A0A096NJK4_PAPAN Loading...

Serpin family A member 3

AlphaFold DB , UniProt , Accession A0A096NJK4, Species PAPAN (Papio anubis, Olive baboon), Gene SERPINA3, Length 448 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	35.9	Very low	245 Å²	245	168.5 Å²	168.5	100%	1.207	85%	0.847	S	S	*	*				0	127.8	0	-164.6	167.4	170.4	0	0	107.5
2	K	41.3	Very low	35.8	Very low	213 Å²	213	165.3 Å²	165.3	93%	0.926	84%	0.842	S	S	*	*			trans	70.4	111	-162.3	-71.1	-176.5	175.8	179	0	116.1
3	I	34.8	Very low	35.5	Very low	165 Å²	165	161.5 Å²	161.5	85%	0.846	84%	0.84	S	S	*	*			trans	-105.3	144	-173.8	-70.3	165.6	0	0	0	108.3
4	H	35.9	Very low	35.4	Very low	179 Å²	179	158.4 Å²	158.4	83%	0.829	83%	0.832	S	S	*	*			trans	-69.1	142.2	170.4	-95.9	-56.5	0	0	0	113.3
5	H	41.3	Very low	35.2	Very low	182 Å²	182	155.9 Å²	155.9	84%	0.843	83%	0.832	S	S	*	*			trans	-132.3	110.3	145.8	-103.3	-62.3	0	0	0	105.2
6	S	34.5	Very low	35.1	Very low	106 Å²	106	158.8 Å²	158.8	74%	0.741	83%	0.83	S	S	*	*				72.2	107.4	63.7	-153.4	0	0	0	0	114.8
7	R	35.9	Very low	35	Very low	230 Å²	230	159 Å²	159	87%	0.868	83%	0.83	S	S	*	*			trans	-45.3	157.4	159.6	-70.3	167.1	162	179.1	-4.8	113
8	Q	35	Very low	34.8	Very low	168 Å²	168	159.9 Å²	159.9	79%	0.785	83%	0.829	S	S	*	*				170.5	145.3	91.1	-123.6	174.4	-10.7	0	0	114.8
9	T	31.7	Very low	34.7	Very low	128 Å²	128	159.8 Å²	159.8	79%	0.785	83%	0.829	S	S	*	*			trans	63.8	148.3	146.1	38.5	0	0	0	0	121.1
10	A	31.7	Very low	35.1	Very low	80 Å²	80	158 Å²	158	66%	0.661	83%	0.828	S	S	*	*			cis	-173.6	147.6	-10.5	0	0	0	0	0	106
11	L	32.6	Very low	35.2	Very low	158 Å²	158	159.4 Å²	159.4	83%	0.827	83%	0.83	S	S	*	*				165.3	116.9	91.2	-95.8	147.7	0	0	0	106.7
12	V	34.7	Very low	34.8	Very low	129 Å²	129	152.8 Å²	152.8	78%	0.782	81%	0.814	S	S	*	*				47.2	111.6	106.7	-171	0	0	0	0	117
13	S	31.9	Very low	34.4	Very low	117 Å²	117	151.8 Å²	151.8	82%	0.818	81%	0.813	S	S	*	*			trans	-160.3	115.2	133.3	-179.4	0	0	0	0	110.7
14	T	33.7	Very low	34.2	Very low	118 Å²	118	152 Å²	152	72%	0.724	82%	0.815	S	S	*	*			trans	-77	143.1	171.3	26.2	0	0	0	0	112.6
15	S	33.3	Very low	34	Very low	120 Å²	120	153.8 Å²	153.8	84%	0.839	82%	0.82	S	S	*	*			trans	-163.3	121.4	138.6	47.6	0	0	0	0	111.5
16	Y	32.5	Very low	33.5	Very low	203 Å²	203	153 Å²	153	80%	0.796	82%	0.819	S	S	*	*			trans	-63.7	162.3	169.8	-88.9	-106.5	0	0	0	112.9
17	I	34.5	Very low	33.4	Very low	162 Å²	162	157.4 Å²	157.4	83%	0.831	83%	0.828	S	S	*	*			trans	164.5	98.9	140.3	-77.3	146.7	0	0	0	105.5
18	Q	30.5	Very low	33.4	Very low	176 Å²	176	157.4 Å²	157.4	82%	0.822	83%	0.828	S	S	*	*				75.7	110.9	73.3	-152.5	164.2	-12.2	0	0	114.3
19	L	34.2	Very low	33.1	Very low	158 Å²	158	158.3 Å²	158.3	83%	0.827	83%	0.834	S	S	*	*			trans	-59.9	162.5	170.6	-81	143.5	0	0	0	112.4
20	P	42.3	Very low	33.1	Very low	122 Å²	122	160 Å²	160	79%	0.792	84%	0.838	S	S	*	*				-144.6	156.6	106.8	33.8	-16.4	0	0	0	116.6
21	E	36.2	Very low	34.2	Very low	188 Å²	188	161.2 Å²	161.2	88%	0.879	84%	0.839	S	S	*	*			trans	-61.7	156.1	161.7	-67.7	167.1	134.8	0	0	112.3
22	A	33.1	Very low	34.1	Very low	106 Å²	106	161.4 Å²	161.4	88%	0.876	84%	0.84	S	S	*	*			trans	-146	133	160.3	0	0	0	0	0	111.5
23	E	31.5	Very low	34	Very low	192 Å²	192	162.8 Å²	162.8	90%	0.897	84%	0.842	S	S	*	*			trans	-80.2	160.6	-167.8	-64.7	170.2	126.6	0	0	114.8
24	L	32.4	Very low	34	Very low	171 Å²	171	161.3 Å²	161.3	90%	0.895	84%	0.837	S	S	*	*			trans	-59.8	141.5	162.5	-91.4	83.3	0	0	0	112.2
25	K	30.5	Very low	33.9	Very low	216 Å²	216	164 Å²	164	94%	0.939	85%	0.846	S	S	*	*			trans	-139.3	130.3	147.2	-112.9	177.8	-175.8	176.5	0	112.4
26	M	31.2	Very low	33.7	Very low	166 Å²	166	161.5 Å²	161.5	82%	0.818	84%	0.839	S	S	*	*			trans	-87.8	137.2	178.9	167.5	-175.3	66.8	0	0	109.6
27	E	32.4	Very low	33.8	Very low	198 Å²	198	159.2 Å²	159.2	93%	0.925	84%	0.84	S	S	*	*			trans	-151.2	132.5	155.1	-124.3	169	-172.6	0	0	112.9
28	R	35.1	Very low	33.6	Very low	230 Å²	230	158.5 Å²	158.5	87%	0.868	84%	0.837	S	S	*	*			trans	-81.8	152.2	178.6	-78.6	167.7	152.8	174.3	-6.9	110.6
29	M	28.5	Very low	33.8	Very low	186 Å²	186	157.1 Å²	157.1	92%	0.916	84%	0.84	S	S	*	*				174.5	129.5	121.6	-95.9	-163.3	-49.1	0	0	112.9
30	L	32.4	Very low	33.7	Very low	164 Å²	164	154 Å²	154	86%	0.859	84%	0.837	S	S	*	*			trans	-111.1	-179.1	152.3	-99.8	108.2	0	0	0	106.7
31	P	55.2	Low	33.1	Very low	105 Å²	105	151.1 Å²	151.1	68%	0.682	83%	0.83	S	S	*	*			cis	-134.2	-174.3	-29.6	32	-11.4	0	0	0	112.5
32	L	31.2	Very low	32.8	Very low	162 Å²	162	152.2 Å²	152.2	85%	0.848	83%	0.832	S	S	*	*			trans	173.8	107.3	148.7	-91.1	149.8	0	0	0	109.2
33	L	31.9	Very low	32.8	Very low	159 Å²	159	153 Å²	153	83%	0.832	83%	0.83	S	S	*	*				77.9	104.2	87.1	-91	166.8	0	0	0	118
34	A	32.5	Very low	33.1	Very low	85 Å²	85	149.3 Å²	149.3	70%	0.702	82%	0.823	S	S	*	*			trans	46.2	129.4	131.4	0	0	0	0	0	124.7
35	L	30.3	Very low	33.3	Very low	174 Å²	174	146 Å²	146	91%	0.911	82%	0.819	S	S	*	*				172.4	123.8	117.7	-129.5	70.4	0	0	0	109.5
36	G	29.9	Very low	33.5	Very low	68 Å²	68	141.5 Å²	141.5	70%	0.701	81%	0.81	S	S	*	*				71.6	129.9	85.7	0	0	0	0	0	112.6
37	L	34.2	Very low	33.5	Very low	156 Å²	156	141.3 Å²	141.3	82%	0.817	81%	0.811	S	S	*	*			cis	-172.6	155.5	21.7	-98.1	153.9	0	0	0	110
38	L	31.2	Very low	33.2	Very low	147 Å²	147	138 Å²	138	77%	0.77	81%	0.809	S	S	*	*			trans	48.7	131.8	144.7	-75.1	162.2	0	0	0	122.4
39	V	33.1	Very low	32.9	Very low	146 Å²	146	137.8 Å²	137.8	89%	0.885	81%	0.81	S	S	*	*				-166.2	144	106.7	166.3	0	0	0	0	110.2
40	A	32.3	Very low	33.7	Very low	92 Å²	92	133.6 Å²	133.6	76%	0.76	80%	0.796	S	S	*	*			trans	-78.2	165.4	-169.5	0	0	0	0	0	116.8
41	G	29.5	Very low	33.6	Very low	63 Å²	63	133.3 Å²	133.3	65%	0.649	80%	0.795	S	S	*	*			trans	106.6	105.9	132.9	0	0	0	0	0	117.1
42	F	30.5	Very low	32.1	Very low	210 Å²	210	134.4 Å²	134.4	92%	0.921	80%	0.804	S	S	*	*				149.2	113.7	121	-94.4	-88.5	0	0	0	111.7
43	C	33.3	Very low	32.3	Very low	122 Å²	122	132.4 Å²	132.4	82%	0.824	80%	0.801	S	S	*	*			trans	-64.1	154.5	158.7	-76.8	0	0	0	0	110.5
44	P	36.8	Very low	32.5	Very low	116 Å²	116	133 Å²	133	75%	0.753	80%	0.804	S	S	*	*				-127.2	135.5	124.2	27.4	-13.3	0	0	0	111.6
45	A	37.7	Very low	32.4	Very low	100 Å²	100	136.5 Å²	136.5	83%	0.826	81%	0.811	S	S	*	*			trans	-64.3	130.1	169.5	0	0	0	0	0	110.5
46	V	34.1	Very low	32.8	Very low	123 Å²	123	138 Å²	138	75%	0.745	81%	0.81	S	S	*	*			trans	-134.5	101	162.1	179.9	0	0	0	0	108.3
47	L	31.3	Very low	33	Very low	161 Å²	161	143.6 Å²	143.6	84%	0.843	82%	0.818	S	S	*	*			trans	29.6	107.9	139.8	-62.8	160.6	0	0	0	118
48	C	26.6	Very low	33	Very low	128 Å²	128	143.2 Å²	143.2	87%	0.865	82%	0.817	S	S	*	*			trans	-113.4	124.7	156.8	-72.6	0	0	0	0	110.3
49	Y	28.8	Very low	33.3	Very low	227 Å²	227	140 Å²	140	89%	0.89	80%	0.804	S	S	*	*			trans	-103	158.1	151.8	-98.5	-87.1	0	0	0	108.5
50	P	45.8	Very low	33.9	Very low	97 Å²	97	137.1 Å²	137.1	63%	0.63	79%	0.787	S	S	*	*			trans	-94.6	149.4	-150.4	36.5	-34.2	0	0	0	113.6
51	N	29.3	Very low	34.2	Very low	158 Å²	158	140.8 Å²	140.8	85%	0.845	79%	0.789	S	S	*	*			trans	159.5	105.6	131.3	-83.9	-20.7	0	0	0	112.2
52	C	24.6	Very low	34.5	Very low	128 Å²	128	145.5 Å²	145.5	87%	0.865	79%	0.794	S	S	*	*			trans	-169.6	121.2	141.6	-127	0	0	0	0	109.6
53	P	34.3	Very low	35.1	Very low	120 Å²	120	140.4 Å²	140.4	78%	0.779	78%	0.776	S	S	*	*			trans	-101.9	116.5	169.7	33.3	-22.2	0	0	0	110
54	L	37.5	Very low	35.6	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	76%	0.762	S	S	*	*			trans	-151.7	78	155.4	-85.6	179.8	0	0	0	107.5
55	D	29.3	Very low	35.7	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	76%	0.757	S	S	*	*			trans	-107.3	122.7	161.4	-86.2	-33.5	0	0	0	109	E57	D55-E57 PolarHBondContact O-N 3.03Å; D55-E57 VanDerWaalsContact O-N 3.12Å
56	K	38.6	Very low	36.2	Very low	206 Å²	206	143.7 Å²	143.7	90%	0.896	75%	0.749	S	S	*	*			trans	-61.3	104.8	155.4	-80.5	175.5	172.4	178.1	0	106	N58	K56-N58 PolarHBondContact O-N 3.13Å; K56-N58 VanDerWaalsContact O-N 3.13Å
57	E	34.3	Very low	37	Very low	186 Å²	186	138.8 Å²	138.8	87%	0.869	72%	0.724	S	S	*	*			trans	-63	114.6	169.5	-74	-179.9	165.1	0	0	108.5	D55	D55-E57 PolarHBondContact O-N 3.03Å; D55-E57 VanDerWaalsContact O-N 3.12Å
58	N	34.6	Very low	38.1	Very low	148 Å²	148	135 Å²	135	79%	0.791	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.8	157.2	-84.3	-24.6	0	0	0	106.9	K56 T60	K56-N58 PolarHBondContact O-N 3.13Å; K56-N58 VanDerWaalsContact O-N 3.13Å; N58-T60 PolarHBondContact O-N 3.44Å
59	P	37.9	Very low	39.5	Very low	78 Å²	78	135.9 Å²	135.9	51%	0.506	70%	0.698	S	S	.	*	P	Polyproline II helix	trans	-58.4	133.1	-178.7	21.6	-30.3	0	0	0	110.1	D63 Q64	P59-D63 HydrophobicContact CB-CB 4.4Å; P59-Q64 HydrophobicContact CB-CG 4.37Å; P59-Q64 HydrophobicContact CG-CG 4.44Å
60	T	45.3	Very low	40.8	Very low	86 Å²	86	127.5 Å²	127.5	53%	0.528	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-64.8	155.6	175.6	45.6	0	0	0	0	110.1	N58 E62 D63 Q64	N58-T60 PolarHBondContact O-N 3.44Å; T60-E62 PolarHBondContact O-N 2.94Å; T60-D63 PolarHBondContact O-N 3.13Å; T60-Q64 PolarHBondContact O-N 3.05Å; T60-Q64 VanDerWaalsContact O-N 3.11Å
61	Q	38.8	Very low	41.5	Very low	170 Å²	170	124.1 Å²	124.1	79%	0.794	65%	0.647	S	S	*	*	H	α-helix	trans	-60.1	-28.5	-179.9	-166.5	167.6	-23.5	0	0	112.2	D65	Q61-D65 WeakPolarHBondContact O-CB 3.31Å; Q61-D65 PolarHBondContact O-N 3.16Å
62	E	35.7	Very low	43.1	Very low	162 Å²	162	121 Å²	121	76%	0.757	63%	0.63	S	S	*	*	H	α-helix	trans	-68.9	-37.7	172.2	-72.1	-177.4	165.7	0	0	113.1	T60 R66	T60-E62 PolarHBondContact O-N 2.94Å; E62-R66 WeakPolarHBondContact O-CB 3.49Å; E62-R66 PolarHBondContact O-N 2.96Å
63	D	41.4	Very low	45.5	Very low	103 Å²	103	116.8 Å²	116.8	55%	0.551	61%	0.608	S	S	*	*	H	α-helix	trans	-69.9	-33.4	175.3	-92.8	-17.6	0	0	0	111.9	P59 T60 G67	P59-D63 HydrophobicContact CB-CB 4.4Å; T60-D63 PolarHBondContact O-N 3.13Å; D63-G67 PolarHBondContact O-N 3.41Å
64	Q	44.6	Very low	47.8	Very low	111 Å²	111	111.3 Å²	111.3	52%	0.519	57%	0.572	S	S	.	*	H	α-helix	trans	-70.1	-42.8	174.1	-71.8	-175.7	-14.9	0	0	112.3	P59 T60 G67 T68	P59-Q64 HydrophobicContact CB-CG 4.37Å; P59-Q64 HydrophobicContact CG-CG 4.44Å; T60-Q64 PolarHBondContact O-N 3.05Å; T60-Q64 VanDerWaalsContact O-N 3.11Å; Q64-G67 PolarHBondContact O-N 2.9Å; Q64-T68 WeakPolarHBondContact O-CB 3.49Å; Q64-T68 PolarHBondContact O-N 3.47Å; Q64-T68 PolarHBondContact O-OG1 3.31Å
65	D	39.2	Very low	50.1	Low	121 Å²	121	103.1 Å²	103.1	65%	0.647	53%	0.529	S	S	*	.	H	α-helix	trans	-70.4	-38.1	-179.8	-147.4	21.6	0	0	0	111.1	Q61 T68 H69	Q61-D65 WeakPolarHBondContact O-CB 3.31Å; Q61-D65 PolarHBondContact O-N 3.16Å; D65-T68 PolarHBondContact O-N 3.35Å; D65-H69 WeakPolarHBondContact O-CB 3.39Å; D65-H69 PolarHBondContact O-N 2.9Å
66	R	48.2	Very low	52.8	Low	174 Å²	174	98 Å²	98	66%	0.657	51%	0.506	S	S	*	.	H	α-helix	trans	-67.6	-42.3	173.7	-160.7	175.5	-169.8	-176.4	1.9	112	E62 H69 V70	E62-R66 WeakPolarHBondContact O-CB 3.49Å; E62-R66 PolarHBondContact O-N 2.96Å; R66-H69 PolarHBondContact O-N 3.18Å; R66-V70 WeakPolarHBondContact O-CB 3.3Å; R66-V70 WeakPolarHBondContact O-CG2 3.1Å; R66-V70 PolarHBondContact O-N 3.19Å
67	G	50.9	Low	55.4	Low	21 Å²	21	89.6 Å²	89.6	22%	0.216	47%	0.472	C	S	.	.	H	α-helix	trans	-61.3	-42.2	173.9	0	0	0	0	0	112.8	D63 Q64 V70 D71	D63-G67 PolarHBondContact O-N 3.41Å; Q64-G67 PolarHBondContact O-N 2.9Å; G67-V70 PolarHBondContact O-N 2.84Å; G67-D71 WeakPolarHBondContact O-CB 3.47Å; G67-D71 PolarHBondContact O-N 3.39Å
68	T	53.8	Low	58.2	Low	80 Å²	80	81 Å²	81	49%	0.491	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-41.4	178.7	-53.7	0	0	0	0	112	Q64 D65 L72	Q64-T68 WeakPolarHBondContact O-CB 3.49Å; Q64-T68 PolarHBondContact O-N 3.47Å; Q64-T68 PolarHBondContact O-OG1 3.31Å; D65-T68 PolarHBondContact O-N 3.35Å; T68-L72 HydrophobicContact CG2-CD1 4.25Å; T68-L72 WeakPolarHBondContact O-CD1 3.17Å; T68-L72 WeakPolarHBondContact O-CG 3.45Å; T68-L72 PolarHBondContact O-N 3.1Å
69	H	55.4	Low	61.1	Low	148 Å²	148	74.1 Å²	74.1	69%	0.685	40%	0.395	S	S	*	.	H	α-helix	trans	-68	-38.1	177.2	-169.2	-82.3	0	0	0	112.4	D65 R66 G73	D65-H69 WeakPolarHBondContact O-CB 3.39Å; D65-H69 PolarHBondContact O-N 2.9Å; R66-H69 PolarHBondContact O-N 3.18Å; H69-G73 PolarHBondContact O-N 3.15Å
70	V	57.6	Low	63.8	Low	51 Å²	51	73 Å²	73	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176.6	170.1	0	0	0	0	111.3	R66 G67 L72 G73 L74 S143	R66-V70 WeakPolarHBondContact O-CB 3.3Å; R66-V70 WeakPolarHBondContact O-CG2 3.1Å; R66-V70 PolarHBondContact O-N 3.19Å; G67-V70 PolarHBondContact O-N 2.84Å; V70-L72 PolarHBondContact O-N 3.06Å; V70-G73 PolarHBondContact O-N 2.84Å; V70-L74 PolarHBondContact O-N 3.31Å; V70-L74 VanDerWaalsContact O-N 3.13Å; V70-S143 WeakPolarHBondContact CG1-OG 3.44Å
71	D	60.7	Low	66.3	Low	26 Å²	26	69 Å²	69	14%	0.139	36%	0.36	C	S	.	.	H	α-helix	trans	-65.8	-36.8	178	-93.2	-2.3	0	0	0	113.4	G67 A75 H146	G67-D71 WeakPolarHBondContact O-CB 3.47Å; G67-D71 PolarHBondContact O-N 3.39Å; D71-A75 VanDerWaalsContact O-CB 3.29Å; D71-A75 WeakPolarHBondContact O-CB 3.2Å; D71-A75 PolarHBondContact O-N 3.32Å; D71-H146 IonicContact OD1-CD2 2.68Å; D71-H146 PolarHBondContact OD1-CD2 2.71Å; D71-H146 VanDerWaalsContact OD1-CD2 3.3Å; D71-H146 IonicContact OD2-CD2 3.29Å; D71-H146 PolarHBondContact OD2-CD2 3.01Å; D71-H146 VanDerWaalsContact OD2-CD2 3.27Å; D71-H146 IonicContact OD2-NE2 2.74Å
72	L	62.4	Low	69.1	Low	92 Å²	92	60.9 Å²	60.9	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-40.8	177.5	-76.2	164.6	0	0	0	112.3	T68 V70 A75 S76	T68-L72 HydrophobicContact CG2-CD1 4.25Å; T68-L72 WeakPolarHBondContact O-CD1 3.17Å; T68-L72 WeakPolarHBondContact O-CG 3.45Å; T68-L72 PolarHBondContact O-N 3.1Å; V70-L72 PolarHBondContact O-N 3.06Å; L72-A75 PolarHBondContact O-N 2.63Å; L72-S76 PolarHBondContact O-N 3Å; L72-S76 VanDerWaalsContact O-N 3.15Å
73	G	75.6	Confident	72	Confident	40 Å²	40	53.3 Å²	53.3	41%	0.412	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-42.9	177.2	0	0	0	0	0	112.9	H69 V70 T77	H69-G73 PolarHBondContact O-N 3.15Å; V70-G73 PolarHBondContact O-N 2.84Å; G73-T77 PolarHBondContact O-N 3.13Å; G73-T77 PolarHBondContact O-OG1 3.24Å
74	L	82.6	Confident	74.7	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-43.9	174.4	177.4	62.1	0	0	0	111.4	V70 S76 T77 N78 F130 F144 L147	V70-L74 PolarHBondContact O-N 3.31Å; V70-L74 VanDerWaalsContact O-N 3.13Å; L74-S76 PolarHBondContact O-N 2.78Å; L74-T77 PolarHBondContact O-N 2.96Å; L74-N78 WeakPolarHBondContact O-CB 3.3Å; L74-N78 PolarHBondContact O-N 2.78Å; L74-F130 HydrophobicContact CD1-CE1 3.83Å; L74-F130 HydrophobicContact CD1-CZ 3.51Å; L74-F144 HydrophobicContact CD1-CD2 4.33Å; L74-F144 HydrophobicContact CD1-CE1 4.33Å; L74-F144 HydrophobicContact CD1-CE2 3.89Å; L74-F144 HydrophobicContact CD1-CZ 3.89Å; L74-F144 HydrophobicContact CD2-CD1 4.39Å; L74-F144 HydrophobicContact CD2-CG 4.44Å; L74-L147 HydrophobicContact CD2-CB 4.18Å; L74-L147 HydrophobicContact CD2-CD2 3.86Å
75	A	84.1	Confident	77.1	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-45	-178.2	0	0	0	0	0	112.1	D71 L72 T77 N78 V79 Q434	D71-A75 VanDerWaalsContact O-CB 3.29Å; D71-A75 WeakPolarHBondContact O-CB 3.2Å; D71-A75 PolarHBondContact O-N 3.32Å; L72-A75 PolarHBondContact O-N 2.63Å; A75-T77 VanDerWaalsContact C-N 3.32Å; A75-T77 PolarHBondContact O-N 2.67Å; A75-N78 PolarHBondContact O-N 3Å; A75-V79 WeakPolarHBondContact O-CG2 3.44Å; A75-V79 PolarHBondContact O-N 3.42Å; A75-Q434 HydrophobicContact CB-CB 3.76Å
76	S	87.8	Confident	79.9	Confident	51 Å²	51	38.3 Å²	38.3	36%	0.357	21%	0.212	S	C	.	.	H	α-helix	trans	-60.2	-42.9	176.2	-171	0	0	0	0	112.1	L72 L74 V79 D80	L72-S76 PolarHBondContact O-N 3Å; L72-S76 VanDerWaalsContact O-N 3.15Å; L74-S76 PolarHBondContact O-N 2.78Å; S76-V79 PolarHBondContact O-N 3.24Å; S76-D80 PolarHBondContact O-N 3.44Å
77	T	92.3	Very high	82.2	Confident	29 Å²	29	33.1 Å²	33.1	18%	0.178	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-45.9	177.7	-57.2	0	0	0	0	111.4	G73 L74 A75 V79 D80 F81 L128 K129 F130	G73-T77 PolarHBondContact O-N 3.13Å; G73-T77 PolarHBondContact O-OG1 3.24Å; L74-T77 PolarHBondContact O-N 2.96Å; A75-T77 VanDerWaalsContact C-N 3.32Å; A75-T77 PolarHBondContact O-N 2.67Å; T77-V79 VanDerWaalsContact C-N 3.29Å; T77-V79 PolarHBondContact O-N 2.92Å; T77-D80 PolarHBondContact O-N 2.91Å; T77-F81 PolarHBondContact O-N 3.46Å; T77-L128 VanDerWaalsContact CG2-O 3.24Å; T77-L128 WeakPolarHBondContact CG2-O 3.15Å; T77-K129 HydrophobicContact CG2-CB 3.93Å; T77-F130 HydrophobicContact CG2-CD1 3.8Å; T77-F130 HydrophobicContact CG2-CD2 4.36Å; T77-F130 HydrophobicContact CG2-CE1 3.82Å; T77-F130 HydrophobicContact CG2-CE2 4.37Å; T77-F130 HydrophobicContact CG2-CG 4.07Å; T77-F130 HydrophobicContact CG2-CZ 4.1Å
78	N	93.1	Very high	84.3	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-35	175.5	-82.6	-26.4	0	0	0	112.5	L74 A75 A82 S106 N435	L74-N78 WeakPolarHBondContact O-CB 3.3Å; L74-N78 PolarHBondContact O-N 2.78Å; A75-N78 PolarHBondContact O-N 3Å; N78-A82 VanDerWaalsContact O-CB 3.27Å; N78-A82 WeakPolarHBondContact O-CB 3.11Å; N78-A82 PolarHBondContact O-N 3.48Å; N78-S106 WeakPolarHBondContact OD1-CB 3.47Å; N78-S106 PolarHBondContact OD1-OG 3.35Å; N78-N435 PolarHBondContact ND2-OD1 2.83Å
79	V	95	Very high	86.2	Confident	4 Å²	4	31 Å²	31	2%	0.024	17%	0.173	C	C	.	.	H	α-helix	trans	-69.8	-41	177.3	173.6	0	0	0	0	111.4	A75 S76 T77 A82 F83 P318 L321 Q434 I436	A75-V79 WeakPolarHBondContact O-CG2 3.44Å; A75-V79 PolarHBondContact O-N 3.42Å; S76-V79 PolarHBondContact O-N 3.24Å; T77-V79 VanDerWaalsContact C-N 3.29Å; T77-V79 PolarHBondContact O-N 2.92Å; V79-A82 WeakPolarHBondContact O-CB 3.47Å; V79-A82 PolarHBondContact O-N 2.97Å; V79-F83 HydrophobicContact CG1-CD2 3.76Å; V79-F83 HydrophobicContact CG1-CE2 3.32Å; V79-F83 HydrophobicContact CG1-CZ 4.07Å; V79-F83 WeakPolarHBondContact O-CD2 3.4Å; V79-F83 PolarHBondContact O-N 2.88Å; V79-P318 HydrophobicContact CB-CB 4.44Å; V79-P318 HydrophobicContact CB-CG 4.45Å; V79-P318 HydrophobicContact CG1-CB 3.93Å; V79-P318 HydrophobicContact CG1-CG 4.02Å; V79-L321 HydrophobicContact CG1-CD2 4.06Å; V79-L321 HydrophobicContact CG2-CD2 4.27Å; V79-Q434 WeakPolarHBondContact CG2-O 3.33Å; V79-I436 HydrophobicContact CB-CD1 4.43Å; V79-I436 HydrophobicContact CG1-CD1 4.16Å; V79-I436 HydrophobicContact CG2-CD1 3.98Å; V79-I436 HydrophobicContact CG2-CG1 4.12Å
80	D	95.7	Very high	88	Confident	56 Å²	56	24.7 Å²	24.7	30%	0.299	15%	0.145	S	C	.	.	H	α-helix	trans	-63.9	-44.8	174.5	-176.6	15.1	0	0	0	111.1	S76 T77 A82 F83 S84 K129 P318	S76-D80 PolarHBondContact O-N 3.44Å; T77-D80 PolarHBondContact O-N 2.91Å; D80-A82 VanDerWaalsContact C-N 3.3Å; D80-A82 PolarHBondContact O-N 2.85Å; D80-F83 PolarHBondContact O-N 3.42Å; D80-S84 WeakPolarHBondContact O-CB 3.36Å; D80-S84 PolarHBondContact O-N 3.26Å; D80-S84 PolarHBondContact O-OG 3.37Å; D80-S84 VanDerWaalsContact O-OG 3.05Å; D80-S84 PolarHBondContact OD1-OG 2.97Å; D80-K129 HydrophobicContact CB-CB 4.42Å; D80-K129 HydrophobicContact CB-CG 4.17Å; D80-P318 HydrophobicContact CB-CG 3.87Å
81	F	97.3	Very high	89.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-56.5	-45.4	172	172.5	-107.6	0	0	0	111.5	T77 F83 S84 L85 I105 L109 G127 L128 K129 L356	T77-F81 PolarHBondContact O-N 3.46Å; F81-F83 PolarHBondContact O-N 2.86Å; F81-S84 PolarHBondContact O-N 3Å; F81-L85 HydrophobicContact CE1-CD2 4Å; F81-L85 HydrophobicContact CZ-CB 4.46Å; F81-L85 HydrophobicContact CZ-CD2 3.87Å; F81-L85 VanDerWaalsContact O-CB 3.28Å; F81-L85 WeakPolarHBondContact O-CB 3.49Å; F81-L85 PolarHBondContact O-N 3.45Å; F81-I105 HydrophobicContact CE1-CB 4.34Å; F81-I105 HydrophobicContact CE1-CG2 4.03Å; F81-I105 HydrophobicContact CZ-CG2 3.84Å; F81-L109 HydrophobicContact CE2-CD1 4.42Å; F81-L109 HydrophobicContact CZ-CD1 4.01Å; F81-G127 WeakPolarHBondContact CD2-O 3.41Å; F81-L128 HydrophobicContact CD1-CD2 4.25Å; F81-L128 HydrophobicContact CD2-CD2 4Å; F81-L128 HydrophobicContact CE1-CD2 4.14Å; F81-L128 HydrophobicContact CE2-CD2 3.88Å; F81-L128 HydrophobicContact CG-CD2 4.17Å; F81-L128 HydrophobicContact CZ-CD2 3.96Å; F81-K129 HydrophobicContact CB-CG 4.08Å; F81-L356 HydrophobicContact CE2-CD1 3.93Å
82	A	97.3	Very high	91	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57	-47.6	179.8	0	0	0	0	0	112.8	N78 V79 D80 Y86 P102 I436 I439	N78-A82 VanDerWaalsContact O-CB 3.27Å; N78-A82 WeakPolarHBondContact O-CB 3.11Å; N78-A82 PolarHBondContact O-N 3.48Å; V79-A82 WeakPolarHBondContact O-CB 3.47Å; V79-A82 PolarHBondContact O-N 2.97Å; D80-A82 VanDerWaalsContact C-N 3.3Å; D80-A82 PolarHBondContact O-N 2.85Å; A82-Y86 WeakPolarHBondContact O-CB 3.23Å; A82-Y86 PolarHBondContact O-N 3.09Å; A82-P102 HydrophobicContact CB-CB 3.28Å; A82-P102 HydrophobicContact CB-CG 3.41Å; A82-P102 VanDerWaalsContact CB-CG 3.41Å; A82-I436 HydrophobicContact CB-CD1 4Å; A82-I439 HydrophobicContact CB-CD1 3.82Å
83	F	97.3	Very high	92.2	Very high	3 Å²	3	30 Å²	30	1%	0.013	17%	0.171	C	C	.	.	H	α-helix	trans	-75.8	-33	-179.3	-63.5	-40.3	0	0	0	112.9	V79 D80 F81 Y86 K87 L316 L317 L321 I427 I436 I439	V79-F83 HydrophobicContact CG1-CD2 3.76Å; V79-F83 HydrophobicContact CG1-CE2 3.32Å; V79-F83 HydrophobicContact CG1-CZ 4.07Å; V79-F83 WeakPolarHBondContact O-CD2 3.4Å; V79-F83 PolarHBondContact O-N 2.88Å; D80-F83 PolarHBondContact O-N 3.42Å; F81-F83 PolarHBondContact O-N 2.86Å; F83-Y86 PolarHBondContact O-N 3.48Å; F83-K87 VanDerWaalsContact O-CG 3.27Å; F83-K87 WeakPolarHBondContact O-CG 3.5Å; F83-K87 PolarHBondContact O-N 3.45Å; F83-L316 HydrophobicContact CB-CB 4.24Å; F83-L316 VanDerWaalsContact CB-O 3.3Å; F83-L316 WeakPolarHBondContact CB-O 3.23Å; F83-L316 HydrophobicContact CD1-CB 3.69Å; F83-L316 HydrophobicContact CD1-CD1 4.32Å; F83-L316 HydrophobicContact CD1-CG 4.41Å; F83-L316 HydrophobicContact CD2-CB 4.38Å; F83-L316 HydrophobicContact CE1-CB 4.07Å; F83-L316 HydrophobicContact CE1-CD2 4.14Å; F83-L316 HydrophobicContact CE1-CG 4.47Å; F83-L316 HydrophobicContact CG-CB 3.86Å; F83-L317 VanDerWaalsContact CE2-C 3.42Å; F83-L317 VanDerWaalsContact CE2-O 3.31Å; F83-L317 WeakPolarHBondContact CE2-O 3.28Å; F83-L321 HydrophobicContact CE2-CB 4.16Å; F83-L321 HydrophobicContact CZ-CB 4.07Å; F83-L321 HydrophobicContact CZ-CD2 4.19Å; F83-I427 HydrophobicContact CE1-CD1 4.18Å; F83-I427 HydrophobicContact CZ-CD1 4.42Å; F83-I436 HydrophobicContact CE1-CD1 4.26Å; F83-I436 HydrophobicContact CZ-CD1 4.14Å; F83-I439 HydrophobicContact CD1-CD1 3.95Å; F83-I439 HydrophobicContact CE1-CD1 3.91Å
84	S	97	Very high	92.7	Very high	20 Å²	20	31.7 Å²	31.7	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-46.8	170.6	-69	0	0	0	0	111.2	D80 F81 K87 Q88 K129	D80-S84 WeakPolarHBondContact O-CB 3.36Å; D80-S84 PolarHBondContact O-N 3.26Å; D80-S84 PolarHBondContact O-OG 3.37Å; D80-S84 VanDerWaalsContact O-OG 3.05Å; D80-S84 PolarHBondContact OD1-OG 2.97Å; F81-S84 PolarHBondContact O-N 3Å; S84-K87 PolarHBondContact O-N 3.09Å; S84-Q88 PolarHBondContact O-N 2.95Å; S84-K129 WeakPolarHBondContact OG-CE 3.24Å; S84-K129 PolarHBondContact OG-NZ 2.99Å
85	L	96.9	Very high	92.8	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-45.3	176.4	178.3	57.8	0	0	0	111.8	F81 K87 Q88 L89 F100 I105 V352 L356	F81-L85 HydrophobicContact CE1-CD2 4Å; F81-L85 HydrophobicContact CZ-CB 4.46Å; F81-L85 HydrophobicContact CZ-CD2 3.87Å; F81-L85 VanDerWaalsContact O-CB 3.28Å; F81-L85 WeakPolarHBondContact O-CB 3.49Å; F81-L85 PolarHBondContact O-N 3.45Å; L85-K87 VanDerWaalsContact C-N 3.31Å; L85-K87 PolarHBondContact O-N 3Å; L85-Q88 PolarHBondContact O-N 3.49Å; L85-L89 HydrophobicContact CD1-CD1 4.27Å; L85-L89 HydrophobicContact CD1-CG 4.2Å; L85-L89 HydrophobicContact CG-CD1 4.11Å; L85-L89 HydrophobicContact CG-CG 4.46Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 2.86Å; L85-F100 HydrophobicContact CB-CE2 4.23Å; L85-F100 HydrophobicContact CB-CZ 4.39Å; L85-F100 HydrophobicContact CD2-CD2 3.74Å; L85-F100 HydrophobicContact CD2-CE2 3.5Å; L85-F100 HydrophobicContact CD2-CZ 4.34Å; L85-F100 HydrophobicContact CG-CD2 4.31Å; L85-F100 HydrophobicContact CG-CE2 3.79Å; L85-F100 HydrophobicContact CG-CZ 4.14Å; L85-I105 HydrophobicContact CD2-CD1 3.62Å; L85-I105 HydrophobicContact CD2-CG2 4.26Å; L85-V352 HydrophobicContact CD1-CG1 3.32Å; L85-L356 HydrophobicContact CB-CD1 4.19Å; L85-L356 HydrophobicContact CD1-CD1 4.07Å
86	Y	97.1	Very high	93.2	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-52.7	-48.9	175.8	176	-91.1	0	0	0	112	A82 F83 Q88 L89 V90 F100 E313 L316 L425 I439 K441	A82-Y86 WeakPolarHBondContact O-CB 3.23Å; A82-Y86 PolarHBondContact O-N 3.09Å; F83-Y86 PolarHBondContact O-N 3.48Å; Y86-Q88 VanDerWaalsContact C-N 3.32Å; Y86-Q88 PolarHBondContact O-N 2.77Å; Y86-L89 PolarHBondContact O-N 3.28Å; Y86-V90 HydrophobicContact CD1-CG2 4.13Å; Y86-V90 HydrophobicContact CD2-CG2 4.41Å; Y86-V90 HydrophobicContact CE1-CG2 3.58Å; Y86-V90 HydrophobicContact CE2-CG2 3.94Å; Y86-V90 VanDerWaalsContact CZ-CG2 3.48Å; Y86-V90 WeakPolarHBondContact O-CG2 3.31Å; Y86-V90 PolarHBondContact O-N 3.12Å; Y86-F100 HydrophobicContact CD2-CE1 4.01Å; Y86-E313 HydrophobicContact CE1-CB 4.22Å; Y86-E313 HydrophobicContact CE1-CG 3.84Å; Y86-E313 PolarHBondContact OH-OE1 2.86Å; Y86-L316 HydrophobicContact CD1-CD1 3.69Å; Y86-L316 HydrophobicContact CE1-CD1 3.58Å; Y86-L316 HydrophobicContact CG-CD1 4.34Å; Y86-L425 HydrophobicContact CE2-CD2 4.45Å; Y86-L425 WeakPolarHBondContact OH-CD2 3.27Å; Y86-I439 HydrophobicContact CD2-CG2 3.47Å; Y86-I439 VanDerWaalsContact CD2-CG2 3.47Å; Y86-I439 HydrophobicContact CE2-CG2 3.81Å; Y86-I439 HydrophobicContact CG-CG2 4.41Å; Y86-K441 HydrophobicContact CE2-CB 4.22Å
87	K	95.9	Very high	93.5	Very high	64 Å²	64	40.2 Å²	40.2	28%	0.278	21%	0.211	S	C	.	.	H	α-helix	trans	-59.6	-43.2	-179.2	-73.1	169.6	-176.7	178.8	0	111.2	F83 S84 L85 L91 E313 A314 L316	F83-K87 VanDerWaalsContact O-CG 3.27Å; F83-K87 WeakPolarHBondContact O-CG 3.5Å; F83-K87 PolarHBondContact O-N 3.45Å; S84-K87 PolarHBondContact O-N 3.09Å; L85-K87 VanDerWaalsContact C-N 3.31Å; L85-K87 PolarHBondContact O-N 3Å; K87-L91 WeakPolarHBondContact O-CB 3.28Å; K87-L91 WeakPolarHBondContact O-CG 3.07Å; K87-L91 PolarHBondContact O-N 2.84Å; K87-E313 VanDerWaalsContact CE-O 3.31Å; K87-E313 WeakPolarHBondContact CE-O 3.17Å; K87-A314 PolarHBondContact NZ-O 2.84Å; K87-L316 PolarHBondContact NZ-O 3.32Å
88	Q	95.5	Very high	93.6	Very high	51 Å²	51	39 Å²	39	24%	0.238	20%	0.204	C	C	.	.	H	α-helix	trans	-65.1	-40.7	176.5	-63.3	-59.6	-22.9	0	0	112.7	S84 L85 Y86 L91 K92 V352 Q355 L356	S84-Q88 PolarHBondContact O-N 2.95Å; L85-Q88 PolarHBondContact O-N 3.49Å; Y86-Q88 VanDerWaalsContact C-N 3.32Å; Y86-Q88 PolarHBondContact O-N 2.77Å; Q88-L91 PolarHBondContact O-N 3.29Å; Q88-K92 PolarHBondContact O-N 2.85Å; Q88-K92 VanDerWaalsContact O-N 3.08Å; Q88-V352 HydrophobicContact CB-CG1 3.73Å; Q88-Q355 HydrophobicContact CG-CB 4.33Å; Q88-L356 HydrophobicContact CG-CD2 3.81Å; Q88-L356 HydrophobicContact CG-CG 4.22Å
89	L	94.4	Very high	93.6	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-42.8	178.3	-69.4	176.7	0	0	0	112.4	L85 Y86 K92 A93 V98 F100 Y347 V352	L85-L89 HydrophobicContact CD1-CD1 4.27Å; L85-L89 HydrophobicContact CD1-CG 4.2Å; L85-L89 HydrophobicContact CG-CD1 4.11Å; L85-L89 HydrophobicContact CG-CG 4.46Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 2.86Å; Y86-L89 PolarHBondContact O-N 3.28Å; L89-K92 PolarHBondContact O-N 3.28Å; L89-A93 PolarHBondContact O-N 3.29Å; L89-V98 HydrophobicContact CB-CG1 4.16Å; L89-V98 HydrophobicContact CD1-CG1 4.28Å; L89-F100 HydrophobicContact CD1-CB 4.41Å; L89-F100 HydrophobicContact CD1-CD1 3.39Å; L89-F100 HydrophobicContact CD1-CD2 4.39Å; L89-F100 HydrophobicContact CD1-CE1 3.61Å; L89-F100 HydrophobicContact CD1-CG 3.82Å; L89-F100 HydrophobicContact CD1-CZ 4.2Å; L89-Y347 HydrophobicContact CD1-CD1 4.48Å; L89-Y347 HydrophobicContact CD1-CE1 4.09Å; L89-Y347 HydrophobicContact CD2-CD1 3.45Å; L89-Y347 VanDerWaalsContact CD2-CD1 3.45Å; L89-Y347 HydrophobicContact CD2-CE1 3.6Å; L89-Y347 HydrophobicContact CD2-CG 4.29Å; L89-Y347 HydrophobicContact CG-CE1 4.33Å; L89-V352 HydrophobicContact CD2-CG1 4.11Å; L89-V352 HydrophobicContact CD2-CG2 3.9Å; L89-V352 HydrophobicContact CG-CG1 4.41Å
90	V	93.4	Very high	93.6	Very high	16 Å²	16	38.6 Å²	38.6	10%	0.097	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-39.5	176.3	172.8	0	0	0	0	111.3	Y86 K92 A93 P94 V98 K441	Y86-V90 HydrophobicContact CD1-CG2 4.13Å; Y86-V90 HydrophobicContact CD2-CG2 4.41Å; Y86-V90 HydrophobicContact CE1-CG2 3.58Å; Y86-V90 HydrophobicContact CE2-CG2 3.94Å; Y86-V90 VanDerWaalsContact CZ-CG2 3.48Å; Y86-V90 WeakPolarHBondContact O-CG2 3.31Å; Y86-V90 PolarHBondContact O-N 3.12Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 3.29Å; V90-A93 CarbonylContact O-C 3.53Å; V90-A93 VanDerWaalsContact O-C 3.29Å; V90-A93 PolarHBondContact O-N 3.34Å; V90-P94 WeakPolarHBondContact O-CA 3.33Å; V90-P94 VanDerWaalsContact O-N 3.07Å; V90-V98 HydrophobicContact CG2-CG2 3.99Å; V90-K441 HydrophobicContact CG2-CD 4.17Å
91	L	92.1	Very high	93.5	Very high	129 Å²	129	35.9 Å²	35.9	68%	0.675	19%	0.187	S	C	*	.	H	α-helix	trans	-61.9	-38.7	176.2	-73.6	170.9	0	0	0	112.3	K87 Q88	K87-L91 WeakPolarHBondContact O-CB 3.28Å; K87-L91 WeakPolarHBondContact O-CG 3.07Å; K87-L91 PolarHBondContact O-N 2.84Å; Q88-L91 PolarHBondContact O-N 3.29Å
92	K	88.9	Confident	93.5	Very high	118 Å²	118	36 Å²	36	51%	0.513	19%	0.188	S	C	.	.	H	α-helix	trans	-70.9	-30.6	178.8	-165	174	-173.1	174.9	0	112.5	Q88 L89 V90 D351 V352	Q88-K92 PolarHBondContact O-N 2.85Å; Q88-K92 VanDerWaalsContact O-N 3.08Å; L89-K92 PolarHBondContact O-N 3.28Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 3.29Å; K92-D351 IonicContact NZ-OD2 3.78Å; K92-D351 PolarHBondContact NZ-OD2 2.91Å; K92-V352 HydrophobicContact CD-CG2 4.18Å
93	A	86.6	Confident	93.3	Very high	34 Å²	34	36 Å²	36	28%	0.281	19%	0.188	S	C	.	.			trans	-142.1	67.8	-175.1	0	0	0	0	0	112.9	L89 V90 D95 K96	L89-A93 PolarHBondContact O-N 3.29Å; V90-A93 CarbonylContact O-C 3.53Å; V90-A93 VanDerWaalsContact O-C 3.29Å; V90-A93 PolarHBondContact O-N 3.34Å; A93-D95 VanDerWaalsContact C-N 3.28Å; A93-D95 PolarHBondContact O-N 3.32Å; A93-K96 HydrophobicContact CB-CB 3.98Å; A93-K96 HydrophobicContact CB-CG 3.94Å; A93-K96 PolarHBondContact O-N 2.91Å; A93-K96 VanDerWaalsContact O-N 3.14Å
94	P	85.8	Confident	93.1	Very high	75 Å²	75	35.9 Å²	35.9	49%	0.487	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.5	-168.2	23.2	-34.4	0	0	0	114.3	V90 I443	V90-P94 WeakPolarHBondContact O-CA 3.33Å; V90-P94 VanDerWaalsContact O-N 3.07Å; P94-I443 WeakPolarHBondContact O-CD1 3.43Å
95	D	86	Confident	93	Very high	137 Å²	137	35 Å²	35	73%	0.733	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	15.1	-177.9	-64.4	-51.5	0	0	0	113.7	A93	A93-D95 VanDerWaalsContact C-N 3.28Å; A93-D95 PolarHBondContact O-N 3.32Å
96	K	91.3	Very high	93	Very high	96 Å²	96	35 Å²	35	42%	0.417	18%	0.181	S	C	.	.	S	Bend	trans	-114.2	151.5	-179.6	-59.5	-62	-174.2	175.7	0	111.5	A93 V98 I443	A93-K96 HydrophobicContact CB-CB 3.98Å; A93-K96 HydrophobicContact CB-CG 3.94Å; A93-K96 PolarHBondContact O-N 2.91Å; A93-K96 VanDerWaalsContact O-N 3.14Å; K96-V98 PolarHBondContact O-N 3.49Å; K96-I443 VanDerWaalsContact O-CD1 3.22Å; K96-I443 WeakPolarHBondContact O-CD1 3.44Å
97	N	94.2	Very high	92.9	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.011	18%	0.181	C	C	.	.			trans	-57.4	139.7	163.5	-66.8	-15	0	0	0	109.3	I343 K441 I443 N444 Q447	N97-I343 HydrophobicContact CB-CG2 4.46Å; N97-I343 WeakPolarHBondContact ND2-CG2 3.38Å; N97-K441 VanDerWaalsContact CA-O 3.29Å; N97-K441 WeakPolarHBondContact CA-O 3.39Å; N97-I443 PolarHBondContact OD1-N 3.4Å; N97-N444 PolarHBondContact ND2-O 3.08Å; N97-N444 PolarHBondContact OD1-N 2.94Å; N97-Q447 PolarHBondContact ND2-O 3.47Å
98	V	94.8	Very high	92.9	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.018	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.5	172.1	176.9	0	0	0	0	106.8	L89 V90 K96 F100 S440 K441	L89-V98 HydrophobicContact CB-CG1 4.16Å; L89-V98 HydrophobicContact CD1-CG1 4.28Å; V90-V98 HydrophobicContact CG2-CG2 3.99Å; K96-V98 PolarHBondContact O-N 3.49Å; V98-F100 HydrophobicContact CG1-CD1 3.9Å; V98-F100 HydrophobicContact CG1-CE1 4.1Å; V98-S440 CarbonylContact O-C 3.59Å; V98-S440 WeakPolarHBondContact O-CA 3.46Å; V98-S440 PolarHBondContact O-OG 2.63Å; V98-K441 HydrophobicContact CB-CB 4.03Å; V98-K441 HydrophobicContact CG2-CB 4.5Å; V98-K441 PolarHBondContact N-O 2.89Å; V98-K441 PolarHBondContact O-N 3.1Å
99	I	93.5	Very high	93	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	132.5	167.2	175.8	168.8	0	0	0	109.2	I343 R345 Y347 A386 L388 F438 I439	I99-I343 HydrophobicContact CB-CD1 3.85Å; I99-I343 HydrophobicContact CB-CG1 4.33Å; I99-I343 HydrophobicContact CD1-CD1 3.94Å; I99-I343 HydrophobicContact CD1-CG1 3.92Å; I99-I343 HydrophobicContact CG1-CD1 4.41Å; I99-I343 HydrophobicContact CG2-CB 4.49Å; I99-I343 HydrophobicContact CG2-CD1 4.15Å; I99-I343 HydrophobicContact CG2-CG1 4.18Å; I99-R345 HydrophobicContact CG2-CB 3.73Å; I99-R345 HydrophobicContact CG2-CG 3.68Å; I99-Y347 PolarHBondContact N-OH 3.22Å; I99-Y347 WeakPolarHBondContact O-CE2 3.48Å; I99-Y347 VanDerWaalsContact O-CZ 3.28Å; I99-Y347 PolarHBondContact O-OH 3.36Å; I99-A386 HydrophobicContact CD1-CB 4.29Å; I99-A386 HydrophobicContact CG1-CB 3.9Å; I99-L388 HydrophobicContact CD1-CB 3.13Å; I99-L388 HydrophobicContact CD1-CD2 4Å; I99-L388 HydrophobicContact CD1-CG 4.19Å; I99-F438 HydrophobicContact CD1-CD1 4.24Å; I99-F438 HydrophobicContact CG1-CD1 4.29Å; I99-I439 VanDerWaalsContact CA-O 3.31Å; I99-I439 WeakPolarHBondContact CA-O 3.46Å
100	F	94.6	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	169.7	171.3	65.2	-79	0	0	0	109.9	L85 Y86 L89 V98 P102 I105 Y347 H384 F438 I439	L85-F100 HydrophobicContact CB-CE2 4.23Å; L85-F100 HydrophobicContact CB-CZ 4.39Å; L85-F100 HydrophobicContact CD2-CD2 3.74Å; L85-F100 HydrophobicContact CD2-CE2 3.5Å; L85-F100 HydrophobicContact CD2-CZ 4.34Å; L85-F100 HydrophobicContact CG-CD2 4.31Å; L85-F100 HydrophobicContact CG-CE2 3.79Å; L85-F100 HydrophobicContact CG-CZ 4.14Å; Y86-F100 HydrophobicContact CD2-CE1 4.01Å; L89-F100 HydrophobicContact CD1-CB 4.41Å; L89-F100 HydrophobicContact CD1-CD1 3.39Å; L89-F100 HydrophobicContact CD1-CD2 4.39Å; L89-F100 HydrophobicContact CD1-CE1 3.61Å; L89-F100 HydrophobicContact CD1-CG 3.82Å; L89-F100 HydrophobicContact CD1-CZ 4.2Å; V98-F100 HydrophobicContact CG1-CD1 3.9Å; V98-F100 HydrophobicContact CG1-CE1 4.1Å; F100-P102 HydrophobicContact CD2-CG 4.03Å; F100-P102 HydrophobicContact CE2-CB 4Å; F100-P102 HydrophobicContact CE2-CG 3.51Å; F100-P102 HydrophobicContact CZ-CG 4.22Å; F100-I105 HydrophobicContact CB-CD1 4.3Å; F100-I105 HydrophobicContact CD2-CD1 3.93Å; F100-Y347 HydrophobicContact CB-CE2 4.05Å; F100-H384 WeakPolarHBondContact CA-NE2 3.02Å; F100-F438 WeakPolarHBondContact O-CA 3.22Å; F100-I439 HydrophobicContact CE1-CB 4.09Å; F100-I439 HydrophobicContact CE1-CG2 4.45Å; F100-I439 HydrophobicContact CZ-CB 4.22Å; F100-I439 HydrophobicContact CZ-CD1 4.22Å; F100-I439 PolarHBondContact N-O 3.18Å; F100-I439 VanDerWaalsContact N-O 3.07Å; F100-I439 PolarHBondContact O-N 3.06Å
101	S	95	Very high	93.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.			trans	-109	107	169.7	177.3	0	0	0	0	111.5	L103 S104 I105 I236 H384 F437	S101-L103 VanDerWaalsContact C-N 3.33Å; S101-L103 PolarHBondContact O-N 2.77Å; S101-S104 PolarHBondContact O-N 2.87Å; S101-S104 WeakPolarHBondContact OG-CB 3.35Å; S101-S104 PolarHBondContact OG-N 3.28Å; S101-I105 WeakPolarHBondContact O-CG1 3.27Å; S101-I105 PolarHBondContact O-N 3.42Å; S101-I105 VanDerWaalsContact O-N 3.12Å; S101-I236 WeakPolarHBondContact OG-CD1 3.13Å; S101-H384 PolarHBondContact N-NE2 2.95Å; S101-F437 VanDerWaalsContact CA-O 3.28Å; S101-F437 WeakPolarHBondContact CA-O 3.49Å; S101-F437 WeakPolarHBondContact CB-O 3.48Å; S101-F437 PolarHBondContact OG-O 3.11Å
102	P	95.4	Very high	93.5	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-44	177.2	-16.6	24.1	0	0	0	112.7	A82 F100 S104 I105 S106 I436 I439	A82-P102 HydrophobicContact CB-CB 3.28Å; A82-P102 HydrophobicContact CB-CG 3.41Å; A82-P102 VanDerWaalsContact CB-CG 3.41Å; F100-P102 HydrophobicContact CD2-CG 4.03Å; F100-P102 HydrophobicContact CE2-CB 4Å; F100-P102 HydrophobicContact CE2-CG 3.51Å; F100-P102 HydrophobicContact CZ-CG 4.22Å; P102-S104 VanDerWaalsContact C-N 3.31Å; P102-S104 PolarHBondContact O-N 2.99Å; P102-I105 PolarHBondContact O-N 3.35Å; P102-S106 WeakPolarHBondContact O-CB 3.29Å; P102-S106 PolarHBondContact O-N 2.68Å; P102-S106 PolarHBondContact O-OG 2.81Å; P102-I436 HydrophobicContact CG-CB 4.24Å; P102-I436 HydrophobicContact CG-CG2 4Å; P102-I439 HydrophobicContact CG-CD1 3.83Å; P102-I439 HydrophobicContact CG-CG1 3.89Å
103	L	93.2	Very high	94	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-41.6	-179.5	-171.7	63.7	0	0	0	112.4	S101 S106 T107 L147 L151 M162 N435 I436 F437	S101-L103 VanDerWaalsContact C-N 3.33Å; S101-L103 PolarHBondContact O-N 2.77Å; L103-S106 PolarHBondContact O-OG 3.46Å; L103-T107 VanDerWaalsContact O-CB 3.3Å; L103-T107 WeakPolarHBondContact O-CB 3.14Å; L103-T107 PolarHBondContact O-N 3.41Å; L103-T107 PolarHBondContact O-OG1 3.43Å; L103-L147 HydrophobicContact CD1-CD2 3.52Å; L103-L147 HydrophobicContact CG-CD2 4.46Å; L103-L151 HydrophobicContact CD2-CD1 3.74Å; L103-M162 HydrophobicContact CG-SD 4.44Å; L103-N435 HydrophobicContact CD1-CB 4.19Å; L103-N435 HydrophobicContact CD2-CB 4.31Å; L103-I436 VanDerWaalsContact CB-O 3.31Å; L103-I436 WeakPolarHBondContact CB-O 3.31Å; L103-F437 HydrophobicContact CD2-CD1 3.72Å; L103-F437 HydrophobicContact CD2-CE1 3.83Å
104	S	93.1	Very high	94.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.2	-47.2	179.1	-162.6	0	0	0	0	110.6	S101 P102 T107 A108 M162 N234	S101-S104 PolarHBondContact O-N 2.87Å; S101-S104 WeakPolarHBondContact OG-CB 3.35Å; S101-S104 PolarHBondContact OG-N 3.28Å; P102-S104 VanDerWaalsContact C-N 3.31Å; P102-S104 PolarHBondContact O-N 2.99Å; S104-T107 PolarHBondContact O-N 2.8Å; S104-A108 PolarHBondContact O-N 2.92Å; S104-M162 VanDerWaalsContact CA-SD 3.58Å; S104-M162 WeakPolarHBondContact OG-CG 3.49Å; S104-N234 VanDerWaalsContact CB-OD1 3.25Å; S104-N234 WeakPolarHBondContact CB-OD1 3.43Å; S104-N234 PolarHBondContact O-ND2 2.72Å; S104-N234 PolarHBondContact OG-ND2 2.94Å; S104-N234 PolarHBondContact OG-OD1 3.11Å
105	I	95.6	Very high	95	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-65.8	-44.7	178.1	-64.2	168	0	0	0	111.3	F81 L85 F100 S101 P102 T107 A108 L109 L349 H384	F81-I105 HydrophobicContact CE1-CB 4.34Å; F81-I105 HydrophobicContact CE1-CG2 4.03Å; F81-I105 HydrophobicContact CZ-CG2 3.84Å; L85-I105 HydrophobicContact CD2-CD1 3.62Å; L85-I105 HydrophobicContact CD2-CG2 4.26Å; F100-I105 HydrophobicContact CB-CD1 4.3Å; F100-I105 HydrophobicContact CD2-CD1 3.93Å; S101-I105 WeakPolarHBondContact O-CG1 3.27Å; S101-I105 PolarHBondContact O-N 3.42Å; S101-I105 VanDerWaalsContact O-N 3.12Å; P102-I105 PolarHBondContact O-N 3.35Å; I105-T107 VanDerWaalsContact C-N 3.28Å; I105-T107 PolarHBondContact O-N 2.67Å; I105-A108 WeakPolarHBondContact O-CB 3.4Å; I105-A108 PolarHBondContact O-N 3.11Å; I105-A108 VanDerWaalsContact O-N 3.12Å; I105-L109 HydrophobicContact CG2-CD1 3.94Å; I105-L109 HydrophobicContact CG2-CG 4.43Å; I105-L109 WeakPolarHBondContact O-CG 3.25Å; I105-L109 PolarHBondContact O-N 3.46Å; I105-L349 HydrophobicContact CD1-CD1 3.75Å; I105-L349 HydrophobicContact CD1-CD2 4.41Å; I105-L349 HydrophobicContact CG1-CD1 3.88Å; I105-L349 HydrophobicContact CG2-CD1 3.84Å; I105-H384 HydrophobicContact CD1-CB 4.24Å; I105-H384 HydrophobicContact CG1-CB 4.16Å
106	S	96.1	Very high	95.6	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-63.5	-38.3	179.6	69.9	0	0	0	0	111.6	N78 P102 L103 L109 A110	N78-S106 WeakPolarHBondContact OD1-CB 3.47Å; N78-S106 PolarHBondContact OD1-OG 3.35Å; P102-S106 WeakPolarHBondContact O-CB 3.29Å; P102-S106 PolarHBondContact O-N 2.68Å; P102-S106 PolarHBondContact O-OG 2.81Å; L103-S106 PolarHBondContact O-OG 3.46Å; S106-L109 PolarHBondContact O-N 3.42Å; S106-A110 VanDerWaalsContact O-CB 3.32Å; S106-A110 WeakPolarHBondContact O-CB 3.47Å; S106-A110 PolarHBondContact O-N 3.16Å
107	T	95.2	Very high	95.9	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-62.1	-43	172.5	-57.3	0	0	0	0	111.7	L103 S104 I105 L109 A110 F111 L148 N164 Y186	L103-T107 VanDerWaalsContact O-CB 3.3Å; L103-T107 WeakPolarHBondContact O-CB 3.14Å; L103-T107 PolarHBondContact O-N 3.41Å; L103-T107 PolarHBondContact O-OG1 3.43Å; S104-T107 PolarHBondContact O-N 2.8Å; I105-T107 VanDerWaalsContact C-N 3.28Å; I105-T107 PolarHBondContact O-N 2.67Å; T107-L109 VanDerWaalsContact C-N 3.35Å; T107-L109 PolarHBondContact O-N 2.89Å; T107-A110 PolarHBondContact O-N 3.16Å; T107-F111 VanDerWaalsContact O-CB 3.32Å; T107-F111 WeakPolarHBondContact O-CB 3.31Å; T107-F111 PolarHBondContact O-N 2.84Å; T107-L148 HydrophobicContact CG2-CD1 3.8Å; T107-L148 HydrophobicContact CG2-CD2 4.04Å; T107-L148 HydrophobicContact CG2-CG 4.32Å; T107-N164 WeakPolarHBondContact CG2-ND2 3.47Å; T107-Y186 HydrophobicContact CG2-CD1 3.76Å; T107-Y186 HydrophobicContact CG2-CE1 4.17Å
108	A	95.8	Very high	96	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.008	5%	0.053	C	C	.	.	H	α-helix	trans	-61.7	-43.1	178.6	0	0	0	0	0	112.1	S104 I105 F111 L112 N164 L232 N234	S104-A108 PolarHBondContact O-N 2.92Å; I105-A108 WeakPolarHBondContact O-CB 3.4Å; I105-A108 PolarHBondContact O-N 3.11Å; I105-A108 VanDerWaalsContact O-N 3.12Å; A108-F111 WeakPolarHBondContact O-CB 3.41Å; A108-F111 PolarHBondContact O-N 3.32Å; A108-L112 PolarHBondContact O-N 2.95Å; A108-N164 WeakPolarHBondContact CA-OD1 3.29Å; A108-N164 WeakPolarHBondContact CB-OD1 3.41Å; A108-L232 HydrophobicContact CB-CD2 4.07Å; A108-L232 HydrophobicContact CB-CG 4.44Å; A108-N234 HydrophobicContact CB-CB 3.98Å
109	L	97.6	Very high	96.1	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-72	-38	179.5	-66.9	172.6	0	0	0	112	F81 I105 S106 T107 F111 L112 S113 I124 L128 L353 I358	F81-L109 HydrophobicContact CE2-CD1 4.42Å; F81-L109 HydrophobicContact CZ-CD1 4.01Å; I105-L109 HydrophobicContact CG2-CD1 3.94Å; I105-L109 HydrophobicContact CG2-CG 4.43Å; I105-L109 WeakPolarHBondContact O-CG 3.25Å; I105-L109 PolarHBondContact O-N 3.46Å; S106-L109 PolarHBondContact O-N 3.42Å; T107-L109 VanDerWaalsContact C-N 3.35Å; T107-L109 PolarHBondContact O-N 2.89Å; L109-F111 VanDerWaalsContact C-N 3.3Å; L109-L112 HydrophobicContact CD2-CD2 4.41Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.02Å; L109-S113 PolarHBondContact O-N 3.3Å; L109-I124 HydrophobicContact CB-CG2 4.23Å; L109-I124 WeakPolarHBondContact O-CG2 3.09Å; L109-L128 HydrophobicContact CB-CD1 3.9Å; L109-L128 HydrophobicContact CB-CD2 3.95Å; L109-L128 HydrophobicContact CB-CG 4.19Å; L109-L128 HydrophobicContact CD1-CD2 3.74Å; L109-L128 HydrophobicContact CD1-CG 4.48Å; L109-L128 HydrophobicContact CG-CD2 4.5Å; L109-L353 HydrophobicContact CD1-CD1 4.42Å; L109-L353 HydrophobicContact CD1-CD2 3.67Å; L109-L353 HydrophobicContact CD2-CD1 3.96Å; L109-I358 HydrophobicContact CD1-CD1 4.11Å
110	A	97.1	Very high	96.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-68	-32.1	172.7	0	0	0	0	0	112	S106 T107 S113 L128 H141 F144 Y186	S106-A110 VanDerWaalsContact O-CB 3.32Å; S106-A110 WeakPolarHBondContact O-CB 3.47Å; S106-A110 PolarHBondContact O-N 3.16Å; T107-A110 PolarHBondContact O-N 3.16Å; A110-S113 PolarHBondContact O-N 2.62Å; A110-S113 PolarHBondContact O-OG 3.09Å; A110-L128 HydrophobicContact CB-CD1 4.14Å; A110-H141 PolarHBondContact O-CE1 2.96Å; A110-H141 VanDerWaalsContact O-CE1 3.3Å; A110-F144 HydrophobicContact CB-CD2 3.6Å; A110-F144 HydrophobicContact CB-CE1 4.36Å; A110-F144 HydrophobicContact CB-CE2 3.35Å; A110-F144 HydrophobicContact CB-CG 4.21Å; A110-F144 HydrophobicContact CB-CZ 3.78Å; A110-Y186 HydrophobicContact CB-CE1 4Å; A110-Y186 WeakPolarHBondContact CB-OH 3.42Å; A110-Y186 PolarHBondContact O-OH 3.39Å
111	F	97.3	Very high	96.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.7	-47.8	169.2	161	-130.5	0	0	0	111.1	T107 A108 L109 S113 L114 N164 M166 F178 A182 Y186 L232	T107-F111 VanDerWaalsContact O-CB 3.32Å; T107-F111 WeakPolarHBondContact O-CB 3.31Å; T107-F111 PolarHBondContact O-N 2.84Å; A108-F111 WeakPolarHBondContact O-CB 3.41Å; A108-F111 PolarHBondContact O-N 3.32Å; L109-F111 VanDerWaalsContact C-N 3.3Å; F111-S113 PolarHBondContact O-N 3.18Å; F111-L114 HydrophobicContact CD2-CD1 4.28Å; F111-L114 WeakPolarHBondContact O-CB 3.38Å; F111-L114 PolarHBondContact O-N 3.32Å; F111-L114 VanDerWaalsContact O-N 3.16Å; F111-N164 HydrophobicContact CD1-CB 3.99Å; F111-N164 HydrophobicContact CE1-CB 4.47Å; F111-M166 HydrophobicContact CE1-CB 3.87Å; F111-M166 HydrophobicContact CE1-CE 3.9Å; F111-M166 HydrophobicContact CE2-CE 4.47Å; F111-M166 HydrophobicContact CZ-CB 3.91Å; F111-M166 HydrophobicContact CZ-CE 3.86Å; F111-M166 HydrophobicContact CZ-SD 4.46Å; F111-F178 HydrophobicContact CE2-CE1 4.36Å; F111-F178 HydrophobicContact CE2-CE2 4.29Å; F111-F178 AromaticContact CE2-CZ 3.7Å; F111-F178 HydrophobicContact CE2-CZ 3.7Å; F111-F178 HydrophobicContact CZ-CZ 4.06Å; F111-A182 HydrophobicContact CD2-CB 4.13Å; F111-A182 HydrophobicContact CE2-CB 3.41Å; F111-A182 VanDerWaalsContact CE2-CB 3.41Å; F111-A182 HydrophobicContact CZ-CB 4.2Å; F111-Y186 HydrophobicContact CB-CD1 3.96Å; F111-Y186 HydrophobicContact CB-CD2 4.2Å; F111-Y186 HydrophobicContact CB-CE1 4.29Å; F111-Y186 HydrophobicContact CB-CG 3.92Å; F111-Y186 HydrophobicContact CD2-CD2 4.42Å; F111-L232 HydrophobicContact CD1-CD1 3.96Å; F111-L232 HydrophobicContact CE1-CD1 4Å
112	L	97.6	Very high	96.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-56.7	-37.8	175.5	174.8	62.2	0	0	0	112	A108 L109 L114 G115 I124 M166 M230 L232 V361 L368 I371 V379	A108-L112 PolarHBondContact O-N 2.95Å; L109-L112 HydrophobicContact CD2-CD2 4.41Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.02Å; L112-L114 PolarHBondContact O-N 3.26Å; L112-G115 PolarHBondContact O-N 2.88Å; L112-G115 VanDerWaalsContact O-N 3.13Å; L112-I124 HydrophobicContact CD2-CD1 4.22Å; L112-I124 HydrophobicContact CG-CD1 4.17Å; L112-M166 HydrophobicContact CD1-CE 3.78Å; L112-M230 HydrophobicContact CD1-CE 3.4Å; L112-L232 HydrophobicContact CB-CD2 4.14Å; L112-L232 HydrophobicContact CD2-CD2 4.19Å; L112-V361 HydrophobicContact CD2-CG2 3.95Å; L112-L368 HydrophobicContact CD1-CD2 4.17Å; L112-I371 HydrophobicContact CD1-CD1 4.37Å; L112-V379 HydrophobicContact CD1-CG2 3.92Å; L112-V379 HydrophobicContact CD2-CG2 3.93Å
113	S	97.9	Very high	96.8	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.014	10%	0.098	C	C	.	.	H	α-helix	trans	-65.3	-19.6	-178.3	85.7	0	0	0	0	113.7	L109 A110 F111 G115 A116 L121 H141	L109-S113 PolarHBondContact O-N 3.3Å; A110-S113 PolarHBondContact O-N 2.62Å; A110-S113 PolarHBondContact O-OG 3.09Å; F111-S113 PolarHBondContact O-N 3.18Å; S113-G115 PolarHBondContact O-N 2.86Å; S113-A116 PolarHBondContact O-N 3.04Å; S113-A116 VanDerWaalsContact O-N 3.15Å; S113-L121 WeakPolarHBondContact O-CD1 3.31Å; S113-H141 PolarHBondContact OG-CE1 3.12Å; S113-H141 VanDerWaalsContact OG-CE1 3.23Å
114	L	97.3	Very high	97	Very high	34 Å²	34	18.9 Å²	18.9	18%	0.178	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.3	172.8	-74.5	176.5	0	0	0	112.9	F111 L112 H141 F178 D181 L185 Y186	F111-L114 HydrophobicContact CD2-CD1 4.28Å; F111-L114 WeakPolarHBondContact O-CB 3.38Å; F111-L114 PolarHBondContact O-N 3.32Å; F111-L114 VanDerWaalsContact O-N 3.16Å; L112-L114 PolarHBondContact O-N 3.26Å; L114-H141 VanDerWaalsContact CD2-CE1 3.46Å; L114-H141 WeakPolarHBondContact CD2-CE1 3.31Å; L114-F178 HydrophobicContact CB-CD2 4.3Å; L114-F178 HydrophobicContact CB-CE2 4.02Å; L114-D181 HydrophobicContact CD1-CB 4.23Å; L114-L185 HydrophobicContact CD1-CD1 4.27Å; L114-L185 HydrophobicContact CD2-CD1 3.76Å; L114-Y186 HydrophobicContact CD1-CD2 3.6Å; L114-Y186 HydrophobicContact CD1-CE2 3.59Å; L114-Y186 HydrophobicContact CD2-CE2 4.34Å; L114-Y186 HydrophobicContact CG-CD2 4.4Å; L114-Y186 HydrophobicContact CG-CE2 3.9Å
115	G	96.9	Very high	97.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.2	-179.5	0	0	0	0	0	114.2	L112 S113 L368 G370	L112-G115 PolarHBondContact O-N 2.88Å; L112-G115 VanDerWaalsContact O-N 3.13Å; S113-G115 PolarHBondContact O-N 2.86Å; G115-L368 CarbonylContact O-C 3.52Å; G115-L368 VanDerWaalsContact O-C 3.28Å; G115-L368 VanDerWaalsContact O-CA 3.31Å; G115-L368 WeakPolarHBondContact O-CA 3.09Å; G115-G370 VanDerWaalsContact O-CA 3.3Å; G115-G370 WeakPolarHBondContact O-CA 3.34Å; G115-G370 PolarHBondContact O-N 2.73Å
116	A	98	Very high	97.3	Very high	2 Å²	2	25.9 Å²	25.9	2%	0.017	12%	0.124	C	C	.	.			trans	-94	151.1	-176.1	0	0	0	0	0	111.6	S113 T120 L121 I124 D367 L368	S113-A116 PolarHBondContact O-N 3.04Å; S113-A116 VanDerWaalsContact O-N 3.15Å; A116-T120 HydrophobicContact CB-CG2 3.97Å; A116-L121 HydrophobicContact CB-CB 4.03Å; A116-L121 HydrophobicContact CB-CD1 4.31Å; A116-I124 HydrophobicContact CB-CD1 3.88Å; A116-D367 CarbonylContact C-O 3.28Å; A116-D367 WeakPolarHBondContact CA-O 3.31Å; A116-L368 HydrophobicContact CB-CD2 4.03Å
117	H	97.5	Very high	97.4	Very high	72 Å²	72	26 Å²	26	33%	0.333	13%	0.126	S	C	.	.			trans	-133.9	167.8	173.6	-61.4	-56.1	0	0	0	112.1	T119 T120 L121 D367 S369 G370	H117-T119 PolarHBondContact O-N 3.16Å; H117-T120 WeakPolarHBondContact O-CB 3.25Å; H117-T120 PolarHBondContact O-N 2.97Å; H117-L121 PolarHBondContact O-N 3Å; H117-L121 VanDerWaalsContact O-N 3.12Å; H117-D367 HydrophobicContact CB-CB 4.34Å; H117-D367 PolarHBondContact N-O 2.76Å; H117-S369 PolarHBondContact CD2-OG 3.48Å; H117-G370 WeakPolarHBondContact NE2-CA 3.31Å; H117-G370 PolarHBondContact NE2-N 3.19Å
118	N	96.2	Very high	97.4	Very high	97 Å²	97	26 Å²	26	52%	0.519	13%	0.126	S	C	.	.	H	α-helix	trans	53	-133.9	170.4	-59.4	-50.7	0	0	0	113.1	T120 L121 M122 D367	N118-T120 VanDerWaalsContact C-N 3.34Å; N118-T120 PolarHBondContact O-N 2.96Å; N118-L121 PolarHBondContact O-N 2.98Å; N118-M122 WeakPolarHBondContact O-CG 3.49Å; N118-M122 PolarHBondContact O-N 2.85Å; N118-D367 PolarHBondContact ND2-OD2 3.37Å
119	T	97.5	Very high	97.5	Very high	56 Å²	56	29.7 Å²	29.7	34%	0.344	14%	0.141	S	C	.	.	H	α-helix	trans	-59.3	-44.4	-178.7	-56.5	0	0	0	0	111.7	H117 L121 M122 E123 E360	H117-T119 PolarHBondContact O-N 3.16Å; T119-L121 VanDerWaalsContact C-N 3.31Å; T119-L121 PolarHBondContact O-N 3.23Å; T119-M122 PolarHBondContact O-N 3.02Å; T119-M122 VanDerWaalsContact O-N 3.14Å; T119-E123 HydrophobicContact CG2-CG 4.19Å; T119-E123 WeakPolarHBondContact CG2-OE1 3.49Å; T119-E123 WeakPolarHBondContact O-CB 3.4Å; T119-E123 WeakPolarHBondContact O-CG 3.13Å; T119-E123 PolarHBondContact O-N 3.31Å; T119-E360 WeakPolarHBondContact CB-OE1 3.27Å; T119-E360 WeakPolarHBondContact CB-OE2 3.38Å; T119-E360 WeakPolarHBondContact CG2-OE2 3.28Å
120	T	98.4	Very high	97.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-52.8	-47.4	175.7	-58.6	0	0	0	0	112	A116 H117 N118 I124 E360 V361 A366 D367 L368	A116-T120 HydrophobicContact CB-CG2 3.97Å; H117-T120 WeakPolarHBondContact O-CB 3.25Å; H117-T120 PolarHBondContact O-N 2.97Å; N118-T120 VanDerWaalsContact C-N 3.34Å; N118-T120 PolarHBondContact O-N 2.96Å; T120-I124 HydrophobicContact CG2-CD1 4.16Å; T120-I124 WeakPolarHBondContact O-CD1 3.41Å; T120-I124 VanDerWaalsContact O-CG1 3.26Å; T120-I124 WeakPolarHBondContact O-CG1 3.33Å; T120-I124 PolarHBondContact O-N 3.21Å; T120-E360 PolarHBondContact N-OE1 3.15Å; T120-E360 PolarHBondContact OG1-OE1 2.79Å; T120-V361 HydrophobicContact CG2-CB 3.8Å; T120-V361 HydrophobicContact CG2-CG2 3.88Å; T120-A366 WeakPolarHBondContact OG1-CA 3.43Å; T120-D367 PolarHBondContact OG1-N 3.37Å; T120-L368 HydrophobicContact CG2-CD2 4.26Å
121	L	98.2	Very high	97.1	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.052	16%	0.161	C	C	.	.	H	α-helix	trans	-64.3	-47.2	176.8	176.9	57.6	0	0	0	112.4	S113 A116 H117 N118 T119 E123 I124 L125 E137	S113-L121 WeakPolarHBondContact O-CD1 3.31Å; A116-L121 HydrophobicContact CB-CB 4.03Å; A116-L121 HydrophobicContact CB-CD1 4.31Å; H117-L121 PolarHBondContact O-N 3Å; H117-L121 VanDerWaalsContact O-N 3.12Å; N118-L121 PolarHBondContact O-N 2.98Å; T119-L121 VanDerWaalsContact C-N 3.31Å; T119-L121 PolarHBondContact O-N 3.23Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 2.92Å; L121-I124 PolarHBondContact O-N 3.02Å; L121-L125 HydrophobicContact CD1-CD1 3.75Å; L121-L125 HydrophobicContact CD1-CG 4.01Å; L121-L125 HydrophobicContact CG-CD1 4.23Å; L121-L125 PolarHBondContact O-N 2.66Å; L121-L125 VanDerWaalsContact O-N 3.08Å; L121-E137 VanDerWaalsContact CD2-OE1 3.29Å; L121-E137 WeakPolarHBondContact CD2-OE1 3.49Å
122	M	97.9	Very high	96.9	Very high	73 Å²	73	35.5 Å²	35.5	36%	0.36	17%	0.172	S	C	.	.	H	α-helix	trans	-60.7	-42	-179.3	-72.6	-169.3	-63.8	0	0	112.2	N118 T119 R126 L132	N118-M122 WeakPolarHBondContact O-CG 3.49Å; N118-M122 PolarHBondContact O-N 2.85Å; T119-M122 PolarHBondContact O-N 3.02Å; T119-M122 VanDerWaalsContact O-N 3.14Å; M122-R126 VanDerWaalsContact O-CB 3.25Å; M122-R126 WeakPolarHBondContact O-CB 3.27Å; M122-R126 VanDerWaalsContact O-CG 3.28Å; M122-R126 WeakPolarHBondContact O-CG 3.2Å; M122-R126 PolarHBondContact O-N 2.89Å; M122-L132 HydrophobicContact CB-CD1 4.47Å; M122-L132 HydrophobicContact CG-CD1 4.26Å
123	E	98.4	Very high	96.6	Very high	47 Å²	47	41.5 Å²	41.5	22%	0.22	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-46.5	178	-77.6	-175.4	-171.9	0	0	111.5	T119 L121 G127 G357 E359 E360	T119-E123 HydrophobicContact CG2-CG 4.19Å; T119-E123 WeakPolarHBondContact CG2-OE1 3.49Å; T119-E123 WeakPolarHBondContact O-CB 3.4Å; T119-E123 WeakPolarHBondContact O-CG 3.13Å; T119-E123 PolarHBondContact O-N 3.31Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 2.92Å; E123-G127 WeakPolarHBondContact O-CA 3.42Å; E123-G127 PolarHBondContact O-N 3.4Å; E123-G357 WeakPolarHBondContact CB-O 3.35Å; E123-E359 PolarHBondContact OE2-N 2.72Å; E123-E360 WeakPolarHBondContact OE2-CB 3.5Å; E123-E360 PolarHBondContact OE2-N 3.45Å
124	I	98.4	Very high	96.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-53.5	177.9	-65.7	163.6	0	0	0	110.5	L109 L112 A116 T120 L121 G127 L128 I358 V361	L109-I124 HydrophobicContact CB-CG2 4.23Å; L109-I124 WeakPolarHBondContact O-CG2 3.09Å; L112-I124 HydrophobicContact CD2-CD1 4.22Å; L112-I124 HydrophobicContact CG-CD1 4.17Å; A116-I124 HydrophobicContact CB-CD1 3.88Å; T120-I124 HydrophobicContact CG2-CD1 4.16Å; T120-I124 WeakPolarHBondContact O-CD1 3.41Å; T120-I124 VanDerWaalsContact O-CG1 3.26Å; T120-I124 WeakPolarHBondContact O-CG1 3.33Å; T120-I124 PolarHBondContact O-N 3.21Å; L121-I124 PolarHBondContact O-N 3.02Å; I124-G127 PolarHBondContact O-N 3.13Å; I124-L128 HydrophobicContact CG2-CD1 4.36Å; I124-L128 WeakPolarHBondContact O-CG 3.25Å; I124-L128 PolarHBondContact O-N 3.11Å; I124-I358 HydrophobicContact CG1-CG2 3.93Å; I124-V361 HydrophobicContact CD1-CB 4.42Å; I124-V361 HydrophobicContact CD1-CG2 4.11Å
125	L	97.8	Very high	95.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-70.2	-36.7	-174.6	-63.4	-179	0	0	0	112.9	L121 L128 K129 F130 L132 E137 I140	L121-L125 HydrophobicContact CD1-CD1 3.75Å; L121-L125 HydrophobicContact CD1-CG 4.01Å; L121-L125 HydrophobicContact CG-CD1 4.23Å; L121-L125 PolarHBondContact O-N 2.66Å; L121-L125 VanDerWaalsContact O-N 3.08Å; L125-L128 HydrophobicContact CD2-CD1 4.49Å; L125-L128 CarbonylContact O-C 3.58Å; L125-L128 WeakPolarHBondContact O-CB 3.4Å; L125-L128 PolarHBondContact O-N 3.03Å; L125-K129 PolarHBondContact O-N 3.34Å; L125-F130 HydrophobicContact CD2-CD2 4.42Å; L125-F130 WeakPolarHBondContact O-CB 3.43Å; L125-F130 WeakPolarHBondContact O-CD2 3.24Å; L125-F130 PolarHBondContact O-N 2.88Å; L125-L132 HydrophobicContact CB-CD1 4.33Å; L125-L132 HydrophobicContact CB-CD2 3.86Å; L125-L132 HydrophobicContact CB-CG 4.49Å; L125-L132 HydrophobicContact CD1-CD2 3.8Å; L125-L132 HydrophobicContact CG-CD2 4.5Å; L125-E137 HydrophobicContact CD1-CG 3.9Å; L125-I140 HydrophobicContact CD1-CD1 4.13Å; L125-I140 HydrophobicContact CD2-CD1 4.42Å; L125-I140 HydrophobicContact CD2-CG2 4.36Å
126	R	96.8	Very high	95.6	Very high	148 Å²	148	51.5 Å²	51.5	56%	0.558	26%	0.263	S	S	*	.	H	α-helix	trans	-70.7	-35.4	173.8	-73.1	178.2	175.7	162.6	1.8	112.5	M122 L128 K129 L132	M122-R126 VanDerWaalsContact O-CB 3.25Å; M122-R126 WeakPolarHBondContact O-CB 3.27Å; M122-R126 VanDerWaalsContact O-CG 3.28Å; M122-R126 WeakPolarHBondContact O-CG 3.2Å; M122-R126 PolarHBondContact O-N 2.89Å; R126-L128 PolarHBondContact O-N 3.4Å; R126-K129 VanDerWaalsContact O-CA 3.28Å; R126-K129 WeakPolarHBondContact O-CA 3.42Å; R126-K129 PolarHBondContact O-N 3.19Å; R126-L132 HydrophobicContact CG-CD1 4.28Å
127	G	97.1	Very high	95.4	Very high	3 Å²	3	55.7 Å²	55.7	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-35.1	172.8	0	0	0	0	0	112	F81 E123 I124 K129	F81-G127 WeakPolarHBondContact CD2-O 3.41Å; E123-G127 WeakPolarHBondContact O-CA 3.42Å; E123-G127 PolarHBondContact O-N 3.4Å; I124-G127 PolarHBondContact O-N 3.13Å; G127-K129 PolarHBondContact O-N 3.15Å
128	L	96.6	Very high	95.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	4.6	167.8	-68.6	179	0	0	0	114.5	T77 F81 L109 A110 I124 L125 R126 F130	T77-L128 VanDerWaalsContact CG2-O 3.24Å; T77-L128 WeakPolarHBondContact CG2-O 3.15Å; F81-L128 HydrophobicContact CD1-CD2 4.25Å; F81-L128 HydrophobicContact CD2-CD2 4Å; F81-L128 HydrophobicContact CE1-CD2 4.14Å; F81-L128 HydrophobicContact CE2-CD2 3.88Å; F81-L128 HydrophobicContact CG-CD2 4.17Å; F81-L128 HydrophobicContact CZ-CD2 3.96Å; L109-L128 HydrophobicContact CB-CD1 3.9Å; L109-L128 HydrophobicContact CB-CD2 3.95Å; L109-L128 HydrophobicContact CB-CG 4.19Å; L109-L128 HydrophobicContact CD1-CD2 3.74Å; L109-L128 HydrophobicContact CD1-CG 4.48Å; L109-L128 HydrophobicContact CG-CD2 4.5Å; A110-L128 HydrophobicContact CB-CD1 4.14Å; I124-L128 HydrophobicContact CG2-CD1 4.36Å; I124-L128 WeakPolarHBondContact O-CG 3.25Å; I124-L128 PolarHBondContact O-N 3.11Å; L125-L128 HydrophobicContact CD2-CD1 4.49Å; L125-L128 CarbonylContact O-C 3.58Å; L125-L128 WeakPolarHBondContact O-CB 3.4Å; L125-L128 PolarHBondContact O-N 3.03Å; R126-L128 PolarHBondContact O-N 3.4Å; L128-F130 VanDerWaalsContact C-N 3.33Å; L128-F130 HydrophobicContact CB-CD2 3.7Å; L128-F130 HydrophobicContact CB-CE2 3.78Å; L128-F130 HydrophobicContact CD1-CE2 4.16Å; L128-F130 PolarHBondContact O-N 3.19Å
129	K	96.3	Very high	95	Very high	78 Å²	78	54.2 Å²	54.2	34%	0.339	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	13.8	178.5	-51.2	-62	-172.4	166.9	0	115.9	T77 D80 F81 S84 L125 R126 G127	T77-K129 HydrophobicContact CG2-CB 3.93Å; D80-K129 HydrophobicContact CB-CB 4.42Å; D80-K129 HydrophobicContact CB-CG 4.17Å; F81-K129 HydrophobicContact CB-CG 4.08Å; S84-K129 WeakPolarHBondContact OG-CE 3.24Å; S84-K129 PolarHBondContact OG-NZ 2.99Å; L125-K129 PolarHBondContact O-N 3.34Å; R126-K129 VanDerWaalsContact O-CA 3.28Å; R126-K129 WeakPolarHBondContact O-CA 3.42Å; R126-K129 PolarHBondContact O-N 3.19Å; G127-K129 PolarHBondContact O-N 3.15Å
130	F	94.9	Very high	94.8	Very high	10 Å²	10	51.6 Å²	51.6	4%	0.044	27%	0.266	C	S	.	.			trans	-72.1	133.4	174.3	-68.8	-75.7	0	0	0	112	L74 T77 L125 L128 L132 I140 F144	L74-F130 HydrophobicContact CD1-CE1 3.83Å; L74-F130 HydrophobicContact CD1-CZ 3.51Å; T77-F130 HydrophobicContact CG2-CD1 3.8Å; T77-F130 HydrophobicContact CG2-CD2 4.36Å; T77-F130 HydrophobicContact CG2-CE1 3.82Å; T77-F130 HydrophobicContact CG2-CE2 4.37Å; T77-F130 HydrophobicContact CG2-CG 4.07Å; T77-F130 HydrophobicContact CG2-CZ 4.1Å; L125-F130 HydrophobicContact CD2-CD2 4.42Å; L125-F130 WeakPolarHBondContact O-CB 3.43Å; L125-F130 WeakPolarHBondContact O-CD2 3.24Å; L125-F130 PolarHBondContact O-N 2.88Å; L128-F130 VanDerWaalsContact C-N 3.33Å; L128-F130 HydrophobicContact CB-CD2 3.7Å; L128-F130 HydrophobicContact CB-CE2 3.78Å; L128-F130 HydrophobicContact CD1-CE2 4.16Å; L128-F130 PolarHBondContact O-N 3.19Å; F130-L132 HydrophobicContact CB-CD2 4.32Å; F130-L132 PolarHBondContact O-N 2.74Å; F130-I140 HydrophobicContact CB-CD1 3.77Å; F130-I140 HydrophobicContact CD1-CD1 3.76Å; F130-I140 HydrophobicContact CD1-CG1 3.67Å; F130-I140 HydrophobicContact CD1-CG2 4.39Å; F130-I140 HydrophobicContact CD2-CD1 4.07Å; F130-I140 HydrophobicContact CD2-CG2 4.19Å; F130-I140 HydrophobicContact CE1-CB 4.46Å; F130-I140 HydrophobicContact CE1-CD1 4.39Å; F130-I140 HydrophobicContact CE1-CG1 3.89Å; F130-I140 HydrophobicContact CE1-CG2 3.98Å; F130-I140 HydrophobicContact CE2-CG2 3.76Å; F130-I140 HydrophobicContact CG-CD1 3.59Å; F130-I140 HydrophobicContact CG-CG1 4.02Å; F130-I140 HydrophobicContact CG-CG2 4.49Å; F130-I140 HydrophobicContact CZ-CG1 4.41Å; F130-I140 HydrophobicContact CZ-CG2 3.66Å; F130-F144 AromaticContact CE2-CE2 3.9Å; F130-F144 HydrophobicContact CE2-CE2 3.9Å; F130-F144 HydrophobicContact CE2-CZ 4.36Å; F130-F144 AromaticContact CZ-CE2 3.65Å; F130-F144 HydrophobicContact CZ-CE2 3.65Å; F130-F144 HydrophobicContact CZ-CZ 4.16Å
131	N	93.3	Very high	94.7	Very high	68 Å²	68	52.4 Å²	52.4	36%	0.364	27%	0.27	S	S	.	.			trans	-86.6	97.8	168.3	-171.6	-2.2	0	0	0	110.4	T133 E134 T135	N131-T133 PolarHBondContact ND2-OG1 2.68Å; N131-T133 PolarHBondContact O-N 3.01Å; N131-T133 VanDerWaalsContact O-N 3.07Å; N131-T133 PolarHBondContact OD1-N 2.8Å; N131-T133 PolarHBondContact OD1-OG1 2.73Å; N131-E134 HydrophobicContact CB-CB 4.31Å; N131-E134 PolarHBondContact ND2-OE1 3.23Å; N131-E134 VanDerWaalsContact ND2-OE1 3.09Å; N131-E134 PolarHBondContact ND2-OE2 3.38Å; N131-E134 PolarHBondContact O-N 3.16Å; N131-T135 PolarHBondContact O-N 3.29Å
132	L	91.3	Very high	94.5	Very high	46 Å²	46	57.5 Å²	57.5	24%	0.241	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.6	-177.4	-58.4	-178.9	0	0	0	114.5	M122 L125 R126 F130 I140	M122-L132 HydrophobicContact CB-CD1 4.47Å; M122-L132 HydrophobicContact CG-CD1 4.26Å; L125-L132 HydrophobicContact CB-CD1 4.33Å; L125-L132 HydrophobicContact CB-CD2 3.86Å; L125-L132 HydrophobicContact CB-CG 4.49Å; L125-L132 HydrophobicContact CD1-CD2 3.8Å; L125-L132 HydrophobicContact CG-CD2 4.5Å; R126-L132 HydrophobicContact CG-CD1 4.28Å; F130-L132 HydrophobicContact CB-CD2 4.32Å; F130-L132 PolarHBondContact O-N 2.74Å; L132-I140 HydrophobicContact CD2-CD1 3.92Å
133	T	91.2	Very high	94.2	Very high	125 Å²	125	54.4 Å²	54.4	77%	0.767	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-20.3	170.2	65.3	0	0	0	0	112.8	N131	N131-T133 PolarHBondContact ND2-OG1 2.68Å; N131-T133 PolarHBondContact O-N 3.01Å; N131-T133 VanDerWaalsContact O-N 3.07Å; N131-T133 PolarHBondContact OD1-N 2.8Å; N131-T133 PolarHBondContact OD1-OG1 2.73Å
134	E	89.4	Confident	94	Very high	149 Å²	149	52.1 Å²	52.1	70%	0.696	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-32.1	-175.4	-69.6	174.2	-172.4	0	0	112.4	N131	N131-E134 HydrophobicContact CB-CB 4.31Å; N131-E134 PolarHBondContact ND2-OE1 3.23Å; N131-E134 VanDerWaalsContact ND2-OE1 3.09Å; N131-E134 PolarHBondContact ND2-OE2 3.38Å; N131-E134 PolarHBondContact O-N 3.16Å
135	T	89.6	Confident	93.7	Very high	43 Å²	43	53.4 Å²	53.4	26%	0.264	28%	0.275	S	S	.	.	S	Bend	trans	-122.7	124.3	-179.1	-45.6	0	0	0	0	109.9	N131 E139 I140	N131-T135 PolarHBondContact O-N 3.29Å; T135-E139 HydrophobicContact CG2-CB 3.94Å; T135-I140 HydrophobicContact CG2-CD1 4.48Å; T135-I140 HydrophobicContact CG2-CG1 3.71Å
136	S	93	Very high	93.4	Very high	54 Å²	54	57.3 Å²	57.3	38%	0.378	29%	0.292	S	S	.	.			trans	-75.2	155.1	176.4	67.4	0	0	0	0	111.8	A138 E139 I140	S136-A138 PolarHBondContact O-N 3.21Å; S136-E139 WeakPolarHBondContact CB-OE2 3.29Å; S136-E139 PolarHBondContact N-OE2 2.83Å; S136-E139 PolarHBondContact O-N 3.2Å; S136-E139 VanDerWaalsContact O-N 3.11Å; S136-E139 VanDerWaalsContact OG-CG 3.24Å; S136-E139 WeakPolarHBondContact OG-CG 3.1Å; S136-E139 PolarHBondContact OG-N 3.19Å; S136-E139 PolarHBondContact OG-OE2 2.61Å; S136-I140 WeakPolarHBondContact O-CG1 3.43Å; S136-I140 PolarHBondContact O-N 3.48Å
137	E	93.1	Very high	93	Very high	91 Å²	91	50.4 Å²	50.4	43%	0.425	27%	0.267	S	S	.	.	H	α-helix	trans	-55.3	-40.9	176.4	-62.4	172.3	-166.7	0	0	112.2	L121 L125 E139 I140 H141	L121-E137 VanDerWaalsContact CD2-OE1 3.29Å; L121-E137 WeakPolarHBondContact CD2-OE1 3.49Å; L125-E137 HydrophobicContact CD1-CG 3.9Å; E137-E139 PolarHBondContact O-N 3.09Å; E137-I140 WeakPolarHBondContact O-CB 3.25Å; E137-I140 PolarHBondContact O-N 2.8Å; E137-H141 PolarHBondContact O-CD2 2.89Å; E137-H141 PolarHBondContact O-N 3.41Å
138	A	92.6	Very high	92.6	Very high	58 Å²	58	50.9 Å²	50.9	48%	0.479	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-42.9	178.1	0	0	0	0	0	112	S136 H141 Q142	S136-A138 PolarHBondContact O-N 3.21Å; A138-H141 PolarHBondContact O-N 2.53Å; A138-Q142 WeakPolarHBondContact O-CB 3.15Å; A138-Q142 WeakPolarHBondContact O-CG 3.35Å; A138-Q142 PolarHBondContact O-N 2.93Å
139	E	93	Very high	92.2	Very high	80 Å²	80	57.8 Å²	57.8	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-40.3	176.3	-72.8	163.8	148.6	0	0	111.3	T135 S136 E137 H141 Q142 S143	T135-E139 HydrophobicContact CG2-CB 3.94Å; S136-E139 WeakPolarHBondContact CB-OE2 3.29Å; S136-E139 PolarHBondContact N-OE2 2.83Å; S136-E139 PolarHBondContact O-N 3.2Å; S136-E139 VanDerWaalsContact O-N 3.11Å; S136-E139 VanDerWaalsContact OG-CG 3.24Å; S136-E139 WeakPolarHBondContact OG-CG 3.1Å; S136-E139 PolarHBondContact OG-N 3.19Å; S136-E139 PolarHBondContact OG-OE2 2.61Å; E137-E139 PolarHBondContact O-N 3.09Å; E139-H141 PolarHBondContact O-N 2.77Å; E139-Q142 PolarHBondContact O-N 3.06Å; E139-S143 WeakPolarHBondContact O-CB 2.99Å; E139-S143 PolarHBondContact O-N 2.86Å; E139-S143 PolarHBondContact O-OG 3.34Å
140	I	94.4	Very high	91.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.3	-52.8	175.9	-65.4	168.5	0	0	0	110.2	L125 F130 L132 T135 S136 E137 Q142 S143 F144	L125-I140 HydrophobicContact CD1-CD1 4.13Å; L125-I140 HydrophobicContact CD2-CD1 4.42Å; L125-I140 HydrophobicContact CD2-CG2 4.36Å; F130-I140 HydrophobicContact CB-CD1 3.77Å; F130-I140 HydrophobicContact CD1-CD1 3.76Å; F130-I140 HydrophobicContact CD1-CG1 3.67Å; F130-I140 HydrophobicContact CD1-CG2 4.39Å; F130-I140 HydrophobicContact CD2-CD1 4.07Å; F130-I140 HydrophobicContact CD2-CG2 4.19Å; F130-I140 HydrophobicContact CE1-CB 4.46Å; F130-I140 HydrophobicContact CE1-CD1 4.39Å; F130-I140 HydrophobicContact CE1-CG1 3.89Å; F130-I140 HydrophobicContact CE1-CG2 3.98Å; F130-I140 HydrophobicContact CE2-CG2 3.76Å; F130-I140 HydrophobicContact CG-CD1 3.59Å; F130-I140 HydrophobicContact CG-CG1 4.02Å; F130-I140 HydrophobicContact CG-CG2 4.49Å; F130-I140 HydrophobicContact CZ-CG1 4.41Å; F130-I140 HydrophobicContact CZ-CG2 3.66Å; L132-I140 HydrophobicContact CD2-CD1 3.92Å; T135-I140 HydrophobicContact CG2-CD1 4.48Å; T135-I140 HydrophobicContact CG2-CG1 3.71Å; S136-I140 WeakPolarHBondContact O-CG1 3.43Å; S136-I140 PolarHBondContact O-N 3.48Å; E137-I140 WeakPolarHBondContact O-CB 3.25Å; E137-I140 PolarHBondContact O-N 2.8Å; I140-Q142 PolarHBondContact O-N 2.95Å; I140-S143 WeakPolarHBondContact O-CB 3.46Å; I140-S143 PolarHBondContact O-N 2.72Å; I140-F144 HydrophobicContact CG2-CD2 3.95Å; I140-F144 HydrophobicContact CG2-CE2 3.9Å; I140-F144 WeakPolarHBondContact O-CD2 3.31Å; I140-F144 PolarHBondContact O-N 2.93Å
141	H	95.6	Very high	91	Very high	18 Å²	18	57.1 Å²	57.1	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-38.6	-179.4	-68.4	-58.2	0	0	0	112.8	A110 S113 L114 E137 A138 E139 S143 F144 Q145 L185 Y186	A110-H141 PolarHBondContact O-CE1 2.96Å; A110-H141 VanDerWaalsContact O-CE1 3.3Å; S113-H141 PolarHBondContact OG-CE1 3.12Å; S113-H141 VanDerWaalsContact OG-CE1 3.23Å; L114-H141 VanDerWaalsContact CD2-CE1 3.46Å; L114-H141 WeakPolarHBondContact CD2-CE1 3.31Å; E137-H141 PolarHBondContact O-CD2 2.89Å; E137-H141 PolarHBondContact O-N 3.41Å; A138-H141 PolarHBondContact O-N 2.53Å; E139-H141 PolarHBondContact O-N 2.77Å; H141-S143 VanDerWaalsContact C-N 3.33Å; H141-F144 PolarHBondContact O-N 2.81Å; H141-Q145 WeakPolarHBondContact O-CB 3.46Å; H141-Q145 PolarHBondContact O-N 3.43Å; H141-L185 HydrophobicContact CB-CD1 4.34Å; H141-Y186 AromaticContact ND1-CE2 3.69Å; H141-Y186 AromaticContact ND1-CZ 3.65Å; H141-Y186 PolarHBondContact ND1-OH 3.05Å
142	Q	93.4	Very high	90.2	Very high	117 Å²	117	59.8 Å²	59.8	55%	0.547	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-38.5	174.6	-74.9	171.5	-1.7	0	0	112	A138 E139 I140 Q145 H146	A138-Q142 WeakPolarHBondContact O-CB 3.15Å; A138-Q142 WeakPolarHBondContact O-CG 3.35Å; A138-Q142 PolarHBondContact O-N 2.93Å; E139-Q142 PolarHBondContact O-N 3.06Å; I140-Q142 PolarHBondContact O-N 2.95Å; Q142-Q145 PolarHBondContact O-N 2.8Å; Q142-H146 PolarHBondContact O-N 3.09Å
143	S	92.4	Very high	89.4	Confident	7 Å²	7	63.8 Å²	63.8	5%	0.049	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-47.6	176.8	-50.9	0	0	0	0	110.9	V70 E139 I140 H141 Q145 H146 L147	V70-S143 WeakPolarHBondContact CG1-OG 3.44Å; E139-S143 WeakPolarHBondContact O-CB 2.99Å; E139-S143 PolarHBondContact O-N 2.86Å; E139-S143 PolarHBondContact O-OG 3.34Å; I140-S143 WeakPolarHBondContact O-CB 3.46Å; I140-S143 PolarHBondContact O-N 2.72Å; H141-S143 VanDerWaalsContact C-N 3.33Å; S143-Q145 VanDerWaalsContact C-N 3.33Å; S143-Q145 PolarHBondContact O-N 2.73Å; S143-H146 PolarHBondContact O-N 3.19Å; S143-L147 WeakPolarHBondContact O-CB 3.3Å; S143-L147 PolarHBondContact O-N 3.21Å
144	F	93.2	Very high	88	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-40.5	174.5	-83.5	-73.3	0	0	0	112.2	L74 A110 F130 I140 H141 H146 L147 L148 Y186	L74-F144 HydrophobicContact CD1-CD2 4.33Å; L74-F144 HydrophobicContact CD1-CE1 4.33Å; L74-F144 HydrophobicContact CD1-CE2 3.89Å; L74-F144 HydrophobicContact CD1-CZ 3.89Å; L74-F144 HydrophobicContact CD2-CD1 4.39Å; L74-F144 HydrophobicContact CD2-CG 4.44Å; A110-F144 HydrophobicContact CB-CD2 3.6Å; A110-F144 HydrophobicContact CB-CE1 4.36Å; A110-F144 HydrophobicContact CB-CE2 3.35Å; A110-F144 HydrophobicContact CB-CG 4.21Å; A110-F144 HydrophobicContact CB-CZ 3.78Å; F130-F144 AromaticContact CE2-CE2 3.9Å; F130-F144 HydrophobicContact CE2-CE2 3.9Å; F130-F144 HydrophobicContact CE2-CZ 4.36Å; F130-F144 AromaticContact CZ-CE2 3.65Å; F130-F144 HydrophobicContact CZ-CE2 3.65Å; F130-F144 HydrophobicContact CZ-CZ 4.16Å; I140-F144 HydrophobicContact CG2-CD2 3.95Å; I140-F144 HydrophobicContact CG2-CE2 3.9Å; I140-F144 WeakPolarHBondContact O-CD2 3.31Å; I140-F144 PolarHBondContact O-N 2.93Å; H141-F144 PolarHBondContact O-N 2.81Å; F144-H146 VanDerWaalsContact C-N 3.34Å; F144-H146 PolarHBondContact O-N 3.15Å; F144-L147 HydrophobicContact CD1-CD2 4.3Å; F144-L147 PolarHBondContact O-N 3.02Å; F144-L148 WeakPolarHBondContact O-CB 3.42Å; F144-L148 VanDerWaalsContact O-CG 3.24Å; F144-L148 WeakPolarHBondContact O-CG 2.96Å; F144-L148 PolarHBondContact O-N 3.22Å; F144-Y186 HydrophobicContact CB-CD1 4.49Å; F144-Y186 HydrophobicContact CB-CE1 3.63Å; F144-Y186 HydrophobicContact CD1-CE1 4.45Å; F144-Y186 AromaticContact CG-CE1 3.98Å; F144-Y186 HydrophobicContact CG-CE1 3.98Å
145	Q	93.5	Very high	87	Confident	27 Å²	27	58.6 Å²	58.6	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-44.4	176.1	-177.7	-176.6	50.8	0	0	111.6	H141 Q142 S143 R149 R184 L185	H141-Q145 WeakPolarHBondContact O-CB 3.46Å; H141-Q145 PolarHBondContact O-N 3.43Å; Q142-Q145 PolarHBondContact O-N 2.8Å; S143-Q145 VanDerWaalsContact C-N 3.33Å; S143-Q145 PolarHBondContact O-N 2.73Å; Q145-R149 VanDerWaalsContact O-CG 3.3Å; Q145-R149 WeakPolarHBondContact O-CG 3.42Å; Q145-R149 PolarHBondContact O-N 2.97Å; Q145-R184 PolarHBondContact NE2-O 3.19Å; Q145-L185 VanDerWaalsContact CA-O 3.32Å; Q145-L185 WeakPolarHBondContact CA-O 3.26Å; Q145-L185 HydrophobicContact CB-CD2 4.37Å; Q145-L185 WeakPolarHBondContact CB-O 3.41Å; Q145-L185 HydrophobicContact CG-CD2 4.48Å
146	H	90.1	Very high	86.2	Confident	81 Å²	81	63.8 Å²	63.8	38%	0.375	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-52.7	177.7	-173.2	82.4	0	0	0	110.9	D71 Q142 S143 F144 L148 R149 T150	D71-H146 IonicContact OD1-CD2 2.68Å; D71-H146 PolarHBondContact OD1-CD2 2.71Å; D71-H146 VanDerWaalsContact OD1-CD2 3.3Å; D71-H146 IonicContact OD2-CD2 3.29Å; D71-H146 PolarHBondContact OD2-CD2 3.01Å; D71-H146 VanDerWaalsContact OD2-CD2 3.27Å; D71-H146 IonicContact OD2-NE2 2.74Å; Q142-H146 PolarHBondContact O-N 3.09Å; S143-H146 PolarHBondContact O-N 3.19Å; F144-H146 VanDerWaalsContact C-N 3.34Å; F144-H146 PolarHBondContact O-N 3.15Å; H146-L148 VanDerWaalsContact C-N 3.34Å; H146-L148 PolarHBondContact O-N 2.66Å; H146-R149 WeakPolarHBondContact O-CB 2.92Å; H146-R149 PolarHBondContact O-N 3.46Å; H146-R149 VanDerWaalsContact O-N 3.1Å; H146-T150 PolarHBondContact O-N 3.31Å; H146-T150 PolarHBondContact O-OG1 2.96Å
147	L	88.8	Confident	85.4	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.016	34%	0.344	C	S	.	.	H	α-helix	trans	-51.6	-50.6	176.2	170.9	66.7	0	0	0	112	L74 L103 S143 F144 R149 T150 L151 N435	L74-L147 HydrophobicContact CD2-CB 4.18Å; L74-L147 HydrophobicContact CD2-CD2 3.86Å; L103-L147 HydrophobicContact CD1-CD2 3.52Å; L103-L147 HydrophobicContact CG-CD2 4.46Å; S143-L147 WeakPolarHBondContact O-CB 3.3Å; S143-L147 PolarHBondContact O-N 3.21Å; F144-L147 HydrophobicContact CD1-CD2 4.3Å; F144-L147 PolarHBondContact O-N 3.02Å; L147-R149 VanDerWaalsContact C-N 3.32Å; L147-R149 PolarHBondContact O-N 3.01Å; L147-T150 PolarHBondContact O-N 3.38Å; L147-T150 VanDerWaalsContact O-N 3.17Å; L147-L151 HydrophobicContact CD1-CD1 3.91Å; L147-L151 HydrophobicContact CD1-CG 4.14Å; L147-L151 HydrophobicContact CG-CD1 3.97Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.25Å; L147-L151 PolarHBondContact O-N 2.75Å; L147-N435 WeakPolarHBondContact CD1-ND2 3.35Å
148	L	88.8	Confident	85	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.073	33%	0.329	C	S	.	.	H	α-helix	trans	-65.2	-34.7	-179.1	-72.9	175.2	0	0	0	112.7	T107 F144 H146 N152 M162 Y186	T107-L148 HydrophobicContact CG2-CD1 3.8Å; T107-L148 HydrophobicContact CG2-CD2 4.04Å; T107-L148 HydrophobicContact CG2-CG 4.32Å; F144-L148 WeakPolarHBondContact O-CB 3.42Å; F144-L148 VanDerWaalsContact O-CG 3.24Å; F144-L148 WeakPolarHBondContact O-CG 2.96Å; F144-L148 PolarHBondContact O-N 3.22Å; H146-L148 VanDerWaalsContact C-N 3.34Å; H146-L148 PolarHBondContact O-N 2.66Å; L148-N152 VanDerWaalsContact O-CB 3.32Å; L148-N152 WeakPolarHBondContact O-CB 3.42Å; L148-N152 VanDerWaalsContact O-CG 3.26Å; L148-N152 PolarHBondContact O-N 3.26Å; L148-N152 PolarHBondContact O-ND2 2.71Å; L148-M162 HydrophobicContact CD2-CE 3.31Å; L148-Y186 HydrophobicContact CD1-CD1 3.81Å; L148-Y186 HydrophobicContact CD1-CG 4.4Å
149	R	87.6	Confident	84.7	Confident	144 Å²	144	60 Å²	60	54%	0.543	32%	0.319	S	S	.	.	H	α-helix	trans	-65	-42.6	172.7	-75.3	174.2	179.6	176.5	2	111.1	Q145 H146 L147 N152 Q153	Q145-R149 VanDerWaalsContact O-CG 3.3Å; Q145-R149 WeakPolarHBondContact O-CG 3.42Å; Q145-R149 PolarHBondContact O-N 2.97Å; H146-R149 WeakPolarHBondContact O-CB 2.92Å; H146-R149 PolarHBondContact O-N 3.46Å; H146-R149 VanDerWaalsContact O-N 3.1Å; L147-R149 VanDerWaalsContact C-N 3.32Å; L147-R149 PolarHBondContact O-N 3.01Å; R149-N152 PolarHBondContact O-N 2.75Å; R149-Q153 WeakPolarHBondContact O-CG 3.38Å; R149-Q153 PolarHBondContact O-N 3.01Å
150	T	84.4	Confident	84.2	Confident	40 Å²	40	58 Å²	58	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-43.1	177.6	-58.6	0	0	0	0	111.4	H146 L147 N152 Q153	H146-T150 PolarHBondContact O-N 3.31Å; H146-T150 PolarHBondContact O-OG1 2.96Å; L147-T150 PolarHBondContact O-N 3.38Å; L147-T150 VanDerWaalsContact O-N 3.17Å; T150-N152 VanDerWaalsContact C-N 3.33Å; T150-N152 PolarHBondContact O-N 2.65Å; T150-Q153 WeakPolarHBondContact O-CB 3.32Å; T150-Q153 PolarHBondContact O-N 3.33Å
151	L	81.8	Confident	83.5	Confident	35 Å²	35	59.6 Å²	59.6	18%	0.183	32%	0.322	C	S	.	.	H	α-helix	trans	-68.2	-30.7	178	-66.1	172.3	0	0	0	113.8	L103 L147 Q153 L160 M162 F437	L103-L151 HydrophobicContact CD2-CD1 3.74Å; L147-L151 HydrophobicContact CD1-CD1 3.91Å; L147-L151 HydrophobicContact CD1-CG 4.14Å; L147-L151 HydrophobicContact CG-CD1 3.97Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.25Å; L147-L151 PolarHBondContact O-N 2.75Å; L151-Q153 VanDerWaalsContact C-N 3.28Å; L151-L160 HydrophobicContact CD2-CD2 4.17Å; L151-M162 HydrophobicContact CD1-CE 4.17Å; L151-F437 HydrophobicContact CD2-CE1 3.53Å; L151-F437 HydrophobicContact CD2-CZ 3.66Å
152	N	77	Confident	83	Confident	123 Å²	123	60.2 Å²	60.2	66%	0.658	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-9	177.2	-77	-40.9	0	0	0	113.2	L148 R149 T150 S154	L148-N152 VanDerWaalsContact O-CB 3.32Å; L148-N152 WeakPolarHBondContact O-CB 3.42Å; L148-N152 VanDerWaalsContact O-CG 3.26Å; L148-N152 PolarHBondContact O-N 3.26Å; L148-N152 PolarHBondContact O-ND2 2.71Å; R149-N152 PolarHBondContact O-N 2.75Å; T150-N152 VanDerWaalsContact C-N 3.33Å; T150-N152 PolarHBondContact O-N 2.65Å; N152-S154 PolarHBondContact O-N 3.12Å
153	Q	75.2	Confident	82.6	Confident	130 Å²	130	55.2 Å²	55.2	61%	0.607	31%	0.305	S	S	*	.	S	Bend	trans	-68.9	127.3	171.1	-70	169.1	23.5	0	0	108.9	R149 T150 L151 S155	R149-Q153 WeakPolarHBondContact O-CG 3.38Å; R149-Q153 PolarHBondContact O-N 3.01Å; T150-Q153 WeakPolarHBondContact O-CB 3.32Å; T150-Q153 PolarHBondContact O-N 3.33Å; L151-Q153 VanDerWaalsContact C-N 3.28Å; Q153-S155 PolarHBondContact O-N 3.43Å
154	S	61.3	Low	82.5	Confident	120 Å²	120	55.1 Å²	55.1	84%	0.839	30%	0.304	S	S	*	.			trans	-60.3	121.6	179.4	52.8	0	0	0	0	110.1	N152	N152-S154 PolarHBondContact O-N 3.12Å
155	S	67.4	Low	82.5	Confident	45 Å²	45	55.1 Å²	55.1	32%	0.315	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-108	132.3	167.8	61.1	0	0	0	0	109.5	Q153 G157 L158	Q153-S155 PolarHBondContact O-N 3.43Å; S155-G157 PolarHBondContact O-N 3.01Å; S155-L158 PolarHBondContact O-N 2.9Å; S155-L158 WeakPolarHBondContact OG-CB 3.32Å
156	D	72.8	Confident	82.6	Confident	152 Å²	152	53.8 Å²	53.8	81%	0.813	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	121.8	179.7	-76.3	-21.1	0	0	0	110.2	G295	D156-G295 WeakPolarHBondContact O-CA 3.46Å
157	G	77.4	Confident	82.9	Confident	45 Å²	45	50 Å²	50	46%	0.464	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-6.5	173.5	0	0	0	0	0	116.9	S155 I294	S155-G157 PolarHBondContact O-N 3.01Å; G157-I294 CarbonylContact C-O 3.55Å
158	L	84.9	Confident	83.2	Confident	23 Å²	23	49.8 Å²	49.8	12%	0.12	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.5	174.5	165.8	63.3	0	0	0	110.3	S155 F238 A240 A297	S155-L158 PolarHBondContact O-N 2.9Å; S155-L158 WeakPolarHBondContact OG-CB 3.32Å; L158-F238 HydrophobicContact CD1-CD2 3.64Å; L158-F238 HydrophobicContact CD1-CE2 3.15Å; L158-F238 HydrophobicContact CD1-CZ 3.84Å; L158-F238 HydrophobicContact CG-CE2 4.49Å; L158-A240 HydrophobicContact CD1-CB 3.79Å; L158-A297 HydrophobicContact CD2-CB 4.02Å
159	Q	85.5	Confident	83.5	Confident	57 Å²	57	49.5 Å²	49.5	27%	0.266	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	104.7	172.1	-178.3	-179.6	5.8	0	0	109.3	K239	Q159-K239 HydrophobicContact CB-CB 4.16Å; Q159-K239 PolarHBondContact N-O 3.17Å; Q159-K239 PolarHBondContact O-N 2.9Å
160	L	82.9	Confident	83.7	Confident	36 Å²	36	47.6 Å²	47.6	19%	0.188	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.7	170.2	-178.1	67.6	0	0	0	108.6	L151 I236 F238 F437	L151-L160 HydrophobicContact CD2-CD2 4.17Å; L160-I236 HydrophobicContact CD1-CD1 3.97Å; L160-I236 HydrophobicContact CD1-CG1 3.98Å; L160-F238 HydrophobicContact CD1-CB 4.35Å; L160-F238 HydrophobicContact CD1-CD2 4.13Å; L160-F437 HydrophobicContact CD2-CD1 4.34Å; L160-F437 HydrophobicContact CD2-CE1 3.93Å; L160-F437 HydrophobicContact CD2-CE2 4.47Å; L160-F437 HydrophobicContact CD2-CZ 3.99Å
161	S	79.7	Confident	83.9	Confident	35 Å²	35	51 Å²	51	25%	0.245	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	106.5	171.7	-175.6	0	0	0	0	108.2	I236 F237	S161-I236 CarbonylContact O-C 3.55Å; S161-I236 WeakPolarHBondContact O-CA 3.31Å; S161-F237 PolarHBondContact N-O 3.41Å; S161-F237 PolarHBondContact O-N 3.33Å
162	M	85.5	Confident	84.3	Confident	31 Å²	31	50.6 Å²	50.6	15%	0.153	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	142	179.9	-172.8	177.4	76	0	0	108.2	L103 S104 L148 L151 Y235 I236	L103-M162 HydrophobicContact CG-SD 4.44Å; S104-M162 VanDerWaalsContact CA-SD 3.58Å; S104-M162 WeakPolarHBondContact OG-CG 3.49Å; L148-M162 HydrophobicContact CD2-CE 3.31Å; L151-M162 HydrophobicContact CD1-CE 4.17Å; M162-Y235 WeakPolarHBondContact CA-O 3.47Å; M162-I236 HydrophobicContact CB-CG1 4.14Å; M162-I236 HydrophobicContact CG-CB 4.33Å; M162-I236 HydrophobicContact CG-CD1 4.32Å; M162-I236 HydrophobicContact CG-CG1 4.2Å; M162-I236 HydrophobicContact SD-CD1 4.19Å
163	G	84.4	Confident	85	Confident	12 Å²	12	49.3 Å²	49.3	12%	0.124	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	163	177	0	0	0	0	0	113.5	N234 Y235	G163-N234 PolarHBondContact O-ND2 3.44Å; G163-Y235 PolarHBondContact N-O 2.89Å; G163-Y235 PolarHBondContact O-N 3Å; G163-Y235 VanDerWaalsContact O-N 3.11Å
164	N	89.9	Confident	86	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.4	178.2	-49.1	-76.8	0	0	0	109.3	T107 A108 F111 S188 V233 N234	T107-N164 WeakPolarHBondContact CG2-ND2 3.47Å; A108-N164 WeakPolarHBondContact CA-OD1 3.29Å; A108-N164 WeakPolarHBondContact CB-OD1 3.41Å; F111-N164 HydrophobicContact CD1-CB 3.99Å; F111-N164 HydrophobicContact CE1-CB 4.47Å; N164-S188 WeakPolarHBondContact O-CB 3.34Å; N164-V233 VanDerWaalsContact CA-O 3.31Å; N164-V233 WeakPolarHBondContact CA-O 3.38Å; N164-N234 PolarHBondContact OD1-ND2 3.01Å
165	A	93.8	Very high	87.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	148	169.5	0	0	0	0	0	110.4	F167 E189 F191 Y208 V233	A165-F167 HydrophobicContact CB-CE2 3.74Å; A165-F167 HydrophobicContact CB-CZ 4.1Å; A165-E189 WeakPolarHBondContact CA-O 3.46Å; A165-F191 HydrophobicContact CB-CE2 4.22Å; A165-Y208 HydrophobicContact CB-CD1 4.06Å; A165-Y208 HydrophobicContact CB-CE1 3.36Å; A165-V233 PolarHBondContact N-O 3.41Å; A165-V233 PolarHBondContact O-N 2.74Å
166	M	95.6	Very high	89.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.1	177.2	-173.3	179	-72.8	0	0	109.1	F111 L112 V168 F178 E189 A190 F191 M230 L232 I371	F111-M166 HydrophobicContact CE1-CB 3.87Å; F111-M166 HydrophobicContact CE1-CE 3.9Å; F111-M166 HydrophobicContact CE2-CE 4.47Å; F111-M166 HydrophobicContact CZ-CB 3.91Å; F111-M166 HydrophobicContact CZ-CE 3.86Å; F111-M166 HydrophobicContact CZ-SD 4.46Å; L112-M166 HydrophobicContact CD1-CE 3.78Å; M166-V168 HydrophobicContact CG-CG2 3.8Å; M166-V168 HydrophobicContact SD-CG2 4.08Å; M166-F178 HydrophobicContact CE-CZ 3.86Å; M166-F178 HydrophobicContact SD-CE1 3.86Å; M166-F178 HydrophobicContact SD-CZ 3.73Å; M166-E189 PolarHBondContact N-O 3.49Å; M166-A190 HydrophobicContact CB-CB 4.17Å; M166-A190 CarbonylContact O-C 3.55Å; M166-A190 VanDerWaalsContact O-CA 3.25Å; M166-A190 WeakPolarHBondContact O-CA 3.27Å; M166-F191 PolarHBondContact O-N 3.38Å; M166-M230 HydrophobicContact CE-CE 3.31Å; M166-M230 HydrophobicContact CG-CE 3.69Å; M166-M230 HydrophobicContact CG-CG 4.49Å; M166-M230 HydrophobicContact SD-CE 3.33Å; M166-M230 WeakPolarHBondContact SD-CE 3.22Å; M166-L232 HydrophobicContact CE-CD1 4.37Å; M166-I371 HydrophobicContact CE-CD1 4.14Å; M166-I371 HydrophobicContact SD-CD1 3.83Å; M166-I371 HydrophobicContact SD-CG2 4.26Å
167	F	96.4	Very high	90.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.5	177	-60.4	-94.6	0	0	0	107.2	A165 F191 T193 F195 F204 I205 Y208 M230 V231 V233	A165-F167 HydrophobicContact CB-CE2 3.74Å; A165-F167 HydrophobicContact CB-CZ 4.1Å; F167-F191 WeakPolarHBondContact CA-O 3.36Å; F167-F191 HydrophobicContact CD1-CB 3.99Å; F167-F191 HydrophobicContact CD1-CD2 4.08Å; F167-F191 HydrophobicContact CD1-CG 4.42Å; F167-F191 HydrophobicContact CE1-CB 4.3Å; F167-F191 AromaticContact CE1-CD2 3.69Å; F167-F191 HydrophobicContact CE1-CD2 3.69Å; F167-F191 HydrophobicContact CE1-CE2 4.42Å; F167-F191 HydrophobicContact CE1-CG 4.26Å; F167-F191 HydrophobicContact CZ-CD2 4.06Å; F167-F191 HydrophobicContact CZ-CE2 4.47Å; F167-T193 WeakPolarHBondContact CD1-OG1 3.35Å; F167-F195 HydrophobicContact CB-CE2 4.49Å; F167-F195 HydrophobicContact CB-CZ 3.83Å; F167-F204 AromaticContact CD1-CD1 3.95Å; F167-F204 HydrophobicContact CD1-CD1 3.95Å; F167-F204 AromaticContact CD1-CE1 3.73Å; F167-F204 HydrophobicContact CD1-CE1 3.73Å; F167-F204 AromaticContact CE1-CD1 3.87Å; F167-F204 HydrophobicContact CE1-CD1 3.87Å; F167-F204 AromaticContact CE1-CE1 3.59Å; F167-F204 HydrophobicContact CE1-CE1 3.59Å; F167-F204 HydrophobicContact CE1-CZ 4.12Å; F167-I205 HydrophobicContact CB-CD1 4.23Å; F167-I205 HydrophobicContact CB-CG1 4.34Å; F167-I205 HydrophobicContact CD1-CD1 4.44Å; F167-I205 HydrophobicContact CD1-CG1 3.65Å; F167-I205 HydrophobicContact CD2-CD1 4.23Å; F167-I205 HydrophobicContact CD2-CG1 3.82Å; F167-I205 HydrophobicContact CD2-CG2 4.29Å; F167-I205 HydrophobicContact CE1-CB 4.47Å; F167-I205 HydrophobicContact CE1-CG1 3.8Å; F167-I205 HydrophobicContact CE2-CB 4.35Å; F167-I205 HydrophobicContact CE2-CG1 3.97Å; F167-I205 HydrophobicContact CE2-CG2 3.87Å; F167-I205 HydrophobicContact CG-CD1 4.05Å; F167-I205 HydrophobicContact CG-CG1 3.67Å; F167-I205 HydrophobicContact CZ-CB 4.27Å; F167-I205 HydrophobicContact CZ-CG1 3.95Å; F167-I205 HydrophobicContact CZ-CG2 4.15Å; F167-Y208 AromaticContact CZ-CD1 3.96Å; F167-Y208 HydrophobicContact CZ-CD1 3.96Å; F167-Y208 AromaticContact CZ-CG 3.97Å; F167-Y208 HydrophobicContact CZ-CG 3.97Å; F167-M230 CarbonylContact O-C 3.5Å; F167-M230 VanDerWaalsContact O-CA 3.28Å; F167-M230 WeakPolarHBondContact O-CA 3.47Å; F167-V231 HydrophobicContact CB-CB 4.47Å; F167-V231 PolarHBondContact N-O 2.96Å; F167-V231 PolarHBondContact O-N 2.92Å; F167-V233 HydrophobicContact CD2-CG2 4.17Å; F167-V233 HydrophobicContact CE2-CB 4.13Å; F167-V233 HydrophobicContact CE2-CG2 3.94Å
168	V	95.9	Very high	91.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.6	-173.2	-176.8	0	0	0	0	108.8	M166 E170 L172 L174 F191 A192 T193 M230 I371 T372 L377	M166-V168 HydrophobicContact CG-CG2 3.8Å; M166-V168 HydrophobicContact SD-CG2 4.08Å; V168-E170 PolarHBondContact O-N 2.92Å; V168-L172 HydrophobicContact CG1-CB 4.28Å; V168-L172 HydrophobicContact CG1-CD1 4.24Å; V168-L174 HydrophobicContact CB-CD2 4Å; V168-L174 HydrophobicContact CG1-CD2 4.26Å; V168-L174 HydrophobicContact CG2-CD2 3.83Å; V168-F191 PolarHBondContact N-O 3.14Å; V168-A192 CarbonylContact O-C 3.29Å; V168-A192 WeakPolarHBondContact O-CA 3.42Å; V168-T193 PolarHBondContact O-N 3.29Å; V168-M230 HydrophobicContact CG2-CG 4.33Å; V168-I371 HydrophobicContact CG2-CG2 4.37Å; V168-T372 HydrophobicContact CG1-CG2 4.2Å; V168-L377 HydrophobicContact CG1-CD1 4.23Å; V168-L377 HydrophobicContact CG1-CD2 4.29Å
169	E	94.4	Very high	91.8	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.033	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	127.8	177.6	178.7	59.5	-92.6	0	0	111.5	Q171 L172 T193 F195 Q196 V229	E169-Q171 PolarHBondContact O-N 3.47Å; E169-Q171 VanDerWaalsContact O-N 3.15Å; E169-Q171 VanDerWaalsContact OE1-CD 3.24Å; E169-Q171 PolarHBondContact OE1-NE2 3.28Å; E169-Q171 PolarHBondContact OE1-OE1 3.39Å; E169-Q171 VanDerWaalsContact OE1-OE1 3.1Å; E169-L172 HydrophobicContact CB-CD1 4.42Å; E169-L172 WeakPolarHBondContact O-CB 3.36Å; E169-L172 PolarHBondContact O-N 3.12Å; E169-T193 WeakPolarHBondContact CA-O 3.26Å; E169-F195 HydrophobicContact CB-CD2 4.13Å; E169-F195 WeakPolarHBondContact OE2-CB 3.43Å; E169-Q196 PolarHBondContact OE2-NE2 2.99Å; E169-V229 HydrophobicContact CB-CB 4.29Å; E169-V229 PolarHBondContact N-O 3Å
170	E	90.8	Very high	92.4	Very high	104 Å²	104	50.9 Å²	50.9	49%	0.486	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.4	-167.2	62.6	166.4	-157.2	0	0	114	V168 L172 A192 T193 D194	V168-E170 PolarHBondContact O-N 2.92Å; E170-L172 PolarHBondContact O-N 3.28Å; E170-A192 HydrophobicContact CB-CB 4.09Å; E170-T193 PolarHBondContact N-O 3.18Å; E170-D194 HydrophobicContact CG-CB 4.24Å
171	Q	88.9	Confident	93	Very high	112 Å²	112	50.4 Å²	50.4	52%	0.523	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-9.1	175.7	-51.2	93	36.3	0	0	112.5	E169	E169-Q171 PolarHBondContact O-N 3.47Å; E169-Q171 VanDerWaalsContact O-N 3.15Å; E169-Q171 VanDerWaalsContact OE1-CD 3.24Å; E169-Q171 PolarHBondContact OE1-NE2 3.28Å; E169-Q171 PolarHBondContact OE1-OE1 3.39Å; E169-Q171 VanDerWaalsContact OE1-OE1 3.1Å
172	L	90.4	Very high	93.8	Very high	27 Å²	27	48.8 Å²	48.8	14%	0.141	24%	0.243	C	C	.	.	S	Bend	trans	-97.9	118.5	171.8	-55.5	175.6	0	0	0	109.8	V168 E169 E170 L174 T372 L377	V168-L172 HydrophobicContact CG1-CB 4.28Å; V168-L172 HydrophobicContact CG1-CD1 4.24Å; E169-L172 HydrophobicContact CB-CD1 4.42Å; E169-L172 WeakPolarHBondContact O-CB 3.36Å; E169-L172 PolarHBondContact O-N 3.12Å; E170-L172 PolarHBondContact O-N 3.28Å; L172-L174 PolarHBondContact O-N 3.26Å; L172-T372 HydrophobicContact CB-CG2 3.84Å; L172-L377 HydrophobicContact CD1-CB 4.47Å; L172-L377 HydrophobicContact CD1-CD1 3.72Å
173	S	92.6	Very high	94.3	Very high	96 Å²	96	54.7 Å²	54.7	67%	0.671	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-72.6	116.8	178.7	-59	0	0	0	0	111.3	T372	S173-T372 VanDerWaalsContact O-CA 3.22Å; S173-T372 WeakPolarHBondContact O-CA 3.41Å
174	L	96.3	Very high	94.8	Very high	27 Å²	27	61.5 Å²	61.5	14%	0.141	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-64.3	136.5	170.1	-67.3	174.9	0	0	0	110.8	V168 L172 M179 A190 I371 T372	V168-L174 HydrophobicContact CB-CD2 4Å; V168-L174 HydrophobicContact CG1-CD2 4.26Å; V168-L174 HydrophobicContact CG2-CD2 3.83Å; L172-L174 PolarHBondContact O-N 3.26Å; L174-M179 HydrophobicContact CB-CE 4.24Å; L174-M179 HydrophobicContact CB-CG 4.3Å; L174-M179 HydrophobicContact CB-SD 3.95Å; L174-M179 HydrophobicContact CD1-SD 4.05Å; L174-A190 HydrophobicContact CD1-CB 3.94Å; L174-I371 HydrophobicContact CD2-CG2 3.61Å; L174-T372 HydrophobicContact CD2-CG2 4.48Å
175	L	97.3	Very high	95	Very high	69 Å²	69	62.3 Å²	62.3	36%	0.361	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-75.9	130.8	175.4	-65.8	-179.9	0	0	0	110.8	R177 F178 M179 I371	L175-R177 VanDerWaalsContact C-N 3.27Å; L175-R177 PolarHBondContact O-N 3.4Å; L175-F178 HydrophobicContact CB-CB 4.24Å; L175-F178 WeakPolarHBondContact O-CB 3.46Å; L175-F178 PolarHBondContact O-N 2.73Å; L175-M179 PolarHBondContact O-N 2.86Å; L175-M179 VanDerWaalsContact O-N 3.16Å; L175-I371 PolarHBondContact N-O 3.12Å
176	D	96.7	Very high	95.1	Very high	117 Å²	117	62.9 Å²	62.9	63%	0.626	30%	0.296	S	S	*	.	H	α-helix	trans	-54.8	-44.2	178.8	-67.7	-31.6	0	0	0	112.2	F178 M179 E180	D176-F178 VanDerWaalsContact C-N 3.29Å; D176-F178 PolarHBondContact O-N 2.97Å; D176-M179 PolarHBondContact O-N 2.83Å; D176-M179 VanDerWaalsContact O-N 3.16Å; D176-M179 WeakPolarHBondContact OD1-CE 3.37Å; D176-E180 WeakPolarHBondContact O-CG 3.1Å; D176-E180 PolarHBondContact O-N 2.68Å
177	R	96.6	Very high	95	Very high	191 Å²	191	65.8 Å²	65.8	72%	0.721	33%	0.326	S	S	*	.	H	α-helix	trans	-58.3	-40.8	177.8	-176.8	177.7	176.5	-179.4	-0.1	112.4	L175 E180 D181	L175-R177 VanDerWaalsContact C-N 3.27Å; L175-R177 PolarHBondContact O-N 3.4Å; R177-E180 PolarHBondContact O-N 2.86Å; R177-D181 IonicContact NE-OD2 3.54Å; R177-D181 WeakPolarHBondContact O-CB 3.42Å; R177-D181 PolarHBondContact O-N 3.23Å
178	F	97.2	Very high	94.9	Very high	6 Å²	6	65.9 Å²	65.9	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-44.6	177.9	173.2	-101.5	0	0	0	111	F111 L114 M166 L175 D176 E180 D181 A182 A190 G370 I371	F111-F178 HydrophobicContact CE2-CE1 4.36Å; F111-F178 HydrophobicContact CE2-CE2 4.29Å; F111-F178 AromaticContact CE2-CZ 3.7Å; F111-F178 HydrophobicContact CE2-CZ 3.7Å; F111-F178 HydrophobicContact CZ-CZ 4.06Å; L114-F178 HydrophobicContact CB-CD2 4.3Å; L114-F178 HydrophobicContact CB-CE2 4.02Å; M166-F178 HydrophobicContact CE-CZ 3.86Å; M166-F178 HydrophobicContact SD-CE1 3.86Å; M166-F178 HydrophobicContact SD-CZ 3.73Å; L175-F178 HydrophobicContact CB-CB 4.24Å; L175-F178 WeakPolarHBondContact O-CB 3.46Å; L175-F178 PolarHBondContact O-N 2.73Å; D176-F178 VanDerWaalsContact C-N 3.29Å; D176-F178 PolarHBondContact O-N 2.97Å; F178-E180 VanDerWaalsContact C-N 3.34Å; F178-E180 PolarHBondContact O-N 3.29Å; F178-D181 PolarHBondContact O-N 3.3Å; F178-A182 VanDerWaalsContact O-CB 3.24Å; F178-A182 WeakPolarHBondContact O-CB 3.18Å; F178-A182 PolarHBondContact O-N 2.81Å; F178-A190 HydrophobicContact CD1-CB 4.48Å; F178-A190 HydrophobicContact CE1-CB 3.92Å; F178-G370 WeakPolarHBondContact CB-O 3.27Å; F178-I371 HydrophobicContact CD1-CG2 4.08Å; F178-I371 HydrophobicContact CD2-CG1 4.29Å; F178-I371 HydrophobicContact CE1-CG1 4.38Å; F178-I371 HydrophobicContact CE1-CG2 3.94Å; F178-I371 HydrophobicContact CE2-CG1 3.98Å; F178-I371 HydrophobicContact CZ-CD1 4.36Å; F178-I371 HydrophobicContact CZ-CG1 4.04Å; F178-I371 HydrophobicContact CZ-CG2 4.4Å
179	M	97.1	Very high	94.8	Very high	63 Å²	63	68.9 Å²	68.9	31%	0.31	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-38.9	177.4	-64.5	-172.9	-72.5	0	0	112.2	L174 L175 D176 K183	L174-M179 HydrophobicContact CB-CE 4.24Å; L174-M179 HydrophobicContact CB-CG 4.3Å; L174-M179 HydrophobicContact CB-SD 3.95Å; L174-M179 HydrophobicContact CD1-SD 4.05Å; L175-M179 PolarHBondContact O-N 2.86Å; L175-M179 VanDerWaalsContact O-N 3.16Å; D176-M179 PolarHBondContact O-N 2.83Å; D176-M179 VanDerWaalsContact O-N 3.16Å; D176-M179 WeakPolarHBondContact OD1-CE 3.37Å; M179-K183 WeakPolarHBondContact O-CB 3.37Å; M179-K183 PolarHBondContact O-N 2.92Å; M179-K183 VanDerWaalsContact O-N 3.11Å
180	E	97.1	Very high	94.9	Very high	132 Å²	132	69.2 Å²	69.2	62%	0.617	34%	0.344	S	S	*	.	H	α-helix	trans	-63.1	-47.2	174.3	-73.6	179.2	-179.1	0	0	111.9	D176 R177 F178 K183 R184	D176-E180 WeakPolarHBondContact O-CG 3.1Å; D176-E180 PolarHBondContact O-N 2.68Å; R177-E180 PolarHBondContact O-N 2.86Å; F178-E180 VanDerWaalsContact C-N 3.34Å; F178-E180 PolarHBondContact O-N 3.29Å; E180-K183 PolarHBondContact O-N 3.03Å; E180-R184 WeakPolarHBondContact O-CB 3.38Å; E180-R184 PolarHBondContact O-N 2.76Å
181	D	96.4	Very high	95.1	Very high	26 Å²	26	66.6 Å²	66.6	14%	0.139	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-42.8	179.2	-76.5	-27.1	0	0	0	111.7	L114 R177 F178 K183 R184 L185	L114-D181 HydrophobicContact CD1-CB 4.23Å; R177-D181 IonicContact NE-OD2 3.54Å; R177-D181 WeakPolarHBondContact O-CB 3.42Å; R177-D181 PolarHBondContact O-N 3.23Å; F178-D181 PolarHBondContact O-N 3.3Å; D181-K183 VanDerWaalsContact C-N 3.34Å; D181-K183 PolarHBondContact O-N 3.19Å; D181-R184 PolarHBondContact O-N 2.93Å; D181-R184 IonicContact OD1-CZ 2.86Å; D181-R184 VanDerWaalsContact OD1-CZ 3.26Å; D181-R184 IonicContact OD1-NE 3.69Å; D181-R184 IonicContact OD1-NH2 2.73Å; D181-R184 PolarHBondContact OD1-NH2 3.4Å; D181-L185 HydrophobicContact CB-CD1 4.3Å; D181-L185 VanDerWaalsContact O-CB 3.27Å; D181-L185 WeakPolarHBondContact O-CB 2.99Å; D181-L185 WeakPolarHBondContact O-CG 3.47Å; D181-L185 PolarHBondContact O-N 3.43Å
182	A	96.5	Very high	95.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-54.4	-49.4	174.4	0	0	0	0	0	111.9	F111 F178 Y186 G187 S188	F111-A182 HydrophobicContact CD2-CB 4.13Å; F111-A182 HydrophobicContact CE2-CB 3.41Å; F111-A182 VanDerWaalsContact CE2-CB 3.41Å; F111-A182 HydrophobicContact CZ-CB 4.2Å; F178-A182 VanDerWaalsContact O-CB 3.24Å; F178-A182 WeakPolarHBondContact O-CB 3.18Å; F178-A182 PolarHBondContact O-N 2.81Å; A182-Y186 CarbonylContact O-C 3.51Å; A182-Y186 WeakPolarHBondContact O-CA 3.37Å; A182-Y186 WeakPolarHBondContact O-CB 3.39Å; A182-Y186 PolarHBondContact O-N 3.31Å; A182-G187 PolarHBondContact O-N 3.43Å; A182-S188 CarbonylContact C-O 3.48Å; A182-S188 PolarHBondContact O-N 3.1Å
183	K	95.4	Very high	95.6	Very high	156 Å²	156	63.1 Å²	63.1	68%	0.678	33%	0.326	S	S	*	.	I	π-helix	trans	-69.8	-43.6	-179.9	-173.3	173.8	-176.4	174.2	0	111.9	M179 E180 D181 G187 S188	M179-K183 WeakPolarHBondContact O-CB 3.37Å; M179-K183 PolarHBondContact O-N 2.92Å; M179-K183 VanDerWaalsContact O-N 3.11Å; E180-K183 PolarHBondContact O-N 3.03Å; D181-K183 VanDerWaalsContact C-N 3.34Å; D181-K183 PolarHBondContact O-N 3.19Å; K183-G187 VanDerWaalsContact O-CA 3.29Å; K183-G187 WeakPolarHBondContact O-CA 3.42Å; K183-G187 PolarHBondContact O-N 3.04Å; K183-G187 VanDerWaalsContact O-N 3.09Å; K183-S188 WeakPolarHBondContact CA-O 3.38Å; K183-S188 PolarHBondContact N-O 2.68Å
184	R	95.4	Very high	95.6	Very high	154 Å²	154	61.1 Å²	61.1	58%	0.581	31%	0.307	S	S	*	.	I	π-helix	trans	-70.9	-44.2	-175.2	-179.2	-178.9	67.4	-177.8	3.4	112.8	Q145 E180 D181	Q145-R184 PolarHBondContact NE2-O 3.19Å; E180-R184 WeakPolarHBondContact O-CB 3.38Å; E180-R184 PolarHBondContact O-N 2.76Å; D181-R184 PolarHBondContact O-N 2.93Å; D181-R184 IonicContact OD1-CZ 2.86Å; D181-R184 VanDerWaalsContact OD1-CZ 3.26Å; D181-R184 IonicContact OD1-NE 3.69Å; D181-R184 IonicContact OD1-NH2 2.73Å; D181-R184 PolarHBondContact OD1-NH2 3.4Å
185	L	94.6	Very high	95.5	Very high	22 Å²	22	60.1 Å²	60.1	12%	0.115	30%	0.302	C	S	.	.	I	π-helix	trans	-88.5	-39.4	-173.3	-62.4	172.1	0	0	0	111.5	L114 H141 Q145 D181	L114-L185 HydrophobicContact CD1-CD1 4.27Å; L114-L185 HydrophobicContact CD2-CD1 3.76Å; H141-L185 HydrophobicContact CB-CD1 4.34Å; Q145-L185 VanDerWaalsContact CA-O 3.32Å; Q145-L185 WeakPolarHBondContact CA-O 3.26Å; Q145-L185 HydrophobicContact CB-CD2 4.37Å; Q145-L185 WeakPolarHBondContact CB-O 3.41Å; Q145-L185 HydrophobicContact CG-CD2 4.48Å; D181-L185 HydrophobicContact CB-CD1 4.3Å; D181-L185 VanDerWaalsContact O-CB 3.27Å; D181-L185 WeakPolarHBondContact O-CB 2.99Å; D181-L185 WeakPolarHBondContact O-CG 3.47Å; D181-L185 PolarHBondContact O-N 3.43Å
186	Y	94.8	Very high	95.1	Very high	11 Å²	11	63.7 Å²	63.7	4%	0.043	32%	0.316	C	S	.	.	I	π-helix	trans	-114.5	-11.1	-171.6	-69	-87.5	0	0	0	114.6	T107 A110 F111 L114 H141 F144 L148 A182 S188	T107-Y186 HydrophobicContact CG2-CD1 3.76Å; T107-Y186 HydrophobicContact CG2-CE1 4.17Å; A110-Y186 HydrophobicContact CB-CE1 4Å; A110-Y186 WeakPolarHBondContact CB-OH 3.42Å; A110-Y186 PolarHBondContact O-OH 3.39Å; F111-Y186 HydrophobicContact CB-CD1 3.96Å; F111-Y186 HydrophobicContact CB-CD2 4.2Å; F111-Y186 HydrophobicContact CB-CE1 4.29Å; F111-Y186 HydrophobicContact CB-CG 3.92Å; F111-Y186 HydrophobicContact CD2-CD2 4.42Å; L114-Y186 HydrophobicContact CD1-CD2 3.6Å; L114-Y186 HydrophobicContact CD1-CE2 3.59Å; L114-Y186 HydrophobicContact CD2-CE2 4.34Å; L114-Y186 HydrophobicContact CG-CD2 4.4Å; L114-Y186 HydrophobicContact CG-CE2 3.9Å; H141-Y186 AromaticContact ND1-CE2 3.69Å; H141-Y186 AromaticContact ND1-CZ 3.65Å; H141-Y186 PolarHBondContact ND1-OH 3.05Å; F144-Y186 HydrophobicContact CB-CD1 4.49Å; F144-Y186 HydrophobicContact CB-CE1 3.63Å; F144-Y186 HydrophobicContact CD1-CE1 4.45Å; F144-Y186 AromaticContact CG-CE1 3.98Å; F144-Y186 HydrophobicContact CG-CE1 3.98Å; L148-Y186 HydrophobicContact CD1-CD1 3.81Å; L148-Y186 HydrophobicContact CD1-CG 4.4Å; A182-Y186 CarbonylContact O-C 3.51Å; A182-Y186 WeakPolarHBondContact O-CA 3.37Å; A182-Y186 WeakPolarHBondContact O-CB 3.39Å; A182-Y186 PolarHBondContact O-N 3.31Å; Y186-S188 WeakPolarHBondContact CB-OG 3.44Å; Y186-S188 PolarHBondContact O-N 3.23Å
187	G	93.3	Very high	94.8	Very high	61 Å²	61	61.5 Å²	61.5	63%	0.629	31%	0.305	S	S	*	.			trans	62.2	18.4	-169.2	0	0	0	0	0	112.8	A182 K183	A182-G187 PolarHBondContact O-N 3.43Å; K183-G187 VanDerWaalsContact O-CA 3.29Å; K183-G187 WeakPolarHBondContact O-CA 3.42Å; K183-G187 PolarHBondContact O-N 3.04Å; K183-G187 VanDerWaalsContact O-N 3.09Å
188	S	94.4	Very high	94.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.014	29%	0.29	C	S	.	.			trans	-92.1	162.2	-178	-58.4	0	0	0	0	110.9	N164 A182 K183 Y186	N164-S188 WeakPolarHBondContact O-CB 3.34Å; A182-S188 CarbonylContact C-O 3.48Å; A182-S188 PolarHBondContact O-N 3.1Å; K183-S188 WeakPolarHBondContact CA-O 3.38Å; K183-S188 PolarHBondContact N-O 2.68Å; Y186-S188 WeakPolarHBondContact CB-OG 3.44Å; Y186-S188 PolarHBondContact O-N 3.23Å
189	E	94.2	Very high	94.3	Very high	63 Å²	63	58 Å²	58	29%	0.294	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151	178.8	-65.7	170.7	128.7	0	0	110.7	A165 M166 F191 Y208 R212	A165-E189 WeakPolarHBondContact CA-O 3.46Å; M166-E189 PolarHBondContact N-O 3.49Å; E189-F191 HydrophobicContact CB-CD2 4.44Å; E189-F191 HydrophobicContact CB-CE1 4.38Å; E189-F191 HydrophobicContact CB-CE2 3.55Å; E189-F191 HydrophobicContact CB-CZ 3.52Å; E189-F191 HydrophobicContact CG-CZ 4.18Å; E189-Y208 VanDerWaalsContact OE2-CE2 3.29Å; E189-Y208 WeakPolarHBondContact OE2-CE2 3.4Å; E189-Y208 PolarHBondContact OE2-OH 2.87Å; E189-R212 VanDerWaalsContact CD-NH2 3.31Å; E189-R212 IonicContact OE1-NH2 3.29Å; E189-R212 PolarHBondContact OE1-NH2 3.46Å; E189-R212 IonicContact OE2-CZ 3.85Å; E189-R212 IonicContact OE2-NE 3.8Å; E189-R212 IonicContact OE2-NH2 2.66Å; E189-R212 PolarHBondContact OE2-NH2 2.79Å
190	A	95.9	Very high	94	Very high	14 Å²	14	58.9 Å²	58.9	12%	0.116	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.5	170.6	0	0	0	0	0	109.1	M166 L174 F178	M166-A190 HydrophobicContact CB-CB 4.17Å; M166-A190 CarbonylContact O-C 3.55Å; M166-A190 VanDerWaalsContact O-CA 3.25Å; M166-A190 WeakPolarHBondContact O-CA 3.27Å; L174-A190 HydrophobicContact CD1-CB 3.94Å; F178-A190 HydrophobicContact CD1-CB 4.48Å; F178-A190 HydrophobicContact CE1-CB 3.92Å
191	F	95.8	Very high	93.9	Very high	49 Å²	49	52.7 Å²	52.7	22%	0.215	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.2	-174.9	-59.2	-77.2	0	0	0	110.9	A165 M166 F167 V168 E189 T193 F204 Y208	A165-F191 HydrophobicContact CB-CE2 4.22Å; M166-F191 PolarHBondContact O-N 3.38Å; F167-F191 WeakPolarHBondContact CA-O 3.36Å; F167-F191 HydrophobicContact CD1-CB 3.99Å; F167-F191 HydrophobicContact CD1-CD2 4.08Å; F167-F191 HydrophobicContact CD1-CG 4.42Å; F167-F191 HydrophobicContact CE1-CB 4.3Å; F167-F191 AromaticContact CE1-CD2 3.69Å; F167-F191 HydrophobicContact CE1-CD2 3.69Å; F167-F191 HydrophobicContact CE1-CE2 4.42Å; F167-F191 HydrophobicContact CE1-CG 4.26Å; F167-F191 HydrophobicContact CZ-CD2 4.06Å; F167-F191 HydrophobicContact CZ-CE2 4.47Å; V168-F191 PolarHBondContact N-O 3.14Å; E189-F191 HydrophobicContact CB-CD2 4.44Å; E189-F191 HydrophobicContact CB-CE1 4.38Å; E189-F191 HydrophobicContact CB-CE2 3.55Å; E189-F191 HydrophobicContact CB-CZ 3.52Å; E189-F191 HydrophobicContact CG-CZ 4.18Å; F191-T193 PolarHBondContact O-OG1 2.86Å; F191-F204 HydrophobicContact CB-CE1 4.02Å; F191-F204 HydrophobicContact CB-CZ 4.3Å; F191-F204 HydrophobicContact CD1-CZ 4.21Å; F191-F204 HydrophobicContact CG-CE1 4.33Å; F191-F204 HydrophobicContact CG-CZ 4.16Å; F191-Y208 AromaticContact CE2-CD2 3.9Å; F191-Y208 HydrophobicContact CE2-CD2 3.9Å; F191-Y208 AromaticContact CE2-CE2 3.48Å; F191-Y208 HydrophobicContact CE2-CE2 3.48Å; F191-Y208 VanDerWaalsContact CE2-CE2 3.48Å; F191-Y208 AromaticContact CE2-CZ 3.92Å; F191-Y208 HydrophobicContact CZ-CD2 4.03Å; F191-Y208 AromaticContact CZ-CE2 3.53Å; F191-Y208 HydrophobicContact CZ-CE2 3.53Å
192	A	94.9	Very high	93.8	Very high	60 Å²	60	54.9 Å²	54.9	50%	0.496	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.5	161.3	0	0	0	0	0	109	V168 E170	V168-A192 CarbonylContact O-C 3.29Å; V168-A192 WeakPolarHBondContact O-CA 3.42Å; E170-A192 HydrophobicContact CB-CB 4.09Å
193	T	94.7	Very high	93.7	Very high	7 Å²	7	61.4 Å²	61.4	4%	0.043	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	128.6	-173.7	-54.6	0	0	0	0	109.5	F167 V168 E169 E170 F191 F195 A201 F204	F167-T193 WeakPolarHBondContact CD1-OG1 3.35Å; V168-T193 PolarHBondContact O-N 3.29Å; E169-T193 WeakPolarHBondContact CA-O 3.26Å; E170-T193 PolarHBondContact N-O 3.18Å; F191-T193 PolarHBondContact O-OG1 2.86Å; T193-F195 HydrophobicContact CG2-CD1 4.45Å; T193-F195 HydrophobicContact CG2-CE1 4.18Å; T193-F195 HydrophobicContact CG2-CE2 4.32Å; T193-F195 HydrophobicContact CG2-CZ 4.11Å; T193-F195 PolarHBondContact O-N 3.23Å; T193-A201 HydrophobicContact CG2-CB 3.8Å; T193-F204 HydrophobicContact CG2-CD1 4.12Å
194	D	92.8	Very high	93.7	Very high	53 Å²	53	57.9 Å²	57.9	28%	0.283	32%	0.316	S	S	.	.			trans	-73.1	102.2	172	178.9	8.3	0	0	0	110	E170 Q196	E170-D194 HydrophobicContact CG-CB 4.24Å; D194-Q196 VanDerWaalsContact C-N 3.35Å; D194-Q196 WeakPolarHBondContact OD1-CA 3.18Å; D194-Q196 WeakPolarHBondContact OD1-CB 3.33Å; D194-Q196 WeakPolarHBondContact OD1-CG 3.43Å; D194-Q196 PolarHBondContact OD1-N 2.88Å
195	F	94	Very high	93.6	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.026	29%	0.288	C	S	.	.			trans	-86.9	-3.8	175.1	-70	-72.6	0	0	0	113.2	F167 E169 T193 D197 A201 I205 L224 T228 V231	F167-F195 HydrophobicContact CB-CE2 4.49Å; F167-F195 HydrophobicContact CB-CZ 3.83Å; E169-F195 HydrophobicContact CB-CD2 4.13Å; E169-F195 WeakPolarHBondContact OE2-CB 3.43Å; T193-F195 HydrophobicContact CG2-CD1 4.45Å; T193-F195 HydrophobicContact CG2-CE1 4.18Å; T193-F195 HydrophobicContact CG2-CE2 4.32Å; T193-F195 HydrophobicContact CG2-CZ 4.11Å; T193-F195 PolarHBondContact O-N 3.23Å; F195-D197 PolarHBondContact O-N 3.01Å; F195-A201 HydrophobicContact CD1-CB 3.65Å; F195-A201 HydrophobicContact CE1-CB 4Å; F195-A201 HydrophobicContact CG-CB 4.49Å; F195-I205 HydrophobicContact CE1-CD1 4.07Å; F195-I205 HydrophobicContact CZ-CD1 4.47Å; F195-L224 HydrophobicContact CD1-CD1 4.18Å; F195-L224 HydrophobicContact CE1-CD1 4.15Å; F195-T228 WeakPolarHBondContact CB-O 3.15Å; F195-T228 HydrophobicContact CD1-CG2 3.58Å; F195-T228 HydrophobicContact CD2-CG2 4.34Å; F195-T228 HydrophobicContact CE1-CG2 3.59Å; F195-T228 HydrophobicContact CE2-CG2 4.35Å; F195-T228 HydrophobicContact CG-CG2 3.98Å; F195-T228 WeakPolarHBondContact CG-O 3.46Å; F195-T228 HydrophobicContact CZ-CG2 4Å; F195-V231 HydrophobicContact CE1-CG2 3.78Å; F195-V231 HydrophobicContact CZ-CB 4.32Å; F195-V231 HydrophobicContact CZ-CG2 3.78Å
196	Q	90.3	Very high	93.6	Very high	144 Å²	144	50 Å²	50	67%	0.673	29%	0.285	S	S	*	.	S	Bend	trans	-66.6	-31	172.9	-54.7	-61.9	-50.5	0	0	111.1	E169 D194	E169-Q196 PolarHBondContact OE2-NE2 2.99Å; D194-Q196 VanDerWaalsContact C-N 3.35Å; D194-Q196 WeakPolarHBondContact OD1-CA 3.18Å; D194-Q196 WeakPolarHBondContact OD1-CB 3.33Å; D194-Q196 WeakPolarHBondContact OD1-CG 3.43Å; D194-Q196 PolarHBondContact OD1-N 2.88Å
197	D	90	Very high	93.6	Very high	72 Å²	72	53.1 Å²	53.1	39%	0.385	30%	0.303	S	S	.	.	S	Bend	trans	-102.2	88.7	166	-168.6	-30.9	0	0	0	110.8	F195 A199 V200 A201	F195-D197 PolarHBondContact O-N 3.01Å; D197-A199 PolarHBondContact O-N 2.81Å; D197-A199 VanDerWaalsContact O-N 3.16Å; D197-A199 WeakPolarHBondContact OD1-CB 3.21Å; D197-A199 PolarHBondContact OD1-N 2.85Å; D197-A199 VanDerWaalsContact OD1-N 3.13Å; D197-V200 HydrophobicContact CB-CB 4.04Å; D197-V200 HydrophobicContact CB-CG2 4.14Å; D197-V200 VanDerWaalsContact CG-CG2 3.4Å; D197-V200 PolarHBondContact O-N 3.37Å; D197-V200 VanDerWaalsContact O-N 3.13Å; D197-V200 PolarHBondContact OD1-N 2.91Å; D197-V200 VanDerWaalsContact OD2-CG2 3.31Å; D197-V200 WeakPolarHBondContact OD2-CG2 3.43Å; D197-A201 PolarHBondContact O-N 3.03Å
198	S	90.6	Very high	93.5	Very high	58 Å²	58	51.5 Å²	51.5	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-28.3	-178.7	66.4	0	0	0	0	113.6	K202	S198-K202 WeakPolarHBondContact O-CB 3.25Å; S198-K202 PolarHBondContact O-N 3.17Å
199	A	91.3	Very high	93.3	Very high	65 Å²	65	51.4 Å²	51.4	54%	0.537	28%	0.277	S	S	.	.	H	α-helix	trans	-73.3	-40.6	178.4	0	0	0	0	0	111.3	D197 K203	D197-A199 PolarHBondContact O-N 2.81Å; D197-A199 VanDerWaalsContact O-N 3.16Å; D197-A199 WeakPolarHBondContact OD1-CB 3.21Å; D197-A199 PolarHBondContact OD1-N 2.85Å; D197-A199 VanDerWaalsContact OD1-N 3.13Å; A199-K203 VanDerWaalsContact O-CB 3.3Å; A199-K203 WeakPolarHBondContact O-CB 3.41Å; A199-K203 PolarHBondContact O-N 3.48Å
200	V	91.9	Very high	93.2	Very high	82 Å²	82	52.8 Å²	52.8	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-67.3	-46.9	174.7	173.2	0	0	0	0	110.7	D197 K203 F204	D197-V200 HydrophobicContact CB-CB 4.04Å; D197-V200 HydrophobicContact CB-CG2 4.14Å; D197-V200 VanDerWaalsContact CG-CG2 3.4Å; D197-V200 PolarHBondContact O-N 3.37Å; D197-V200 VanDerWaalsContact O-N 3.13Å; D197-V200 PolarHBondContact OD1-N 2.91Å; D197-V200 VanDerWaalsContact OD2-CG2 3.31Å; D197-V200 WeakPolarHBondContact OD2-CG2 3.43Å; V200-K203 PolarHBondContact O-N 3.21Å; V200-F204 WeakPolarHBondContact O-CB 2.87Å; V200-F204 PolarHBondContact O-N 2.99Å
201	A	94.4	Very high	92.9	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-51.1	176.8	0	0	0	0	0	112	T193 F195 D197 K203 F204 I205 L224	T193-A201 HydrophobicContact CG2-CB 3.8Å; F195-A201 HydrophobicContact CD1-CB 3.65Å; F195-A201 HydrophobicContact CE1-CB 4Å; F195-A201 HydrophobicContact CG-CB 4.49Å; D197-A201 PolarHBondContact O-N 3.03Å; A201-K203 VanDerWaalsContact C-N 3.31Å; A201-K203 PolarHBondContact O-N 3.44Å; A201-F204 PolarHBondContact O-N 2.83Å; A201-I205 VanDerWaalsContact O-CG1 3.31Å; A201-I205 WeakPolarHBondContact O-CG1 3.3Å; A201-I205 PolarHBondContact O-N 3.19Å; A201-L224 HydrophobicContact CB-CD1 3.78Å
202	K	94.5	Very high	92.4	Very high	73 Å²	73	61.2 Å²	61.2	32%	0.317	32%	0.319	S	S	.	.	H	α-helix	trans	-56.1	-46.6	177.5	175.1	-179.1	166.9	-179.7	0	111.3	S198 I205 N206 I221 E222 L224	S198-K202 WeakPolarHBondContact O-CB 3.25Å; S198-K202 PolarHBondContact O-N 3.17Å; K202-I205 PolarHBondContact O-N 3.11Å; K202-N206 WeakPolarHBondContact O-CB 3.35Å; K202-N206 PolarHBondContact O-N 3.05Å; K202-N206 PolarHBondContact O-ND2 2.99Å; K202-I221 VanDerWaalsContact CE-O 3.23Å; K202-I221 WeakPolarHBondContact CE-O 3.35Å; K202-I221 HydrophobicContact CG-CG2 4.37Å; K202-E222 WeakPolarHBondContact CD-O 3.45Å; K202-E222 WeakPolarHBondContact CE-O 3.35Å; K202-E222 PolarHBondContact NZ-O 3.36Å; K202-L224 HydrophobicContact CB-CD1 3.95Å; K202-L224 HydrophobicContact CB-CG 4.49Å
203	K	94.2	Very high	91.7	Very high	137 Å²	137	58.5 Å²	58.5	60%	0.596	30%	0.297	S	S	*	.	H	α-helix	trans	-62.9	-45.2	179	-174.5	-173.6	172.8	-154.9	0	111.2	A199 V200 A201 I205 N206 D207	A199-K203 VanDerWaalsContact O-CB 3.3Å; A199-K203 WeakPolarHBondContact O-CB 3.41Å; A199-K203 PolarHBondContact O-N 3.48Å; V200-K203 PolarHBondContact O-N 3.21Å; A201-K203 VanDerWaalsContact C-N 3.31Å; A201-K203 PolarHBondContact O-N 3.44Å; K203-I205 PolarHBondContact O-N 3.29Å; K203-N206 PolarHBondContact O-N 2.88Å; K203-D207 WeakPolarHBondContact CE-OD2 3.39Å; K203-D207 VanDerWaalsContact O-CB 3.3Å; K203-D207 WeakPolarHBondContact O-CB 3.4Å; K203-D207 PolarHBondContact O-N 3.13Å
204	F	95.1	Very high	91.2	Very high	82 Å²	82	67.6 Å²	67.6	36%	0.36	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-46.8	179.2	175.8	-133	0	0	0	111.9	F167 F191 T193 V200 A201 D207 Y208	F167-F204 AromaticContact CD1-CD1 3.95Å; F167-F204 HydrophobicContact CD1-CD1 3.95Å; F167-F204 AromaticContact CD1-CE1 3.73Å; F167-F204 HydrophobicContact CD1-CE1 3.73Å; F167-F204 AromaticContact CE1-CD1 3.87Å; F167-F204 HydrophobicContact CE1-CD1 3.87Å; F167-F204 AromaticContact CE1-CE1 3.59Å; F167-F204 HydrophobicContact CE1-CE1 3.59Å; F167-F204 HydrophobicContact CE1-CZ 4.12Å; F191-F204 HydrophobicContact CB-CE1 4.02Å; F191-F204 HydrophobicContact CB-CZ 4.3Å; F191-F204 HydrophobicContact CD1-CZ 4.21Å; F191-F204 HydrophobicContact CG-CE1 4.33Å; F191-F204 HydrophobicContact CG-CZ 4.16Å; T193-F204 HydrophobicContact CG2-CD1 4.12Å; V200-F204 WeakPolarHBondContact O-CB 2.87Å; V200-F204 PolarHBondContact O-N 2.99Å; A201-F204 PolarHBondContact O-N 2.83Å; F204-D207 PolarHBondContact O-N 3.22Å; F204-Y208 WeakPolarHBondContact O-CB 3.29Å; F204-Y208 PolarHBondContact O-N 3.27Å
205	I	94.4	Very high	90.8	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-47	179	-63.4	167.5	0	0	0	111.1	F167 F195 A201 K202 K203 Y208 V209 I221 L224 V231 V233	F167-I205 HydrophobicContact CB-CD1 4.23Å; F167-I205 HydrophobicContact CB-CG1 4.34Å; F167-I205 HydrophobicContact CD1-CD1 4.44Å; F167-I205 HydrophobicContact CD1-CG1 3.65Å; F167-I205 HydrophobicContact CD2-CD1 4.23Å; F167-I205 HydrophobicContact CD2-CG1 3.82Å; F167-I205 HydrophobicContact CD2-CG2 4.29Å; F167-I205 HydrophobicContact CE1-CB 4.47Å; F167-I205 HydrophobicContact CE1-CG1 3.8Å; F167-I205 HydrophobicContact CE2-CB 4.35Å; F167-I205 HydrophobicContact CE2-CG1 3.97Å; F167-I205 HydrophobicContact CE2-CG2 3.87Å; F167-I205 HydrophobicContact CG-CD1 4.05Å; F167-I205 HydrophobicContact CG-CG1 3.67Å; F167-I205 HydrophobicContact CZ-CB 4.27Å; F167-I205 HydrophobicContact CZ-CG1 3.95Å; F167-I205 HydrophobicContact CZ-CG2 4.15Å; F195-I205 HydrophobicContact CE1-CD1 4.07Å; F195-I205 HydrophobicContact CZ-CD1 4.47Å; A201-I205 VanDerWaalsContact O-CG1 3.31Å; A201-I205 WeakPolarHBondContact O-CG1 3.3Å; A201-I205 PolarHBondContact O-N 3.19Å; K202-I205 PolarHBondContact O-N 3.11Å; K203-I205 PolarHBondContact O-N 3.29Å; I205-Y208 WeakPolarHBondContact O-CB 3.24Å; I205-Y208 PolarHBondContact O-N 2.98Å; I205-V209 WeakPolarHBondContact O-CG2 3.3Å; I205-V209 PolarHBondContact O-N 3.12Å; I205-V209 VanDerWaalsContact O-N 3.09Å; I205-I221 HydrophobicContact CB-CD1 4.04Å; I205-I221 HydrophobicContact CD1-CD1 3.66Å; I205-I221 HydrophobicContact CG1-CD1 4.41Å; I205-I221 HydrophobicContact CG2-CD1 3.43Å; I205-I221 VanDerWaalsContact CG2-CD1 3.43Å; I205-I221 HydrophobicContact CG2-CG1 4Å; I205-L224 HydrophobicContact CD1-CD1 4.37Å; I205-V231 HydrophobicContact CD1-CB 4.4Å; I205-V231 HydrophobicContact CD1-CG2 4.44Å; I205-V233 HydrophobicContact CG2-CG2 3.59Å
206	N	93.8	Very high	90.2	Very high	10 Å²	10	71.7 Å²	71.7	5%	0.053	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-41.1	178.9	-77.2	-25.6	0	0	0	112.3	K202 K203 Y208 V209 K210 L220 I221	K202-N206 WeakPolarHBondContact O-CB 3.35Å; K202-N206 PolarHBondContact O-N 3.05Å; K202-N206 PolarHBondContact O-ND2 2.99Å; K203-N206 PolarHBondContact O-N 2.88Å; N206-Y208 VanDerWaalsContact C-N 3.33Å; N206-Y208 PolarHBondContact O-N 2.71Å; N206-V209 PolarHBondContact O-N 3.27Å; N206-K210 WeakPolarHBondContact O-CB 3.46Å; N206-K210 PolarHBondContact O-N 3.37Å; N206-L220 PolarHBondContact OD1-N 2.96Å; N206-I221 PolarHBondContact ND2-O 3.25Å; N206-I221 PolarHBondContact OD1-N 2.64Å
207	D	94.4	Very high	89.8	Confident	77 Å²	77	65 Å²	65	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-63.9	-38.3	176	-79.6	-22	0	0	0	111.6	K203 F204 N211	K203-D207 WeakPolarHBondContact CE-OD2 3.39Å; K203-D207 VanDerWaalsContact O-CB 3.3Å; K203-D207 WeakPolarHBondContact O-CB 3.4Å; K203-D207 PolarHBondContact O-N 3.13Å; F204-D207 PolarHBondContact O-N 3.22Å; D207-N211 WeakPolarHBondContact O-CB 3.43Å; D207-N211 PolarHBondContact O-N 3.33Å
208	Y	92.6	Very high	89.5	Confident	26 Å²	26	64.4 Å²	64.4	10%	0.102	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-54	173.9	176.4	-91.7	0	0	0	111.2	A165 F167 E189 F191 F204 I205 N206 K210 N211 R212 Y235	A165-Y208 HydrophobicContact CB-CD1 4.06Å; A165-Y208 HydrophobicContact CB-CE1 3.36Å; F167-Y208 AromaticContact CZ-CD1 3.96Å; F167-Y208 HydrophobicContact CZ-CD1 3.96Å; F167-Y208 AromaticContact CZ-CG 3.97Å; F167-Y208 HydrophobicContact CZ-CG 3.97Å; E189-Y208 VanDerWaalsContact OE2-CE2 3.29Å; E189-Y208 WeakPolarHBondContact OE2-CE2 3.4Å; E189-Y208 PolarHBondContact OE2-OH 2.87Å; F191-Y208 AromaticContact CE2-CD2 3.9Å; F191-Y208 HydrophobicContact CE2-CD2 3.9Å; F191-Y208 AromaticContact CE2-CE2 3.48Å; F191-Y208 HydrophobicContact CE2-CE2 3.48Å; F191-Y208 VanDerWaalsContact CE2-CE2 3.48Å; F191-Y208 AromaticContact CE2-CZ 3.92Å; F191-Y208 HydrophobicContact CZ-CD2 4.03Å; F191-Y208 AromaticContact CZ-CE2 3.53Å; F191-Y208 HydrophobicContact CZ-CE2 3.53Å; F204-Y208 WeakPolarHBondContact O-CB 3.29Å; F204-Y208 PolarHBondContact O-N 3.27Å; I205-Y208 WeakPolarHBondContact O-CB 3.24Å; I205-Y208 PolarHBondContact O-N 2.98Å; N206-Y208 VanDerWaalsContact C-N 3.33Å; N206-Y208 PolarHBondContact O-N 2.71Å; Y208-K210 VanDerWaalsContact C-N 3.34Å; Y208-K210 PolarHBondContact O-N 2.95Å; Y208-N211 PolarHBondContact O-N 2.82Å; Y208-R212 HydrophobicContact CD1-CG 4.26Å; Y208-R212 HydrophobicContact CE1-CG 3.84Å; Y208-R212 HydrophobicContact CE2-CG 4.27Å; Y208-R212 WeakPolarHBondContact O-CG 3.35Å; Y208-R212 PolarHBondContact O-N 2.89Å; Y208-R212 PolarHBondContact OH-NE 3.32Å; Y208-Y235 HydrophobicContact CE1-CE1 4.09Å
209	V	89.7	Confident	89.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-41.2	-178.4	178.1	0	0	0	0	111	I205 N206 N211 R212 T213 I217 L220 V233 Y235	I205-V209 WeakPolarHBondContact O-CG2 3.3Å; I205-V209 PolarHBondContact O-N 3.12Å; I205-V209 VanDerWaalsContact O-N 3.09Å; N206-V209 PolarHBondContact O-N 3.27Å; V209-N211 VanDerWaalsContact C-N 3.33Å; V209-N211 PolarHBondContact O-N 3.42Å; V209-R212 PolarHBondContact O-N 3.31Å; V209-T213 HydrophobicContact CG1-CG2 4.18Å; V209-T213 WeakPolarHBondContact O-CB 3.32Å; V209-T213 WeakPolarHBondContact O-CG2 3.42Å; V209-T213 PolarHBondContact O-N 3.47Å; V209-T213 PolarHBondContact O-OG1 3.42Å; V209-I217 HydrophobicContact CG1-CB 3.89Å; V209-I217 HydrophobicContact CG1-CG2 3.54Å; V209-L220 HydrophobicContact CG1-CB 4.39Å; V209-L220 HydrophobicContact CG1-CD2 4.35Å; V209-L220 HydrophobicContact CG2-CB 4.46Å; V209-L220 HydrophobicContact CG2-CD2 3.66Å; V209-V233 HydrophobicContact CG2-CG1 3.56Å; V209-Y235 HydrophobicContact CG1-CD1 4.09Å; V209-Y235 HydrophobicContact CG1-CG 4.13Å; V209-Y235 HydrophobicContact CG2-CD1 4.18Å
210	K	91.1	Very high	88.8	Confident	93 Å²	93	63.2 Å²	63.2	40%	0.404	30%	0.303	S	S	.	.	H	α-helix	trans	-58.6	-44.9	175.9	-174.8	-178.1	178.2	176.6	0	111.8	N206 Y208 T213 R214 G215 I217 T218	N206-K210 WeakPolarHBondContact O-CB 3.46Å; N206-K210 PolarHBondContact O-N 3.37Å; Y208-K210 VanDerWaalsContact C-N 3.34Å; Y208-K210 PolarHBondContact O-N 2.95Å; K210-T213 PolarHBondContact O-N 3.28Å; K210-T213 PolarHBondContact O-OG1 2.8Å; K210-R214 PolarHBondContact O-N 3.07Å; K210-R214 VanDerWaalsContact O-N 3.09Å; K210-G215 PolarHBondContact O-N 3.03Å; K210-I217 WeakPolarHBondContact CA-O 3.44Å; K210-I217 PolarHBondContact N-O 3.16Å; K210-T218 HydrophobicContact CD-CG2 4.19Å; K210-T218 HydrophobicContact CG-CG2 4.24Å
211	N	90	Very high	88.5	Confident	130 Å²	130	59.4 Å²	59.4	70%	0.695	28%	0.28	S	S	*	.	H	α-helix	trans	-64.9	-47.3	177.6	-171.1	15.8	0	0	0	111.2	D207 Y208 V209 T213 R214	D207-N211 WeakPolarHBondContact O-CB 3.43Å; D207-N211 PolarHBondContact O-N 3.33Å; Y208-N211 PolarHBondContact O-N 2.82Å; V209-N211 VanDerWaalsContact C-N 3.33Å; V209-N211 PolarHBondContact O-N 3.42Å; N211-T213 VanDerWaalsContact C-N 3.26Å; N211-T213 PolarHBondContact O-N 2.87Å; N211-R214 PolarHBondContact O-N 3.14Å; N211-R214 VanDerWaalsContact O-N 3.12Å
212	R	85.5	Confident	88	Confident	110 Å²	110	65.3 Å²	65.3	42%	0.415	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-32.2	179.7	-68.5	-66.1	-175.2	-162.7	-0.7	113.3	E189 Y208 V209 Y235	E189-R212 VanDerWaalsContact CD-NH2 3.31Å; E189-R212 IonicContact OE1-NH2 3.29Å; E189-R212 PolarHBondContact OE1-NH2 3.46Å; E189-R212 IonicContact OE2-CZ 3.85Å; E189-R212 IonicContact OE2-NE 3.8Å; E189-R212 IonicContact OE2-NH2 2.66Å; E189-R212 PolarHBondContact OE2-NH2 2.79Å; Y208-R212 HydrophobicContact CD1-CG 4.26Å; Y208-R212 HydrophobicContact CE1-CG 3.84Å; Y208-R212 HydrophobicContact CE2-CG 4.27Å; Y208-R212 WeakPolarHBondContact O-CG 3.35Å; Y208-R212 PolarHBondContact O-N 2.89Å; Y208-R212 PolarHBondContact OH-NE 3.32Å; V209-R212 PolarHBondContact O-N 3.31Å; R212-Y235 HydrophobicContact CB-CE1 4.12Å; R212-Y235 HydrophobicContact CB-CE2 3.8Å; R212-Y235 VanDerWaalsContact CB-CZ 3.44Å; R212-Y235 WeakPolarHBondContact CB-OH 3.23Å; R212-Y235 HydrophobicContact CG-CE1 4.38Å; R212-Y235 VanDerWaalsContact CG-OH 3.27Å; R212-Y235 WeakPolarHBondContact CG-OH 2.99Å
213	T	80.8	Confident	87.6	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.018	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	11	178.7	63.4	0	0	0	0	113.6	V209 K210 N211 G215 K216 I217 Y235	V209-T213 HydrophobicContact CG1-CG2 4.18Å; V209-T213 WeakPolarHBondContact O-CB 3.32Å; V209-T213 WeakPolarHBondContact O-CG2 3.42Å; V209-T213 PolarHBondContact O-N 3.47Å; V209-T213 PolarHBondContact O-OG1 3.42Å; K210-T213 PolarHBondContact O-N 3.28Å; K210-T213 PolarHBondContact O-OG1 2.8Å; N211-T213 VanDerWaalsContact C-N 3.26Å; N211-T213 PolarHBondContact O-N 2.87Å; T213-G215 PolarHBondContact O-N 3.32Å; T213-K216 VanDerWaalsContact O-CB 3.31Å; T213-K216 WeakPolarHBondContact O-CB 3.32Å; T213-K216 VanDerWaalsContact O-CG 3.25Å; T213-K216 WeakPolarHBondContact O-CG 3.43Å; T213-K216 PolarHBondContact O-N 2.78Å; T213-K216 VanDerWaalsContact O-N 3.1Å; T213-I217 HydrophobicContact CG2-CB 4.13Å; T213-I217 HydrophobicContact CG2-CD1 4.06Å; T213-I217 HydrophobicContact CG2-CG1 4.17Å; T213-I217 PolarHBondContact OG1-N 3.14Å; T213-I217 PolarHBondContact OG1-O 2.77Å; T213-Y235 HydrophobicContact CG2-CD2 3.5Å; T213-Y235 HydrophobicContact CG2-CE2 4.06Å; T213-Y235 HydrophobicContact CG2-CG 4.05Å
214	R	83.3	Confident	87.3	Confident	197 Å²	197	62.4 Å²	62.4	74%	0.743	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	38	-179.3	-53.3	-179	-176.1	178.5	2.7	113.3	K210 N211	K210-R214 PolarHBondContact O-N 3.07Å; K210-R214 VanDerWaalsContact O-N 3.09Å; N211-R214 PolarHBondContact O-N 3.14Å; N211-R214 VanDerWaalsContact O-N 3.12Å
215	G	85.3	Confident	86.9	Confident	34 Å²	34	63.1 Å²	63.1	35%	0.351	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	5.7	178.4	0	0	0	0	0	115.2	K210 T213	K210-G215 PolarHBondContact O-N 3.03Å; T213-G215 PolarHBondContact O-N 3.32Å
216	K	81.3	Confident	86.5	Confident	111 Å²	111	67.9 Å²	67.9	48%	0.483	34%	0.343	S	S	.	.	S	Bend	trans	-79.8	-31.2	-177.2	-64.6	-73.6	163.4	176.3	0	113.3	T213 F237 E396	T213-K216 VanDerWaalsContact O-CB 3.31Å; T213-K216 WeakPolarHBondContact O-CB 3.32Å; T213-K216 VanDerWaalsContact O-CG 3.25Å; T213-K216 WeakPolarHBondContact O-CG 3.43Å; T213-K216 PolarHBondContact O-N 2.78Å; T213-K216 VanDerWaalsContact O-N 3.1Å; K216-F237 HydrophobicContact CB-CD2 3.98Å; K216-F237 HydrophobicContact CB-CE2 4.04Å; K216-F237 HydrophobicContact CD-CE2 3.87Å; K216-F237 HydrophobicContact CD-CZ 4.26Å; K216-F237 HydrophobicContact CG-CD2 4.04Å; K216-F237 HydrophobicContact CG-CE2 3.65Å; K216-F237 HydrophobicContact CG-CZ 3.99Å; K216-E396 WeakPolarHBondContact CE-OE1 3.3Å; K216-E396 IonicContact NZ-OE1 2.63Å; K216-E396 PolarHBondContact NZ-OE1 2.92Å
217	I	81.3	Confident	86.2	Confident	3 Å²	3	74.9 Å²	74.9	2%	0.015	38%	0.375	C	S	.	.			trans	-115.8	108.5	172	-62.2	-179.6	0	0	0	107.4	V209 K210 T213 L220 K385	V209-I217 HydrophobicContact CG1-CB 3.89Å; V209-I217 HydrophobicContact CG1-CG2 3.54Å; K210-I217 WeakPolarHBondContact CA-O 3.44Å; K210-I217 PolarHBondContact N-O 3.16Å; T213-I217 HydrophobicContact CG2-CB 4.13Å; T213-I217 HydrophobicContact CG2-CD1 4.06Å; T213-I217 HydrophobicContact CG2-CG1 4.17Å; T213-I217 PolarHBondContact OG1-N 3.14Å; T213-I217 PolarHBondContact OG1-O 2.77Å; I217-L220 HydrophobicContact CG2-CB 4.14Å; I217-K385 HydrophobicContact CB-CD 4.46Å; I217-K385 HydrophobicContact CD1-CB 4.49Å; I217-K385 HydrophobicContact CD1-CD 4.34Å; I217-K385 HydrophobicContact CD1-CG 4.44Å; I217-K385 HydrophobicContact CG1-CD 4.27Å; I217-K385 HydrophobicContact CG2-CD 3.57Å
218	T	84.9	Confident	86.1	Confident	60 Å²	60	71.6 Å²	71.6	37%	0.368	36%	0.357	S	S	.	.			trans	-99.8	-35.8	-176.1	51.8	0	0	0	0	113.3	K210	K210-T218 HydrophobicContact CD-CG2 4.19Å; K210-T218 HydrophobicContact CG-CG2 4.24Å
219	D	83.1	Confident	86.1	Confident	95 Å²	95	72.5 Å²	72.5	51%	0.508	37%	0.366	S	S	.	.			trans	-129.7	84.4	-173.2	-55.5	-76.7	0	0	0	107.1	K385	D219-K385 PolarHBondContact O-NZ 3.33Å
220	L	84.3	Confident	86.4	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.021	37%	0.366	C	S	.	.	S	Bend	trans	-82.1	-47.1	176.6	178.5	68.5	0	0	0	110.2	N206 V209 I217 V233 V383 K385	N206-L220 PolarHBondContact OD1-N 2.96Å; V209-L220 HydrophobicContact CG1-CB 4.39Å; V209-L220 HydrophobicContact CG1-CD2 4.35Å; V209-L220 HydrophobicContact CG2-CB 4.46Å; V209-L220 HydrophobicContact CG2-CD2 3.66Å; I217-L220 HydrophobicContact CG2-CB 4.14Å; L220-V233 HydrophobicContact CD2-CB 4.04Å; L220-V233 HydrophobicContact CD2-CG1 3.24Å; L220-V233 HydrophobicContact CD2-CG2 3.77Å; L220-V383 HydrophobicContact CD1-CG1 3.72Å; L220-V383 HydrophobicContact CD2-CG1 4.35Å; L220-V383 HydrophobicContact CG-CB 4.43Å; L220-V383 HydrophobicContact CG-CG1 3.74Å; L220-K385 HydrophobicContact CD1-CB 3.28Å; L220-K385 HydrophobicContact CD1-CD 4.25Å; L220-K385 HydrophobicContact CD1-CG 4.4Å
221	I	85.3	Confident	86.6	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	35%	0.347	C	S	.	.			trans	-102.4	119.8	179.7	-60.1	-167.2	0	0	0	108.7	K202 I205 N206 D223 L224 V231 V233 V383	K202-I221 VanDerWaalsContact CE-O 3.23Å; K202-I221 WeakPolarHBondContact CE-O 3.35Å; K202-I221 HydrophobicContact CG-CG2 4.37Å; I205-I221 HydrophobicContact CB-CD1 4.04Å; I205-I221 HydrophobicContact CD1-CD1 3.66Å; I205-I221 HydrophobicContact CG1-CD1 4.41Å; I205-I221 HydrophobicContact CG2-CD1 3.43Å; I205-I221 VanDerWaalsContact CG2-CD1 3.43Å; I205-I221 HydrophobicContact CG2-CG1 4Å; N206-I221 PolarHBondContact ND2-O 3.25Å; N206-I221 PolarHBondContact OD1-N 2.64Å; I221-D223 WeakPolarHBondContact CG2-O 3.42Å; I221-L224 HydrophobicContact CD1-CD2 4.13Å; I221-L224 HydrophobicContact CG2-CD2 3.67Å; I221-L224 HydrophobicContact CG2-CG 3.76Å; I221-V231 HydrophobicContact CD1-CG1 3.74Å; I221-V233 HydrophobicContact CD1-CG2 4.3Å; I221-V383 HydrophobicContact CD1-CG2 4.5Å; I221-V383 HydrophobicContact CG1-CG2 4.29Å
222	E	83.9	Confident	86.8	Confident	125 Å²	125	61.9 Å²	61.9	58%	0.584	31%	0.314	S	S	*	.	S	Bend	trans	-85.5	-47.4	174.2	-65.2	-167.4	164.1	0	0	111.1	K202	K202-E222 WeakPolarHBondContact CD-O 3.45Å; K202-E222 WeakPolarHBondContact CE-O 3.35Å; K202-E222 PolarHBondContact NZ-O 3.36Å
223	D	84.5	Confident	87.1	Confident	125 Å²	125	56.7 Å²	56.7	67%	0.668	29%	0.294	S	S	*	.			trans	-138.2	149.9	-177.5	-65.8	-52.1	0	0	0	110.7	I221	I221-D223 WeakPolarHBondContact CG2-O 3.42Å
224	L	88.2	Confident	87.5	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.12	29%	0.293	C	S	.	.			trans	-125.3	130.3	171.9	-69.7	175.7	0	0	0	108.3	F195 A201 K202 I205 I221 T228 V231	F195-L224 HydrophobicContact CD1-CD1 4.18Å; F195-L224 HydrophobicContact CE1-CD1 4.15Å; A201-L224 HydrophobicContact CB-CD1 3.78Å; K202-L224 HydrophobicContact CB-CD1 3.95Å; K202-L224 HydrophobicContact CB-CG 4.49Å; I205-L224 HydrophobicContact CD1-CD1 4.37Å; I221-L224 HydrophobicContact CD1-CD2 4.13Å; I221-L224 HydrophobicContact CG2-CD2 3.67Å; I221-L224 HydrophobicContact CG2-CG 3.76Å; L224-T228 HydrophobicContact CD2-CG2 4.35Å; L224-V231 HydrophobicContact CD2-CG2 3.91Å
225	D	86.9	Confident	87.5	Confident	98 Å²	98	47.8 Å²	47.8	52%	0.524	26%	0.26	S	S	.	.			trans	-71.8	149.7	175.7	-175.6	-97.6	0	0	0	111	Q227 T228	D225-Q227 PolarHBondContact O-N 3.32Å; D225-Q227 VanDerWaalsContact O-N 3.13Å; D225-Q227 WeakPolarHBondContact OD1-CA 2.95Å; D225-Q227 VanDerWaalsContact OD1-CB 3.28Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.45Å; D225-Q227 WeakPolarHBondContact OD1-CG 3.47Å; D225-Q227 PolarHBondContact OD1-N 2.83Å; D225-T228 PolarHBondContact N-OG1 3.44Å; D225-T228 VanDerWaalsContact O-CB 3.23Å; D225-T228 WeakPolarHBondContact O-CB 3.43Å; D225-T228 PolarHBondContact O-N 3.17Å; D225-T228 PolarHBondContact O-OG1 2.94Å
226	S	86.4	Confident	87.5	Confident	100 Å²	100	46.2 Å²	46.2	70%	0.699	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.6	178.4	61.9	0	0	0	0	114.8
227	Q	87.4	Confident	87.6	Confident	157 Å²	157	41.9 Å²	41.9	73%	0.734	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	10.6	176.8	-49	-164.3	-77	0	0	112.6	D225 V229	D225-Q227 PolarHBondContact O-N 3.32Å; D225-Q227 VanDerWaalsContact O-N 3.13Å; D225-Q227 WeakPolarHBondContact OD1-CA 2.95Å; D225-Q227 VanDerWaalsContact OD1-CB 3.28Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.45Å; D225-Q227 WeakPolarHBondContact OD1-CG 3.47Å; D225-Q227 PolarHBondContact OD1-N 2.83Å; Q227-V229 PolarHBondContact O-N 3.42Å
228	T	92.6	Very high	87.7	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.043	23%	0.226	C	C	.	.			trans	-61.4	122.5	177.9	-60.2	0	0	0	0	109.8	F195 L224 D225 V231	F195-T228 WeakPolarHBondContact CB-O 3.15Å; F195-T228 HydrophobicContact CD1-CG2 3.58Å; F195-T228 HydrophobicContact CD2-CG2 4.34Å; F195-T228 HydrophobicContact CE1-CG2 3.59Å; F195-T228 HydrophobicContact CE2-CG2 4.35Å; F195-T228 HydrophobicContact CG-CG2 3.98Å; F195-T228 WeakPolarHBondContact CG-O 3.46Å; F195-T228 HydrophobicContact CZ-CG2 4Å; L224-T228 HydrophobicContact CD2-CG2 4.35Å; D225-T228 PolarHBondContact N-OG1 3.44Å; D225-T228 VanDerWaalsContact O-CB 3.23Å; D225-T228 WeakPolarHBondContact O-CB 3.43Å; D225-T228 PolarHBondContact O-N 3.17Å; D225-T228 PolarHBondContact O-OG1 2.94Å; T228-V231 HydrophobicContact CG2-CG2 3.48Å; T228-V231 VanDerWaalsContact CG2-CG2 3.48Å
229	V	92.9	Very high	87.8	Confident	46 Å²	46	41.9 Å²	41.9	28%	0.279	22%	0.22	S	C	.	.			trans	-119.1	-17.2	174.6	-66.6	0	0	0	0	112.4	E169 Q227 L377 A378 S380	E169-V229 HydrophobicContact CB-CB 4.29Å; E169-V229 PolarHBondContact N-O 3Å; Q227-V229 PolarHBondContact O-N 3.42Å; V229-L377 HydrophobicContact CB-CD1 4.4Å; V229-L377 HydrophobicContact CG2-CD1 4.12Å; V229-A378 WeakPolarHBondContact CG2-O 3.29Å; V229-S380 WeakPolarHBondContact CG2-OG 3.19Å; V229-S380 PolarHBondContact N-OG 3.08Å
230	M	94.8	Very high	88.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	129.5	-179.5	-177.2	175.2	170.1	0	0	112.1	L112 M166 F167 V168 L368 I371 L377 A378 V379 S380 Q381	L112-M230 HydrophobicContact CD1-CE 3.4Å; M166-M230 HydrophobicContact CE-CE 3.31Å; M166-M230 HydrophobicContact CG-CE 3.69Å; M166-M230 HydrophobicContact CG-CG 4.49Å; M166-M230 HydrophobicContact SD-CE 3.33Å; M166-M230 WeakPolarHBondContact SD-CE 3.22Å; F167-M230 CarbonylContact O-C 3.5Å; F167-M230 VanDerWaalsContact O-CA 3.28Å; F167-M230 WeakPolarHBondContact O-CA 3.47Å; V168-M230 HydrophobicContact CG2-CG 4.33Å; M230-L368 HydrophobicContact SD-CD1 3.89Å; M230-I371 HydrophobicContact CE-CD1 3.78Å; M230-I371 HydrophobicContact SD-CD1 4.21Å; M230-L377 HydrophobicContact CB-CD1 3.87Å; M230-L377 HydrophobicContact SD-CD1 4.16Å; M230-L377 HydrophobicContact SD-CD2 3.97Å; M230-L377 HydrophobicContact SD-CG 4Å; M230-A378 WeakPolarHBondContact CB-O 3.36Å; M230-V379 HydrophobicContact CE-CG2 3.78Å; M230-V379 HydrophobicContact SD-CG2 3.81Å; M230-S380 PolarHBondContact N-OG 2.95Å; M230-S380 WeakPolarHBondContact O-CA 3.4Å; M230-S380 VanDerWaalsContact O-CB 3.27Å; M230-S380 WeakPolarHBondContact O-CB 3.31Å; M230-S380 PolarHBondContact O-N 2.8Å; M230-Q381 PolarHBondContact O-N 2.88Å
231	V	95.2	Very high	88.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.5	173.9	-176.5	0	0	0	0	109.7	F167 F195 I205 I221 L224 T228 V233 Q381	F167-V231 HydrophobicContact CB-CB 4.47Å; F167-V231 PolarHBondContact N-O 2.96Å; F167-V231 PolarHBondContact O-N 2.92Å; F195-V231 HydrophobicContact CE1-CG2 3.78Å; F195-V231 HydrophobicContact CZ-CB 4.32Å; F195-V231 HydrophobicContact CZ-CG2 3.78Å; I205-V231 HydrophobicContact CD1-CB 4.4Å; I205-V231 HydrophobicContact CD1-CG2 4.44Å; I221-V231 HydrophobicContact CD1-CG1 3.74Å; L224-V231 HydrophobicContact CD2-CG2 3.91Å; T228-V231 HydrophobicContact CG2-CG2 3.48Å; T228-V231 VanDerWaalsContact CG2-CG2 3.48Å; V231-V233 HydrophobicContact CG1-CG2 4Å; V231-Q381 HydrophobicContact CG1-CB 4.38Å; V231-Q381 HydrophobicContact CG2-CB 4.41Å
232	L	95	Very high	88.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.9	169	179.9	64.2	0	0	0	109.1	A108 F111 L112 M166 Q381 V382 V383	A108-L232 HydrophobicContact CB-CD2 4.07Å; A108-L232 HydrophobicContact CB-CG 4.44Å; F111-L232 HydrophobicContact CD1-CD1 3.96Å; F111-L232 HydrophobicContact CE1-CD1 4Å; L112-L232 HydrophobicContact CB-CD2 4.14Å; L112-L232 HydrophobicContact CD2-CD2 4.19Å; M166-L232 HydrophobicContact CE-CD1 4.37Å; L232-Q381 PolarHBondContact N-O 3.03Å; L232-V382 HydrophobicContact CB-CG1 4.49Å; L232-V382 HydrophobicContact CB-CG2 4.26Å; L232-V382 HydrophobicContact CD2-CG1 4.19Å; L232-V382 HydrophobicContact CD2-CG2 4.39Å; L232-V382 HydrophobicContact CG-CG1 4.49Å; L232-V382 WeakPolarHBondContact O-CA 3.11Å; L232-V383 PolarHBondContact O-N 3.28Å
233	V	91.4	Very high	89.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.7	178.6	161.4	0	0	0	0	110.1	N164 A165 F167 I205 V209 L220 I221 V231 Y235	N164-V233 VanDerWaalsContact CA-O 3.31Å; N164-V233 WeakPolarHBondContact CA-O 3.38Å; A165-V233 PolarHBondContact N-O 3.41Å; A165-V233 PolarHBondContact O-N 2.74Å; F167-V233 HydrophobicContact CD2-CG2 4.17Å; F167-V233 HydrophobicContact CE2-CB 4.13Å; F167-V233 HydrophobicContact CE2-CG2 3.94Å; I205-V233 HydrophobicContact CG2-CG2 3.59Å; V209-V233 HydrophobicContact CG2-CG1 3.56Å; L220-V233 HydrophobicContact CD2-CB 4.04Å; L220-V233 HydrophobicContact CD2-CG1 3.24Å; L220-V233 HydrophobicContact CD2-CG2 3.77Å; I221-V233 HydrophobicContact CD1-CG2 4.3Å; V231-V233 HydrophobicContact CG1-CG2 4Å; V233-Y235 HydrophobicContact CG1-CD1 4.14Å
234	N	88.7	Confident	89.7	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.011	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.3	170.1	177.5	-103.5	0	0	0	111	S104 A108 G163 N164 V383 H384	S104-N234 VanDerWaalsContact CB-OD1 3.25Å; S104-N234 WeakPolarHBondContact CB-OD1 3.43Å; S104-N234 PolarHBondContact O-ND2 2.72Å; S104-N234 PolarHBondContact OG-ND2 2.94Å; S104-N234 PolarHBondContact OG-OD1 3.11Å; A108-N234 HydrophobicContact CB-CB 3.98Å; G163-N234 PolarHBondContact O-ND2 3.44Å; N164-N234 PolarHBondContact OD1-ND2 3.01Å; N234-V383 PolarHBondContact N-O 2.89Å; N234-H384 PolarHBondContact OD1-CE1 3.39Å; N234-H384 PolarHBondContact OD1-ND1 2.88Å
235	Y	84.3	Confident	89.9	Confident	11 Å²	11	42.2 Å²	42.2	4%	0.043	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.5	174.8	62	-92.6	0	0	0	111.4	M162 G163 Y208 V209 R212 T213 V233	M162-Y235 WeakPolarHBondContact CA-O 3.47Å; G163-Y235 PolarHBondContact N-O 2.89Å; G163-Y235 PolarHBondContact O-N 3Å; G163-Y235 VanDerWaalsContact O-N 3.11Å; Y208-Y235 HydrophobicContact CE1-CE1 4.09Å; V209-Y235 HydrophobicContact CG1-CD1 4.09Å; V209-Y235 HydrophobicContact CG1-CG 4.13Å; V209-Y235 HydrophobicContact CG2-CD1 4.18Å; R212-Y235 HydrophobicContact CB-CE1 4.12Å; R212-Y235 HydrophobicContact CB-CE2 3.8Å; R212-Y235 VanDerWaalsContact CB-CZ 3.44Å; R212-Y235 WeakPolarHBondContact CB-OH 3.23Å; R212-Y235 HydrophobicContact CG-CE1 4.38Å; R212-Y235 VanDerWaalsContact CG-OH 3.27Å; R212-Y235 WeakPolarHBondContact CG-OH 2.99Å; T213-Y235 HydrophobicContact CG2-CD2 3.5Å; T213-Y235 HydrophobicContact CG2-CE2 4.06Å; T213-Y235 HydrophobicContact CG2-CG 4.05Å; V233-Y235 HydrophobicContact CG1-CD1 4.14Å
236	I	85.1	Confident	90.2	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	141.6	174.1	-170.4	173	0	0	0	109.8	S101 L160 S161 M162 F438	S101-I236 WeakPolarHBondContact OG-CD1 3.13Å; L160-I236 HydrophobicContact CD1-CD1 3.97Å; L160-I236 HydrophobicContact CD1-CG1 3.98Å; S161-I236 CarbonylContact O-C 3.55Å; S161-I236 WeakPolarHBondContact O-CA 3.31Å; M162-I236 HydrophobicContact CB-CG1 4.14Å; M162-I236 HydrophobicContact CG-CB 4.33Å; M162-I236 HydrophobicContact CG-CD1 4.32Å; M162-I236 HydrophobicContact CG-CG1 4.2Å; M162-I236 HydrophobicContact SD-CD1 4.19Å; I236-F438 HydrophobicContact CB-CZ 4.16Å; I236-F438 HydrophobicContact CD1-CE1 4.45Å; I236-F438 HydrophobicContact CD1-CE2 3.7Å; I236-F438 HydrophobicContact CD1-CZ 3.66Å; I236-F438 HydrophobicContact CG1-CE2 4.09Å; I236-F438 HydrophobicContact CG1-CZ 3.67Å; I236-F438 HydrophobicContact CG2-CE1 3.59Å; I236-F438 HydrophobicContact CG2-CZ 3.53Å
237	F	82.9	Confident	90.5	Very high	20 Å²	20	34.8 Å²	34.8	9%	0.088	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131	176.4	170.7	-100	0	0	0	108.7	S161 K216 K239 E396	S161-F237 PolarHBondContact N-O 3.41Å; S161-F237 PolarHBondContact O-N 3.33Å; K216-F237 HydrophobicContact CB-CD2 3.98Å; K216-F237 HydrophobicContact CB-CE2 4.04Å; K216-F237 HydrophobicContact CD-CE2 3.87Å; K216-F237 HydrophobicContact CD-CZ 4.26Å; K216-F237 HydrophobicContact CG-CD2 4.04Å; K216-F237 HydrophobicContact CG-CE2 3.65Å; K216-F237 HydrophobicContact CG-CZ 3.99Å; F237-K239 HydrophobicContact CE1-CB 4Å; F237-K239 HydrophobicContact CZ-CB 4.04Å; F237-E396 VanDerWaalsContact CZ-OE2 3.25Å; F237-E396 WeakPolarHBondContact CZ-OE2 3.39Å
238	F	84.9	Confident	90.7	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.035	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.1	-178.2	175	-92.1	0	0	0	110	L158 L160 A240 Y293 A297 T395 I428 F437 F438	L158-F238 HydrophobicContact CD1-CD2 3.64Å; L158-F238 HydrophobicContact CD1-CE2 3.15Å; L158-F238 HydrophobicContact CD1-CZ 3.84Å; L158-F238 HydrophobicContact CG-CE2 4.49Å; L160-F238 HydrophobicContact CD1-CB 4.35Å; L160-F238 HydrophobicContact CD1-CD2 4.13Å; F238-A240 HydrophobicContact CE1-CB 3.98Å; F238-A240 HydrophobicContact CE2-CB 4.4Å; F238-A240 HydrophobicContact CZ-CB 3.73Å; F238-Y293 HydrophobicContact CE1-CD2 4.36Å; F238-Y293 HydrophobicContact CE1-CE1 4.14Å; F238-Y293 AromaticContact CE1-CE2 3.81Å; F238-Y293 HydrophobicContact CE1-CE2 3.81Å; F238-Y293 AromaticContact CE1-CZ 3.67Å; F238-Y293 AromaticContact CZ-CD2 3.87Å; F238-Y293 HydrophobicContact CZ-CD2 3.87Å; F238-Y293 AromaticContact CZ-CE2 3.67Å; F238-Y293 HydrophobicContact CZ-CE2 3.67Å; F238-Y293 HydrophobicContact CZ-CG 4.39Å; F238-A297 HydrophobicContact CE2-CB 4.09Å; F238-A297 HydrophobicContact CZ-CB 4.09Å; F238-T395 HydrophobicContact CD1-CG2 4.31Å; F238-T395 VanDerWaalsContact CD1-OG1 3.23Å; F238-T395 WeakPolarHBondContact CD1-OG1 3.28Å; F238-T395 HydrophobicContact CE1-CG2 4.13Å; F238-T395 WeakPolarHBondContact CE1-OG1 3.49Å; F238-I428 HydrophobicContact CD1-CD1 4.05Å; F238-I428 HydrophobicContact CE1-CD1 3.89Å; F238-I428 HydrophobicContact CE1-CG2 4.09Å; F238-I428 HydrophobicContact CE2-CG2 3.95Å; F238-I428 HydrophobicContact CZ-CG2 3.68Å; F238-F437 HydrophobicContact CD2-CD2 4.37Å; F238-F437 HydrophobicContact CE2-CD2 4.06Å; F238-F438 HydrophobicContact CB-CD2 4.31Å; F238-F438 HydrophobicContact CB-CE2 3.42Å; F238-F438 VanDerWaalsContact CB-CE2 3.42Å; F238-F438 HydrophobicContact CB-CZ 3.93Å; F238-F438 HydrophobicContact CG-CE2 4.07Å
239	K	86.3	Confident	90.7	Very high	55 Å²	55	38.4 Å²	38.4	24%	0.239	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.5	172.8	165.3	-174.7	-136.6	142.9	0	108.7	Q159 F237 T395 E396	Q159-K239 HydrophobicContact CB-CB 4.16Å; Q159-K239 PolarHBondContact N-O 3.17Å; Q159-K239 PolarHBondContact O-N 2.9Å; F237-K239 HydrophobicContact CE1-CB 4Å; F237-K239 HydrophobicContact CZ-CB 4.04Å; K239-T395 CarbonylContact C-O 3.52Å; K239-T395 VanDerWaalsContact CA-O 3.3Å; K239-T395 WeakPolarHBondContact CA-O 2.9Å; K239-E396 HydrophobicContact CB-CB 3.99Å; K239-E396 WeakPolarHBondContact CB-OE2 3.21Å; K239-E396 HydrophobicContact CD-CB 4.4Å; K239-E396 WeakPolarHBondContact CD-OE2 3.42Å; K239-E396 WeakPolarHBondContact CE-OE2 3.36Å; K239-E396 HydrophobicContact CG-CB 3.92Å; K239-E396 WeakPolarHBondContact CG-OE2 3.38Å; K239-E396 VanDerWaalsContact NZ-CD 3.35Å; K239-E396 IonicContact NZ-OE1 3.42Å; K239-E396 IonicContact NZ-OE2 3.56Å; K239-E396 PolarHBondContact NZ-OE2 3.4Å
240	A	89.6	Confident	90.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	143	172.2	0	0	0	0	0	110.8	L158 F238 Y293 G394 T395	L158-A240 HydrophobicContact CD1-CB 3.79Å; F238-A240 HydrophobicContact CE1-CB 3.98Å; F238-A240 HydrophobicContact CE2-CB 4.4Å; F238-A240 HydrophobicContact CZ-CB 3.73Å; A240-Y293 HydrophobicContact CB-CD1 3.51Å; A240-Y293 HydrophobicContact CB-CD2 4.39Å; A240-Y293 HydrophobicContact CB-CE1 4.17Å; A240-Y293 HydrophobicContact CB-CG 3.63Å; A240-Y293 WeakPolarHBondContact O-CD1 3.4Å; A240-G394 CarbonylContact O-C 3.59Å; A240-G394 VanDerWaalsContact O-CA 3.31Å; A240-G394 WeakPolarHBondContact O-CA 3.39Å; A240-T395 PolarHBondContact N-O 3.36Å; A240-T395 PolarHBondContact N-OG1 3.03Å; A240-T395 VanDerWaalsContact N-OG1 3.16Å; A240-T395 PolarHBondContact O-N 3.14Å; A240-T395 PolarHBondContact O-OG1 3.5Å
241	K	92.4	Very high	90.8	Very high	91 Å²	91	40 Å²	40	40%	0.396	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	143.7	176.4	-67.6	-174.3	177.3	-171	0	110.6	Y293 I294 E393	K241-Y293 CarbonylContact O-C 3.46Å; K241-Y293 WeakPolarHBondContact O-CA 3.4Å; K241-Y293 WeakPolarHBondContact O-CB 3.48Å; K241-Y293 WeakPolarHBondContact O-CD1 3.19Å; K241-I294 HydrophobicContact CB-CD1 3.89Å; K241-I294 HydrophobicContact CB-CG1 4.18Å; K241-I294 PolarHBondContact O-N 3.45Å; K241-E393 CarbonylContact C-O 3.57Å; K241-E393 VanDerWaalsContact CA-O 3.29Å; K241-E393 WeakPolarHBondContact CA-O 3.18Å
242	W	94.2	Very high	90.8	Very high	5 Å²	5	44.1 Å²	44.1	2%	0.019	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-59.1	139.9	168.7	-61.5	129	0	0	0	109.8	M244 F246 L291 Y293 A299 F301 V390 S391 E393 G394 M426	W242-M244 WeakPolarHBondContact CB-O 3.29Å; W242-M244 PolarHBondContact O-N 3.45Å; W242-F246 AromaticContact CD1-CD2 3.89Å; W242-F246 AromaticContact CD1-CE2 3.96Å; W242-F246 AromaticContact NE1-CE2 3.82Å; W242-L291 HydrophobicContact CE3-CB 4Å; W242-L291 HydrophobicContact CZ3-CB 3.83Å; W242-Y293 HydrophobicContact CD2-CD1 4.25Å; W242-Y293 AromaticContact CD2-CE1 3.96Å; W242-Y293 HydrophobicContact CD2-CE1 3.96Å; W242-Y293 AromaticContact CE3-CD1 3.58Å; W242-Y293 HydrophobicContact CE3-CD1 3.58Å; W242-Y293 AromaticContact CE3-CE1 3.36Å; W242-Y293 HydrophobicContact CE3-CE1 3.36Å; W242-Y293 HydrophobicContact CE3-CG 4.27Å; W242-Y293 AromaticContact CE3-CZ 3.89Å; W242-Y293 HydrophobicContact CH2-CD1 4.5Å; W242-Y293 AromaticContact CH2-CE1 3.49Å; W242-Y293 HydrophobicContact CH2-CE1 3.49Å; W242-Y293 VanDerWaalsContact CH2-CE1 3.49Å; W242-Y293 HydrophobicContact CH2-CE2 4.34Å; W242-Y293 AromaticContact CH2-CZ 3.39Å; W242-Y293 WeakPolarHBondContact CH2-OH 3.4Å; W242-Y293 HydrophobicContact CZ2-CE1 4.05Å; W242-Y293 AromaticContact CZ3-CD1 3.75Å; W242-Y293 HydrophobicContact CZ3-CD1 3.75Å; W242-Y293 HydrophobicContact CZ3-CD2 4.32Å; W242-Y293 AromaticContact CZ3-CE1 3.12Å; W242-Y293 HydrophobicContact CZ3-CE1 3.12Å; W242-Y293 AromaticContact CZ3-CE2 3.79Å; W242-Y293 HydrophobicContact CZ3-CE2 3.79Å; W242-Y293 HydrophobicContact CZ3-CG 4.31Å; W242-Y293 AromaticContact CZ3-CZ 3.14Å; W242-Y293 WeakPolarHBondContact CZ3-OH 3.21Å; W242-A299 HydrophobicContact CH2-CB 3.97Å; W242-A299 HydrophobicContact CZ3-CB 3.92Å; W242-F301 HydrophobicContact CH2-CE2 4.15Å; W242-F301 HydrophobicContact CH2-CZ 4.03Å; W242-V390 HydrophobicContact CZ2-CG1 4.22Å; W242-S391 PolarHBondContact NE1-O 3.13Å; W242-E393 PolarHBondContact N-O 3.03Å; W242-G394 VanDerWaalsContact NE1-CA 3.27Å; W242-M426 HydrophobicContact CH2-CE 4.36Å
243	K	91.9	Very high	91	Very high	144 Å²	144	48.5 Å²	48.5	63%	0.626	24%	0.241	S	C	*	.	S	Bend	trans	-62.8	-31.7	168.8	-173.7	171.2	-177	172.8	0	111	K292	K243-K292 HydrophobicContact CB-CB 4.16Å; K243-K292 VanDerWaalsContact CB-O 3.31Å; K243-K292 WeakPolarHBondContact CB-O 3.41Å; K243-K292 HydrophobicContact CD-CB 4.3Å; K243-K292 PolarHBondContact N-O 3.47Å
244	M	91.6	Very high	91.2	Very high	80 Å²	80	50.1 Å²	50.1	39%	0.394	25%	0.252	S	S	.	.	S	Bend	trans	-126.1	96.9	171.2	-62.7	-171.8	-50.3	0	0	108.6	W242 V274	W242-M244 WeakPolarHBondContact CB-O 3.29Å; W242-M244 PolarHBondContact O-N 3.45Å; M244-V274 HydrophobicContact CE-CG2 3.16Å; M244-V274 HydrophobicContact SD-CG2 4.16Å
245	P	93.2	Very high	91.6	Very high	60 Å²	60	56.1 Å²	56.1	39%	0.39	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-72.2	156.2	179.3	31	-35.3	0	0	0	111.6	E392	P245-E392 CarbonylContact C-O 3.34Å; P245-E392 WeakPolarHBondContact CA-O 3.45Å; P245-E392 WeakPolarHBondContact CB-O 3.41Å
246	F	93.6	Very high	92.2	Very high	5 Å²	5	55.6 Å²	55.6	2%	0.022	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-78.2	149.7	169.2	-57.4	-103.4	0	0	0	109.8	W242 P248 M269 L271 L291 L338 E392	W242-F246 AromaticContact CD1-CD2 3.89Å; W242-F246 AromaticContact CD1-CE2 3.96Å; W242-F246 AromaticContact NE1-CE2 3.82Å; F246-P248 WeakPolarHBondContact O-CD 3.48Å; F246-M269 HydrophobicContact CB-CB 4.1Å; F246-M269 HydrophobicContact CD1-CB 3.47Å; F246-M269 VanDerWaalsContact CD1-CB 3.47Å; F246-M269 HydrophobicContact CD2-CE 4.06Å; F246-M269 HydrophobicContact CD2-SD 4.24Å; F246-M269 HydrophobicContact CE1-CB 3.99Å; F246-M269 HydrophobicContact CE2-CE 3.97Å; F246-M269 HydrophobicContact CG-CB 3.79Å; F246-M269 HydrophobicContact CG-CE 4.42Å; F246-M269 HydrophobicContact CG-SD 4.28Å; F246-M269 HydrophobicContact CZ-CE 4.23Å; F246-L271 HydrophobicContact CB-CD2 4.5Å; F246-L271 HydrophobicContact CD1-CD1 4.29Å; F246-L271 HydrophobicContact CD1-CD2 4.07Å; F246-L271 HydrophobicContact CD1-CG 3.6Å; F246-L271 HydrophobicContact CE1-CB 4.5Å; F246-L271 HydrophobicContact CE1-CD1 3.99Å; F246-L271 HydrophobicContact CE1-CG 3.64Å; F246-L271 HydrophobicContact CG-CD2 4.29Å; F246-L271 HydrophobicContact CG-CG 4.2Å; F246-L271 HydrophobicContact CZ-CD1 4.11Å; F246-L271 HydrophobicContact CZ-CG 4.26Å; F246-L291 HydrophobicContact CE2-CD1 4.29Å; F246-L291 HydrophobicContact CZ-CD1 4Å; F246-L338 HydrophobicContact CE1-CB 4.21Å; F246-L338 HydrophobicContact CE2-CD2 4.28Å; F246-L338 HydrophobicContact CZ-CB 4.02Å; F246-L338 HydrophobicContact CZ-CD2 3.92Å; F246-E392 HydrophobicContact CB-CB 3.96Å; F246-E392 HydrophobicContact CB-CG 4.23Å; F246-E392 PolarHBondContact N-O 2.9Å
247	D	92.3	Very high	92.7	Very high	37 Å²	37	59.9 Å²	59.9	20%	0.198	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-82	122.7	170.3	-167	-30.8	0	0	0	109.3	Q249 D250	D247-Q249 PolarHBondContact O-N 3.46Å; D247-Q249 VanDerWaalsContact O-N 3.12Å; D247-Q249 WeakPolarHBondContact OD1-CB 3.43Å; D247-Q249 WeakPolarHBondContact OD1-CG 3.43Å; D247-Q249 PolarHBondContact OD1-N 3.06Å; D247-D250 HydrophobicContact CB-CB 4.39Å; D247-D250 PolarHBondContact O-N 3.28Å
248	P	92.4	Very high	92.9	Very high	64 Å²	64	62.5 Å²	62.5	42%	0.416	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-55.6	-25.8	174	-25.8	35.4	0	0	0	114.1	F246 D250 T251 E392	F246-P248 WeakPolarHBondContact O-CD 3.48Å; P248-D250 VanDerWaalsContact C-N 3.28Å; P248-D250 PolarHBondContact O-N 2.93Å; P248-T251 WeakPolarHBondContact O-CB 3.39Å; P248-T251 PolarHBondContact O-N 3.29Å; P248-E392 HydrophobicContact CB-CG 4.42Å; P248-E392 HydrophobicContact CG-CB 4.18Å; P248-E392 HydrophobicContact CG-CG 4.21Å
249	Q	92.6	Very high	92.9	Very high	175 Å²	175	64.4 Å²	64.4	82%	0.818	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-71	-23.9	176.8	-60.1	-173.8	17.3	0	0	113.1	D247 T251	D247-Q249 PolarHBondContact O-N 3.46Å; D247-Q249 VanDerWaalsContact O-N 3.12Å; D247-Q249 WeakPolarHBondContact OD1-CB 3.43Å; D247-Q249 WeakPolarHBondContact OD1-CG 3.43Å; D247-Q249 PolarHBondContact OD1-N 3.06Å; Q249-T251 VanDerWaalsContact C-N 3.33Å
250	D	93.6	Very high	92.7	Very high	49 Å²	49	69 Å²	69	26%	0.262	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-88.3	-6.6	177.3	-67.6	-30.7	0	0	0	112	D247 P248 H252 S270	D247-D250 HydrophobicContact CB-CB 4.39Å; D247-D250 PolarHBondContact O-N 3.28Å; P248-D250 VanDerWaalsContact C-N 3.28Å; P248-D250 PolarHBondContact O-N 2.93Å; D250-H252 PolarHBondContact O-N 3.49Å; D250-H252 PolarHBondContact O-ND1 3.04Å; D250-S270 PolarHBondContact O-OG 2.95Å
251	T	96.2	Very high	92.5	Very high	31 Å²	31	80.2 Å²	80.2	19%	0.19	38%	0.375	C	S	.	.			trans	-77	121.7	177	-62	0	0	0	0	110.8	P248 Q249 P267 M268 M269	P248-T251 WeakPolarHBondContact O-CB 3.39Å; P248-T251 PolarHBondContact O-N 3.29Å; Q249-T251 VanDerWaalsContact C-N 3.33Å; T251-P267 HydrophobicContact CG2-CB 4.04Å; T251-M268 WeakPolarHBondContact CA-O 3.43Å; T251-M269 HydrophobicContact CG2-CG 4.26Å
252	H	95.6	Very high	92.4	Very high	86 Å²	86	83.8 Å²	83.8	40%	0.398	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	156.3	-178.3	60.4	-81.2	0	0	0	111.5	D250 S254 M268 Y337	D250-H252 PolarHBondContact O-N 3.49Å; D250-H252 PolarHBondContact O-ND1 3.04Å; H252-S254 PolarHBondContact O-N 3.44Å; H252-M268 PolarHBondContact N-O 3.46Å; H252-M268 WeakPolarHBondContact O-CB 3.32Å; H252-M268 PolarHBondContact O-N 2.96Å; H252-Y337 AromaticContact CE1-CE1 3.95Å
253	D	97.6	Very high	92.4	Very high	93 Å²	93	89.2 Å²	89.2	50%	0.497	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	126.5	176	-81.8	-27.1	0	0	0	111.5	K265 V266	D253-K265 HydrophobicContact CB-CD 3.81Å; D253-K265 VanDerWaalsContact CB-CE 3.41Å; D253-K265 HydrophobicContact CB-CG 3.81Å; D253-K265 WeakPolarHBondContact OD2-CD 3.03Å; D253-K265 WeakPolarHBondContact OD2-CE 3.28Å; D253-K265 IonicContact OD2-NZ 3.28Å; D253-K265 PolarHBondContact OD2-NZ 3.26Å; D253-V266 WeakPolarHBondContact CA-O 3.44Å
254	S	97.1	Very high	92.6	Very high	34 Å²	34	83.6 Å²	83.6	24%	0.238	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	168.1	176.8	-164	0	0	0	0	112.1	H252 K265 V266	H252-S254 PolarHBondContact O-N 3.44Å; S254-K265 CarbonylContact O-C 3.56Å; S254-K265 WeakPolarHBondContact O-CA 3.08Å; S254-V266 PolarHBondContact N-O 2.96Å; S254-V266 PolarHBondContact O-N 3.19Å
255	R	97.1	Very high	92.9	Very high	128 Å²	128	84.9 Å²	84.9	48%	0.483	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131.5	176.8	-66.3	-171.2	176.3	100.2	-1	110.3	Y257 W263	R255-Y257 HydrophobicContact CB-CE2 3.95Å; R255-W263 HydrophobicContact CB-CE3 4.29Å; R255-W263 HydrophobicContact CG-CD2 4.05Å; R255-W263 HydrophobicContact CG-CE3 3.71Å; R255-W263 HydrophobicContact CG-CZ3 4.09Å
256	F	97.3	Very high	93	Very high	0 Å²	0	82.1 Å²	82.1	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.8	166.8	-171.7	-76.6	0	0	0	109.4	W258 W263 V264 V266 P339 F420 N421 R422 F424 I443 P445	F256-W258 HydrophobicContact CE1-CB 4.49Å; F256-W263 CarbonylContact O-C 3.55Å; F256-W263 WeakPolarHBondContact O-CA 2.96Å; F256-W263 VanDerWaalsContact O-CB 3.26Å; F256-W263 WeakPolarHBondContact O-CB 3.23Å; F256-V264 HydrophobicContact CB-CG2 4.23Å; F256-V264 PolarHBondContact N-O 3.11Å; F256-V264 PolarHBondContact O-N 3.36Å; F256-V266 HydrophobicContact CB-CG1 3.91Å; F256-V266 HydrophobicContact CB-CG2 3.85Å; F256-P339 HydrophobicContact CD2-CG 4.31Å; F256-P339 HydrophobicContact CE2-CG 4.21Å; F256-F420 WeakPolarHBondContact CD2-O 3.47Å; F256-F420 VanDerWaalsContact CE2-O 3.3Å; F256-F420 WeakPolarHBondContact CE2-O 3.4Å; F256-N421 CarbonylContact C-O 3.53Å; F256-N421 WeakPolarHBondContact CA-O 3.46Å; F256-R422 WeakPolarHBondContact CZ-O 3.43Å; F256-F424 HydrophobicContact CE2-CD1 4.01Å; F256-F424 AromaticContact CE2-CE1 3.82Å; F256-F424 HydrophobicContact CE2-CE1 3.82Å; F256-F424 HydrophobicContact CZ-CD1 4.12Å; F256-F424 HydrophobicContact CZ-CE1 4.16Å; F256-I443 WeakPolarHBondContact CE1-O 3.43Å; F256-P445 HydrophobicContact CB-CG 4.49Å; F256-P445 HydrophobicContact CD1-CG 4.05Å; F256-P445 HydrophobicContact CD2-CG 3.59Å; F256-P445 HydrophobicContact CE1-CG 4.15Å; F256-P445 HydrophobicContact CE2-CG 3.67Å; F256-P445 HydrophobicContact CG-CG 3.77Å; F256-P445 HydrophobicContact CZ-CG 3.93Å
257	Y	94.9	Very high	93.2	Very high	91 Å²	91	83.9 Å²	83.9	36%	0.357	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	99.3	-174.2	-57.6	-89.4	0	0	0	110.5	R255 S259 R262 W263 N421 R422 P423	R255-Y257 HydrophobicContact CB-CE2 3.95Å; Y257-S259 VanDerWaalsContact C-N 3.27Å; Y257-R262 WeakPolarHBondContact CA-O 3.37Å; Y257-W263 HydrophobicContact CD1-CB 3.8Å; Y257-W263 HydrophobicContact CD1-CG 4.47Å; Y257-W263 HydrophobicContact CE1-CB 4.13Å; Y257-W263 HydrophobicContact CE1-CG 4.39Å; Y257-W263 HydrophobicContact CG-CB 4.35Å; Y257-N421 WeakPolarHBondContact CD2-O 3.43Å; Y257-N421 PolarHBondContact N-O 3.2Å; Y257-R422 WeakPolarHBondContact O-CA 3.5Å; Y257-P423 VanDerWaalsContact O-CD 3.27Å; Y257-P423 WeakPolarHBondContact O-CD 3.47Å
258	W	86.6	Confident	93.5	Very high	75 Å²	75	82.2 Å²	82.2	28%	0.284	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-5.9	173.4	71.8	82.5	0	0	0	113.4	F256 R262 W263 V264 I443	F256-W258 HydrophobicContact CE1-CB 4.49Å; W258-R262 HydrophobicContact CD2-CB 4.22Å; W258-R262 HydrophobicContact CH2-CB 4.43Å; W258-R262 HydrophobicContact CZ2-CB 3.67Å; W258-R262 PolarHBondContact N-O 2.86Å; W258-W263 WeakPolarHBondContact CZ3-O 3.05Å; W258-V264 HydrophobicContact CE3-CB 4.37Å; W258-V264 HydrophobicContact CE3-CG1 4.28Å; W258-V264 HydrophobicContact CE3-CG2 3.9Å; W258-V264 HydrophobicContact CH2-CB 4.37Å; W258-V264 HydrophobicContact CH2-CG1 3.58Å; W258-V264 HydrophobicContact CZ3-CB 3.54Å; W258-V264 HydrophobicContact CZ3-CG1 3.17Å; W258-V264 HydrophobicContact CZ3-CG2 3.55Å; W258-I443 HydrophobicContact CB-CG2 4.13Å; W258-I443 WeakPolarHBondContact CB-O 3.35Å
259	S	84.5	Confident	93.8	Very high	48 Å²	48	79.2 Å²	79.2	34%	0.336	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	168.8	166.2	66.4	0	0	0	0	110	Y257 R261 R262	Y257-S259 VanDerWaalsContact C-N 3.27Å; S259-R261 PolarHBondContact O-N 3.26Å; S259-R262 PolarHBondContact N-O 3.46Å; S259-R262 PolarHBondContact O-N 3.34Å; S259-R262 VanDerWaalsContact O-O 3.07Å; S259-R262 WeakPolarHBondContact OG-CB 3.34Å; S259-R262 WeakPolarHBondContact OG-CG 3.36Å; S259-R262 PolarHBondContact OG-N 2.63Å
260	K	81.8	Confident	93.9	Very high	151 Å²	151	71.2 Å²	71.2	66%	0.657	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-26.8	-179.5	-67.7	-176.7	179.8	176.6	0	114.9	D307	K260-D307 VanDerWaalsContact CE-CG 3.45Å; K260-D307 WeakPolarHBondContact CE-OD1 3.44Å; K260-D307 WeakPolarHBondContact CE-OD2 3.31Å; K260-D307 IonicContact NZ-OD1 3.71Å; K260-D307 IonicContact NZ-OD2 2.61Å; K260-D307 PolarHBondContact NZ-OD2 3.02Å
261	R	86.3	Confident	93.9	Very high	238 Å²	238	70 Å²	70	90%	0.898	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-4.2	-175.9	-63	-174	-179.2	-172.6	1.3	114.4	S259	S259-R261 PolarHBondContact O-N 3.26Å
262	R	90.3	Very high	93.7	Very high	165 Å²	165	73.6 Å²	73.6	62%	0.623	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.8	-177.3	-56	179	168.9	176.6	-3.7	110.4	Y257 W258 S259	Y257-R262 WeakPolarHBondContact CA-O 3.37Å; W258-R262 HydrophobicContact CD2-CB 4.22Å; W258-R262 HydrophobicContact CH2-CB 4.43Å; W258-R262 HydrophobicContact CZ2-CB 3.67Å; W258-R262 PolarHBondContact N-O 2.86Å; S259-R262 PolarHBondContact N-O 3.46Å; S259-R262 PolarHBondContact O-N 3.34Å; S259-R262 VanDerWaalsContact O-O 3.07Å; S259-R262 WeakPolarHBondContact OG-CB 3.34Å; S259-R262 WeakPolarHBondContact OG-CG 3.36Å; S259-R262 PolarHBondContact OG-N 2.63Å
263	W	95.1	Very high	93.4	Very high	120 Å²	120	74 Å²	74	46%	0.455	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	157	179.3	60.7	-92.8	0	0	0	111.4	R255 F256 Y257 W258 K265	R255-W263 HydrophobicContact CB-CE3 4.29Å; R255-W263 HydrophobicContact CG-CD2 4.05Å; R255-W263 HydrophobicContact CG-CE3 3.71Å; R255-W263 HydrophobicContact CG-CZ3 4.09Å; F256-W263 CarbonylContact O-C 3.55Å; F256-W263 WeakPolarHBondContact O-CA 2.96Å; F256-W263 VanDerWaalsContact O-CB 3.26Å; F256-W263 WeakPolarHBondContact O-CB 3.23Å; Y257-W263 HydrophobicContact CD1-CB 3.8Å; Y257-W263 HydrophobicContact CD1-CG 4.47Å; Y257-W263 HydrophobicContact CE1-CB 4.13Å; Y257-W263 HydrophobicContact CE1-CG 4.39Å; Y257-W263 HydrophobicContact CG-CB 4.35Å; W258-W263 WeakPolarHBondContact CZ3-O 3.05Å; W263-K265 HydrophobicContact CZ3-CB 4.38Å
264	V	95.4	Very high	93.1	Very high	26 Å²	26	70 Å²	70	16%	0.158	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.1	169.3	-89	0	0	0	0	108.6	F256 W258 V266 N444 K446	F256-V264 HydrophobicContact CB-CG2 4.23Å; F256-V264 PolarHBondContact N-O 3.11Å; F256-V264 PolarHBondContact O-N 3.36Å; W258-V264 HydrophobicContact CE3-CB 4.37Å; W258-V264 HydrophobicContact CE3-CG1 4.28Å; W258-V264 HydrophobicContact CE3-CG2 3.9Å; W258-V264 HydrophobicContact CH2-CB 4.37Å; W258-V264 HydrophobicContact CH2-CG1 3.58Å; W258-V264 HydrophobicContact CZ3-CB 3.54Å; W258-V264 HydrophobicContact CZ3-CG1 3.17Å; W258-V264 HydrophobicContact CZ3-CG2 3.55Å; V264-V266 HydrophobicContact CB-CG1 4.42Å; V264-V266 HydrophobicContact CG2-CG1 3.63Å; V264-N444 WeakPolarHBondContact CG2-OD1 3.38Å; V264-K446 HydrophobicContact CB-CD 4.24Å; V264-K446 HydrophobicContact CG1-CD 4.19Å
265	K	96.8	Very high	92.9	Very high	107 Å²	107	72 Å²	72	47%	0.465	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.6	164.7	-157.2	-175.1	-147.7	-144.9	0	108.8	D253 S254 W263 K446	D253-K265 HydrophobicContact CB-CD 3.81Å; D253-K265 VanDerWaalsContact CB-CE 3.41Å; D253-K265 HydrophobicContact CB-CG 3.81Å; D253-K265 WeakPolarHBondContact OD2-CD 3.03Å; D253-K265 WeakPolarHBondContact OD2-CE 3.28Å; D253-K265 IonicContact OD2-NZ 3.28Å; D253-K265 PolarHBondContact OD2-NZ 3.26Å; S254-K265 CarbonylContact O-C 3.56Å; S254-K265 WeakPolarHBondContact O-CA 3.08Å; W263-K265 HydrophobicContact CZ3-CB 4.38Å; K265-K446 WeakPolarHBondContact O-CD 3.15Å; K265-K446 WeakPolarHBondContact O-CE 3.42Å; K265-K446 PolarHBondContact O-NZ 3.29Å
266	V	97.1	Very high	92.8	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.3	178.2	-57.4	0	0	0	0	110.1	D253 S254 F256 V264 M268 P339 P445 K446	D253-V266 WeakPolarHBondContact CA-O 3.44Å; S254-V266 PolarHBondContact N-O 2.96Å; S254-V266 PolarHBondContact O-N 3.19Å; F256-V266 HydrophobicContact CB-CG1 3.91Å; F256-V266 HydrophobicContact CB-CG2 3.85Å; V264-V266 HydrophobicContact CB-CG1 4.42Å; V264-V266 HydrophobicContact CG2-CG1 3.63Å; V266-M268 HydrophobicContact CG2-CE 3.89Å; V266-M268 PolarHBondContact O-N 2.89Å; V266-P339 HydrophobicContact CG2-CB 4.08Å; V266-P445 HydrophobicContact CG1-CB 3.98Å; V266-P445 HydrophobicContact CG1-CG 4.15Å; V266-K446 HydrophobicContact CG1-CG 4.41Å
267	P	97.6	Very high	92.8	Very high	43 Å²	43	66.3 Å²	66.3	28%	0.279	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	118.1	164.9	26.5	-31.9	0	0	0	108.9	T251 P339 K340	T251-P267 HydrophobicContact CG2-CB 4.04Å; P267-P339 WeakPolarHBondContact O-CA 3.35Å; P267-K340 HydrophobicContact CB-CB 4.22Å; P267-K340 HydrophobicContact CG-CB 3.95Å; P267-K340 HydrophobicContact CG-CG 4.36Å; P267-K340 PolarHBondContact O-N 3.35Å
268	M	98.1	Very high	92.9	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.7	-178.7	-171.2	68.9	67.7	0	0	108.6	T251 H252 V266 Y337 P339 N421	T251-M268 WeakPolarHBondContact CA-O 3.43Å; H252-M268 PolarHBondContact N-O 3.46Å; H252-M268 WeakPolarHBondContact O-CB 3.32Å; H252-M268 PolarHBondContact O-N 2.96Å; V266-M268 HydrophobicContact CG2-CE 3.89Å; V266-M268 PolarHBondContact O-N 2.89Å; M268-Y337 HydrophobicContact CG-CD1 4.03Å; M268-Y337 HydrophobicContact CG-CG 4.43Å; M268-P339 HydrophobicContact CE-CB 4.38Å; M268-P339 HydrophobicContact SD-CB 4.34Å; M268-P339 VanDerWaalsContact SD-N 3.43Å; M268-N421 HydrophobicContact CE-CB 4.18Å
269	M	97.8	Very high	93.5	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	153.2	174.3	-47.1	179.1	-62.1	0	0	108.8	F246 T251 Y337 L338 K340 V390 E392	F246-M269 HydrophobicContact CB-CB 4.1Å; F246-M269 HydrophobicContact CD1-CB 3.47Å; F246-M269 VanDerWaalsContact CD1-CB 3.47Å; F246-M269 HydrophobicContact CD2-CE 4.06Å; F246-M269 HydrophobicContact CD2-SD 4.24Å; F246-M269 HydrophobicContact CE1-CB 3.99Å; F246-M269 HydrophobicContact CE2-CE 3.97Å; F246-M269 HydrophobicContact CG-CB 3.79Å; F246-M269 HydrophobicContact CG-CE 4.42Å; F246-M269 HydrophobicContact CG-SD 4.28Å; F246-M269 HydrophobicContact CZ-CE 4.23Å; T251-M269 HydrophobicContact CG2-CG 4.26Å; M269-Y337 WeakPolarHBondContact O-CA 3.28Å; M269-L338 WeakPolarHBondContact CB-O 3.45Å; M269-L338 HydrophobicContact CE-CB 4.19Å; M269-L338 HydrophobicContact CE-CD2 3.86Å; M269-L338 HydrophobicContact CE-CG 4.11Å; M269-L338 PolarHBondContact N-O 3.13Å; M269-L338 PolarHBondContact O-N 3.12Å; M269-K340 HydrophobicContact CG-CB 3.96Å; M269-K340 HydrophobicContact SD-CB 3.93Å; M269-V390 HydrophobicContact CE-CG1 3.98Å; M269-E392 HydrophobicContact CG-CG 4.06Å; M269-E392 VanDerWaalsContact SD-CA 3.54Å; M269-E392 HydrophobicContact SD-CB 4.21Å; M269-E392 HydrophobicContact SD-CG 3.75Å; M269-E392 PolarHBondContact SD-N 2.87Å
270	S	96.1	Very high	94.1	Very high	8 Å²	8	62.8 Å²	62.8	6%	0.056	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144.5	175.6	59.6	0	0	0	0	113.9	D250 L336	D250-S270 PolarHBondContact O-OG 2.95Å; S270-L336 CarbonylContact C-O 3.54Å; S270-L336 WeakPolarHBondContact CA-O 3.31Å
271	L	93.3	Very high	94.9	Very high	22 Å²	22	55.7 Å²	55.7	12%	0.115	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.3	164.2	-68.4	174.7	0	0	0	108.7	F246 V274 L336	F246-L271 HydrophobicContact CB-CD2 4.5Å; F246-L271 HydrophobicContact CD1-CD1 4.29Å; F246-L271 HydrophobicContact CD1-CD2 4.07Å; F246-L271 HydrophobicContact CD1-CG 3.6Å; F246-L271 HydrophobicContact CE1-CB 4.5Å; F246-L271 HydrophobicContact CE1-CD1 3.99Å; F246-L271 HydrophobicContact CE1-CG 3.64Å; F246-L271 HydrophobicContact CG-CD2 4.29Å; F246-L271 HydrophobicContact CG-CG 4.2Å; F246-L271 HydrophobicContact CZ-CD1 4.11Å; F246-L271 HydrophobicContact CZ-CG 4.26Å; L271-V274 HydrophobicContact CB-CB 4.14Å; L271-V274 HydrophobicContact CB-CG1 4.17Å; L271-V274 HydrophobicContact CD1-CG2 4.16Å; L271-L336 HydrophobicContact CB-CB 4.38Å; L271-L336 HydrophobicContact CD1-CD2 4.37Å; L271-L336 PolarHBondContact N-O 2.9Å; L271-L336 PolarHBondContact O-N 2.87Å
272	Q	91.6	Very high	95.4	Very high	108 Å²	108	50.5 Å²	50.5	51%	0.505	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.9	174.3	-64.2	-175.7	-5.1	0	0	109.9	V274 D334	Q272-V274 VanDerWaalsContact C-N 3.3Å; Q272-V274 PolarHBondContact O-N 2.92Å; Q272-D334 CarbonylContact C-O 3.54Å; Q272-D334 WeakPolarHBondContact CA-O 3.25Å
273	H	88.7	Confident	95.6	Very high	94 Å²	94	49.4 Å²	49.4	44%	0.435	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.7	44.8	173.3	-60	-60.3	0	0	0	113.6	H332 I333 D334	H273-H332 AromaticContact ND1-NE2 3.51Å; H273-I333 CarbonylContact C-O 3.55Å; H273-I333 WeakPolarHBondContact CA-O 3.46Å; H273-I333 PolarHBondContact N-O 3.17Å; H273-D334 PolarHBondContact N-O 3.33Å
274	V	91.6	Very high	95.7	Very high	10 Å²	10	44.2 Å²	44.2	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.5	-174.9	65.2	0	0	0	0	111.1	M244 L271 Q272 I333 L336	M244-V274 HydrophobicContact CE-CG2 3.16Å; M244-V274 HydrophobicContact SD-CG2 4.16Å; L271-V274 HydrophobicContact CB-CB 4.14Å; L271-V274 HydrophobicContact CB-CG1 4.17Å; L271-V274 HydrophobicContact CD1-CG2 4.16Å; Q272-V274 VanDerWaalsContact C-N 3.3Å; Q272-V274 PolarHBondContact O-N 2.92Å; V274-I333 HydrophobicContact CG1-CB 3.86Å; V274-I333 HydrophobicContact CG1-CG2 4.43Å; V274-I333 PolarHBondContact N-O 2.6Å; V274-I333 PolarHBondContact O-N 2.53Å; V274-L336 HydrophobicContact CG1-CB 4.14Å; V274-L336 HydrophobicContact CG1-CD2 4.47Å
275	T	93.3	Very high	95.8	Very high	75 Å²	75	44.5 Å²	44.5	46%	0.46	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	110.2	169.9	-59.7	0	0	0	0	109.1	F330 R331	T275-F330 HydrophobicContact CG2-CB 4.14Å; T275-F330 HydrophobicContact CG2-CD1 4.26Å; T275-R331 WeakPolarHBondContact CA-O 3.43Å
276	T	95.3	Very high	95.9	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	159.6	-176.7	-155	0	0	0	0	110.5	Y278 V289 E290 L291 R331 I333	T276-Y278 PolarHBondContact O-N 3.43Å; T276-V289 HydrophobicContact CG2-CG1 3.85Å; T276-E290 PolarHBondContact OG1-O 2.88Å; T276-L291 HydrophobicContact CG2-CD2 4.34Å; T276-R331 PolarHBondContact N-O 3.31Å; T276-R331 VanDerWaalsContact N-O 3.14Å; T276-R331 PolarHBondContact O-N 2.94Å; T276-I333 HydrophobicContact CG2-CD1 3.85Å
277	P	97.1	Very high	96	Very high	4 Å²	4	40 Å²	40	3%	0.026	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	131.2	178	-20.7	35	0	0	0	111.2	E290 L328 E329 F330	P277-E290 HydrophobicContact CB-CB 3.93Å; P277-E290 WeakPolarHBondContact CB-OE2 3.46Å; P277-E290 HydrophobicContact CG-CB 4.3Å; P277-E290 VanDerWaalsContact CG-OE2 3.27Å; P277-E290 WeakPolarHBondContact CG-OE2 3.35Å; P277-E290 PolarHBondContact O-N 3.46Å; P277-L328 HydrophobicContact CB-CB 4Å; P277-L328 HydrophobicContact CB-CD2 4.1Å; P277-L328 HydrophobicContact CB-CG 4.47Å; P277-E329 CarbonylContact C-O 3.59Å; P277-E329 WeakPolarHBondContact CA-O 3.29Å; P277-F330 HydrophobicContact CG-CD1 4.02Å; P277-F330 HydrophobicContact CG-CE1 3.78Å; P277-F330 HydrophobicContact CG-CE2 4.3Å; P277-F330 HydrophobicContact CG-CG 4.4Å; P277-F330 HydrophobicContact CG-CZ 3.94Å
278	Y	97.4	Very high	96	Very high	38 Å²	38	38 Å²	38	15%	0.149	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.1	-170.9	172.1	-82.7	0	0	0	108.8	T276 R280 T287 V288 V289 E329 R331 I333 I416 V418	T276-Y278 PolarHBondContact O-N 3.43Å; Y278-R280 HydrophobicContact CE1-CB 4.02Å; Y278-T287 HydrophobicContact CD2-CG2 4.17Å; Y278-T287 HydrophobicContact CE2-CG2 3.36Å; Y278-V288 WeakPolarHBondContact CA-O 3.48Å; Y278-V289 HydrophobicContact CD2-CG2 4.04Å; Y278-E329 PolarHBondContact N-O 3.35Å; Y278-E329 PolarHBondContact O-N 3.08Å; Y278-R331 HydrophobicContact CD1-CB 4.33Å; Y278-R331 HydrophobicContact CD1-CG 3.98Å; Y278-R331 HydrophobicContact CG-CB 4.31Å; Y278-R331 HydrophobicContact CG-CG 4.36Å; Y278-I333 HydrophobicContact CD2-CD1 3.86Å; Y278-I333 HydrophobicContact CD2-CG1 4.39Å; Y278-I416 HydrophobicContact CE2-CG2 4.34Å; Y278-V418 HydrophobicContact CD2-CG2 4.43Å; Y278-V418 HydrophobicContact CE2-CG2 3.86Å
279	F	97.9	Very high	96	Very high	41 Å²	41	37.9 Å²	37.9	18%	0.18	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	135.4	172.7	177.7	-122.1	0	0	0	110.2	D281 V288 W324 S327 L328	F279-D281 HydrophobicContact CD1-CB 4.11Å; F279-D281 HydrophobicContact CE1-CB 3.57Å; F279-D281 HydrophobicContact CZ-CB 4.24Å; F279-V288 HydrophobicContact CB-CB 4.36Å; F279-V288 PolarHBondContact N-O 3.42Å; F279-V288 PolarHBondContact O-N 3.35Å; F279-W324 AromaticContact CD1-CD1 3.85Å; F279-W324 AromaticContact CE1-CD1 3.81Å; F279-S327 VanDerWaalsContact CD2-CB 3.48Å; F279-S327 WeakPolarHBondContact CD2-O 3.36Å; F279-S327 VanDerWaalsContact CE2-CB 3.46Å; F279-L328 HydrophobicContact CB-CD2 4.01Å; F279-L328 HydrophobicContact CB-CG 4.46Å
280	R	97.7	Very high	96	Very high	60 Å²	60	38.9 Å²	38.9	23%	0.226	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	111.6	170.7	174.5	60.2	-174	176.2	5.6	107.8	Y278 E282 T287 D305	Y278-R280 HydrophobicContact CE1-CB 4.02Å; R280-E282 HydrophobicContact CG-CG 4.29Å; R280-E282 WeakPolarHBondContact CG-OE1 3.14Å; R280-E282 IonicContact CZ-OE2 2.72Å; R280-E282 IonicContact NE-OE1 3.03Å; R280-E282 PolarHBondContact NE-OE1 3.37Å; R280-E282 IonicContact NE-OE2 3.63Å; R280-E282 PolarHBondContact NE-OE2 3.45Å; R280-E282 VanDerWaalsContact NE-OE2 3.08Å; R280-E282 IonicContact NH2-OE2 2.72Å; R280-E282 PolarHBondContact NH2-OE2 3.06Å; R280-E282 VanDerWaalsContact NH2-OE2 3.08Å; R280-E282 PolarHBondContact O-N 3.04Å; R280-T287 PolarHBondContact NH1-OG1 3.03Å; R280-D305 IonicContact CZ-OD1 3.08Å; R280-D305 IonicContact CZ-OD2 3.95Å; R280-D305 IonicContact NH1-OD1 3.08Å; R280-D305 PolarHBondContact NH1-OD1 3.24Å; R280-D305 IonicContact NH1-OD2 2.69Å; R280-D305 PolarHBondContact NH1-OD2 3.34Å; R280-D305 IonicContact NH2-OD1 3.34Å; R280-D305 IonicContact NH2-OD2 3.77Å; R280-D305 PolarHBondContact NH2-OD2 2.85Å
281	D	97.9	Very high	96.1	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	95.9	178.4	-170.3	-5.3	0	0	0	109.5	F279 E283 L284 S285 C286 R323 W324	F279-D281 HydrophobicContact CD1-CB 4.11Å; F279-D281 HydrophobicContact CE1-CB 3.57Å; F279-D281 HydrophobicContact CZ-CB 4.24Å; D281-E283 VanDerWaalsContact C-N 3.27Å; D281-E283 PolarHBondContact O-N 2.99Å; D281-E283 WeakPolarHBondContact OD1-CB 3.41Å; D281-E283 PolarHBondContact OD1-N 2.81Å; D281-L284 PolarHBondContact OD1-N 2.92Å; D281-L284 WeakPolarHBondContact OD2-CD1 3.37Å; D281-L284 WeakPolarHBondContact OD2-CG 3.5Å; D281-S285 VanDerWaalsContact O-CA 3.31Å; D281-S285 WeakPolarHBondContact O-CA 3.3Å; D281-S285 PolarHBondContact O-N 2.83Å; D281-C286 PolarHBondContact N-O 3.3Å; D281-C286 PolarHBondContact O-N 3.39Å; D281-R323 IonicContact OD1-CZ 3.01Å; D281-R323 IonicContact OD1-NH1 3.54Å; D281-R323 PolarHBondContact OD1-NH1 3.41Å; D281-R323 IonicContact OD1-NH2 3.3Å; D281-R323 IonicContact OD2-CZ 2.71Å; D281-R323 VanDerWaalsContact OD2-CZ 3.25Å; D281-R323 IonicContact OD2-NH1 2.68Å; D281-R323 PolarHBondContact OD2-NH1 2.99Å; D281-R323 IonicContact OD2-NH2 3.42Å; D281-R323 PolarHBondContact OD2-NH2 3.17Å; D281-W324 PolarHBondContact OD2-NE1 3.48Å
282	E	97.1	Very high	96.2	Very high	129 Å²	129	40.5 Å²	40.5	60%	0.603	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-23.8	178.9	-58.7	-61.6	178.5	0	0	112.5	R280	R280-E282 HydrophobicContact CG-CG 4.29Å; R280-E282 WeakPolarHBondContact CG-OE1 3.14Å; R280-E282 IonicContact CZ-OE2 2.72Å; R280-E282 IonicContact NE-OE1 3.03Å; R280-E282 PolarHBondContact NE-OE1 3.37Å; R280-E282 IonicContact NE-OE2 3.63Å; R280-E282 PolarHBondContact NE-OE2 3.45Å; R280-E282 VanDerWaalsContact NE-OE2 3.08Å; R280-E282 IonicContact NH2-OE2 2.72Å; R280-E282 PolarHBondContact NH2-OE2 3.06Å; R280-E282 VanDerWaalsContact NH2-OE2 3.08Å; R280-E282 PolarHBondContact O-N 3.04Å
283	E	95.9	Very high	96.3	Very high	141 Å²	141	35.5 Å²	35.5	66%	0.659	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-46.4	178.3	-174.3	-178.2	170.7	0	0	110.8	D281 R323	D281-E283 VanDerWaalsContact C-N 3.27Å; D281-E283 PolarHBondContact O-N 2.99Å; D281-E283 WeakPolarHBondContact OD1-CB 3.41Å; D281-E283 PolarHBondContact OD1-N 2.81Å; E283-R323 IonicContact OE2-NH1 3.27Å
284	L	96.8	Very high	96.4	Very high	11 Å²	11	34.8 Å²	34.8	6%	0.058	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	1.2	177.8	-60.1	-175.8	0	0	0	113.6	D281 C286 V312 M315 T320 W324	D281-L284 PolarHBondContact OD1-N 2.92Å; D281-L284 WeakPolarHBondContact OD2-CD1 3.37Å; D281-L284 WeakPolarHBondContact OD2-CG 3.5Å; L284-C286 PolarHBondContact O-N 3.18Å; L284-V312 HydrophobicContact CB-CG2 4.35Å; L284-V312 WeakPolarHBondContact O-CG2 3.39Å; L284-M315 HydrophobicContact CD1-CB 3.93Å; L284-M315 HydrophobicContact CD2-CB 3.55Å; L284-M315 HydrophobicContact CD2-CE 4.43Å; L284-M315 HydrophobicContact CD2-CG 3.58Å; L284-M315 HydrophobicContact CG-CB 4.43Å; L284-T320 HydrophobicContact CD1-CG2 3.62Å; L284-W324 HydrophobicContact CD1-CZ2 3.78Å
285	S	97.8	Very high	96.2	Very high	32 Å²	32	35.7 Å²	35.7	22%	0.224	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	53.1	-178.4	-57.6	0	0	0	0	112	D281 D305	D281-S285 VanDerWaalsContact O-CA 3.31Å; D281-S285 WeakPolarHBondContact O-CA 3.3Å; D281-S285 PolarHBondContact O-N 2.83Å; S285-D305 VanDerWaalsContact O-CB 3.27Å; S285-D305 WeakPolarHBondContact O-CB 3.3Å; S285-D305 PolarHBondContact O-N 3.41Å
286	C	98.4	Very high	95.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.7	179.6	75.8	0	0	0	0	112.8	D281 L284 I302 L303 V312	D281-C286 PolarHBondContact N-O 3.3Å; D281-C286 PolarHBondContact O-N 3.39Å; L284-C286 PolarHBondContact O-N 3.18Å; C286-I302 HydrophobicContact CB-CG2 4.14Å; C286-L303 WeakPolarHBondContact CA-O 3.16Å; C286-V312 HydrophobicContact CB-CG2 3.84Å
287	T	98.5	Very high	95.8	Very high	14 Å²	14	34.4 Å²	34.4	9%	0.086	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129	174.2	-66.3	0	0	0	0	109.3	Y278 R280 V289 I302 L303 V418	Y278-T287 HydrophobicContact CD2-CG2 4.17Å; Y278-T287 HydrophobicContact CE2-CG2 3.36Å; R280-T287 PolarHBondContact NH1-OG1 3.03Å; T287-V289 HydrophobicContact CG2-CG2 4.16Å; T287-I302 WeakPolarHBondContact O-CA 3.21Å; T287-L303 PolarHBondContact N-O 3.32Å; T287-L303 PolarHBondContact O-N 2.86Å; T287-V418 HydrophobicContact CG2-CG1 4.38Å; T287-V418 HydrophobicContact CG2-CG2 4.4Å
288	V	98.6	Very high	95.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127	177.5	-173.4	0	0	0	0	109	Y278 F279 F301 I302 W324 L328	Y278-V288 WeakPolarHBondContact CA-O 3.48Å; F279-V288 HydrophobicContact CB-CB 4.36Å; F279-V288 PolarHBondContact N-O 3.42Å; F279-V288 PolarHBondContact O-N 3.35Å; V288-F301 CarbonylContact C-O 3.48Å; V288-F301 WeakPolarHBondContact CA-O 3.19Å; V288-I302 HydrophobicContact CG1-CG1 4.36Å; V288-I302 HydrophobicContact CG2-CG1 4.22Å; V288-I302 HydrophobicContact CG2-CG2 4.37Å; V288-W324 HydrophobicContact CG2-CD2 4.01Å; V288-W324 HydrophobicContact CG2-CG 4.03Å; V288-L328 HydrophobicContact CG1-CD2 4.26Å
289	V	98.4	Very high	95.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.5	176.1	-178.2	0	0	0	0	108.9	T276 Y278 T287 L291 F301 I333 L336 V418 F420	T276-V289 HydrophobicContact CG2-CG1 3.85Å; Y278-V289 HydrophobicContact CD2-CG2 4.04Å; T287-V289 HydrophobicContact CG2-CG2 4.16Å; V289-L291 HydrophobicContact CG1-CD2 4.25Å; V289-F301 PolarHBondContact N-O 3.24Å; V289-F301 PolarHBondContact O-N 3.05Å; V289-I333 HydrophobicContact CG1-CD1 4.44Å; V289-L336 HydrophobicContact CG1-CD1 4.5Å; V289-L336 HydrophobicContact CG1-CD2 4.46Å; V289-V418 HydrophobicContact CG2-CG1 4.1Å; V289-V418 HydrophobicContact CG2-CG2 4.5Å; V289-F420 HydrophobicContact CB-CZ 4.33Å; V289-F420 HydrophobicContact CG2-CE2 4.31Å; V289-F420 HydrophobicContact CG2-CZ 4.22Å
290	E	97.8	Very high	95.6	Very high	22 Å²	22	30.6 Å²	30.6	10%	0.103	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.8	172.3	-173.6	-175.2	-161.2	0	0	110.1	T276 P277 K292 S298 A299 L300 L328	T276-E290 PolarHBondContact OG1-O 2.88Å; P277-E290 HydrophobicContact CB-CB 3.93Å; P277-E290 WeakPolarHBondContact CB-OE2 3.46Å; P277-E290 HydrophobicContact CG-CB 4.3Å; P277-E290 VanDerWaalsContact CG-OE2 3.27Å; P277-E290 WeakPolarHBondContact CG-OE2 3.35Å; P277-E290 PolarHBondContact O-N 3.46Å; E290-K292 HydrophobicContact CG-CG 4.33Å; E290-K292 WeakPolarHBondContact OE2-CE 3.44Å; E290-K292 IonicContact OE2-NZ 2.95Å; E290-S298 WeakPolarHBondContact OE1-CB 3.05Å; E290-S298 PolarHBondContact OE1-OG 3.37Å; E290-A299 WeakPolarHBondContact CA-O 3.36Å; E290-L300 HydrophobicContact CB-CD2 3.77Å; E290-L300 HydrophobicContact CG-CD2 3.83Å; E290-L328 HydrophobicContact CB-CD1 4.08Å; E290-L328 HydrophobicContact CB-CD2 4.42Å
291	L	96.8	Very high	95.7	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.4	165.2	-59.3	-175	0	0	0	109.3	W242 F246 T276 V289 A299 F301 L336 L338	W242-L291 HydrophobicContact CE3-CB 4Å; W242-L291 HydrophobicContact CZ3-CB 3.83Å; F246-L291 HydrophobicContact CE2-CD1 4.29Å; F246-L291 HydrophobicContact CZ-CD1 4Å; T276-L291 HydrophobicContact CG2-CD2 4.34Å; V289-L291 HydrophobicContact CG1-CD2 4.25Å; L291-A299 PolarHBondContact N-O 3.4Å; L291-A299 PolarHBondContact O-N 2.98Å; L291-F301 HydrophobicContact CB-CE2 4.08Å; L291-F301 HydrophobicContact CD1-CD2 4.21Å; L291-F301 HydrophobicContact CD1-CE2 3.71Å; L291-F301 HydrophobicContact CD1-CZ 4.49Å; L291-F301 HydrophobicContact CG-CD2 4.14Å; L291-F301 HydrophobicContact CG-CE2 3.94Å; L291-L336 HydrophobicContact CD1-CD2 4.37Å; L291-L336 HydrophobicContact CD2-CD2 3.89Å; L291-L338 HydrophobicContact CD1-CD2 4.21Å
292	K	95.1	Very high	95.7	Very high	56 Å²	56	27.6 Å²	27.6	24%	0.243	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	143.2	-177.7	-64.4	-172.7	178.2	-172.9	0	110.9	K243 E290 M431	K243-K292 HydrophobicContact CB-CB 4.16Å; K243-K292 VanDerWaalsContact CB-O 3.31Å; K243-K292 WeakPolarHBondContact CB-O 3.41Å; K243-K292 HydrophobicContact CD-CB 4.3Å; K243-K292 PolarHBondContact N-O 3.47Å; E290-K292 HydrophobicContact CG-CG 4.33Å; E290-K292 WeakPolarHBondContact OE2-CE 3.44Å; E290-K292 IonicContact OE2-NZ 2.95Å; K292-M431 HydrophobicContact CB-CE 3.76Å; K292-M431 HydrophobicContact CD-CE 3.94Å; K292-M431 HydrophobicContact CD-SD 4.43Å; K292-M431 HydrophobicContact CG-CE 3.82Å
293	Y	93.8	Very high	95.8	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.012	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-88.3	168.2	167.2	-63.5	-78.4	0	0	0	111.3	F238 A240 K241 W242 A297 A299 T395 I428	F238-Y293 HydrophobicContact CE1-CD2 4.36Å; F238-Y293 HydrophobicContact CE1-CE1 4.14Å; F238-Y293 AromaticContact CE1-CE2 3.81Å; F238-Y293 HydrophobicContact CE1-CE2 3.81Å; F238-Y293 AromaticContact CE1-CZ 3.67Å; F238-Y293 AromaticContact CZ-CD2 3.87Å; F238-Y293 HydrophobicContact CZ-CD2 3.87Å; F238-Y293 AromaticContact CZ-CE2 3.67Å; F238-Y293 HydrophobicContact CZ-CE2 3.67Å; F238-Y293 HydrophobicContact CZ-CG 4.39Å; A240-Y293 HydrophobicContact CB-CD1 3.51Å; A240-Y293 HydrophobicContact CB-CD2 4.39Å; A240-Y293 HydrophobicContact CB-CE1 4.17Å; A240-Y293 HydrophobicContact CB-CG 3.63Å; A240-Y293 WeakPolarHBondContact O-CD1 3.4Å; K241-Y293 CarbonylContact O-C 3.46Å; K241-Y293 WeakPolarHBondContact O-CA 3.4Å; K241-Y293 WeakPolarHBondContact O-CB 3.48Å; K241-Y293 WeakPolarHBondContact O-CD1 3.19Å; W242-Y293 HydrophobicContact CD2-CD1 4.25Å; W242-Y293 AromaticContact CD2-CE1 3.96Å; W242-Y293 HydrophobicContact CD2-CE1 3.96Å; W242-Y293 AromaticContact CE3-CD1 3.58Å; W242-Y293 HydrophobicContact CE3-CD1 3.58Å; W242-Y293 AromaticContact CE3-CE1 3.36Å; W242-Y293 HydrophobicContact CE3-CE1 3.36Å; W242-Y293 HydrophobicContact CE3-CG 4.27Å; W242-Y293 AromaticContact CE3-CZ 3.89Å; W242-Y293 HydrophobicContact CH2-CD1 4.5Å; W242-Y293 AromaticContact CH2-CE1 3.49Å; W242-Y293 HydrophobicContact CH2-CE1 3.49Å; W242-Y293 VanDerWaalsContact CH2-CE1 3.49Å; W242-Y293 HydrophobicContact CH2-CE2 4.34Å; W242-Y293 AromaticContact CH2-CZ 3.39Å; W242-Y293 WeakPolarHBondContact CH2-OH 3.4Å; W242-Y293 HydrophobicContact CZ2-CE1 4.05Å; W242-Y293 AromaticContact CZ3-CD1 3.75Å; W242-Y293 HydrophobicContact CZ3-CD1 3.75Å; W242-Y293 HydrophobicContact CZ3-CD2 4.32Å; W242-Y293 AromaticContact CZ3-CE1 3.12Å; W242-Y293 HydrophobicContact CZ3-CE1 3.12Å; W242-Y293 AromaticContact CZ3-CE2 3.79Å; W242-Y293 HydrophobicContact CZ3-CE2 3.79Å; W242-Y293 HydrophobicContact CZ3-CG 4.31Å; W242-Y293 AromaticContact CZ3-CZ 3.14Å; W242-Y293 WeakPolarHBondContact CZ3-OH 3.21Å; Y293-A297 WeakPolarHBondContact CB-O 3.48Å; Y293-A297 HydrophobicContact CD2-CB 3.94Å; Y293-A297 WeakPolarHBondContact CD2-O 3.38Å; Y293-A297 PolarHBondContact N-O 3Å; Y293-A299 HydrophobicContact CE2-CB 3.97Å; Y293-T395 HydrophobicContact CE1-CG2 3.86Å; Y293-T395 WeakPolarHBondContact CE1-OG1 3.34Å; Y293-T395 WeakPolarHBondContact OH-CG2 3.16Å; Y293-I428 HydrophobicContact CE2-CG2 4.23Å
294	I	90.8	Very high	95.9	Very high	79 Å²	79	15.1 Å²	15.1	41%	0.405	9%	0.086	S	C	.	.	S	Bend	trans	-72.1	124.8	158	-54.9	-177.3	0	0	0	106.6	G157 K241	G157-I294 CarbonylContact C-O 3.55Å; K241-I294 HydrophobicContact CB-CD1 3.89Å; K241-I294 HydrophobicContact CB-CG1 4.18Å; K241-I294 PolarHBondContact O-N 3.45Å
295	G	87.6	Confident	95.9	Very high	29 Å²	29	16.8 Å²	16.8	30%	0.299	10%	0.095	S	C	.	.	S	Bend	trans	99.3	-171.3	-171.4	0	0	0	0	0	112.6	D156 A297	D156-G295 WeakPolarHBondContact O-CA 3.46Å; G295-A297 VanDerWaalsContact C-N 3.33Å; G295-A297 PolarHBondContact O-N 2.79Å; G295-A297 VanDerWaalsContact O-N 3.13Å
296	N	87.7	Confident	95.6	Very high	52 Å²	52	20.4 Å²	20.4	28%	0.278	11%	0.109	S	C	.	.	S	Bend	trans	-90	58.6	-170.8	-178.6	31	0	0	0	112.6	P430 M431 D432	N296-P430 WeakPolarHBondContact O-CA 3.17Å; N296-M431 VanDerWaalsContact OD1-CB 3.28Å; N296-M431 WeakPolarHBondContact OD1-CB 3.26Å; N296-M431 PolarHBondContact OD1-N 2.69Å; N296-M431 VanDerWaalsContact OD1-N 3.1Å; N296-D432 PolarHBondContact ND2-OD1 2.78Å; N296-D432 PolarHBondContact ND2-OD2 3.29Å; N296-D432 PolarHBondContact OD1-N 2.84Å
297	A	91.9	Very high	95.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.			trans	-153	153.5	174.3	0	0	0	0	0	112.6	L158 F238 Y293 G295 V429 M431 F437	L158-A297 HydrophobicContact CD2-CB 4.02Å; F238-A297 HydrophobicContact CE2-CB 4.09Å; F238-A297 HydrophobicContact CZ-CB 4.09Å; Y293-A297 WeakPolarHBondContact CB-O 3.48Å; Y293-A297 HydrophobicContact CD2-CB 3.94Å; Y293-A297 WeakPolarHBondContact CD2-O 3.38Å; Y293-A297 PolarHBondContact N-O 3Å; G295-A297 VanDerWaalsContact C-N 3.33Å; G295-A297 PolarHBondContact O-N 2.79Å; G295-A297 VanDerWaalsContact O-N 3.13Å; A297-V429 CarbonylContact C-O 3.58Å; A297-V429 VanDerWaalsContact CA-O 3.28Å; A297-V429 WeakPolarHBondContact CA-O 3.32Å; A297-M431 WeakPolarHBondContact O-CE 3.22Å; A297-F437 HydrophobicContact CB-CE2 4.33Å
298	S	94.8	Very high	95.2	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	157.1	169.3	62.9	0	0	0	0	112.1	E290 I428 V429	E290-S298 WeakPolarHBondContact OE1-CB 3.05Å; E290-S298 PolarHBondContact OE1-OG 3.37Å; S298-I428 WeakPolarHBondContact O-CA 3.33Å; S298-V429 PolarHBondContact N-O 2.85Å; S298-V429 PolarHBondContact O-N 2.84Å
299	A	97	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.8	170.8	0	0	0	0	0	109.4	W242 E290 L291 Y293 F301 M426 I427 I428	W242-A299 HydrophobicContact CH2-CB 3.97Å; W242-A299 HydrophobicContact CZ3-CB 3.92Å; E290-A299 WeakPolarHBondContact CA-O 3.36Å; L291-A299 PolarHBondContact N-O 3.4Å; L291-A299 PolarHBondContact O-N 2.98Å; Y293-A299 HydrophobicContact CE2-CB 3.97Å; A299-F301 HydrophobicContact CB-CD2 4.25Å; A299-F301 HydrophobicContact CB-CE2 3.6Å; A299-F301 HydrophobicContact CB-CZ 4.08Å; A299-M426 HydrophobicContact CB-CE 3.68Å; A299-I427 CarbonylContact C-O 3.52Å; A299-I427 WeakPolarHBondContact CA-O 3.08Å; A299-I428 HydrophobicContact CB-CG1 4.43Å
300	L	98	Very high	94.8	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.6	167	-59.2	-179.4	0	0	0	108.5	E290 I302 L321 K325 L328 M426 I427	E290-L300 HydrophobicContact CB-CD2 3.77Å; E290-L300 HydrophobicContact CG-CD2 3.83Å; L300-I302 HydrophobicContact CB-CD1 4.21Å; L300-L321 HydrophobicContact CD1-CD1 3.7Å; L300-K325 HydrophobicContact CD1-CG 4.33Å; L300-L328 HydrophobicContact CD2-CD1 3.7Å; L300-M426 CarbonylContact O-C 3.52Å; L300-M426 VanDerWaalsContact O-CA 3.32Å; L300-M426 WeakPolarHBondContact O-CA 3.46Å; L300-I427 HydrophobicContact CB-CB 4.39Å; L300-I427 PolarHBondContact N-O 2.95Å; L300-I427 PolarHBondContact O-N 2.77Å
301	F	98.5	Very high	94.7	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.9	172.3	-65.8	-89.8	0	0	0	109.1	W242 V288 V289 L291 A299 L338 F420 F424 L425 M426	W242-F301 HydrophobicContact CH2-CE2 4.15Å; W242-F301 HydrophobicContact CH2-CZ 4.03Å; V288-F301 CarbonylContact C-O 3.48Å; V288-F301 WeakPolarHBondContact CA-O 3.19Å; V289-F301 PolarHBondContact N-O 3.24Å; V289-F301 PolarHBondContact O-N 3.05Å; L291-F301 HydrophobicContact CB-CE2 4.08Å; L291-F301 HydrophobicContact CD1-CD2 4.21Å; L291-F301 HydrophobicContact CD1-CE2 3.71Å; L291-F301 HydrophobicContact CD1-CZ 4.49Å; L291-F301 HydrophobicContact CG-CD2 4.14Å; L291-F301 HydrophobicContact CG-CE2 3.94Å; A299-F301 HydrophobicContact CB-CD2 4.25Å; A299-F301 HydrophobicContact CB-CE2 3.6Å; A299-F301 HydrophobicContact CB-CZ 4.08Å; F301-L338 HydrophobicContact CD1-CD1 3.71Å; F301-L338 HydrophobicContact CE1-CD1 3.53Å; F301-L338 HydrophobicContact CE1-CD2 3.94Å; F301-L338 HydrophobicContact CE1-CG 4.37Å; F301-L338 HydrophobicContact CE2-CD2 4.28Å; F301-L338 HydrophobicContact CG-CD1 4.4Å; F301-L338 HydrophobicContact CZ-CD1 4.1Å; F301-L338 HydrophobicContact CZ-CD2 3.67Å; F301-F420 HydrophobicContact CB-CD1 4.37Å; F301-F420 HydrophobicContact CB-CE1 3.44Å; F301-F420 VanDerWaalsContact CB-CE1 3.44Å; F301-F420 HydrophobicContact CB-CE2 4.12Å; F301-F420 HydrophobicContact CB-CZ 3.29Å; F301-F420 HydrophobicContact CG-CE1 4.37Å; F301-F420 HydrophobicContact CG-CZ 4.25Å; F301-F424 HydrophobicContact CD1-CD2 4.19Å; F301-F424 AromaticContact CD1-CE2 3.9Å; F301-F424 HydrophobicContact CD1-CE2 3.9Å; F301-F424 HydrophobicContact CE1-CE2 4.21Å; F301-L425 WeakPolarHBondContact CA-O 3.35Å; F301-M426 HydrophobicContact CD1-CB 4.24Å; F301-M426 HydrophobicContact CD1-CG 4.07Å; F301-M426 HydrophobicContact CD1-SD 4.36Å; F301-M426 HydrophobicContact CE1-CB 4.29Å; F301-M426 HydrophobicContact CE1-CE 4.11Å; F301-M426 HydrophobicContact CE1-CG 3.78Å; F301-M426 HydrophobicContact CE1-SD 3.52Å; F301-M426 VanDerWaalsContact CE1-SD 3.52Å; F301-M426 HydrophobicContact CZ-CE 3.78Å; F301-M426 HydrophobicContact CZ-CG 4.23Å; F301-M426 HydrophobicContact CZ-SD 3.85Å
302	I	98.7	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.6	-179	-53.4	90.5	0	0	0	107.6	C286 T287 V288 L300 P304 V312 W324 F424 L425 I427	C286-I302 HydrophobicContact CB-CG2 4.14Å; T287-I302 WeakPolarHBondContact O-CA 3.21Å; V288-I302 HydrophobicContact CG1-CG1 4.36Å; V288-I302 HydrophobicContact CG2-CG1 4.22Å; V288-I302 HydrophobicContact CG2-CG2 4.37Å; L300-I302 HydrophobicContact CB-CD1 4.21Å; I302-P304 VanDerWaalsContact O-CD 3.31Å; I302-P304 WeakPolarHBondContact O-CD 3.44Å; I302-V312 HydrophobicContact CG2-CG1 4.09Å; I302-W324 HydrophobicContact CD1-CZ3 4.22Å; I302-W324 HydrophobicContact CG1-CE3 4.16Å; I302-W324 HydrophobicContact CG1-CH2 4.1Å; I302-W324 HydrophobicContact CG1-CZ3 3.75Å; I302-W324 HydrophobicContact CG2-CH2 3.97Å; I302-W324 HydrophobicContact CG2-CZ2 4.26Å; I302-W324 HydrophobicContact CG2-CZ3 4.49Å; I302-F424 WeakPolarHBondContact O-CA 3.42Å; I302-F424 WeakPolarHBondContact O-CB 3.45Å; I302-L425 HydrophobicContact CB-CB 4.15Å; I302-L425 HydrophobicContact CD1-CB 4.18Å; I302-L425 PolarHBondContact N-O 2.87Å; I302-L425 PolarHBondContact O-N 2.81Å; I302-I427 HydrophobicContact CD1-CD1 3.97Å; I302-I427 HydrophobicContact CD1-CG1 3.95Å
303	L	98.5	Very high	94.8	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	95.6	179.9	-174.7	62.3	0	0	0	109	C286 T287 V418 R419 F420 R422 F424	C286-L303 WeakPolarHBondContact CA-O 3.16Å; T287-L303 PolarHBondContact N-O 3.32Å; T287-L303 PolarHBondContact O-N 2.86Å; L303-V418 HydrophobicContact CD2-CG1 4.13Å; L303-R419 WeakPolarHBondContact CD2-O 3.22Å; L303-F420 HydrophobicContact CB-CD1 4.08Å; L303-F420 HydrophobicContact CB-CE1 3.57Å; L303-F420 HydrophobicContact CB-CZ 4.12Å; L303-F420 HydrophobicContact CD1-CD1 3.96Å; L303-F420 HydrophobicContact CD1-CE1 4.34Å; L303-F420 HydrophobicContact CD2-CD1 4.46Å; L303-F420 HydrophobicContact CD2-CE1 4.48Å; L303-F420 HydrophobicContact CG-CD1 4.38Å; L303-F420 HydrophobicContact CG-CE1 4.33Å; L303-R422 HydrophobicContact CD1-CG 3.77Å; L303-F424 HydrophobicContact CD1-CB 4.06Å
304	P	97.9	Very high	94.9	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.013	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	148.6	171.9	-21.9	33.4	0	0	0	110.9	I302 K308 M309 V312 R422	I302-P304 VanDerWaalsContact O-CD 3.31Å; I302-P304 WeakPolarHBondContact O-CD 3.44Å; P304-K308 HydrophobicContact CB-CB 4.23Å; P304-M309 HydrophobicContact CG-CB 4.48Å; P304-M309 HydrophobicContact CG-CE 3.84Å; P304-M309 HydrophobicContact CG-SD 3.87Å; P304-V312 HydrophobicContact CB-CG2 3.95Å; P304-V312 HydrophobicContact CG-CB 4.2Å; P304-V312 HydrophobicContact CG-CG1 4.37Å; P304-V312 HydrophobicContact CG-CG2 4.05Å; P304-R422 PolarHBondContact O-NE 2.95Å; P304-R422 PolarHBondContact O-NH2 3.2Å
305	D	96.6	Very high	95.2	Very high	46 Å²	46	39.4 Å²	39.4	25%	0.246	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-60.1	169.9	167	-74	-8	0	0	0	111.6	R280 S285 D307 K308	R280-D305 IonicContact CZ-OD1 3.08Å; R280-D305 IonicContact CZ-OD2 3.95Å; R280-D305 IonicContact NH1-OD1 3.08Å; R280-D305 PolarHBondContact NH1-OD1 3.24Å; R280-D305 IonicContact NH1-OD2 2.69Å; R280-D305 PolarHBondContact NH1-OD2 3.34Å; R280-D305 IonicContact NH2-OD1 3.34Å; R280-D305 IonicContact NH2-OD2 3.77Å; R280-D305 PolarHBondContact NH2-OD2 2.85Å; S285-D305 VanDerWaalsContact O-CB 3.27Å; S285-D305 WeakPolarHBondContact O-CB 3.3Å; S285-D305 PolarHBondContact O-N 3.41Å; D305-D307 PolarHBondContact O-N 2.89Å; D305-D307 VanDerWaalsContact O-N 3.15Å; D305-K308 HydrophobicContact CB-CB 4.12Å; D305-K308 HydrophobicContact CB-CG 3.83Å; D305-K308 PolarHBondContact O-N 2.81Å
306	Q	92.6	Very high	95.6	Very high	109 Å²	109	38 Å²	38	51%	0.509	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	125.2	178.8	-173.5	65.2	43.7	0	0	110	K308	Q306-K308 PolarHBondContact O-N 3.44Å
307	D	91.1	Very high	95.9	Very high	92 Å²	92	38.5 Å²	38.5	49%	0.492	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	20.4	-179.5	-44	-33.6	0	0	0	114.6	K260 D305	K260-D307 VanDerWaalsContact CE-CG 3.45Å; K260-D307 WeakPolarHBondContact CE-OD1 3.44Å; K260-D307 WeakPolarHBondContact CE-OD2 3.31Å; K260-D307 IonicContact NZ-OD1 3.71Å; K260-D307 IonicContact NZ-OD2 2.61Å; K260-D307 PolarHBondContact NZ-OD2 3.02Å; D305-D307 PolarHBondContact O-N 2.89Å; D305-D307 VanDerWaalsContact O-N 3.15Å
308	K	96.2	Very high	96	Very high	72 Å²	72	39.4 Å²	39.4	31%	0.313	20%	0.203	S	C	.	.			trans	-103.8	8.4	179.8	-65.8	-58.8	-173.5	177.2	0	116.4	P304 D305 Q306 E310 E311 V312	P304-K308 HydrophobicContact CB-CB 4.23Å; D305-K308 HydrophobicContact CB-CB 4.12Å; D305-K308 HydrophobicContact CB-CG 3.83Å; D305-K308 PolarHBondContact O-N 2.81Å; Q306-K308 PolarHBondContact O-N 3.44Å; K308-E310 PolarHBondContact O-N 3.39Å; K308-E311 WeakPolarHBondContact CA-OE2 3.2Å; K308-E311 VanDerWaalsContact CD-OE1 3.3Å; K308-E311 WeakPolarHBondContact CD-OE1 3.48Å; K308-E311 WeakPolarHBondContact CD-OE2 3.47Å; K308-E311 IonicContact NZ-OE1 2.89Å; K308-E311 PolarHBondContact NZ-OE1 3.39Å; K308-V312 WeakPolarHBondContact O-CG2 3.22Å; K308-V312 PolarHBondContact O-N 2.79Å
309	M	95.3	Very high	95.9	Very high	26 Å²	26	45.1 Å²	45.1	13%	0.128	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-47.3	-176.9	179	63.2	74.8	0	0	111.6	P304 E311 V312 E313 P423 L425	P304-M309 HydrophobicContact CG-CB 4.48Å; P304-M309 HydrophobicContact CG-CE 3.84Å; P304-M309 HydrophobicContact CG-SD 3.87Å; M309-E311 PolarHBondContact O-N 3.47Å; M309-V312 PolarHBondContact O-N 2.99Å; M309-E313 HydrophobicContact CG-CG 4.2Å; M309-E313 WeakPolarHBondContact O-CB 3.44Å; M309-E313 VanDerWaalsContact O-CG 3.28Å; M309-E313 WeakPolarHBondContact O-CG 3.23Å; M309-E313 PolarHBondContact O-N 3.01Å; M309-E313 HydrophobicContact SD-CG 3.95Å; M309-P423 HydrophobicContact CE-CB 3.59Å; M309-P423 VanDerWaalsContact CE-O 3.28Å; M309-P423 WeakPolarHBondContact CE-O 3.43Å; M309-L425 HydrophobicContact CE-CD2 4.38Å; M309-L425 HydrophobicContact SD-CD2 3.9Å; M309-L425 HydrophobicContact SD-CG 4.18Å
310	E	94.5	Very high	95.8	Very high	157 Å²	157	45.5 Å²	45.5	73%	0.734	23%	0.232	S	C	*	.	H	α-helix	trans	-64.2	-40.3	-175.9	-67.1	177.9	-171	0	0	112.1	K308 E313 A314	K308-E310 PolarHBondContact O-N 3.39Å; E310-E313 PolarHBondContact O-N 3.36Å; E310-A314 WeakPolarHBondContact O-CB 3.31Å; E310-A314 PolarHBondContact O-N 3.37Å
311	E	96	Very high	95.7	Very high	81 Å²	81	45.7 Å²	45.7	38%	0.379	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-39.9	176.1	-62.3	100.8	140.1	0	0	112.2	K308 M309 M315	K308-E311 WeakPolarHBondContact CA-OE2 3.2Å; K308-E311 VanDerWaalsContact CD-OE1 3.3Å; K308-E311 WeakPolarHBondContact CD-OE1 3.48Å; K308-E311 WeakPolarHBondContact CD-OE2 3.47Å; K308-E311 IonicContact NZ-OE1 2.89Å; K308-E311 PolarHBondContact NZ-OE1 3.39Å; M309-E311 PolarHBondContact O-N 3.47Å; E311-M315 WeakPolarHBondContact O-CG 3.41Å; E311-M315 PolarHBondContact O-N 3.19Å
312	V	97.4	Very high	95.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-45.5	174.8	173.4	0	0	0	0	110.6	L284 C286 I302 P304 K308 M309 A314 M315 L316 W324 L425	L284-V312 HydrophobicContact CB-CG2 4.35Å; L284-V312 WeakPolarHBondContact O-CG2 3.39Å; C286-V312 HydrophobicContact CB-CG2 3.84Å; I302-V312 HydrophobicContact CG2-CG1 4.09Å; P304-V312 HydrophobicContact CB-CG2 3.95Å; P304-V312 HydrophobicContact CG-CB 4.2Å; P304-V312 HydrophobicContact CG-CG1 4.37Å; P304-V312 HydrophobicContact CG-CG2 4.05Å; K308-V312 WeakPolarHBondContact O-CG2 3.22Å; K308-V312 PolarHBondContact O-N 2.79Å; M309-V312 PolarHBondContact O-N 2.99Å; V312-A314 PolarHBondContact O-N 2.92Å; V312-M315 CarbonylContact O-C 3.43Å; V312-M315 PolarHBondContact O-N 2.87Å; V312-L316 PolarHBondContact O-N 2.79Å; V312-W324 HydrophobicContact CG1-CH2 4.18Å; V312-W324 HydrophobicContact CG1-CZ2 4.48Å; V312-L425 HydrophobicContact CG1-CD1 4.1Å
313	E	96.7	Very high	95.3	Very high	17 Å²	17	54 Å²	54	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-39.9	179.3	-71.9	-178.3	126.7	0	0	112.5	Y86 K87 M309 E310 M315 L316 K441	Y86-E313 HydrophobicContact CE1-CB 4.22Å; Y86-E313 HydrophobicContact CE1-CG 3.84Å; Y86-E313 PolarHBondContact OH-OE1 2.86Å; K87-E313 VanDerWaalsContact CE-O 3.31Å; K87-E313 WeakPolarHBondContact CE-O 3.17Å; M309-E313 HydrophobicContact CG-CG 4.2Å; M309-E313 WeakPolarHBondContact O-CB 3.44Å; M309-E313 VanDerWaalsContact O-CG 3.28Å; M309-E313 WeakPolarHBondContact O-CG 3.23Å; M309-E313 PolarHBondContact O-N 3.01Å; M309-E313 HydrophobicContact SD-CG 3.95Å; E310-E313 PolarHBondContact O-N 3.36Å; E313-M315 PolarHBondContact O-N 3.32Å; E313-L316 PolarHBondContact O-N 2.99Å; E313-K441 VanDerWaalsContact CD-NZ 3.26Å; E313-K441 VanDerWaalsContact OE1-CD 3.31Å; E313-K441 WeakPolarHBondContact OE1-CD 3.24Å; E313-K441 WeakPolarHBondContact OE1-CE 3.45Å; E313-K441 IonicContact OE1-NZ 3.26Å; E313-K441 PolarHBondContact OE1-NZ 2.97Å; E313-K441 IonicContact OE2-NZ 3.88Å; E313-K441 PolarHBondContact OE2-NZ 3.37Å
314	A	95.7	Very high	95.2	Very high	60 Å²	60	53.8 Å²	53.8	50%	0.496	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-37.2	176.5	0	0	0	0	0	111.7	K87 E310 V312	K87-A314 PolarHBondContact NZ-O 2.84Å; E310-A314 WeakPolarHBondContact O-CB 3.31Å; E310-A314 PolarHBondContact O-N 3.37Å; V312-A314 PolarHBondContact O-N 2.92Å
315	M	96.6	Very high	95	Very high	75 Å²	75	56.4 Å²	56.4	37%	0.369	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	10.9	-177.4	-64.3	-63.3	-75.1	0	0	114.1	L284 E311 V312 E313 L317 T320	L284-M315 HydrophobicContact CD1-CB 3.93Å; L284-M315 HydrophobicContact CD2-CB 3.55Å; L284-M315 HydrophobicContact CD2-CE 4.43Å; L284-M315 HydrophobicContact CD2-CG 3.58Å; L284-M315 HydrophobicContact CG-CB 4.43Å; E311-M315 WeakPolarHBondContact O-CG 3.41Å; E311-M315 PolarHBondContact O-N 3.19Å; V312-M315 CarbonylContact O-C 3.43Å; V312-M315 PolarHBondContact O-N 2.87Å; E313-M315 PolarHBondContact O-N 3.32Å; M315-L317 PolarHBondContact O-N 3.28Å; M315-T320 WeakPolarHBondContact O-CB 3.25Å; M315-T320 WeakPolarHBondContact O-CG2 3.33Å; M315-T320 PolarHBondContact O-OG1 3.49Å
316	L	95.6	Very high	94.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	29%	0.294	C	S	.	.			trans	-67.3	98.2	166.1	-69.2	177.5	0	0	0	109.2	F83 Y86 K87 V312 E313 W324 L425	F83-L316 HydrophobicContact CB-CB 4.24Å; F83-L316 VanDerWaalsContact CB-O 3.3Å; F83-L316 WeakPolarHBondContact CB-O 3.23Å; F83-L316 HydrophobicContact CD1-CB 3.69Å; F83-L316 HydrophobicContact CD1-CD1 4.32Å; F83-L316 HydrophobicContact CD1-CG 4.41Å; F83-L316 HydrophobicContact CD2-CB 4.38Å; F83-L316 HydrophobicContact CE1-CB 4.07Å; F83-L316 HydrophobicContact CE1-CD2 4.14Å; F83-L316 HydrophobicContact CE1-CG 4.47Å; F83-L316 HydrophobicContact CG-CB 3.86Å; Y86-L316 HydrophobicContact CD1-CD1 3.69Å; Y86-L316 HydrophobicContact CE1-CD1 3.58Å; Y86-L316 HydrophobicContact CG-CD1 4.34Å; K87-L316 PolarHBondContact NZ-O 3.32Å; V312-L316 PolarHBondContact O-N 2.79Å; E313-L316 PolarHBondContact O-N 2.99Å; L316-W324 HydrophobicContact CD2-CH2 3.81Å; L316-W324 HydrophobicContact CD2-CZ3 3.93Å; L316-L425 HydrophobicContact CD1-CD1 3.95Å; L316-L425 HydrophobicContact CD2-CD1 4.21Å; L316-L425 HydrophobicContact CG-CD1 4.5Å
317	L	94.5	Very high	95.1	Very high	61 Å²	61	56.3 Å²	56.3	32%	0.319	28%	0.283	S	S	.	.			trans	-137.4	156.3	-178.4	-61.9	174.9	0	0	0	109.1	F83 M315 E319 T320 L321	F83-L317 VanDerWaalsContact CE2-C 3.42Å; F83-L317 VanDerWaalsContact CE2-O 3.31Å; F83-L317 WeakPolarHBondContact CE2-O 3.28Å; M315-L317 PolarHBondContact O-N 3.28Å; L317-E319 PolarHBondContact O-N 3.13Å; L317-T320 WeakPolarHBondContact O-CB 3.33Å; L317-T320 PolarHBondContact O-N 2.83Å; L317-L321 PolarHBondContact O-N 3.13Å; L317-L321 VanDerWaalsContact O-N 3.13Å
318	P	93.4	Very high	95.4	Very high	19 Å²	19	53.3 Å²	53.3	12%	0.123	27%	0.267	C	S	.	.	H	α-helix	trans	-52	-41.1	177.1	-25.5	33.9	0	0	0	113.7	V79 D80 T320 L321 K322	V79-P318 HydrophobicContact CB-CB 4.44Å; V79-P318 HydrophobicContact CB-CG 4.45Å; V79-P318 HydrophobicContact CG1-CB 3.93Å; V79-P318 HydrophobicContact CG1-CG 4.02Å; D80-P318 HydrophobicContact CB-CG 3.87Å; P318-T320 VanDerWaalsContact C-N 3.32Å; P318-T320 PolarHBondContact O-N 3.1Å; P318-L321 PolarHBondContact O-N 3.44Å; P318-K322 WeakPolarHBondContact O-CB 3.31Å; P318-K322 PolarHBondContact O-N 2.9Å
319	E	93.6	Very high	95.4	Very high	122 Å²	122	55 Å²	55	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-66.1	-36.3	179.5	-59.3	70.7	-152.1	0	0	111.5	L317 K322 R323	L317-E319 PolarHBondContact O-N 3.13Å; E319-K322 PolarHBondContact O-N 2.92Å; E319-R323 VanDerWaalsContact O-CB 3.24Å; E319-R323 WeakPolarHBondContact O-CB 3.32Å; E319-R323 PolarHBondContact O-N 3.3Å
320	T	95.1	Very high	95.4	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-47	176.3	-61.4	0	0	0	0	110.9	L284 M315 L317 P318 K322 R323 W324	L284-T320 HydrophobicContact CD1-CG2 3.62Å; M315-T320 WeakPolarHBondContact O-CB 3.25Å; M315-T320 WeakPolarHBondContact O-CG2 3.33Å; M315-T320 PolarHBondContact O-OG1 3.49Å; L317-T320 WeakPolarHBondContact O-CB 3.33Å; L317-T320 PolarHBondContact O-N 2.83Å; P318-T320 VanDerWaalsContact C-N 3.32Å; P318-T320 PolarHBondContact O-N 3.1Å; T320-K322 VanDerWaalsContact C-N 3.34Å; T320-K322 PolarHBondContact O-N 3.27Å; T320-R323 PolarHBondContact O-N 3.37Å; T320-W324 HydrophobicContact CG2-CD2 3.95Å; T320-W324 HydrophobicContact CG2-CE3 4.23Å; T320-W324 HydrophobicContact CG2-CH2 3.83Å; T320-W324 HydrophobicContact CG2-CZ2 3.52Å; T320-W324 HydrophobicContact CG2-CZ3 4.16Å; T320-W324 PolarHBondContact O-N 3.17Å
321	L	94.8	Very high	95.3	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-43.4	177.3	179.9	60.7	0	0	0	111.2	V79 F83 L300 L317 P318 W324 K325 I427 I436	V79-L321 HydrophobicContact CG1-CD2 4.06Å; V79-L321 HydrophobicContact CG2-CD2 4.27Å; F83-L321 HydrophobicContact CE2-CB 4.16Å; F83-L321 HydrophobicContact CZ-CB 4.07Å; F83-L321 HydrophobicContact CZ-CD2 4.19Å; L300-L321 HydrophobicContact CD1-CD1 3.7Å; L317-L321 PolarHBondContact O-N 3.13Å; L317-L321 VanDerWaalsContact O-N 3.13Å; P318-L321 PolarHBondContact O-N 3.44Å; L321-W324 PolarHBondContact O-N 3.48Å; L321-K325 HydrophobicContact CD1-CG 4.49Å; L321-K325 HydrophobicContact CG-CD 4.48Å; L321-K325 WeakPolarHBondContact O-CG 3.38Å; L321-K325 PolarHBondContact O-N 2.75Å; L321-I427 HydrophobicContact CD1-CD1 4.4Å; L321-I436 HydrophobicContact CD2-CD1 3.83Å; L321-I436 HydrophobicContact CD2-CG1 4.08Å
322	K	93.4	Very high	95.2	Very high	111 Å²	111	56.4 Å²	56.4	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-49.9	175.5	-177.4	177.7	177.6	-178	0	111.2	P318 E319 T320 W324 K325 D326	P318-K322 WeakPolarHBondContact O-CB 3.31Å; P318-K322 PolarHBondContact O-N 2.9Å; E319-K322 PolarHBondContact O-N 2.92Å; T320-K322 VanDerWaalsContact C-N 3.34Å; T320-K322 PolarHBondContact O-N 3.27Å; K322-W324 VanDerWaalsContact C-N 3.33Å; K322-W324 PolarHBondContact O-N 2.94Å; K322-K325 PolarHBondContact O-N 3.11Å; K322-K325 VanDerWaalsContact O-N 3.13Å; K322-D326 WeakPolarHBondContact CG-OD2 3.28Å; K322-D326 WeakPolarHBondContact O-CB 3.49Å; K322-D326 VanDerWaalsContact O-CG 3.24Å; K322-D326 PolarHBondContact O-N 3.33Å
323	R	95.4	Very high	95	Very high	65 Å²	65	56.4 Å²	56.4	25%	0.245	28%	0.275	C	S	.	.	H	α-helix	trans	-57.5	-43.8	177.3	-179.6	176.1	60.8	89	6.6	111.9	D281 E283 E319 T320 D326 S327	D281-R323 IonicContact OD1-CZ 3.01Å; D281-R323 IonicContact OD1-NH1 3.54Å; D281-R323 PolarHBondContact OD1-NH1 3.41Å; D281-R323 IonicContact OD1-NH2 3.3Å; D281-R323 IonicContact OD2-CZ 2.71Å; D281-R323 VanDerWaalsContact OD2-CZ 3.25Å; D281-R323 IonicContact OD2-NH1 2.68Å; D281-R323 PolarHBondContact OD2-NH1 2.99Å; D281-R323 IonicContact OD2-NH2 3.42Å; D281-R323 PolarHBondContact OD2-NH2 3.17Å; E283-R323 IonicContact OE2-NH1 3.27Å; E319-R323 VanDerWaalsContact O-CB 3.24Å; E319-R323 WeakPolarHBondContact O-CB 3.32Å; E319-R323 PolarHBondContact O-N 3.3Å; T320-R323 PolarHBondContact O-N 3.37Å; R323-D326 PolarHBondContact O-N 3.2Å; R323-S327 VanDerWaalsContact O-CB 3.24Å; R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 2.94Å; R323-S327 PolarHBondContact O-OG 3.4Å
324	W	96.3	Very high	94.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-50	174.1	-70.8	-18.2	0	0	0	111.5	F279 D281 L284 V288 I302 V312 L316 T320 L321 K322 D326 S327 L328	F279-W324 AromaticContact CD1-CD1 3.85Å; F279-W324 AromaticContact CE1-CD1 3.81Å; D281-W324 PolarHBondContact OD2-NE1 3.48Å; L284-W324 HydrophobicContact CD1-CZ2 3.78Å; V288-W324 HydrophobicContact CG2-CD2 4.01Å; V288-W324 HydrophobicContact CG2-CG 4.03Å; I302-W324 HydrophobicContact CD1-CZ3 4.22Å; I302-W324 HydrophobicContact CG1-CE3 4.16Å; I302-W324 HydrophobicContact CG1-CH2 4.1Å; I302-W324 HydrophobicContact CG1-CZ3 3.75Å; I302-W324 HydrophobicContact CG2-CH2 3.97Å; I302-W324 HydrophobicContact CG2-CZ2 4.26Å; I302-W324 HydrophobicContact CG2-CZ3 4.49Å; V312-W324 HydrophobicContact CG1-CH2 4.18Å; V312-W324 HydrophobicContact CG1-CZ2 4.48Å; L316-W324 HydrophobicContact CD2-CH2 3.81Å; L316-W324 HydrophobicContact CD2-CZ3 3.93Å; T320-W324 HydrophobicContact CG2-CD2 3.95Å; T320-W324 HydrophobicContact CG2-CE3 4.23Å; T320-W324 HydrophobicContact CG2-CH2 3.83Å; T320-W324 HydrophobicContact CG2-CZ2 3.52Å; T320-W324 HydrophobicContact CG2-CZ3 4.16Å; T320-W324 PolarHBondContact O-N 3.17Å; L321-W324 PolarHBondContact O-N 3.48Å; K322-W324 VanDerWaalsContact C-N 3.33Å; K322-W324 PolarHBondContact O-N 2.94Å; W324-D326 VanDerWaalsContact C-N 3.31Å; W324-D326 PolarHBondContact O-N 3.24Å; W324-S327 PolarHBondContact O-N 2.77Å; W324-L328 VanDerWaalsContact O-CG 3.32Å; W324-L328 WeakPolarHBondContact O-CG 3.28Å; W324-L328 PolarHBondContact O-N 3.28Å
325	K	93.6	Very high	94.9	Very high	57 Å²	57	56.5 Å²	56.5	25%	0.248	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-43.3	178	-72.8	-176.7	72.3	170	0	112.2	L300 L321 K322 S327 T433	L300-K325 HydrophobicContact CD1-CG 4.33Å; L321-K325 HydrophobicContact CD1-CG 4.49Å; L321-K325 HydrophobicContact CG-CD 4.48Å; L321-K325 WeakPolarHBondContact O-CG 3.38Å; L321-K325 PolarHBondContact O-N 2.75Å; K322-K325 PolarHBondContact O-N 3.11Å; K322-K325 VanDerWaalsContact O-N 3.13Å; K325-S327 VanDerWaalsContact C-N 3.33Å; K325-S327 PolarHBondContact O-N 3.01Å; K325-T433 PolarHBondContact NZ-O 3.19Å
326	D	94.8	Very high	94.9	Very high	114 Å²	114	53 Å²	53	61%	0.61	25%	0.249	S	C	*	.	H	α-helix	trans	-72.8	-25.8	-178.1	-65.6	-14.2	0	0	0	112.6	K322 R323 W324	K322-D326 WeakPolarHBondContact CG-OD2 3.28Å; K322-D326 WeakPolarHBondContact O-CB 3.49Å; K322-D326 VanDerWaalsContact O-CG 3.24Å; K322-D326 PolarHBondContact O-N 3.33Å; R323-D326 PolarHBondContact O-N 3.2Å; W324-D326 VanDerWaalsContact C-N 3.31Å; W324-D326 PolarHBondContact O-N 3.24Å
327	S	97.4	Very high	95.1	Very high	39 Å²	39	54.1 Å²	54.1	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-94.9	-4.5	-177.6	-51.6	0	0	0	0	114	F279 R323 W324 K325 E329	F279-S327 VanDerWaalsContact CD2-CB 3.48Å; F279-S327 WeakPolarHBondContact CD2-O 3.36Å; F279-S327 VanDerWaalsContact CE2-CB 3.46Å; R323-S327 VanDerWaalsContact O-CB 3.24Å; R323-S327 WeakPolarHBondContact O-CB 3.42Å; R323-S327 PolarHBondContact O-N 2.94Å; R323-S327 PolarHBondContact O-OG 3.4Å; W324-S327 PolarHBondContact O-N 2.77Å; K325-S327 VanDerWaalsContact C-N 3.33Å; K325-S327 PolarHBondContact O-N 3.01Å; S327-E329 PolarHBondContact O-N 3.28Å
328	L	96.3	Very high	95.2	Very high	29 Å²	29	51.3 Å²	51.3	15%	0.152	24%	0.238	C	C	.	.			trans	-69.3	119.1	177.8	-82	167.2	0	0	0	110.6	P277 F279 V288 E290 L300 W324	P277-L328 HydrophobicContact CB-CB 4Å; P277-L328 HydrophobicContact CB-CD2 4.1Å; P277-L328 HydrophobicContact CB-CG 4.47Å; F279-L328 HydrophobicContact CB-CD2 4.01Å; F279-L328 HydrophobicContact CB-CG 4.46Å; V288-L328 HydrophobicContact CG1-CD2 4.26Å; E290-L328 HydrophobicContact CB-CD1 4.08Å; E290-L328 HydrophobicContact CB-CD2 4.42Å; L300-L328 HydrophobicContact CD2-CD1 3.7Å; W324-L328 VanDerWaalsContact O-CG 3.32Å; W324-L328 WeakPolarHBondContact O-CG 3.28Å; W324-L328 PolarHBondContact O-N 3.28Å
329	E	96.5	Very high	95.4	Very high	108 Å²	108	50.4 Å²	50.4	51%	0.505	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.2	174.3	-66.9	-175.6	166.1	0	0	110.3	P277 Y278 S327 R331	P277-E329 CarbonylContact C-O 3.59Å; P277-E329 WeakPolarHBondContact CA-O 3.29Å; Y278-E329 PolarHBondContact N-O 3.35Å; Y278-E329 PolarHBondContact O-N 3.08Å; S327-E329 PolarHBondContact O-N 3.28Å; E329-R331 PolarHBondContact O-N 3.03Å; E329-R331 VanDerWaalsContact O-N 3.11Å; E329-R331 IonicContact OE2-CZ 2.71Å; E329-R331 IonicContact OE2-NE 2.91Å; E329-R331 IonicContact OE2-NH2 3.94Å; E329-R331 PolarHBondContact OE2-NH2 2.71Å
330	F	94.9	Very high	95.5	Very high	132 Å²	132	48.4 Å²	48.4	58%	0.579	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	117.2	171.8	-76	-85.6	0	0	0	110	T275 P277	T275-F330 HydrophobicContact CG2-CB 4.14Å; T275-F330 HydrophobicContact CG2-CD1 4.26Å; P277-F330 HydrophobicContact CG-CD1 4.02Å; P277-F330 HydrophobicContact CG-CE1 3.78Å; P277-F330 HydrophobicContact CG-CE2 4.3Å; P277-F330 HydrophobicContact CG-CG 4.4Å; P277-F330 HydrophobicContact CG-CZ 3.94Å
331	R	93.5	Very high	95.5	Very high	122 Å²	122	48.4 Å²	48.4	46%	0.46	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.1	174.7	-62.2	-67.3	-177.5	173.5	-3.9	110.3	T275 T276 Y278 E329	T275-R331 WeakPolarHBondContact CA-O 3.43Å; T276-R331 PolarHBondContact N-O 3.31Å; T276-R331 VanDerWaalsContact N-O 3.14Å; T276-R331 PolarHBondContact O-N 2.94Å; Y278-R331 HydrophobicContact CD1-CB 4.33Å; Y278-R331 HydrophobicContact CD1-CG 3.98Å; Y278-R331 HydrophobicContact CG-CB 4.31Å; Y278-R331 HydrophobicContact CG-CG 4.36Å; E329-R331 PolarHBondContact O-N 3.03Å; E329-R331 VanDerWaalsContact O-N 3.11Å; E329-R331 IonicContact OE2-CZ 2.71Å; E329-R331 IonicContact OE2-NE 2.91Å; E329-R331 IonicContact OE2-NH2 3.94Å; E329-R331 PolarHBondContact OE2-NH2 2.71Å
332	H	93.2	Very high	95.3	Very high	39 Å²	39	51 Å²	51	18%	0.181	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.1	170.3	-170	71.9	0	0	0	109.6	H273	H273-H332 AromaticContact ND1-NE2 3.51Å
333	I	94.1	Very high	95	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.9	174.6	-56.3	177.2	0	0	0	107.1	H273 V274 T276 Y278 V289 L336 I416 V418	H273-I333 CarbonylContact C-O 3.55Å; H273-I333 WeakPolarHBondContact CA-O 3.46Å; H273-I333 PolarHBondContact N-O 3.17Å; V274-I333 HydrophobicContact CG1-CB 3.86Å; V274-I333 HydrophobicContact CG1-CG2 4.43Å; V274-I333 PolarHBondContact N-O 2.6Å; V274-I333 PolarHBondContact O-N 2.53Å; T276-I333 HydrophobicContact CG2-CD1 3.85Å; Y278-I333 HydrophobicContact CD2-CD1 3.86Å; Y278-I333 HydrophobicContact CD2-CG1 4.39Å; V289-I333 HydrophobicContact CG1-CD1 4.44Å; I333-L336 HydrophobicContact CG2-CB 4.17Å; I333-I416 HydrophobicContact CG1-CG2 4.28Å; I333-I416 HydrophobicContact CG2-CG2 4.34Å; I333-I416 WeakPolarHBondContact CG2-O 3.45Å; I333-V418 HydrophobicContact CD1-CG2 4.38Å; I333-V418 HydrophobicContact CG2-CG2 4.22Å
334	D	94.2	Very high	94.6	Very high	22 Å²	22	44.5 Å²	44.5	12%	0.118	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	-43.3	-179.8	-63.3	-98.9	0	0	0	111.7	Q272 H273 K415 I416	Q272-D334 CarbonylContact C-O 3.54Å; Q272-D334 WeakPolarHBondContact CA-O 3.25Å; H273-D334 PolarHBondContact N-O 3.33Å; D334-K415 HydrophobicContact CB-CB 4.48Å; D334-K415 WeakPolarHBondContact OD2-CA 3.35Å; D334-I416 PolarHBondContact N-O 2.84Å; D334-I416 PolarHBondContact OD2-N 2.69Å
335	E	95.6	Very high	94.1	Very high	56 Å²	56	47 Å²	47	26%	0.262	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	117.9	-179.9	-53.1	177.7	-170	0	0	111.1	Y337 I416 T417 V418 R419	E335-Y337 HydrophobicContact CB-CD2 4.26Å; E335-Y337 HydrophobicContact CB-CE2 3.45Å; E335-Y337 VanDerWaalsContact CB-CE2 3.45Å; E335-Y337 HydrophobicContact CG-CE2 4.34Å; E335-Y337 WeakPolarHBondContact OE2-CE2 3.33Å; E335-Y337 PolarHBondContact OE2-OH 2.86Å; E335-I416 PolarHBondContact N-O 3.06Å; E335-T417 HydrophobicContact CB-CG2 4.13Å; E335-T417 CarbonylContact O-C 3.37Å; E335-T417 WeakPolarHBondContact O-CA 3.32Å; E335-V418 PolarHBondContact O-N 2.9Å; E335-R419 IonicContact OE2-CZ 3.25Å; E335-R419 IonicContact OE2-NH2 3.79Å; E335-R419 PolarHBondContact OE2-NH2 2.94Å
336	L	97.7	Very high	93.6	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.1	172.1	175	65.6	0	0	0	109.1	S270 L271 V274 V289 L291 I333 V418 F420	S270-L336 CarbonylContact C-O 3.54Å; S270-L336 WeakPolarHBondContact CA-O 3.31Å; L271-L336 HydrophobicContact CB-CB 4.38Å; L271-L336 HydrophobicContact CD1-CD2 4.37Å; L271-L336 PolarHBondContact N-O 2.9Å; L271-L336 PolarHBondContact O-N 2.87Å; V274-L336 HydrophobicContact CG1-CB 4.14Å; V274-L336 HydrophobicContact CG1-CD2 4.47Å; V289-L336 HydrophobicContact CG1-CD1 4.5Å; V289-L336 HydrophobicContact CG1-CD2 4.46Å; L291-L336 HydrophobicContact CD1-CD2 4.37Å; L291-L336 HydrophobicContact CD2-CD2 3.89Å; I333-L336 HydrophobicContact CG2-CB 4.17Å; L336-V418 CarbonylContact C-O 3.59Å; L336-V418 WeakPolarHBondContact CA-O 3.38Å; L336-V418 HydrophobicContact CD1-CB 3.86Å; L336-V418 HydrophobicContact CD1-CG1 4.04Å; L336-F420 HydrophobicContact CD1-CD2 4.17Å; L336-F420 HydrophobicContact CD1-CE2 3.85Å
337	Y	98.3	Very high	93	Very high	26 Å²	26	43.3 Å²	43.3	10%	0.102	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.8	177.1	-59.8	-98.2	0	0	0	110.9	H252 M268 M269 E335 T417 V418 R419 F420	H252-Y337 AromaticContact CE1-CE1 3.95Å; M268-Y337 HydrophobicContact CG-CD1 4.03Å; M268-Y337 HydrophobicContact CG-CG 4.43Å; M269-Y337 WeakPolarHBondContact O-CA 3.28Å; E335-Y337 HydrophobicContact CB-CD2 4.26Å; E335-Y337 HydrophobicContact CB-CE2 3.45Å; E335-Y337 VanDerWaalsContact CB-CE2 3.45Å; E335-Y337 HydrophobicContact CG-CE2 4.34Å; E335-Y337 WeakPolarHBondContact OE2-CE2 3.33Å; E335-Y337 PolarHBondContact OE2-OH 2.86Å; Y337-T417 HydrophobicContact CE2-CG2 4.25Å; Y337-V418 PolarHBondContact N-O 2.86Å; Y337-R419 HydrophobicContact CD2-CG 3.43Å; Y337-R419 VanDerWaalsContact CD2-CG 3.43Å; Y337-R419 HydrophobicContact CE2-CG 4.08Å; Y337-R419 HydrophobicContact CG-CG 4.03Å; Y337-R419 VanDerWaalsContact CZ-CZ 3.46Å; Y337-R419 VanDerWaalsContact CZ-NH2 3.31Å; Y337-R419 PolarHBondContact OH-NH2 2.9Å; Y337-F420 WeakPolarHBondContact O-CB 3.37Å; Y337-F420 WeakPolarHBondContact O-CD2 3.27Å; Y337-F420 PolarHBondContact O-N 3.01Å
338	L	98.2	Very high	92.4	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.9	-178.7	-174.1	72.2	0	0	0	109.7	F246 M269 L291 F301 V390 F420	F246-L338 HydrophobicContact CE1-CB 4.21Å; F246-L338 HydrophobicContact CE2-CD2 4.28Å; F246-L338 HydrophobicContact CZ-CB 4.02Å; F246-L338 HydrophobicContact CZ-CD2 3.92Å; M269-L338 WeakPolarHBondContact CB-O 3.45Å; M269-L338 HydrophobicContact CE-CB 4.19Å; M269-L338 HydrophobicContact CE-CD2 3.86Å; M269-L338 HydrophobicContact CE-CG 4.11Å; M269-L338 PolarHBondContact N-O 3.13Å; M269-L338 PolarHBondContact O-N 3.12Å; L291-L338 HydrophobicContact CD1-CD2 4.21Å; F301-L338 HydrophobicContact CD1-CD1 3.71Å; F301-L338 HydrophobicContact CE1-CD1 3.53Å; F301-L338 HydrophobicContact CE1-CD2 3.94Å; F301-L338 HydrophobicContact CE1-CG 4.37Å; F301-L338 HydrophobicContact CE2-CD2 4.28Å; F301-L338 HydrophobicContact CG-CD1 4.4Å; F301-L338 HydrophobicContact CZ-CD1 4.1Å; F301-L338 HydrophobicContact CZ-CD2 3.67Å; L338-V390 HydrophobicContact CD2-CG1 4.08Å; L338-F420 HydrophobicContact CD1-CB 4Å; L338-F420 HydrophobicContact CD1-CD2 3.94Å; L338-F420 HydrophobicContact CD1-CG 3.9Å
339	P	97.4	Very high	92.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	143.5	177.3	27.3	-31.7	0	0	0	109.8	F256 V266 P267 M268 F341 F420 F424 P445	F256-P339 HydrophobicContact CD2-CG 4.31Å; F256-P339 HydrophobicContact CE2-CG 4.21Å; V266-P339 HydrophobicContact CG2-CB 4.08Å; P267-P339 WeakPolarHBondContact O-CA 3.35Å; M268-P339 HydrophobicContact CE-CB 4.38Å; M268-P339 HydrophobicContact SD-CB 4.34Å; M268-P339 VanDerWaalsContact SD-N 3.43Å; P339-F341 HydrophobicContact CB-CD1 4.46Å; P339-F341 HydrophobicContact CG-CD1 4.13Å; P339-F341 VanDerWaalsContact O-CD1 3.23Å; P339-F341 WeakPolarHBondContact O-CD1 3.46Å; P339-F420 VanDerWaalsContact CD-O 3.31Å; P339-F420 WeakPolarHBondContact CD-O 3.35Å; P339-F424 HydrophobicContact CG-CE1 3.81Å; P339-F424 HydrophobicContact CG-CZ 4.04Å; P339-P445 HydrophobicContact CB-CB 4.31Å; P339-P445 HydrophobicContact CB-CG 4.18Å; P339-P445 HydrophobicContact CG-CG 4.21Å
340	K	95.6	Very high	91.8	Very high	80 Å²	80	40.2 Å²	40.2	35%	0.348	19%	0.191	S	C	.	.			trans	-81.5	127.9	163.1	171.5	174.9	-171.7	162.7	0	108.3	P267 M269 V390 E392	P267-K340 HydrophobicContact CB-CB 4.22Å; P267-K340 HydrophobicContact CG-CB 3.95Å; P267-K340 HydrophobicContact CG-CG 4.36Å; P267-K340 PolarHBondContact O-N 3.35Å; M269-K340 HydrophobicContact CG-CB 3.96Å; M269-K340 HydrophobicContact SD-CB 3.93Å; K340-V390 WeakPolarHBondContact CG-O 3.5Å; K340-E392 WeakPolarHBondContact CE-OE2 3.24Å; K340-E392 VanDerWaalsContact NZ-CD 3.29Å; K340-E392 IonicContact NZ-OE1 2.99Å; K340-E392 PolarHBondContact NZ-OE1 3.05Å; K340-E392 IonicContact NZ-OE2 3.79Å; K340-E392 PolarHBondContact NZ-OE2 3.05Å
341	F	93.5	Very high	91.7	Very high	10 Å²	10	38.3 Å²	38.3	4%	0.044	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	159.5	-175.4	64.8	-92.5	0	0	0	112.6	P339 I343 L388 V390 F424 M426 V442 P445	P339-F341 HydrophobicContact CB-CD1 4.46Å; P339-F341 HydrophobicContact CG-CD1 4.13Å; P339-F341 VanDerWaalsContact O-CD1 3.23Å; P339-F341 WeakPolarHBondContact O-CD1 3.46Å; F341-I343 HydrophobicContact CD2-CD1 4.42Å; F341-I343 HydrophobicContact CD2-CG1 4.22Å; F341-I343 HydrophobicContact CD2-CG2 3.96Å; F341-I343 HydrophobicContact CE2-CD1 3.96Å; F341-I343 HydrophobicContact CE2-CG1 4.11Å; F341-I343 HydrophobicContact CE2-CG2 4.5Å; F341-L388 HydrophobicContact CE2-CD2 4.42Å; F341-V390 HydrophobicContact CD1-CB 4.06Å; F341-V390 HydrophobicContact CD1-CG1 4.41Å; F341-V390 HydrophobicContact CD2-CB 4.47Å; F341-V390 HydrophobicContact CE1-CB 3.75Å; F341-V390 HydrophobicContact CE1-CG1 3.99Å; F341-V390 HydrophobicContact CE1-CG2 3.85Å; F341-V390 HydrophobicContact CE2-CB 4.22Å; F341-V390 HydrophobicContact CE2-CG2 3.83Å; F341-V390 HydrophobicContact CG-CB 4.4Å; F341-V390 HydrophobicContact CZ-CB 3.86Å; F341-V390 HydrophobicContact CZ-CG1 4.45Å; F341-V390 HydrophobicContact CZ-CG2 3.46Å; F341-V390 VanDerWaalsContact CZ-CG2 3.46Å; F341-V390 PolarHBondContact N-O 3.18Å; F341-V390 VanDerWaalsContact N-O 3.13Å; F341-V390 PolarHBondContact O-N 3.47Å; F341-F424 HydrophobicContact CD1-CZ 4.45Å; F341-F424 HydrophobicContact CE1-CE2 4.33Å; F341-F424 AromaticContact CE1-CZ 3.73Å; F341-F424 HydrophobicContact CE1-CZ 3.73Å; F341-F424 HydrophobicContact CZ-CE2 4.42Å; F341-F424 HydrophobicContact CZ-CZ 4.16Å; F341-M426 HydrophobicContact CZ-SD 4.12Å; F341-V442 HydrophobicContact CE1-CG2 4.49Å; F341-V442 HydrophobicContact CE2-CG2 3.92Å; F341-V442 HydrophobicContact CZ-CG2 3.87Å; F341-P445 HydrophobicContact CB-CB 3.89Å
342	S	91.4	Very high	91.7	Very high	58 Å²	58	32.7 Å²	32.7	41%	0.406	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.5	171.2	176.5	0	0	0	0	106.7	L388 D389	S342-L388 WeakPolarHBondContact CA-O 3.42Å; S342-D389 WeakPolarHBondContact CB-OD1 3.41Å; S342-D389 PolarHBondContact OG-OD1 3.44Å
343	I	88.3	Confident	91.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.3	177.4	57.2	176.9	0	0	0	109.7	N97 I99 F341 V387 L388 S440 V442	N97-I343 HydrophobicContact CB-CG2 4.46Å; N97-I343 WeakPolarHBondContact ND2-CG2 3.38Å; I99-I343 HydrophobicContact CB-CD1 3.85Å; I99-I343 HydrophobicContact CB-CG1 4.33Å; I99-I343 HydrophobicContact CD1-CD1 3.94Å; I99-I343 HydrophobicContact CD1-CG1 3.92Å; I99-I343 HydrophobicContact CG1-CD1 4.41Å; I99-I343 HydrophobicContact CG2-CB 4.49Å; I99-I343 HydrophobicContact CG2-CD1 4.15Å; I99-I343 HydrophobicContact CG2-CG1 4.18Å; F341-I343 HydrophobicContact CD2-CD1 4.42Å; F341-I343 HydrophobicContact CD2-CG1 4.22Å; F341-I343 HydrophobicContact CD2-CG2 3.96Å; F341-I343 HydrophobicContact CE2-CD1 3.96Å; F341-I343 HydrophobicContact CE2-CG1 4.11Å; F341-I343 HydrophobicContact CE2-CG2 4.5Å; I343-V387 WeakPolarHBondContact O-CA 3.47Å; I343-L388 HydrophobicContact CD1-CD2 4.41Å; I343-L388 HydrophobicContact CG1-CB 4.05Å; I343-L388 PolarHBondContact N-O 2.88Å; I343-L388 PolarHBondContact O-N 2.81Å; I343-S440 WeakPolarHBondContact CD1-OG 3.31Å; I343-V442 HydrophobicContact CD1-CG2 4.33Å
344	S	85.3	Confident	91.9	Very high	40 Å²	40	35 Å²	35	28%	0.28	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.6	177.2	58.5	0	0	0	0	109.5	A386 A448	S344-A386 WeakPolarHBondContact CA-O 3.47Å; S344-A448 PolarHBondContact N-OXT 2.72Å; S344-A448 PolarHBondContact OG-OXT 3.06Å; S344-A448 VanDerWaalsContact OG-OXT 3.09Å
345	R	85.9	Confident	92	Very high	52 Å²	52	40.5 Å²	40.5	20%	0.196	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	137	174	-70.2	-71.3	143.2	157.1	-8.1	110.1	I99 Y347 K385 A386 Q447 A448	I99-R345 HydrophobicContact CG2-CB 3.73Å; I99-R345 HydrophobicContact CG2-CG 3.68Å; R345-Y347 HydrophobicContact CB-CD2 4.47Å; R345-Y347 HydrophobicContact CB-CE1 4.44Å; R345-Y347 HydrophobicContact CB-CE2 3.56Å; R345-Y347 WeakPolarHBondContact CB-OH 3.27Å; R345-K385 WeakPolarHBondContact O-CA 3.28Å; R345-A386 PolarHBondContact N-O 3.28Å; R345-A386 VanDerWaalsContact N-O 3.12Å; R345-A386 PolarHBondContact O-N 3.25Å; R345-Q447 VanDerWaalsContact NH2-CG 3.33Å; R345-A448 PolarHBondContact NH2-O 3.19Å
346	D	83.1	Confident	92	Very high	65 Å²	65	39 Å²	39	35%	0.348	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	135.2	169.1	-61	-66.5	0	0	0	107.8	K385	D346-K385 VanDerWaalsContact OD1-CB 3.24Å; D346-K385 WeakPolarHBondContact OD1-CB 3.42Å; D346-K385 WeakPolarHBondContact OD1-CD 3.02Å; D346-K385 VanDerWaalsContact OD1-CE 3.25Å; D346-K385 WeakPolarHBondContact OD1-CE 3.29Å; D346-K385 WeakPolarHBondContact OD1-CG 3.4Å; D346-K385 IonicContact OD1-NZ 2.68Å; D346-K385 PolarHBondContact OD1-NZ 3.48Å; D346-K385 IonicContact OD2-NZ 3.6Å; D346-K385 PolarHBondContact OD2-NZ 2.97Å
347	Y	83.9	Confident	92	Very high	30 Å²	30	40.9 Å²	40.9	12%	0.118	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.1	173	-52.8	-90.6	0	0	0	109.6	L89 I99 F100 R345 L349 H384	L89-Y347 HydrophobicContact CD1-CD1 4.48Å; L89-Y347 HydrophobicContact CD1-CE1 4.09Å; L89-Y347 HydrophobicContact CD2-CD1 3.45Å; L89-Y347 VanDerWaalsContact CD2-CD1 3.45Å; L89-Y347 HydrophobicContact CD2-CE1 3.6Å; L89-Y347 HydrophobicContact CD2-CG 4.29Å; L89-Y347 HydrophobicContact CG-CE1 4.33Å; I99-Y347 PolarHBondContact N-OH 3.22Å; I99-Y347 WeakPolarHBondContact O-CE2 3.48Å; I99-Y347 VanDerWaalsContact O-CZ 3.28Å; I99-Y347 PolarHBondContact O-OH 3.36Å; F100-Y347 HydrophobicContact CB-CE2 4.05Å; R345-Y347 HydrophobicContact CB-CD2 4.47Å; R345-Y347 HydrophobicContact CB-CE1 4.44Å; R345-Y347 HydrophobicContact CB-CE2 3.56Å; R345-Y347 WeakPolarHBondContact CB-OH 3.27Å; Y347-L349 HydrophobicContact CG-CD2 4.21Å; Y347-H384 PolarHBondContact N-O 2.93Å; Y347-H384 PolarHBondContact O-N 2.94Å; Y347-H384 VanDerWaalsContact O-N 3.16Å
348	D	83.6	Confident	92	Very high	70 Å²	70	39.7 Å²	39.7	37%	0.374	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	109.1	148.7	-162.2	-35.5	0	0	0	107.8	E350 Q381	D348-E350 VanDerWaalsContact C-N 3.32Å; D348-E350 PolarHBondContact OD1-N 2.73Å; D348-Q381 PolarHBondContact OD2-NE2 2.67Å
349	L	89.9	Confident	91.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.231	C	C	.	.			trans	-82.5	-8.4	-171.5	-68.8	178.1	0	0	0	113	I105 Y347 D351 V352 L353 V382 H384	I105-L349 HydrophobicContact CD1-CD1 3.75Å; I105-L349 HydrophobicContact CD1-CD2 4.41Å; I105-L349 HydrophobicContact CG1-CD1 3.88Å; I105-L349 HydrophobicContact CG2-CD1 3.84Å; Y347-L349 HydrophobicContact CG-CD2 4.21Å; L349-D351 PolarHBondContact O-N 2.92Å; L349-V352 PolarHBondContact O-N 2.95Å; L349-V352 VanDerWaalsContact O-N 3.11Å; L349-L353 HydrophobicContact CB-CD1 3.68Å; L349-L353 HydrophobicContact CB-CG 3.95Å; L349-L353 WeakPolarHBondContact O-CB 3Å; L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.22Å; L349-V382 HydrophobicContact CB-CB 4.22Å; L349-V382 HydrophobicContact CB-CG1 4.19Å; L349-V382 HydrophobicContact CD1-CG1 4.06Å; L349-V382 PolarHBondContact N-O 3.42Å; L349-H384 HydrophobicContact CD1-CB 3.72Å; L349-H384 HydrophobicContact CG-CB 4.26Å
350	E	91.4	Very high	91.9	Very high	40 Å²	40	46.4 Å²	46.4	19%	0.187	24%	0.238	C	C	.	.	H	α-helix	trans	-52	-59.5	-174	176.3	173.7	179.9	0	0	112.8	D348 V352 L353 R354 F362	D348-E350 VanDerWaalsContact C-N 3.32Å; D348-E350 PolarHBondContact OD1-N 2.73Å; E350-V352 PolarHBondContact O-N 3.2Å; E350-L353 PolarHBondContact O-N 3.15Å; E350-R354 WeakPolarHBondContact O-CG 3.49Å; E350-R354 PolarHBondContact O-N 3.42Å; E350-R354 IonicContact OE1-CZ 3.78Å; E350-R354 IonicContact OE1-NE 3.47Å; E350-R354 PolarHBondContact OE1-NE 3.44Å; E350-R354 IonicContact OE1-NH2 2.73Å; E350-R354 PolarHBondContact OE1-NH2 3.01Å; E350-F362 HydrophobicContact CB-CD1 4.18Å; E350-F362 HydrophobicContact CB-CE1 3.99Å; E350-F362 HydrophobicContact CB-CZ 4.37Å; E350-F362 HydrophobicContact CG-CB 4.32Å; E350-F362 HydrophobicContact CG-CD1 3.66Å; E350-F362 HydrophobicContact CG-CD2 4.21Å; E350-F362 HydrophobicContact CG-CE1 3.94Å; E350-F362 HydrophobicContact CG-CE2 4.46Å; E350-F362 HydrophobicContact CG-CG 3.81Å; E350-F362 HydrophobicContact CG-CZ 4.35Å
351	D	91.5	Very high	92	Very high	91 Å²	91	42.7 Å²	42.7	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-55.5	-39.8	-179.2	-70.3	-31.7	0	0	0	112	K92 L349 Q355	K92-D351 IonicContact NZ-OD2 3.78Å; K92-D351 PolarHBondContact NZ-OD2 2.91Å; L349-D351 PolarHBondContact O-N 2.92Å; D351-Q355 WeakPolarHBondContact O-CG 3.11Å; D351-Q355 PolarHBondContact O-N 3.23Å
352	V	93.6	Very high	92.2	Very high	5 Å²	5	43 Å²	43	3%	0.03	22%	0.223	C	C	.	.	H	α-helix	trans	-72.9	-41.2	-174.6	177.7	0	0	0	0	110.3	L85 Q88 L89 K92 L349 E350 Q355 L356	L85-V352 HydrophobicContact CD1-CG1 3.32Å; Q88-V352 HydrophobicContact CB-CG1 3.73Å; L89-V352 HydrophobicContact CD2-CG1 4.11Å; L89-V352 HydrophobicContact CD2-CG2 3.9Å; L89-V352 HydrophobicContact CG-CG1 4.41Å; K92-V352 HydrophobicContact CD-CG2 4.18Å; L349-V352 PolarHBondContact O-N 2.95Å; L349-V352 VanDerWaalsContact O-N 3.11Å; E350-V352 PolarHBondContact O-N 3.2Å; V352-Q355 PolarHBondContact O-N 3.25Å; V352-L356 WeakPolarHBondContact O-CG 3.28Å; V352-L356 PolarHBondContact O-N 3.07Å
353	L	96.1	Very high	92.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.9	-36.4	177.4	-66.9	173.1	0	0	0	111.5	L109 L349 E350 Q355 L356 G357 I358 F362 V382	L109-L353 HydrophobicContact CD1-CD1 4.42Å; L109-L353 HydrophobicContact CD1-CD2 3.67Å; L109-L353 HydrophobicContact CD2-CD1 3.96Å; L349-L353 HydrophobicContact CB-CD1 3.68Å; L349-L353 HydrophobicContact CB-CG 3.95Å; L349-L353 WeakPolarHBondContact O-CB 3Å; L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.22Å; E350-L353 PolarHBondContact O-N 3.15Å; L353-Q355 VanDerWaalsContact C-N 3.33Å; L353-Q355 PolarHBondContact O-N 3.02Å; L353-L356 HydrophobicContact CD2-CD1 4.49Å; L353-L356 CarbonylContact O-C 3.59Å; L353-L356 WeakPolarHBondContact O-CA 3.01Å; L353-L356 WeakPolarHBondContact O-CB 3.44Å; L353-L356 PolarHBondContact O-N 2.84Å; L353-G357 PolarHBondContact O-N 2.93Å; L353-I358 CarbonylContact C-O 3.47Å; L353-I358 HydrophobicContact CB-CB 4.22Å; L353-I358 HydrophobicContact CB-CD1 4.4Å; L353-I358 HydrophobicContact CD2-CD1 3.98Å; L353-I358 WeakPolarHBondContact O-CB 3.24Å; L353-I358 PolarHBondContact O-N 3.46Å; L353-F362 HydrophobicContact CB-CE2 3.99Å; L353-F362 HydrophobicContact CB-CZ 4.1Å; L353-F362 HydrophobicContact CD1-CZ 3.88Å; L353-V382 HydrophobicContact CD1-CB 4.42Å; L353-V382 HydrophobicContact CD1-CG1 4.37Å; L353-V382 HydrophobicContact CD1-CG2 4.4Å
354	R	96.3	Very high	92.7	Very high	86 Å²	86	47.6 Å²	47.6	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-42.8	170.7	-71.8	177.7	177.8	-148.1	2.9	111.9	E350 L356 G357 I358 F362	E350-R354 WeakPolarHBondContact O-CG 3.49Å; E350-R354 PolarHBondContact O-N 3.42Å; E350-R354 IonicContact OE1-CZ 3.78Å; E350-R354 IonicContact OE1-NE 3.47Å; E350-R354 PolarHBondContact OE1-NE 3.44Å; E350-R354 IonicContact OE1-NH2 2.73Å; E350-R354 PolarHBondContact OE1-NH2 3.01Å; R354-L356 PolarHBondContact O-N 3.45Å; R354-G357 PolarHBondContact O-N 3.19Å; R354-I358 VanDerWaalsContact CA-O 3.29Å; R354-I358 WeakPolarHBondContact CA-O 3.45Å; R354-I358 PolarHBondContact N-O 3.02Å; R354-F362 HydrophobicContact CG-CD2 3.94Å; R354-F362 HydrophobicContact CG-CE2 4.35Å
355	Q	95.4	Very high	93.2	Very high	138 Å²	138	53.4 Å²	53.4	65%	0.645	28%	0.275	S	S	*	.	H	α-helix	trans	-65.6	-18.8	174.3	-64.3	-58.6	-29	0	0	113.6	Q88 D351 V352 L353 G357	Q88-Q355 HydrophobicContact CG-CB 4.33Å; D351-Q355 WeakPolarHBondContact O-CG 3.11Å; D351-Q355 PolarHBondContact O-N 3.23Å; V352-Q355 PolarHBondContact O-N 3.25Å; L353-Q355 VanDerWaalsContact C-N 3.33Å; L353-Q355 PolarHBondContact O-N 3.02Å; Q355-G357 VanDerWaalsContact C-N 3.34Å
356	L	96.3	Very high	93.7	Very high	26 Å²	26	51 Å²	51	14%	0.136	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	4.8	172.6	-63.3	176.8	0	0	0	113.1	F81 L85 Q88 V352 L353 R354	F81-L356 HydrophobicContact CE2-CD1 3.93Å; L85-L356 HydrophobicContact CB-CD1 4.19Å; L85-L356 HydrophobicContact CD1-CD1 4.07Å; Q88-L356 HydrophobicContact CG-CD2 3.81Å; Q88-L356 HydrophobicContact CG-CG 4.22Å; V352-L356 WeakPolarHBondContact O-CG 3.28Å; V352-L356 PolarHBondContact O-N 3.07Å; L353-L356 HydrophobicContact CD2-CD1 4.49Å; L353-L356 CarbonylContact O-C 3.59Å; L353-L356 WeakPolarHBondContact O-CA 3.01Å; L353-L356 WeakPolarHBondContact O-CB 3.44Å; L353-L356 PolarHBondContact O-N 2.84Å; R354-L356 PolarHBondContact O-N 3.45Å
357	G	96.8	Very high	94.4	Very high	40 Å²	40	48.3 Å²	48.3	41%	0.412	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	15.3	177.8	0	0	0	0	0	114.7	E123 L353 R354 Q355	E123-G357 WeakPolarHBondContact CB-O 3.35Å; L353-G357 PolarHBondContact O-N 2.93Å; R354-G357 PolarHBondContact O-N 3.19Å; Q355-G357 VanDerWaalsContact C-N 3.34Å
358	I	98	Very high	95.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.			trans	-100.3	92.6	173.6	-54.1	167.9	0	0	0	107.2	L109 I124 L353 R354 V361 F362	L109-I358 HydrophobicContact CD1-CD1 4.11Å; I124-I358 HydrophobicContact CG1-CG2 3.93Å; L353-I358 CarbonylContact C-O 3.47Å; L353-I358 HydrophobicContact CB-CB 4.22Å; L353-I358 HydrophobicContact CB-CD1 4.4Å; L353-I358 HydrophobicContact CD2-CD1 3.98Å; L353-I358 WeakPolarHBondContact O-CB 3.24Å; L353-I358 PolarHBondContact O-N 3.46Å; R354-I358 VanDerWaalsContact CA-O 3.29Å; R354-I358 WeakPolarHBondContact CA-O 3.45Å; R354-I358 PolarHBondContact N-O 3.02Å; I358-V361 HydrophobicContact CG2-CG1 3.71Å; I358-F362 HydrophobicContact CG2-CE2 4.13Å; I358-F362 WeakPolarHBondContact O-CD2 3.19Å; I358-F362 VanDerWaalsContact O-CE2 3.26Å; I358-F362 WeakPolarHBondContact O-CE2 3.46Å
359	E	97	Very high	95.7	Very high	108 Å²	108	44.7 Å²	44.7	51%	0.505	24%	0.236	S	C	.	.			trans	-118.7	-53.8	-168.9	-173.5	179.1	167.1	0	0	112.5	E123 V361 F362	E123-E359 PolarHBondContact OE2-N 2.72Å; E359-V361 PolarHBondContact O-N 2.96Å; E359-V361 VanDerWaalsContact O-N 3.09Å; E359-F362 PolarHBondContact O-N 3Å
360	E	97.9	Very high	96.1	Very high	35 Å²	35	45.4 Å²	45.4	16%	0.164	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-58	-34	-168.5	-167.1	174.8	90	0	0	112.2	T119 T120 E123 F362 T363 K365 A366	T119-E360 WeakPolarHBondContact CB-OE1 3.27Å; T119-E360 WeakPolarHBondContact CB-OE2 3.38Å; T119-E360 WeakPolarHBondContact CG2-OE2 3.28Å; T120-E360 PolarHBondContact N-OE1 3.15Å; T120-E360 PolarHBondContact OG1-OE1 2.79Å; E123-E360 WeakPolarHBondContact OE2-CB 3.5Å; E123-E360 PolarHBondContact OE2-N 3.45Å; E360-F362 PolarHBondContact O-N 3.49Å; E360-F362 VanDerWaalsContact O-N 3.15Å; E360-T363 PolarHBondContact O-N 3.24Å; E360-T363 PolarHBondContact O-OG1 2.94Å; E360-K365 HydrophobicContact CG-CB 3.79Å; E360-A366 WeakPolarHBondContact O-CB 3.38Å; E360-A366 PolarHBondContact O-N 3.02Å
361	V	97.6	Very high	96.3	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-59.1	-25.1	179.7	77	0	0	0	0	114	L112 T120 I124 I358 E359 L368 V379	L112-V361 HydrophobicContact CD2-CG2 3.95Å; T120-V361 HydrophobicContact CG2-CB 3.8Å; T120-V361 HydrophobicContact CG2-CG2 3.88Å; I124-V361 HydrophobicContact CD1-CB 4.42Å; I124-V361 HydrophobicContact CD1-CG2 4.11Å; I358-V361 HydrophobicContact CG2-CG1 3.71Å; E359-V361 PolarHBondContact O-N 2.96Å; E359-V361 VanDerWaalsContact O-N 3.09Å; V361-L368 HydrophobicContact CG2-CD1 4.24Å; V361-L368 HydrophobicContact CG2-CD2 4.12Å; V361-V379 HydrophobicContact CG2-CB 4.38Å; V361-V379 HydrophobicContact CG2-CG2 3.72Å; V361-V379 PolarHBondContact O-N 2.88Å
362	F	96.7	Very high	96.5	Very high	16 Å²	16	39.9 Å²	39.9	7%	0.07	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-94.2	6.6	179	-58.5	-72.4	0	0	0	112.8	E350 L353 R354 I358 E359 E360 V379 V382	E350-F362 HydrophobicContact CB-CD1 4.18Å; E350-F362 HydrophobicContact CB-CE1 3.99Å; E350-F362 HydrophobicContact CB-CZ 4.37Å; E350-F362 HydrophobicContact CG-CB 4.32Å; E350-F362 HydrophobicContact CG-CD1 3.66Å; E350-F362 HydrophobicContact CG-CD2 4.21Å; E350-F362 HydrophobicContact CG-CE1 3.94Å; E350-F362 HydrophobicContact CG-CE2 4.46Å; E350-F362 HydrophobicContact CG-CG 3.81Å; E350-F362 HydrophobicContact CG-CZ 4.35Å; L353-F362 HydrophobicContact CB-CE2 3.99Å; L353-F362 HydrophobicContact CB-CZ 4.1Å; L353-F362 HydrophobicContact CD1-CZ 3.88Å; R354-F362 HydrophobicContact CG-CD2 3.94Å; R354-F362 HydrophobicContact CG-CE2 4.35Å; I358-F362 HydrophobicContact CG2-CE2 4.13Å; I358-F362 WeakPolarHBondContact O-CD2 3.19Å; I358-F362 VanDerWaalsContact O-CE2 3.26Å; I358-F362 WeakPolarHBondContact O-CE2 3.46Å; E359-F362 PolarHBondContact O-N 3Å; E360-F362 PolarHBondContact O-N 3.49Å; E360-F362 VanDerWaalsContact O-N 3.15Å; F362-V379 HydrophobicContact CD1-CB 4.07Å; F362-V379 HydrophobicContact CD1-CG1 4.09Å; F362-V379 HydrophobicContact CE1-CB 4.18Å; F362-V379 HydrophobicContact CE1-CG1 3.82Å; F362-V382 HydrophobicContact CE1-CG2 3.81Å; F362-V382 HydrophobicContact CZ-CG2 4.14Å
363	T	95.6	Very high	96.4	Very high	36 Å²	36	42.1 Å²	42.1	22%	0.221	24%	0.24	C	C	.	.	S	Bend	trans	-122.9	166	-173.1	76.9	0	0	0	0	111.6	E360 K365 A366 A378	E360-T363 PolarHBondContact O-N 3.24Å; E360-T363 PolarHBondContact O-OG1 2.94Å; T363-K365 PolarHBondContact O-N 2.89Å; T363-K365 PolarHBondContact OG1-N 3.19Å; T363-A366 VanDerWaalsContact O-CB 3.25Å; T363-A366 WeakPolarHBondContact O-CB 3.35Å; T363-A366 PolarHBondContact O-N 3.44Å; T363-A378 VanDerWaalsContact O-CB 3.29Å; T363-A378 WeakPolarHBondContact O-CB 3.06Å
364	S	94.2	Very high	96	Very high	120 Å²	120	43.9 Å²	43.9	84%	0.839	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-4.2	173.7	68.3	0	0	0	0	114.6
365	K	96.2	Very high	95.5	Very high	161 Å²	161	47.5 Å²	47.5	70%	0.7	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-8	174.9	-64.2	178.1	-177.6	172.8	0	112.8	E360 T363 D367	E360-K365 HydrophobicContact CG-CB 3.79Å; T363-K365 PolarHBondContact O-N 2.89Å; T363-K365 PolarHBondContact OG1-N 3.19Å; K365-D367 PolarHBondContact O-N 2.91Å
366	A	97.3	Very high	95	Very high	1 Å²	1	46 Å²	46	1%	0.008	27%	0.265	C	S	.	.			trans	-52.1	127.1	-178.7	0	0	0	0	0	111.5	T120 E360 T363 L368 L377 A378	T120-A366 WeakPolarHBondContact OG1-CA 3.43Å; E360-A366 WeakPolarHBondContact O-CB 3.38Å; E360-A366 PolarHBondContact O-N 3.02Å; T363-A366 VanDerWaalsContact O-CB 3.25Å; T363-A366 WeakPolarHBondContact O-CB 3.35Å; T363-A366 PolarHBondContact O-N 3.44Å; A366-L368 HydrophobicContact CB-CD1 4.39Å; A366-L368 HydrophobicContact CB-CG 4.25Å; A366-L368 PolarHBondContact O-N 2.93Å; A366-L377 WeakPolarHBondContact CB-O 3.32Å; A366-A378 HydrophobicContact CB-CB 4.17Å
367	D	97.9	Very high	94.9	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.048	26%	0.259	C	S	.	.			trans	-97.6	75.6	173.1	-162.1	1.4	0	0	0	109.8	A116 H117 N118 T120 K365 S369 R375	A116-D367 CarbonylContact C-O 3.28Å; A116-D367 WeakPolarHBondContact CA-O 3.31Å; H117-D367 HydrophobicContact CB-CB 4.34Å; H117-D367 PolarHBondContact N-O 2.76Å; N118-D367 PolarHBondContact ND2-OD2 3.37Å; T120-D367 PolarHBondContact OG1-N 3.37Å; K365-D367 PolarHBondContact O-N 2.91Å; D367-S369 VanDerWaalsContact C-N 3.33Å; D367-S369 PolarHBondContact OD1-OG 3.31Å; D367-R375 WeakPolarHBondContact OD1-CG 3.37Å; D367-R375 IonicContact OD1-CZ 2.69Å; D367-R375 IonicContact OD1-NE 2.73Å; D367-R375 PolarHBondContact OD1-NE 2.91Å; D367-R375 IonicContact OD1-NH2 3.56Å; D367-R375 IonicContact OD2-CZ 3.11Å; D367-R375 VanDerWaalsContact OD2-CZ 3.28Å; D367-R375 IonicContact OD2-NE 3.18Å; D367-R375 PolarHBondContact OD2-NE 3.39Å; D367-R375 IonicContact OD2-NH2 2.62Å; D367-R375 PolarHBondContact OD2-NH2 2.78Å
368	L	97.6	Very high	94.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.			trans	-97	25.6	175.7	-65.3	177	0	0	0	112.4	L112 G115 A116 T120 M230 V361 A366 G370 I371 L377 V379	L112-L368 HydrophobicContact CD1-CD2 4.17Å; G115-L368 CarbonylContact O-C 3.52Å; G115-L368 VanDerWaalsContact O-C 3.28Å; G115-L368 VanDerWaalsContact O-CA 3.31Å; G115-L368 WeakPolarHBondContact O-CA 3.09Å; A116-L368 HydrophobicContact CB-CD2 4.03Å; T120-L368 HydrophobicContact CG2-CD2 4.26Å; M230-L368 HydrophobicContact SD-CD1 3.89Å; V361-L368 HydrophobicContact CG2-CD1 4.24Å; V361-L368 HydrophobicContact CG2-CD2 4.12Å; A366-L368 HydrophobicContact CB-CD1 4.39Å; A366-L368 HydrophobicContact CB-CG 4.25Å; A366-L368 PolarHBondContact O-N 2.93Å; L368-G370 PolarHBondContact O-N 3.21Å; L368-G370 VanDerWaalsContact O-N 3.11Å; L368-I371 HydrophobicContact CB-CD1 4.1Å; L368-I371 HydrophobicContact CB-CG1 4.43Å; L368-I371 HydrophobicContact CD1-CD1 4.4Å; L368-I371 HydrophobicContact CD2-CD1 4.11Å; L368-I371 HydrophobicContact CG-CD1 4.43Å; L368-I371 WeakPolarHBondContact O-CB 3.19Å; L368-I371 PolarHBondContact O-N 3.27Å; L368-L377 HydrophobicContact CB-CB 4.23Å; L368-L377 HydrophobicContact CB-CD2 4.14Å; L368-L377 HydrophobicContact CB-CG 4.26Å; L368-L377 HydrophobicContact CD1-CD2 4.43Å; L368-L377 HydrophobicContact CD1-CG 4.09Å; L368-V379 HydrophobicContact CD1-CG2 4.15Å
369	S	97.1	Very high	94.7	Very high	25 Å²	25	44 Å²	44	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-15.6	-177.9	70.6	0	0	0	0	113.4	H117 D367 I371 G373 A374	H117-S369 PolarHBondContact CD2-OG 3.48Å; D367-S369 VanDerWaalsContact C-N 3.33Å; D367-S369 PolarHBondContact OD1-OG 3.31Å; S369-I371 PolarHBondContact O-N 2.98Å; S369-G373 WeakPolarHBondContact O-CA 3.44Å; S369-G373 PolarHBondContact O-N 2.91Å; S369-A374 VanDerWaalsContact CA-O 3.31Å; S369-A374 WeakPolarHBondContact CA-O 3.48Å
370	G	97.2	Very high	94.5	Very high	15 Å²	15	40.5 Å²	40.5	16%	0.155	24%	0.235	C	C	.	.	H	α-helix	trans	-68	-16.3	171.1	0	0	0	0	0	113.2	G115 H117 F178 L368	G115-G370 VanDerWaalsContact O-CA 3.3Å; G115-G370 WeakPolarHBondContact O-CA 3.34Å; G115-G370 PolarHBondContact O-N 2.73Å; H117-G370 WeakPolarHBondContact NE2-CA 3.31Å; H117-G370 PolarHBondContact NE2-N 3.19Å; F178-G370 WeakPolarHBondContact CB-O 3.27Å; L368-G370 PolarHBondContact O-N 3.21Å; L368-G370 VanDerWaalsContact O-N 3.11Å
371	I	97	Very high	94.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-88.6	-47.7	177.6	-53.6	-177.8	0	0	0	111.2	L112 M166 V168 L174 L175 F178 M230 L368 S369 L377	L112-I371 HydrophobicContact CD1-CD1 4.37Å; M166-I371 HydrophobicContact CE-CD1 4.14Å; M166-I371 HydrophobicContact SD-CD1 3.83Å; M166-I371 HydrophobicContact SD-CG2 4.26Å; V168-I371 HydrophobicContact CG2-CG2 4.37Å; L174-I371 HydrophobicContact CD2-CG2 3.61Å; L175-I371 PolarHBondContact N-O 3.12Å; F178-I371 HydrophobicContact CD1-CG2 4.08Å; F178-I371 HydrophobicContact CD2-CG1 4.29Å; F178-I371 HydrophobicContact CE1-CG1 4.38Å; F178-I371 HydrophobicContact CE1-CG2 3.94Å; F178-I371 HydrophobicContact CE2-CG1 3.98Å; F178-I371 HydrophobicContact CZ-CD1 4.36Å; F178-I371 HydrophobicContact CZ-CG1 4.04Å; F178-I371 HydrophobicContact CZ-CG2 4.4Å; M230-I371 HydrophobicContact CE-CD1 3.78Å; M230-I371 HydrophobicContact SD-CD1 4.21Å; L368-I371 HydrophobicContact CB-CD1 4.1Å; L368-I371 HydrophobicContact CB-CG1 4.43Å; L368-I371 HydrophobicContact CD1-CD1 4.4Å; L368-I371 HydrophobicContact CD2-CD1 4.11Å; L368-I371 HydrophobicContact CG-CD1 4.43Å; L368-I371 WeakPolarHBondContact O-CB 3.19Å; L368-I371 PolarHBondContact O-N 3.27Å; S369-I371 PolarHBondContact O-N 2.98Å; I371-L377 HydrophobicContact CB-CD2 4.05Å; I371-L377 HydrophobicContact CD1-CD2 4.16Å; I371-L377 HydrophobicContact CG2-CD2 4.08Å
372	T	94.9	Very high	94	Very high	15 Å²	15	40.4 Å²	40.4	9%	0.092	24%	0.235	C	C	.	.	H	α-helix	trans	-125.4	-2.9	-169.2	62.9	0	0	0	0	114.9	V168 L172 S173 L174 A374 L377	V168-T372 HydrophobicContact CG1-CG2 4.2Å; L172-T372 HydrophobicContact CB-CG2 3.84Å; S173-T372 VanDerWaalsContact O-CA 3.22Å; S173-T372 WeakPolarHBondContact O-CA 3.41Å; L174-T372 HydrophobicContact CD2-CG2 4.48Å; T372-A374 PolarHBondContact O-N 3.31Å; T372-A374 PolarHBondContact OG1-N 2.88Å; T372-L377 HydrophobicContact CG2-CD2 3.78Å
373	G	92.1	Very high	93.7	Very high	53 Å²	53	40 Å²	40	55%	0.546	23%	0.233	S	C	.	.	S	Bend	trans	77.2	-7.6	-171.8	0	0	0	0	0	114.5	S369	S369-G373 WeakPolarHBondContact O-CA 3.44Å; S369-G373 PolarHBondContact O-N 2.91Å
374	A	87.6	Confident	93.5	Very high	37 Å²	37	38.2 Å²	38.2	31%	0.306	22%	0.223	S	C	.	.	S	Bend	trans	-116.9	156.4	-178.5	0	0	0	0	0	112.2	S369 T372 N376	S369-A374 VanDerWaalsContact CA-O 3.31Å; S369-A374 WeakPolarHBondContact CA-O 3.48Å; T372-A374 PolarHBondContact O-N 3.31Å; T372-A374 PolarHBondContact OG1-N 2.88Å; A374-N376 WeakPolarHBondContact CB-OD1 3.3Å
375	R	85.1	Confident	93.1	Very high	161 Å²	161	33.8 Å²	33.8	61%	0.608	19%	0.188	S	C	*	.	S	Bend	trans	-100	20.1	-178.8	-69.9	-172.7	166.2	175.2	-3.2	114	D367	D367-R375 WeakPolarHBondContact OD1-CG 3.37Å; D367-R375 IonicContact OD1-CZ 2.69Å; D367-R375 IonicContact OD1-NE 2.73Å; D367-R375 PolarHBondContact OD1-NE 2.91Å; D367-R375 IonicContact OD1-NH2 3.56Å; D367-R375 IonicContact OD2-CZ 3.11Å; D367-R375 VanDerWaalsContact OD2-CZ 3.28Å; D367-R375 IonicContact OD2-NE 3.18Å; D367-R375 PolarHBondContact OD2-NE 3.39Å; D367-R375 IonicContact OD2-NH2 2.62Å; D367-R375 PolarHBondContact OD2-NH2 2.78Å
376	N	85.8	Confident	92.6	Very high	106 Å²	106	26.1 Å²	26.1	57%	0.567	16%	0.155	S	C	*	.			trans	-104.6	27.1	-179.5	65.7	-36.5	0	0	0	111.9	A374	A374-N376 WeakPolarHBondContact CB-OD1 3.3Å
377	L	93.4	Very high	91.9	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	17%	0.166	C	C	.	.			trans	-120.4	131.4	-178.6	-176.9	62	0	0	0	109.4	V168 L172 V229 M230 A366 L368 I371 T372	V168-L377 HydrophobicContact CG1-CD1 4.23Å; V168-L377 HydrophobicContact CG1-CD2 4.29Å; L172-L377 HydrophobicContact CD1-CB 4.47Å; L172-L377 HydrophobicContact CD1-CD1 3.72Å; V229-L377 HydrophobicContact CB-CD1 4.4Å; V229-L377 HydrophobicContact CG2-CD1 4.12Å; M230-L377 HydrophobicContact CB-CD1 3.87Å; M230-L377 HydrophobicContact SD-CD1 4.16Å; M230-L377 HydrophobicContact SD-CD2 3.97Å; M230-L377 HydrophobicContact SD-CG 4Å; A366-L377 WeakPolarHBondContact CB-O 3.32Å; L368-L377 HydrophobicContact CB-CB 4.23Å; L368-L377 HydrophobicContact CB-CD2 4.14Å; L368-L377 HydrophobicContact CB-CG 4.26Å; L368-L377 HydrophobicContact CD1-CD2 4.43Å; L368-L377 HydrophobicContact CD1-CG 4.09Å; I371-L377 HydrophobicContact CB-CD2 4.05Å; I371-L377 HydrophobicContact CD1-CD2 4.16Å; I371-L377 HydrophobicContact CG2-CD2 4.08Å; T372-L377 HydrophobicContact CG2-CD2 3.78Å
378	A	95.3	Very high	91.3	Very high	18 Å²	18	27.6 Å²	27.6	15%	0.149	16%	0.164	C	C	.	.			trans	-134.4	154.5	172	0	0	0	0	0	108.5	V229 M230 T363 A366 S380	V229-A378 WeakPolarHBondContact CG2-O 3.29Å; M230-A378 WeakPolarHBondContact CB-O 3.36Å; T363-A378 VanDerWaalsContact O-CB 3.29Å; T363-A378 WeakPolarHBondContact O-CB 3.06Å; A366-A378 HydrophobicContact CB-CB 4.17Å; A378-S380 PolarHBondContact O-N 2.7Å
379	V	95.5	Very high	90.9	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	18%	0.179	C	C	.	.			trans	-72.8	118.5	173.5	175.8	0	0	0	0	108.7	L112 M230 V361 F362 L368 V382	L112-V379 HydrophobicContact CD1-CG2 3.92Å; L112-V379 HydrophobicContact CD2-CG2 3.93Å; M230-V379 HydrophobicContact CE-CG2 3.78Å; M230-V379 HydrophobicContact SD-CG2 3.81Å; V361-V379 HydrophobicContact CG2-CB 4.38Å; V361-V379 HydrophobicContact CG2-CG2 3.72Å; V361-V379 PolarHBondContact O-N 2.88Å; F362-V379 HydrophobicContact CD1-CB 4.07Å; F362-V379 HydrophobicContact CD1-CG1 4.09Å; F362-V379 HydrophobicContact CE1-CB 4.18Å; F362-V379 HydrophobicContact CE1-CG1 3.82Å; L368-V379 HydrophobicContact CD1-CG2 4.15Å; V379-V382 HydrophobicContact CG1-CG2 3.53Å
380	S	93.8	Very high	90.8	Very high	36 Å²	36	29.3 Å²	29.3	25%	0.252	17%	0.171	S	C	.	.			trans	-84.5	-31.2	177.1	-49.2	0	0	0	0	112	V229 M230 A378	V229-S380 WeakPolarHBondContact CG2-OG 3.19Å; V229-S380 PolarHBondContact N-OG 3.08Å; M230-S380 PolarHBondContact N-OG 2.95Å; M230-S380 WeakPolarHBondContact O-CA 3.4Å; M230-S380 VanDerWaalsContact O-CB 3.27Å; M230-S380 WeakPolarHBondContact O-CB 3.31Å; M230-S380 PolarHBondContact O-N 2.8Å; A378-S380 PolarHBondContact O-N 2.7Å
381	Q	91.7	Very high	90.6	Very high	32 Å²	32	29.1 Å²	29.1	15%	0.15	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	141.1	-179.8	-156.8	177.3	17.9	0	0	112	M230 V231 L232 D348 V383	M230-Q381 PolarHBondContact O-N 2.88Å; V231-Q381 HydrophobicContact CG1-CB 4.38Å; V231-Q381 HydrophobicContact CG2-CB 4.41Å; L232-Q381 PolarHBondContact N-O 3.03Å; D348-Q381 PolarHBondContact OD2-NE2 2.67Å; Q381-V383 HydrophobicContact CB-CG2 4.49Å; Q381-V383 VanDerWaalsContact CD-CG2 3.48Å; Q381-V383 HydrophobicContact CG-CG2 3.65Å
382	V	92.6	Very high	90.4	Very high	2 Å²	2	30 Å²	30	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	109.9	168.9	-176.7	0	0	0	0	108.4	L232 L349 L353 F362 V379	L232-V382 HydrophobicContact CB-CG1 4.49Å; L232-V382 HydrophobicContact CB-CG2 4.26Å; L232-V382 HydrophobicContact CD2-CG1 4.19Å; L232-V382 HydrophobicContact CD2-CG2 4.39Å; L232-V382 HydrophobicContact CG-CG1 4.49Å; L232-V382 WeakPolarHBondContact O-CA 3.11Å; L349-V382 HydrophobicContact CB-CB 4.22Å; L349-V382 HydrophobicContact CB-CG1 4.19Å; L349-V382 HydrophobicContact CD1-CG1 4.06Å; L349-V382 PolarHBondContact N-O 3.42Å; L353-V382 HydrophobicContact CD1-CB 4.42Å; L353-V382 HydrophobicContact CD1-CG1 4.37Å; L353-V382 HydrophobicContact CD1-CG2 4.4Å; F362-V382 HydrophobicContact CE1-CG2 3.81Å; F362-V382 HydrophobicContact CZ-CG2 4.14Å; V379-V382 HydrophobicContact CG1-CG2 3.53Å
383	V	90.9	Very high	90.1	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.036	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.6	-174.8	-169.9	0	0	0	0	110.3	L220 I221 L232 N234 Q381	L220-V383 HydrophobicContact CD1-CG1 3.72Å; L220-V383 HydrophobicContact CD2-CG1 4.35Å; L220-V383 HydrophobicContact CG-CB 4.43Å; L220-V383 HydrophobicContact CG-CG1 3.74Å; I221-V383 HydrophobicContact CD1-CG2 4.5Å; I221-V383 HydrophobicContact CG1-CG2 4.29Å; L232-V383 PolarHBondContact O-N 3.28Å; N234-V383 PolarHBondContact N-O 2.89Å; Q381-V383 HydrophobicContact CB-CG2 4.49Å; Q381-V383 VanDerWaalsContact CD-CG2 3.48Å; Q381-V383 HydrophobicContact CG-CG2 3.65Å
384	H	90.3	Very high	89.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.8	171.8	177.6	69	0	0	0	110.4	F100 S101 I105 N234 Y347 L349	F100-H384 WeakPolarHBondContact CA-NE2 3.02Å; S101-H384 PolarHBondContact N-NE2 2.95Å; I105-H384 HydrophobicContact CD1-CB 4.24Å; I105-H384 HydrophobicContact CG1-CB 4.16Å; N234-H384 PolarHBondContact OD1-CE1 3.39Å; N234-H384 PolarHBondContact OD1-ND1 2.88Å; Y347-H384 PolarHBondContact N-O 2.93Å; Y347-H384 PolarHBondContact O-N 2.94Å; Y347-H384 VanDerWaalsContact O-N 3.16Å; L349-H384 HydrophobicContact CD1-CB 3.72Å; L349-H384 HydrophobicContact CG-CB 4.26Å
385	K	86.7	Confident	89.4	Confident	27 Å²	27	26 Å²	26	12%	0.117	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.9	169	-173.9	179.7	-151.2	105.5	0	110.7	I217 D219 L220 R345 D346 V387	I217-K385 HydrophobicContact CB-CD 4.46Å; I217-K385 HydrophobicContact CD1-CB 4.49Å; I217-K385 HydrophobicContact CD1-CD 4.34Å; I217-K385 HydrophobicContact CD1-CG 4.44Å; I217-K385 HydrophobicContact CG1-CD 4.27Å; I217-K385 HydrophobicContact CG2-CD 3.57Å; D219-K385 PolarHBondContact O-NZ 3.33Å; L220-K385 HydrophobicContact CD1-CB 3.28Å; L220-K385 HydrophobicContact CD1-CD 4.25Å; L220-K385 HydrophobicContact CD1-CG 4.4Å; R345-K385 WeakPolarHBondContact O-CA 3.28Å; D346-K385 VanDerWaalsContact OD1-CB 3.24Å; D346-K385 WeakPolarHBondContact OD1-CB 3.42Å; D346-K385 WeakPolarHBondContact OD1-CD 3.02Å; D346-K385 VanDerWaalsContact OD1-CE 3.25Å; D346-K385 WeakPolarHBondContact OD1-CE 3.29Å; D346-K385 WeakPolarHBondContact OD1-CG 3.4Å; D346-K385 IonicContact OD1-NZ 2.68Å; D346-K385 PolarHBondContact OD1-NZ 3.48Å; D346-K385 IonicContact OD2-NZ 3.6Å; D346-K385 PolarHBondContact OD2-NZ 2.97Å; K385-V387 HydrophobicContact CG-CG2 4.41Å
386	A	84.9	Confident	88.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.1	171.6	0	0	0	0	0	109.6	I99 S344 R345 F438	I99-A386 HydrophobicContact CD1-CB 4.29Å; I99-A386 HydrophobicContact CG1-CB 3.9Å; S344-A386 WeakPolarHBondContact CA-O 3.47Å; R345-A386 PolarHBondContact N-O 3.28Å; R345-A386 VanDerWaalsContact N-O 3.12Å; R345-A386 PolarHBondContact O-N 3.25Å; A386-F438 HydrophobicContact CB-CD1 4.34Å; A386-F438 HydrophobicContact CB-CE1 3.97Å
387	V	83.1	Confident	86.3	Confident	38 Å²	38	17.5 Å²	17.5	23%	0.23	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.4	174.7	-175.8	0	0	0	0	107.9	I343 K385	I343-V387 WeakPolarHBondContact O-CA 3.47Å; K385-V387 HydrophobicContact CG-CG2 4.41Å
388	L	84.9	Confident	83.6	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.016	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	119.5	175.5	-179.6	69.2	0	0	0	110.4	I99 F341 S342 I343 V390 T395 M426 I428	I99-L388 HydrophobicContact CD1-CB 3.13Å; I99-L388 HydrophobicContact CD1-CD2 4Å; I99-L388 HydrophobicContact CD1-CG 4.19Å; F341-L388 HydrophobicContact CE2-CD2 4.42Å; S342-L388 WeakPolarHBondContact CA-O 3.42Å; I343-L388 HydrophobicContact CD1-CD2 4.41Å; I343-L388 HydrophobicContact CG1-CB 4.05Å; I343-L388 PolarHBondContact N-O 2.88Å; I343-L388 PolarHBondContact O-N 2.81Å; L388-V390 HydrophobicContact CD2-CG2 4.38Å; L388-V390 HydrophobicContact CG-CG2 4.18Å; L388-T395 HydrophobicContact CD1-CG2 3.68Å; L388-M426 HydrophobicContact CD2-CE 4.11Å; L388-M426 HydrophobicContact CD2-SD 3.72Å; L388-I428 HydrophobicContact CD1-CD1 3.7Å
389	D	89.4	Confident	80.6	Confident	59 Å²	59	25.1 Å²	25.1	32%	0.316	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.7	175.7	-65.5	-43	0	0	0	109	S342 T395 E396	S342-D389 WeakPolarHBondContact CB-OD1 3.41Å; S342-D389 PolarHBondContact OG-OD1 3.44Å; D389-T395 WeakPolarHBondContact O-CA 3.39Å; D389-E396 PolarHBondContact O-N 3.13Å
390	V	93.9	Very high	77.7	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121	174.7	172.4	0	0	0	0	109.5	W242 M269 L338 K340 F341 L388 T395 M426	W242-V390 HydrophobicContact CZ2-CG1 4.22Å; M269-V390 HydrophobicContact CE-CG1 3.98Å; L338-V390 HydrophobicContact CD2-CG1 4.08Å; K340-V390 WeakPolarHBondContact CG-O 3.5Å; F341-V390 HydrophobicContact CD1-CB 4.06Å; F341-V390 HydrophobicContact CD1-CG1 4.41Å; F341-V390 HydrophobicContact CD2-CB 4.47Å; F341-V390 HydrophobicContact CE1-CB 3.75Å; F341-V390 HydrophobicContact CE1-CG1 3.99Å; F341-V390 HydrophobicContact CE1-CG2 3.85Å; F341-V390 HydrophobicContact CE2-CB 4.22Å; F341-V390 HydrophobicContact CE2-CG2 3.83Å; F341-V390 HydrophobicContact CG-CB 4.4Å; F341-V390 HydrophobicContact CZ-CB 3.86Å; F341-V390 HydrophobicContact CZ-CG1 4.45Å; F341-V390 HydrophobicContact CZ-CG2 3.46Å; F341-V390 VanDerWaalsContact CZ-CG2 3.46Å; F341-V390 PolarHBondContact N-O 3.18Å; F341-V390 VanDerWaalsContact N-O 3.13Å; F341-V390 PolarHBondContact O-N 3.47Å; L388-V390 HydrophobicContact CD2-CG2 4.38Å; L388-V390 HydrophobicContact CG-CG2 4.18Å; V390-T395 HydrophobicContact CG2-CG2 4.3Å; V390-M426 HydrophobicContact CG2-CE 4.04Å; V390-M426 HydrophobicContact CG2-SD 4.06Å
391	S	94	Very high	75	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.07	21%	0.214	C	C	.	.			trans	-135.2	-179.2	-177.8	71.7	0	0	0	0	112	W242 E393 G394	W242-S391 PolarHBondContact NE1-O 3.13Å; S391-E393 PolarHBondContact O-N 3.45Å; S391-G394 PolarHBondContact N-O 3.35Å; S391-G394 PolarHBondContact O-N 3.23Å; S391-G394 PolarHBondContact OG-O 3.34Å
392	E	93.3	Very high	72.6	Confident	20 Å²	20	32.5 Å²	32.5	9%	0.093	22%	0.223	C	C	.	.	S	Bend	trans	-62.8	-32.1	-177.8	-62.6	86.8	160.7	0	0	111.9	P245 F246 P248 M269 K340	P245-E392 CarbonylContact C-O 3.34Å; P245-E392 WeakPolarHBondContact CA-O 3.45Å; P245-E392 WeakPolarHBondContact CB-O 3.41Å; F246-E392 HydrophobicContact CB-CB 3.96Å; F246-E392 HydrophobicContact CB-CG 4.23Å; F246-E392 PolarHBondContact N-O 2.9Å; P248-E392 HydrophobicContact CB-CG 4.42Å; P248-E392 HydrophobicContact CG-CB 4.18Å; P248-E392 HydrophobicContact CG-CG 4.21Å; M269-E392 HydrophobicContact CG-CG 4.06Å; M269-E392 VanDerWaalsContact SD-CA 3.54Å; M269-E392 HydrophobicContact SD-CB 4.21Å; M269-E392 HydrophobicContact SD-CG 3.75Å; M269-E392 PolarHBondContact SD-N 2.87Å; K340-E392 WeakPolarHBondContact CE-OE2 3.24Å; K340-E392 VanDerWaalsContact NZ-CD 3.29Å; K340-E392 IonicContact NZ-OE1 2.99Å; K340-E392 PolarHBondContact NZ-OE1 3.05Å; K340-E392 IonicContact NZ-OE2 3.79Å; K340-E392 PolarHBondContact NZ-OE2 3.05Å
393	E	87.8	Confident	70.1	Confident	20 Å²	20	38.9 Å²	38.9	9%	0.093	26%	0.262	C	S	.	.	S	Bend	trans	-89.4	-23.7	-176.4	-72	167.9	-164.9	0	0	114.2	K241 W242 S391 S398 A399 A400	K241-E393 CarbonylContact C-O 3.57Å; K241-E393 VanDerWaalsContact CA-O 3.29Å; K241-E393 WeakPolarHBondContact CA-O 3.18Å; W242-E393 PolarHBondContact N-O 3.03Å; S391-E393 PolarHBondContact O-N 3.45Å; E393-S398 VanDerWaalsContact OE1-O 3.1Å; E393-S398 WeakPolarHBondContact OE2-CA 3.35Å; E393-S398 PolarHBondContact OE2-N 3.09Å; E393-A399 WeakPolarHBondContact OE1-CA 3.5Å; E393-A399 PolarHBondContact OE1-N 2.66Å; E393-A400 HydrophobicContact CG-CB 4.27Å; E393-A400 PolarHBondContact OE1-N 3.29Å
394	G	86.6	Confident	67.8	Low	0 Å²	0	45.2 Å²	45.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.1	-158.6	-167.6	0	0	0	0	0	112.6	A240 W242 S391	A240-G394 CarbonylContact O-C 3.59Å; A240-G394 VanDerWaalsContact O-CA 3.31Å; A240-G394 WeakPolarHBondContact O-CA 3.39Å; W242-G394 VanDerWaalsContact NE1-CA 3.27Å; S391-G394 PolarHBondContact N-O 3.35Å; S391-G394 PolarHBondContact O-N 3.23Å; S391-G394 PolarHBondContact OG-O 3.34Å
395	T	79.6	Confident	65.7	Low	0 Å²	0	52.2 Å²	52.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.1	163.5	49	0	0	0	0	110.1	F238 K239 A240 Y293 L388 D389 V390	F238-T395 HydrophobicContact CD1-CG2 4.31Å; F238-T395 VanDerWaalsContact CD1-OG1 3.23Å; F238-T395 WeakPolarHBondContact CD1-OG1 3.28Å; F238-T395 HydrophobicContact CE1-CG2 4.13Å; F238-T395 WeakPolarHBondContact CE1-OG1 3.49Å; K239-T395 CarbonylContact C-O 3.52Å; K239-T395 VanDerWaalsContact CA-O 3.3Å; K239-T395 WeakPolarHBondContact CA-O 2.9Å; A240-T395 PolarHBondContact N-O 3.36Å; A240-T395 PolarHBondContact N-OG1 3.03Å; A240-T395 VanDerWaalsContact N-OG1 3.16Å; A240-T395 PolarHBondContact O-N 3.14Å; A240-T395 PolarHBondContact O-OG1 3.5Å; Y293-T395 HydrophobicContact CE1-CG2 3.86Å; Y293-T395 WeakPolarHBondContact CE1-OG1 3.34Å; Y293-T395 WeakPolarHBondContact OH-CG2 3.16Å; L388-T395 HydrophobicContact CD1-CG2 3.68Å; D389-T395 WeakPolarHBondContact O-CA 3.39Å; V390-T395 HydrophobicContact CG2-CG2 4.3Å
396	E	67.1	Low	63.7	Low	18 Å²	18	55.4 Å²	55.4	8%	0.084	35%	0.347	C	S	.	.	S	Bend	trans	73.4	135	-169.2	-147.6	-151.8	174.6	0	0	117.9	K216 F237 K239 D389	K216-E396 WeakPolarHBondContact CE-OE1 3.3Å; K216-E396 IonicContact NZ-OE1 2.63Å; K216-E396 PolarHBondContact NZ-OE1 2.92Å; F237-E396 VanDerWaalsContact CZ-OE2 3.25Å; F237-E396 WeakPolarHBondContact CZ-OE2 3.39Å; K239-E396 HydrophobicContact CB-CB 3.99Å; K239-E396 WeakPolarHBondContact CB-OE2 3.21Å; K239-E396 HydrophobicContact CD-CB 4.4Å; K239-E396 WeakPolarHBondContact CD-OE2 3.42Å; K239-E396 WeakPolarHBondContact CE-OE2 3.36Å; K239-E396 HydrophobicContact CG-CB 3.92Å; K239-E396 WeakPolarHBondContact CG-OE2 3.38Å; K239-E396 VanDerWaalsContact NZ-CD 3.35Å; K239-E396 IonicContact NZ-OE1 3.42Å; K239-E396 IonicContact NZ-OE2 3.56Å; K239-E396 PolarHBondContact NZ-OE2 3.4Å; D389-E396 PolarHBondContact O-N 3.13Å
397	A	37.2	Very low	62	Low	71 Å²	71	59.8 Å²	59.8	59%	0.587	37%	0.369	S	S	*	.			trans	-90.3	142.7	-160.6	0	0	0	0	0	116.9
398	S	37.3	Very low	60.2	Low	79 Å²	79	66.2 Å²	66.2	55%	0.552	40%	0.402	S	S	*	.			trans	-170	109.3	150.2	172.7	0	0	0	0	111.8	E393 A400	E393-S398 VanDerWaalsContact OE1-O 3.1Å; E393-S398 WeakPolarHBondContact OE2-CA 3.35Å; E393-S398 PolarHBondContact OE2-N 3.09Å; S398-A400 PolarHBondContact O-N 2.73Å
399	A	32.6	Very low	58.7	Low	101 Å²	101	70.3 Å²	70.3	84%	0.835	43%	0.431	S	S	*	.			trans	-18.6	112.9	-178.6	0	0	0	0	0	116.5	E393	E393-A399 WeakPolarHBondContact OE1-CA 3.5Å; E393-A399 PolarHBondContact OE1-N 2.66Å
400	A	34.6	Very low	56.8	Low	49 Å²	49	71.1 Å²	71.1	41%	0.405	45%	0.452	S	S	.	.			trans	-135.3	136.9	172	0	0	0	0	0	112.4	E393 S398	E393-A400 HydrophobicContact CG-CB 4.27Å; E393-A400 PolarHBondContact OE1-N 3.29Å; S398-A400 PolarHBondContact O-N 2.73Å
401	T	37.3	Very low	54.9	Low	145 Å²	145	77.1 Å²	77.1	89%	0.89	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-79.7	117.6	-179.5	-23.8	0	0	0	0	110.1
402	G	40.8	Very low	53	Low	32 Å²	32	83.8 Å²	83.8	33%	0.33	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-75.2	149.8	175.1	0	0	0	0	0	112.8
403	V	39.7	Very low	51.4	Low	137 Å²	137	88.8 Å²	88.8	83%	0.83	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-101	119.6	172	177.3	0	0	0	0	108.8
404	K	42.1	Very low	50.7	Low	139 Å²	139	93.1 Å²	93.1	60%	0.604	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-84.5	118.8	-179.3	-170.8	170.3	-174.8	159.9	0	110.8
405	I	46.7	Very low	50.6	Low	147 Å²	147	101 Å²	101	75%	0.754	61%	0.61	S	S	*	*			trans	-101.2	113.5	167.4	-58.5	177.7	0	0	0	107.1
406	T	45.3	Very low	51.2	Low	94 Å²	94	103.5 Å²	103.5	58%	0.577	62%	0.623	S	S	*	*			trans	-102.6	120.3	174.2	-55.3	0	0	0	0	108.4
407	L	49.4	Very low	52.5	Low	91 Å²	91	105.7 Å²	105.7	48%	0.476	64%	0.638	S	S	.	*			trans	-80.1	137.4	173.4	-63.9	174.5	0	0	0	109.6	F411	L407-F411 HydrophobicContact CD1-CE2 4.19Å
408	L	45	Very low	55.4	Low	174 Å²	174	102.6 Å²	102.6	91%	0.911	61%	0.612	S	S	*	*			trans	-98.8	6.4	-174.1	-64.9	171.6	0	0	0	113.8
409	S	53.2	Low	58.3	Low	89 Å²	89	103.2 Å²	103.2	62%	0.622	60%	0.602	S	S	*	*	S	Bend	trans	-128.9	133.9	-179.3	57.9	0	0	0	0	111.4
410	G	49.5	Very low	61.4	Low	75 Å²	75	98.4 Å²	98.4	77%	0.773	56%	0.562	S	S	*	*			trans	-77.8	130.9	179.7	0	0	0	0	0	112.8
411	F	53.4	Low	64.4	Low	128 Å²	128	98 Å²	98	56%	0.561	55%	0.553	S	S	*	*			trans	-77.3	141.3	166.1	-74.7	-90.7	0	0	0	109.7	L407	L407-F411 HydrophobicContact CD1-CE2 4.19Å
412	V	54.1	Low	67.2	Low	150 Å²	150	93.3 Å²	93.3	91%	0.909	52%	0.519	S	S	*	.			trans	-96.5	4.7	-174	-174.1	0	0	0	0	112.1
413	D	59.8	Low	69.9	Low	126 Å²	126	93.1 Å²	93.1	67%	0.674	51%	0.512	S	S	*	.	S	Bend	trans	-80.4	158.3	178.2	-79.3	-31.2	0	0	0	112.6	K415	D413-K415 PolarHBondContact O-N 3.42Å
414	P	73.6	Confident	72.6	Confident	111 Å²	111	86.6 Å²	86.6	72%	0.721	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-57.5	129.4	174.3	23.7	-33.3	0	0	0	110.2	I416	P414-I416 PolarHBondContact O-N 2.73Å
415	K	84.3	Confident	75.3	Confident	164 Å²	164	80 Å²	80	71%	0.713	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-59.1	121	-177.9	-67.8	-173.2	175.5	-170.7	0	111.1	D334 D413	D334-K415 HydrophobicContact CB-CB 4.48Å; D334-K415 WeakPolarHBondContact OD2-CA 3.35Å; D413-K415 PolarHBondContact O-N 3.42Å
416	I	91.8	Very high	77.7	Confident	54 Å²	54	73.1 Å²	73.1	28%	0.277	41%	0.408	S	S	.	.			trans	-92	114	175.1	-58.8	-177.8	0	0	0	107.9	Y278 I333 D334 E335 P414 V418	Y278-I416 HydrophobicContact CE2-CG2 4.34Å; I333-I416 HydrophobicContact CG1-CG2 4.28Å; I333-I416 HydrophobicContact CG2-CG2 4.34Å; I333-I416 WeakPolarHBondContact CG2-O 3.45Å; D334-I416 PolarHBondContact N-O 2.84Å; D334-I416 PolarHBondContact OD2-N 2.69Å; E335-I416 PolarHBondContact N-O 3.06Å; P414-I416 PolarHBondContact O-N 2.73Å; I416-V418 HydrophobicContact CG2-CG2 4.28Å
417	T	95.6	Very high	80.2	Confident	63 Å²	63	68.7 Å²	68.7	39%	0.387	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.2	175.9	-63.8	0	0	0	0	109.9	E335 Y337 R419	E335-T417 HydrophobicContact CB-CG2 4.13Å; E335-T417 CarbonylContact O-C 3.37Å; E335-T417 WeakPolarHBondContact O-CA 3.32Å; Y337-T417 HydrophobicContact CE2-CG2 4.25Å; T417-R419 HydrophobicContact CG2-CG 4Å
418	V	97.6	Very high	82.4	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.042	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.1	177.9	-175	0	0	0	0	109.1	Y278 T287 V289 L303 I333 E335 L336 Y337 I416 F420	Y278-V418 HydrophobicContact CD2-CG2 4.43Å; Y278-V418 HydrophobicContact CE2-CG2 3.86Å; T287-V418 HydrophobicContact CG2-CG1 4.38Å; T287-V418 HydrophobicContact CG2-CG2 4.4Å; V289-V418 HydrophobicContact CG2-CG1 4.1Å; V289-V418 HydrophobicContact CG2-CG2 4.5Å; L303-V418 HydrophobicContact CD2-CG1 4.13Å; I333-V418 HydrophobicContact CD1-CG2 4.38Å; I333-V418 HydrophobicContact CG2-CG2 4.22Å; E335-V418 PolarHBondContact O-N 2.9Å; L336-V418 CarbonylContact C-O 3.59Å; L336-V418 WeakPolarHBondContact CA-O 3.38Å; L336-V418 HydrophobicContact CD1-CB 3.86Å; L336-V418 HydrophobicContact CD1-CG1 4.04Å; Y337-V418 PolarHBondContact N-O 2.86Å; I416-V418 HydrophobicContact CG2-CG2 4.28Å; V418-F420 HydrophobicContact CG1-CD2 4.16Å; V418-F420 HydrophobicContact CG1-CE2 3.62Å; V418-F420 HydrophobicContact CG1-CZ 4.18Å
419	R	97.9	Very high	84.7	Confident	91 Å²	91	56.1 Å²	56.1	34%	0.343	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	108.6	-178.4	-70.4	175.5	-173.1	-91.3	0.3	110.2	L303 E335 Y337 T417 N421	L303-R419 WeakPolarHBondContact CD2-O 3.22Å; E335-R419 IonicContact OE2-CZ 3.25Å; E335-R419 IonicContact OE2-NH2 3.79Å; E335-R419 PolarHBondContact OE2-NH2 2.94Å; Y337-R419 HydrophobicContact CD2-CG 3.43Å; Y337-R419 VanDerWaalsContact CD2-CG 3.43Å; Y337-R419 HydrophobicContact CE2-CG 4.08Å; Y337-R419 HydrophobicContact CG-CG 4.03Å; Y337-R419 VanDerWaalsContact CZ-CZ 3.46Å; Y337-R419 VanDerWaalsContact CZ-NH2 3.31Å; Y337-R419 PolarHBondContact OH-NH2 2.9Å; T417-R419 HydrophobicContact CG2-CG 4Å; R419-N421 HydrophobicContact CB-CB 4.47Å; R419-N421 PolarHBondContact O-N 3.44Å; R419-N421 PolarHBondContact O-OD1 3.39Å
420	F	98.1	Very high	86.4	Confident	1 Å²	1	52 Å²	52	0%	0.004	29%	0.287	C	S	.	.			trans	-77.8	60.7	170.8	-69.9	-88.2	0	0	0	110.6	F256 V289 F301 L303 L336 Y337 L338 P339 V418 F424	F256-F420 WeakPolarHBondContact CD2-O 3.47Å; F256-F420 VanDerWaalsContact CE2-O 3.3Å; F256-F420 WeakPolarHBondContact CE2-O 3.4Å; V289-F420 HydrophobicContact CB-CZ 4.33Å; V289-F420 HydrophobicContact CG2-CE2 4.31Å; V289-F420 HydrophobicContact CG2-CZ 4.22Å; F301-F420 HydrophobicContact CB-CD1 4.37Å; F301-F420 HydrophobicContact CB-CE1 3.44Å; F301-F420 VanDerWaalsContact CB-CE1 3.44Å; F301-F420 HydrophobicContact CB-CE2 4.12Å; F301-F420 HydrophobicContact CB-CZ 3.29Å; F301-F420 HydrophobicContact CG-CE1 4.37Å; F301-F420 HydrophobicContact CG-CZ 4.25Å; L303-F420 HydrophobicContact CB-CD1 4.08Å; L303-F420 HydrophobicContact CB-CE1 3.57Å; L303-F420 HydrophobicContact CB-CZ 4.12Å; L303-F420 HydrophobicContact CD1-CD1 3.96Å; L303-F420 HydrophobicContact CD1-CE1 4.34Å; L303-F420 HydrophobicContact CD2-CD1 4.46Å; L303-F420 HydrophobicContact CD2-CE1 4.48Å; L303-F420 HydrophobicContact CG-CD1 4.38Å; L303-F420 HydrophobicContact CG-CE1 4.33Å; L336-F420 HydrophobicContact CD1-CD2 4.17Å; L336-F420 HydrophobicContact CD1-CE2 3.85Å; Y337-F420 WeakPolarHBondContact O-CB 3.37Å; Y337-F420 WeakPolarHBondContact O-CD2 3.27Å; Y337-F420 PolarHBondContact O-N 3.01Å; L338-F420 HydrophobicContact CD1-CB 4Å; L338-F420 HydrophobicContact CD1-CD2 3.94Å; L338-F420 HydrophobicContact CD1-CG 3.9Å; P339-F420 VanDerWaalsContact CD-O 3.31Å; P339-F420 WeakPolarHBondContact CD-O 3.35Å; V418-F420 HydrophobicContact CG1-CD2 4.16Å; V418-F420 HydrophobicContact CG1-CE2 3.62Å; V418-F420 HydrophobicContact CG1-CZ 4.18Å; F420-F424 HydrophobicContact CB-CD1 4.22Å; F420-F424 HydrophobicContact CB-CE1 4.34Å; F420-F424 HydrophobicContact CD1-CB 3.76Å; F420-F424 HydrophobicContact CD1-CD1 4.1Å; F420-F424 AromaticContact CD1-CD2 3.92Å; F420-F424 HydrophobicContact CD1-CD2 3.92Å; F420-F424 AromaticContact CD1-CG 3.67Å; F420-F424 HydrophobicContact CD1-CG 3.67Å; F420-F424 HydrophobicContact CE1-CB 4.22Å; F420-F424 HydrophobicContact CE1-CD2 4.41Å; F420-F424 HydrophobicContact CE1-CG 4.4Å
421	N	96.9	Very high	88	Confident	39 Å²	39	51.9 Å²	51.9	21%	0.209	27%	0.267	C	S	.	.			trans	-108.4	19	-177	72.4	-16.2	0	0	0	113.3	F256 Y257 M268 R419	F256-N421 CarbonylContact C-O 3.53Å; F256-N421 WeakPolarHBondContact CA-O 3.46Å; Y257-N421 WeakPolarHBondContact CD2-O 3.43Å; Y257-N421 PolarHBondContact N-O 3.2Å; M268-N421 HydrophobicContact CE-CB 4.18Å; R419-N421 HydrophobicContact CB-CB 4.47Å; R419-N421 PolarHBondContact O-N 3.44Å; R419-N421 PolarHBondContact O-OD1 3.39Å
422	R	96.4	Very high	89.2	Confident	48 Å²	48	50.6 Å²	50.6	18%	0.181	27%	0.266	C	S	.	.	S	Bend	trans	-150.4	168.5	177.5	67	178.4	179.9	-84.9	8.7	108.9	F256 Y257 L303 P304 F424	F256-R422 WeakPolarHBondContact CZ-O 3.43Å; Y257-R422 WeakPolarHBondContact O-CA 3.5Å; L303-R422 HydrophobicContact CD1-CG 3.77Å; P304-R422 PolarHBondContact O-NE 2.95Å; P304-R422 PolarHBondContact O-NH2 3.2Å; R422-F424 WeakPolarHBondContact O-CD1 3.42Å; R422-F424 PolarHBondContact O-N 2.9Å
423	P	96.8	Very high	90.3	Very high	28 Å²	28	44.4 Å²	44.4	18%	0.182	23%	0.228	C	C	.	.			trans	-50.9	134.4	-176.9	-30.2	36.8	0	0	0	113	Y257 M309 V442	Y257-P423 VanDerWaalsContact O-CD 3.27Å; Y257-P423 WeakPolarHBondContact O-CD 3.47Å; M309-P423 HydrophobicContact CE-CB 3.59Å; M309-P423 VanDerWaalsContact CE-O 3.28Å; M309-P423 WeakPolarHBondContact CE-O 3.43Å; P423-V442 VanDerWaalsContact CA-O 3.23Å; P423-V442 WeakPolarHBondContact CA-O 3.48Å
424	F	97.8	Very high	91.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	162.8	-175.9	66.6	-90.6	0	0	0	110	F256 F301 I302 L303 P339 F341 F420 R422 M426 V442	F256-F424 HydrophobicContact CE2-CD1 4.01Å; F256-F424 AromaticContact CE2-CE1 3.82Å; F256-F424 HydrophobicContact CE2-CE1 3.82Å; F256-F424 HydrophobicContact CZ-CD1 4.12Å; F256-F424 HydrophobicContact CZ-CE1 4.16Å; F301-F424 HydrophobicContact CD1-CD2 4.19Å; F301-F424 AromaticContact CD1-CE2 3.9Å; F301-F424 HydrophobicContact CD1-CE2 3.9Å; F301-F424 HydrophobicContact CE1-CE2 4.21Å; I302-F424 WeakPolarHBondContact O-CA 3.42Å; I302-F424 WeakPolarHBondContact O-CB 3.45Å; L303-F424 HydrophobicContact CD1-CB 4.06Å; P339-F424 HydrophobicContact CG-CE1 3.81Å; P339-F424 HydrophobicContact CG-CZ 4.04Å; F341-F424 HydrophobicContact CD1-CZ 4.45Å; F341-F424 HydrophobicContact CE1-CE2 4.33Å; F341-F424 AromaticContact CE1-CZ 3.73Å; F341-F424 HydrophobicContact CE1-CZ 3.73Å; F341-F424 HydrophobicContact CZ-CE2 4.42Å; F341-F424 HydrophobicContact CZ-CZ 4.16Å; F420-F424 HydrophobicContact CB-CD1 4.22Å; F420-F424 HydrophobicContact CB-CE1 4.34Å; F420-F424 HydrophobicContact CD1-CB 3.76Å; F420-F424 HydrophobicContact CD1-CD1 4.1Å; F420-F424 AromaticContact CD1-CD2 3.92Å; F420-F424 HydrophobicContact CD1-CD2 3.92Å; F420-F424 AromaticContact CD1-CG 3.67Å; F420-F424 HydrophobicContact CD1-CG 3.67Å; F420-F424 HydrophobicContact CE1-CB 4.22Å; F420-F424 HydrophobicContact CE1-CD2 4.41Å; F420-F424 HydrophobicContact CE1-CG 4.4Å; R422-F424 WeakPolarHBondContact O-CD1 3.42Å; R422-F424 PolarHBondContact O-N 2.9Å; F424-M426 HydrophobicContact CE2-CB 4.48Å; F424-V442 HydrophobicContact CD1-CB 4.13Å; F424-V442 HydrophobicContact CD2-CB 4.44Å; F424-V442 HydrophobicContact CD2-CG2 4.49Å; F424-V442 HydrophobicContact CE1-CB 3.68Å; F424-V442 HydrophobicContact CE1-CG1 3.73Å; F424-V442 HydrophobicContact CE1-CG2 4.26Å; F424-V442 HydrophobicContact CE2-CB 4.01Å; F424-V442 HydrophobicContact CE2-CG2 3.79Å; F424-V442 HydrophobicContact CG-CB 4.49Å; F424-V442 HydrophobicContact CZ-CB 3.61Å; F424-V442 HydrophobicContact CZ-CG1 3.85Å; F424-V442 HydrophobicContact CZ-CG2 3.67Å; F424-V442 PolarHBondContact N-O 2.86Å; F424-V442 PolarHBondContact O-N 3.44Å
425	L	98.2	Very high	91.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	149.8	173	-48.4	176.3	0	0	0	110	Y86 F301 I302 M309 V312 L316 S440 K441	Y86-L425 HydrophobicContact CE2-CD2 4.45Å; Y86-L425 WeakPolarHBondContact OH-CD2 3.27Å; F301-L425 WeakPolarHBondContact CA-O 3.35Å; I302-L425 HydrophobicContact CB-CB 4.15Å; I302-L425 HydrophobicContact CD1-CB 4.18Å; I302-L425 PolarHBondContact N-O 2.87Å; I302-L425 PolarHBondContact O-N 2.81Å; M309-L425 HydrophobicContact CE-CD2 4.38Å; M309-L425 HydrophobicContact SD-CD2 3.9Å; M309-L425 HydrophobicContact SD-CG 4.18Å; V312-L425 HydrophobicContact CG1-CD1 4.1Å; L316-L425 HydrophobicContact CD1-CD1 3.95Å; L316-L425 HydrophobicContact CD2-CD1 4.21Å; L316-L425 HydrophobicContact CG-CD1 4.5Å; L425-S440 CarbonylContact C-O 3.51Å; L425-S440 VanDerWaalsContact CA-O 3.25Å; L425-S440 WeakPolarHBondContact CA-O 3.24Å; L425-K441 HydrophobicContact CD2-CB 3.84Å; L425-K441 HydrophobicContact CD2-CG 3.83Å
426	M	97.6	Very high	92.3	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.6	172.7	-178	-179.2	174.7	0	0	108.8	W242 A299 L300 F301 F341 L388 V390 F424 I428 I439 S440	W242-M426 HydrophobicContact CH2-CE 4.36Å; A299-M426 HydrophobicContact CB-CE 3.68Å; L300-M426 CarbonylContact O-C 3.52Å; L300-M426 VanDerWaalsContact O-CA 3.32Å; L300-M426 WeakPolarHBondContact O-CA 3.46Å; F301-M426 HydrophobicContact CD1-CB 4.24Å; F301-M426 HydrophobicContact CD1-CG 4.07Å; F301-M426 HydrophobicContact CD1-SD 4.36Å; F301-M426 HydrophobicContact CE1-CB 4.29Å; F301-M426 HydrophobicContact CE1-CE 4.11Å; F301-M426 HydrophobicContact CE1-CG 3.78Å; F301-M426 HydrophobicContact CE1-SD 3.52Å; F301-M426 VanDerWaalsContact CE1-SD 3.52Å; F301-M426 HydrophobicContact CZ-CE 3.78Å; F301-M426 HydrophobicContact CZ-CG 4.23Å; F301-M426 HydrophobicContact CZ-SD 3.85Å; F341-M426 HydrophobicContact CZ-SD 4.12Å; L388-M426 HydrophobicContact CD2-CE 4.11Å; L388-M426 HydrophobicContact CD2-SD 3.72Å; V390-M426 HydrophobicContact CG2-CE 4.04Å; V390-M426 HydrophobicContact CG2-SD 4.06Å; F424-M426 HydrophobicContact CE2-CB 4.48Å; M426-I428 HydrophobicContact CE-CD1 3.81Å; M426-I428 HydrophobicContact CE-CG1 3.82Å; M426-I439 CarbonylContact O-C 3.59Å; M426-I439 WeakPolarHBondContact O-CA 3.46Å; M426-S440 PolarHBondContact N-O 3.22Å; M426-S440 PolarHBondContact O-N 2.7Å
427	I	97.6	Very high	92.3	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.6	176.3	-54.2	179.2	0	0	0	107.8	F83 A299 L300 I302 L321 V429 I436 F438 I439	F83-I427 HydrophobicContact CE1-CD1 4.18Å; F83-I427 HydrophobicContact CZ-CD1 4.42Å; A299-I427 CarbonylContact C-O 3.52Å; A299-I427 WeakPolarHBondContact CA-O 3.08Å; L300-I427 HydrophobicContact CB-CB 4.39Å; L300-I427 PolarHBondContact N-O 2.95Å; L300-I427 PolarHBondContact O-N 2.77Å; I302-I427 HydrophobicContact CD1-CD1 3.97Å; I302-I427 HydrophobicContact CD1-CG1 3.95Å; L321-I427 HydrophobicContact CD1-CD1 4.4Å; I427-V429 HydrophobicContact CG2-CG1 3.74Å; I427-I436 HydrophobicContact CG2-CD1 4.32Å; I427-I436 HydrophobicContact CG2-CG1 4.19Å; I427-I436 HydrophobicContact CG2-CG2 3.63Å; I427-F438 CarbonylContact C-O 3.46Å; I427-F438 VanDerWaalsContact CA-O 3.32Å; I427-F438 WeakPolarHBondContact CA-O 3.47Å; I427-I439 HydrophobicContact CG2-CG1 4.49Å
428	I	95.6	Very high	92.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.5	174.2	-57	179.7	0	0	0	108.3	F238 Y293 S298 A299 L388 M426 F437 F438	F238-I428 HydrophobicContact CD1-CD1 4.05Å; F238-I428 HydrophobicContact CE1-CD1 3.89Å; F238-I428 HydrophobicContact CE1-CG2 4.09Å; F238-I428 HydrophobicContact CE2-CG2 3.95Å; F238-I428 HydrophobicContact CZ-CG2 3.68Å; Y293-I428 HydrophobicContact CE2-CG2 4.23Å; S298-I428 WeakPolarHBondContact O-CA 3.33Å; A299-I428 HydrophobicContact CB-CG1 4.43Å; L388-I428 HydrophobicContact CD1-CD1 3.7Å; M426-I428 HydrophobicContact CE-CD1 3.81Å; M426-I428 HydrophobicContact CE-CG1 3.82Å; I428-F437 HydrophobicContact CB-CB 4.32Å; I428-F437 HydrophobicContact CG2-CB 4.12Å; I428-F437 HydrophobicContact CG2-CD2 4.09Å; I428-F437 PolarHBondContact O-N 2.89Å; I428-F438 HydrophobicContact CB-CB 4.16Å; I428-F438 HydrophobicContact CB-CD2 4.38Å; I428-F438 HydrophobicContact CD1-CB 4.16Å; I428-F438 HydrophobicContact CD1-CD2 4.08Å; I428-F438 HydrophobicContact CD1-CG 4.38Å; I428-F438 HydrophobicContact CG1-CB 4.22Å; I428-F438 PolarHBondContact N-O 3.31Å; I428-F438 PolarHBondContact O-N 2.86Å
429	V	92.8	Very high	92.3	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.7	-178.2	-60.4	0	0	0	0	110.8	A297 S298 I427 I436	A297-V429 CarbonylContact C-O 3.58Å; A297-V429 VanDerWaalsContact CA-O 3.28Å; A297-V429 WeakPolarHBondContact CA-O 3.32Å; S298-V429 PolarHBondContact N-O 2.85Å; S298-V429 PolarHBondContact O-N 2.84Å; I427-V429 HydrophobicContact CG2-CG1 3.74Å; V429-I436 HydrophobicContact CG1-CG1 4.29Å
430	P	89.2	Confident	92.2	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.013	9%	0.093	C	C	.	.			trans	-62.6	152.1	159.1	28.7	-33.5	0	0	0	110.8	N296 D432 T433 N435 F437	N296-P430 WeakPolarHBondContact O-CA 3.17Å; P430-D432 WeakPolarHBondContact CB-OD1 3.3Å; P430-T433 WeakPolarHBondContact CG-OG1 3.27Å; P430-N435 VanDerWaalsContact CD-O 3.27Å; P430-N435 WeakPolarHBondContact CD-O 3.48Å; P430-N435 HydrophobicContact CG-CB 4.28Å; P430-F437 HydrophobicContact CB-CE1 4.42Å; P430-F437 HydrophobicContact CB-CE2 3.95Å; P430-F437 HydrophobicContact CB-CZ 3.69Å; P430-F437 HydrophobicContact CG-CE1 4.11Å; P430-F437 HydrophobicContact CG-CE2 4.3Å; P430-F437 HydrophobicContact CG-CZ 3.86Å
431	M	82.9	Confident	92.1	Very high	73 Å²	73	18.8 Å²	18.8	36%	0.36	10%	0.095	S	C	.	.	S	Bend	trans	-81.9	-28.1	-178.4	-56.9	-169.9	-168.6	0	0	112.8	K292 N296 A297	K292-M431 HydrophobicContact CB-CE 3.76Å; K292-M431 HydrophobicContact CD-CE 3.94Å; K292-M431 HydrophobicContact CD-SD 4.43Å; K292-M431 HydrophobicContact CG-CE 3.82Å; N296-M431 VanDerWaalsContact OD1-CB 3.28Å; N296-M431 WeakPolarHBondContact OD1-CB 3.26Å; N296-M431 PolarHBondContact OD1-N 2.69Å; N296-M431 VanDerWaalsContact OD1-N 3.1Å; A297-M431 WeakPolarHBondContact O-CE 3.22Å
432	D	79.1	Confident	92	Very high	100 Å²	100	17 Å²	17	54%	0.535	9%	0.085	S	C	.	.	S	Bend	trans	-87.6	-27.3	-176.9	60.4	-15.4	0	0	0	114.2	N296 P430	N296-D432 PolarHBondContact ND2-OD1 2.78Å; N296-D432 PolarHBondContact ND2-OD2 3.29Å; N296-D432 PolarHBondContact OD1-N 2.84Å; P430-D432 WeakPolarHBondContact CB-OD1 3.3Å
433	T	76.6	Confident	91.9	Very high	21 Å²	21	15.5 Å²	15.5	13%	0.129	8%	0.081	C	C	.	.	S	Bend	trans	-115.6	168.4	178.5	73.3	0	0	0	0	112.4	K325 P430 N435	K325-T433 PolarHBondContact NZ-O 3.19Å; P430-T433 WeakPolarHBondContact CG-OG1 3.27Å; T433-N435 PolarHBondContact OG1-ND2 3.37Å
434	Q	78.4	Confident	91.7	Very high	54 Å²	54	15.7 Å²	15.7	25%	0.252	8%	0.08	S	C	.	.	S	Bend	trans	-93.3	7.9	175.1	-66.2	-172	-35.2	0	0	113.1	A75 V79	A75-Q434 HydrophobicContact CB-CB 3.76Å; V79-Q434 WeakPolarHBondContact CG2-O 3.33Å
435	N	87.8	Confident	91.4	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.083	C	C	.	.			trans	-65.6	165.4	177.5	-69.4	-71.2	0	0	0	111.7	N78 L103 L147 P430 T433	N78-N435 PolarHBondContact ND2-OD1 2.83Å; L103-N435 HydrophobicContact CD1-CB 4.19Å; L103-N435 HydrophobicContact CD2-CB 4.31Å; L147-N435 WeakPolarHBondContact CD1-ND2 3.35Å; P430-N435 VanDerWaalsContact CD-O 3.27Å; P430-N435 WeakPolarHBondContact CD-O 3.48Å; P430-N435 HydrophobicContact CG-CB 4.28Å; T433-N435 PolarHBondContact OG1-ND2 3.37Å
436	I	93.8	Very high	90.9	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	11%	0.11	C	C	.	.			trans	-123.4	115.7	177.9	-60.1	172.9	0	0	0	109.1	V79 A82 F83 P102 L103 L321 I427 V429 F438 I439	V79-I436 HydrophobicContact CB-CD1 4.43Å; V79-I436 HydrophobicContact CG1-CD1 4.16Å; V79-I436 HydrophobicContact CG2-CD1 3.98Å; V79-I436 HydrophobicContact CG2-CG1 4.12Å; A82-I436 HydrophobicContact CB-CD1 4Å; F83-I436 HydrophobicContact CE1-CD1 4.26Å; F83-I436 HydrophobicContact CZ-CD1 4.14Å; P102-I436 HydrophobicContact CG-CB 4.24Å; P102-I436 HydrophobicContact CG-CG2 4Å; L103-I436 VanDerWaalsContact CB-O 3.31Å; L103-I436 WeakPolarHBondContact CB-O 3.31Å; L321-I436 HydrophobicContact CD2-CD1 3.83Å; L321-I436 HydrophobicContact CD2-CG1 4.08Å; I427-I436 HydrophobicContact CG2-CD1 4.32Å; I427-I436 HydrophobicContact CG2-CG1 4.19Å; I427-I436 HydrophobicContact CG2-CG2 3.63Å; V429-I436 HydrophobicContact CG1-CG1 4.29Å; I436-F438 WeakPolarHBondContact CG2-O 3.5Å; I436-I439 HydrophobicContact CD1-CD1 4.08Å; I436-I439 HydrophobicContact CG2-CD1 4.18Å; I436-I439 HydrophobicContact CG2-CG1 3.54Å
437	F	92.8	Very high	90.1	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.018	12%	0.119	C	C	.	.	S	Bend	trans	-72.1	-46	174.4	-65.6	-26.7	0	0	0	111.5	S101 L103 L151 L160 F238 A297 I428 P430	S101-F437 VanDerWaalsContact CA-O 3.28Å; S101-F437 WeakPolarHBondContact CA-O 3.49Å; S101-F437 WeakPolarHBondContact CB-O 3.48Å; S101-F437 PolarHBondContact OG-O 3.11Å; L103-F437 HydrophobicContact CD2-CD1 3.72Å; L103-F437 HydrophobicContact CD2-CE1 3.83Å; L151-F437 HydrophobicContact CD2-CE1 3.53Å; L151-F437 HydrophobicContact CD2-CZ 3.66Å; L160-F437 HydrophobicContact CD2-CD1 4.34Å; L160-F437 HydrophobicContact CD2-CE1 3.93Å; L160-F437 HydrophobicContact CD2-CE2 4.47Å; L160-F437 HydrophobicContact CD2-CZ 3.99Å; F238-F437 HydrophobicContact CD2-CD2 4.37Å; F238-F437 HydrophobicContact CE2-CD2 4.06Å; A297-F437 HydrophobicContact CB-CE2 4.33Å; I428-F437 HydrophobicContact CB-CB 4.32Å; I428-F437 HydrophobicContact CG2-CB 4.12Å; I428-F437 HydrophobicContact CG2-CD2 4.09Å; I428-F437 PolarHBondContact O-N 2.89Å; P430-F437 HydrophobicContact CB-CE1 4.42Å; P430-F437 HydrophobicContact CB-CE2 3.95Å; P430-F437 HydrophobicContact CB-CZ 3.69Å; P430-F437 HydrophobicContact CG-CE1 4.11Å; P430-F437 HydrophobicContact CG-CE2 4.3Å; P430-F437 HydrophobicContact CG-CZ 3.86Å
438	F	94.9	Very high	88.3	Confident	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	144.9	179.4	-68.7	-92.6	0	0	0	111.2	I99 F100 I236 F238 A386 I427 I428 I436	I99-F438 HydrophobicContact CD1-CD1 4.24Å; I99-F438 HydrophobicContact CG1-CD1 4.29Å; F100-F438 WeakPolarHBondContact O-CA 3.22Å; I236-F438 HydrophobicContact CB-CZ 4.16Å; I236-F438 HydrophobicContact CD1-CE1 4.45Å; I236-F438 HydrophobicContact CD1-CE2 3.7Å; I236-F438 HydrophobicContact CD1-CZ 3.66Å; I236-F438 HydrophobicContact CG1-CE2 4.09Å; I236-F438 HydrophobicContact CG1-CZ 3.67Å; I236-F438 HydrophobicContact CG2-CE1 3.59Å; I236-F438 HydrophobicContact CG2-CZ 3.53Å; F238-F438 HydrophobicContact CB-CD2 4.31Å; F238-F438 HydrophobicContact CB-CE2 3.42Å; F238-F438 VanDerWaalsContact CB-CE2 3.42Å; F238-F438 HydrophobicContact CB-CZ 3.93Å; F238-F438 HydrophobicContact CG-CE2 4.07Å; A386-F438 HydrophobicContact CB-CD1 4.34Å; A386-F438 HydrophobicContact CB-CE1 3.97Å; I427-F438 CarbonylContact C-O 3.46Å; I427-F438 VanDerWaalsContact CA-O 3.32Å; I427-F438 WeakPolarHBondContact CA-O 3.47Å; I428-F438 HydrophobicContact CB-CB 4.16Å; I428-F438 HydrophobicContact CB-CD2 4.38Å; I428-F438 HydrophobicContact CD1-CB 4.16Å; I428-F438 HydrophobicContact CD1-CD2 4.08Å; I428-F438 HydrophobicContact CD1-CG 4.38Å; I428-F438 HydrophobicContact CG1-CB 4.22Å; I428-F438 PolarHBondContact N-O 3.31Å; I428-F438 PolarHBondContact O-N 2.86Å; I436-F438 WeakPolarHBondContact CG2-O 3.5Å
439	I	96.7	Very high	87.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.6	161.2	-58.3	-178	0	0	0	107.4	A82 F83 Y86 I99 F100 P102 M426 I427 I436	A82-I439 HydrophobicContact CB-CD1 3.82Å; F83-I439 HydrophobicContact CD1-CD1 3.95Å; F83-I439 HydrophobicContact CE1-CD1 3.91Å; Y86-I439 HydrophobicContact CD2-CG2 3.47Å; Y86-I439 VanDerWaalsContact CD2-CG2 3.47Å; Y86-I439 HydrophobicContact CE2-CG2 3.81Å; Y86-I439 HydrophobicContact CG-CG2 4.41Å; I99-I439 VanDerWaalsContact CA-O 3.31Å; I99-I439 WeakPolarHBondContact CA-O 3.46Å; F100-I439 HydrophobicContact CE1-CB 4.09Å; F100-I439 HydrophobicContact CE1-CG2 4.45Å; F100-I439 HydrophobicContact CZ-CB 4.22Å; F100-I439 HydrophobicContact CZ-CD1 4.22Å; F100-I439 PolarHBondContact N-O 3.18Å; F100-I439 VanDerWaalsContact N-O 3.07Å; F100-I439 PolarHBondContact O-N 3.06Å; P102-I439 HydrophobicContact CG-CD1 3.83Å; P102-I439 HydrophobicContact CG-CG1 3.89Å; M426-I439 CarbonylContact O-C 3.59Å; M426-I439 WeakPolarHBondContact O-CA 3.46Å; I427-I439 HydrophobicContact CG2-CG1 4.49Å; I436-I439 HydrophobicContact CD1-CD1 4.08Å; I436-I439 HydrophobicContact CG2-CD1 4.18Å; I436-I439 HydrophobicContact CG2-CG1 3.54Å
440	S	95.8	Very high	87.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140	174.2	170.8	0	0	0	0	112.1	V98 I343 L425 M426	V98-S440 CarbonylContact O-C 3.59Å; V98-S440 WeakPolarHBondContact O-CA 3.46Å; V98-S440 PolarHBondContact O-OG 2.63Å; I343-S440 WeakPolarHBondContact CD1-OG 3.31Å; L425-S440 CarbonylContact C-O 3.51Å; L425-S440 VanDerWaalsContact CA-O 3.25Å; L425-S440 WeakPolarHBondContact CA-O 3.24Å; M426-S440 PolarHBondContact N-O 3.22Å; M426-S440 PolarHBondContact O-N 2.7Å
441	K	96.3	Very high	87.6	Confident	14 Å²	14	32.1 Å²	32.1	6%	0.061	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	115.6	164.1	-176.3	-174.5	-170.4	161.9	0	107.7	Y86 V90 N97 V98 E313 L425 I443	Y86-K441 HydrophobicContact CE2-CB 4.22Å; V90-K441 HydrophobicContact CG2-CD 4.17Å; N97-K441 VanDerWaalsContact CA-O 3.29Å; N97-K441 WeakPolarHBondContact CA-O 3.39Å; V98-K441 HydrophobicContact CB-CB 4.03Å; V98-K441 HydrophobicContact CG2-CB 4.5Å; V98-K441 PolarHBondContact N-O 2.89Å; V98-K441 PolarHBondContact O-N 3.1Å; E313-K441 VanDerWaalsContact CD-NZ 3.26Å; E313-K441 VanDerWaalsContact OE1-CD 3.31Å; E313-K441 WeakPolarHBondContact OE1-CD 3.24Å; E313-K441 WeakPolarHBondContact OE1-CE 3.45Å; E313-K441 IonicContact OE1-NZ 3.26Å; E313-K441 PolarHBondContact OE1-NZ 2.97Å; E313-K441 IonicContact OE2-NZ 3.88Å; E313-K441 PolarHBondContact OE2-NZ 3.37Å; L425-K441 HydrophobicContact CD2-CB 3.84Å; L425-K441 HydrophobicContact CD2-CG 3.83Å; K441-I443 HydrophobicContact CD-CD1 4.01Å; K441-I443 HydrophobicContact CD-CG1 4Å; K441-I443 HydrophobicContact CG-CG1 3.99Å
442	V	96	Very high	87.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	99.7	178	-175.9	0	0	0	0	108.6	F341 I343 P423 F424 P445	F341-V442 HydrophobicContact CE1-CG2 4.49Å; F341-V442 HydrophobicContact CE2-CG2 3.92Å; F341-V442 HydrophobicContact CZ-CG2 3.87Å; I343-V442 HydrophobicContact CD1-CG2 4.33Å; P423-V442 VanDerWaalsContact CA-O 3.23Å; P423-V442 WeakPolarHBondContact CA-O 3.48Å; F424-V442 HydrophobicContact CD1-CB 4.13Å; F424-V442 HydrophobicContact CD2-CB 4.44Å; F424-V442 HydrophobicContact CD2-CG2 4.49Å; F424-V442 HydrophobicContact CE1-CB 3.68Å; F424-V442 HydrophobicContact CE1-CG1 3.73Å; F424-V442 HydrophobicContact CE1-CG2 4.26Å; F424-V442 HydrophobicContact CE2-CB 4.01Å; F424-V442 HydrophobicContact CE2-CG2 3.79Å; F424-V442 HydrophobicContact CG-CB 4.49Å; F424-V442 HydrophobicContact CZ-CB 3.61Å; F424-V442 HydrophobicContact CZ-CG1 3.85Å; F424-V442 HydrophobicContact CZ-CG2 3.67Å; F424-V442 PolarHBondContact N-O 2.86Å; F424-V442 PolarHBondContact O-N 3.44Å; V442-P445 HydrophobicContact CG1-CB 4.43Å; V442-P445 HydrophobicContact CG1-CG 3.94Å
443	I	94.4	Very high	88.4	Confident	18 Å²	18	25.3 Å²	25.3	9%	0.092	14%	0.137	C	C	.	.	S	Bend	trans	-87.8	-43.9	174.4	-59.1	-174.8	0	0	0	110.2	P94 K96 N97 F256 W258 K441	P94-I443 WeakPolarHBondContact O-CD1 3.43Å; K96-I443 VanDerWaalsContact O-CD1 3.22Å; K96-I443 WeakPolarHBondContact O-CD1 3.44Å; N97-I443 PolarHBondContact OD1-N 3.4Å; F256-I443 WeakPolarHBondContact CE1-O 3.43Å; W258-I443 HydrophobicContact CB-CG2 4.13Å; W258-I443 WeakPolarHBondContact CB-O 3.35Å; K441-I443 HydrophobicContact CD-CD1 4.01Å; K441-I443 HydrophobicContact CD-CG1 4Å; K441-I443 HydrophobicContact CG-CG1 3.99Å
444	N	92.4	Very high	89.2	Confident	31 Å²	31	25.5 Å²	25.5	17%	0.166	14%	0.137	C	C	.	.			trans	-137.4	109	178.7	179.9	-0.4	0	0	0	110.5	N97 V264 K446 Q447	N97-N444 PolarHBondContact ND2-O 3.08Å; N97-N444 PolarHBondContact OD1-N 2.94Å; V264-N444 WeakPolarHBondContact CG2-OD1 3.38Å; N444-K446 PolarHBondContact O-N 3.08Å; N444-K446 PolarHBondContact OD1-N 3.34Å; N444-Q447 HydrophobicContact CB-CB 4.07Å; N444-Q447 WeakPolarHBondContact O-CB 3.19Å; N444-Q447 PolarHBondContact O-N 3.47Å
445	P	91.1	Very high	90	Very high	9 Å²	9	23.5 Å²	23.5	6%	0.058	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.1	-179.3	-22.8	32.6	0	0	0	115.4	F256 V266 P339 F341 V442	F256-P445 HydrophobicContact CB-CG 4.49Å; F256-P445 HydrophobicContact CD1-CG 4.05Å; F256-P445 HydrophobicContact CD2-CG 3.59Å; F256-P445 HydrophobicContact CE1-CG 4.15Å; F256-P445 HydrophobicContact CE2-CG 3.67Å; F256-P445 HydrophobicContact CG-CG 3.77Å; F256-P445 HydrophobicContact CZ-CG 3.93Å; V266-P445 HydrophobicContact CG1-CB 3.98Å; V266-P445 HydrophobicContact CG1-CG 4.15Å; P339-P445 HydrophobicContact CB-CB 4.31Å; P339-P445 HydrophobicContact CB-CG 4.18Å; P339-P445 HydrophobicContact CG-CG 4.21Å; F341-P445 HydrophobicContact CB-CB 3.89Å; V442-P445 HydrophobicContact CG1-CB 4.43Å; V442-P445 HydrophobicContact CG1-CG 3.94Å
446	K	88.1	Confident	90.1	Very high	131 Å²	131	25.2 Å²	25.2	57%	0.57	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-7.1	175.1	-82.4	-168.3	160.1	171.5	0	114.3	V264 K265 V266 N444 A448	V264-K446 HydrophobicContact CB-CD 4.24Å; V264-K446 HydrophobicContact CG1-CD 4.19Å; K265-K446 WeakPolarHBondContact O-CD 3.15Å; K265-K446 WeakPolarHBondContact O-CE 3.42Å; K265-K446 PolarHBondContact O-NZ 3.29Å; V266-K446 HydrophobicContact CG1-CG 4.41Å; N444-K446 PolarHBondContact O-N 3.08Å; N444-K446 PolarHBondContact OD1-N 3.34Å; K446-A448 PolarHBondContact O-N 3.3Å
447	Q	79.6	Confident	89.8	Confident	41 Å²	41	27 Å²	27	19%	0.192	15%	0.148	C	C	.	.			trans	-84.2	111.5	172.8	174	175.5	76.9	0	0	108	N97 R345 N444	N97-Q447 PolarHBondContact ND2-O 3.47Å; R345-Q447 VanDerWaalsContact NH2-CG 3.33Å; N444-Q447 HydrophobicContact CB-CB 4.07Å; N444-Q447 WeakPolarHBondContact O-CB 3.19Å; N444-Q447 PolarHBondContact O-N 3.47Å
448	A	59.7	Low	89.5	Confident	74 Å²	74	29.1 Å²	29.1	61%	0.612	16%	0.16	S	C	*	.			trans	-60.1	0	171.3	0	0	0	0	0	111.8	S344 R345 K446	S344-A448 PolarHBondContact N-OXT 2.72Å; S344-A448 PolarHBondContact OG-OXT 3.06Å; S344-A448 VanDerWaalsContact OG-OXT 3.09Å; R345-A448 PolarHBondContact NH2-O 3.19Å; K446-A448 PolarHBondContact O-N 3.3Å

Retrieved 448 of 448 residues in 932.1 ms (Link to these results)

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