	-74.2	158.1	-174.1	35	-39.3	0	0	0	112.5	A117 V120 S263 K270 V271 S328	A117-P268 WeakPolarHBondContact O-CA 3.41Å; V120-P268 HydrophobicContact CB-CG 4.35Å; V120-P268 HydrophobicContact CG2-CB 4.14Å; V120-P268 HydrophobicContact CG2-CG 3.78Å; S263-P268 VanDerWaalsContact O-CD 3.24Å; S263-P268 WeakPolarHBondContact O-CD 3.47Å; P268-K270 VanDerWaalsContact C-N 3.3Å; P268-V271 HydrophobicContact CG-CG2 3.84Å; P268-S328 WeakPolarHBondContact O-CB 3.25Å; P268-S328 PolarHBondContact O-OG 2.99Å
269	L	90.4	Very high	95.1	Very high	61 Å²	61	22.8 Å²	22.8	32%	0.319	11%	0.114	S	C	.	.	S	Bend	trans	-68.5	-31.4	171.3	-69.5	177.5	0	0	0	112.3	F118 E327 S328 S329	F118-L269 HydrophobicContact CD2-CB 4.38Å; F118-L269 HydrophobicContact CD2-CD1 4.19Å; F118-L269 HydrophobicContact CE2-CB 4.41Å; F118-L269 HydrophobicContact CE2-CD1 4.37Å; F118-L269 PolarHBondContact O-N 3.28Å; F118-L269 VanDerWaalsContact O-N 3.14Å; L269-E327 HydrophobicContact CD2-CB 4.39Å; L269-S328 WeakPolarHBondContact O-CA 3.49Å; L269-S329 PolarHBondContact O-N 3.31Å; L269-S329 VanDerWaalsContact O-N 3.14Å
270	K	93.8	Very high	94.8	Very high	35 Å²	35	23 Å²	23	15%	0.152	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	133.2	-177.8	-69.1	-70.5	-178.8	176.4	0	111.7	F118 A119 V120 P268 M272 S329 L342	F118-K270 HydrophobicContact CE2-CG 4.43Å; F118-K270 HydrophobicContact CZ-CG 4.1Å; F118-K270 PolarHBondContact O-N 2.88Å; F118-K270 VanDerWaalsContact O-N 3.1Å; A119-K270 CarbonylContact C-O 3.11Å; A119-K270 WeakPolarHBondContact CA-O 3.41Å; A119-K270 HydrophobicContact CB-CB 4.04Å; V120-K270 PolarHBondContact N-O 3.16Å; P268-K270 VanDerWaalsContact C-N 3.3Å; K270-M272 HydrophobicContact CB-CG 4.47Å; K270-S329 WeakPolarHBondContact CA-O 3.16Å; K270-S329 WeakPolarHBondContact CD-OG 3.23Å; K270-S329 WeakPolarHBondContact CE-OG 3.35Å; K270-S329 PolarHBondContact NZ-OG 3.46Å; K270-L342 HydrophobicContact CB-CD2 4.32Å; K270-L342 HydrophobicContact CD-CD2 4.22Å; K270-L342 HydrophobicContact CG-CD2 3.83Å
271	V	97.6	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	121.9	166.4	-174.3	0	0	0	0	107.4	V120 T259 P268 F273 L320 L324 S329 A330 V331	V120-V271 CarbonylContact O-C 3.52Å; V120-V271 WeakPolarHBondContact O-CA 3.23Å; T259-V271 HydrophobicContact CG2-CG1 3.99Å; P268-V271 HydrophobicContact CG-CG2 3.84Å; V271-F273 HydrophobicContact CG1-CE2 3.81Å; V271-F273 HydrophobicContact CG1-CZ 4.08Å; V271-L320 HydrophobicContact CB-CD2 4.44Å; V271-L320 HydrophobicContact CG1-CD2 3.98Å; V271-L320 HydrophobicContact CG2-CD2 4.09Å; V271-L324 HydrophobicContact CG2-CD1 3.82Å; V271-S329 PolarHBondContact N-O 2.99Å; V271-A330 HydrophobicContact CB-CB 4.14Å; V271-A330 CarbonylContact O-C 3.6Å; V271-A330 WeakPolarHBondContact O-CA 3.35Å; V271-V331 PolarHBondContact O-N 3.47Å
272	M	97.8	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.7	-174.1	-52.3	-171.9	77.5	0	0	110.8	V120 L121 E122 K270 L274 V331 T333 M338 E341 L342	V120-M272 PolarHBondContact O-N 3.15Å; L121-M272 CarbonylContact C-O 3.56Å; L121-M272 VanDerWaalsContact CA-O 3.27Å; L121-M272 WeakPolarHBondContact CA-O 3.37Å; L121-M272 HydrophobicContact CB-CB 4.35Å; L121-M272 HydrophobicContact CD2-CB 3.94Å; L121-M272 HydrophobicContact CD2-CG 4.13Å; L121-M272 HydrophobicContact CD2-SD 3.61Å; L121-M272 HydrophobicContact CG-CB 3.97Å; L121-M272 HydrophobicContact CG-CG 4.26Å; L121-M272 HydrophobicContact CG-SD 4.31Å; E122-M272 PolarHBondContact N-O 3.43Å; K270-M272 HydrophobicContact CB-CG 4.47Å; M272-L274 HydrophobicContact CB-CD2 4.11Å; M272-L274 HydrophobicContact CE-CD2 4.24Å; M272-V331 CarbonylContact C-O 3.56Å; M272-V331 WeakPolarHBondContact CA-O 3.04Å; M272-V331 HydrophobicContact CB-CG1 4.08Å; M272-V331 HydrophobicContact CE-CG1 3.75Å; M272-V331 HydrophobicContact CG-CG1 3.71Å; M272-T333 HydrophobicContact CE-CG2 3.93Å; M272-M338 HydrophobicContact CE-CG 3.82Å; M272-M338 HydrophobicContact SD-CE 4.29Å; M272-M338 HydrophobicContact SD-CG 4.15Å; M272-E341 HydrophobicContact CE-CB 4.35Å; M272-E341 HydrophobicContact CE-CG 4.28Å; M272-L342 HydrophobicContact CE-CD1 4.48Å; M272-L342 HydrophobicContact CE-CD2 4.04Å; M272-L342 HydrophobicContact CE-CG 3.91Å; M272-L342 HydrophobicContact SD-CD1 4.09Å; M272-L342 HydrophobicContact SD-CD2 3.7Å; M272-L342 HydrophobicContact SD-CG 3.94Å
273	F	97.4	Very high	93.6	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	111.1	172.6	-63.9	-87.6	0	0	0	107.5	E122 V256 T259 V271 I317 V331 I332 T333	E122-F273 HydrophobicContact CB-CD1 3.63Å; E122-F273 HydrophobicContact CB-CE1 4.09Å; E122-F273 HydrophobicContact CB-CG 4.46Å; E122-F273 HydrophobicContact CG-CD1 4.17Å; V256-F273 HydrophobicContact CB-CE1 4.37Å; V256-F273 HydrophobicContact CG1-CE1 3.84Å; V256-F273 HydrophobicContact CG1-CZ 4.24Å; V256-F273 HydrophobicContact CG2-CE1 4.3Å; T259-F273 HydrophobicContact CG2-CE1 3.93Å; T259-F273 HydrophobicContact CG2-CZ 3.99Å; V271-F273 HydrophobicContact CG1-CE2 3.81Å; V271-F273 HydrophobicContact CG1-CZ 4.08Å; F273-I317 HydrophobicContact CD2-CD1 3.84Å; F273-I317 HydrophobicContact CD2-CG1 4.26Å; F273-I317 HydrophobicContact CE2-CD1 3.64Å; F273-I317 HydrophobicContact CE2-CG1 3.53Å; F273-I317 HydrophobicContact CZ-CD1 4.35Å; F273-I317 HydrophobicContact CZ-CG1 3.97Å; F273-V331 PolarHBondContact N-O 3Å; F273-I332 HydrophobicContact CB-CG1 3.98Å; F273-I332 HydrophobicContact CD2-CG1 4.35Å; F273-I332 HydrophobicContact CG-CG1 4.46Å; F273-I332 WeakPolarHBondContact O-CA 3.45Å; F273-T333 PolarHBondContact O-N 3.4Å
274	L	97.1	Very high	93.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.4	-169.3	-55.3	-175	0	0	0	110.6	L121 E122 V123 D124 L137 M272 T333 A335 M338	L121-L274 HydrophobicContact CD2-CD1 3.95Å; E122-L274 WeakPolarHBondContact O-CB 3.41Å; E122-L274 PolarHBondContact O-N 3.15Å; V123-L274 HydrophobicContact CG2-CD1 4.33Å; D124-L274 WeakPolarHBondContact CB-O 3.25Å; D124-L274 PolarHBondContact N-O 3.45Å; L137-L274 HydrophobicContact CD1-CD1 3.52Å; M272-L274 HydrophobicContact CB-CD2 4.11Å; M272-L274 HydrophobicContact CE-CD2 4.24Å; L274-T333 WeakPolarHBondContact CA-O 3.39Å; L274-T333 HydrophobicContact CD2-CG2 3.58Å; L274-A335 HydrophobicContact CB-CB 4.17Å; L274-M338 HydrophobicContact CD1-CG 4.45Å; L274-M338 HydrophobicContact CD1-SD 4.05Å; L274-M338 HydrophobicContact CD2-CB 4.46Å; L274-M338 HydrophobicContact CD2-CG 4.41Å
275	N	94.4	Very high	92.6	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.027	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	-173	175.9	63	35.1	0	0	0	111.3	D124 W277 G278 T333 S334 A335	D124-N275 HydrophobicContact CB-CB 4.12Å; N275-W277 HydrophobicContact CB-CD2 4.17Å; N275-W277 HydrophobicContact CB-CE3 4.33Å; N275-W277 HydrophobicContact CB-CH2 3.98Å; N275-W277 HydrophobicContact CB-CZ2 3.82Å; N275-W277 HydrophobicContact CB-CZ3 4.25Å; N275-W277 PolarHBondContact ND2-NE1 3.31Å; N275-W277 PolarHBondContact OD1-N 3.01Å; N275-W277 VanDerWaalsContact OD1-N 3.1Å; N275-G278 VanDerWaalsContact CG-O 3.26Å; N275-G278 PolarHBondContact ND2-O 2.74Å; N275-G278 WeakPolarHBondContact OD1-CA 3.38Å; N275-G278 PolarHBondContact OD1-N 3.44Å; N275-G278 PolarHBondContact OD1-O 3.33Å; N275-T333 PolarHBondContact N-O 3.27Å; N275-T333 PolarHBondContact OD1-O 2.95Å; N275-S334 CarbonylContact O-C 3.59Å; N275-S334 VanDerWaalsContact O-CA 3.29Å; N275-S334 WeakPolarHBondContact O-CA 3.37Å; N275-S334 PolarHBondContact O-OG 2.96Å; N275-A335 PolarHBondContact O-N 3.07Å
276	S	93.6	Very high	92.3	Very high	41 Å²	41	46.5 Å²	46.5	29%	0.287	22%	0.224	S	C	.	.	S	Bend	trans	-87	-22.1	178.3	69.9	0	0	0	0	115	S126 M133 S334	S126-S276 WeakPolarHBondContact CB-OG 3.37Å; S126-S276 PolarHBondContact OG-N 3.3Å; S126-S276 VanDerWaalsContact OG-N 3.16Å; S126-S276 PolarHBondContact OG-OG 3.04Å; M133-S276 WeakPolarHBondContact CE-O 3.48Å; M133-S276 VanDerWaalsContact SD-CA 3.57Å; S276-S334 PolarHBondContact O-OG 3.29Å
277	W	89.3	Confident	92.1	Very high	105 Å²	105	47.5 Å²	47.5	40%	0.398	23%	0.231	S	C	.	.	S	Bend	trans	-107.3	-8.2	-169	55.6	82.3	0	0	0	116.1	S126 N275 R281	S126-W277 WeakPolarHBondContact OG-CZ3 3.17Å; N275-W277 HydrophobicContact CB-CD2 4.17Å; N275-W277 HydrophobicContact CB-CE3 4.33Å; N275-W277 HydrophobicContact CB-CH2 3.98Å; N275-W277 HydrophobicContact CB-CZ2 3.82Å; N275-W277 HydrophobicContact CB-CZ3 4.25Å; N275-W277 PolarHBondContact ND2-NE1 3.31Å; N275-W277 PolarHBondContact OD1-N 3.01Å; N275-W277 VanDerWaalsContact OD1-N 3.1Å; W277-R281 PolarHBondContact O-NH2 2.88Å
278	G	89.2	Confident	91.9	Very high	4 Å²	4	46 Å²	46	4%	0.041	23%	0.225	C	C	.	.			trans	102.9	-152.5	-179.4	0	0	0	0	0	114.7	N275	N275-G278 VanDerWaalsContact CG-O 3.26Å; N275-G278 PolarHBondContact ND2-O 2.74Å; N275-G278 WeakPolarHBondContact OD1-CA 3.38Å; N275-G278 PolarHBondContact OD1-N 3.44Å; N275-G278 PolarHBondContact OD1-O 3.33Å
279	G	91.8	Very high	91.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-67.9	-172	-179.9	0	0	0	0	0	115.1	I332 T350	G279-I332 VanDerWaalsContact CA-O 3.29Å; G279-I332 WeakPolarHBondContact CA-O 3.44Å; G279-T350 VanDerWaalsContact CA-OG1 3.29Å; G279-T350 WeakPolarHBondContact CA-OG1 3.42Å
280	L	92	Very high	91.4	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	25%	0.248	C	C	.	.			trans	-65.2	132.8	172.9	-65.7	-178	0	0	0	110.4	V287 L288 L306 E310 V314 I332 T350 F352	L280-V287 CarbonylContact O-C 3.49Å; L280-V287 WeakPolarHBondContact O-CA 3.47Å; L280-L288 HydrophobicContact CB-CD1 4.37Å; L280-L288 PolarHBondContact O-N 3.29Å; L280-L306 HydrophobicContact CD2-CD2 4.21Å; L280-E310 HydrophobicContact CD2-CB 4.38Å; L280-E310 HydrophobicContact CD2-CG 4.27Å; L280-V314 HydrophobicContact CD1-CG2 3.68Å; L280-I332 HydrophobicContact CD1-CD1 4.31Å; L280-I332 HydrophobicContact CD2-CD1 3.79Å; L280-I332 HydrophobicContact CG-CD1 3.85Å; L280-T350 HydrophobicContact CB-CG2 4.35Å; L280-T350 HydrophobicContact CD1-CG2 4.36Å; L280-T350 HydrophobicContact CG-CG2 4.37Å; L280-T350 PolarHBondContact N-OG1 3.21Å; L280-F352 HydrophobicContact CD1-CE1 4.39Å; L280-F352 HydrophobicContact CD1-CZ 3.67Å; L280-F352 HydrophobicContact CG-CZ 4.4Å
281	R	90.1	Very high	91.2	Very high	102 Å²	102	48.6 Å²	48.6	39%	0.385	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-107.6	125.5	-177.3	-66	-177.5	178	-142.2	1.5	110.9	W277 K286 V287 W305	W277-R281 PolarHBondContact O-NH2 2.88Å; R281-K286 CarbonylContact C-O 3.55Å; R281-K286 WeakPolarHBondContact CA-O 3.44Å; R281-V287 HydrophobicContact CG-CG2 4.18Å; R281-W305 VanDerWaalsContact C-CZ3 3.46Å; R281-W305 WeakPolarHBondContact O-CZ3 3.38Å
282	N	88.3	Confident	90.7	Very high	39 Å²	39	49.1 Å²	49.1	21%	0.209	24%	0.244	C	C	.	.			trans	-70.2	-176.7	176.8	70.6	7.1	0	0	0	112.8	S284 H285 K286 L288 W305	N282-S284 PolarHBondContact ND2-OG 2.81Å; N282-S284 PolarHBondContact O-N 3.31Å; N282-S284 VanDerWaalsContact O-N 3.11Å; N282-S284 WeakPolarHBondContact OD1-CA 3.38Å; N282-S284 PolarHBondContact OD1-N 3.28Å; N282-S284 PolarHBondContact OD1-OG 2.88Å; N282-H285 WeakPolarHBondContact O-CA 3.45Å; N282-H285 PolarHBondContact O-N 3.32Å; N282-H285 PolarHBondContact OD1-N 3.42Å; N282-K286 PolarHBondContact N-O 2.63Å; N282-K286 PolarHBondContact OD1-N 3.49Å; N282-K286 PolarHBondContact OD1-O 2.91Å; N282-L288 HydrophobicContact CB-CD2 4.02Å; N282-L288 HydrophobicContact CB-CG 4.43Å; N282-W305 HydrophobicContact CB-CH2 4.46Å; N282-W305 HydrophobicContact CB-CZ2 4.46Å
283	Q	87.4	Confident	90.2	Very high	138 Å²	138	49.3 Å²	49.3	65%	0.645	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-28.3	176.9	-64.9	178.8	-19.2	0	0	114.5	H285 W305	Q283-H285 VanDerWaalsContact C-N 3.27Å; Q283-W305 HydrophobicContact CG-CB 3.77Å; Q283-W305 HydrophobicContact CG-CD2 4.35Å; Q283-W305 HydrophobicContact CG-CG 3.48Å; Q283-W305 VanDerWaalsContact CG-CG 3.48Å
284	S	87.8	Confident	89.6	Confident	87 Å²	87	52 Å²	52	61%	0.608	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	15	177.1	57.3	0	0	0	0	113.2	N282 K286	N282-S284 PolarHBondContact ND2-OG 2.81Å; N282-S284 PolarHBondContact O-N 3.31Å; N282-S284 VanDerWaalsContact O-N 3.11Å; N282-S284 WeakPolarHBondContact OD1-CA 3.38Å; N282-S284 PolarHBondContact OD1-N 3.28Å; N282-S284 PolarHBondContact OD1-OG 2.88Å; S284-K286 PolarHBondContact O-N 3.3Å; S284-K286 VanDerWaalsContact O-N 3.14Å
285	H	85.8	Confident	88.8	Confident	143 Å²	143	55 Å²	55	66%	0.662	29%	0.294	S	S	*	.	S	Bend	trans	58.4	17	-176.1	-60.6	-71.3	0	0	0	114.8	N282 Q283	N282-H285 WeakPolarHBondContact O-CA 3.45Å; N282-H285 PolarHBondContact O-N 3.32Å; N282-H285 PolarHBondContact OD1-N 3.42Å; Q283-H285 VanDerWaalsContact C-N 3.27Å
286	K	89.8	Confident	88.5	Confident	127 Å²	127	56.4 Å²	56.4	55%	0.552	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-86.1	135.9	174.3	-170.4	-171.8	171.2	-167.8	0	109.4	R281 N282 S284 L288	R281-K286 CarbonylContact C-O 3.55Å; R281-K286 WeakPolarHBondContact CA-O 3.44Å; N282-K286 PolarHBondContact N-O 2.63Å; N282-K286 PolarHBondContact OD1-N 3.49Å; N282-K286 PolarHBondContact OD1-O 2.91Å; S284-K286 PolarHBondContact O-N 3.3Å; S284-K286 VanDerWaalsContact O-N 3.14Å; K286-L288 PolarHBondContact O-N 3.39Å
287	V	91.4	Very high	88.3	Confident	33 Å²	33	56.7 Å²	56.7	20%	0.2	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-62.7	133.9	172.9	178.4	0	0	0	0	109.7	L280 R281	L280-V287 CarbonylContact O-C 3.49Å; L280-V287 WeakPolarHBondContact O-CA 3.47Å; R281-V287 HydrophobicContact CG-CG2 4.18Å
288	L	90.6	Very high	88.3	Confident	43 Å²	43	56.2 Å²	56.2	23%	0.225	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-77.4	123.3	169.5	-66.2	-179.9	0	0	0	108.6	L280 N282 K286 L300 W305 T350	L280-L288 HydrophobicContact CB-CD1 4.37Å; L280-L288 PolarHBondContact O-N 3.29Å; N282-L288 HydrophobicContact CB-CD2 4.02Å; N282-L288 HydrophobicContact CB-CG 4.43Å; K286-L288 PolarHBondContact O-N 3.39Å; L288-L300 HydrophobicContact CD1-CD2 4.12Å; L288-W305 HydrophobicContact CD1-CH2 3.71Å; L288-W305 HydrophobicContact CD1-CZ2 4.41Å; L288-T350 HydrophobicContact CB-CG2 4.15Å; L288-T350 WeakPolarHBondContact O-CA 3.21Å; L288-T350 WeakPolarHBondContact O-CB 3.27Å; L288-T350 WeakPolarHBondContact O-CG2 3.41Å; L288-T350 PolarHBondContact O-OG1 2.98Å
289	D	87.9	Confident	88.4	Confident	107 Å²	107	59.7 Å²	59.7	57%	0.572	33%	0.334	S	S	*	.			trans	-76.6	-42.6	-175.6	-57.4	-25.4	0	0	0	111.5	L351	D289-L351 PolarHBondContact O-N 2.87Å
290	L	87.4	Confident	88.3	Confident	41 Å²	41	60.2 Å²	60.2	22%	0.215	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.1	-176	-179.2	66.2	0	0	0	110.8	L351 Q439 I440	L290-L351 CarbonylContact C-O 3.47Å; L290-L351 WeakPolarHBondContact CA-O 3.45Å; L290-L351 HydrophobicContact CD1-CB 4.24Å; L290-L351 HydrophobicContact CD1-CD2 4.13Å; L290-L351 HydrophobicContact CD1-CG 4.2Å; L290-Q439 HydrophobicContact CD2-CG 4.04Å; L290-I440 HydrophobicContact CD2-CG1 4.47Å
291	V	89.6	Confident	88.2	Confident	2 Å²	2	63 Å²	63	1%	0.012	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	117.1	167.7	174.3	0	0	0	0	108.2	L293 D296 L300 T350 L351 F352 K353	V291-L293 HydrophobicContact CG1-CD2 4.11Å; V291-L293 HydrophobicContact CG1-CG 4.26Å; V291-D296 HydrophobicContact CG1-CB 3.99Å; V291-L300 HydrophobicContact CB-CD1 4.4Å; V291-L300 HydrophobicContact CG1-CD1 3.47Å; V291-L300 VanDerWaalsContact CG1-CD1 3.47Å; V291-L300 HydrophobicContact CG2-CD1 3.95Å; V291-T350 HydrophobicContact CB-CG2 4.46Å; V291-T350 HydrophobicContact CG2-CG2 3.55Å; V291-L351 PolarHBondContact N-O 3.07Å; V291-F352 HydrophobicContact CB-CD1 3.7Å; V291-F352 HydrophobicContact CB-CE1 3.86Å; V291-F352 HydrophobicContact CB-CG 4.3Å; V291-F352 HydrophobicContact CG1-CD1 3.67Å; V291-F352 HydrophobicContact CG1-CE1 3.78Å; V291-F352 HydrophobicContact CG2-CD1 4.36Å; V291-F352 HydrophobicContact CG2-CE1 4.02Å; V291-F352 HydrophobicContact CG2-CZ 4.36Å; V291-K353 PolarHBondContact O-N 3.4Å
292	S	85.9	Confident	88.1	Confident	10 Å²	10	61 Å²	61	7%	0.07	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	108.9	-177.9	-61.8	0	0	0	0	110.1	G295 D296 I440	S292-G295 PolarHBondContact O-N 2.79Å; S292-D296 PolarHBondContact N-OD2 2.98Å; S292-D296 WeakPolarHBondContact O-CB 3.48Å; S292-D296 PolarHBondContact O-N 2.91Å; S292-I440 WeakPolarHBondContact OG-CG1 3.27Å
293	L	86.8	Confident	88.2	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.026	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	144.9	-179.7	-64	168	0	0	0	110.9	V291 L297 I317 A318 L321 F352 K353 G355	V291-L293 HydrophobicContact CG1-CD2 4.11Å; V291-L293 HydrophobicContact CG1-CG 4.26Å; L293-L297 HydrophobicContact CD2-CB 4.01Å; L293-L297 HydrophobicContact CD2-CD1 4.35Å; L293-I317 HydrophobicContact CD1-CG2 4.47Å; L293-A318 HydrophobicContact CD1-CB 3.82Å; L293-A318 HydrophobicContact CD2-CB 3.89Å; L293-A318 HydrophobicContact CG-CB 4.41Å; L293-L321 HydrophobicContact CD1-CD1 3.88Å; L293-F352 HydrophobicContact CD1-CB 4.29Å; L293-F352 HydrophobicContact CD1-CD1 4.06Å; L293-K353 PolarHBondContact N-O 3.08Å; L293-K353 VanDerWaalsContact N-O 3.08Å; L293-G355 PolarHBondContact O-N 3.14Å
294	P	84.6	Confident	88.2	Confident	57 Å²	57	57.7 Å²	57.7	37%	0.37	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	cis	-83.5	-4.6	0.7	33.8	-35.8	0	0	0	114.8	D296 L297 P357	P294-D296 PolarHBondContact O-N 3.47Å; P294-L297 VanDerWaalsContact O-CB 3.32Å; P294-L297 WeakPolarHBondContact O-CB 3.34Å; P294-L297 PolarHBondContact O-N 3.24Å; P294-L297 VanDerWaalsContact O-N 3.09Å; P294-P357 HydrophobicContact CG-CG 3.98Å
295	G	82	Confident	88.3	Confident	63 Å²	63	57 Å²	57	65%	0.649	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-42.2	-169.6	0	0	0	0	0	115.7	S292 P298	S292-G295 PolarHBondContact O-N 2.79Å; G295-P298 WeakPolarHBondContact O-CD 3.49Å
296	D	87.3	Confident	88.6	Confident	35 Å²	35	50.4 Å²	50.4	19%	0.187	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.9	-178.7	-67.9	-30.3	0	0	0	113.5	V291 S292 P294 S299 L300	V291-D296 HydrophobicContact CG1-CB 3.99Å; S292-D296 PolarHBondContact N-OD2 2.98Å; S292-D296 WeakPolarHBondContact O-CB 3.48Å; S292-D296 PolarHBondContact O-N 2.91Å; P294-D296 PolarHBondContact O-N 3.47Å; D296-S299 PolarHBondContact O-N 3.5Å; D296-S299 PolarHBondContact O-OG 2.93Å; D296-L300 HydrophobicContact CB-CD1 4.27Å; D296-L300 WeakPolarHBondContact O-CG 3.17Å; D296-L300 PolarHBondContact O-N 3.33Å; D296-L300 VanDerWaalsContact O-N 3.12Å
297	L	90	Very high	88.5	Confident	47 Å²	47	46.8 Å²	46.8	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-43.1	-174.4	-173.5	63.2	0	0	0	113.3	L293 P294 S299 L300 S301 V314 A318	L293-L297 HydrophobicContact CD2-CB 4.01Å; L293-L297 HydrophobicContact CD2-CD1 4.35Å; P294-L297 VanDerWaalsContact O-CB 3.32Å; P294-L297 WeakPolarHBondContact O-CB 3.34Å; P294-L297 PolarHBondContact O-N 3.24Å; P294-L297 VanDerWaalsContact O-N 3.09Å; L297-S299 PolarHBondContact O-N 2.73Å; L297-L300 PolarHBondContact O-N 3.22Å; L297-S301 VanDerWaalsContact O-CB 3.3Å; L297-S301 WeakPolarHBondContact O-CB 3.29Å; L297-S301 PolarHBondContact O-N 3.47Å; L297-S301 PolarHBondContact O-OG 2.76Å; L297-V314 HydrophobicContact CD1-CG1 3.79Å; L297-A318 HydrophobicContact CD1-CB 4.06Å; L297-A318 HydrophobicContact CD2-CB 4.01Å
298	P	89.8	Confident	88.3	Confident	95 Å²	95	49.3 Å²	49.3	62%	0.617	32%	0.316	S	S	*	.	H	α-helix	trans	-63.3	-39.7	178.7	-23.4	35.3	0	0	0	113.3	G295 S301 G302	G295-P298 WeakPolarHBondContact O-CD 3.49Å; P298-S301 PolarHBondContact O-N 3.18Å; P298-G302 PolarHBondContact O-N 2.81Å
299	S	89.3	Confident	88.1	Confident	77 Å²	77	50.1 Å²	50.1	54%	0.538	33%	0.329	S	S	.	.	H	α-helix	trans	-69.6	-39.4	-179	66.3	0	0	0	0	111.5	D296 L297 A303	D296-S299 PolarHBondContact O-N 3.5Å; D296-S299 PolarHBondContact O-OG 2.93Å; L297-S299 PolarHBondContact O-N 2.73Å; S299-A303 WeakPolarHBondContact O-CB 3.49Å; S299-A303 PolarHBondContact O-N 2.86Å
300	L	91.2	Very high	88.2	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-71.3	-38.1	175.4	-65.1	173.1	0	0	0	112.4	L288 V291 D296 L297 G302 A303 W305 L306 V314	L288-L300 HydrophobicContact CD1-CD2 4.12Å; V291-L300 HydrophobicContact CB-CD1 4.4Å; V291-L300 HydrophobicContact CG1-CD1 3.47Å; V291-L300 VanDerWaalsContact CG1-CD1 3.47Å; V291-L300 HydrophobicContact CG2-CD1 3.95Å; D296-L300 HydrophobicContact CB-CD1 4.27Å; D296-L300 WeakPolarHBondContact O-CG 3.17Å; D296-L300 PolarHBondContact O-N 3.33Å; D296-L300 VanDerWaalsContact O-N 3.12Å; L297-L300 PolarHBondContact O-N 3.22Å; L300-G302 VanDerWaalsContact C-N 3.27Å; L300-G302 PolarHBondContact O-N 3.01Å; L300-A303 WeakPolarHBondContact O-CB 3.48Å; L300-A303 PolarHBondContact O-N 3.23Å; L300-W305 HydrophobicContact CD2-CH2 4.03Å; L300-W305 HydrophobicContact CD2-CZ2 4.13Å; L300-L306 HydrophobicContact CB-CD1 4.18Å; L300-L306 HydrophobicContact CD2-CD1 4.09Å; L300-L306 WeakPolarHBondContact O-CD1 3.13Å; L300-V314 HydrophobicContact CB-CG1 4.34Å; L300-V314 HydrophobicContact CD1-CG1 4.08Å
301	S	89.2	Confident	88.4	Confident	60 Å²	60	48.9 Å²	48.9	42%	0.42	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-32.9	179	-58.7	0	0	0	0	112.3	L297 P298 R311	L297-S301 VanDerWaalsContact O-CB 3.3Å; L297-S301 WeakPolarHBondContact O-CB 3.29Å; L297-S301 PolarHBondContact O-N 3.47Å; L297-S301 PolarHBondContact O-OG 2.76Å; P298-S301 PolarHBondContact O-N 3.18Å; S301-R311 WeakPolarHBondContact O-CD 3.46Å
302	G	87.9	Confident	88.5	Confident	60 Å²	60	54.4 Å²	54.4	62%	0.619	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-1.3	176.6	0	0	0	0	0	115.1	P298 L300 P304	P298-G302 PolarHBondContact O-N 2.81Å; L300-G302 VanDerWaalsContact C-N 3.27Å; L300-G302 PolarHBondContact O-N 3.01Å; G302-P304 WeakPolarHBondContact O-CD 3.24Å
303	A	89.6	Confident	88.8	Confident	6 Å²	6	55.8 Å²	55.8	5%	0.05	34%	0.34	C	S	.	.			trans	-72	117.3	-171.1	0	0	0	0	0	112.4	S299 L300 W305 L306 R311	S299-A303 WeakPolarHBondContact O-CB 3.49Å; S299-A303 PolarHBondContact O-N 2.86Å; L300-A303 WeakPolarHBondContact O-CB 3.48Å; L300-A303 PolarHBondContact O-N 3.23Å; A303-W305 HydrophobicContact CB-CD2 4.29Å; A303-W305 HydrophobicContact CB-CG 4.45Å; A303-W305 HydrophobicContact CB-CZ2 4.02Å; A303-W305 PolarHBondContact O-N 3.18Å; A303-L306 HydrophobicContact CB-CB 4.48Å; A303-L306 HydrophobicContact CB-CD1 4.12Å; A303-L306 HydrophobicContact CB-CG 4.23Å; A303-L306 PolarHBondContact O-N 2.89Å; A303-R311 VanDerWaalsContact O-CZ 3.29Å; A303-R311 PolarHBondContact O-NE 3.03Å; A303-R311 VanDerWaalsContact O-NE 3.09Å; A303-R311 PolarHBondContact O-NH2 3.39Å
304	P	89.3	Confident	89.2	Confident	102 Å²	102	55.6 Å²	55.6	66%	0.662	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.5	-176.1	27.6	-35.5	0	0	0	113.4	G302	G302-P304 WeakPolarHBondContact O-CD 3.24Å
305	W	89.9	Confident	89.6	Confident	74 Å²	74	53.9 Å²	53.9	28%	0.28	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-10.8	-178.7	55.4	-90	0	0	0	114	R281 N282 Q283 L288 L300 A303	R281-W305 VanDerWaalsContact C-CZ3 3.46Å; R281-W305 WeakPolarHBondContact O-CZ3 3.38Å; N282-W305 HydrophobicContact CB-CH2 4.46Å; N282-W305 HydrophobicContact CB-CZ2 4.46Å; Q283-W305 HydrophobicContact CG-CB 3.77Å; Q283-W305 HydrophobicContact CG-CD2 4.35Å; Q283-W305 HydrophobicContact CG-CG 3.48Å; Q283-W305 VanDerWaalsContact CG-CG 3.48Å; L288-W305 HydrophobicContact CD1-CH2 3.71Å; L288-W305 HydrophobicContact CD1-CZ2 4.41Å; L300-W305 HydrophobicContact CD2-CH2 4.03Å; L300-W305 HydrophobicContact CD2-CZ2 4.13Å; A303-W305 HydrophobicContact CB-CD2 4.29Å; A303-W305 HydrophobicContact CB-CG 4.45Å; A303-W305 HydrophobicContact CB-CZ2 4.02Å; A303-W305 PolarHBondContact O-N 3.18Å
306	L	90.6	Very high	90.2	Very high	4 Å²	4	52 Å²	52	2%	0.021	31%	0.307	C	S	.	.	S	Bend	trans	-88.7	135.6	170.7	-74	177.1	0	0	0	110.3	L280 L300 A303 E310 R311	L280-L306 HydrophobicContact CD2-CD2 4.21Å; L300-L306 HydrophobicContact CB-CD1 4.18Å; L300-L306 HydrophobicContact CD2-CD1 4.09Å; L300-L306 WeakPolarHBondContact O-CD1 3.13Å; A303-L306 HydrophobicContact CB-CB 4.48Å; A303-L306 HydrophobicContact CB-CD1 4.12Å; A303-L306 HydrophobicContact CB-CG 4.23Å; A303-L306 PolarHBondContact O-N 2.89Å; L306-E310 HydrophobicContact CB-CB 4.47Å; L306-E310 HydrophobicContact CD2-CB 3.99Å; L306-R311 HydrophobicContact CB-CG 3.77Å; L306-R311 HydrophobicContact CD1-CG 4.36Å; L306-R311 VanDerWaalsContact O-CZ 3.26Å; L306-R311 PolarHBondContact O-NE 3.3Å; L306-R311 PolarHBondContact O-NH2 3.18Å
307	S	88.8	Confident	90.6	Very high	51 Å²	51	50.3 Å²	50.3	36%	0.357	30%	0.298	S	S	.	.			trans	-65.2	160.5	170.5	65.5	0	0	0	0	111.7	A309 E310 R311	S307-A309 PolarHBondContact O-N 3.49Å; S307-E310 WeakPolarHBondContact CB-OE2 3.41Å; S307-E310 PolarHBondContact N-OE2 3.28Å; S307-E310 PolarHBondContact O-N 3.44Å; S307-E310 WeakPolarHBondContact OG-CB 3.39Å; S307-E310 VanDerWaalsContact OG-CG 3.23Å; S307-E310 WeakPolarHBondContact OG-CG 3.42Å; S307-E310 PolarHBondContact OG-N 2.94Å; S307-E310 VanDerWaalsContact OG-N 3.16Å; S307-E310 PolarHBondContact OG-OE2 3.4Å; S307-R311 WeakPolarHBondContact O-CG 3.01Å; S307-R311 PolarHBondContact O-N 3.14Å
308	L	87.4	Confident	90.7	Very high	86 Å²	86	48.3 Å²	48.3	45%	0.45	29%	0.289	S	S	.	.	H	α-helix	trans	-58.9	-37.8	175.8	-175.8	64	0	0	0	111.7	R311 R312	L308-R311 PolarHBondContact O-N 3.5Å; L308-R312 WeakPolarHBondContact O-CG 3.39Å; L308-R312 PolarHBondContact O-N 2.91Å
309	A	85.8	Confident	90.9	Very high	59 Å²	59	49.6 Å²	49.6	49%	0.488	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-42.8	177.5	0	0	0	0	0	112.2	S307 R312 R313	S307-A309 PolarHBondContact O-N 3.49Å; A309-R312 PolarHBondContact O-N 2.96Å; A309-R313 WeakPolarHBondContact O-CB 3.49Å; A309-R313 PolarHBondContact O-N 3.26Å
310	E	90.8	Very high	91.1	Very high	46 Å²	46	46 Å²	46	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-41.5	176.1	-71.9	165.2	128.6	0	0	111.9	L280 L306 S307 R312 R313 V314	L280-E310 HydrophobicContact CD2-CB 4.38Å; L280-E310 HydrophobicContact CD2-CG 4.27Å; L306-E310 HydrophobicContact CB-CB 4.47Å; L306-E310 HydrophobicContact CD2-CB 3.99Å; S307-E310 WeakPolarHBondContact CB-OE2 3.41Å; S307-E310 PolarHBondContact N-OE2 3.28Å; S307-E310 PolarHBondContact O-N 3.44Å; S307-E310 WeakPolarHBondContact OG-CB 3.39Å; S307-E310 VanDerWaalsContact OG-CG 3.23Å; S307-E310 WeakPolarHBondContact OG-CG 3.42Å; S307-E310 PolarHBondContact OG-N 2.94Å; S307-E310 VanDerWaalsContact OG-N 3.16Å; S307-E310 PolarHBondContact OG-OE2 3.4Å; E310-R312 PolarHBondContact O-N 2.87Å; E310-R313 WeakPolarHBondContact O-CB 3.36Å; E310-R313 PolarHBondContact O-N 3.03Å; E310-V314 WeakPolarHBondContact O-CG2 3.4Å; E310-V314 PolarHBondContact O-N 2.93Å
311	R	91.7	Very high	91.2	Very high	77 Å²	77	45.7 Å²	45.7	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-43.9	175.6	-67.7	-178.9	-162.1	144.8	11.3	111.7	S301 A303 L306 S307 L308 V314 G315	S301-R311 WeakPolarHBondContact O-CD 3.46Å; A303-R311 VanDerWaalsContact O-CZ 3.29Å; A303-R311 PolarHBondContact O-NE 3.03Å; A303-R311 VanDerWaalsContact O-NE 3.09Å; A303-R311 PolarHBondContact O-NH2 3.39Å; L306-R311 HydrophobicContact CB-CG 3.77Å; L306-R311 HydrophobicContact CD1-CG 4.36Å; L306-R311 VanDerWaalsContact O-CZ 3.26Å; L306-R311 PolarHBondContact O-NE 3.3Å; L306-R311 PolarHBondContact O-NH2 3.18Å; S307-R311 WeakPolarHBondContact O-CG 3.01Å; S307-R311 PolarHBondContact O-N 3.14Å; L308-R311 PolarHBondContact O-N 3.5Å; R311-V314 PolarHBondContact O-N 3.3Å; R311-G315 PolarHBondContact O-N 3.18Å
312	R	90	Very high	91.2	Very high	117 Å²	117	48 Å²	48	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-59.3	-47.1	173.6	-75.5	179.4	-178.5	165.1	4.2	110.8	D163 L308 A309 E310 V314 G315 T316	D163-R312 IonicContact OD2-NH2 2.71Å; L308-R312 WeakPolarHBondContact O-CG 3.39Å; L308-R312 PolarHBondContact O-N 2.91Å; A309-R312 PolarHBondContact O-N 2.96Å; E310-R312 PolarHBondContact O-N 2.87Å; R312-V314 PolarHBondContact O-N 2.84Å; R312-G315 PolarHBondContact O-N 3.5Å; R312-G315 VanDerWaalsContact O-N 3.15Å; R312-T316 PolarHBondContact O-N 3.47Å; R312-T316 PolarHBondContact O-OG1 3.17Å
313	R	92.6	Very high	91.4	Very high	39 Å²	39	49.9 Å²	49.9	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-57.5	-47.1	176.9	-171.6	-171.8	-60.7	-125.9	0.3	112.2	E122 V256 A309 E310 G315 T316 I317	E122-R313 IonicContact OE2-CZ 3.27Å; E122-R313 IonicContact OE2-NH1 2.74Å; E122-R313 PolarHBondContact OE2-NH1 3.4Å; E122-R313 IonicContact OE2-NH2 3.64Å; V256-R313 HydrophobicContact CG1-CB 4.49Å; V256-R313 HydrophobicContact CG1-CG 4.04Å; V256-R313 HydrophobicContact CG2-CG 4.23Å; A309-R313 WeakPolarHBondContact O-CB 3.49Å; A309-R313 PolarHBondContact O-N 3.26Å; E310-R313 WeakPolarHBondContact O-CB 3.36Å; E310-R313 PolarHBondContact O-N 3.03Å; R313-G315 VanDerWaalsContact C-N 3.33Å; R313-G315 PolarHBondContact O-N 3.46Å; R313-T316 PolarHBondContact O-N 3.13Å; R313-I317 HydrophobicContact CG-CD1 4.01Å; R313-I317 WeakPolarHBondContact O-CB 3.17Å; R313-I317 VanDerWaalsContact O-CG1 3.27Å; R313-I317 WeakPolarHBondContact O-CG1 3.46Å; R313-I317 PolarHBondContact O-N 2.86Å
314	V	94.4	Very high	91.5	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-44	176.2	170.8	0	0	0	0	111	L280 L297 L300 E310 R311 R312 I317 A318 F352	L280-V314 HydrophobicContact CD1-CG2 3.68Å; L297-V314 HydrophobicContact CD1-CG1 3.79Å; L300-V314 HydrophobicContact CB-CG1 4.34Å; L300-V314 HydrophobicContact CD1-CG1 4.08Å; E310-V314 WeakPolarHBondContact O-CG2 3.4Å; E310-V314 PolarHBondContact O-N 2.93Å; R311-V314 PolarHBondContact O-N 3.3Å; R312-V314 PolarHBondContact O-N 2.84Å; V314-I317 PolarHBondContact O-N 3.43Å; V314-A318 WeakPolarHBondContact O-CB 3.45Å; V314-A318 PolarHBondContact O-N 3.02Å; V314-F352 HydrophobicContact CG1-CE1 4.25Å; V314-F352 HydrophobicContact CG2-CE1 4.07Å; V314-F352 HydrophobicContact CG2-CZ 4.14Å
315	G	93.7	Very high	91.4	Very high	21 Å²	21	47.9 Å²	47.9	22%	0.216	25%	0.246	C	C	.	.	H	α-helix	trans	-58.7	-47.6	174.7	0	0	0	0	0	112.7	R311 R312 R313 A318 Q319	R311-G315 PolarHBondContact O-N 3.18Å; R312-G315 PolarHBondContact O-N 3.5Å; R312-G315 VanDerWaalsContact O-N 3.15Å; R313-G315 VanDerWaalsContact C-N 3.33Å; R313-G315 PolarHBondContact O-N 3.46Å; G315-A318 PolarHBondContact O-N 3.17Å; G315-Q319 WeakPolarHBondContact O-CG 3.02Å; G315-Q319 PolarHBondContact O-N 3.33Å
316	T	94.2	Very high	90.8	Very high	23 Å²	23	47.1 Å²	47.1	14%	0.141	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-41.8	177.3	-56.9	0	0	0	0	111.9	V256 A260 R312 R313 A318 Q319 L320	V256-T316 HydrophobicContact CG1-CG2 3.9Å; A260-T316 HydrophobicContact CB-CG2 3.69Å; R312-T316 PolarHBondContact O-N 3.47Å; R312-T316 PolarHBondContact O-OG1 3.17Å; R313-T316 PolarHBondContact O-N 3.13Å; T316-A318 VanDerWaalsContact C-N 3.33Å; T316-A318 PolarHBondContact O-N 3.38Å; T316-Q319 PolarHBondContact O-N 3.23Å; T316-L320 VanDerWaalsContact O-CB 3.25Å; T316-L320 WeakPolarHBondContact O-CB 3.4Å; T316-L320 PolarHBondContact O-N 3.16Å
317	I	95.7	Very high	90.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-44.8	174.8	-71.9	168.7	0	0	0	110.7	F273 L293 R313 V314 L320 L321 A330 I332 F352	F273-I317 HydrophobicContact CD2-CD1 3.84Å; F273-I317 HydrophobicContact CD2-CG1 4.26Å; F273-I317 HydrophobicContact CE2-CD1 3.64Å; F273-I317 HydrophobicContact CE2-CG1 3.53Å; F273-I317 HydrophobicContact CZ-CD1 4.35Å; F273-I317 HydrophobicContact CZ-CG1 3.97Å; L293-I317 HydrophobicContact CD1-CG2 4.47Å; R313-I317 HydrophobicContact CG-CD1 4.01Å; R313-I317 WeakPolarHBondContact O-CB 3.17Å; R313-I317 VanDerWaalsContact O-CG1 3.27Å; R313-I317 WeakPolarHBondContact O-CG1 3.46Å; R313-I317 PolarHBondContact O-N 2.86Å; V314-I317 PolarHBondContact O-N 3.43Å; I317-L320 PolarHBondContact O-N 3.06Å; I317-L321 HydrophobicContact CG2-CD1 3.89Å; I317-L321 HydrophobicContact CG2-CG 4.33Å; I317-L321 WeakPolarHBondContact O-CG 3.36Å; I317-L321 PolarHBondContact O-N 3.25Å; I317-A330 HydrophobicContact CG2-CB 3.65Å; I317-I332 HydrophobicContact CD1-CD1 4.03Å; I317-I332 HydrophobicContact CD1-CG1 4.18Å; I317-F352 HydrophobicContact CD1-CD2 4.27Å; I317-F352 HydrophobicContact CD1-CE1 4.49Å; I317-F352 HydrophobicContact CD1-CE2 4.02Å; I317-F352 HydrophobicContact CD1-CZ 4.12Å; I317-F352 HydrophobicContact CG2-CB 3.83Å; I317-F352 HydrophobicContact CG2-CD1 3.79Å; I317-F352 HydrophobicContact CG2-CD2 4.24Å; I317-F352 HydrophobicContact CG2-CE1 4.4Å; I317-F352 HydrophobicContact CG2-CG 3.69Å
318	A	93.5	Very high	90.3	Very high	6 Å²	6	50.5 Å²	50.5	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-44.9	180	0	0	0	0	0	112.4	L293 L297 V314 G315 T316 L320 N322	L293-A318 HydrophobicContact CD1-CB 3.82Å; L293-A318 HydrophobicContact CD2-CB 3.89Å; L293-A318 HydrophobicContact CG-CB 4.41Å; L297-A318 HydrophobicContact CD1-CB 4.06Å; L297-A318 HydrophobicContact CD2-CB 4.01Å; V314-A318 WeakPolarHBondContact O-CB 3.45Å; V314-A318 PolarHBondContact O-N 3.02Å; G315-A318 PolarHBondContact O-N 3.17Å; T316-A318 VanDerWaalsContact C-N 3.33Å; T316-A318 PolarHBondContact O-N 3.38Å; A318-L320 VanDerWaalsContact C-N 3.32Å; A318-L320 PolarHBondContact O-N 3.12Å; A318-N322 PolarHBondContact O-N 3.07Å; A318-N322 PolarHBondContact O-ND2 3.25Å
319	Q	92.9	Very high	90.5	Very high	122 Å²	122	46.9 Å²	46.9	57%	0.57	24%	0.243	S	C	*	.	H	α-helix	trans	-62.9	-39.8	174.7	-69.4	176	1.9	0	0	112.2	G315 T316 N322	G315-Q319 WeakPolarHBondContact O-CG 3.02Å; G315-Q319 PolarHBondContact O-N 3.33Å; T316-Q319 PolarHBondContact O-N 3.23Å; Q319-N322 PolarHBondContact O-N 3.1Å
320	L	94.8	Very high	90.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-49.4	178.8	174	61.7	0	0	0	111.5	A260 K264 V271 T316 I317 A318 N322 Q323 L324	A260-L320 HydrophobicContact CB-CB 4.47Å; A260-L320 HydrophobicContact CB-CD1 4.35Å; A260-L320 HydrophobicContact CB-CD2 4.18Å; A260-L320 WeakPolarHBondContact O-CD1 3.41Å; K264-L320 HydrophobicContact CG-CD1 3.74Å; V271-L320 HydrophobicContact CB-CD2 4.44Å; V271-L320 HydrophobicContact CG1-CD2 3.98Å; V271-L320 HydrophobicContact CG2-CD2 4.09Å; T316-L320 VanDerWaalsContact O-CB 3.25Å; T316-L320 WeakPolarHBondContact O-CB 3.4Å; T316-L320 PolarHBondContact O-N 3.16Å; I317-L320 PolarHBondContact O-N 3.06Å; A318-L320 VanDerWaalsContact C-N 3.32Å; A318-L320 PolarHBondContact O-N 3.12Å; L320-N322 PolarHBondContact O-N 2.8Å; L320-Q323 CarbonylContact O-C 3.58Å; L320-Q323 WeakPolarHBondContact O-CA 3.32Å; L320-Q323 PolarHBondContact O-N 2.55Å; L320-L324 HydrophobicContact CD1-CD1 4Å; L320-L324 HydrophobicContact CD1-CD2 4.24Å; L320-L324 HydrophobicContact CD1-CG 3.96Å; L320-L324 HydrophobicContact CD2-CD1 4.32Å; L320-L324 HydrophobicContact CG-CD1 3.82Å; L320-L324 HydrophobicContact CG-CG 4.18Å; L320-L324 WeakPolarHBondContact O-CG 3.38Å; L320-L324 PolarHBondContact O-N 3.28Å
321	L	92.7	Very high	91.2	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-20.5	-177.7	-74	176	0	0	0	113.4	L293 I317 Q323 L324 A330 F352 N354	L293-L321 HydrophobicContact CD1-CD1 3.88Å; I317-L321 HydrophobicContact CG2-CD1 3.89Å; I317-L321 HydrophobicContact CG2-CG 4.33Å; I317-L321 WeakPolarHBondContact O-CG 3.36Å; I317-L321 PolarHBondContact O-N 3.25Å; L321-Q323 VanDerWaalsContact C-N 3.26Å; L321-L324 HydrophobicContact CD2-CD1 4.34Å; L321-A330 HydrophobicContact CD1-CB 4.02Å; L321-A330 HydrophobicContact CD2-CB 4.07Å; L321-A330 HydrophobicContact CG-CB 4.16Å; L321-F352 HydrophobicContact CD1-CB 3.75Å; L321-N354 HydrophobicContact CB-CB 4.16Å; L321-N354 PolarHBondContact O-ND2 2.96Å
322	N	89.7	Confident	91.4	Very high	107 Å²	107	38.5 Å²	38.5	57%	0.572	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.6	169.6	-73.2	-24.1	0	0	0	113.5	A318 Q319 L320 N354	A318-N322 PolarHBondContact O-N 3.07Å; A318-N322 PolarHBondContact O-ND2 3.25Å; Q319-N322 PolarHBondContact O-N 3.1Å; L320-N322 PolarHBondContact O-N 2.8Å; N322-N354 PolarHBondContact OD1-ND2 2.76Å; N322-N354 PolarHBondContact OD1-OD1 3.26Å
323	Q	91.6	Very high	91.7	Very high	100 Å²	100	32.9 Å²	32.9	47%	0.467	18%	0.176	S	C	.	.	S	Bend	trans	-110.4	0.5	-177.7	-60.3	177.9	15.5	0	0	112.6	K264 Q267 L320 L321	K264-Q323 VanDerWaalsContact NZ-OE1 3.14Å; Q267-Q323 PolarHBondContact NE2-O 3.43Å; Q267-Q323 VanDerWaalsContact NE2-O 3.12Å; L320-Q323 CarbonylContact O-C 3.58Å; L320-Q323 WeakPolarHBondContact O-CA 3.32Å; L320-Q323 PolarHBondContact O-N 2.55Å; L321-Q323 VanDerWaalsContact C-N 3.26Å
324	L	91.3	Very high	91.9	Very high	16 Å²	16	31.5 Å²	31.5	8%	0.084	17%	0.173	C	C	.	.	S	Bend	trans	-103.4	162.2	175.6	-67	-176.5	0	0	0	110.6	S263 V271 L320 L321	S263-L324 WeakPolarHBondContact O-CD2 3.26Å; V271-L324 HydrophobicContact CG2-CD1 3.82Å; L320-L324 HydrophobicContact CD1-CD1 4Å; L320-L324 HydrophobicContact CD1-CD2 4.24Å; L320-L324 HydrophobicContact CD1-CG 3.96Å; L320-L324 HydrophobicContact CD2-CD1 4.32Å; L320-L324 HydrophobicContact CG-CD1 3.82Å; L320-L324 HydrophobicContact CG-CG 4.18Å; L320-L324 WeakPolarHBondContact O-CG 3.38Å; L320-L324 PolarHBondContact O-N 3.28Å; L321-L324 HydrophobicContact CD2-CD1 4.34Å
325	P	86.7	Confident	92	Very high	51 Å²	51	31.5 Å²	31.5	33%	0.331	17%	0.173	S	C	.	.			trans	-61.8	155.1	174.3	-19.4	35.8	0	0	0	110.8	E327 S328	P325-E327 WeakPolarHBondContact CB-OE2 3.36Å; P325-E327 PolarHBondContact O-N 2.97Å; P325-E327 VanDerWaalsContact O-N 3.12Å; P325-S328 WeakPolarHBondContact CD-OG 3.09Å; P325-S328 VanDerWaalsContact O-CB 3.29Å; P325-S328 WeakPolarHBondContact O-CB 3.32Å; P325-S328 PolarHBondContact O-N 3.24Å
326	C	79	Confident	91.9	Very high	58 Å²	58	33.3 Å²	33.3	39%	0.392	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.4	-174.8	71.7	0	0	0	0	114	S328 K353 K432	C326-S328 VanDerWaalsContact C-N 3.31Å; C326-K353 PolarHBondContact O-NZ 3.02Å; C326-K432 PolarHBondContact SG-NZ 3.15Å
327	E	79.1	Confident	91.9	Very high	121 Å²	121	34 Å²	34	57%	0.565	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.1	174.8	-58.4	76.4	-169	0	0	112.3	L269 P325	L269-E327 HydrophobicContact CD2-CB 4.39Å; P325-E327 WeakPolarHBondContact CB-OE2 3.36Å; P325-E327 PolarHBondContact O-N 2.97Å; P325-E327 VanDerWaalsContact O-N 3.12Å
328	S	88.9	Confident	91.8	Very high	4 Å²	4	34.1 Å²	34.1	3%	0.028	19%	0.187	C	C	.	.			trans	-71.2	147.4	177.9	-63.8	0	0	0	0	111.5	P268 L269 P325 C326	P268-S328 WeakPolarHBondContact O-CB 3.25Å; P268-S328 PolarHBondContact O-OG 2.99Å; L269-S328 WeakPolarHBondContact O-CA 3.49Å; P325-S328 WeakPolarHBondContact CD-OG 3.09Å; P325-S328 VanDerWaalsContact O-CB 3.29Å; P325-S328 WeakPolarHBondContact O-CB 3.32Å; P325-S328 PolarHBondContact O-N 3.24Å; C326-S328 VanDerWaalsContact C-N 3.31Å
329	S	91	Very high	91.8	Very high	11 Å²	11	34.4 Å²	34.4	8%	0.077	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152	175.6	46.2	0	0	0	0	110.3	L269 K270 V271	L269-S329 PolarHBondContact O-N 3.31Å; L269-S329 VanDerWaalsContact O-N 3.14Å; K270-S329 WeakPolarHBondContact CA-O 3.16Å; K270-S329 WeakPolarHBondContact CD-OG 3.23Å; K270-S329 WeakPolarHBondContact CE-OG 3.35Å; K270-S329 PolarHBondContact NZ-OG 3.46Å; V271-S329 PolarHBondContact N-O 2.99Å
330	A	95.6	Very high	91.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.6	174.6	0	0	0	0	0	109.7	V271 I317 L321 F352	V271-A330 HydrophobicContact CB-CB 4.14Å; V271-A330 CarbonylContact O-C 3.6Å; V271-A330 WeakPolarHBondContact O-CA 3.35Å; I317-A330 HydrophobicContact CG2-CB 3.65Å; L321-A330 HydrophobicContact CD1-CB 4.02Å; L321-A330 HydrophobicContact CD2-CB 4.07Å; L321-A330 HydrophobicContact CG-CB 4.16Å; A330-F352 HydrophobicContact CB-CB 4.19Å; A330-F352 PolarHBondContact N-O 2.89Å; A330-F352 WeakPolarHBondContact O-CA 3.45Å; A330-F352 PolarHBondContact O-N 2.99Å
331	V	96.1	Very high	91.5	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141	-179	63.2	0	0	0	0	111.9	V271 M272 F273 E341 T350 L351	V271-V331 PolarHBondContact O-N 3.47Å; M272-V331 CarbonylContact C-O 3.56Å; M272-V331 WeakPolarHBondContact CA-O 3.04Å; M272-V331 HydrophobicContact CB-CG1 4.08Å; M272-V331 HydrophobicContact CE-CG1 3.75Å; M272-V331 HydrophobicContact CG-CG1 3.71Å; F273-V331 PolarHBondContact N-O 3Å; V331-E341 HydrophobicContact CB-CG 4.32Å; V331-E341 HydrophobicContact CG1-CG 4.08Å; V331-E341 VanDerWaalsContact CG2-CD 3.5Å; V331-E341 HydrophobicContact CG2-CG 3.47Å; V331-E341 VanDerWaalsContact CG2-CG 3.47Å; V331-E341 WeakPolarHBondContact CG2-OE1 3.37Å; V331-T350 WeakPolarHBondContact CA-O 3.21Å; V331-T350 WeakPolarHBondContact CG2-O 3.49Å; V331-L351 HydrophobicContact CB-CD1 4.49Å
332	I	96.6	Very high	91.3	Very high	4 Å²	4	31 Å²	31	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.4	167.4	-59.2	168.8	0	0	0	107.2	F273 G279 L280 I317 G349 T350 F352	F273-I332 HydrophobicContact CB-CG1 3.98Å; F273-I332 HydrophobicContact CD2-CG1 4.35Å; F273-I332 HydrophobicContact CG-CG1 4.46Å; F273-I332 WeakPolarHBondContact O-CA 3.45Å; G279-I332 VanDerWaalsContact CA-O 3.29Å; G279-I332 WeakPolarHBondContact CA-O 3.44Å; L280-I332 HydrophobicContact CD1-CD1 4.31Å; L280-I332 HydrophobicContact CD2-CD1 3.79Å; L280-I332 HydrophobicContact CG-CD1 3.85Å; I317-I332 HydrophobicContact CD1-CD1 4.03Å; I317-I332 HydrophobicContact CD1-CG1 4.18Å; I332-G349 CarbonylContact O-C 3.58Å; I332-G349 VanDerWaalsContact O-CA 3.26Å; I332-G349 WeakPolarHBondContact O-CA 3.4Å; I332-T350 PolarHBondContact N-O 3.31Å; I332-T350 PolarHBondContact O-N 3.23Å; I332-F352 HydrophobicContact CB-CE2 4.41Å; I332-F352 HydrophobicContact CD1-CE2 3.59Å; I332-F352 HydrophobicContact CD1-CZ 3.73Å; I332-F352 HydrophobicContact CG1-CE2 3.74Å; I332-F352 HydrophobicContact CG1-CZ 4.4Å
333	T	96.6	Very high	91	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	172.4	-176.5	-165.5	0	0	0	0	112	M272 F273 L274 N275 T337 E341 S348	M272-T333 HydrophobicContact CE-CG2 3.93Å; F273-T333 PolarHBondContact O-N 3.4Å; L274-T333 WeakPolarHBondContact CA-O 3.39Å; L274-T333 HydrophobicContact CD2-CG2 3.58Å; N275-T333 PolarHBondContact N-O 3.27Å; N275-T333 PolarHBondContact OD1-O 2.95Å; T333-T337 PolarHBondContact OG1-OG1 3.45Å; T333-E341 HydrophobicContact CG2-CB 3.98Å; T333-E341 HydrophobicContact CG2-CG 3.96Å; T333-S348 PolarHBondContact OG1-OG 3.33Å
334	S	95.8	Very high	90.5	Very high	10 Å²	10	22.3 Å²	22.3	7%	0.07	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	140.6	176	-173.3	0	0	0	0	110.2	N275 S276 S336 T337 M338	N275-S334 CarbonylContact O-C 3.59Å; N275-S334 VanDerWaalsContact O-CA 3.29Å; N275-S334 WeakPolarHBondContact O-CA 3.37Å; N275-S334 PolarHBondContact O-OG 2.96Å; S276-S334 PolarHBondContact O-OG 3.29Å; S334-S336 PolarHBondContact O-N 2.99Å; S334-S336 PolarHBondContact OG-OG 2.9Å; S334-S336 VanDerWaalsContact OG-OG 3.12Å; S334-T337 CarbonylContact O-C 3.53Å; S334-T337 PolarHBondContact O-N 3.26Å; S334-T337 PolarHBondContact O-OG1 2.85Å; S334-M338 PolarHBondContact O-N 2.84Å
335	A	95.8	Very high	89.6	Confident	1 Å²	1	28 Å²	28	1%	0.008	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-59.8	-26.6	175.7	0	0	0	0	0	112.9	V127 M133 L137 L274 N275	V127-A335 HydrophobicContact CB-CB 4.31Å; V127-A335 HydrophobicContact CG1-CB 3.63Å; V127-A335 HydrophobicContact CG2-CB 3.65Å; M133-A335 HydrophobicContact CG-CB 3.84Å; M133-A335 HydrophobicContact SD-CB 4.09Å; L137-A335 HydrophobicContact CB-CB 4.29Å; L137-A335 HydrophobicContact CD2-CB 4.45Å; L274-A335 HydrophobicContact CB-CB 4.17Å; N275-A335 PolarHBondContact O-N 3.07Å
336	S	93.4	Very high	88.9	Confident	58 Å²	58	34.8 Å²	34.8	41%	0.406	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-77.2	-22.2	176.8	60	0	0	0	0	113.8	S334	S334-S336 PolarHBondContact O-N 2.99Å; S334-S336 PolarHBondContact OG-OG 2.9Å; S334-S336 VanDerWaalsContact OG-OG 3.12Å
337	T	92.6	Very high	89	Confident	37 Å²	37	33 Å²	33	23%	0.227	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-112.7	17.3	-178.3	61.6	0	0	0	0	112.6	T333 S334 L339 T340 E341 S348	T333-T337 PolarHBondContact OG1-OG1 3.45Å; S334-T337 CarbonylContact O-C 3.53Å; S334-T337 PolarHBondContact O-N 3.26Å; S334-T337 PolarHBondContact O-OG1 2.85Å; T337-L339 VanDerWaalsContact C-N 3.32Å; T337-L339 PolarHBondContact O-N 2.95Å; T337-T340 WeakPolarHBondContact O-CB 3.24Å; T337-T340 PolarHBondContact O-N 3.33Å; T337-T340 VanDerWaalsContact O-N 3.13Å; T337-E341 PolarHBondContact O-N 3.38Å; T337-S348 WeakPolarHBondContact CB-OG 3.33Å; T337-S348 PolarHBondContact O-OG 3.05Å; T337-S348 PolarHBondContact OG1-OG 3.49Å
338	M	94.3	Very high	89.4	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-53	-45.5	179.1	175.8	-168.8	158.6	0	0	112.5	L121 L137 L141 L144 M272 L274 S334 E341 L342	L121-M338 HydrophobicContact CD2-CE 3.41Å; L121-M338 VanDerWaalsContact CD2-CE 3.41Å; L121-M338 HydrophobicContact CD2-SD 3.82Å; L137-M338 HydrophobicContact CD1-SD 3.94Å; L141-M338 HydrophobicContact CD2-CE 4.19Å; L144-M338 HydrophobicContact CD1-CE 3.31Å; L144-M338 HydrophobicContact CG-CE 4.19Å; M272-M338 HydrophobicContact CE-CG 3.82Å; M272-M338 HydrophobicContact SD-CE 4.29Å; M272-M338 HydrophobicContact SD-CG 4.15Å; L274-M338 HydrophobicContact CD1-CG 4.45Å; L274-M338 HydrophobicContact CD1-SD 4.05Å; L274-M338 HydrophobicContact CD2-CB 4.46Å; L274-M338 HydrophobicContact CD2-CG 4.41Å; S334-M338 PolarHBondContact O-N 2.84Å; M338-E341 PolarHBondContact O-N 3.21Å; M338-L342 HydrophobicContact CE-CD1 3.82Å; M338-L342 HydrophobicContact CG-CD1 4.33Å; M338-L342 WeakPolarHBondContact O-CG 3.36Å; M338-L342 PolarHBondContact O-N 3.29Å
339	L	92.6	Very high	89.6	Confident	12 Å²	12	29.3 Å²	29.3	6%	0.063	16%	0.162	C	C	.	.	H	α-helix	trans	-70.5	-36.5	179.8	-62	-175.7	0	0	0	112	E92 F139 F143 T337 E341 L342 F343	E92-L339 HydrophobicContact CG-CB 3.85Å; F139-L339 HydrophobicContact CD1-CD1 4.19Å; F139-L339 HydrophobicContact CE1-CD1 3.83Å; F143-L339 HydrophobicContact CD1-CD2 4.13Å; T337-L339 VanDerWaalsContact C-N 3.32Å; T337-L339 PolarHBondContact O-N 2.95Å; L339-E341 VanDerWaalsContact C-N 3.29Å; L339-E341 PolarHBondContact O-N 2.87Å; L339-L342 PolarHBondContact O-N 2.97Å; L339-F343 HydrophobicContact CB-CD2 4.21Å; L339-F343 HydrophobicContact CB-CE2 4.28Å; L339-F343 HydrophobicContact CD2-CE2 3.87Å; L339-F343 HydrophobicContact CD2-CZ 4.46Å; L339-F343 WeakPolarHBondContact O-CB 3.46Å; L339-F343 WeakPolarHBondContact O-CD2 3.42Å; L339-F343 PolarHBondContact O-N 2.86Å
340	T	90.8	Very high	89.8	Confident	37 Å²	37	28.8 Å²	28.8	23%	0.227	16%	0.159	C	C	.	.	H	α-helix	trans	-59.6	-44	173.4	-43.3	0	0	0	0	110.5	E92 T337 L342 S344	E92-T340 WeakPolarHBondContact OE2-CA 3.34Å; E92-T340 VanDerWaalsContact OE2-CB 3.23Å; E92-T340 WeakPolarHBondContact OE2-CB 3.26Å; E92-T340 PolarHBondContact OE2-N 2.85Å; E92-T340 PolarHBondContact OE2-OG1 3.16Å; T337-T340 WeakPolarHBondContact O-CB 3.24Å; T337-T340 PolarHBondContact O-N 3.33Å; T337-T340 VanDerWaalsContact O-N 3.13Å; T340-L342 VanDerWaalsContact C-N 3.35Å; T340-L342 PolarHBondContact O-N 3.39Å; T340-S344 WeakPolarHBondContact O-CA 3.27Å; T340-S344 WeakPolarHBondContact O-CB 3.25Å; T340-S344 PolarHBondContact O-N 3.22Å
341	E	91.2	Very high	89.7	Confident	14 Å²	14	31.1 Å²	31.1	7%	0.065	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-37.4	177.5	-172.5	58.9	-139.3	0	0	113	M272 V331 T333 T337 M338 L339 G347 S348 G349	M272-E341 HydrophobicContact CE-CB 4.35Å; M272-E341 HydrophobicContact CE-CG 4.28Å; V331-E341 HydrophobicContact CB-CG 4.32Å; V331-E341 HydrophobicContact CG1-CG 4.08Å; V331-E341 VanDerWaalsContact CG2-CD 3.5Å; V331-E341 HydrophobicContact CG2-CG 3.47Å; V331-E341 VanDerWaalsContact CG2-CG 3.47Å; V331-E341 WeakPolarHBondContact CG2-OE1 3.37Å; T333-E341 HydrophobicContact CG2-CB 3.98Å; T333-E341 HydrophobicContact CG2-CG 3.96Å; T337-E341 PolarHBondContact O-N 3.38Å; M338-E341 PolarHBondContact O-N 3.21Å; L339-E341 VanDerWaalsContact C-N 3.29Å; L339-E341 PolarHBondContact O-N 2.87Å; E341-G347 WeakPolarHBondContact OE2-CA 3.32Å; E341-S348 PolarHBondContact OE2-N 3.09Å; E341-G349 PolarHBondContact OE2-N 3.16Å
342	L	88.9	Confident	89.5	Confident	7 Å²	7	31 Å²	31	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-70.4	-50.8	176.5	-73.4	173.1	0	0	0	110.9	W103 F118 L144 K270 M272 M338 L339 T340	W103-L342 WeakPolarHBondContact CZ2-O 3.38Å; F118-L342 HydrophobicContact CE1-CD1 4.25Å; F118-L342 HydrophobicContact CE1-CD2 4.14Å; F118-L342 HydrophobicContact CZ-CD2 4.06Å; L144-L342 HydrophobicContact CD1-CD1 4.08Å; L144-L342 HydrophobicContact CD2-CD1 4.03Å; K270-L342 HydrophobicContact CB-CD2 4.32Å; K270-L342 HydrophobicContact CD-CD2 4.22Å; K270-L342 HydrophobicContact CG-CD2 3.83Å; M272-L342 HydrophobicContact CE-CD1 4.48Å; M272-L342 HydrophobicContact CE-CD2 4.04Å; M272-L342 HydrophobicContact CE-CG 3.91Å; M272-L342 HydrophobicContact SD-CD1 4.09Å; M272-L342 HydrophobicContact SD-CD2 3.7Å; M272-L342 HydrophobicContact SD-CG 3.94Å; M338-L342 HydrophobicContact CE-CD1 3.82Å; M338-L342 HydrophobicContact CG-CD1 4.33Å; M338-L342 WeakPolarHBondContact O-CG 3.36Å; M338-L342 PolarHBondContact O-N 3.29Å; L339-L342 PolarHBondContact O-N 2.97Å; T340-L342 VanDerWaalsContact C-N 3.35Å; T340-L342 PolarHBondContact O-N 3.39Å
343	F	84.3	Confident	88.9	Confident	1 Å²	1	31.8 Å²	31.8	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-96.8	-14.2	-165.1	-56.6	-40.6	0	0	0	115.3	F89 E92 I93 E99 W103 F107 F143 L144 L339	F89-F343 HydrophobicContact CD2-CD2 4.31Å; F89-F343 HydrophobicContact CD2-CE2 4.47Å; E92-F343 HydrophobicContact CB-CB 4.24Å; E92-F343 HydrophobicContact CB-CD2 4.24Å; I93-F343 HydrophobicContact CG1-CB 4.15Å; E99-F343 VanDerWaalsContact CG-O 3.26Å; E99-F343 WeakPolarHBondContact CG-O 3.38Å; W103-F343 AromaticContact CD2-CD1 3.45Å; W103-F343 HydrophobicContact CD2-CD1 3.45Å; W103-F343 VanDerWaalsContact CD2-CD1 3.45Å; W103-F343 AromaticContact CD2-CE1 3.89Å; W103-F343 HydrophobicContact CD2-CE1 3.89Å; W103-F343 AromaticContact CE2-CD1 3.6Å; W103-F343 AromaticContact CE3-CD1 3.73Å; W103-F343 HydrophobicContact CE3-CD1 3.73Å; W103-F343 AromaticContact CE3-CE1 3.66Å; W103-F343 HydrophobicContact CE3-CE1 3.66Å; W103-F343 AromaticContact CG-CD1 3.85Å; W103-F343 HydrophobicContact CG-CD1 3.85Å; W103-F343 HydrophobicContact CG-CE1 4.49Å; W103-F343 HydrophobicContact CH2-CD1 4.28Å; W103-F343 HydrophobicContact CH2-CE1 4.38Å; W103-F343 HydrophobicContact CZ2-CD1 4.07Å; W103-F343 HydrophobicContact CZ3-CD1 4.13Å; W103-F343 AromaticContact CZ3-CE1 3.92Å; W103-F343 HydrophobicContact CZ3-CE1 3.92Å; W103-F343 AromaticContact NE1-CD1 3.94Å; W103-F343 PolarHBondContact NE1-O 2.77Å; F107-F343 HydrophobicContact CE1-CE1 4.14Å; F107-F343 HydrophobicContact CE1-CZ 4.27Å; F107-F343 HydrophobicContact CZ-CE1 4.17Å; F107-F343 HydrophobicContact CZ-CZ 4.23Å; F143-F343 HydrophobicContact CD1-CE2 4.08Å; F143-F343 HydrophobicContact CD1-CZ 4.2Å; F143-F343 AromaticContact CE1-CE2 3.44Å; F143-F343 HydrophobicContact CE1-CE2 3.44Å; F143-F343 VanDerWaalsContact CE1-CE2 3.44Å; F143-F343 AromaticContact CE1-CZ 3.49Å; F143-F343 HydrophobicContact CE1-CZ 3.49Å; F143-F343 VanDerWaalsContact CE1-CZ 3.49Å; F143-F343 HydrophobicContact CZ-CE2 4.08Å; F143-F343 HydrophobicContact CZ-CZ 4.36Å; L144-F343 HydrophobicContact CD2-CZ 4.09Å; L339-F343 HydrophobicContact CB-CD2 4.21Å; L339-F343 HydrophobicContact CB-CE2 4.28Å; L339-F343 HydrophobicContact CD2-CE2 3.87Å; L339-F343 HydrophobicContact CD2-CZ 4.46Å; L339-F343 WeakPolarHBondContact O-CB 3.46Å; L339-F343 WeakPolarHBondContact O-CD2 3.42Å; L339-F343 PolarHBondContact O-N 2.86Å
344	S	81.1	Confident	88.2	Confident	23 Å²	23	33.8 Å²	33.8	16%	0.161	18%	0.184	C	C	.	.			trans	-104.4	133.7	-179.2	-163.7	0	0	0	0	113.1	E99 T340 K346 G347	E99-S344 WeakPolarHBondContact OE1-CA 3.32Å; T340-S344 WeakPolarHBondContact O-CA 3.27Å; T340-S344 WeakPolarHBondContact O-CB 3.25Å; T340-S344 PolarHBondContact O-N 3.22Å; S344-K346 PolarHBondContact O-N 3.44Å; S344-K346 PolarHBondContact OG-N 3Å; S344-G347 PolarHBondContact O-N 2.99Å; S344-G347 VanDerWaalsContact O-N 3.12Å
345	H	71.1	Confident	87.3	Confident	136 Å²	136	33.7 Å²	33.7	63%	0.63	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.9	172.3	-72.5	-165.5	0	0	0	112.7	E99	E99-H345 IonicContact OE1-CD2 3.86Å; E99-H345 PolarHBondContact OE1-CD2 3.48Å; E99-H345 IonicContact OE1-CG 3.75Å; E99-H345 PolarHBondContact OE1-N 2.92Å; E99-H345 IonicContact OE1-NE2 2.7Å
346	K	71.6	Confident	86.5	Confident	192 Å²	192	36 Å²	36	84%	0.835	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-28.9	175.9	-72.8	-173.1	177.4	-177.7	0	111.9	S344	S344-K346 PolarHBondContact O-N 3.44Å; S344-K346 PolarHBondContact OG-N 3Å
347	G	82	Confident	86	Confident	21 Å²	21	35 Å²	35	22%	0.216	19%	0.189	C	C	.	.			trans	57	-171.4	-169.6	0	0	0	0	0	113.4	E341 S344	E341-G347 WeakPolarHBondContact OE2-CA 3.32Å; S344-G347 PolarHBondContact O-N 2.99Å; S344-G347 VanDerWaalsContact O-N 3.12Å
348	S	87.8	Confident	85.7	Confident	43 Å²	43	35 Å²	35	30%	0.301	19%	0.187	S	C	.	.	S	Bend	trans	-146.4	-1.5	176.3	59.1	0	0	0	0	112.7	T333 T337 E341	T333-S348 PolarHBondContact OG1-OG 3.33Å; T337-S348 WeakPolarHBondContact CB-OG 3.33Å; T337-S348 PolarHBondContact O-OG 3.05Å; T337-S348 PolarHBondContact OG1-OG 3.49Å; E341-S348 PolarHBondContact OE2-N 3.09Å
349	G	93.2	Very high	85.6	Confident	4 Å²	4	38.4 Å²	38.4	4%	0.041	20%	0.203	C	C	.	.	S	Bend	trans	-126.5	-157.3	-179.6	0	0	0	0	0	113	I332 E341	I332-G349 CarbonylContact O-C 3.58Å; I332-G349 VanDerWaalsContact O-CA 3.26Å; I332-G349 WeakPolarHBondContact O-CA 3.4Å; E341-G349 PolarHBondContact OE2-N 3.16Å
350	T	94.9	Very high	85.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	106.1	177.4	-56.4	0	0	0	0	109.7	G279 L280 L288 V291 V331 I332 F352	G279-T350 VanDerWaalsContact CA-OG1 3.29Å; G279-T350 WeakPolarHBondContact CA-OG1 3.42Å; L280-T350 HydrophobicContact CB-CG2 4.35Å; L280-T350 HydrophobicContact CD1-CG2 4.36Å; L280-T350 HydrophobicContact CG-CG2 4.37Å; L280-T350 PolarHBondContact N-OG1 3.21Å; L288-T350 HydrophobicContact CB-CG2 4.15Å; L288-T350 WeakPolarHBondContact O-CA 3.21Å; L288-T350 WeakPolarHBondContact O-CB 3.27Å; L288-T350 WeakPolarHBondContact O-CG2 3.41Å; L288-T350 PolarHBondContact O-OG1 2.98Å; V291-T350 HydrophobicContact CB-CG2 4.46Å; V291-T350 HydrophobicContact CG2-CG2 3.55Å; V331-T350 WeakPolarHBondContact CA-O 3.21Å; V331-T350 WeakPolarHBondContact CG2-O 3.49Å; I332-T350 PolarHBondContact N-O 3.31Å; I332-T350 PolarHBondContact O-N 3.23Å; T350-F352 HydrophobicContact CG2-CD2 4.46Å; T350-F352 HydrophobicContact CG2-CE2 3.84Å; T350-F352 HydrophobicContact CG2-CZ 4.07Å; T350-F352 WeakPolarHBondContact O-CD2 3.49Å; T350-F352 WeakPolarHBondContact O-CE2 3.38Å
351	L	92.6	Very high	85.9	Confident	49 Å²	49	43.6 Å²	43.6	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.8	175.4	-179.2	66.3	0	0	0	109.9	D289 L290 V291 V331	D289-L351 PolarHBondContact O-N 2.87Å; L290-L351 CarbonylContact C-O 3.47Å; L290-L351 WeakPolarHBondContact CA-O 3.45Å; L290-L351 HydrophobicContact CD1-CB 4.24Å; L290-L351 HydrophobicContact CD1-CD2 4.13Å; L290-L351 HydrophobicContact CD1-CG 4.2Å; V291-L351 PolarHBondContact N-O 3.07Å; V331-L351 HydrophobicContact CB-CD1 4.49Å
352	F	92.2	Very high	86.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.5	168.3	-61.9	-103.2	0	0	0	107.8	L280 V291 L293 V314 I317 L321 A330 I332 T350	L280-F352 HydrophobicContact CD1-CE1 4.39Å; L280-F352 HydrophobicContact CD1-CZ 3.67Å; L280-F352 HydrophobicContact CG-CZ 4.4Å; V291-F352 HydrophobicContact CB-CD1 3.7Å; V291-F352 HydrophobicContact CB-CE1 3.86Å; V291-F352 HydrophobicContact CB-CG 4.3Å; V291-F352 HydrophobicContact CG1-CD1 3.67Å; V291-F352 HydrophobicContact CG1-CE1 3.78Å; V291-F352 HydrophobicContact CG2-CD1 4.36Å; V291-F352 HydrophobicContact CG2-CE1 4.02Å; V291-F352 HydrophobicContact CG2-CZ 4.36Å; L293-F352 HydrophobicContact CD1-CB 4.29Å; L293-F352 HydrophobicContact CD1-CD1 4.06Å; V314-F352 HydrophobicContact CG1-CE1 4.25Å; V314-F352 HydrophobicContact CG2-CE1 4.07Å; V314-F352 HydrophobicContact CG2-CZ 4.14Å; I317-F352 HydrophobicContact CD1-CD2 4.27Å; I317-F352 HydrophobicContact CD1-CE1 4.49Å; I317-F352 HydrophobicContact CD1-CE2 4.02Å; I317-F352 HydrophobicContact CD1-CZ 4.12Å; I317-F352 HydrophobicContact CG2-CB 3.83Å; I317-F352 HydrophobicContact CG2-CD1 3.79Å; I317-F352 HydrophobicContact CG2-CD2 4.24Å; I317-F352 HydrophobicContact CG2-CE1 4.4Å; I317-F352 HydrophobicContact CG2-CG 3.69Å; L321-F352 HydrophobicContact CD1-CB 3.75Å; A330-F352 HydrophobicContact CB-CB 4.19Å; A330-F352 PolarHBondContact N-O 2.89Å; A330-F352 WeakPolarHBondContact O-CA 3.45Å; A330-F352 PolarHBondContact O-N 2.99Å; I332-F352 HydrophobicContact CB-CE2 4.41Å; I332-F352 HydrophobicContact CD1-CE2 3.59Å; I332-F352 HydrophobicContact CD1-CZ 3.73Å; I332-F352 HydrophobicContact CG1-CE2 3.74Å; I332-F352 HydrophobicContact CG1-CZ 4.4Å; T350-F352 HydrophobicContact CG2-CD2 4.46Å; T350-F352 HydrophobicContact CG2-CE2 3.84Å; T350-F352 HydrophobicContact CG2-CZ 4.07Å; T350-F352 WeakPolarHBondContact O-CD2 3.49Å; T350-F352 WeakPolarHBondContact O-CE2 3.38Å
353	K	84.1	Confident	86.3	Confident	20 Å²	20	49.9 Å²	49.9	9%	0.087	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.7	166.7	-173.3	171.9	162.5	57.3	0	110	V291 L293 C326 G355 E435	V291-K353 PolarHBondContact O-N 3.4Å; L293-K353 PolarHBondContact N-O 3.08Å; L293-K353 VanDerWaalsContact N-O 3.08Å; C326-K353 PolarHBondContact O-NZ 3.02Å; K353-G355 PolarHBondContact O-N 3.41Å; K353-E435 WeakPolarHBondContact CE-OE2 3.29Å; K353-E435 IonicContact NZ-OE2 3.36Å; K353-E435 PolarHBondContact NZ-OE2 3.48Å
354	N	81.6	Confident	86.7	Confident	41 Å²	41	51 Å²	51	22%	0.219	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	110	164.6	-151.4	0.3	0	0	0	108.7	L321 N322	L321-N354 HydrophobicContact CB-CB 4.16Å; L321-N354 PolarHBondContact O-ND2 2.96Å; N322-N354 PolarHBondContact OD1-ND2 2.76Å; N322-N354 PolarHBondContact OD1-OD1 3.26Å
355	G	76.6	Confident	87.2	Confident	9 Å²	9	56.2 Å²	56.2	9%	0.093	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-96.4	150	176.2	0	0	0	0	0	110.4	L293 K353 P357	L293-G355 PolarHBondContact O-N 3.14Å; K353-G355 PolarHBondContact O-N 3.41Å; G355-P357 WeakPolarHBondContact O-CD 3.41Å
356	D	78.8	Confident	88.1	Confident	48 Å²	48	55.9 Å²	55.9	26%	0.257	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-61.1	118.1	162.7	-167.3	3.6	0	0	0	107.5	I358 S402 E403 G404 S406	D356-I358 PolarHBondContact O-N 3.03Å; D356-S402 VanDerWaalsContact OD2-CB 3.29Å; D356-S402 WeakPolarHBondContact OD2-CB 3.37Å; D356-S402 PolarHBondContact OD2-OG 3.41Å; D356-E403 WeakPolarHBondContact OD1-CB 3.47Å; D356-E403 PolarHBondContact OD1-N 3.49Å; D356-G404 VanDerWaalsContact CG-N 3.27Å; D356-G404 PolarHBondContact OD1-N 3Å; D356-G404 WeakPolarHBondContact OD2-CA 3.4Å; D356-G404 PolarHBondContact OD2-N 3.19Å; D356-S406 PolarHBondContact OD2-OG 3.5Å
357	P	83	Confident	89.2	Confident	37 Å²	37	47.3 Å²	47.3	24%	0.24	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-53.3	134.7	-174.7	-27.5	35.3	0	0	0	111.6	P294 G355 S402 E403	P294-P357 HydrophobicContact CG-CG 3.98Å; G355-P357 WeakPolarHBondContact O-CD 3.41Å; P357-S402 CarbonylContact O-C 3.49Å; P357-S402 VanDerWaalsContact O-CA 3.25Å; P357-S402 WeakPolarHBondContact O-CA 3.33Å; P357-E403 HydrophobicContact CB-CB 4.49Å; P357-E403 WeakPolarHBondContact CG-OE2 3.45Å; P357-E403 PolarHBondContact O-N 3.01Å
358	I	88.1	Confident	89.9	Confident	37 Å²	37	49.6 Å²	49.6	19%	0.19	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.8	-178.9	-56.2	-174.7	0	0	0	108.7	D356 Y400 I440 L441	D356-I358 PolarHBondContact O-N 3.03Å; I358-Y400 HydrophobicContact CG2-CD1 4.48Å; I358-I440 HydrophobicContact CD1-CB 4.3Å; I358-I440 HydrophobicContact CD1-CG2 3.73Å; I358-I440 HydrophobicContact CG1-CG2 4.44Å; I358-L441 HydrophobicContact CD1-CB 3.73Å; I358-L441 HydrophobicContact CD1-CD1 3.94Å; I358-L441 HydrophobicContact CD1-CG 4.46Å; I358-L441 HydrophobicContact CG2-CD1 3.94Å
359	H	91.1	Very high	90.2	Very high	75 Å²	75	50.2 Å²	50.2	35%	0.347	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	144.2	177.4	-59.2	-66.2	0	0	0	110.5	Y361 Y400 L401	H359-Y361 HydrophobicContact CB-CD2 4.34Å; H359-Y361 HydrophobicContact CB-CE2 3.5Å; H359-Y361 VanDerWaalsContact CB-CE2 3.5Å; H359-Y400 CarbonylContact O-C 3.58Å; H359-Y400 WeakPolarHBondContact O-CA 3.35Å; H359-L401 PolarHBondContact N-O 3.34Å; H359-L401 PolarHBondContact O-N 3.23Å
360	K	94.8	Very high	90.3	Very high	103 Å²	103	56.2 Å²	56.2	45%	0.448	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.5	174.5	-177.4	-174.9	-170.7	165.3	0	109.7	I399 Y400 D448	K360-I399 CarbonylContact C-O 3.59Å; K360-I399 WeakPolarHBondContact CA-O 3.49Å; K360-Y400 HydrophobicContact CB-CD1 4.37Å; K360-Y400 HydrophobicContact CB-CE1 4.28Å; K360-Y400 HydrophobicContact CD-CE1 4.14Å; K360-Y400 HydrophobicContact CG-CE1 4.13Å; K360-Y400 PolarHBondContact NZ-OH 3.24Å; K360-D448 VanDerWaalsContact CD-OD2 3.29Å; K360-D448 WeakPolarHBondContact CD-OD2 3.23Å; K360-D448 WeakPolarHBondContact CE-OD2 3.45Å; K360-D448 IonicContact NZ-OD2 3.93Å; K360-D448 PolarHBondContact NZ-OD2 2.85Å
361	Y	95.9	Very high	90.3	Very high	55 Å²	55	61.6 Å²	61.6	22%	0.216	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.7	176.4	-58.1	-94.9	0	0	0	110.2	H359 D366 I367 S398 I399 L401	H359-Y361 HydrophobicContact CB-CD2 4.34Å; H359-Y361 HydrophobicContact CB-CE2 3.5Å; H359-Y361 VanDerWaalsContact CB-CE2 3.5Å; Y361-D366 HydrophobicContact CD1-CB 4.24Å; Y361-D366 HydrophobicContact CE1-CB 4.04Å; Y361-I367 HydrophobicContact CD1-CD1 4.32Å; Y361-I367 HydrophobicContact CD1-CG1 3.98Å; Y361-I367 HydrophobicContact CD2-CD1 4Å; Y361-I367 HydrophobicContact CD2-CG1 4.22Å; Y361-I367 HydrophobicContact CE1-CG1 4.26Å; Y361-I367 HydrophobicContact CE2-CG1 4.49Å; Y361-I367 HydrophobicContact CG-CD1 3.81Å; Y361-I367 HydrophobicContact CG-CG1 3.96Å; Y361-S398 CarbonylContact O-C 3.54Å; Y361-S398 VanDerWaalsContact O-CA 3.24Å; Y361-S398 WeakPolarHBondContact O-CA 3.43Å; Y361-I399 PolarHBondContact N-O 2.86Å; Y361-I399 PolarHBondContact O-N 3.25Å; Y361-L401 HydrophobicContact CD2-CB 4.25Å; Y361-L401 HydrophobicContact CE2-CB 3.99Å; Y361-L401 HydrophobicContact CE2-CD2 4.22Å
362	S	93.9	Very high	90.5	Very high	88 Å²	88	59.3 Å²	59.3	62%	0.615	31%	0.309	S	S	*	.	S	Bend	trans	-99.4	-19	173.7	-57.9	0	0	0	0	112.4
363	T	93.6	Very high	90.6	Very high	65 Å²	65	61.3 Å²	61.3	40%	0.399	32%	0.32	S	S	.	.	S	Bend	trans	-130	174.4	178.3	74.6	0	0	0	0	110.5	D365	T363-D365 WeakPolarHBondContact CB-OD2 3.42Å; T363-D365 PolarHBondContact OG1-OD2 3.08Å
364	L	92.3	Very high	91.1	Very high	24 Å²	24	63.1 Å²	63.1	13%	0.126	34%	0.338	C	S	.	.	S	Bend	trans	-94.4	-3.5	178.6	-71.2	164.8	0	0	0	112.8	D366 I367 L369 I389 L396 I399	L364-D366 PolarHBondContact O-N 3.25Å; L364-I367 HydrophobicContact CD2-CD1 4.48Å; L364-I367 PolarHBondContact O-N 2.98Å; L364-L369 HydrophobicContact CB-CD2 4.23Å; L364-L369 HydrophobicContact CD2-CD2 3.72Å; L364-L369 HydrophobicContact CG-CD2 4.42Å; L364-I389 HydrophobicContact CD1-CG2 3.96Å; L364-L396 HydrophobicContact CG-CD2 4.12Å; L364-I399 HydrophobicContact CD2-CD1 3.34Å; L364-I399 HydrophobicContact CG-CD1 4.2Å
365	D	91.4	Very high	91.7	Very high	134 Å²	134	61.8 Å²	61.8	72%	0.717	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-34.7	-165.8	-52.8	-48	0	0	0	112.8	T363 I367	T363-D365 WeakPolarHBondContact CB-OD2 3.42Å; T363-D365 PolarHBondContact OG1-OD2 3.08Å; D365-I367 VanDerWaalsContact C-N 3.34Å
366	D	90.9	Very high	92.5	Very high	128 Å²	128	61.3 Å²	61.3	68%	0.684	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	17.5	179.7	-61	-46	0	0	0	112.8	Y361 L364	Y361-D366 HydrophobicContact CD1-CB 4.24Å; Y361-D366 HydrophobicContact CE1-CB 4.04Å; L364-D366 PolarHBondContact O-N 3.25Å
367	I	94.7	Very high	93.3	Very high	13 Å²	13	60.9 Å²	60.9	7%	0.067	32%	0.324	C	S	.	.	S	Bend	trans	-115.5	130.9	-176.8	-59.8	178.8	0	0	0	110.3	Y361 L364 D365 L369 L372 I399 L401 Y405	Y361-I367 HydrophobicContact CD1-CD1 4.32Å; Y361-I367 HydrophobicContact CD1-CG1 3.98Å; Y361-I367 HydrophobicContact CD2-CD1 4Å; Y361-I367 HydrophobicContact CD2-CG1 4.22Å; Y361-I367 HydrophobicContact CE1-CG1 4.26Å; Y361-I367 HydrophobicContact CE2-CG1 4.49Å; Y361-I367 HydrophobicContact CG-CD1 3.81Å; Y361-I367 HydrophobicContact CG-CG1 3.96Å; L364-I367 HydrophobicContact CD2-CD1 4.48Å; L364-I367 PolarHBondContact O-N 2.98Å; D365-I367 VanDerWaalsContact C-N 3.34Å; I367-L369 HydrophobicContact CG2-CD2 4.47Å; I367-L369 PolarHBondContact O-N 3.08Å; I367-L372 HydrophobicContact CG2-CB 4.33Å; I367-L372 HydrophobicContact CG2-CD2 4.1Å; I367-I399 HydrophobicContact CD1-CB 4.15Å; I367-I399 HydrophobicContact CD1-CD1 3.53Å; I367-I399 HydrophobicContact CD1-CG1 4.41Å; I367-I399 HydrophobicContact CD1-CG2 4.11Å; I367-L401 HydrophobicContact CD1-CD2 4.42Å; I367-L401 HydrophobicContact CG1-CD2 4.3Å; I367-L401 HydrophobicContact CG2-CD2 3.82Å; I367-Y405 HydrophobicContact CG2-CE1 4.24Å
368	D	95.9	Very high	93.7	Very high	68 Å²	68	65.7 Å²	65.7	36%	0.364	34%	0.341	S	S	.	.			trans	-70	95.3	166.7	-175.2	-31.4	0	0	0	109.1	D370 R371 L372 Y405	D368-D370 VanDerWaalsContact C-N 3.28Å; D368-D370 PolarHBondContact O-N 2.8Å; D368-D370 PolarHBondContact OD1-N 3.44Å; D368-R371 HydrophobicContact CB-CB 4.22Å; D368-R371 HydrophobicContact CB-CG 4.36Å; D368-R371 PolarHBondContact O-N 3.03Å; D368-R371 PolarHBondContact OD1-N 2.96Å; D368-R371 WeakPolarHBondContact OD2-CD 3.26Å; D368-R371 WeakPolarHBondContact OD2-CG 3.29Å; D368-L372 PolarHBondContact O-N 2.75Å; D368-Y405 HydrophobicContact CB-CE1 4.05Å; D368-Y405 WeakPolarHBondContact CB-OH 3.18Å; D368-Y405 PolarHBondContact N-OH 3.45Å; D368-Y405 VanDerWaalsContact O-CE1 3.27Å; D368-Y405 WeakPolarHBondContact O-CE1 3.16Å
369	L	94.9	Very high	93.8	Very high	57 Å²	57	65.4 Å²	65.4	30%	0.298	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-35.3	-176.7	-65.1	179	0	0	0	112.5	L364 I367 L372 L373 I389	L364-L369 HydrophobicContact CB-CD2 4.23Å; L364-L369 HydrophobicContact CD2-CD2 3.72Å; L364-L369 HydrophobicContact CG-CD2 4.42Å; I367-L369 HydrophobicContact CG2-CD2 4.47Å; I367-L369 PolarHBondContact O-N 3.08Å; L369-L372 PolarHBondContact O-N 2.95Å; L369-L373 WeakPolarHBondContact O-CB 3.34Å; L369-L373 VanDerWaalsContact O-CG 3.24Å; L369-L373 WeakPolarHBondContact O-CG 3.11Å; L369-L373 PolarHBondContact O-N 2.9Å; L369-I389 HydrophobicContact CD1-CG2 4.25Å; L369-I389 HydrophobicContact CD2-CD1 4.43Å
370	D	94.9	Very high	93.6	Very high	130 Å²	130	65.2 Å²	65.2	70%	0.695	34%	0.341	S	S	*	.	H	α-helix	trans	-65.8	-44.3	-179.1	-69.9	-30.4	0	0	0	110.4	D368 A374	D368-D370 VanDerWaalsContact C-N 3.28Å; D368-D370 PolarHBondContact O-N 2.8Å; D368-D370 PolarHBondContact OD1-N 3.44Å; D370-A374 VanDerWaalsContact O-CB 3.25Å; D370-A374 WeakPolarHBondContact O-CB 3.43Å; D370-A374 PolarHBondContact O-N 2.95Å
371	R	95.8	Very high	93.3	Very high	113 Å²	113	68.9 Å²	68.9	43%	0.426	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.6	-71.1	178.6	68.2	-166.7	-1.2	112.3	D368 A374 L375 G404 Y405	D368-R371 HydrophobicContact CB-CB 4.22Å; D368-R371 HydrophobicContact CB-CG 4.36Å; D368-R371 PolarHBondContact O-N 3.03Å; D368-R371 PolarHBondContact OD1-N 2.96Å; D368-R371 WeakPolarHBondContact OD2-CD 3.26Å; D368-R371 WeakPolarHBondContact OD2-CG 3.29Å; R371-A374 PolarHBondContact O-N 3.4Å; R371-L375 WeakPolarHBondContact O-CB 3.32Å; R371-L375 PolarHBondContact O-N 2.84Å; R371-G404 PolarHBondContact NH2-O 2.81Å; R371-G404 VanDerWaalsContact NH2-O 3.14Å; R371-Y405 HydrophobicContact CB-CD1 3.4Å; R371-Y405 HydrophobicContact CB-CE1 3.7Å; R371-Y405 HydrophobicContact CB-CG 3.91Å
372	L	95.6	Very high	93	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.1	-46.9	177.3	176.5	60.8	0	0	0	111.4	I367 D368 L369 L375 I376 L401 Y405 A408 I410	I367-L372 HydrophobicContact CG2-CB 4.33Å; I367-L372 HydrophobicContact CG2-CD2 4.1Å; D368-L372 PolarHBondContact O-N 2.75Å; L369-L372 PolarHBondContact O-N 2.95Å; L372-L375 WeakPolarHBondContact O-CB 3.43Å; L372-L375 PolarHBondContact O-N 3.22Å; L372-I376 HydrophobicContact CD1-CD1 4.01Å; L372-I376 HydrophobicContact CD1-CG1 4.34Å; L372-I376 HydrophobicContact CG-CD1 4Å; L372-I376 WeakPolarHBondContact O-CG1 3.38Å; L372-I376 PolarHBondContact O-N 3.47Å; L372-L401 HydrophobicContact CD1-CD1 4.29Å; L372-Y405 HydrophobicContact CB-CD1 4.43Å; L372-Y405 HydrophobicContact CB-CE1 4.26Å; L372-A408 HydrophobicContact CD1-CB 3.69Å; L372-I410 HydrophobicContact CD2-CD1 4.4Å
373	L	94.6	Very high	92.9	Very high	43 Å²	43	72.1 Å²	72.1	23%	0.225	37%	0.369	C	S	.	.	H	α-helix	trans	-64	-41.7	177.4	-72.2	174.5	0	0	0	111.4	L369 L375 I376 N377 L384 I389	L369-L373 WeakPolarHBondContact O-CB 3.34Å; L369-L373 VanDerWaalsContact O-CG 3.24Å; L369-L373 WeakPolarHBondContact O-CG 3.11Å; L369-L373 PolarHBondContact O-N 2.9Å; L373-L375 VanDerWaalsContact C-N 3.34Å; L373-L375 PolarHBondContact O-N 2.82Å; L373-I376 PolarHBondContact O-N 3.2Å; L373-N377 WeakPolarHBondContact O-CB 3.29Å; L373-N377 PolarHBondContact O-N 2.57Å; L373-N377 PolarHBondContact O-ND2 3.1Å; L373-L384 HydrophobicContact CD2-CD1 3.56Å; L373-I389 HydrophobicContact CD1-CG1 4.26Å; L373-I389 HydrophobicContact CD2-CD1 3.92Å; L373-I389 HydrophobicContact CD2-CG1 4.14Å; L373-I389 HydrophobicContact CG-CD1 4.39Å
374	A	94.3	Very high	92.8	Very high	58 Å²	58	69.6 Å²	69.6	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-59.4	-43.7	174.9	0	0	0	0	0	111.8	D370 R371 K378	D370-A374 VanDerWaalsContact O-CB 3.25Å; D370-A374 WeakPolarHBondContact O-CB 3.43Å; D370-A374 PolarHBondContact O-N 2.95Å; R371-A374 PolarHBondContact O-N 3.4Å; A374-K378 WeakPolarHBondContact O-CB 3.46Å; A374-K378 PolarHBondContact O-N 3.16Å
375	L	94.6	Very high	92.8	Very high	12 Å²	12	72.9 Å²	72.9	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-51.7	174.3	172.5	64.5	0	0	0	111.1	R371 L372 L373 N377 K378 S379 Y405 A408 V427	R371-L375 WeakPolarHBondContact O-CB 3.32Å; R371-L375 PolarHBondContact O-N 2.84Å; L372-L375 WeakPolarHBondContact O-CB 3.43Å; L372-L375 PolarHBondContact O-N 3.22Å; L373-L375 VanDerWaalsContact C-N 3.34Å; L373-L375 PolarHBondContact O-N 2.82Å; L375-N377 PolarHBondContact O-N 2.7Å; L375-K378 PolarHBondContact O-N 3.48Å; L375-S379 WeakPolarHBondContact O-CB 3.17Å; L375-S379 PolarHBondContact O-N 2.81Å; L375-S379 PolarHBondContact O-OG 3.25Å; L375-Y405 WeakPolarHBondContact CD2-O 3.5Å; L375-A408 HydrophobicContact CD2-CB 3.88Å; L375-V427 HydrophobicContact CD2-CG2 3.84Å; L375-V427 HydrophobicContact CG-CG2 3.93Å
376	I	94.4	Very high	92.6	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-48.1	-177.1	-63.4	163.8	0	0	0	110.6	L372 L373 K378 S379 F380 L384 I410 K425 V427 F506	L372-I376 HydrophobicContact CD1-CD1 4.01Å; L372-I376 HydrophobicContact CD1-CG1 4.34Å; L372-I376 HydrophobicContact CG-CD1 4Å; L372-I376 WeakPolarHBondContact O-CG1 3.38Å; L372-I376 PolarHBondContact O-N 3.47Å; L373-I376 PolarHBondContact O-N 3.2Å; I376-K378 VanDerWaalsContact C-N 3.32Å; I376-K378 PolarHBondContact O-N 3.24Å; I376-S379 PolarHBondContact O-N 3.12Å; I376-F380 HydrophobicContact CG2-CD2 3.79Å; I376-F380 HydrophobicContact CG2-CE2 4.06Å; I376-F380 WeakPolarHBondContact O-CD2 3.36Å; I376-F380 PolarHBondContact O-N 3.45Å; I376-F380 VanDerWaalsContact O-N 3.08Å; I376-L384 HydrophobicContact CB-CD1 3.89Å; I376-L384 HydrophobicContact CD1-CD1 3.94Å; I376-L384 HydrophobicContact CG2-CD1 3.51Å; I376-L384 HydrophobicContact CG2-CD2 4.28Å; I376-L384 HydrophobicContact CG2-CG 3.9Å; I376-I410 HydrophobicContact CD1-CD1 3.87Å; I376-K425 HydrophobicContact CG2-CD 4.13Å; I376-V427 HydrophobicContact CB-CG1 4.45Å; I376-V427 HydrophobicContact CG1-CG1 4.23Å; I376-V427 HydrophobicContact CG1-CG2 3.95Å; I376-V427 HydrophobicContact CG2-CG1 4.28Å; I376-F506 HydrophobicContact CG2-CE1 4.31Å; I376-F506 HydrophobicContact CG2-CZ 4.26Å
377	N	93.6	Very high	92.6	Very high	38 Å²	38	72.7 Å²	72.7	20%	0.203	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-40.9	-177.5	-69.5	-17.4	0	0	0	111.6	L373 L375 E381 K382 L384	L373-N377 WeakPolarHBondContact O-CB 3.29Å; L373-N377 PolarHBondContact O-N 2.57Å; L373-N377 PolarHBondContact O-ND2 3.1Å; L375-N377 PolarHBondContact O-N 2.7Å; N377-E381 WeakPolarHBondContact O-CA 3.4Å; N377-E381 PolarHBondContact O-N 3.06Å; N377-K382 WeakPolarHBondContact CA-O 3.41Å; N377-K382 WeakPolarHBondContact CB-O 3.3Å; N377-K382 PolarHBondContact O-N 2.75Å; N377-K382 VanDerWaalsContact O-N 3.14Å; N377-K382 PolarHBondContact OD1-O 2.65Å; N377-L384 WeakPolarHBondContact OD1-CB 3.36Å; N377-L384 WeakPolarHBondContact OD1-CG 3.45Å; N377-L384 PolarHBondContact OD1-N 3.4Å
378	K	92	Very high	92.5	Very high	138 Å²	138	72.4 Å²	72.4	60%	0.6	36%	0.355	S	S	*	.	H	α-helix	trans	-67.1	-42.6	176.9	-172.2	176.4	-178.6	179.7	0	112.3	A374 L375 I376 F380 E381	A374-K378 WeakPolarHBondContact O-CB 3.46Å; A374-K378 PolarHBondContact O-N 3.16Å; L375-K378 PolarHBondContact O-N 3.48Å; I376-K378 VanDerWaalsContact C-N 3.32Å; I376-K378 PolarHBondContact O-N 3.24Å; K378-F380 PolarHBondContact O-N 3.49Å; K378-E381 PolarHBondContact O-N 3.26Å
379	S	89.7	Confident	92.3	Very high	31 Å²	31	70.4 Å²	70.4	22%	0.217	34%	0.344	C	S	.	.	H	α-helix	trans	-68.1	-32	-179.1	-74	0	0	0	0	113.5	L375 I376 V428	L375-S379 WeakPolarHBondContact O-CB 3.17Å; L375-S379 PolarHBondContact O-N 2.81Å; L375-S379 PolarHBondContact O-OG 3.25Å; I376-S379 PolarHBondContact O-N 3.12Å; S379-V428 PolarHBondContact OG-O 2.82Å
380	F	87.8	Confident	92.1	Very high	72 Å²	72	73.1 Å²	73.1	32%	0.316	36%	0.355	S	S	.	.	H	α-helix	trans	-95.1	-5.3	176.9	-74.9	-76.8	0	0	0	114.3	I376 K378 K382 K425 V427 F506	I376-F380 HydrophobicContact CG2-CD2 3.79Å; I376-F380 HydrophobicContact CG2-CE2 4.06Å; I376-F380 WeakPolarHBondContact O-CD2 3.36Å; I376-F380 PolarHBondContact O-N 3.45Å; I376-F380 VanDerWaalsContact O-N 3.08Å; K378-F380 PolarHBondContact O-N 3.49Å; F380-K382 PolarHBondContact O-N 3.45Å; F380-K425 HydrophobicContact CE2-CD 3.84Å; F380-K425 HydrophobicContact CZ-CD 4.32Å; F380-V427 HydrophobicContact CD2-CG1 3.72Å; F380-V427 HydrophobicContact CE2-CG1 3.18Å; F380-V427 HydrophobicContact CZ-CG1 4.02Å; F380-F506 HydrophobicContact CB-CE1 3.75Å; F380-F506 HydrophobicContact CB-CE2 4.43Å; F380-F506 HydrophobicContact CB-CZ 3.68Å; F380-F506 HydrophobicContact CD1-CE2 4.24Å; F380-F506 HydrophobicContact CD1-CZ 4.06Å; F380-F506 HydrophobicContact CD2-CE1 4.01Å; F380-F506 HydrophobicContact CD2-CE2 4.22Å; F380-F506 AromaticContact CD2-CZ 3.33Å; F380-F506 HydrophobicContact CD2-CZ 3.33Å; F380-F506 HydrophobicContact CE2-CE2 4.49Å; F380-F506 AromaticContact CE2-CZ 3.85Å; F380-F506 HydrophobicContact CE2-CZ 3.85Å; F380-F506 HydrophobicContact CG-CE1 4.02Å; F380-F506 HydrophobicContact CG-CE2 4.06Å; F380-F506 AromaticContact CG-CZ 3.42Å; F380-F506 HydrophobicContact CG-CZ 3.42Å; F380-F506 VanDerWaalsContact CG-CZ 3.42Å; F380-F506 HydrophobicContact CZ-CZ 4.44Å
381	E	89.1	Confident	92	Very high	180 Å²	180	69.2 Å²	69.2	84%	0.841	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	35.2	-174.2	-58.5	174.9	-171.2	0	0	112.4	N377 K378	N377-E381 WeakPolarHBondContact O-CA 3.4Å; N377-E381 PolarHBondContact O-N 3.06Å; K378-E381 PolarHBondContact O-N 3.26Å
382	K	89.8	Confident	91.8	Very high	102 Å²	102	63.8 Å²	63.8	44%	0.443	32%	0.317	S	S	.	.	S	Bend	trans	-150.6	153.1	-175.4	-69.4	-177.2	-176.4	-175	0	111	N377 F380 F506	N377-K382 WeakPolarHBondContact CA-O 3.41Å; N377-K382 WeakPolarHBondContact CB-O 3.3Å; N377-K382 PolarHBondContact O-N 2.75Å; N377-K382 VanDerWaalsContact O-N 3.14Å; N377-K382 PolarHBondContact OD1-O 2.65Å; F380-K382 PolarHBondContact O-N 3.45Å; K382-F506 HydrophobicContact CB-CB 4.2Å; K382-F506 HydrophobicContact CB-CD1 3.53Å; K382-F506 HydrophobicContact CB-CE1 4.2Å; K382-F506 HydrophobicContact CB-CG 4Å; K382-F506 HydrophobicContact CD-CB 4.1Å; K382-F506 HydrophobicContact CD-CD1 4.49Å; K382-F506 HydrophobicContact CD-CG 4.17Å
383	N	90.3	Very high	91.5	Very high	108 Å²	108	69.9 Å²	69.9	58%	0.578	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-87.3	127.4	174.2	-65.5	-28.7	0	0	0	111.2	F506 H507	N383-F506 WeakPolarHBondContact O-CA 3.32Å; N383-H507 PolarHBondContact O-CD2 2.6Å; N383-H507 PolarHBondContact O-N 2.8Å
384	L	91.4	Very high	91.1	Very high	12 Å²	12	72.3 Å²	72.3	6%	0.063	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-60.9	149.4	165.2	-79.6	171.2	0	0	0	110.7	L373 I376 N377 Y388 F506 H507	L373-L384 HydrophobicContact CD2-CD1 3.56Å; I376-L384 HydrophobicContact CB-CD1 3.89Å; I376-L384 HydrophobicContact CD1-CD1 3.94Å; I376-L384 HydrophobicContact CG2-CD1 3.51Å; I376-L384 HydrophobicContact CG2-CD2 4.28Å; I376-L384 HydrophobicContact CG2-CG 3.9Å; N377-L384 WeakPolarHBondContact OD1-CB 3.36Å; N377-L384 WeakPolarHBondContact OD1-CG 3.45Å; N377-L384 PolarHBondContact OD1-N 3.4Å; L384-Y388 HydrophobicContact CD1-CD1 3.86Å; L384-Y388 HydrophobicContact CD1-CE1 4.17Å; L384-Y388 HydrophobicContact CD1-CG 4.47Å; L384-Y388 HydrophobicContact CD2-CD1 4.24Å; L384-Y388 HydrophobicContact CD2-CD2 4.34Å; L384-Y388 HydrophobicContact CD2-CG 4.13Å; L384-F506 HydrophobicContact CD2-CD1 4.09Å; L384-F506 HydrophobicContact CD2-CE1 3.71Å; L384-F506 HydrophobicContact CD2-CZ 3.94Å; L384-F506 HydrophobicContact CG-CD1 4.29Å; L384-F506 HydrophobicContact CG-CE1 3.86Å; L384-F506 HydrophobicContact CG-CZ 4.49Å; L384-H507 PolarHBondContact O-CD2 3.37Å; L384-H507 PolarHBondContact O-NE2 2.67Å
385	R	92	Very high	91.1	Very high	93 Å²	93	71.8 Å²	71.8	35%	0.351	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-64.4	145.2	170.9	-66.9	165.2	49.3	167.9	2	111.1	D387 Y388 S505	R385-D387 WeakPolarHBondContact CB-OD1 3.48Å; R385-D387 IonicContact CZ-OD1 2.72Å; R385-D387 IonicContact CZ-OD2 3.6Å; R385-D387 IonicContact NE-OD1 3.33Å; R385-D387 PolarHBondContact NE-OD1 3.34Å; R385-D387 IonicContact NE-OD2 3.88Å; R385-D387 VanDerWaalsContact NH2-CG 3.3Å; R385-D387 IonicContact NH2-OD1 3.59Å; R385-D387 PolarHBondContact NH2-OD1 3.47Å; R385-D387 VanDerWaalsContact NH2-OD1 3.15Å; R385-D387 IonicContact NH2-OD2 2.9Å; R385-D387 PolarHBondContact NH2-OD2 2.81Å; R385-D387 PolarHBondContact O-N 3.12Å; R385-Y388 WeakPolarHBondContact O-CB 3.43Å; R385-Y388 PolarHBondContact O-N 3.05Å; R385-S505 WeakPolarHBondContact CG-O 3.35Å; R385-S505 PolarHBondContact N-O 2.72Å
386	E	88.1	Confident	91.1	Very high	185 Å²	185	72.7 Å²	72.7	86%	0.864	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-32.9	-179.9	-63.3	176.9	-178.6	0	0	113	Y388	E386-Y388 PolarHBondContact O-N 3.06Å
387	D	90.5	Very high	91.2	Very high	74 Å²	74	74.1 Å²	74.1	40%	0.396	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1	179.3	70.9	-35.6	0	0	0	113.9	R385 I389 E390 S391	R385-D387 WeakPolarHBondContact CB-OD1 3.48Å; R385-D387 IonicContact CZ-OD1 2.72Å; R385-D387 IonicContact CZ-OD2 3.6Å; R385-D387 IonicContact NE-OD1 3.33Å; R385-D387 PolarHBondContact NE-OD1 3.34Å; R385-D387 IonicContact NE-OD2 3.88Å; R385-D387 VanDerWaalsContact NH2-CG 3.3Å; R385-D387 IonicContact NH2-OD1 3.59Å; R385-D387 PolarHBondContact NH2-OD1 3.47Å; R385-D387 VanDerWaalsContact NH2-OD1 3.15Å; R385-D387 IonicContact NH2-OD2 2.9Å; R385-D387 PolarHBondContact NH2-OD2 2.81Å; R385-D387 PolarHBondContact O-N 3.12Å; D387-I389 PolarHBondContact O-N 3.35Å; D387-E390 PolarHBondContact O-N 3.47Å; D387-S391 WeakPolarHBondContact O-CB 3.44Å; D387-S391 PolarHBondContact O-N 3.49Å
388	Y	92.4	Very high	91.4	Very high	6 Å²	6	72.3 Å²	72.3	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-61.4	-47.3	-175.9	176.7	-105.7	0	0	0	112.5	L384 R385 E386 E390 S391 L392 I410 D424 K425	L384-Y388 HydrophobicContact CD1-CD1 3.86Å; L384-Y388 HydrophobicContact CD1-CE1 4.17Å; L384-Y388 HydrophobicContact CD1-CG 4.47Å; L384-Y388 HydrophobicContact CD2-CD1 4.24Å; L384-Y388 HydrophobicContact CD2-CD2 4.34Å; L384-Y388 HydrophobicContact CD2-CG 4.13Å; R385-Y388 WeakPolarHBondContact O-CB 3.43Å; R385-Y388 PolarHBondContact O-N 3.05Å; E386-Y388 PolarHBondContact O-N 3.06Å; Y388-E390 VanDerWaalsContact C-N 3.34Å; Y388-E390 PolarHBondContact O-N 3.21Å; Y388-S391 WeakPolarHBondContact O-CB 3.39Å; Y388-S391 PolarHBondContact O-N 2.89Å; Y388-S391 VanDerWaalsContact O-N 3.16Å; Y388-S391 PolarHBondContact O-OG 3.26Å; Y388-L392 HydrophobicContact CD1-CD1 4.4Å; Y388-L392 HydrophobicContact CE1-CD1 3.79Å; Y388-L392 HydrophobicContact CE1-CG 4.34Å; Y388-L392 HydrophobicContact CE2-CD2 4.44Å; Y388-L392 PolarHBondContact O-N 3.37Å; Y388-I410 HydrophobicContact CE1-CD1 4.15Å; Y388-D424 WeakPolarHBondContact CE2-OD2 3.37Å; Y388-D424 VanDerWaalsContact CZ-OD2 3.28Å; Y388-D424 PolarHBondContact OH-OD2 3.42Å; Y388-K425 VanDerWaalsContact OH-CG 3.24Å; Y388-K425 WeakPolarHBondContact OH-CG 3.23Å
389	I	92.8	Very high	91.6	Very high	27 Å²	27	65.8 Å²	65.8	14%	0.138	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-42.8	-180	-62.3	-59.1	0	0	0	110.8	L364 L369 L373 D387 S391 L392	L364-I389 HydrophobicContact CD1-CG2 3.96Å; L369-I389 HydrophobicContact CD1-CG2 4.25Å; L369-I389 HydrophobicContact CD2-CD1 4.43Å; L373-I389 HydrophobicContact CD1-CG1 4.26Å; L373-I389 HydrophobicContact CD2-CD1 3.92Å; L373-I389 HydrophobicContact CD2-CG1 4.14Å; L373-I389 HydrophobicContact CG-CD1 4.39Å; D387-I389 PolarHBondContact O-N 3.35Å; I389-S391 VanDerWaalsContact C-N 3.28Å; I389-S391 PolarHBondContact O-N 3.48Å; I389-L392 HydrophobicContact CD1-CD1 4.36Å; I389-L392 WeakPolarHBondContact O-CB 3.19Å; I389-L392 PolarHBondContact O-N 3.48Å; I389-L392 VanDerWaalsContact O-N 3.12Å
390	E	91.5	Very high	92	Very high	113 Å²	113	64.5 Å²	64.5	53%	0.528	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-39.8	175.2	-165.4	61.5	-152.6	0	0	111	D387 Y388 L392 K393	D387-E390 PolarHBondContact O-N 3.47Å; Y388-E390 VanDerWaalsContact C-N 3.34Å; Y388-E390 PolarHBondContact O-N 3.21Å; E390-L392 PolarHBondContact O-N 3.35Å; E390-L392 VanDerWaalsContact O-N 3.15Å; E390-K393 WeakPolarHBondContact O-CB 3.24Å; E390-K393 PolarHBondContact O-N 2.7Å; E390-K393 VanDerWaalsContact O-N 3.08Å; E390-K393 WeakPolarHBondContact OE1-CD 3.22Å; E390-K393 IonicContact OE1-NZ 3.49Å; E390-K393 PolarHBondContact OE1-NZ 3.47Å; E390-K393 VanDerWaalsContact OE2-CE 3.29Å; E390-K393 WeakPolarHBondContact OE2-CE 3.35Å; E390-K393 IonicContact OE2-NZ 2.63Å; E390-K393 PolarHBondContact OE2-NZ 2.87Å
391	S	90.9	Very high	92.3	Very high	48 Å²	48	61.1 Å²	61.1	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-21.1	177.2	87.3	0	0	0	0	113.9	D387 Y388 I389 R395	D387-S391 WeakPolarHBondContact O-CB 3.44Å; D387-S391 PolarHBondContact O-N 3.49Å; Y388-S391 WeakPolarHBondContact O-CB 3.39Å; Y388-S391 PolarHBondContact O-N 2.89Å; Y388-S391 VanDerWaalsContact O-N 3.16Å; Y388-S391 PolarHBondContact O-OG 3.26Å; I389-S391 VanDerWaalsContact C-N 3.28Å; I389-S391 PolarHBondContact O-N 3.48Å; S391-R395 WeakPolarHBondContact O-CD 3.16Å; S391-R395 WeakPolarHBondContact O-CG 3.2Å; S391-R395 PolarHBondContact O-NE 3.09Å; S391-R395 PolarHBondContact OG-NH2 3.05Å; S391-R395 VanDerWaalsContact OG-NH2 3.1Å
392	L	92.4	Very high	92.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-77.7	-26.1	177.7	-68.2	174.5	0	0	0	111.9	Y388 I389 E390 G394 R395 L396 I410 T412	Y388-L392 HydrophobicContact CD1-CD1 4.4Å; Y388-L392 HydrophobicContact CE1-CD1 3.79Å; Y388-L392 HydrophobicContact CE1-CG 4.34Å; Y388-L392 HydrophobicContact CE2-CD2 4.44Å; Y388-L392 PolarHBondContact O-N 3.37Å; I389-L392 HydrophobicContact CD1-CD1 4.36Å; I389-L392 WeakPolarHBondContact O-CB 3.19Å; I389-L392 PolarHBondContact O-N 3.48Å; I389-L392 VanDerWaalsContact O-N 3.12Å; E390-L392 PolarHBondContact O-N 3.35Å; E390-L392 VanDerWaalsContact O-N 3.15Å; L392-G394 PolarHBondContact O-N 2.87Å; L392-R395 PolarHBondContact O-N 2.91Å; L392-R395 VanDerWaalsContact O-N 3.1Å; L392-L396 WeakPolarHBondContact O-CB 3.45Å; L392-L396 PolarHBondContact O-N 3.36Å; L392-I410 HydrophobicContact CD1-CD1 4.44Å; L392-I410 HydrophobicContact CD1-CG2 4.25Å; L392-I410 HydrophobicContact CD2-CG2 3.89Å; L392-T412 HydrophobicContact CD2-CG2 3.75Å
393	K	88.9	Confident	92.4	Very high	128 Å²	128	53.4 Å²	53.4	56%	0.557	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	126.7	179.2	-65.2	-179.2	-177	166.7	0	109.6	E390 R395	E390-K393 WeakPolarHBondContact O-CB 3.24Å; E390-K393 PolarHBondContact O-N 2.7Å; E390-K393 VanDerWaalsContact O-N 3.08Å; E390-K393 WeakPolarHBondContact OE1-CD 3.22Å; E390-K393 IonicContact OE1-NZ 3.49Å; E390-K393 PolarHBondContact OE1-NZ 3.47Å; E390-K393 VanDerWaalsContact OE2-CE 3.29Å; E390-K393 WeakPolarHBondContact OE2-CE 3.35Å; E390-K393 IonicContact OE2-NZ 2.63Å; E390-K393 PolarHBondContact OE2-NZ 2.87Å; K393-R395 VanDerWaalsContact C-N 3.32Å; K393-R395 PolarHBondContact O-N 3.12Å
394	G	86.8	Confident	92.4	Very high	94 Å²	94	50.2 Å²	50.2	97%	0.969	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-13.9	-178.7	0	0	0	0	0	115.9	L392	L392-G394 PolarHBondContact O-N 2.87Å
395	R	93.4	Very high	92.4	Very high	47 Å²	47	51.2 Å²	51.2	18%	0.177	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-3.7	172.7	69.3	173.4	-178.5	106.9	7.1	114.4	S391 L392 K393 H397 T412 R413 E414 D424	S391-R395 WeakPolarHBondContact O-CD 3.16Å; S391-R395 WeakPolarHBondContact O-CG 3.2Å; S391-R395 PolarHBondContact O-NE 3.09Å; S391-R395 PolarHBondContact OG-NH2 3.05Å; S391-R395 VanDerWaalsContact OG-NH2 3.1Å; L392-R395 PolarHBondContact O-N 2.91Å; L392-R395 VanDerWaalsContact O-N 3.1Å; K393-R395 VanDerWaalsContact C-N 3.32Å; K393-R395 PolarHBondContact O-N 3.12Å; R395-H397 PolarHBondContact O-N 2.85Å; R395-T412 HydrophobicContact CG-CG2 4.33Å; R395-T412 PolarHBondContact NH1-OG1 2.74Å; R395-T412 CarbonylContact O-C 3.42Å; R395-T412 WeakPolarHBondContact O-CA 3.44Å; R395-T412 WeakPolarHBondContact O-CB 3.28Å; R395-R413 PolarHBondContact O-N 2.87Å; R395-E414 IonicContact CZ-OE1 3.62Å; R395-E414 IonicContact NH1-OE1 2.89Å; R395-E414 PolarHBondContact NH1-OE1 2.88Å; R395-D424 IonicContact NH1-OD1 2.73Å
396	L	95.8	Very high	92.3	Very high	30 Å²	30	47.4 Å²	47.4	16%	0.157	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	125.1	177.8	-173.3	63.8	0	0	0	110.4	L364 L392 I399 I410	L364-L396 HydrophobicContact CG-CD2 4.12Å; L392-L396 WeakPolarHBondContact O-CB 3.45Å; L392-L396 PolarHBondContact O-N 3.36Å; L396-I399 HydrophobicContact CD1-CD1 4.05Å; L396-I399 HydrophobicContact CD1-CG1 3.72Å; L396-I399 HydrophobicContact CD2-CD1 3.83Å; L396-I399 HydrophobicContact CD2-CG1 4.12Å; L396-I399 HydrophobicContact CG-CG1 4.39Å; L396-I410 HydrophobicContact CD1-CG2 3.97Å
397	H	96	Very high	92.5	Very high	31 Å²	31	38.6 Å²	38.6	14%	0.144	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-56	171.8	-179.9	-76.5	0	0	0	110	R395 I411 R413	R395-H397 PolarHBondContact O-N 2.85Å; H397-I411 WeakPolarHBondContact CA-O 3.45Å; H397-I411 HydrophobicContact CB-CB 4.3Å; H397-I411 HydrophobicContact CB-CG2 3.99Å; H397-I411 VanDerWaalsContact CB-O 3.28Å; H397-I411 WeakPolarHBondContact CB-O 3.32Å; H397-I411 PolarHBondContact N-O 3.15Å; H397-R413 HydrophobicContact CB-CG 3.82Å; H397-R413 PolarHBondContact CD2-NH1 3.26Å; H397-R413 PolarHBondContact CD2-NH2 2.57Å; H397-R413 PolarHBondContact NE2-NH2 2.87Å; H397-R413 VanDerWaalsContact NE2-NH2 3.16Å
398	S	97.1	Very high	92.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	154.3	-177.1	52.9	0	0	0	0	110.8	Y361 Y400 I411	Y361-S398 CarbonylContact O-C 3.54Å; Y361-S398 VanDerWaalsContact O-CA 3.24Å; Y361-S398 WeakPolarHBondContact O-CA 3.43Å; S398-Y400 WeakPolarHBondContact OG-CE2 3.27Å; S398-I411 PolarHBondContact N-O 2.79Å; S398-I411 PolarHBondContact O-N 2.84Å
399	I	97.6	Very high	93.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127	172.1	-54.7	172.8	0	0	0	107.6	K360 Y361 L364 I367 L396 L401 A409 I410	K360-I399 CarbonylContact C-O 3.59Å; K360-I399 WeakPolarHBondContact CA-O 3.49Å; Y361-I399 PolarHBondContact N-O 2.86Å; Y361-I399 PolarHBondContact O-N 3.25Å; L364-I399 HydrophobicContact CD2-CD1 3.34Å; L364-I399 HydrophobicContact CG-CD1 4.2Å; I367-I399 HydrophobicContact CD1-CB 4.15Å; I367-I399 HydrophobicContact CD1-CD1 3.53Å; I367-I399 HydrophobicContact CD1-CG1 4.41Å; I367-I399 HydrophobicContact CD1-CG2 4.11Å; L396-I399 HydrophobicContact CD1-CD1 4.05Å; L396-I399 HydrophobicContact CD1-CG1 3.72Å; L396-I399 HydrophobicContact CD2-CD1 3.83Å; L396-I399 HydrophobicContact CD2-CG1 4.12Å; L396-I399 HydrophobicContact CG-CG1 4.39Å; I399-L401 HydrophobicContact CG2-CB 4.23Å; I399-A409 CarbonylContact C-O 3.51Å; I399-A409 WeakPolarHBondContact CA-O 3.37Å; I399-I410 HydrophobicContact CG2-CG1 4.4Å
400	Y	96.5	Very high	93.3	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.8	168	-61.8	-99.3	0	0	0	106.7	I358 H359 K360 S398 A408 A409 I411 C444 I445 D448	I358-Y400 HydrophobicContact CG2-CD1 4.48Å; H359-Y400 CarbonylContact O-C 3.58Å; H359-Y400 WeakPolarHBondContact O-CA 3.35Å; K360-Y400 HydrophobicContact CB-CD1 4.37Å; K360-Y400 HydrophobicContact CB-CE1 4.28Å; K360-Y400 HydrophobicContact CD-CE1 4.14Å; K360-Y400 HydrophobicContact CG-CE1 4.13Å; K360-Y400 PolarHBondContact NZ-OH 3.24Å; S398-Y400 WeakPolarHBondContact OG-CE2 3.27Å; Y400-A408 CarbonylContact O-C 3.55Å; Y400-A408 WeakPolarHBondContact O-CA 3.2Å; Y400-A409 PolarHBondContact N-O 3.33Å; Y400-A409 PolarHBondContact O-N 2.88Å; Y400-I411 HydrophobicContact CD2-CD1 3.98Å; Y400-I411 HydrophobicContact CD2-CG1 4.43Å; Y400-I411 HydrophobicContact CE2-CD1 3.5Å; Y400-I411 HydrophobicContact CE2-CG1 4.3Å; Y400-C444 HydrophobicContact CD1-CB 4.16Å; Y400-C444 HydrophobicContact CE1-CB 4.43Å; Y400-I445 HydrophobicContact CD1-CG1 4.31Å; Y400-I445 HydrophobicContact CD2-CG1 3.77Å; Y400-I445 HydrophobicContact CE1-CG1 4.47Å; Y400-I445 HydrophobicContact CE2-CG1 3.97Å; Y400-I445 HydrophobicContact CG-CG1 3.96Å; Y400-D448 HydrophobicContact CE1-CB 4.35Å; Y400-D448 WeakPolarHBondContact CE1-OD2 3.29Å; Y400-D448 WeakPolarHBondContact OH-CB 3.38Å; Y400-D448 PolarHBondContact OH-OD2 3.08Å
401	L	95.4	Very high	93.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.4	-171.9	176.4	63.1	0	0	0	109.4	H359 Y361 I367 L372 I399 Y405 A408	H359-L401 PolarHBondContact N-O 3.34Å; H359-L401 PolarHBondContact O-N 3.23Å; Y361-L401 HydrophobicContact CD2-CB 4.25Å; Y361-L401 HydrophobicContact CE2-CB 3.99Å; Y361-L401 HydrophobicContact CE2-CD2 4.22Å; I367-L401 HydrophobicContact CD1-CD2 4.42Å; I367-L401 HydrophobicContact CG1-CD2 4.3Å; I367-L401 HydrophobicContact CG2-CD2 3.82Å; L372-L401 HydrophobicContact CD1-CD1 4.29Å; I399-L401 HydrophobicContact CG2-CB 4.23Å; L401-Y405 HydrophobicContact CD1-CD1 3.92Å; L401-Y405 HydrophobicContact CD1-CE1 4.19Å; L401-Y405 HydrophobicContact CD1-CG 4.22Å; L401-Y405 HydrophobicContact CD2-CD1 4.25Å; L401-Y405 HydrophobicContact CD2-CE1 3.67Å; L401-Y405 HydrophobicContact CD2-CE2 4.24Å; L401-Y405 HydrophobicContact CG-CE1 4.42Å; L401-A408 HydrophobicContact CD1-CB 3.8Å
402	S	92.4	Very high	93.9	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	139.8	172.3	65.7	0	0	0	0	110.5	D356 P357 G404 Y405 S406 A407	D356-S402 VanDerWaalsContact OD2-CB 3.29Å; D356-S402 WeakPolarHBondContact OD2-CB 3.37Å; D356-S402 PolarHBondContact OD2-OG 3.41Å; P357-S402 CarbonylContact O-C 3.49Å; P357-S402 VanDerWaalsContact O-CA 3.25Å; P357-S402 WeakPolarHBondContact O-CA 3.33Å; S402-G404 VanDerWaalsContact C-N 3.25Å; S402-G404 PolarHBondContact O-N 3.07Å; S402-Y405 WeakPolarHBondContact O-CA 3.21Å; S402-Y405 PolarHBondContact O-N 2.87Å; S402-Y405 PolarHBondContact OG-N 2.75Å; S402-S406 PolarHBondContact OG-N 2.8Å; S402-S406 PolarHBondContact OG-OG 2.8Å; S402-A407 PolarHBondContact N-O 3.1Å; S402-A407 PolarHBondContact OG-N 2.71Å; S402-A407 PolarHBondContact OG-O 3.12Å; S402-A407 VanDerWaalsContact OG-O 3.07Å
403	E	89.1	Confident	93.9	Very high	118 Å²	118	32 Å²	32	55%	0.551	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-40.9	179.9	-171.6	178.5	-176.8	0	0	113	D356 P357 Y405	D356-E403 WeakPolarHBondContact OD1-CB 3.47Å; D356-E403 PolarHBondContact OD1-N 3.49Å; P357-E403 HydrophobicContact CB-CB 4.49Å; P357-E403 WeakPolarHBondContact CG-OE2 3.45Å; P357-E403 PolarHBondContact O-N 3.01Å; E403-Y405 VanDerWaalsContact C-N 3.29Å; E403-Y405 WeakPolarHBondContact O-CD2 3.38Å; E403-Y405 PolarHBondContact O-N 2.61Å
404	G	89.1	Confident	94	Very high	41 Å²	41	26.9 Å²	26.9	42%	0.423	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	0.7	176	0	0	0	0	0	115.8	D356 R371 S402 S406	D356-G404 VanDerWaalsContact CG-N 3.27Å; D356-G404 PolarHBondContact OD1-N 3Å; D356-G404 WeakPolarHBondContact OD2-CA 3.4Å; D356-G404 PolarHBondContact OD2-N 3.19Å; R371-G404 PolarHBondContact NH2-O 2.81Å; R371-G404 VanDerWaalsContact NH2-O 3.14Å; S402-G404 VanDerWaalsContact C-N 3.25Å; S402-G404 PolarHBondContact O-N 3.07Å; G404-S406 PolarHBondContact O-N 3.46Å
405	Y	92.3	Very high	93.9	Very high	33 Å²	33	28.1 Å²	28.1	13%	0.129	15%	0.146	C	C	.	.	S	Bend	trans	55.1	37.7	-173.1	-69	-115.1	0	0	0	112.4	I367 D368 R371 L372 L375 L401 S402 E403	I367-Y405 HydrophobicContact CG2-CE1 4.24Å; D368-Y405 HydrophobicContact CB-CE1 4.05Å; D368-Y405 WeakPolarHBondContact CB-OH 3.18Å; D368-Y405 PolarHBondContact N-OH 3.45Å; D368-Y405 VanDerWaalsContact O-CE1 3.27Å; D368-Y405 WeakPolarHBondContact O-CE1 3.16Å; R371-Y405 HydrophobicContact CB-CD1 3.4Å; R371-Y405 HydrophobicContact CB-CE1 3.7Å; R371-Y405 HydrophobicContact CB-CG 3.91Å; L372-Y405 HydrophobicContact CB-CD1 4.43Å; L372-Y405 HydrophobicContact CB-CE1 4.26Å; L375-Y405 WeakPolarHBondContact CD2-O 3.5Å; L401-Y405 HydrophobicContact CD1-CD1 3.92Å; L401-Y405 HydrophobicContact CD1-CE1 4.19Å; L401-Y405 HydrophobicContact CD1-CG 4.22Å; L401-Y405 HydrophobicContact CD2-CD1 4.25Å; L401-Y405 HydrophobicContact CD2-CE1 3.67Å; L401-Y405 HydrophobicContact CD2-CE2 4.24Å; L401-Y405 HydrophobicContact CG-CE1 4.42Å; S402-Y405 WeakPolarHBondContact O-CA 3.21Å; S402-Y405 PolarHBondContact O-N 2.87Å; S402-Y405 PolarHBondContact OG-N 2.75Å; E403-Y405 VanDerWaalsContact C-N 3.29Å; E403-Y405 WeakPolarHBondContact O-CD2 3.38Å; E403-Y405 PolarHBondContact O-N 2.61Å
406	S	89.4	Confident	93.4	Very high	14 Å²	14	27.2 Å²	27.2	10%	0.098	15%	0.145	C	C	.	.	S	Bend	trans	-91.7	-20	175.9	67.8	0	0	0	0	113.2	D356 S402 G404 S429	D356-S406 PolarHBondContact OD2-OG 3.5Å; S402-S406 PolarHBondContact OG-N 2.8Å; S402-S406 PolarHBondContact OG-OG 2.8Å; G404-S406 PolarHBondContact O-N 3.46Å; S406-S429 WeakPolarHBondContact O-CB 3.36Å; S406-S429 PolarHBondContact O-N 2.81Å
407	A	92.3	Very high	92.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	145.3	176.8	0	0	0	0	0	111.7	S402 V427 V428 T437 L441	S402-A407 PolarHBondContact N-O 3.1Å; S402-A407 PolarHBondContact OG-N 2.71Å; S402-A407 PolarHBondContact OG-O 3.12Å; S402-A407 VanDerWaalsContact OG-O 3.07Å; A407-V427 CarbonylContact C-O 3.54Å; A407-V427 VanDerWaalsContact CA-O 3.27Å; A407-V427 WeakPolarHBondContact CA-O 3.28Å; A407-V428 HydrophobicContact CB-CG2 4.06Å; A407-T437 HydrophobicContact CB-CG2 3.49Å; A407-T437 VanDerWaalsContact CB-CG2 3.49Å; A407-L441 HydrophobicContact CB-CD2 4.02Å
408	A	96.6	Very high	91.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.6	176.2	0	0	0	0	0	112.4	L372 L375 Y400 L401 V427	L372-A408 HydrophobicContact CD1-CB 3.69Å; L375-A408 HydrophobicContact CD2-CB 3.88Å; Y400-A408 CarbonylContact O-C 3.55Å; Y400-A408 WeakPolarHBondContact O-CA 3.2Å; L401-A408 HydrophobicContact CD1-CB 3.8Å; A408-V427 HydrophobicContact CB-CG2 3.73Å; A408-V427 PolarHBondContact N-O 3.37Å; A408-V427 WeakPolarHBondContact O-CG2 3.27Å; A408-V427 PolarHBondContact O-N 3.2Å
409	A	97.6	Very high	90.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.3	167.6	0	0	0	0	0	110.4	I399 Y400 L423 K425 F426 L441 I445	I399-A409 CarbonylContact C-O 3.51Å; I399-A409 WeakPolarHBondContact CA-O 3.37Å; Y400-A409 PolarHBondContact N-O 3.33Å; Y400-A409 PolarHBondContact O-N 2.88Å; A409-L423 HydrophobicContact CB-CD1 3.9Å; A409-K425 CarbonylContact C-O 3.44Å; A409-K425 WeakPolarHBondContact CA-O 3.39Å; A409-F426 HydrophobicContact CB-CD2 4.03Å; A409-L441 HydrophobicContact CB-CD1 4.19Å; A409-L441 HydrophobicContact CB-CD2 4.12Å; A409-L441 HydrophobicContact CB-CG 4.3Å; A409-I445 HydrophobicContact CB-CD1 3.49Å; A409-I445 VanDerWaalsContact CB-CD1 3.49Å; A409-I445 HydrophobicContact CB-CG1 4.46Å
410	I	97.8	Very high	90.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.5	177.1	-58.7	175.8	0	0	0	107.8	L372 I376 Y388 L392 L396 I399 T412 D424 K425	L372-I410 HydrophobicContact CD2-CD1 4.4Å; I376-I410 HydrophobicContact CD1-CD1 3.87Å; Y388-I410 HydrophobicContact CE1-CD1 4.15Å; L392-I410 HydrophobicContact CD1-CD1 4.44Å; L392-I410 HydrophobicContact CD1-CG2 4.25Å; L392-I410 HydrophobicContact CD2-CG2 3.89Å; L396-I410 HydrophobicContact CD1-CG2 3.97Å; I399-I410 HydrophobicContact CG2-CG1 4.4Å; I410-T412 HydrophobicContact CG2-CG2 4.42Å; I410-D424 PolarHBondContact O-N 2.69Å; I410-K425 HydrophobicContact CB-CB 4.13Å; I410-K425 HydrophobicContact CD1-CB 4.21Å; I410-K425 HydrophobicContact CD1-CG 4.23Å; I410-K425 HydrophobicContact CG1-CB 4.25Å; I410-K425 PolarHBondContact N-O 3.44Å; I410-K425 PolarHBondContact O-N 3.36Å
411	I	97.9	Very high	90.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.5	-179.3	-51.8	-171.8	0	0	0	108.8	H397 S398 Y400 P421 Y422 L423 I445 L449 L452	H397-I411 WeakPolarHBondContact CA-O 3.45Å; H397-I411 HydrophobicContact CB-CB 4.3Å; H397-I411 HydrophobicContact CB-CG2 3.99Å; H397-I411 VanDerWaalsContact CB-O 3.28Å; H397-I411 WeakPolarHBondContact CB-O 3.32Å; H397-I411 PolarHBondContact N-O 3.15Å; S398-I411 PolarHBondContact N-O 2.79Å; S398-I411 PolarHBondContact O-N 2.84Å; Y400-I411 HydrophobicContact CD2-CD1 3.98Å; Y400-I411 HydrophobicContact CD2-CG1 4.43Å; Y400-I411 HydrophobicContact CE2-CD1 3.5Å; Y400-I411 HydrophobicContact CE2-CG1 4.3Å; I411-P421 HydrophobicContact CG2-CB 3.56Å; I411-Y422 CarbonylContact C-O 3.51Å; I411-Y422 VanDerWaalsContact CA-O 3.29Å; I411-Y422 WeakPolarHBondContact CA-O 3.4Å; I411-Y422 WeakPolarHBondContact CG2-O 3.36Å; I411-L423 HydrophobicContact CG1-CD1 4.12Å; I411-I445 HydrophobicContact CD1-CG1 4.36Å; I411-I445 HydrophobicContact CD1-CG2 3.87Å; I411-L449 HydrophobicContact CD1-CD1 3.41Å; I411-L449 VanDerWaalsContact CD1-CD1 3.41Å; I411-L449 HydrophobicContact CG2-CD1 4.22Å; I411-L452 HydrophobicContact CD1-CD1 4.24Å; I411-L452 HydrophobicContact CG2-CD1 4.06Å
412	T	96.4	Very high	90.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.1	-176.6	57.8	0	0	0	0	111.7	L392 R395 I410 E414 Y422 D424	L392-T412 HydrophobicContact CD2-CG2 3.75Å; R395-T412 HydrophobicContact CG-CG2 4.33Å; R395-T412 PolarHBondContact NH1-OG1 2.74Å; R395-T412 CarbonylContact O-C 3.42Å; R395-T412 WeakPolarHBondContact O-CA 3.44Å; R395-T412 WeakPolarHBondContact O-CB 3.28Å; I410-T412 HydrophobicContact CG2-CG2 4.42Å; T412-E414 VanDerWaalsContact CB-OE1 3.24Å; T412-E414 WeakPolarHBondContact CB-OE1 3.29Å; T412-E414 PolarHBondContact OG1-OE1 3.19Å; T412-Y422 PolarHBondContact N-O 3.2Å; T412-Y422 PolarHBondContact O-N 3.05Å; T412-D424 HydrophobicContact CG2-CB 4.2Å
413	R	94.3	Very high	90.9	Very high	128 Å²	128	35.3 Å²	35.3	48%	0.483	20%	0.199	S	C	.	.			trans	-92.6	110.6	170.7	-61.7	-175.3	-175	-84.1	-3.9	107.6	R395 H397	R395-R413 PolarHBondContact O-N 2.87Å; H397-R413 HydrophobicContact CB-CG 3.82Å; H397-R413 PolarHBondContact CD2-NH1 3.26Å; H397-R413 PolarHBondContact CD2-NH2 2.57Å; H397-R413 PolarHBondContact NE2-NH2 2.87Å; H397-R413 VanDerWaalsContact NE2-NH2 3.16Å
414	E	90.9	Very high	91.3	Very high	22 Å²	22	30.4 Å²	30.4	10%	0.103	18%	0.176	C	C	.	.			trans	-102.5	148.6	-180	-59.2	-57.9	161.2	0	0	110.1	R395 T412 L416 Y422 Y498	R395-E414 IonicContact CZ-OE1 3.62Å; R395-E414 IonicContact NH1-OE1 2.89Å; R395-E414 PolarHBondContact NH1-OE1 2.88Å; T412-E414 VanDerWaalsContact CB-OE1 3.24Å; T412-E414 WeakPolarHBondContact CB-OE1 3.29Å; T412-E414 PolarHBondContact OG1-OE1 3.19Å; E414-L416 HydrophobicContact CB-CD1 4.31Å; E414-L416 HydrophobicContact CB-CG 4.46Å; E414-L416 PolarHBondContact O-N 2.85Å; E414-Y422 HydrophobicContact CG-CD1 4.21Å; E414-Y422 HydrophobicContact CG-CG 4.1Å; E414-Y498 HydrophobicContact CB-CE1 3.86Å; E414-Y498 HydrophobicContact CB-CE2 3.95Å; E414-Y498 HydrophobicContact CG-CE1 3.7Å; E414-Y498 HydrophobicContact CG-CE2 4.41Å; E414-Y498 WeakPolarHBondContact CG-OH 3.27Å; E414-Y498 PolarHBondContact OE2-OH 3.15Å
415	P	84.2	Confident	91.6	Very high	119 Å²	119	28.9 Å²	28.9	77%	0.773	16%	0.158	S	C	*	.	S	Bend	trans	-74.3	72.6	-173	31.1	-36.3	0	0	0	111.5
416	L	82.1	Confident	91.8	Very high	28 Å²	28	28 Å²	28	15%	0.147	16%	0.155	C	C	.	.			trans	-115.9	143.6	-179.2	-69.9	169.2	0	0	0	109.7	E414 S418 D419 F453 Q494 L495 Y498	E414-L416 HydrophobicContact CB-CD1 4.31Å; E414-L416 HydrophobicContact CB-CG 4.46Å; E414-L416 PolarHBondContact O-N 2.85Å; L416-S418 PolarHBondContact O-N 3.12Å; L416-D419 PolarHBondContact O-N 2.98Å; L416-F453 HydrophobicContact CD1-CE1 3.52Å; L416-F453 HydrophobicContact CD1-CE2 4.39Å; L416-F453 HydrophobicContact CD1-CZ 3.43Å; L416-F453 VanDerWaalsContact CD1-CZ 3.43Å; L416-Q494 HydrophobicContact CD2-CB 4.44Å; L416-L495 HydrophobicContact CD1-CD2 3.7Å; L416-Y498 HydrophobicContact CD1-CG 4.46Å; L416-Y498 HydrophobicContact CD2-CD2 4.25Å; L416-Y498 HydrophobicContact CD2-CG 3.98Å; L416-Y498 HydrophobicContact CG-CG 4.38Å
417	S	74.6	Confident	92	Very high	100 Å²	100	27.5 Å²	27.5	70%	0.699	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.7	175.5	42	0	0	0	0	113.7	Q494	S417-Q494 PolarHBondContact OG-NE2 3.12Å; S417-Q494 PolarHBondContact OG-OE1 3.47Å
418	S	74.8	Confident	91.8	Very high	11 Å²	11	28.1 Å²	28.1	8%	0.077	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-3.3	-178.8	53.6	0	0	0	0	114.5	L416 T420 K451	L416-S418 PolarHBondContact O-N 3.12Å; S418-T420 PolarHBondContact O-N 3.27Å; S418-T420 PolarHBondContact O-OG1 3.13Å; S418-T420 PolarHBondContact OG-OG1 2.89Å; S418-K451 PolarHBondContact O-NZ 2.99Å
419	D	86.6	Confident	91.2	Very high	102 Å²	102	28.7 Å²	28.7	55%	0.545	16%	0.159	S	C	.	.			trans	44.4	33.7	-174.3	-167.5	40.7	0	0	0	113.2	L416 P421 K451	L416-D419 PolarHBondContact O-N 2.98Å; D419-P421 WeakPolarHBondContact O-CD 3.41Å; D419-K451 WeakPolarHBondContact O-CE 3.41Å; D419-K451 PolarHBondContact O-NZ 2.82Å
420	T	93.6	Very high	90	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	18%	0.183	C	C	.	.			trans	-86.5	120.2	178.7	-56.3	0	0	0	0	108.2	S418 K451 F453 L486	S418-T420 PolarHBondContact O-N 3.27Å; S418-T420 PolarHBondContact O-OG1 3.13Å; S418-T420 PolarHBondContact OG-OG1 2.89Å; T420-K451 HydrophobicContact CG2-CB 4.28Å; T420-K451 HydrophobicContact CG2-CD 4.28Å; T420-K451 HydrophobicContact CG2-CG 4.11Å; T420-F453 HydrophobicContact CG2-CB 4.43Å; T420-F453 HydrophobicContact CG2-CD1 3.79Å; T420-F453 VanDerWaalsContact O-CE1 3.31Å; T420-F453 WeakPolarHBondContact O-CE1 3.4Å; T420-L486 HydrophobicContact CG2-CD2 4.26Å
421	P	96.1	Very high	88.5	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.071	21%	0.212	C	C	.	.			trans	-63.3	148.3	178	-20.5	32	0	0	0	112.2	I411 D419 L449 L452 F453	I411-P421 HydrophobicContact CG2-CB 3.56Å; D419-P421 WeakPolarHBondContact O-CD 3.41Å; P421-L449 HydrophobicContact CB-CD1 4.48Å; P421-L452 HydrophobicContact CB-CD1 4.1Å; P421-L452 WeakPolarHBondContact O-CD1 3.4Å; P421-F453 WeakPolarHBondContact O-CD1 3.24Å; P421-F453 PolarHBondContact O-N 3.27Å; P421-F453 VanDerWaalsContact O-N 3.12Å
422	Y	96.9	Very high	86.8	Confident	6 Å²	6	38.5 Å²	38.5	2%	0.024	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.3	178.7	179.3	-114.3	0	0	0	110.9	I411 T412 E414 D424 F453 R455	I411-Y422 CarbonylContact C-O 3.51Å; I411-Y422 VanDerWaalsContact CA-O 3.29Å; I411-Y422 WeakPolarHBondContact CA-O 3.4Å; I411-Y422 WeakPolarHBondContact CG2-O 3.36Å; T412-Y422 PolarHBondContact N-O 3.2Å; T412-Y422 PolarHBondContact O-N 3.05Å; E414-Y422 HydrophobicContact CG-CD1 4.21Å; E414-Y422 HydrophobicContact CG-CG 4.1Å; Y422-D424 HydrophobicContact CD1-CB 3.96Å; Y422-D424 HydrophobicContact CE1-CB 3.89Å; Y422-D424 PolarHBondContact O-N 2.68Å; Y422-F453 WeakPolarHBondContact CA-O 3.42Å; Y422-F453 HydrophobicContact CD2-CD1 4.32Å; Y422-F453 AromaticContact CD2-CD2 3.81Å; Y422-F453 HydrophobicContact CD2-CD2 3.81Å; Y422-F453 AromaticContact CD2-CE1 3.9Å; Y422-F453 HydrophobicContact CD2-CE1 3.9Å; Y422-F453 AromaticContact CD2-CE2 3.36Å; Y422-F453 HydrophobicContact CD2-CE2 3.36Å; Y422-F453 HydrophobicContact CD2-CG 4.27Å; Y422-F453 AromaticContact CD2-CZ 3.4Å; Y422-F453 HydrophobicContact CD2-CZ 3.4Å; Y422-F453 WeakPolarHBondContact CD2-O 3.43Å; Y422-F453 HydrophobicContact CE2-CD2 4.36Å; Y422-F453 AromaticContact CE2-CE2 3.96Å; Y422-F453 HydrophobicContact CE2-CE2 3.96Å; Y422-F453 HydrophobicContact CE2-CZ 4.36Å; Y422-F453 HydrophobicContact CG-CE1 4.17Å; Y422-F453 HydrophobicContact CG-CE2 4.28Å; Y422-F453 AromaticContact CG-CZ 3.86Å; Y422-F453 HydrophobicContact CG-CZ 3.86Å; Y422-R455 WeakPolarHBondContact OH-CG 3.28Å; Y422-R455 PolarHBondContact OH-NE 2.93Å
423	L	97.4	Very high	85.1	Confident	7 Å²	7	44.6 Å²	44.6	4%	0.037	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	102.8	170.6	177.2	67.5	0	0	0	109.4	A409 I411 K425 F426 W442 L452 F453 W454	A409-L423 HydrophobicContact CB-CD1 3.9Å; I411-L423 HydrophobicContact CG1-CD1 4.12Å; L423-K425 VanDerWaalsContact CD1-O 3.32Å; L423-K425 WeakPolarHBondContact CD1-O 3.49Å; L423-F426 HydrophobicContact CD1-CB 4.24Å; L423-F426 HydrophobicContact CD1-CD2 4.37Å; L423-F426 HydrophobicContact CD2-CB 3.96Å; L423-F426 HydrophobicContact CD2-CD2 4.15Å; L423-F426 HydrophobicContact CD2-CG 4.35Å; L423-F426 HydrophobicContact CG-CB 4.22Å; L423-W442 HydrophobicContact CD2-CZ3 3.84Å; L423-L452 HydrophobicContact CB-CD1 4.23Å; L423-L452 HydrophobicContact CB-CD2 4.08Å; L423-L452 HydrophobicContact CB-CG 4.25Å; L423-L452 HydrophobicContact CD2-CD2 4.26Å; L423-F453 PolarHBondContact N-O 3.09Å; L423-W454 HydrophobicContact CB-CB 3.78Å; L423-W454 HydrophobicContact CD2-CB 4.14Å; L423-W454 HydrophobicContact CD2-CG 4.27Å; L423-W454 HydrophobicContact CG-CB 4.36Å
424	D	96.1	Very high	83.4	Confident	15 Å²	15	42.5 Å²	42.5	8%	0.08	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-39.1	-174.4	-174.4	87.4	0	0	0	112.6	Y388 R395 I410 T412 Y422	Y388-D424 WeakPolarHBondContact CE2-OD2 3.37Å; Y388-D424 VanDerWaalsContact CZ-OD2 3.28Å; Y388-D424 PolarHBondContact OH-OD2 3.42Å; R395-D424 IonicContact NH1-OD1 2.73Å; I410-D424 PolarHBondContact O-N 2.69Å; T412-D424 HydrophobicContact CG2-CB 4.2Å; Y422-D424 HydrophobicContact CD1-CB 3.96Å; Y422-D424 HydrophobicContact CE1-CB 3.89Å; Y422-D424 PolarHBondContact O-N 2.68Å
425	K	96	Very high	82.1	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	137.7	173.6	-61.8	-67.7	167.3	-68.7	0	110	I376 F380 Y388 A409 I410 L423 S505 F506	I376-K425 HydrophobicContact CG2-CD 4.13Å; F380-K425 HydrophobicContact CE2-CD 3.84Å; F380-K425 HydrophobicContact CZ-CD 4.32Å; Y388-K425 VanDerWaalsContact OH-CG 3.24Å; Y388-K425 WeakPolarHBondContact OH-CG 3.23Å; A409-K425 CarbonylContact C-O 3.44Å; A409-K425 WeakPolarHBondContact CA-O 3.39Å; I410-K425 HydrophobicContact CB-CB 4.13Å; I410-K425 HydrophobicContact CD1-CB 4.21Å; I410-K425 HydrophobicContact CD1-CG 4.23Å; I410-K425 HydrophobicContact CG1-CB 4.25Å; I410-K425 PolarHBondContact N-O 3.44Å; I410-K425 PolarHBondContact O-N 3.36Å; L423-K425 VanDerWaalsContact CD1-O 3.32Å; L423-K425 WeakPolarHBondContact CD1-O 3.49Å; K425-S505 PolarHBondContact NZ-OG 3.33Å; K425-F506 HydrophobicContact CD-CZ 4.37Å
426	F	95.8	Very high	81.4	Confident	16 Å²	16	39.2 Å²	39.2	7%	0.07	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	109.5	169.4	-173.9	-91.8	0	0	0	106.9	A409 L423 V428 L441 W442 I445 I462 W465	A409-F426 HydrophobicContact CB-CD2 4.03Å; L423-F426 HydrophobicContact CD1-CB 4.24Å; L423-F426 HydrophobicContact CD1-CD2 4.37Å; L423-F426 HydrophobicContact CD2-CB 3.96Å; L423-F426 HydrophobicContact CD2-CD2 4.15Å; L423-F426 HydrophobicContact CD2-CG 4.35Å; L423-F426 HydrophobicContact CG-CB 4.22Å; F426-V428 HydrophobicContact CE1-CG2 4.44Å; F426-L441 HydrophobicContact CD2-CD2 4.11Å; F426-L441 HydrophobicContact CE2-CB 4.42Å; F426-L441 HydrophobicContact CE2-CD2 3.65Å; F426-L441 HydrophobicContact CE2-CG 3.86Å; F426-L441 HydrophobicContact CZ-CD2 4.07Å; F426-L441 HydrophobicContact CZ-CG 4.41Å; F426-W442 HydrophobicContact CD2-CE3 4.48Å; F426-W442 AromaticContact CE2-CE3 4Å; F426-W442 HydrophobicContact CE2-CE3 4Å; F426-I445 HydrophobicContact CD2-CD1 4.29Å; F426-I445 HydrophobicContact CE2-CD1 4.14Å; F426-I462 HydrophobicContact CD1-CD1 4.33Å; F426-I462 HydrophobicContact CE1-CD1 4.29Å; F426-W465 HydrophobicContact CE1-CH2 4.46Å; F426-W465 HydrophobicContact CE1-CZ3 4.36Å; F426-W465 HydrophobicContact CZ-CH2 4.13Å; F426-W465 HydrophobicContact CZ-CZ3 4.42Å
427	V	93.4	Very high	81.3	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.4	-170.7	-65.8	0	0	0	0	110.9	L375 I376 F380 A407 A408	L375-V427 HydrophobicContact CD2-CG2 3.84Å; L375-V427 HydrophobicContact CG-CG2 3.93Å; I376-V427 HydrophobicContact CB-CG1 4.45Å; I376-V427 HydrophobicContact CG1-CG1 4.23Å; I376-V427 HydrophobicContact CG1-CG2 3.95Å; I376-V427 HydrophobicContact CG2-CG1 4.28Å; F380-V427 HydrophobicContact CD2-CG1 3.72Å; F380-V427 HydrophobicContact CE2-CG1 3.18Å; F380-V427 HydrophobicContact CZ-CG1 4.02Å; A407-V427 CarbonylContact C-O 3.54Å; A407-V427 VanDerWaalsContact CA-O 3.27Å; A407-V427 WeakPolarHBondContact CA-O 3.28Å; A408-V427 HydrophobicContact CB-CG2 3.73Å; A408-V427 PolarHBondContact N-O 3.37Å; A408-V427 WeakPolarHBondContact O-CG2 3.27Å; A408-V427 PolarHBondContact O-N 3.2Å
428	V	88.9	Confident	81.6	Confident	13 Å²	13	35 Å²	35	8%	0.079	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.3	171.7	-178.8	0	0	0	0	107	S379 A407 F426 K432 Q433 T437	S379-V428 PolarHBondContact OG-O 2.82Å; A407-V428 HydrophobicContact CB-CG2 4.06Å; F426-V428 HydrophobicContact CE1-CG2 4.44Å; V428-K432 HydrophobicContact CG1-CB 4.27Å; V428-Q433 HydrophobicContact CG1-CG 4.46Å; V428-T437 HydrophobicContact CG1-CG2 4.02Å
429	S	84.1	Confident	82	Confident	12 Å²	12	36.8 Å²	36.8	8%	0.084	23%	0.231	C	C	.	.			trans	-57.1	138.9	176.5	175.9	0	0	0	0	110.2	S406 S431 K432 Q433	S406-S429 WeakPolarHBondContact O-CB 3.36Å; S406-S429 PolarHBondContact O-N 2.81Å; S429-S431 PolarHBondContact O-N 2.9Å; S429-S431 PolarHBondContact OG-N 2.78Å; S429-S431 PolarHBondContact OG-OG 2.86Å; S429-K432 CarbonylContact O-C 3.46Å; S429-K432 PolarHBondContact O-N 3.16Å; S429-Q433 PolarHBondContact O-N 3.21Å
430	S	72.8	Confident	81.8	Confident	71 Å²	71	32.6 Å²	32.6	50%	0.497	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-57.8	-29.8	176.6	53.7	0	0	0	0	113.2	K432 Q433	S430-K432 PolarHBondContact O-N 3.4Å; S430-Q433 PolarHBondContact O-N 3.24Å
431	S	65.3	Low	81.6	Confident	89 Å²	89	32.5 Å²	32.5	62%	0.622	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-67.2	-20.2	175	59.2	0	0	0	0	113.9	S429	S429-S431 PolarHBondContact O-N 2.9Å; S429-S431 PolarHBondContact OG-N 2.78Å; S429-S431 PolarHBondContact OG-OG 2.86Å
432	K	62.6	Low	81.4	Confident	45 Å²	45	32 Å²	32	20%	0.196	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-112.6	7.5	-179.1	-67.8	-58.8	-170.3	177.1	0	112.8	C326 V428 S429 S430 G434 E435 T437	C326-K432 PolarHBondContact SG-NZ 3.15Å; V428-K432 HydrophobicContact CG1-CB 4.27Å; S429-K432 CarbonylContact O-C 3.46Å; S429-K432 PolarHBondContact O-N 3.16Å; S430-K432 PolarHBondContact O-N 3.4Å; K432-G434 PolarHBondContact O-N 3.08Å; K432-E435 WeakPolarHBondContact CD-OE1 3.42Å; K432-E435 WeakPolarHBondContact CE-OE1 3.47Å; K432-E435 IonicContact NZ-OE1 3.13Å; K432-E435 PolarHBondContact NZ-OE1 3.12Å; K432-E435 IonicContact NZ-OE2 3.47Å; K432-E435 PolarHBondContact NZ-OE2 3.25Å; K432-E435 WeakPolarHBondContact O-CB 3.12Å; K432-T437 PolarHBondContact O-OG1 2.63Å
433	Q	60	Low	80.9	Confident	128 Å²	128	34.1 Å²	34.1	60%	0.598	21%	0.214	S	C	*	.	B	Isolated β-bridge	trans	-73.7	125.8	175.2	-74.9	176.8	3.3	0	0	110.4	V428 S429 S430 E435	V428-Q433 HydrophobicContact CG1-CG 4.46Å; S429-Q433 PolarHBondContact O-N 3.21Å; S430-Q433 PolarHBondContact O-N 3.24Å; Q433-E435 VanDerWaalsContact C-N 3.26Å; Q433-E435 PolarHBondContact O-N 2.9Å
434	G	59.6	Low	80.5	Confident	85 Å²	85	35.3 Å²	35.3	88%	0.876	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.2	-17.2	-179	0	0	0	0	0	113.8	K432	K432-G434 PolarHBondContact O-N 3.08Å
435	E	62.8	Low	80.4	Confident	42 Å²	42	34.6 Å²	34.6	20%	0.196	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	142.6	134.8	-75.8	-179.3	-110.2	0	0	107.5	K353 K432 Q433 T437	K353-E435 WeakPolarHBondContact CE-OE2 3.29Å; K353-E435 IonicContact NZ-OE2 3.36Å; K353-E435 PolarHBondContact NZ-OE2 3.48Å; K432-E435 WeakPolarHBondContact CD-OE1 3.42Å; K432-E435 WeakPolarHBondContact CE-OE1 3.47Å; K432-E435 IonicContact NZ-OE1 3.13Å; K432-E435 PolarHBondContact NZ-OE1 3.12Å; K432-E435 IonicContact NZ-OE2 3.47Å; K432-E435 PolarHBondContact NZ-OE2 3.25Å; K432-E435 WeakPolarHBondContact O-CB 3.12Å; Q433-E435 VanDerWaalsContact C-N 3.26Å; Q433-E435 PolarHBondContact O-N 2.9Å; E435-T437 PolarHBondContact O-N 3.25Å
436	G	70.8	Confident	80.2	Confident	30 Å²	30	39 Å²	39	31%	0.309	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-71	19.2	-177	0	0	0	0	0	115.2	S438 Q439 I440	G436-S438 VanDerWaalsContact C-N 3.25Å; G436-S438 PolarHBondContact O-N 3.35Å; G436-Q439 WeakPolarHBondContact O-CA 3.44Å; G436-Q439 VanDerWaalsContact O-CB 3.23Å; G436-Q439 WeakPolarHBondContact O-CB 3.48Å; G436-Q439 PolarHBondContact O-N 3.04Å; G436-I440 PolarHBondContact O-N 2.72Å; G436-I440 VanDerWaalsContact O-N 3.08Å
437	T	78.5	Confident	79.8	Confident	10 Å²	10	44.7 Å²	44.7	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-26.1	-174.5	11.2	0	0	0	0	113	A407 V428 K432 E435 Q439 I440 L441	A407-T437 HydrophobicContact CB-CG2 3.49Å; A407-T437 VanDerWaalsContact CB-CG2 3.49Å; V428-T437 HydrophobicContact CG1-CG2 4.02Å; K432-T437 PolarHBondContact O-OG1 2.63Å; E435-T437 PolarHBondContact O-N 3.25Å; T437-Q439 VanDerWaalsContact C-N 3.28Å; T437-Q439 PolarHBondContact O-N 3.19Å; T437-I440 PolarHBondContact O-N 2.65Å; T437-L441 WeakPolarHBondContact O-CB 3.4Å; T437-L441 PolarHBondContact O-N 3.1Å
438	S	82.5	Confident	79.7	Confident	30 Å²	30	48.2 Å²	48.2	21%	0.21	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-37	167.8	59.5	0	0	0	0	112.6	G436 W442	G436-S438 VanDerWaalsContact C-N 3.25Å; G436-S438 PolarHBondContact O-N 3.35Å; S438-W442 VanDerWaalsContact O-CB 3.27Å; S438-W442 WeakPolarHBondContact O-CB 2.84Å; S438-W442 PolarHBondContact O-N 3.48Å
439	Q	81.9	Confident	79.9	Confident	48 Å²	48	48.4 Å²	48.4	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-69.9	-46.5	178.4	-175.5	64	25.4	0	0	110.4	L290 G436 T437 L441 W442 E443 H469	L290-Q439 HydrophobicContact CD2-CG 4.04Å; G436-Q439 WeakPolarHBondContact O-CA 3.44Å; G436-Q439 VanDerWaalsContact O-CB 3.23Å; G436-Q439 WeakPolarHBondContact O-CB 3.48Å; G436-Q439 PolarHBondContact O-N 3.04Å; T437-Q439 VanDerWaalsContact C-N 3.28Å; T437-Q439 PolarHBondContact O-N 3.19Å; Q439-L441 PolarHBondContact O-N 3.27Å; Q439-W442 PolarHBondContact O-N 2.87Å; Q439-E443 WeakPolarHBondContact CG-OE1 3.23Å; Q439-E443 PolarHBondContact NE2-OE1 2.91Å; Q439-E443 WeakPolarHBondContact O-CB 3.38Å; Q439-E443 WeakPolarHBondContact O-CG 3.29Å; Q439-E443 PolarHBondContact O-N 2.89Å; Q439-H469 PolarHBondContact OE1-CE1 3.5Å; Q439-H469 PolarHBondContact OE1-NE2 3.26Å
440	I	83	Confident	80.2	Confident	14 Å²	14	51 Å²	51	7%	0.072	31%	0.311	C	S	.	.	H	α-helix	trans	-57.4	-50.4	176.8	-56.2	179.8	0	0	0	110.4	L290 S292 I358 G436 T437 W442 E443 C444	L290-I440 HydrophobicContact CD2-CG1 4.47Å; S292-I440 WeakPolarHBondContact OG-CG1 3.27Å; I358-I440 HydrophobicContact CD1-CB 4.3Å; I358-I440 HydrophobicContact CD1-CG2 3.73Å; I358-I440 HydrophobicContact CG1-CG2 4.44Å; G436-I440 PolarHBondContact O-N 2.72Å; G436-I440 VanDerWaalsContact O-N 3.08Å; T437-I440 PolarHBondContact O-N 2.65Å; I440-W442 VanDerWaalsContact C-N 3.3Å; I440-W442 PolarHBondContact O-N 3.21Å; I440-E443 PolarHBondContact O-N 2.9Å; I440-C444 PolarHBondContact O-N 3.36Å; I440-C444 VanDerWaalsContact O-N 3.08Å; I440-C444 PolarHBondContact O-SG 2.92Å; I440-C444 VanDerWaalsContact O-SG 3.33Å
441	L	89.7	Confident	81.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-42	177.8	179.4	62.9	0	0	0	112.2	I358 A407 A409 F426 T437 Q439 I445	I358-L441 HydrophobicContact CD1-CB 3.73Å; I358-L441 HydrophobicContact CD1-CD1 3.94Å; I358-L441 HydrophobicContact CD1-CG 4.46Å; I358-L441 HydrophobicContact CG2-CD1 3.94Å; A407-L441 HydrophobicContact CB-CD2 4.02Å; A409-L441 HydrophobicContact CB-CD1 4.19Å; A409-L441 HydrophobicContact CB-CD2 4.12Å; A409-L441 HydrophobicContact CB-CG 4.3Å; F426-L441 HydrophobicContact CD2-CD2 4.11Å; F426-L441 HydrophobicContact CE2-CB 4.42Å; F426-L441 HydrophobicContact CE2-CD2 3.65Å; F426-L441 HydrophobicContact CE2-CG 3.86Å; F426-L441 HydrophobicContact CZ-CD2 4.07Å; F426-L441 HydrophobicContact CZ-CG 4.41Å; T437-L441 WeakPolarHBondContact O-CB 3.4Å; T437-L441 PolarHBondContact O-N 3.1Å; Q439-L441 PolarHBondContact O-N 3.27Å; L441-I445 HydrophobicContact CG-CD1 4.28Å; L441-I445 WeakPolarHBondContact O-CD1 3.43Å; L441-I445 VanDerWaalsContact O-CG1 3.28Å; L441-I445 WeakPolarHBondContact O-CG1 3.28Å; L441-I445 PolarHBondContact O-N 3.15Å
442	W	91.1	Very high	82.8	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-37.5	178.8	-174.3	-103.4	0	0	0	113.5	L423 F426 S438 Q439 I440 I445 R446 L452 W454 W465 H469 F484	L423-W442 HydrophobicContact CD2-CZ3 3.84Å; F426-W442 HydrophobicContact CD2-CE3 4.48Å; F426-W442 AromaticContact CE2-CE3 4Å; F426-W442 HydrophobicContact CE2-CE3 4Å; S438-W442 VanDerWaalsContact O-CB 3.27Å; S438-W442 WeakPolarHBondContact O-CB 2.84Å; S438-W442 PolarHBondContact O-N 3.48Å; Q439-W442 PolarHBondContact O-N 2.87Å; I440-W442 VanDerWaalsContact C-N 3.3Å; I440-W442 PolarHBondContact O-N 3.21Å; W442-I445 HydrophobicContact CE3-CD1 4.48Å; W442-I445 PolarHBondContact O-N 2.85Å; W442-R446 VanDerWaalsContact NE1-NE 3.16Å; W442-R446 PolarHBondContact O-N 3.33Å; W442-L452 HydrophobicContact CH2-CD2 4.04Å; W442-L452 HydrophobicContact CZ3-CD2 4.1Å; W442-W454 HydrophobicContact CH2-CD2 4.48Å; W442-W454 HydrophobicContact CH2-CE3 4.11Å; W442-W454 AromaticContact CH2-CH2 3.59Å; W442-W454 HydrophobicContact CH2-CH2 3.59Å; W442-W454 AromaticContact CH2-CZ2 3.94Å; W442-W454 HydrophobicContact CH2-CZ2 3.94Å; W442-W454 AromaticContact CH2-CZ3 3.69Å; W442-W454 HydrophobicContact CH2-CZ3 3.69Å; W442-W454 AromaticContact CZ2-CH2 3.93Å; W442-W454 HydrophobicContact CZ2-CH2 3.93Å; W442-W454 HydrophobicContact CZ2-CZ2 4.46Å; W442-W454 HydrophobicContact CZ2-CZ3 4.27Å; W442-W465 HydrophobicContact CB-CH2 3.64Å; W442-W465 HydrophobicContact CB-CZ2 3.97Å; W442-W465 AromaticContact CD2-CH2 3.64Å; W442-W465 HydrophobicContact CD2-CH2 3.64Å; W442-W465 HydrophobicContact CD2-CZ3 4.28Å; W442-W465 AromaticContact CE3-CH2 3.93Å; W442-W465 HydrophobicContact CE3-CH2 3.93Å; W442-W465 HydrophobicContact CE3-CZ3 4.27Å; W442-W465 AromaticContact CG-CH2 3.5Å; W442-W465 HydrophobicContact CG-CH2 3.5Å; W442-W465 VanDerWaalsContact CG-CH2 3.5Å; W442-W465 HydrophobicContact CG-CZ2 4.04Å; W442-H469 AromaticContact CD1-ND1 3.69Å; W442-H469 HydrophobicContact CZ2-CB 3.97Å; W442-H469 AromaticContact NE1-CG 3.73Å; W442-H469 AromaticContact NE1-ND1 3.57Å; W442-F484 HydrophobicContact CH2-CD1 4.06Å; W442-F484 AromaticContact CH2-CE1 3.7Å; W442-F484 HydrophobicContact CH2-CE1 3.7Å; W442-F484 AromaticContact CZ2-CD1 3.69Å; W442-F484 HydrophobicContact CZ2-CD1 3.69Å; W442-F484 AromaticContact CZ2-CE1 3.48Å; W442-F484 HydrophobicContact CZ2-CE1 3.48Å; W442-F484 VanDerWaalsContact CZ2-CE1 3.48Å
443	E	86.8	Confident	84.4	Confident	49 Å²	49	44.4 Å²	44.4	23%	0.229	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-43.7	176.3	-77	171.3	-173.1	0	0	111.2	Q439 I440 I445 R446 Q447	Q439-E443 WeakPolarHBondContact CG-OE1 3.23Å; Q439-E443 PolarHBondContact NE2-OE1 2.91Å; Q439-E443 WeakPolarHBondContact O-CB 3.38Å; Q439-E443 WeakPolarHBondContact O-CG 3.29Å; Q439-E443 PolarHBondContact O-N 2.89Å; I440-E443 PolarHBondContact O-N 2.9Å; E443-I445 VanDerWaalsContact C-N 3.29Å; E443-I445 PolarHBondContact O-N 2.95Å; E443-R446 PolarHBondContact O-N 3.23Å; E443-Q447 WeakPolarHBondContact O-CB 3.35Å; E443-Q447 VanDerWaalsContact O-CG 3.28Å; E443-Q447 WeakPolarHBondContact O-CG 3.39Å; E443-Q447 PolarHBondContact O-N 3.38Å
444	C	88.6	Confident	86.2	Confident	32 Å²	32	38.4 Å²	38.4	22%	0.216	23%	0.234	C	C	.	.	H	α-helix	trans	-55.4	-45.8	171.9	-62.8	0	0	0	0	111.5	Y400 I440 R446 Q447 D448	Y400-C444 HydrophobicContact CD1-CB 4.16Å; Y400-C444 HydrophobicContact CE1-CB 4.43Å; I440-C444 PolarHBondContact O-N 3.36Å; I440-C444 VanDerWaalsContact O-N 3.08Å; I440-C444 PolarHBondContact O-SG 2.92Å; I440-C444 VanDerWaalsContact O-SG 3.33Å; C444-R446 PolarHBondContact O-N 3.38Å; C444-Q447 PolarHBondContact O-N 3.19Å; C444-D448 WeakPolarHBondContact O-CB 3.45Å; C444-D448 PolarHBondContact O-N 3.14Å; C444-D448 VanDerWaalsContact O-N 3.15Å
445	I	94.1	Very high	87.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-43.8	179	-64.8	163.8	0	0	0	111.3	Y400 A409 I411 F426 L441 W442 E443 D448 L449 L452	Y400-I445 HydrophobicContact CD1-CG1 4.31Å; Y400-I445 HydrophobicContact CD2-CG1 3.77Å; Y400-I445 HydrophobicContact CE1-CG1 4.47Å; Y400-I445 HydrophobicContact CE2-CG1 3.97Å; Y400-I445 HydrophobicContact CG-CG1 3.96Å; A409-I445 HydrophobicContact CB-CD1 3.49Å; A409-I445 VanDerWaalsContact CB-CD1 3.49Å; A409-I445 HydrophobicContact CB-CG1 4.46Å; I411-I445 HydrophobicContact CD1-CG1 4.36Å; I411-I445 HydrophobicContact CD1-CG2 3.87Å; F426-I445 HydrophobicContact CD2-CD1 4.29Å; F426-I445 HydrophobicContact CE2-CD1 4.14Å; L441-I445 HydrophobicContact CG-CD1 4.28Å; L441-I445 WeakPolarHBondContact O-CD1 3.43Å; L441-I445 VanDerWaalsContact O-CG1 3.28Å; L441-I445 WeakPolarHBondContact O-CG1 3.28Å; L441-I445 PolarHBondContact O-N 3.15Å; W442-I445 HydrophobicContact CE3-CD1 4.48Å; W442-I445 PolarHBondContact O-N 2.85Å; E443-I445 VanDerWaalsContact C-N 3.29Å; E443-I445 PolarHBondContact O-N 2.95Å; I445-D448 PolarHBondContact O-N 2.8Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 VanDerWaalsContact O-CB 3.29Å; I445-L449 WeakPolarHBondContact O-CB 3.1Å; I445-L449 PolarHBondContact O-N 2.94Å; I445-L452 HydrophobicContact CG2-CD2 3.79Å
446	R	91.3	Very high	89.4	Confident	101 Å²	101	33.8 Å²	33.8	38%	0.381	19%	0.189	S	C	.	.	H	α-helix	trans	-70	-34.9	-179.7	-90	-163	175.1	-157.7	2.5	113.5	W442 E443 C444 D448 L449 H469 F484	W442-R446 VanDerWaalsContact NE1-NE 3.16Å; W442-R446 PolarHBondContact O-N 3.33Å; E443-R446 PolarHBondContact O-N 3.23Å; C444-R446 PolarHBondContact O-N 3.38Å; R446-D448 VanDerWaalsContact C-N 3.3Å; R446-L449 VanDerWaalsContact O-O 3.13Å; R446-H469 VanDerWaalsContact NH2-C 3.35Å; R446-H469 PolarHBondContact NH2-O 3.12Å; R446-F484 HydrophobicContact CG-CE1 4.07Å; R446-F484 HydrophobicContact CG-CE2 4.22Å; R446-F484 HydrophobicContact CG-CZ 3.79Å
447	Q	87.7	Confident	90.4	Very high	135 Å²	135	36.3 Å²	36.3	63%	0.631	19%	0.189	S	C	*	.	H	α-helix	trans	-65.1	-39.9	175.4	-74.6	174.9	-1	0	0	110.5	E443 C444	E443-Q447 WeakPolarHBondContact O-CB 3.35Å; E443-Q447 VanDerWaalsContact O-CG 3.28Å; E443-Q447 WeakPolarHBondContact O-CG 3.39Å; E443-Q447 PolarHBondContact O-N 3.38Å; C444-Q447 PolarHBondContact O-N 3.19Å
448	D	91.9	Very high	91	Very high	78 Å²	78	38 Å²	38	42%	0.417	20%	0.204	S	C	.	.	H	α-helix	trans	-81.1	-33.5	-178.3	-80.9	15.9	0	0	0	113.8	K360 Y400 C444 I445 R446	K360-D448 VanDerWaalsContact CD-OD2 3.29Å; K360-D448 WeakPolarHBondContact CD-OD2 3.23Å; K360-D448 WeakPolarHBondContact CE-OD2 3.45Å; K360-D448 IonicContact NZ-OD2 3.93Å; K360-D448 PolarHBondContact NZ-OD2 2.85Å; Y400-D448 HydrophobicContact CE1-CB 4.35Å; Y400-D448 WeakPolarHBondContact CE1-OD2 3.29Å; Y400-D448 WeakPolarHBondContact OH-CB 3.38Å; Y400-D448 PolarHBondContact OH-OD2 3.08Å; C444-D448 WeakPolarHBondContact O-CB 3.45Å; C444-D448 PolarHBondContact O-N 3.14Å; C444-D448 VanDerWaalsContact O-N 3.15Å; I445-D448 PolarHBondContact O-N 2.8Å; R446-D448 VanDerWaalsContact C-N 3.3Å
449	L	92.7	Very high	91.4	Very high	16 Å²	16	42.8 Å²	42.8	8%	0.084	23%	0.232	C	C	.	.			trans	-117.6	119.3	-173.8	-56.4	-175.3	0	0	0	111.3	I411 P421 I445 R446 K451 L452 F484	I411-L449 HydrophobicContact CD1-CD1 3.41Å; I411-L449 VanDerWaalsContact CD1-CD1 3.41Å; I411-L449 HydrophobicContact CG2-CD1 4.22Å; P421-L449 HydrophobicContact CB-CD1 4.48Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 VanDerWaalsContact O-CB 3.29Å; I445-L449 WeakPolarHBondContact O-CB 3.1Å; I445-L449 PolarHBondContact O-N 2.94Å; R446-L449 VanDerWaalsContact O-O 3.13Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.23Å; L449-L452 HydrophobicContact CD1-CD1 3.88Å; L449-F484 WeakPolarHBondContact O-CE2 3.48Å
450	G	91.1	Very high	91.7	Very high	68 Å²	68	43.2 Å²	43.2	70%	0.701	24%	0.236	S	C	*	.	S	Bend	trans	-74	-16.3	174.8	0	0	0	0	0	114.7	G485	G450-G485 VanDerWaalsContact O-CA 3.26Å; G450-G485 WeakPolarHBondContact O-CA 3.41Å
451	K	94.6	Very high	91.9	Very high	65 Å²	65	54 Å²	54	28%	0.283	28%	0.276	S	S	.	.			trans	-148.8	146	178.2	62.8	-177.7	177.5	175.4	0	110.9	S418 D419 T420 L449 F484	S418-K451 PolarHBondContact O-NZ 2.99Å; D419-K451 WeakPolarHBondContact O-CE 3.41Å; D419-K451 PolarHBondContact O-NZ 2.82Å; T420-K451 HydrophobicContact CG2-CB 4.28Å; T420-K451 HydrophobicContact CG2-CD 4.28Å; T420-K451 HydrophobicContact CG2-CG 4.11Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.23Å; K451-F484 WeakPolarHBondContact CA-O 3.39Å
452	L	96.9	Very high	91.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	149.4	179.4	-170.6	71.3	0	0	0	109.8	I411 P421 L423 W442 I445 L449 W483 F484	I411-L452 HydrophobicContact CD1-CD1 4.24Å; I411-L452 HydrophobicContact CG2-CD1 4.06Å; P421-L452 HydrophobicContact CB-CD1 4.1Å; P421-L452 WeakPolarHBondContact O-CD1 3.4Å; L423-L452 HydrophobicContact CB-CD1 4.23Å; L423-L452 HydrophobicContact CB-CD2 4.08Å; L423-L452 HydrophobicContact CB-CG 4.25Å; L423-L452 HydrophobicContact CD2-CD2 4.26Å; W442-L452 HydrophobicContact CH2-CD2 4.04Å; W442-L452 HydrophobicContact CZ3-CD2 4.1Å; I445-L452 HydrophobicContact CG2-CD2 3.79Å; L449-L452 HydrophobicContact CD1-CD1 3.88Å; L452-W483 CarbonylContact O-C 3.59Å; L452-W483 VanDerWaalsContact O-CA 3.25Å; L452-W483 WeakPolarHBondContact O-CA 3.44Å; L452-F484 HydrophobicContact CB-CD1 4.06Å; L452-F484 HydrophobicContact CB-CE1 3.41Å; L452-F484 VanDerWaalsContact CB-CE1 3.41Å; L452-F484 HydrophobicContact CB-CE2 4.09Å; L452-F484 HydrophobicContact CB-CZ 3.42Å; L452-F484 VanDerWaalsContact CB-CZ 3.42Å; L452-F484 HydrophobicContact CD2-CE1 3.71Å; L452-F484 HydrophobicContact CD2-CZ 4.1Å; L452-F484 HydrophobicContact CG-CE1 4.2Å; L452-F484 HydrophobicContact CG-CZ 4.42Å; L452-F484 PolarHBondContact N-O 3.02Å; L452-F484 VanDerWaalsContact N-O 3.15Å; L452-F484 PolarHBondContact O-N 2.7Å
453	F	97.1	Very high	91.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.5	168.1	82.9	-72.5	0	0	0	112.1	L416 T420 P421 Y422 L423 F482 W483 L495 Y498	L416-F453 HydrophobicContact CD1-CE1 3.52Å; L416-F453 HydrophobicContact CD1-CE2 4.39Å; L416-F453 HydrophobicContact CD1-CZ 3.43Å; L416-F453 VanDerWaalsContact CD1-CZ 3.43Å; T420-F453 HydrophobicContact CG2-CB 4.43Å; T420-F453 HydrophobicContact CG2-CD1 3.79Å; T420-F453 VanDerWaalsContact O-CE1 3.31Å; T420-F453 WeakPolarHBondContact O-CE1 3.4Å; P421-F453 WeakPolarHBondContact O-CD1 3.24Å; P421-F453 PolarHBondContact O-N 3.27Å; P421-F453 VanDerWaalsContact O-N 3.12Å; Y422-F453 WeakPolarHBondContact CA-O 3.42Å; Y422-F453 HydrophobicContact CD2-CD1 4.32Å; Y422-F453 AromaticContact CD2-CD2 3.81Å; Y422-F453 HydrophobicContact CD2-CD2 3.81Å; Y422-F453 AromaticContact CD2-CE1 3.9Å; Y422-F453 HydrophobicContact CD2-CE1 3.9Å; Y422-F453 AromaticContact CD2-CE2 3.36Å; Y422-F453 HydrophobicContact CD2-CE2 3.36Å; Y422-F453 HydrophobicContact CD2-CG 4.27Å; Y422-F453 AromaticContact CD2-CZ 3.4Å; Y422-F453 HydrophobicContact CD2-CZ 3.4Å; Y422-F453 WeakPolarHBondContact CD2-O 3.43Å; Y422-F453 HydrophobicContact CE2-CD2 4.36Å; Y422-F453 AromaticContact CE2-CE2 3.96Å; Y422-F453 HydrophobicContact CE2-CE2 3.96Å; Y422-F453 HydrophobicContact CE2-CZ 4.36Å; Y422-F453 HydrophobicContact CG-CE1 4.17Å; Y422-F453 HydrophobicContact CG-CE2 4.28Å; Y422-F453 AromaticContact CG-CZ 3.86Å; Y422-F453 HydrophobicContact CG-CZ 3.86Å; L423-F453 PolarHBondContact N-O 3.09Å; F453-F482 CarbonylContact C-O 3.55Å; F453-F482 VanDerWaalsContact CA-O 3.27Å; F453-F482 WeakPolarHBondContact CA-O 3.4Å; F453-F482 WeakPolarHBondContact CB-O 3.43Å; F453-W483 HydrophobicContact CB-CB 4.01Å; F453-L495 HydrophobicContact CB-CD1 3.85Å; F453-L495 HydrophobicContact CD1-CD2 3.82Å; F453-L495 HydrophobicContact CD2-CB 3.83Å; F453-L495 HydrophobicContact CD2-CD2 4.17Å; F453-L495 HydrophobicContact CD2-CG 4.38Å; F453-L495 HydrophobicContact CE1-CD2 4.02Å; F453-L495 HydrophobicContact CE2-CB 4.24Å; F453-L495 HydrophobicContact CE2-CD2 4.33Å; F453-L495 HydrophobicContact CG-CB 4.2Å; F453-L495 HydrophobicContact CG-CD1 4.11Å; F453-L495 HydrophobicContact CG-CD2 3.91Å; F453-L495 HydrophobicContact CG-CG 4.28Å; F453-L495 HydrophobicContact CZ-CD2 4.28Å; F453-Y498 AromaticContact CE2-CD1 3.88Å; F453-Y498 HydrophobicContact CE2-CD1 3.88Å; F453-Y498 HydrophobicContact CE2-CE1 4.48Å; F453-Y498 AromaticContact CZ-CD1 3.73Å; F453-Y498 HydrophobicContact CZ-CD1 3.73Å; F453-Y498 HydrophobicContact CZ-CE1 4.1Å
454	W	96.8	Very high	92	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.011	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	169.5	-177.1	71	103.4	0	0	0	111.3	L423 W442 Y466 C470 V481 F482 F484	L423-W454 HydrophobicContact CB-CB 3.78Å; L423-W454 HydrophobicContact CD2-CB 4.14Å; L423-W454 HydrophobicContact CD2-CG 4.27Å; L423-W454 HydrophobicContact CG-CB 4.36Å; W442-W454 HydrophobicContact CH2-CD2 4.48Å; W442-W454 HydrophobicContact CH2-CE3 4.11Å; W442-W454 AromaticContact CH2-CH2 3.59Å; W442-W454 HydrophobicContact CH2-CH2 3.59Å; W442-W454 AromaticContact CH2-CZ2 3.94Å; W442-W454 HydrophobicContact CH2-CZ2 3.94Å; W442-W454 AromaticContact CH2-CZ3 3.69Å; W442-W454 HydrophobicContact CH2-CZ3 3.69Å; W442-W454 AromaticContact CZ2-CH2 3.93Å; W442-W454 HydrophobicContact CZ2-CH2 3.93Å; W442-W454 HydrophobicContact CZ2-CZ2 4.46Å; W442-W454 HydrophobicContact CZ2-CZ3 4.27Å; W454-Y466 AromaticContact CE2-CD1 3.78Å; W454-Y466 AromaticContact CZ2-CD1 3.86Å; W454-Y466 HydrophobicContact CZ2-CD1 3.86Å; W454-Y466 HydrophobicContact CZ2-CG 4.12Å; W454-Y466 AromaticContact NE1-CD1 3.28Å; W454-Y466 VanDerWaalsContact NE1-CD1 3.28Å; W454-Y466 AromaticContact NE1-CD2 3.48Å; W454-Y466 AromaticContact NE1-CE1 3.55Å; W454-Y466 AromaticContact NE1-CE2 3.7Å; W454-Y466 AromaticContact NE1-CG 3.28Å; W454-Y466 VanDerWaalsContact NE1-CG 3.28Å; W454-Y466 AromaticContact NE1-CZ 3.77Å; W454-C470 HydrophobicContact CH2-CB 3.82Å; W454-C470 HydrophobicContact CZ2-CB 4.22Å; W454-V481 CarbonylContact O-C 3.58Å; W454-V481 WeakPolarHBondContact O-CA 3.36Å; W454-F482 HydrophobicContact CD2-CB 3.58Å; W454-F482 AromaticContact CE2-CG 3.79Å; W454-F482 HydrophobicContact CE3-CB 3.97Å; W454-F482 HydrophobicContact CG-CB 4.19Å; W454-F482 HydrophobicContact CH2-CB 3.7Å; W454-F482 HydrophobicContact CZ2-CB 3.32Å; W454-F482 HydrophobicContact CZ2-CD1 4.37Å; W454-F482 HydrophobicContact CZ2-CD2 4.49Å; W454-F482 AromaticContact CZ2-CG 3.87Å; W454-F482 HydrophobicContact CZ2-CG 3.87Å; W454-F482 HydrophobicContact CZ3-CB 4Å; W454-F482 PolarHBondContact N-O 2.84Å; W454-F482 AromaticContact NE1-CD2 3.54Å; W454-F482 AromaticContact NE1-CG 3.79Å; W454-F482 PolarHBondContact O-N 3.34Å; W454-F484 HydrophobicContact CH2-CD1 4.28Å; W454-F484 AromaticContact CZ3-CD1 3.82Å; W454-F484 HydrophobicContact CZ3-CD1 3.82Å; W454-F484 HydrophobicContact CZ3-CE1 4.39Å
455	R	95.3	Very high	91.9	Very high	25 Å²	25	58.9 Å²	58.9	9%	0.094	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153.7	171.6	74.9	-174	-178.1	164.2	0.7	111.5	Y422 W479 I480 V481 A499 V502 P503	Y422-R455 WeakPolarHBondContact OH-CG 3.28Å; Y422-R455 PolarHBondContact OH-NE 2.93Å; R455-W479 HydrophobicContact CB-CE3 4.21Å; R455-W479 HydrophobicContact CG-CD2 4.49Å; R455-W479 HydrophobicContact CG-CE3 3.75Å; R455-W479 HydrophobicContact CG-CZ3 3.89Å; R455-I480 CarbonylContact C-O 3.58Å; R455-I480 VanDerWaalsContact CA-O 3.23Å; R455-I480 WeakPolarHBondContact CA-O 3.19Å; R455-V481 HydrophobicContact CB-CG2 4.44Å; R455-A499 HydrophobicContact CB-CB 4.43Å; R455-A499 WeakPolarHBondContact CD-O 3.5Å; R455-A499 PolarHBondContact NH1-O 3.38Å; R455-V502 VanDerWaalsContact CZ-O 3.24Å; R455-V502 PolarHBondContact NH1-O 3.3Å; R455-V502 PolarHBondContact NH2-O 3.05Å; R455-P503 PolarHBondContact NH2-O 3.06Å
456	S	95.1	Very high	91.9	Very high	5 Å²	5	59.5 Å²	59.5	4%	0.035	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.2	175.7	-175.8	0	0	0	0	110	N460 N463 W479 I480	S456-N460 VanDerWaalsContact OG-CB 3.28Å; S456-N460 WeakPolarHBondContact OG-CB 3.24Å; S456-N460 PolarHBondContact OG-ND2 2.9Å; S456-N463 WeakPolarHBondContact CB-OD1 3.15Å; S456-N463 PolarHBondContact OG-OD1 3.14Å; S456-W479 VanDerWaalsContact C-CE3 3.46Å; S456-W479 CarbonylContact O-C 3.37Å; S456-W479 WeakPolarHBondContact O-CA 3.46Å; S456-I480 PolarHBondContact N-O 3.12Å; S456-I480 PolarHBondContact O-N 3.23Å
457	R	92.3	Very high	92.1	Very high	83 Å²	83	59.5 Å²	59.5	31%	0.313	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	141.2	172.2	-67.9	-68.3	-169.6	171	0.9	109.1	T459 N460 N463 S478 W479 D504	R457-T459 PolarHBondContact O-N 3.27Å; R457-T459 VanDerWaalsContact O-N 3.12Å; R457-N460 HydrophobicContact CB-CB 4.45Å; R457-N460 WeakPolarHBondContact O-CB 3.48Å; R457-N460 PolarHBondContact O-N 3.1Å; R457-N463 PolarHBondContact O-ND2 2.94Å; R457-S478 WeakPolarHBondContact CA-O 3.45Å; R457-S478 PolarHBondContact NH1-OG 3.31Å; R457-W479 HydrophobicContact CG-CE3 4.24Å; R457-W479 HydrophobicContact CG-CH2 4.03Å; R457-W479 HydrophobicContact CG-CZ3 3.81Å; R457-D504 IonicContact CZ-OD2 2.65Å; R457-D504 IonicContact NH2-OD2 3.87Å; R457-D504 PolarHBondContact NH2-OD2 3.12Å
458	A	91.3	Very high	92.2	Very high	46 Å²	46	61.1 Å²	61.1	38%	0.38	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.2	-179.7	0	0	0	0	0	113.1	N460 N463 S478 I480	A458-N460 VanDerWaalsContact C-N 3.34Å; A458-N463 PolarHBondContact O-ND2 3.19Å; A458-N463 VanDerWaalsContact O-ND2 3.13Å; A458-S478 PolarHBondContact N-O 3Å; A458-I480 HydrophobicContact CB-CD1 4.4Å; A458-I480 HydrophobicContact CB-CG1 4.24Å
459	T	90.7	Very high	92.2	Very high	130 Å²	130	58.6 Å²	58.6	80%	0.798	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-0.6	178.6	54.1	0	0	0	0	114.6	R457 R461	R457-T459 PolarHBondContact O-N 3.27Å; R457-T459 VanDerWaalsContact O-N 3.12Å; T459-R461 PolarHBondContact O-N 3.43Å
460	N	88.8	Confident	92.3	Very high	57 Å²	57	58.9 Å²	58.9	31%	0.305	30%	0.301	S	S	.	.			trans	-71.3	129.7	-175	-167.3	-9.7	0	0	0	111.8	S456 R457 A458 I462 N463	S456-N460 VanDerWaalsContact OG-CB 3.28Å; S456-N460 WeakPolarHBondContact OG-CB 3.24Å; S456-N460 PolarHBondContact OG-ND2 2.9Å; R457-N460 HydrophobicContact CB-CB 4.45Å; R457-N460 WeakPolarHBondContact O-CB 3.48Å; R457-N460 PolarHBondContact O-N 3.1Å; A458-N460 VanDerWaalsContact C-N 3.34Å; N460-I462 HydrophobicContact CB-CG2 4.47Å; N460-I462 WeakPolarHBondContact ND2-CG2 3.47Å; N460-I462 PolarHBondContact O-N 2.78Å; N460-I462 WeakPolarHBondContact OD1-CG2 3.35Å; N460-I462 PolarHBondContact OD1-N 3.27Å; N460-N463 WeakPolarHBondContact O-CB 3.47Å; N460-N463 VanDerWaalsContact O-CG 3.25Å; N460-N463 PolarHBondContact O-N 2.73Å; N460-N463 VanDerWaalsContact O-N 3.15Å; N460-N463 PolarHBondContact O-ND2 3.16Å
461	R	86.4	Confident	92.5	Very high	241 Å²	241	61 Å²	61	91%	0.909	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.2	-177	-63.9	-178.1	-179.1	176.4	2.2	113.6	T459 N463 P464	T459-R461 PolarHBondContact O-N 3.43Å; R461-N463 VanDerWaalsContact C-N 3.34Å; R461-P464 WeakPolarHBondContact O-CD 3.29Å
462	I	86.8	Confident	92.6	Very high	47 Å²	47	58.6 Å²	58.6	24%	0.241	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.6	178.3	-160.8	171.7	0	0	0	113.1	F426 N460 P464 W465 Y466	F426-I462 HydrophobicContact CD1-CD1 4.33Å; F426-I462 HydrophobicContact CE1-CD1 4.29Å; N460-I462 HydrophobicContact CB-CG2 4.47Å; N460-I462 WeakPolarHBondContact ND2-CG2 3.47Å; N460-I462 PolarHBondContact O-N 2.78Å; N460-I462 WeakPolarHBondContact OD1-CG2 3.35Å; N460-I462 PolarHBondContact OD1-N 3.27Å; I462-P464 VanDerWaalsContact C-CD 3.46Å; I462-W465 HydrophobicContact CD1-CE3 4.27Å; I462-W465 HydrophobicContact CG1-CB 4.12Å; I462-W465 HydrophobicContact CG1-CE3 4.17Å; I462-W465 WeakPolarHBondContact O-CA 3.41Å; I462-W465 VanDerWaalsContact O-CB 3.27Å; I462-W465 WeakPolarHBondContact O-CB 3.45Å; I462-W465 PolarHBondContact O-N 3.42Å; I462-Y466 HydrophobicContact CD1-CE1 4.25Å; I462-Y466 HydrophobicContact CG2-CD2 3.77Å; I462-Y466 HydrophobicContact CG2-CE2 3.28Å; I462-Y466 PolarHBondContact O-N 2.85Å; I462-Y466 VanDerWaalsContact O-N 3.12Å
463	N	92.3	Very high	92.5	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-54.7	-40.5	-175.2	-70.9	-17.2	0	0	0	114.4	S456 R457 A458 N460 R461 W465 Y466 F467	S456-N463 WeakPolarHBondContact CB-OD1 3.15Å; S456-N463 PolarHBondContact OG-OD1 3.14Å; R457-N463 PolarHBondContact O-ND2 2.94Å; A458-N463 PolarHBondContact O-ND2 3.19Å; A458-N463 VanDerWaalsContact O-ND2 3.13Å; N460-N463 WeakPolarHBondContact O-CB 3.47Å; N460-N463 VanDerWaalsContact O-CG 3.25Å; N460-N463 PolarHBondContact O-N 2.73Å; N460-N463 VanDerWaalsContact O-N 3.15Å; N460-N463 PolarHBondContact O-ND2 3.16Å; R461-N463 VanDerWaalsContact C-N 3.34Å; N463-W465 PolarHBondContact O-N 2.9Å; N463-Y466 PolarHBondContact O-N 3.44Å; N463-Y466 VanDerWaalsContact O-N 3.09Å; N463-F467 HydrophobicContact CB-CE2 4.34Å; N463-F467 WeakPolarHBondContact O-CD2 3.4Å; N463-F467 PolarHBondContact O-N 3.44Å
464	P	90.6	Very high	92.5	Very high	84 Å²	84	65.2 Å²	65.2	55%	0.545	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-29	173.5	-26	36.1	0	0	0	114	R461 I462 K468	R461-P464 WeakPolarHBondContact O-CD 3.29Å; I462-P464 VanDerWaalsContact C-CD 3.46Å; P464-K468 WeakPolarHBondContact O-CG 3.48Å
465	W	87.2	Confident	92.3	Very high	46 Å²	46	69.3 Å²	69.3	17%	0.174	35%	0.35	C	S	.	.	H	α-helix	trans	-75.4	-46.8	173.2	-175.7	89	0	0	0	110.4	F426 W442 I462 N463 F467 K468 H469	F426-W465 HydrophobicContact CE1-CH2 4.46Å; F426-W465 HydrophobicContact CE1-CZ3 4.36Å; F426-W465 HydrophobicContact CZ-CH2 4.13Å; F426-W465 HydrophobicContact CZ-CZ3 4.42Å; W442-W465 HydrophobicContact CB-CH2 3.64Å; W442-W465 HydrophobicContact CB-CZ2 3.97Å; W442-W465 AromaticContact CD2-CH2 3.64Å; W442-W465 HydrophobicContact CD2-CH2 3.64Å; W442-W465 HydrophobicContact CD2-CZ3 4.28Å; W442-W465 AromaticContact CE3-CH2 3.93Å; W442-W465 HydrophobicContact CE3-CH2 3.93Å; W442-W465 HydrophobicContact CE3-CZ3 4.27Å; W442-W465 AromaticContact CG-CH2 3.5Å; W442-W465 HydrophobicContact CG-CH2 3.5Å; W442-W465 VanDerWaalsContact CG-CH2 3.5Å; W442-W465 HydrophobicContact CG-CZ2 4.04Å; I462-W465 HydrophobicContact CD1-CE3 4.27Å; I462-W465 HydrophobicContact CG1-CB 4.12Å; I462-W465 HydrophobicContact CG1-CE3 4.17Å; I462-W465 WeakPolarHBondContact O-CA 3.41Å; I462-W465 VanDerWaalsContact O-CB 3.27Å; I462-W465 WeakPolarHBondContact O-CB 3.45Å; I462-W465 PolarHBondContact O-N 3.42Å; N463-W465 PolarHBondContact O-N 2.9Å; W465-F467 VanDerWaalsContact C-N 3.28Å; W465-F467 PolarHBondContact O-N 2.85Å; W465-K468 WeakPolarHBondContact O-CB 3.47Å; W465-K468 PolarHBondContact O-N 3.43Å; W465-H469 AromaticContact CD1-CD2 3.95Å; W465-H469 AromaticContact CD1-NE2 3.78Å; W465-H469 AromaticContact CD2-CD2 3.49Å; W465-H469 VanDerWaalsContact CD2-CD2 3.49Å; W465-H469 AromaticContact CD2-NE2 3.97Å; W465-H469 AromaticContact CE2-CD2 3.21Å; W465-H469 AromaticContact CE2-NE2 3.26Å; W465-H469 VanDerWaalsContact CE2-NE2 3.26Å; W465-H469 AromaticContact CE3-CD2 3.96Å; W465-H469 AromaticContact CG-CD2 3.96Å; W465-H469 AromaticContact CH2-CD2 3.91Å; W465-H469 AromaticContact CZ2-CD2 3.45Å; W465-H469 VanDerWaalsContact CZ2-CD2 3.45Å; W465-H469 WeakPolarHBondContact CZ2-CD2 3.45Å; W465-H469 AromaticContact CZ2-NE2 3.52Å; W465-H469 AromaticContact NE1-CD2 3.5Å; W465-H469 AromaticContact NE1-NE2 3.12Å; W465-H469 PolarHBondContact NE1-NE2 2.89Å; W465-H469 VanDerWaalsContact NE1-NE2 3.12Å; W465-H469 PolarHBondContact O-CD2 3.28Å; W465-H469 VanDerWaalsContact O-CD2 3.23Å; W465-H469 PolarHBondContact O-N 2.92Å
466	Y	94.1	Very high	91.6	Very high	13 Å²	13	70.8 Å²	70.8	5%	0.051	36%	0.36	C	S	.	.	H	α-helix	trans	-55.9	-39.1	174.7	-69.9	-36.3	0	0	0	113.5	W454 I462 N463 K468 H469 C470 F482	W454-Y466 AromaticContact CE2-CD1 3.78Å; W454-Y466 AromaticContact CZ2-CD1 3.86Å; W454-Y466 HydrophobicContact CZ2-CD1 3.86Å; W454-Y466 HydrophobicContact CZ2-CG 4.12Å; W454-Y466 AromaticContact NE1-CD1 3.28Å; W454-Y466 VanDerWaalsContact NE1-CD1 3.28Å; W454-Y466 AromaticContact NE1-CD2 3.48Å; W454-Y466 AromaticContact NE1-CE1 3.55Å; W454-Y466 AromaticContact NE1-CE2 3.7Å; W454-Y466 AromaticContact NE1-CG 3.28Å; W454-Y466 VanDerWaalsContact NE1-CG 3.28Å; W454-Y466 AromaticContact NE1-CZ 3.77Å; I462-Y466 HydrophobicContact CD1-CE1 4.25Å; I462-Y466 HydrophobicContact CG2-CD2 3.77Å; I462-Y466 HydrophobicContact CG2-CE2 3.28Å; I462-Y466 PolarHBondContact O-N 2.85Å; I462-Y466 VanDerWaalsContact O-N 3.12Å; N463-Y466 PolarHBondContact O-N 3.44Å; N463-Y466 VanDerWaalsContact O-N 3.09Å; Y466-K468 PolarHBondContact O-N 2.6Å; Y466-H469 CarbonylContact O-C 3.43Å; Y466-H469 PolarHBondContact O-N 2.91Å; Y466-C470 PolarHBondContact O-N 2.85Å; Y466-F482 HydrophobicContact CD2-CD2 4.38Å; Y466-F482 HydrophobicContact CD2-CE2 4.04Å; Y466-F482 HydrophobicContact CG-CE2 4.42Å
467	F	94.5	Very high	91.1	Very high	101 Å²	101	73.8 Å²	73.8	44%	0.443	39%	0.391	S	S	.	.	H	α-helix	trans	-60.5	-29.5	174.9	-79.2	-65.4	0	0	0	113.8	N463 W465 H469 S473 I480 F482	N463-F467 HydrophobicContact CB-CE2 4.34Å; N463-F467 WeakPolarHBondContact O-CD2 3.4Å; N463-F467 PolarHBondContact O-N 3.44Å; W465-F467 VanDerWaalsContact C-N 3.28Å; W465-F467 PolarHBondContact O-N 2.85Å; F467-H469 VanDerWaalsContact C-N 3.33Å; F467-S473 WeakPolarHBondContact CE1-OG 3.48Å; F467-I480 HydrophobicContact CZ-CD1 4.33Å; F467-F482 AromaticContact CD1-CE1 3.74Å; F467-F482 HydrophobicContact CD1-CE1 3.74Å; F467-F482 HydrophobicContact CD2-CE1 4.32Å; F467-F482 HydrophobicContact CD2-CZ 4.46Å; F467-F482 AromaticContact CE1-CE1 3.75Å; F467-F482 HydrophobicContact CE1-CE1 3.75Å; F467-F482 HydrophobicContact CE1-CZ 4.31Å; F467-F482 HydrophobicContact CE2-CE1 4.32Å; F467-F482 HydrophobicContact CE2-CZ 4.22Å; F467-F482 HydrophobicContact CG-CE1 4.02Å; F467-F482 HydrophobicContact CZ-CE1 4.04Å; F467-F482 HydrophobicContact CZ-CZ 4.13Å
468	K	90	Very high	90.9	Very high	168 Å²	168	72.9 Å²	72.9	73%	0.73	40%	0.397	S	S	*	.	H	α-helix	trans	-77.2	-21.9	175.8	-66	175.5	-178.6	-178	0	112.6	P464 W465 Y466	P464-K468 WeakPolarHBondContact O-CG 3.48Å; W465-K468 WeakPolarHBondContact O-CB 3.47Å; W465-K468 PolarHBondContact O-N 3.43Å; Y466-K468 PolarHBondContact O-N 2.6Å
469	H	91.4	Very high	90.9	Very high	26 Å²	26	72.8 Å²	72.8	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-112.7	5.5	-173.3	-67.8	-74.9	0	0	0	114	Q439 W442 R446 W465 Y466 F467	Q439-H469 PolarHBondContact OE1-CE1 3.5Å; Q439-H469 PolarHBondContact OE1-NE2 3.26Å; W442-H469 AromaticContact CD1-ND1 3.69Å; W442-H469 HydrophobicContact CZ2-CB 3.97Å; W442-H469 AromaticContact NE1-CG 3.73Å; W442-H469 AromaticContact NE1-ND1 3.57Å; R446-H469 VanDerWaalsContact NH2-C 3.35Å; R446-H469 PolarHBondContact NH2-O 3.12Å; W465-H469 AromaticContact CD1-CD2 3.95Å; W465-H469 AromaticContact CD1-NE2 3.78Å; W465-H469 AromaticContact CD2-CD2 3.49Å; W465-H469 VanDerWaalsContact CD2-CD2 3.49Å; W465-H469 AromaticContact CD2-NE2 3.97Å; W465-H469 AromaticContact CE2-CD2 3.21Å; W465-H469 AromaticContact CE2-NE2 3.26Å; W465-H469 VanDerWaalsContact CE2-NE2 3.26Å; W465-H469 AromaticContact CE3-CD2 3.96Å; W465-H469 AromaticContact CG-CD2 3.96Å; W465-H469 AromaticContact CH2-CD2 3.91Å; W465-H469 AromaticContact CZ2-CD2 3.45Å; W465-H469 VanDerWaalsContact CZ2-CD2 3.45Å; W465-H469 WeakPolarHBondContact CZ2-CD2 3.45Å; W465-H469 AromaticContact CZ2-NE2 3.52Å; W465-H469 AromaticContact NE1-CD2 3.5Å; W465-H469 AromaticContact NE1-NE2 3.12Å; W465-H469 PolarHBondContact NE1-NE2 2.89Å; W465-H469 VanDerWaalsContact NE1-NE2 3.12Å; W465-H469 PolarHBondContact O-CD2 3.28Å; W465-H469 VanDerWaalsContact O-CD2 3.23Å; W465-H469 PolarHBondContact O-N 2.92Å; Y466-H469 CarbonylContact O-C 3.43Å; Y466-H469 PolarHBondContact O-N 2.91Å; F467-H469 VanDerWaalsContact C-N 3.33Å
470	C	95.7	Very high	91.2	Very high	21 Å²	21	67.2 Å²	67.2	14%	0.142	35%	0.352	C	S	.	.			trans	-104.1	154	173	71	0	0	0	0	111.6	W454 Y466 F482 W483	W454-C470 HydrophobicContact CH2-CB 3.82Å; W454-C470 HydrophobicContact CZ2-CB 4.22Å; Y466-C470 PolarHBondContact O-N 2.85Å; C470-F482 HydrophobicContact CB-CB 4.2Å; C470-F482 HydrophobicContact CB-CD1 3.91Å; C470-W483 WeakPolarHBondContact CA-O 3.36Å; C470-W483 WeakPolarHBondContact CB-O 3.47Å
471	D	95.6	Very high	91.6	Very high	112 Å²	112	64.6 Å²	64.6	60%	0.599	34%	0.338	S	S	*	.	S	Bend	trans	-88.8	-23	167.1	-59.3	-27	0	0	0	111.2	W483 F484 G485	D471-W483 PolarHBondContact N-O 2.85Å; D471-F484 HydrophobicContact CB-CB 4.46Å; D471-F484 WeakPolarHBondContact OD2-CA 3.47Å; D471-F484 WeakPolarHBondContact OD2-CB 3.12Å; D471-G485 PolarHBondContact OD2-N 2.84Å
472	G	95.5	Very high	92.1	Very high	15 Å²	15	53.1 Å²	53.1	16%	0.155	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	162.3	175.4	0	0	0	0	0	113.2	W483	G472-W483 VanDerWaalsContact CA-CE2 3.48Å; G472-W483 PolarHBondContact N-O 3.09Å; G472-W483 PolarHBondContact O-N 3.36Å; G472-W483 VanDerWaalsContact O-N 3.09Å
473	S	96.2	Very high	92.6	Very high	46 Å²	46	51.8 Å²	51.8	32%	0.322	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	156.4	178.2	65.4	0	0	0	0	112.2	F467 V481 W483	F467-S473 WeakPolarHBondContact CE1-OG 3.48Å; S473-V481 CarbonylContact C-O 3.49Å; S473-V481 WeakPolarHBondContact CA-O 3.27Å; S473-V481 WeakPolarHBondContact CB-O 3.45Å; S473-W483 VanDerWaalsContact C-CH2 3.46Å; S473-W483 VanDerWaalsContact C-CZ3 3.48Å
474	F	95.4	Very high	92.7	Very high	94 Å²	94	52 Å²	52	41%	0.412	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	127.5	174.8	-172.7	-88.8	0	0	0	110.5	N476 I480 V481 W483 V496	F474-N476 HydrophobicContact CD1-CB 4.15Å; F474-N476 HydrophobicContact CE1-CB 4Å; F474-I480 WeakPolarHBondContact O-CA 3.23Å; F474-V481 PolarHBondContact N-O 2.93Å; F474-V481 PolarHBondContact O-N 2.79Å; F474-W483 HydrophobicContact CB-CH2 4.27Å; F474-W483 HydrophobicContact CB-CZ3 4.04Å; F474-V496 HydrophobicContact CB-CG2 3.69Å; F474-V496 HydrophobicContact CD1-CG1 3.61Å; F474-V496 HydrophobicContact CD1-CG2 4.08Å; F474-V496 HydrophobicContact CE1-CG1 3.94Å; F474-V496 HydrophobicContact CG-CG1 4.26Å; F474-V496 HydrophobicContact CG-CG2 3.95Å
475	V	92.8	Very high	92.9	Very high	88 Å²	88	49.2 Å²	49.2	53%	0.533	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.7	177.6	-176.1	0	0	0	0	109.4	I480	V475-I480 HydrophobicContact CG1-CG1 4.46Å; V475-I480 HydrophobicContact CG2-CD1 4.49Å; V475-I480 HydrophobicContact CG2-CG1 4.18Å; V475-I480 HydrophobicContact CG2-CG2 4.23Å
476	N	81.8	Confident	93.2	Very high	57 Å²	57	48.6 Å²	48.6	31%	0.305	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	91.1	175.5	-177.3	57.2	0	0	0	111.2	F474 S478 W479 K500	F474-N476 HydrophobicContact CD1-CB 4.15Å; F474-N476 HydrophobicContact CE1-CB 4Å; N476-S478 PolarHBondContact O-N 2.9Å; N476-W479 CarbonylContact C-O 3.53Å; N476-W479 PolarHBondContact N-O 2.71Å; N476-W479 PolarHBondContact O-N 3.11Å; N476-W479 VanDerWaalsContact O-N 3.12Å; N476-K500 VanDerWaalsContact ND2-CE 3.31Å; N476-K500 WeakPolarHBondContact ND2-CE 3.35Å; N476-K500 VanDerWaalsContact ND2-CG 3.28Å; N476-K500 WeakPolarHBondContact ND2-CG 3.17Å; N476-K500 WeakPolarHBondContact OD1-CE 3.39Å
477	G	84.8	Confident	92.9	Very high	67 Å²	67	54 Å²	54	69%	0.691	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	-110.6	179.9	0	0	0	0	0	111.8
478	S	87.4	Confident	92.7	Very high	64 Å²	64	51.3 Å²	51.3	45%	0.448	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.2	-177.5	64.9	0	0	0	0	114.9	R457 A458 N476	R457-S478 WeakPolarHBondContact CA-O 3.45Å; R457-S478 PolarHBondContact NH1-OG 3.31Å; A458-S478 PolarHBondContact N-O 3Å; N476-S478 PolarHBondContact O-N 2.9Å
479	W	92.3	Very high	92.7	Very high	45 Å²	45	48.5 Å²	48.5	17%	0.17	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.8	-177.3	-65.6	102.3	0	0	0	111.8	R455 S456 R457 N476	R455-W479 HydrophobicContact CB-CE3 4.21Å; R455-W479 HydrophobicContact CG-CD2 4.49Å; R455-W479 HydrophobicContact CG-CE3 3.75Å; R455-W479 HydrophobicContact CG-CZ3 3.89Å; S456-W479 VanDerWaalsContact C-CE3 3.46Å; S456-W479 CarbonylContact O-C 3.37Å; S456-W479 WeakPolarHBondContact O-CA 3.46Å; R457-W479 HydrophobicContact CG-CE3 4.24Å; R457-W479 HydrophobicContact CG-CH2 4.03Å; R457-W479 HydrophobicContact CG-CZ3 3.81Å; N476-W479 CarbonylContact C-O 3.53Å; N476-W479 PolarHBondContact N-O 2.71Å; N476-W479 PolarHBondContact O-N 3.11Å; N476-W479 VanDerWaalsContact O-N 3.12Å
480	I	95.6	Very high	92.7	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.062	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.7	166.8	-49.1	179.6	0	0	0	106.9	R455 S456 A458 F467 F474 V475 F482	R455-I480 CarbonylContact C-O 3.58Å; R455-I480 VanDerWaalsContact CA-O 3.23Å; R455-I480 WeakPolarHBondContact CA-O 3.19Å; S456-I480 PolarHBondContact N-O 3.12Å; S456-I480 PolarHBondContact O-N 3.23Å; A458-I480 HydrophobicContact CB-CD1 4.4Å; A458-I480 HydrophobicContact CB-CG1 4.24Å; F467-I480 HydrophobicContact CZ-CD1 4.33Å; F474-I480 WeakPolarHBondContact O-CA 3.23Å; V475-I480 HydrophobicContact CG1-CG1 4.46Å; V475-I480 HydrophobicContact CG2-CD1 4.49Å; V475-I480 HydrophobicContact CG2-CG1 4.18Å; V475-I480 HydrophobicContact CG2-CG2 4.23Å; I480-F482 HydrophobicContact CB-CD2 4.41Å; I480-F482 HydrophobicContact CB-CE2 3.68Å; I480-F482 HydrophobicContact CB-CZ 3.99Å; I480-F482 HydrophobicContact CD1-CZ 4.47Å; I480-F482 HydrophobicContact CG2-CD1 4.49Å; I480-F482 HydrophobicContact CG2-CD2 4.06Å; I480-F482 HydrophobicContact CG2-CE1 3.96Å; I480-F482 HydrophobicContact CG2-CE2 3.46Å; I480-F482 VanDerWaalsContact CG2-CE2 3.46Å; I480-F482 HydrophobicContact CG2-CZ 3.4Å; I480-F482 VanDerWaalsContact CG2-CZ 3.4Å
481	V	96.6	Very high	92.4	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.2	175	-174.1	0	0	0	0	107.8	W454 R455 S473 F474 V496 A499	W454-V481 CarbonylContact O-C 3.58Å; W454-V481 WeakPolarHBondContact O-CA 3.36Å; R455-V481 HydrophobicContact CB-CG2 4.44Å; S473-V481 CarbonylContact C-O 3.49Å; S473-V481 WeakPolarHBondContact CA-O 3.27Å; S473-V481 WeakPolarHBondContact CB-O 3.45Å; F474-V481 PolarHBondContact N-O 2.93Å; F474-V481 PolarHBondContact O-N 2.79Å; V481-V496 HydrophobicContact CB-CG2 4.15Å; V481-V496 HydrophobicContact CG1-CG2 4.18Å; V481-V496 HydrophobicContact CG2-CG2 4.39Å; V481-A499 HydrophobicContact CG1-CB 4.1Å; V481-A499 HydrophobicContact CG2-CB 3.65Å
482	F	97.5	Very high	92.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.1	-178.7	-64.5	-88.2	0	0	0	109.9	F453 W454 Y466 F467 C470 I480	F453-F482 CarbonylContact C-O 3.55Å; F453-F482 VanDerWaalsContact CA-O 3.27Å; F453-F482 WeakPolarHBondContact CA-O 3.4Å; F453-F482 WeakPolarHBondContact CB-O 3.43Å; W454-F482 HydrophobicContact CD2-CB 3.58Å; W454-F482 AromaticContact CE2-CG 3.79Å; W454-F482 HydrophobicContact CE3-CB 3.97Å; W454-F482 HydrophobicContact CG-CB 4.19Å; W454-F482 HydrophobicContact CH2-CB 3.7Å; W454-F482 HydrophobicContact CZ2-CB 3.32Å; W454-F482 HydrophobicContact CZ2-CD1 4.37Å; W454-F482 HydrophobicContact CZ2-CD2 4.49Å; W454-F482 AromaticContact CZ2-CG 3.87Å; W454-F482 HydrophobicContact CZ2-CG 3.87Å; W454-F482 HydrophobicContact CZ3-CB 4Å; W454-F482 PolarHBondContact N-O 2.84Å; W454-F482 AromaticContact NE1-CD2 3.54Å; W454-F482 AromaticContact NE1-CG 3.79Å; W454-F482 PolarHBondContact O-N 3.34Å; Y466-F482 HydrophobicContact CD2-CD2 4.38Å; Y466-F482 HydrophobicContact CD2-CE2 4.04Å; Y466-F482 HydrophobicContact CG-CE2 4.42Å; F467-F482 AromaticContact CD1-CE1 3.74Å; F467-F482 HydrophobicContact CD1-CE1 3.74Å; F467-F482 HydrophobicContact CD2-CE1 4.32Å; F467-F482 HydrophobicContact CD2-CZ 4.46Å; F467-F482 AromaticContact CE1-CE1 3.75Å; F467-F482 HydrophobicContact CE1-CE1 3.75Å; F467-F482 HydrophobicContact CE1-CZ 4.31Å; F467-F482 HydrophobicContact CE2-CE1 4.32Å; F467-F482 HydrophobicContact CE2-CZ 4.22Å; F467-F482 HydrophobicContact CG-CE1 4.02Å; F467-F482 HydrophobicContact CZ-CE1 4.04Å; F467-F482 HydrophobicContact CZ-CZ 4.13Å; C470-F482 HydrophobicContact CB-CB 4.2Å; C470-F482 HydrophobicContact CB-CD1 3.91Å; I480-F482 HydrophobicContact CB-CD2 4.41Å; I480-F482 HydrophobicContact CB-CE2 3.68Å; I480-F482 HydrophobicContact CB-CZ 3.99Å; I480-F482 HydrophobicContact CD1-CZ 4.47Å; I480-F482 HydrophobicContact CG2-CD1 4.49Å; I480-F482 HydrophobicContact CG2-CD2 4.06Å; I480-F482 HydrophobicContact CG2-CE1 3.96Å; I480-F482 HydrophobicContact CG2-CE2 3.46Å; I480-F482 VanDerWaalsContact CG2-CE2 3.46Å; I480-F482 HydrophobicContact CG2-CZ 3.4Å; I480-F482 VanDerWaalsContact CG2-CZ 3.4Å
483	W	96.7	Very high	92	Very high	19 Å²	19	59.8 Å²	59.8	7%	0.072	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	162	174.4	60	87.1	0	0	0	112.4	L452 F453 C470 D471 G472 S473 F474 L486 I489 L495	L452-W483 CarbonylContact O-C 3.59Å; L452-W483 VanDerWaalsContact O-CA 3.25Å; L452-W483 WeakPolarHBondContact O-CA 3.44Å; F453-W483 HydrophobicContact CB-CB 4.01Å; C470-W483 WeakPolarHBondContact CA-O 3.36Å; C470-W483 WeakPolarHBondContact CB-O 3.47Å; D471-W483 PolarHBondContact N-O 2.85Å; G472-W483 VanDerWaalsContact CA-CE2 3.48Å; G472-W483 PolarHBondContact N-O 3.09Å; G472-W483 PolarHBondContact O-N 3.36Å; G472-W483 VanDerWaalsContact O-N 3.09Å; S473-W483 VanDerWaalsContact C-CH2 3.46Å; S473-W483 VanDerWaalsContact C-CZ3 3.48Å; F474-W483 HydrophobicContact CB-CH2 4.27Å; F474-W483 HydrophobicContact CB-CZ3 4.04Å; W483-L486 HydrophobicContact CB-CD1 4.2Å; W483-L486 HydrophobicContact CB-CG 4.34Å; W483-L486 HydrophobicContact CD2-CD1 4.22Å; W483-L486 HydrophobicContact CG-CD1 3.64Å; W483-L486 HydrophobicContact CG-CG 4.09Å; W483-I489 HydrophobicContact CZ2-CD1 3.99Å; W483-L495 HydrophobicContact CB-CD1 4.27Å
484	F	96.2	Very high	91.8	Very high	10 Å²	10	61.5 Å²	61.5	4%	0.044	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.4	162.2	69.9	-105.3	0	0	0	110.7	W442 R446 L449 K451 L452 W454 D471 L486	W442-F484 HydrophobicContact CH2-CD1 4.06Å; W442-F484 AromaticContact CH2-CE1 3.7Å; W442-F484 HydrophobicContact CH2-CE1 3.7Å; W442-F484 AromaticContact CZ2-CD1 3.69Å; W442-F484 HydrophobicContact CZ2-CD1 3.69Å; W442-F484 AromaticContact CZ2-CE1 3.48Å; W442-F484 HydrophobicContact CZ2-CE1 3.48Å; W442-F484 VanDerWaalsContact CZ2-CE1 3.48Å; R446-F484 HydrophobicContact CG-CE1 4.07Å; R446-F484 HydrophobicContact CG-CE2 4.22Å; R446-F484 HydrophobicContact CG-CZ 3.79Å; L449-F484 WeakPolarHBondContact O-CE2 3.48Å; K451-F484 WeakPolarHBondContact CA-O 3.39Å; L452-F484 HydrophobicContact CB-CD1 4.06Å; L452-F484 HydrophobicContact CB-CE1 3.41Å; L452-F484 VanDerWaalsContact CB-CE1 3.41Å; L452-F484 HydrophobicContact CB-CE2 4.09Å; L452-F484 HydrophobicContact CB-CZ 3.42Å; L452-F484 VanDerWaalsContact CB-CZ 3.42Å; L452-F484 HydrophobicContact CD2-CE1 3.71Å; L452-F484 HydrophobicContact CD2-CZ 4.1Å; L452-F484 HydrophobicContact CG-CE1 4.2Å; L452-F484 HydrophobicContact CG-CZ 4.42Å; L452-F484 PolarHBondContact N-O 3.02Å; L452-F484 VanDerWaalsContact N-O 3.15Å; L452-F484 PolarHBondContact O-N 2.7Å; W454-F484 HydrophobicContact CH2-CD1 4.28Å; W454-F484 AromaticContact CZ3-CD1 3.82Å; W454-F484 HydrophobicContact CZ3-CD1 3.82Å; W454-F484 HydrophobicContact CZ3-CE1 4.39Å; D471-F484 HydrophobicContact CB-CB 4.46Å; D471-F484 WeakPolarHBondContact OD2-CA 3.47Å; D471-F484 WeakPolarHBondContact OD2-CB 3.12Å; F484-L486 PolarHBondContact O-N 2.82Å
485	G	93.8	Very high	91.7	Very high	27 Å²	27	57 Å²	57	28%	0.278	31%	0.31	S	S	.	.			trans	77.1	16.2	170.1	0	0	0	0	0	115.8	G450 D471 S487	G450-G485 VanDerWaalsContact O-CA 3.26Å; G450-G485 WeakPolarHBondContact O-CA 3.41Å; D471-G485 PolarHBondContact OD2-N 2.84Å; G485-S487 PolarHBondContact O-N 2.81Å
486	L	92.7	Very high	91.6	Very high	33 Å²	33	53.2 Å²	53.2	17%	0.173	29%	0.287	C	S	.	.			trans	-73.2	128.5	176.4	-58.2	-173.4	0	0	0	110.3	T420 W483 F484 L495	T420-L486 HydrophobicContact CG2-CD2 4.26Å; W483-L486 HydrophobicContact CB-CD1 4.2Å; W483-L486 HydrophobicContact CB-CG 4.34Å; W483-L486 HydrophobicContact CD2-CD1 4.22Å; W483-L486 HydrophobicContact CG-CD1 3.64Å; W483-L486 HydrophobicContact CG-CG 4.09Å; F484-L486 PolarHBondContact O-N 2.82Å; L486-L495 HydrophobicContact CD1-CD1 3.75Å; L486-L495 HydrophobicContact CD2-CD1 3.93Å; L486-L495 HydrophobicContact CG-CD1 4.43Å
487	S	89.3	Confident	92.1	Very high	126 Å²	126	54.3 Å²	54.3	88%	0.881	29%	0.29	S	S	*	.	S	Bend	trans	-77.8	-31.2	173.9	-61.8	0	0	0	0	111.9	G485	G485-S487 PolarHBondContact O-N 2.81Å
488	D	90	Very high	92.4	Very high	44 Å²	44	53.3 Å²	53.3	24%	0.235	27%	0.266	C	S	.	.			trans	-127.7	120.5	177.1	-175.9	-6	0	0	0	110.8	R490 E491	D488-R490 VanDerWaalsContact CG-NE 3.33Å; D488-R490 PolarHBondContact O-N 3.39Å; D488-R490 VanDerWaalsContact O-N 3.11Å; D488-R490 WeakPolarHBondContact OD1-CB 3.44Å; D488-R490 WeakPolarHBondContact OD1-CG 3.31Å; D488-R490 IonicContact OD1-CZ 3.86Å; D488-R490 PolarHBondContact OD1-N 2.54Å; D488-R490 IonicContact OD1-NE 3.04Å; D488-R490 PolarHBondContact OD1-NE 2.74Å; D488-R490 IonicContact OD1-NH2 3.85Å; D488-R490 IonicContact OD2-CZ 3.12Å; D488-R490 IonicContact OD2-NE 2.79Å; D488-R490 PolarHBondContact OD2-NE 3.15Å; D488-R490 IonicContact OD2-NH2 2.65Å; D488-R490 PolarHBondContact OD2-NH2 2.84Å; D488-E491 HydrophobicContact CB-CG 4.32Å; D488-E491 WeakPolarHBondContact O-CB 3.34Å; D488-E491 PolarHBondContact O-N 3.35Å; D488-E491 VanDerWaalsContact O-N 3.08Å
489	I	89.2	Confident	92.5	Very high	109 Å²	109	50.3 Å²	50.3	56%	0.559	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.6	179.3	-168.1	57.7	0	0	0	112.8	W483 E491 S492	W483-I489 HydrophobicContact CZ2-CD1 3.99Å; I489-E491 PolarHBondContact O-N 2.89Å; I489-S492 VanDerWaalsContact O-CB 3.25Å; I489-S492 WeakPolarHBondContact O-CB 3.26Å; I489-S492 PolarHBondContact O-N 2.9Å; I489-S492 PolarHBondContact O-OG 3.5Å
490	R	91.2	Very high	92.2	Very high	175 Å²	175	52 Å²	52	66%	0.66	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.8	177.8	-64.7	173.9	-68.9	-168.2	2.3	112.4	D488 S492 Y493	D488-R490 VanDerWaalsContact CG-NE 3.33Å; D488-R490 PolarHBondContact O-N 3.39Å; D488-R490 VanDerWaalsContact O-N 3.11Å; D488-R490 WeakPolarHBondContact OD1-CB 3.44Å; D488-R490 WeakPolarHBondContact OD1-CG 3.31Å; D488-R490 IonicContact OD1-CZ 3.86Å; D488-R490 PolarHBondContact OD1-N 2.54Å; D488-R490 IonicContact OD1-NE 3.04Å; D488-R490 PolarHBondContact OD1-NE 2.74Å; D488-R490 IonicContact OD1-NH2 3.85Å; D488-R490 IonicContact OD2-CZ 3.12Å; D488-R490 IonicContact OD2-NE 2.79Å; D488-R490 PolarHBondContact OD2-NE 3.15Å; D488-R490 IonicContact OD2-NH2 2.65Å; D488-R490 PolarHBondContact OD2-NH2 2.84Å; R490-S492 PolarHBondContact O-N 3.44Å; R490-Y493 WeakPolarHBondContact O-CD2 3.44Å; R490-Y493 PolarHBondContact O-N 3.46Å
491	E	90.4	Very high	91.9	Very high	49 Å²	49	60.6 Å²	60.6	23%	0.229	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-30.1	173.9	-65	176.6	-166.3	0	0	111.7	D488 I489 Y493 Q494 L495	D488-E491 HydrophobicContact CB-CG 4.32Å; D488-E491 WeakPolarHBondContact O-CB 3.34Å; D488-E491 PolarHBondContact O-N 3.35Å; D488-E491 VanDerWaalsContact O-N 3.08Å; I489-E491 PolarHBondContact O-N 2.89Å; E491-Y493 PolarHBondContact O-N 3.08Å; E491-Y493 VanDerWaalsContact O-N 3.12Å; E491-Q494 WeakPolarHBondContact O-CB 3.36Å; E491-Q494 PolarHBondContact O-N 2.99Å; E491-L495 WeakPolarHBondContact O-CG 3.48Å; E491-L495 PolarHBondContact O-N 2.93Å
492	S	92	Very high	91.5	Very high	13 Å²	13	61.3 Å²	61.3	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-56.9	-31.5	-179.1	69.1	0	0	0	0	113.3	I489 R490 Q494 L495 V496	I489-S492 VanDerWaalsContact O-CB 3.25Å; I489-S492 WeakPolarHBondContact O-CB 3.26Å; I489-S492 PolarHBondContact O-N 2.9Å; I489-S492 PolarHBondContact O-OG 3.5Å; R490-S492 PolarHBondContact O-N 3.44Å; S492-Q494 VanDerWaalsContact C-N 3.33Å; S492-Q494 PolarHBondContact O-N 2.76Å; S492-L495 PolarHBondContact O-N 3.43Å; S492-V496 WeakPolarHBondContact O-CB 3.2Å; S492-V496 VanDerWaalsContact O-CG2 3.29Å; S492-V496 WeakPolarHBondContact O-CG2 3.25Å; S492-V496 PolarHBondContact O-N 3.24Å
493	Y	91.4	Very high	91	Very high	175 Å²	175	65.4 Å²	65.4	69%	0.686	32%	0.316	S	S	*	.	H	α-helix	trans	-61.1	-41.9	176.1	-72	-82	0	0	0	111.8	R490 E491 V496 E497	R490-Y493 WeakPolarHBondContact O-CD2 3.44Å; R490-Y493 PolarHBondContact O-N 3.46Å; E491-Y493 PolarHBondContact O-N 3.08Å; E491-Y493 VanDerWaalsContact O-N 3.12Å; Y493-V496 PolarHBondContact O-N 3.37Å; Y493-E497 WeakPolarHBondContact O-CB 3.43Å; Y493-E497 WeakPolarHBondContact O-CG 3.31Å; Y493-E497 PolarHBondContact O-N 3.26Å
494	Q	91.2	Very high	90.5	Very high	82 Å²	82	67 Å²	67	38%	0.383	33%	0.326	S	S	.	.	H	α-helix	trans	-68.2	-40.5	178.4	-60.4	179.1	-9.2	0	0	111.2	L416 S417 E491 S492 V496 E497 Y498	L416-Q494 HydrophobicContact CD2-CB 4.44Å; S417-Q494 PolarHBondContact OG-NE2 3.12Å; S417-Q494 PolarHBondContact OG-OE1 3.47Å; E491-Q494 WeakPolarHBondContact O-CB 3.36Å; E491-Q494 PolarHBondContact O-N 2.99Å; S492-Q494 VanDerWaalsContact C-N 3.33Å; S492-Q494 PolarHBondContact O-N 2.76Å; Q494-V496 VanDerWaalsContact C-N 3.34Å; Q494-V496 PolarHBondContact O-N 3.04Å; Q494-E497 PolarHBondContact O-N 2.96Å; Q494-Y498 WeakPolarHBondContact O-CB 3.28Å; Q494-Y498 PolarHBondContact O-N 3.39Å
495	L	93.1	Very high	90	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-44.9	176.9	-54	-178.9	0	0	0	111.2	L416 F453 W483 L486 E491 S492 Y498 A499	L416-L495 HydrophobicContact CD1-CD2 3.7Å; F453-L495 HydrophobicContact CB-CD1 3.85Å; F453-L495 HydrophobicContact CD1-CD2 3.82Å; F453-L495 HydrophobicContact CD2-CB 3.83Å; F453-L495 HydrophobicContact CD2-CD2 4.17Å; F453-L495 HydrophobicContact CD2-CG 4.38Å; F453-L495 HydrophobicContact CE1-CD2 4.02Å; F453-L495 HydrophobicContact CE2-CB 4.24Å; F453-L495 HydrophobicContact CE2-CD2 4.33Å; F453-L495 HydrophobicContact CG-CB 4.2Å; F453-L495 HydrophobicContact CG-CD1 4.11Å; F453-L495 HydrophobicContact CG-CD2 3.91Å; F453-L495 HydrophobicContact CG-CG 4.28Å; F453-L495 HydrophobicContact CZ-CD2 4.28Å; W483-L495 HydrophobicContact CB-CD1 4.27Å; L486-L495 HydrophobicContact CD1-CD1 3.75Å; L486-L495 HydrophobicContact CD2-CD1 3.93Å; L486-L495 HydrophobicContact CG-CD1 4.43Å; E491-L495 WeakPolarHBondContact O-CG 3.48Å; E491-L495 PolarHBondContact O-N 2.93Å; S492-L495 PolarHBondContact O-N 3.43Å; L495-Y498 PolarHBondContact O-N 3.38Å; L495-A499 VanDerWaalsContact O-CB 3.23Å; L495-A499 WeakPolarHBondContact O-CB 3.29Å; L495-A499 PolarHBondContact O-N 3.28Å
496	V	91.6	Very high	89.6	Confident	8 Å²	8	67.1 Å²	67.1	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-46.9	177.8	170.6	0	0	0	0	110.9	F474 V481 S492 Y493 Q494 Y498 A499 K500	F474-V496 HydrophobicContact CB-CG2 3.69Å; F474-V496 HydrophobicContact CD1-CG1 3.61Å; F474-V496 HydrophobicContact CD1-CG2 4.08Å; F474-V496 HydrophobicContact CE1-CG1 3.94Å; F474-V496 HydrophobicContact CG-CG1 4.26Å; F474-V496 HydrophobicContact CG-CG2 3.95Å; V481-V496 HydrophobicContact CB-CG2 4.15Å; V481-V496 HydrophobicContact CG1-CG2 4.18Å; V481-V496 HydrophobicContact CG2-CG2 4.39Å; S492-V496 WeakPolarHBondContact O-CB 3.2Å; S492-V496 VanDerWaalsContact O-CG2 3.29Å; S492-V496 WeakPolarHBondContact O-CG2 3.25Å; S492-V496 PolarHBondContact O-N 3.24Å; Y493-V496 PolarHBondContact O-N 3.37Å; Q494-V496 VanDerWaalsContact C-N 3.34Å; Q494-V496 PolarHBondContact O-N 3.04Å; V496-Y498 VanDerWaalsContact C-N 3.33Å; V496-Y498 PolarHBondContact O-N 2.99Å; V496-A499 PolarHBondContact O-N 3.26Å; V496-K500 VanDerWaalsContact O-CG 3.27Å; V496-K500 WeakPolarHBondContact O-CG 3.46Å; V496-K500 PolarHBondContact O-N 3.48Å
497	E	90.8	Very high	89.1	Confident	79 Å²	79	70.3 Å²	70.3	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-38.1	178.7	-77.4	-57.8	118.3	0	0	112.8	Y493 Q494 K500 R501	Y493-E497 WeakPolarHBondContact O-CB 3.43Å; Y493-E497 WeakPolarHBondContact O-CG 3.31Å; Y493-E497 PolarHBondContact O-N 3.26Å; Q494-E497 PolarHBondContact O-N 2.96Å; E497-K500 IonicContact OE1-NZ 2.72Å; E497-K500 PolarHBondContact OE1-NZ 2.66Å; E497-R501 WeakPolarHBondContact O-CG 3.44Å; E497-R501 IonicContact OE2-NH2 3.8Å
498	Y	91	Very high	88	Confident	46 Å²	46	67 Å²	67	18%	0.18	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-51.6	173.2	174.7	-89.9	0	0	0	111.3	E414 L416 F453 Q494 L495 V496 K500 R501 V502	E414-Y498 HydrophobicContact CB-CE1 3.86Å; E414-Y498 HydrophobicContact CB-CE2 3.95Å; E414-Y498 HydrophobicContact CG-CE1 3.7Å; E414-Y498 HydrophobicContact CG-CE2 4.41Å; E414-Y498 WeakPolarHBondContact CG-OH 3.27Å; E414-Y498 PolarHBondContact OE2-OH 3.15Å; L416-Y498 HydrophobicContact CD1-CG 4.46Å; L416-Y498 HydrophobicContact CD2-CD2 4.25Å; L416-Y498 HydrophobicContact CD2-CG 3.98Å; L416-Y498 HydrophobicContact CG-CG 4.38Å; F453-Y498 AromaticContact CE2-CD1 3.88Å; F453-Y498 HydrophobicContact CE2-CD1 3.88Å; F453-Y498 HydrophobicContact CE2-CE1 4.48Å; F453-Y498 AromaticContact CZ-CD1 3.73Å; F453-Y498 HydrophobicContact CZ-CD1 3.73Å; F453-Y498 HydrophobicContact CZ-CE1 4.1Å; Q494-Y498 WeakPolarHBondContact O-CB 3.28Å; Q494-Y498 PolarHBondContact O-N 3.39Å; L495-Y498 PolarHBondContact O-N 3.38Å; V496-Y498 VanDerWaalsContact C-N 3.33Å; V496-Y498 PolarHBondContact O-N 2.99Å; Y498-K500 PolarHBondContact O-N 3.48Å; Y498-K500 VanDerWaalsContact O-N 3.08Å; Y498-R501 PolarHBondContact O-N 3.42Å; Y498-V502 HydrophobicContact CD1-CG2 3.81Å; Y498-V502 HydrophobicContact CE1-CG2 3.21Å; Y498-V502 HydrophobicContact CE2-CG2 4.38Å; Y498-V502 WeakPolarHBondContact O-CG2 3.25Å; Y498-V502 PolarHBondContact O-N 2.98Å
499	A	89.1	Confident	86	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.008	35%	0.346	C	S	.	.	H	α-helix	trans	-59.5	-25.9	-178.2	0	0	0	0	0	113.4	R455 V481 L495 V496	R455-A499 HydrophobicContact CB-CB 4.43Å; R455-A499 WeakPolarHBondContact CD-O 3.5Å; R455-A499 PolarHBondContact NH1-O 3.38Å; V481-A499 HydrophobicContact CG1-CB 4.1Å; V481-A499 HydrophobicContact CG2-CB 3.65Å; L495-A499 VanDerWaalsContact O-CB 3.23Å; L495-A499 WeakPolarHBondContact O-CB 3.29Å; L495-A499 PolarHBondContact O-N 3.28Å; V496-A499 PolarHBondContact O-N 3.26Å
500	K	87.2	Confident	83.7	Confident	81 Å²	81	73.2 Å²	73.2	35%	0.352	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-37.3	170.5	-77.6	177.6	-176	171.9	0	113.5	N476 V496 E497 Y498	N476-K500 VanDerWaalsContact ND2-CE 3.31Å; N476-K500 WeakPolarHBondContact ND2-CE 3.35Å; N476-K500 VanDerWaalsContact ND2-CG 3.28Å; N476-K500 WeakPolarHBondContact ND2-CG 3.17Å; N476-K500 WeakPolarHBondContact OD1-CE 3.39Å; V496-K500 VanDerWaalsContact O-CG 3.27Å; V496-K500 WeakPolarHBondContact O-CG 3.46Å; V496-K500 PolarHBondContact O-N 3.48Å; E497-K500 IonicContact OE1-NZ 2.72Å; E497-K500 PolarHBondContact OE1-NZ 2.66Å; Y498-K500 PolarHBondContact O-N 3.48Å; Y498-K500 VanDerWaalsContact O-N 3.08Å
501	R	88.8	Confident	81.1	Confident	192 Å²	192	73.2 Å²	73.2	73%	0.725	37%	0.37	S	S	*	.	H	α-helix	trans	-87.5	-20.5	-173.1	-63.2	175.3	-166.9	-167.2	2.8	113	E497 Y498 P503	E497-R501 WeakPolarHBondContact O-CG 3.44Å; E497-R501 IonicContact OE2-NH2 3.8Å; Y498-R501 PolarHBondContact O-N 3.42Å; R501-P503 WeakPolarHBondContact O-CD 3.39Å
502	V	87.9	Confident	78.5	Confident	18 Å²	18	73.8 Å²	73.8	11%	0.109	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-59.4	122.3	179	-177.2	0	0	0	0	109.6	R455 Y498	R455-V502 VanDerWaalsContact CZ-O 3.24Å; R455-V502 PolarHBondContact NH1-O 3.3Å; R455-V502 PolarHBondContact NH2-O 3.05Å; Y498-V502 HydrophobicContact CD1-CG2 3.81Å; Y498-V502 HydrophobicContact CE1-CG2 3.21Å; Y498-V502 HydrophobicContact CE2-CG2 4.38Å; Y498-V502 WeakPolarHBondContact O-CG2 3.25Å; Y498-V502 PolarHBondContact O-N 2.98Å
503	P	86.9	Confident	75.6	Confident	86 Å²	86	76.6 Å²	76.6	56%	0.558	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-67.3	166.9	178.9	27.7	-34	0	0	0	111.7	R455 R501	R455-P503 PolarHBondContact NH2-O 3.06Å; R501-P503 WeakPolarHBondContact O-CD 3.39Å
504	D	86.1	Confident	73.1	Confident	52 Å²	52	72.5 Å²	72.5	28%	0.278	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-70.2	134.5	171.2	-153.4	-33.9	0	0	0	109.7	R457 F506	R457-D504 IonicContact CZ-OD2 2.65Å; R457-D504 IonicContact NH2-OD2 3.87Å; R457-D504 PolarHBondContact NH2-OD2 3.12Å; D504-F506 VanDerWaalsContact C-N 3.32Å; D504-F506 WeakPolarHBondContact OD1-CD2 3.46Å; D504-F506 PolarHBondContact OD1-N 3.38Å; D504-F506 VanDerWaalsContact OD1-N 3.1Å
505	S	85.4	Confident	70.6	Confident	18 Å²	18	74.5 Å²	74.5	13%	0.126	44%	0.442	C	S	.	.	S	Bend	trans	-83	-13.5	178	-46.6	0	0	0	0	112.3	R385 K425	R385-S505 WeakPolarHBondContact CG-O 3.35Å; R385-S505 PolarHBondContact N-O 2.72Å; K425-S505 PolarHBondContact NZ-OG 3.33Å
506	F	86.4	Confident	68.1	Low	22 Å²	22	83.6 Å²	83.6	10%	0.096	49%	0.485	C	S	.	.	B	Isolated β-bridge	trans	-100	155.3	-179.8	-61.5	-83	0	0	0	111.2	I376 F380 K382 N383 L384 K425 D504	I376-F506 HydrophobicContact CG2-CE1 4.31Å; I376-F506 HydrophobicContact CG2-CZ 4.26Å; F380-F506 HydrophobicContact CB-CE1 3.75Å; F380-F506 HydrophobicContact CB-CE2 4.43Å; F380-F506 HydrophobicContact CB-CZ 3.68Å; F380-F506 HydrophobicContact CD1-CE2 4.24Å; F380-F506 HydrophobicContact CD1-CZ 4.06Å; F380-F506 HydrophobicContact CD2-CE1 4.01Å; F380-F506 HydrophobicContact CD2-CE2 4.22Å; F380-F506 AromaticContact CD2-CZ 3.33Å; F380-F506 HydrophobicContact CD2-CZ 3.33Å; F380-F506 HydrophobicContact CE2-CE2 4.49Å; F380-F506 AromaticContact CE2-CZ 3.85Å; F380-F506 HydrophobicContact CE2-CZ 3.85Å; F380-F506 HydrophobicContact CG-CE1 4.02Å; F380-F506 HydrophobicContact CG-CE2 4.06Å; F380-F506 AromaticContact CG-CZ 3.42Å; F380-F506 HydrophobicContact CG-CZ 3.42Å; F380-F506 VanDerWaalsContact CG-CZ 3.42Å; F380-F506 HydrophobicContact CZ-CZ 4.44Å; K382-F506 HydrophobicContact CB-CB 4.2Å; K382-F506 HydrophobicContact CB-CD1 3.53Å; K382-F506 HydrophobicContact CB-CE1 4.2Å; K382-F506 HydrophobicContact CB-CG 4Å; K382-F506 HydrophobicContact CD-CB 4.1Å; K382-F506 HydrophobicContact CD-CD1 4.49Å; K382-F506 HydrophobicContact CD-CG 4.17Å; N383-F506 WeakPolarHBondContact O-CA 3.32Å; L384-F506 HydrophobicContact CD2-CD1 4.09Å; L384-F506 HydrophobicContact CD2-CE1 3.71Å; L384-F506 HydrophobicContact CD2-CZ 3.94Å; L384-F506 HydrophobicContact CG-CD1 4.29Å; L384-F506 HydrophobicContact CG-CE1 3.86Å; L384-F506 HydrophobicContact CG-CZ 4.49Å; K425-F506 HydrophobicContact CD-CZ 4.37Å; D504-F506 VanDerWaalsContact C-N 3.32Å; D504-F506 WeakPolarHBondContact OD1-CD2 3.46Å; D504-F506 PolarHBondContact OD1-N 3.38Å; D504-F506 VanDerWaalsContact OD1-N 3.1Å
507	H	81.4	Confident	65.9	Low	100 Å²	100	91.8 Å²	91.8	46%	0.463	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-58.1	141.2	168.7	-70.2	-76.5	0	0	0	110.6	N383 L384	N383-H507 PolarHBondContact O-CD2 2.6Å; N383-H507 PolarHBondContact O-N 2.8Å; L384-H507 PolarHBondContact O-CD2 3.37Å; L384-H507 PolarHBondContact O-NE2 2.67Å
508	G	66.6	Low	64	Low	56 Å²	56	93.4 Å²	93.4	58%	0.577	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-59.4	163.7	169.9	0	0	0	0	0	111	I510	G508-I510 PolarHBondContact O-N 2.98Å
509	P	48.8	Very low	62	Low	119 Å²	119	96.7 Å²	96.7	77%	0.773	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-52.8	132.2	172.7	23.8	-31.6	0	0	0	108.7	M511	P509-M511 VanDerWaalsContact C-N 3.31Å; P509-M511 PolarHBondContact O-N 3.27Å
510	I	39.9	Very low	60.1	Low	166 Å²	166	102.8 Å²	102.8	85%	0.851	61%	0.606	S	S	*	*			trans	-57.6	102.2	170.9	-58.2	171.5	0	0	0	105.3	G508 G512	G508-I510 PolarHBondContact O-N 2.98Å; I510-G512 VanDerWaalsContact C-N 3.27Å; I510-G512 PolarHBondContact O-N 3.08Å
511	M	36.8	Very low	58.5	Low	174 Å²	174	102.3 Å²	102.3	86%	0.857	63%	0.625	S	S	*	*			trans	-66.9	99.3	166.4	-75.5	-150.9	170.4	0	0	105.3	P509 G513	P509-M511 VanDerWaalsContact C-N 3.31Å; P509-M511 PolarHBondContact O-N 3.27Å; M511-G513 PolarHBondContact O-N 2.65Å
512	G	35.7	Very low	56.1	Low	62 Å²	62	102.8 Å²	102.8	64%	0.639	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-47.4	125.5	167	0	0	0	0	0	107.6	I510 A514	I510-G512 VanDerWaalsContact C-N 3.27Å; I510-G512 PolarHBondContact O-N 3.08Å; G512-A514 PolarHBondContact O-N 2.79Å
513	G	32.4	Very low	54.5	Low	71 Å²	71	107 Å²	107	73%	0.732	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-46.4	135.7	-173.1	0	0	0	0	0	111.4	M511	M511-G513 PolarHBondContact O-N 2.65Å
514	A	36.9	Very low	52.8	Low	90 Å²	90	108.1 Å²	108.1	74%	0.744	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-49	133.3	170.6	0	0	0	0	0	109	G512 Q516	G512-A514 PolarHBondContact O-N 2.79Å; A514-Q516 PolarHBondContact O-N 3.04Å
515	P	39.3	Very low	50.9	Low	123 Å²	123	111.2 Å²	111.2	80%	0.799	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-60.4	118.6	174.3	22.6	-28.6	0	0	0	107.9	Q517	P515-Q517 PolarHBondContact O-N 2.9Å; P515-Q517 VanDerWaalsContact O-N 3.16Å
516	Q	42	Very low	48.9	Very low	191 Å²	191	116.7 Å²	116.7	89%	0.893	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55.1	121.1	168.9	-79.7	178	-15.7	0	0	107.7	A514	A514-Q516 PolarHBondContact O-N 3.04Å
517	Q	44.6	Very low	46.5	Very low	181 Å²	181	122.6 Å²	122.6	85%	0.846	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.2	136.6	168.5	-79.4	179.9	-37.6	0	0	108.7	P515	P515-Q517 PolarHBondContact O-N 2.9Å; P515-Q517 VanDerWaalsContact O-N 3.16Å
518	P	51.3	Low	44.2	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.4	172.7	28.8	-31.8	0	0	0	109.4
519	P	49.4	Very low	42.6	Very low	115 Å²	115	129 Å²	129	75%	0.747	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-63.9	147.2	-179.6	27.9	-32.9	0	0	0	110.2	G521	P519-G521 PolarHBondContact O-N 3.11Å
520	P	47.7	Very low	42.1	Very low	129 Å²	129	129.8 Å²	129.8	84%	0.838	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-66.7	127.8	175.7	29	-30.9	0	0	0	108.2
521	G	55	Low	42.3	Very low	71 Å²	71	126.8 Å²	126.8	73%	0.732	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-58.6	139.4	-176.7	0	0	0	0	0	113	P519	P519-G521 PolarHBondContact O-N 3.11Å
522	S	36.8	Very low	42.8	Very low	201 Å²	201	122.5 Å²	122.5	100%	1.406	83%	0.828	S	S	*	*			trans	-157.1	0	144.3	-69	0	0	0	0	107.6

Retrieved 522 of 522 residues in 457.5 ms (Link to these results)

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