A0A093HE16_STRCA Loading...

RING finger and SPRY domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A093HE16, Species STRCA (Struthio camelus australis), Gene n/a, Length 575 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	29.7	Very low	29.5	Very low	206 Å²	206	112 Å²	112	100%	1.015	61%	0.613	S	S	*	*				0	-31.3	0	-68.1	-64.5	-87.2	0	0	112.8
2	I	30.8	Very low	29.3	Very low	138 Å²	138	108.2 Å²	108.2	71%	0.708	60%	0.6	S	S	*	*	H	α-helix	trans	-79.4	-33.6	175.6	-63.9	170.1	0	0	0	112.6	V4 A5 L6	I2-V4 VanDerWaalsContact C-N 3.31Å; I2-V4 PolarHBondContact O-N 3.34Å; I2-A5 PolarHBondContact O-N 3.36Å; I2-L6 HydrophobicContact CG2-CD1 4.22Å; I2-L6 PolarHBondContact O-N 2.8Å
3	V	28.6	Very low	29.6	Very low	115 Å²	115	112.1 Å²	112.1	70%	0.697	60%	0.6	S	S	*	*	H	α-helix	trans	-64	-32	177.2	-179.5	0	0	0	0	113.2	V7	V3-V7 WeakPolarHBondContact O-CG2 3.26Å; V3-V7 PolarHBondContact O-N 2.62Å
4	V	26	Very low	29.9	Very low	98 Å²	98	109.5 Å²	109.5	59%	0.594	60%	0.595	S	S	*	*	H	α-helix	trans	-77	-28.6	178.1	179.6	0	0	0	0	111.4	I2 V8	I2-V4 VanDerWaalsContact C-N 3.31Å; I2-V4 PolarHBondContact O-N 3.34Å; V4-V8 HydrophobicContact CG1-CG2 4.46Å; V4-V8 WeakPolarHBondContact O-CB 3.42Å; V4-V8 VanDerWaalsContact O-CG2 3.22Å; V4-V8 WeakPolarHBondContact O-CG2 3.41Å; V4-V8 PolarHBondContact O-N 3.05Å
5	A	27.1	Very low	29.9	Very low	63 Å²	63	110.6 Å²	110.6	52%	0.521	60%	0.599	S	S	.	*	H	α-helix	trans	-73.3	-35.4	176.6	0	0	0	0	0	112.2	I2 F9	I2-A5 PolarHBondContact O-N 3.36Å; A5-F9 WeakPolarHBondContact O-CB 3.42Å; A5-F9 PolarHBondContact O-N 2.75Å; A5-F9 VanDerWaalsContact O-N 3.11Å
6	L	30.4	Very low	29.8	Very low	95 Å²	95	112.2 Å²	112.2	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-49.5	172.6	-101.6	96.5	0	0	0	111.6	I2 V8 F9 Y10	I2-L6 HydrophobicContact CG2-CD1 4.22Å; I2-L6 PolarHBondContact O-N 2.8Å; L6-V8 VanDerWaalsContact C-N 3.3Å; L6-V8 PolarHBondContact O-N 3.23Å; L6-F9 PolarHBondContact O-N 3.42Å; L6-F9 VanDerWaalsContact O-N 3.08Å; L6-Y10 HydrophobicContact CD2-CE2 3.99Å; L6-Y10 HydrophobicContact CG-CE2 4.43Å; L6-Y10 VanDerWaalsContact O-CD2 3.22Å; L6-Y10 WeakPolarHBondContact O-CD2 3.43Å; L6-Y10 PolarHBondContact O-N 3.34Å
7	V	31.9	Very low	30	Very low	96 Å²	96	114.7 Å²	114.7	58%	0.582	61%	0.605	S	S	*	*	H	α-helix	trans	-61.5	-37.7	-179.1	173.9	0	0	0	0	112	V3 A11	V3-V7 WeakPolarHBondContact O-CG2 3.26Å; V3-V7 PolarHBondContact O-N 2.62Å; V7-A11 VanDerWaalsContact O-CB 3.29Å; V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 2.99Å
8	V	29.2	Very low	30.1	Very low	93 Å²	93	110.4 Å²	110.4	56%	0.564	59%	0.593	S	S	*	*	H	α-helix	trans	-71.7	-31	176.1	173.4	0	0	0	0	112.2	V4 L6 S12	V4-V8 HydrophobicContact CG1-CG2 4.46Å; V4-V8 WeakPolarHBondContact O-CB 3.42Å; V4-V8 VanDerWaalsContact O-CG2 3.22Å; V4-V8 WeakPolarHBondContact O-CG2 3.41Å; V4-V8 PolarHBondContact O-N 3.05Å; L6-V8 VanDerWaalsContact C-N 3.3Å; L6-V8 PolarHBondContact O-N 3.23Å; V8-S12 WeakPolarHBondContact O-CB 3.2Å; V8-S12 PolarHBondContact O-N 3.47Å; V8-S12 VanDerWaalsContact O-N 3.15Å; V8-S12 PolarHBondContact O-OG 3.4Å
9	F	32.4	Very low	30	Very low	125 Å²	125	112.1 Å²	112.1	55%	0.548	60%	0.595	S	S	.	*	H	α-helix	trans	-72.5	-40.2	176.1	-171.8	-102.3	0	0	0	112.6	A5 L6 S12 R13	A5-F9 WeakPolarHBondContact O-CB 3.42Å; A5-F9 PolarHBondContact O-N 2.75Å; A5-F9 VanDerWaalsContact O-N 3.11Å; L6-F9 PolarHBondContact O-N 3.42Å; L6-F9 VanDerWaalsContact O-N 3.08Å; F9-S12 PolarHBondContact O-OG 3.22Å; F9-R13 PolarHBondContact O-N 2.88Å
10	Y	30.4	Very low	30	Very low	153 Å²	153	113.1 Å²	113.1	60%	0.6	60%	0.599	S	S	*	*	H	α-helix	trans	-69.7	-39.1	173.9	-77.7	-79.6	0	0	0	112.5	L6 S12 S14	L6-Y10 HydrophobicContact CD2-CE2 3.99Å; L6-Y10 HydrophobicContact CG-CE2 4.43Å; L6-Y10 VanDerWaalsContact O-CD2 3.22Å; L6-Y10 WeakPolarHBondContact O-CD2 3.43Å; L6-Y10 PolarHBondContact O-N 3.34Å; Y10-S12 PolarHBondContact O-N 3.35Å; Y10-S14 WeakPolarHBondContact O-CB 3.47Å; Y10-S14 PolarHBondContact O-N 2.67Å; Y10-S14 VanDerWaalsContact O-N 3.09Å
11	A	28.3	Very low	30.2	Very low	50 Å²	50	112.6 Å²	112.6	41%	0.413	60%	0.597	S	S	.	*	H	α-helix	trans	-66.7	-36.8	178.1	0	0	0	0	0	113.3	V7 L15	V7-A11 VanDerWaalsContact O-CB 3.29Å; V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 2.99Å; A11-L15 WeakPolarHBondContact O-CD1 3.3Å; A11-L15 WeakPolarHBondContact O-CG 3.32Å; A11-L15 PolarHBondContact O-N 3.24Å
12	S	27.1	Very low	30.2	Very low	66 Å²	66	106.2 Å²	106.2	46%	0.462	57%	0.572	S	S	.	*	H	α-helix	trans	-75.8	-28.7	-179	49.9	0	0	0	0	113.7	V8 F9 Y10	V8-S12 WeakPolarHBondContact O-CB 3.2Å; V8-S12 PolarHBondContact O-N 3.47Å; V8-S12 VanDerWaalsContact O-N 3.15Å; V8-S12 PolarHBondContact O-OG 3.4Å; F9-S12 PolarHBondContact O-OG 3.22Å; Y10-S12 PolarHBondContact O-N 3.35Å
13	R	32.7	Very low	30.2	Very low	159 Å²	159	103.2 Å²	103.2	60%	0.6	56%	0.557	S	S	*	*	H	α-helix	trans	-77.2	-36.2	171.1	-100.1	-176	155.8	-170.9	-4.6	113.2	F9 L16 R17	F9-R13 PolarHBondContact O-N 2.88Å; R13-L16 PolarHBondContact O-N 3.12Å; R13-R17 PolarHBondContact O-N 2.78Å
14	S	33.9	Very low	30.5	Very low	76 Å²	76	105 Å²	105	53%	0.531	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-40.6	175.7	179.5	0	0	0	0	111.9	Y10 L16 R17 G18	Y10-S14 WeakPolarHBondContact O-CB 3.47Å; Y10-S14 PolarHBondContact O-N 2.67Å; Y10-S14 VanDerWaalsContact O-N 3.09Å; S14-L16 PolarHBondContact O-N 3.29Å; S14-R17 PolarHBondContact O-N 3.25Å; S14-G18 PolarHBondContact O-N 2.88Å
15	L	30.3	Very low	30.8	Very low	126 Å²	126	108 Å²	108	66%	0.66	57%	0.566	S	S	*	*	H	α-helix	trans	-66.8	-33.1	176.9	-76.8	163.3	0	0	0	113.9	A11	A11-L15 WeakPolarHBondContact O-CD1 3.3Å; A11-L15 WeakPolarHBondContact O-CG 3.32Å; A11-L15 PolarHBondContact O-N 3.24Å
16	L	28.6	Very low	30.9	Very low	136 Å²	136	111.2 Å²	111.2	71%	0.712	57%	0.569	S	S	*	*	H	α-helix	trans	-79.1	-25.6	179.3	-140.3	85.5	0	0	0	112.8	R13 S14	R13-L16 PolarHBondContact O-N 3.12Å; S14-L16 PolarHBondContact O-N 3.29Å
17	R	32.9	Very low	31.1	Very low	155 Å²	155	111.4 Å²	111.4	59%	0.585	57%	0.574	S	S	*	*	H	α-helix	trans	-92.6	-34.4	176.2	-81.1	-177.4	172.1	-175.6	-4.3	113.3	R13 S14 F19 L20 L21	R13-R17 PolarHBondContact O-N 2.78Å; S14-R17 PolarHBondContact O-N 3.25Å; R17-F19 PolarHBondContact O-N 3.37Å; R17-L20 PolarHBondContact O-N 3.16Å; R17-L20 VanDerWaalsContact O-N 3.08Å; R17-L21 PolarHBondContact O-N 3.22Å
18	G	30.5	Very low	31	Very low	38 Å²	38	112.7 Å²	112.7	39%	0.392	59%	0.585	S	S	.	*	H	α-helix	trans	-62.1	-28.7	174.6	0	0	0	0	0	113.2	S14 L20 L21 S22	S14-G18 PolarHBondContact O-N 2.88Å; G18-L20 VanDerWaalsContact C-N 3.31Å; G18-L20 PolarHBondContact O-N 2.8Å; G18-L21 PolarHBondContact O-N 3.49Å; G18-S22 PolarHBondContact O-N 2.62Å
19	F	29	Very low	31.1	Very low	141 Å²	141	119.4 Å²	119.4	62%	0.618	60%	0.6	S	S	*	*	H	α-helix	trans	-70.1	-24	174.2	-115.9	-84.3	0	0	0	114	R17	R17-F19 PolarHBondContact O-N 3.37Å
20	L	30.8	Very low	31.2	Very low	132 Å²	132	120.3 Å²	120.3	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-85.1	-31.1	175.1	-82.1	158.6	0	0	0	112.2	R17 G18	R17-L20 PolarHBondContact O-N 3.16Å; R17-L20 VanDerWaalsContact O-N 3.08Å; G18-L20 VanDerWaalsContact C-N 3.31Å; G18-L20 PolarHBondContact O-N 2.8Å
21	L	33.6	Very low	31.1	Very low	103 Å²	103	122.4 Å²	122.4	54%	0.539	62%	0.624	S	S	.	*	H	α-helix	trans	-78.2	-27	-178.8	-76.7	156.6	0	0	0	113.8	R17 G18 L23 E24	R17-L21 PolarHBondContact O-N 3.22Å; G18-L21 PolarHBondContact O-N 3.49Å; L21-L23 PolarHBondContact O-N 2.92Å; L21-E24 PolarHBondContact O-N 3.31Å
22	S	29.4	Very low	31.1	Very low	72 Å²	72	123.4 Å²	123.4	50%	0.503	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	175.5	-179.9	0	0	0	0	113.3	G18	G18-S22 PolarHBondContact O-N 2.62Å
23	L	31.8	Very low	31	Very low	76 Å²	76	124.2 Å²	124.2	40%	0.398	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.3	-20.4	-179.5	-114.8	87.3	0	0	0	114	L21	L21-L23 PolarHBondContact O-N 2.92Å
24	E	33.3	Very low	30.8	Very low	151 Å²	151	125.3 Å²	125.3	71%	0.706	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-13.1	-173	-70.9	-169.4	153.9	0	0	114	L21	L21-E24 PolarHBondContact O-N 3.31Å
25	H	32	Very low	30.4	Very low	163 Å²	163	125 Å²	125	76%	0.755	68%	0.675	S	S	*	*	S	Bend	trans	-87.4	-0.2	-175.1	-86.3	-23.8	0	0	0	116.1
26	H	30.6	Very low	30.2	Very low	130 Å²	130	126 Å²	126	60%	0.602	69%	0.687	S	S	*	*	S	Bend	trans	-120	53.4	-178.8	-79.6	-45.6	0	0	0	114.1
27	V	34.3	Very low	30	Very low	99 Å²	99	125.5 Å²	125.5	60%	0.6	70%	0.695	S	S	*	*			trans	-139.8	28.4	174.6	-153.3	0	0	0	0	117.4	R29	V27-R29 PolarHBondContact O-N 2.96Å
28	P	29.7	Very low	29.5	Very low	123 Å²	123	125.6 Å²	125.6	80%	0.799	71%	0.707	S	S	*	*			trans	-98.6	70.7	169	36.4	-28.4	0	0	0	111.1
29	R	32.1	Very low	29.1	Very low	233 Å²	233	132.7 Å²	132.7	88%	0.879	73%	0.733	S	S	*	*	S	Bend	trans	-149.6	2.1	167.9	-116.3	176.7	-170.1	-179.7	3.5	119.1	V27	V27-R29 PolarHBondContact O-N 2.96Å
30	F	33.6	Very low	28.8	Very low	145 Å²	145	129.5 Å²	129.5	64%	0.636	74%	0.74	S	S	*	*			trans	-114.9	7	-168.7	-88.3	-81.4	0	0	0	118.6	G32 D531	F30-G32 PolarHBondContact O-N 2.76Å; F30-D531 WeakPolarHBondContact CE2-OD1 3.33Å
31	L	29.4	Very low	28.5	Very low	196 Å²	196	131 Å²	131	100%	1.026	75%	0.748	S	S	*	*			trans	-84.1	37.7	-177.9	-81.8	161.5	0	0	0	114.8
32	G	27.9	Very low	28	Very low	72 Å²	72	132 Å²	132	74%	0.742	76%	0.763	S	S	*	*	S	Bend	trans	-135.8	33.5	-172.3	0	0	0	0	0	115.9	F30	F30-G32 PolarHBondContact O-N 2.76Å
33	A	25.4	Very low	27.7	Very low	82 Å²	82	134.3 Å²	134.3	68%	0.678	78%	0.779	S	S	*	*			trans	-167.6	123.7	165.4	0	0	0	0	0	114.7
34	L	28.4	Very low	27.4	Very low	182 Å²	182	137.6 Å²	137.6	95%	0.953	80%	0.801	S	S	*	*			trans	69.5	139.7	149.7	-60.9	151.4	0	0	0	116.3
35	G	24.4	Very low	26.9	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	80%	0.804	S	S	*	*			cis	138	119.4	20.5	0	0	0	0	0	106.9
36	T	26.6	Very low	26.5	Very low	147 Å²	147	139.7 Å²	139.7	90%	0.902	81%	0.812	S	S	*	*			trans	-57.3	135.4	-168.8	52	0	0	0	0	115.9
37	S	24.2	Very low	26.2	Very low	126 Å²	126	140.5 Å²	140.5	88%	0.881	82%	0.821	S	S	*	*			trans	-158.2	151.4	145	63.5	0	0	0	0	112
38	N	21.8	Very low	25.9	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	83%	0.83	S	S	*	*			trans	-104.3	173.5	-161.3	-142.5	-6.9	0	0	0	111.2
39	M	23.2	Very low	25.7	Very low	187 Å²	187	142.3 Å²	142.3	92%	0.921	83%	0.83	S	S	*	*			trans	91.6	133.3	170.1	-46.9	-161.4	79.2	0	0	115.4
40	G	22.2	Very low	25.3	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	83%	0.829	S	S	*	*			cis	-178.3	151.9	0.7	0	0	0	0	0	109.3
41	N	24.1	Very low	25	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	84%	0.838	S	S	*	*			trans	-51.8	150.5	-176.8	-71.3	-15.9	0	0	0	115.7
42	S	24.8	Very low	24.9	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	83%	0.828	S	S	*	*				-167.5	121.5	122.8	-81.5	0	0	0	0	112.4
43	C	22.7	Very low	24.8	Very low	122 Å²	122	136.9 Å²	136.9	82%	0.824	84%	0.837	S	S	*	*			trans	-74.3	146	163.3	-70.4	0	0	0	0	111
44	V	24.3	Very low	24.8	Very low	144 Å²	144	140.3 Å²	140.3	87%	0.873	84%	0.844	S	S	*	*			trans	-141.8	117	148.7	178.6	0	0	0	0	108.8
45	C	23.6	Very low	24.7	Very low	113 Å²	113	136.5 Å²	136.5	76%	0.764	84%	0.839	S	S	*	*			trans	-76.6	152.4	169	-56.9	0	0	0	0	110.9
46	R	23.3	Very low	24.7	Very low	246 Å²	246	142.4 Å²	142.4	93%	0.928	85%	0.848	S	S	*	*			trans	-158.6	109.9	151.4	-132.6	175.2	167.7	177.4	-4.6	112.2
47	D	24.2	Very low	24.7	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	84%	0.842	S	S	*	*			trans	-72.3	150.7	154.8	-66.7	-48.6	0	0	0	109.3
48	D	27.2	Very low	24.8	Very low	148 Å²	148	143.5 Å²	143.5	79%	0.791	84%	0.841	S	S	*	*				163.4	141.8	91.8	-136.8	-13.5	0	0	0	113.9
49	S	26.4	Very low	25	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	84%	0.838	S	S	*	*			trans	71.3	135.4	141.2	66.5	0	0	0	0	124.5
50	G	24.6	Very low	25.2	Very low	83 Å²	83	145.8 Å²	145.8	86%	0.856	84%	0.838	S	S	*	*			trans	173.3	110.9	159	0	0	0	0	0	113.4
51	A	26.5	Very low	25.3	Very low	102 Å²	102	150.9 Å²	150.9	84%	0.843	84%	0.842	S	S	*	*			trans	-96.5	168.8	-163.9	0	0	0	0	0	116.8
52	E	26.8	Very low	25.4	Very low	175 Å²	175	150.2 Å²	150.2	82%	0.818	84%	0.844	S	S	*	*			trans	-14.1	148.9	167.2	-60.2	176.9	160.9	0	0	121.5
53	D	25.8	Very low	25.5	Very low	171 Å²	171	152.5 Å²	152.5	91%	0.914	84%	0.841	S	S	*	*				-158.8	142.1	128.6	-116	-20.8	0	0	0	113.8
54	N	25.7	Very low	25.7	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	85%	0.845	S	S	*	*			trans	-94.3	154.3	-178.1	-89.9	-45.9	0	0	0	112.3
55	A	26.5	Very low	25.8	Very low	103 Å²	103	152.5 Å²	152.5	85%	0.851	84%	0.836	S	S	*	*			trans	-164.5	121.7	144.8	0	0	0	0	0	113.3
56	E	24.8	Very low	26	Very low	193 Å²	193	159.6 Å²	159.6	90%	0.902	85%	0.847	S	S	*	*			trans	-85.8	154.3	164.8	-67.3	-179.1	137.9	0	0	111.8
57	S	25.7	Very low	26.1	Very low	112 Å²	112	152.1 Å²	152.1	78%	0.783	84%	0.838	S	S	*	*				-178.3	112.2	128.7	58.3	0	0	0	0	114.7
58	Q	26.7	Very low	26.1	Very low	183 Å²	183	156.5 Å²	156.5	86%	0.855	84%	0.843	S	S	*	*				46.7	123.8	128.4	-66.7	-171.2	-3.6	0	0	125.2
59	N	25.9	Very low	26.1	Very low	145 Å²	145	155.5 Å²	155.5	78%	0.775	84%	0.842	S	S	*	*				51.3	127.6	127.9	-89.7	-14.6	0	0	0	123
60	R	26.5	Very low	26.6	Very low	248 Å²	248	155.3 Å²	155.3	94%	0.936	84%	0.838	S	S	*	*				-170	126.1	117.5	-104.5	170.9	-175.1	-168.3	2	113.4
61	Q	25.6	Very low	26.6	Very low	182 Å²	182	161.1 Å²	161.1	85%	0.85	84%	0.843	S	S	*	*			trans	-78.5	151.7	163.7	-73.4	172.4	-35.5	0	0	111.1
62	T	26.6	Very low	26.6	Very low	148 Å²	148	160.3 Å²	160.3	91%	0.908	84%	0.837	S	S	*	*			trans	-151.2	125.3	143.9	-0.1	0	0	0	0	110.6
63	E	25.8	Very low	26.6	Very low	171 Å²	171	163.5 Å²	163.5	80%	0.799	84%	0.841	S	S	*	*			trans	-73.1	156	170	-63.8	173.2	135	0	0	111.5
64	N	27.2	Very low	26.7	Very low	168 Å²	168	161.1 Å²	161.1	90%	0.898	84%	0.838	S	S	*	*			trans	-158.7	128.9	135.3	-114.8	-21.9	0	0	0	113.3
65	S	26.3	Very low	26.9	Very low	99 Å²	99	162.7 Å²	162.7	69%	0.692	84%	0.84	S	S	*	*			trans	-92.8	150.3	-179.1	-48.9	0	0	0	0	111.2
66	R	27.5	Very low	27.1	Very low	261 Å²	261	163.6 Å²	163.6	99%	0.985	84%	0.837	S	S	*	*			trans	-167.4	143.8	144.5	-107	165.9	-167	-161.7	3.8	112.8
67	A	25.6	Very low	27.4	Very low	89 Å²	89	166.1 Å²	166.1	74%	0.736	84%	0.838	S	S	*	*			trans	-105.6	144.1	-165.3	0	0	0	0	0	113.4
68	R	24.9	Very low	27.6	Very low	239 Å²	239	168.1 Å²	168.1	90%	0.902	84%	0.84	S	S	*	*				56.4	138.9	124.3	-95.5	-178.1	-167.9	-166.4	5.4	118.8
69	V	27.1	Very low	28	Very low	126 Å²	126	165.2 Å²	165.2	76%	0.764	84%	0.837	S	S	*	*			cis	-165.3	-162.1	36	-162.8	0	0	0	0	109.1
70	P	36.4	Very low	28.4	Very low	109 Å²	109	165 Å²	165	71%	0.708	84%	0.841	S	S	*	*				-111.1	168.9	-101.4	36.6	-18.3	0	0	0	116.8
71	E	25.8	Very low	28.8	Very low	205 Å²	205	163.7 Å²	163.7	96%	0.958	84%	0.836	S	S	*	*			trans	-159.3	161	145	-118	171.8	-164	0	0	113
72	A	25.7	Very low	29.1	Very low	86 Å²	86	160.2 Å²	160.2	71%	0.711	83%	0.829	S	S	*	*			trans	-108.9	157.7	-145.4	0	0	0	0	0	116.7
73	R	26	Very low	29.4	Very low	242 Å²	242	159 Å²	159	91%	0.913	82%	0.823	S	S	*	*			trans	72.9	113.8	153.3	-65.8	177	-178.1	-176.5	0.7	120
74	S	27.6	Very low	29.9	Very low	120 Å²	120	162.1 Å²	162.1	84%	0.839	83%	0.828	S	S	*	*				178.9	131.5	110.1	43.5	0	0	0	0	111.7
75	H	30.7	Very low	30.5	Very low	188 Å²	188	166 Å²	166	87%	0.87	83%	0.83	S	S	*	*			trans	-79.1	152.4	176.1	-83.8	-53.2	0	0	0	112.4
76	P	31	Very low	30.7	Very low	122 Å²	122	164.7 Å²	164.7	79%	0.792	83%	0.832	S	S	*	*				-124.8	161.4	129.5	16.9	3.3	0	0	0	112.8
77	R	29.9	Very low	31.2	Very low	246 Å²	246	163 Å²	163	93%	0.928	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.3	140.8	-159.3	-66.7	160.8	172.2	169.6	-3.2	114.2
78	D	31.2	Very low	31.6	Very low	154 Å²	154	161.3 Å²	161.3	82%	0.824	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.6	143.1	165.5	-78.3	-42.6	0	0	0	112.1
79	P	34.3	Very low	32.1	Very low	122 Å²	122	155.9 Å²	155.9	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.7	127.1	169.7	29.5	-29.7	0	0	0	111.3	R81	P79-R81 PolarHBondContact O-N 3.01Å
80	V	35.6	Very low	32.7	Very low	141 Å²	141	158.8 Å²	158.8	86%	0.855	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58	123.2	-179.1	175.1	0	0	0	0	111.9
81	R	33.2	Very low	32.7	Very low	219 Å²	219	159 Å²	159	83%	0.826	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.2	131.4	170.5	-157.2	179	-152	-178.9	7.2	109.6	P79	P79-R81 PolarHBondContact O-N 3.01Å
82	P	33.3	Very low	33.2	Very low	110 Å²	110	154.7 Å²	154.7	71%	0.714	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.5	150.1	178.7	26	-30.5	0	0	0	111.4
83	P	32.4	Very low	33.8	Very low	121 Å²	121	162.3 Å²	162.3	79%	0.786	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.3	137.9	-173.7	28.5	-33.9	0	0	0	111.5	R85	P83-R85 PolarHBondContact O-N 2.98Å
84	R	35.7	Very low	34.8	Very low	238 Å²	238	160 Å²	160	90%	0.898	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-55	119.1	173.1	-70.8	177.5	173.6	179.2	-3.3	109.5	G86	R84-G86 PolarHBondContact O-N 3.24Å
85	R	40	Very low	35.6	Very low	248 Å²	248	163.2 Å²	163.2	94%	0.936	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-61.1	129.1	168.9	-75.4	-177.3	176.7	-175.9	-0.8	108.9	P83	P83-R85 PolarHBondContact O-N 2.98Å
86	G	31.3	Very low	36.3	Very low	72 Å²	72	164.5 Å²	164.5	74%	0.742	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.6	147	179.3	0	0	0	0	0	112.2	R84 G88	R84-G86 PolarHBondContact O-N 3.24Å; G86-G88 PolarHBondContact O-N 3.15Å
87	R	37.8	Very low	37.8	Very low	225 Å²	225	163.4 Å²	163.4	85%	0.849	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60.5	129.4	175.8	-66.1	-179.3	-174.6	-162.7	-1.2	110.1
88	G	33.6	Very low	40.6	Very low	54 Å²	54	156.5 Å²	156.5	56%	0.557	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.8	150.9	167.6	0	0	0	0	0	111.1	G86 H90	G86-G88 PolarHBondContact O-N 3.15Å; G88-H90 VanDerWaalsContact C-N 3.28Å; G88-H90 PolarHBondContact O-N 2.85Å
89	P	36	Very low	43.5	Very low	126 Å²	126	149.8 Å²	149.8	82%	0.818	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	72.3	-178	34.1	-31.8	0	0	0	109.6
90	H	39.4	Very low	46.4	Very low	187 Å²	187	146 Å²	146	87%	0.866	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.5	10.9	161.3	-98.8	-54.6	0	0	0	115.5	G88 P92	G88-H90 VanDerWaalsContact C-N 3.28Å; G88-H90 PolarHBondContact O-N 2.85Å; H90-P92 WeakPolarHBondContact O-CD 3.39Å
91	E	36	Very low	49.2	Very low	114 Å²	114	140.1 Å²	140.1	53%	0.533	67%	0.674	S	S	.	*			trans	-69.6	121.9	169.3	-95.4	-171.5	136	0	0	110.5	R93 R94	E91-R93 PolarHBondContact O-N 3.14Å; E91-R94 IonicContact OE1-NH2 3.46Å
92	P	36.4	Very low	52.2	Low	113 Å²	113	130 Å²	130	73%	0.734	64%	0.637	S	S	*	*			trans	-57.8	134.4	171.2	-17.6	29.4	0	0	0	109.5	H90 R94	H90-P92 WeakPolarHBondContact O-CD 3.39Å; P92-R94 PolarHBondContact O-N 3.03Å
93	R	38.2	Very low	55.1	Low	246 Å²	246	124.8 Å²	124.8	93%	0.928	60%	0.603	S	S	*	*			trans	-53.8	106.5	171.9	-85.2	175.5	159.5	161.7	-6.1	109.2	E91 K95	E91-R93 PolarHBondContact O-N 3.14Å; R93-K95 PolarHBondContact O-N 3.01Å; R93-K95 VanDerWaalsContact O-N 3.12Å
94	R	47.1	Very low	58.1	Low	194 Å²	194	122.7 Å²	122.7	73%	0.732	59%	0.585	S	S	*	*			trans	-58.2	112.3	178.1	-68.6	-177.1	-174.1	-170.1	0.6	109.7	E91 P92	E91-R94 IonicContact OE1-NH2 3.46Å; P92-R94 PolarHBondContact O-N 3.03Å
95	K	45.4	Very low	60.8	Low	187 Å²	187	114.5 Å²	114.5	81%	0.813	56%	0.558	S	S	*	*			trans	-64.7	143.8	166.3	-76.9	179.7	177.3	177	0	107.8	R93 Q97	R93-K95 PolarHBondContact O-N 3.01Å; R93-K95 VanDerWaalsContact O-N 3.12Å; K95-Q97 VanDerWaalsContact C-N 3.33Å; K95-Q97 PolarHBondContact O-N 3.25Å
96	K	44.6	Very low	63.2	Low	215 Å²	215	102.7 Å²	102.7	94%	0.935	51%	0.514	S	S	*	.			trans	-59.7	99	166.2	-133.7	-179.2	-177.7	-171.6	0	106
97	Q	62.8	Low	66.1	Low	100 Å²	100	99.8 Å²	99.8	47%	0.467	48%	0.481	S	S	.	.			trans	-75	130.1	179	-75.5	179	-41.3	0	0	107.7	K95 L102 D105	K95-Q97 VanDerWaalsContact C-N 3.33Å; K95-Q97 PolarHBondContact O-N 3.25Å; Q97-L102 HydrophobicContact CB-CD2 4.21Å; Q97-L102 HydrophobicContact CB-CG 4.36Å; Q97-D105 PolarHBondContact NE2-OD2 2.79Å
98	N	87.4	Confident	68.6	Low	100 Å²	100	92.8 Å²	92.8	54%	0.535	47%	0.472	S	S	.	.			trans	-79.8	162.2	168.4	63.9	-12	0	0	0	109.1	D100 G101 L102	N98-D100 PolarHBondContact O-N 2.97Å; N98-G101 PolarHBondContact O-N 3.09Å; N98-G101 PolarHBondContact OD1-N 2.96Å; N98-G101 VanDerWaalsContact OD1-N 3.11Å; N98-L102 PolarHBondContact O-N 2.84Å
99	V	93.3	Very high	71.1	Confident	13 Å²	13	92.7 Å²	92.7	8%	0.079	46%	0.46	C	S	.	.	H	α-helix	trans	-52.9	-39.3	-178.6	-173.1	0	0	0	0	112.1	G101 L102 V103 L127 M130 E139 V140 S143	V99-G101 VanDerWaalsContact C-N 3.33Å; V99-G101 PolarHBondContact O-N 3.29Å; V99-L102 PolarHBondContact O-N 2.92Å; V99-L102 VanDerWaalsContact O-N 3.15Å; V99-V103 PolarHBondContact O-N 2.81Å; V99-L127 HydrophobicContact CG1-CD2 3.71Å; V99-M130 HydrophobicContact CG2-CE 3.34Å; V99-M130 HydrophobicContact CG2-SD 4.17Å; V99-E139 HydrophobicContact CG2-CB 4.3Å; V99-V140 HydrophobicContact CG1-CG2 4.05Å; V99-S143 PolarHBondContact O-OG 3.03Å
100	D	95.3	Very high	73.4	Confident	43 Å²	43	87.5 Å²	87.5	23%	0.23	43%	0.425	C	S	.	.	H	α-helix	trans	-53.4	-47.1	174.2	-68.6	7.4	0	0	0	112.4	N98 L102 V103 L104 S143 R146 V147	N98-D100 PolarHBondContact O-N 2.97Å; D100-L102 PolarHBondContact O-N 2.91Å; D100-V103 PolarHBondContact O-N 2.8Å; D100-L104 WeakPolarHBondContact O-CG 3.38Å; D100-L104 PolarHBondContact O-N 2.83Å; D100-L104 VanDerWaalsContact O-N 3.12Å; D100-S143 VanDerWaalsContact CA-OG 3.26Å; D100-S143 WeakPolarHBondContact CA-OG 3.35Å; D100-S143 PolarHBondContact N-OG 2.85Å; D100-S143 WeakPolarHBondContact OD1-CB 3.43Å; D100-S143 PolarHBondContact OD1-OG 3.42Å; D100-S143 VanDerWaalsContact OD1-OG 3.11Å; D100-R146 IonicContact OD1-CZ 2.71Å; D100-R146 IonicContact OD1-NE 2.65Å; D100-R146 IonicContact OD1-NH2 2.69Å; D100-R146 PolarHBondContact OD1-NH2 2.91Å; D100-R146 IonicContact OD2-NH2 3.72Å; D100-V147 HydrophobicContact CB-CG1 3.69Å; D100-V147 VanDerWaalsContact CG-CG1 3.46Å
101	G	94.6	Very high	75.4	Confident	18 Å²	18	83.2 Å²	83.2	19%	0.186	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-39.5	176.8	0	0	0	0	0	112.8	N98 V99 L104 D105	N98-G101 PolarHBondContact O-N 3.09Å; N98-G101 PolarHBondContact OD1-N 2.96Å; N98-G101 VanDerWaalsContact OD1-N 3.11Å; V99-G101 VanDerWaalsContact C-N 3.33Å; V99-G101 PolarHBondContact O-N 3.29Å; G101-L104 PolarHBondContact O-N 3.43Å; G101-D105 WeakPolarHBondContact O-CB 3.41Å; G101-D105 PolarHBondContact O-N 2.9Å
102	L	94.8	Very high	77.4	Confident	7 Å²	7	82.1 Å²	82.1	4%	0.037	40%	0.403	C	S	.	.	H	α-helix	trans	-67.7	-37.5	178.5	-63	171.6	0	0	0	112.2	Q97 N98 V99 D100 T106 S123 T126 L127 M130	Q97-L102 HydrophobicContact CB-CD2 4.21Å; Q97-L102 HydrophobicContact CB-CG 4.36Å; N98-L102 PolarHBondContact O-N 2.84Å; V99-L102 PolarHBondContact O-N 2.92Å; V99-L102 VanDerWaalsContact O-N 3.15Å; D100-L102 PolarHBondContact O-N 2.91Å; L102-T106 WeakPolarHBondContact O-CB 3.5Å; L102-T106 PolarHBondContact O-N 2.89Å; L102-T106 PolarHBondContact O-OG1 2.77Å; L102-S123 WeakPolarHBondContact O-CB 3.49Å; L102-T126 HydrophobicContact CD1-CG2 3.69Å; L102-L127 HydrophobicContact CB-CD1 4.02Å; L102-L127 HydrophobicContact CB-CD2 3.85Å; L102-L127 HydrophobicContact CB-CG 3.8Å; L102-L127 HydrophobicContact CD1-CD2 4.29Å; L102-L127 HydrophobicContact CD1-CG 4.4Å; L102-M130 HydrophobicContact CD1-SD 4.16Å
103	V	95.1	Very high	79.3	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-64.5	-46.1	175.4	168.4	0	0	0	0	110.4	V99 D100 T106 L107 L127 S143 L144 V147 I148	V99-V103 PolarHBondContact O-N 2.81Å; D100-V103 PolarHBondContact O-N 2.8Å; V103-T106 WeakPolarHBondContact O-CB 3.49Å; V103-T106 PolarHBondContact O-N 2.8Å; V103-L107 PolarHBondContact O-N 3.11Å; V103-L127 HydrophobicContact CG2-CD1 4.03Å; V103-L127 HydrophobicContact CG2-CD2 4.04Å; V103-S143 WeakPolarHBondContact CG2-OG 3.31Å; V103-L144 HydrophobicContact CG1-CD2 3.87Å; V103-L144 HydrophobicContact CG2-CD2 4.03Å; V103-V147 HydrophobicContact CB-CG2 3.87Å; V103-V147 HydrophobicContact CG1-CG2 3.51Å; V103-I148 HydrophobicContact CG1-CD1 4.07Å; V103-I148 HydrophobicContact CG1-CG1 3.81Å
104	L	94.8	Very high	80.9	Confident	77 Å²	77	68.8 Å²	68.8	40%	0.403	35%	0.345	S	S	.	.	H	α-helix	trans	-65.9	-38.8	177.8	-68.6	173.5	0	0	0	112.6	D100 G101 T106 L107 A108 V147	D100-L104 WeakPolarHBondContact O-CG 3.38Å; D100-L104 PolarHBondContact O-N 2.83Å; D100-L104 VanDerWaalsContact O-N 3.12Å; G101-L104 PolarHBondContact O-N 3.43Å; L104-T106 VanDerWaalsContact C-N 3.33Å; L104-L107 PolarHBondContact O-N 3.19Å; L104-A108 WeakPolarHBondContact O-CB 2.91Å; L104-A108 PolarHBondContact O-N 2.98Å; L104-V147 HydrophobicContact CD1-CB 4.46Å; L104-V147 HydrophobicContact CD2-CB 4.25Å; L104-V147 HydrophobicContact CD2-CG2 4.08Å; L104-V147 HydrophobicContact CG-CB 4.24Å; L104-V147 HydrophobicContact CG-CG2 3.98Å
105	D	92.5	Very high	81.6	Confident	65 Å²	65	63.2 Å²	63.2	35%	0.348	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-42.3	174.8	-74.8	-12.1	0	0	0	110.6	Q97 G101 A108 V109	Q97-D105 PolarHBondContact NE2-OD2 2.79Å; G101-D105 WeakPolarHBondContact O-CB 3.41Å; G101-D105 PolarHBondContact O-N 2.9Å; D105-A108 PolarHBondContact O-N 2.88Å; D105-V109 WeakPolarHBondContact O-CG2 3.33Å; D105-V109 PolarHBondContact O-N 3.45Å
106	T	91.9	Very high	82.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-46.7	174.8	-56.5	0	0	0	0	111.4	L102 V103 L104 A108 V109 I110 S123 M124 V158 L162	L102-T106 WeakPolarHBondContact O-CB 3.5Å; L102-T106 PolarHBondContact O-N 2.89Å; L102-T106 PolarHBondContact O-OG1 2.77Å; V103-T106 WeakPolarHBondContact O-CB 3.49Å; V103-T106 PolarHBondContact O-N 2.8Å; L104-T106 VanDerWaalsContact C-N 3.33Å; T106-A108 VanDerWaalsContact C-N 3.29Å; T106-A108 PolarHBondContact O-N 3.13Å; T106-V109 WeakPolarHBondContact O-CG2 3.18Å; T106-V109 PolarHBondContact O-N 2.73Å; T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 PolarHBondContact O-N 3.31Å; T106-S123 WeakPolarHBondContact CA-OG 3.11Å; T106-S123 PolarHBondContact N-OG 3.01Å; T106-S123 WeakPolarHBondContact OG1-CB 3.28Å; T106-S123 PolarHBondContact OG1-OG 3.13Å; T106-M124 HydrophobicContact CG2-CB 4.35Å; T106-M124 HydrophobicContact CG2-CE 3.87Å; T106-V158 HydrophobicContact CG2-CG1 4.39Å; T106-L162 HydrophobicContact CG2-CD1 4.26Å; T106-L162 HydrophobicContact CG2-CD2 4.25Å; T106-L162 HydrophobicContact CG2-CG 4.44Å
107	L	91.8	Very high	83.2	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-39.8	176.8	-178.1	63.4	0	0	0	112	V103 L104 V109 I110 I148 P149 D152 L154 V158	V103-L107 PolarHBondContact O-N 3.11Å; L104-L107 PolarHBondContact O-N 3.19Å; L107-V109 VanDerWaalsContact C-N 3.29Å; L107-V109 PolarHBondContact O-N 2.83Å; L107-I110 WeakPolarHBondContact O-CG2 3.37Å; L107-I148 HydrophobicContact CD2-CG2 4.46Å; L107-P149 HydrophobicContact CD2-CG 4.17Å; L107-D152 HydrophobicContact CD2-CB 4.21Å; L107-L154 HydrophobicContact CD1-CB 4.44Å; L107-V158 HydrophobicContact CD1-CB 4.2Å; L107-V158 HydrophobicContact CD1-CG2 3.62Å
108	A	89.5	Confident	83.7	Confident	78 Å²	78	55.3 Å²	55.3	65%	0.645	31%	0.307	S	S	*	.	H	α-helix	trans	-66.5	-29.3	-179.5	0	0	0	0	0	113.4	L104 D105 T106	L104-A108 WeakPolarHBondContact O-CB 2.91Å; L104-A108 PolarHBondContact O-N 2.98Å; D105-A108 PolarHBondContact O-N 2.88Å; T106-A108 VanDerWaalsContact C-N 3.29Å; T106-A108 PolarHBondContact O-N 3.13Å
109	V	87.6	Confident	83.3	Confident	51 Å²	51	59.2 Å²	59.2	31%	0.309	32%	0.321	S	S	.	.	H	α-helix	trans	-101.3	-11.8	-177.8	-56.8	0	0	0	0	113.4	D105 T106 L107 R111 T112 P121	D105-V109 WeakPolarHBondContact O-CG2 3.33Å; D105-V109 PolarHBondContact O-N 3.45Å; T106-V109 WeakPolarHBondContact O-CG2 3.18Å; T106-V109 PolarHBondContact O-N 2.73Å; L107-V109 VanDerWaalsContact C-N 3.29Å; L107-V109 PolarHBondContact O-N 2.83Å; V109-R111 VanDerWaalsContact C-N 3.25Å; V109-R111 PolarHBondContact O-N 2.75Å; V109-R111 VanDerWaalsContact O-N 3.17Å; V109-T112 WeakPolarHBondContact O-CA 3.11Å; V109-T112 WeakPolarHBondContact O-CB 3.35Å; V109-T112 PolarHBondContact O-N 2.97Å; V109-T112 PolarHBondContact O-OG1 3.09Å; V109-P121 HydrophobicContact CG2-CB 3.75Å; V109-P121 HydrophobicContact CG2-CG 3.53Å
110	I	83.9	Confident	82.9	Confident	18 Å²	18	61.8 Å²	61.8	9%	0.092	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-36.3	-172.8	-159.5	78	0	0	0	113.1	T106 L107 T112 L113 M124 L154 V158 L161	T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 PolarHBondContact O-N 3.31Å; L107-I110 WeakPolarHBondContact O-CG2 3.37Å; I110-T112 PolarHBondContact O-N 3.44Å; I110-T112 VanDerWaalsContact O-N 3.14Å; I110-L113 HydrophobicContact CD1-CD1 3.7Å; I110-L113 WeakPolarHBondContact O-CB 3.46Å; I110-L113 PolarHBondContact O-N 2.75Å; I110-L113 VanDerWaalsContact O-N 3.08Å; I110-M124 HydrophobicContact CD1-CE 4.19Å; I110-L154 HydrophobicContact CG2-CB 3.97Å; I110-L154 HydrophobicContact CG2-CD1 3.62Å; I110-L154 HydrophobicContact CG2-CG 4.44Å; I110-V158 HydrophobicContact CB-CG2 3.96Å; I110-V158 HydrophobicContact CD1-CG2 4.24Å; I110-V158 HydrophobicContact CG1-CG2 3.86Å; I110-V158 HydrophobicContact CG2-CG2 3.82Å; I110-L161 HydrophobicContact CD1-CD2 3.26Å; I110-L161 HydrophobicContact CG1-CD2 4.33Å
111	R	81.2	Confident	82.5	Confident	96 Å²	96	60.8 Å²	60.8	36%	0.362	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22	176.6	-172.9	177.8	-76.2	149.2	1.1	112.5	V109 L154 C403 R404	V109-R111 VanDerWaalsContact C-N 3.25Å; V109-R111 PolarHBondContact O-N 2.75Å; V109-R111 VanDerWaalsContact O-N 3.17Å; R111-L154 HydrophobicContact CB-CD1 3.95Å; R111-L154 HydrophobicContact CG-CD1 4.48Å; R111-C403 WeakPolarHBondContact CD-O 3.23Å; R111-C403 PolarHBondContact NE-O 2.96Å; R111-R404 HydrophobicContact CG-CG 3.99Å; R111-R404 WeakPolarHBondContact O-CD 3.26Å; R111-R404 WeakPolarHBondContact O-CG 3.37Å
112	T	78.6	Confident	82.3	Confident	91 Å²	91	66.6 Å²	66.6	56%	0.558	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-9.6	179.7	72.2	0	0	0	0	113.4	V109 I110 V114 Q118	V109-T112 WeakPolarHBondContact O-CA 3.11Å; V109-T112 WeakPolarHBondContact O-CB 3.35Å; V109-T112 PolarHBondContact O-N 2.97Å; V109-T112 PolarHBondContact O-OG1 3.09Å; I110-T112 PolarHBondContact O-N 3.44Å; I110-T112 VanDerWaalsContact O-N 3.14Å; T112-V114 WeakPolarHBondContact O-CG2 3.22Å; T112-V114 PolarHBondContact O-N 3.08Å; T112-Q118 PolarHBondContact O-OE1 3.21Å
113	L	75.9	Confident	82.2	Confident	48 Å²	48	66.7 Å²	66.7	25%	0.251	35%	0.353	S	S	.	.			trans	-76.9	105.2	172.2	-62	-179.5	0	0	0	108.7	I110 P121 R404	I110-L113 HydrophobicContact CD1-CD1 3.7Å; I110-L113 WeakPolarHBondContact O-CB 3.46Å; I110-L113 PolarHBondContact O-N 2.75Å; I110-L113 VanDerWaalsContact O-N 3.08Å; L113-P121 HydrophobicContact CD1-CG 3.89Å; L113-P121 HydrophobicContact CD2-CG 3.88Å; L113-P121 HydrophobicContact CG-CG 4.25Å; L113-R404 PolarHBondContact O-NH1 2.95Å
114	V	70.4	Confident	82	Confident	32 Å²	32	67.3 Å²	67.3	19%	0.194	36%	0.356	C	S	.	.			trans	-117.9	-45	-168.2	167.4	0	0	0	0	108.6	T112 L406 W408 S413	T112-V114 WeakPolarHBondContact O-CG2 3.22Å; T112-V114 PolarHBondContact O-N 3.08Å; V114-L406 HydrophobicContact CB-CD1 4.49Å; V114-L406 HydrophobicContact CG1-CD1 3.84Å; V114-L406 HydrophobicContact CG2-CD1 3.7Å; V114-W408 HydrophobicContact CB-CH2 4.13Å; V114-W408 HydrophobicContact CB-CZ2 4.42Å; V114-W408 HydrophobicContact CG1-CH2 3.16Å; V114-W408 HydrophobicContact CG1-CZ2 3.55Å; V114-W408 HydrophobicContact CG1-CZ3 4.09Å; V114-W408 VanDerWaalsContact O-CH2 3.26Å; V114-W408 WeakPolarHBondContact O-CH2 3.49Å; V114-S413 VanDerWaalsContact CG1-OG 3.28Å; V114-S413 WeakPolarHBondContact CG1-OG 3.28Å
115	D	63.2	Low	81.9	Confident	76 Å²	76	66.7 Å²	66.7	41%	0.406	35%	0.353	S	S	.	.			trans	-106.2	136.6	-172.7	-165.3	-16.5	0	0	0	110.9	D117 Q118	D115-D117 PolarHBondContact O-N 3.23Å; D115-D117 PolarHBondContact OD1-N 2.93Å; D115-Q118 HydrophobicContact CB-CB 4.49Å; D115-Q118 HydrophobicContact CB-CG 3.88Å; D115-Q118 WeakPolarHBondContact O-CB 3.28Å; D115-Q118 PolarHBondContact O-N 3.12Å; D115-Q118 VanDerWaalsContact O-N 3.11Å
116	N	61.3	Low	81.9	Confident	101 Å²	101	64.6 Å²	64.6	54%	0.54	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.2	174.7	-73.9	-22.6	0	0	0	111.9	Q118 E387	N116-Q118 VanDerWaalsContact C-N 3.35Å; N116-E387 PolarHBondContact ND2-O 2.8Å; N116-E387 VanDerWaalsContact ND2-O 3.11Å
117	D	62.6	Low	82	Confident	147 Å²	147	64.6 Å²	64.6	79%	0.786	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.4	176.2	-71.7	-27.5	0	0	0	113.5	D115	D115-D117 PolarHBondContact O-N 3.23Å; D115-D117 PolarHBondContact OD1-N 2.93Å
118	Q	73.2	Confident	82.1	Confident	89 Å²	89	65.9 Å²	65.9	42%	0.416	35%	0.347	S	S	.	.	S	Bend	trans	-71.5	136.1	176	-82.4	165.7	8.6	0	0	111.4	T112 D115 N116	T112-Q118 PolarHBondContact O-OE1 3.21Å; D115-Q118 HydrophobicContact CB-CB 4.49Å; D115-Q118 HydrophobicContact CB-CG 3.88Å; D115-Q118 WeakPolarHBondContact O-CB 3.28Å; D115-Q118 PolarHBondContact O-N 3.12Å; D115-Q118 VanDerWaalsContact O-N 3.11Å; N116-Q118 VanDerWaalsContact C-N 3.35Å
119	E	78.8	Confident	82.3	Confident	181 Å²	181	67.8 Å²	67.8	85%	0.846	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-59.9	132.5	171.4	-73	-172.9	167.8	0	0	110.1
120	P	84.1	Confident	82.6	Confident	68 Å²	68	68.1 Å²	68.1	44%	0.442	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-56.7	147.9	176.8	-25.3	33.4	0	0	0	111.7	M124 I125	P120-M124 HydrophobicContact CB-SD 4.13Å; P120-I125 HydrophobicContact CB-CD1 4.38Å; P120-I125 HydrophobicContact CB-CG1 3.99Å; P120-I125 WeakPolarHBondContact O-CD1 3.38Å
121	P	87.6	Confident	83.1	Confident	21 Å²	21	67.4 Å²	67.4	14%	0.136	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57.6	145.3	178	-23.6	33.5	0	0	0	112	V109 L113 S123 M124 I125	V109-P121 HydrophobicContact CG2-CB 3.75Å; V109-P121 HydrophobicContact CG2-CG 3.53Å; L113-P121 HydrophobicContact CD1-CG 3.89Å; L113-P121 HydrophobicContact CD2-CG 3.88Å; L113-P121 HydrophobicContact CG-CG 4.25Å; P121-S123 PolarHBondContact O-N 3.4Å; P121-S123 VanDerWaalsContact O-N 3.1Å; P121-M124 HydrophobicContact CB-CB 4.43Å; P121-M124 WeakPolarHBondContact O-CB 3.47Å; P121-M124 PolarHBondContact O-N 3.13Å; P121-I125 PolarHBondContact O-N 2.81Å
122	Y	90.6	Very high	83.7	Confident	141 Å²	141	70 Å²	70	55%	0.553	36%	0.355	S	S	*	.	H	α-helix	trans	-51.9	-38.3	177.3	173.3	-104.5	0	0	0	113.1	I125 T126	Y122-I125 PolarHBondContact O-N 3.19Å; Y122-T126 WeakPolarHBondContact CE2-OG1 3.31Å; Y122-T126 VanDerWaalsContact CZ-OG1 3.25Å; Y122-T126 WeakPolarHBondContact O-CB 3.37Å; Y122-T126 PolarHBondContact O-N 3.34Å; Y122-T126 PolarHBondContact O-OG1 3.37Å
123	S	92.2	Very high	84.5	Confident	9 Å²	9	69.6 Å²	69.6	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-42.2	177.9	56.3	0	0	0	0	112.2	L102 T106 P121 L127	L102-S123 WeakPolarHBondContact O-CB 3.49Å; T106-S123 WeakPolarHBondContact CA-OG 3.11Å; T106-S123 PolarHBondContact N-OG 3.01Å; T106-S123 WeakPolarHBondContact OG1-CB 3.28Å; T106-S123 PolarHBondContact OG1-OG 3.13Å; P121-S123 PolarHBondContact O-N 3.4Å; P121-S123 VanDerWaalsContact O-N 3.1Å; S123-L127 WeakPolarHBondContact O-CB 3.29Å; S123-L127 WeakPolarHBondContact O-CD1 3.27Å; S123-L127 WeakPolarHBondContact O-CG 3.34Å; S123-L127 PolarHBondContact O-N 3.06Å
124	M	91.3	Very high	85.4	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.059	35%	0.354	C	S	.	.	H	α-helix	trans	-67	-46.9	177.4	178.3	176	-82.3	0	0	111.4	T106 I110 P120 P121 T126 L127 H128 L161 L162	T106-M124 HydrophobicContact CG2-CB 4.35Å; T106-M124 HydrophobicContact CG2-CE 3.87Å; I110-M124 HydrophobicContact CD1-CE 4.19Å; P120-M124 HydrophobicContact CB-SD 4.13Å; P121-M124 HydrophobicContact CB-CB 4.43Å; P121-M124 WeakPolarHBondContact O-CB 3.47Å; P121-M124 PolarHBondContact O-N 3.13Å; M124-T126 VanDerWaalsContact C-N 3.31Å; M124-T126 PolarHBondContact O-N 2.75Å; M124-L127 PolarHBondContact O-N 3.06Å; M124-H128 WeakPolarHBondContact CG-CE1 3.25Å; M124-H128 PolarHBondContact O-N 2.77Å; M124-L161 HydrophobicContact CE-CD2 3.36Å; M124-L161 HydrophobicContact CE-CG 3.84Å; M124-L162 HydrophobicContact CB-CD2 4.41Å; M124-L162 HydrophobicContact CE-CD2 4.07Å; M124-L162 HydrophobicContact CG-CD2 3.93Å
125	I	91.4	Very high	86.6	Confident	65 Å²	65	73.5 Å²	73.5	33%	0.333	37%	0.369	S	S	.	.	H	α-helix	trans	-56.9	-48.1	176.5	-62	172.2	0	0	0	110.2	P120 P121 Y122 L127 H128 E129	P120-I125 HydrophobicContact CB-CD1 4.38Å; P120-I125 HydrophobicContact CB-CG1 3.99Å; P120-I125 WeakPolarHBondContact O-CD1 3.38Å; P121-I125 PolarHBondContact O-N 2.81Å; Y122-I125 PolarHBondContact O-N 3.19Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 3.39Å; I125-H128 PolarHBondContact O-N 3.38Å; I125-E129 HydrophobicContact CG2-CG 4.45Å; I125-E129 WeakPolarHBondContact O-CG 3.5Å; I125-E129 PolarHBondContact O-N 3.33Å
126	T	93.8	Very high	88.1	Confident	20 Å²	20	70.2 Å²	70.2	12%	0.123	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-40.7	-179.9	-54	0	0	0	0	111.5	L102 Y122 M124 E129 M130	L102-T126 HydrophobicContact CD1-CG2 3.69Å; Y122-T126 WeakPolarHBondContact CE2-OG1 3.31Å; Y122-T126 VanDerWaalsContact CZ-OG1 3.25Å; Y122-T126 WeakPolarHBondContact O-CB 3.37Å; Y122-T126 PolarHBondContact O-N 3.34Å; Y122-T126 PolarHBondContact O-OG1 3.37Å; M124-T126 VanDerWaalsContact C-N 3.31Å; M124-T126 PolarHBondContact O-N 2.75Å; T126-E129 PolarHBondContact O-N 3.33Å; T126-M130 HydrophobicContact CG2-SD 4.4Å; T126-M130 VanDerWaalsContact O-CG 3.24Å; T126-M130 WeakPolarHBondContact O-CG 3.49Å; T126-M130 PolarHBondContact O-N 2.79Å
127	L	94.3	Very high	89.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-42.2	176.4	-74.2	165.2	0	0	0	112	V99 L102 V103 S123 M124 I125 M130 A131 V140 L162	V99-L127 HydrophobicContact CG1-CD2 3.71Å; L102-L127 HydrophobicContact CB-CD1 4.02Å; L102-L127 HydrophobicContact CB-CD2 3.85Å; L102-L127 HydrophobicContact CB-CG 3.8Å; L102-L127 HydrophobicContact CD1-CD2 4.29Å; L102-L127 HydrophobicContact CD1-CG 4.4Å; V103-L127 HydrophobicContact CG2-CD1 4.03Å; V103-L127 HydrophobicContact CG2-CD2 4.04Å; S123-L127 WeakPolarHBondContact O-CB 3.29Å; S123-L127 WeakPolarHBondContact O-CD1 3.27Å; S123-L127 WeakPolarHBondContact O-CG 3.34Å; S123-L127 PolarHBondContact O-N 3.06Å; M124-L127 PolarHBondContact O-N 3.06Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 3.39Å; L127-M130 PolarHBondContact O-N 3.39Å; L127-A131 WeakPolarHBondContact O-CB 3.22Å; L127-A131 PolarHBondContact O-N 2.89Å; L127-V140 HydrophobicContact CD2-CG1 4.42Å; L127-V140 HydrophobicContact CD2-CG2 3.9Å; L127-L162 HydrophobicContact CB-CD2 4.42Å; L127-L162 HydrophobicContact CD1-CD1 3.97Å; L127-L162 HydrophobicContact CD1-CD2 3.97Å
128	H	93.6	Very high	91.4	Very high	38 Å²	38	58.9 Å²	58.9	18%	0.176	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-42.9	177.1	-63.7	167	0	0	0	111.9	M124 I125 M130 A131 E132 E165	M124-H128 WeakPolarHBondContact CG-CE1 3.25Å; M124-H128 PolarHBondContact O-N 2.77Å; I125-H128 PolarHBondContact O-N 3.38Å; H128-M130 VanDerWaalsContact C-N 3.29Å; H128-M130 PolarHBondContact O-N 2.87Å; H128-A131 PolarHBondContact O-N 2.85Å; H128-A131 VanDerWaalsContact O-N 3.13Å; H128-E132 PolarHBondContact O-N 2.89Å; H128-E165 WeakPolarHBondContact CE1-CB 3.41Å
129	E	93.5	Very high	92.4	Very high	119 Å²	119	59.3 Å²	59.3	56%	0.556	29%	0.294	S	S	*	.	H	α-helix	trans	-59.2	-39.5	173.9	-72.8	177.6	174.6	0	0	111.7	I125 T126 E132	I125-E129 HydrophobicContact CG2-CG 4.45Å; I125-E129 WeakPolarHBondContact O-CG 3.5Å; I125-E129 PolarHBondContact O-N 3.33Å; T126-E129 PolarHBondContact O-N 3.33Å; E129-E132 WeakPolarHBondContact O-CB 3.37Å; E129-E132 PolarHBondContact O-N 2.85Å
130	M	93.5	Very high	93.3	Very high	58 Å²	58	50.8 Å²	50.8	29%	0.286	25%	0.254	S	S	.	.	H	α-helix	trans	-66	-38.8	175.4	-71.1	-178.9	67	0	0	112.2	V99 L102 T126 L127 H128 E132 T133 G136 V140	V99-M130 HydrophobicContact CG2-CE 3.34Å; V99-M130 HydrophobicContact CG2-SD 4.17Å; L102-M130 HydrophobicContact CD1-SD 4.16Å; T126-M130 HydrophobicContact CG2-SD 4.4Å; T126-M130 VanDerWaalsContact O-CG 3.24Å; T126-M130 WeakPolarHBondContact O-CG 3.49Å; T126-M130 PolarHBondContact O-N 2.79Å; L127-M130 PolarHBondContact O-N 3.39Å; H128-M130 VanDerWaalsContact C-N 3.29Å; H128-M130 PolarHBondContact O-N 2.87Å; M130-E132 PolarHBondContact O-N 2.93Å; M130-T133 PolarHBondContact O-N 2.99Å; M130-T133 PolarHBondContact O-OG1 3.2Å; M130-G136 WeakPolarHBondContact O-CA 3.1Å; M130-V140 HydrophobicContact CB-CG2 4.46Å
131	A	94.9	Very high	93.9	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-2.6	-179.2	0	0	0	0	0	114.3	L127 H128 T133 W137 C166	L127-A131 WeakPolarHBondContact O-CB 3.22Å; L127-A131 PolarHBondContact O-N 2.89Å; H128-A131 PolarHBondContact O-N 2.85Å; H128-A131 VanDerWaalsContact O-N 3.13Å; A131-T133 PolarHBondContact O-N 2.91Å; A131-W137 HydrophobicContact CB-CB 4.37Å; A131-C166 HydrophobicContact CB-CB 4.31Å; A131-C166 WeakPolarHBondContact CB-SG 3.43Å
132	E	93.9	Very high	94.4	Very high	149 Å²	149	49 Å²	49	70%	0.696	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.4	171.8	-66.6	-172.4	172.3	0	0	113.5	H128 E129 M130	H128-E132 PolarHBondContact O-N 2.89Å; E129-E132 WeakPolarHBondContact O-CB 3.37Å; E129-E132 PolarHBondContact O-N 2.85Å; M130-E132 PolarHBondContact O-N 2.93Å
133	T	94.9	Very high	94.7	Very high	84 Å²	84	42.2 Å²	42.2	52%	0.515	21%	0.212	S	C	.	.	S	Bend	trans	-114.8	147.7	176.2	67	0	0	0	0	111	M130 A131 E135 G136 W137	M130-T133 PolarHBondContact O-N 2.99Å; M130-T133 PolarHBondContact O-OG1 3.2Å; A131-T133 PolarHBondContact O-N 2.91Å; T133-E135 VanDerWaalsContact C-N 3.31Å; T133-E135 PolarHBondContact O-N 3.26Å; T133-G136 PolarHBondContact O-N 2.89Å; T133-G136 PolarHBondContact OG1-N 2.84Å; T133-W137 WeakPolarHBondContact O-CB 3.31Å; T133-W137 PolarHBondContact O-N 2.91Å
134	D	94.5	Very high	94.9	Very high	53 Å²	53	41.8 Å²	41.8	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-55.9	-43.2	179.3	-75	-8.3	0	0	0	112.8	L138 T170 A173	D134-L138 WeakPolarHBondContact O-CB 3.24Å; D134-L138 VanDerWaalsContact O-CG 3.25Å; D134-L138 WeakPolarHBondContact O-CG 3.43Å; D134-L138 PolarHBondContact O-N 3.37Å; D134-T170 VanDerWaalsContact CG-OG1 3.26Å; D134-T170 WeakPolarHBondContact OD1-CG2 3.47Å; D134-T170 PolarHBondContact OD1-OG1 3.12Å; D134-T170 WeakPolarHBondContact OD2-CG2 3.27Å; D134-T170 PolarHBondContact OD2-OG1 2.82Å; D134-A173 HydrophobicContact CB-CB 4.01Å
135	E	94.8	Very high	95.2	Very high	108 Å²	108	41.5 Å²	41.5	51%	0.505	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-43.5	178.9	-62.9	-60.4	144.3	0	0	111.7	T133 L138 E139 K176	T133-E135 VanDerWaalsContact C-N 3.31Å; T133-E135 PolarHBondContact O-N 3.26Å; E135-L138 WeakPolarHBondContact O-CB 3.46Å; E135-L138 PolarHBondContact O-N 3.49Å; E135-E139 WeakPolarHBondContact O-CG 3.36Å; E135-E139 PolarHBondContact O-N 2.95Å; E135-K176 IonicContact OE1-NZ 2.79Å; E135-K176 PolarHBondContact OE1-NZ 3.38Å
136	G	95.1	Very high	95.4	Very high	7 Å²	7	44.6 Å²	44.6	7%	0.072	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-37.5	176.9	0	0	0	0	0	112.5	M130 T133 E139 V140	M130-G136 WeakPolarHBondContact O-CA 3.1Å; T133-G136 PolarHBondContact O-N 2.89Å; T133-G136 PolarHBondContact OG1-N 2.84Å; G136-E139 PolarHBondContact O-N 3.22Å; G136-V140 WeakPolarHBondContact O-CG2 3.47Å; G136-V140 PolarHBondContact O-N 2.87Å
137	W	96.4	Very high	95.5	Very high	6 Å²	6	45 Å²	45	2%	0.023	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-45.1	172.6	-179.3	91.9	0	0	0	111.5	A131 T133 E139 V140 V141 P169 A173 L174 L177 L208	A131-W137 HydrophobicContact CB-CB 4.37Å; T133-W137 WeakPolarHBondContact O-CB 3.31Å; T133-W137 PolarHBondContact O-N 2.91Å; W137-E139 VanDerWaalsContact C-N 3.32Å; W137-E139 PolarHBondContact O-N 3.46Å; W137-V140 PolarHBondContact O-N 3.46Å; W137-V141 HydrophobicContact CD2-CG2 3.87Å; W137-V141 HydrophobicContact CE3-CG2 4.08Å; W137-V141 HydrophobicContact CH2-CG2 3.9Å; W137-V141 HydrophobicContact CZ2-CG2 3.67Å; W137-V141 HydrophobicContact CZ3-CG2 4.1Å; W137-V141 WeakPolarHBondContact O-CG2 3.28Å; W137-V141 PolarHBondContact O-N 3.35Å; W137-P169 HydrophobicContact CD2-CB 4.08Å; W137-P169 HydrophobicContact CE3-CB 4.13Å; W137-P169 HydrophobicContact CH2-CB 3.7Å; W137-P169 HydrophobicContact CH2-CG 3.83Å; W137-P169 HydrophobicContact CZ2-CB 3.62Å; W137-P169 HydrophobicContact CZ2-CG 3.57Å; W137-P169 HydrophobicContact CZ3-CB 3.96Å; W137-A173 HydrophobicContact CE3-CB 4.29Å; W137-A173 HydrophobicContact CZ3-CB 4.39Å; W137-L174 HydrophobicContact CH2-CD2 4.18Å; W137-L177 HydrophobicContact CH2-CD2 3.71Å; W137-L177 HydrophobicContact CZ3-CB 4.32Å; W137-L177 HydrophobicContact CZ3-CD2 3.99Å; W137-L208 HydrophobicContact CH2-CD1 4.28Å; W137-L208 HydrophobicContact CH2-CD2 4.19Å; W137-L208 HydrophobicContact CZ2-CD2 3.68Å
138	L	96.6	Very high	95.6	Very high	4 Å²	4	45 Å²	45	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-40	174.7	-74.3	169.9	0	0	0	112	D134 E135 Q142 K176 L177 I180	D134-L138 WeakPolarHBondContact O-CB 3.24Å; D134-L138 VanDerWaalsContact O-CG 3.25Å; D134-L138 WeakPolarHBondContact O-CG 3.43Å; D134-L138 PolarHBondContact O-N 3.37Å; E135-L138 WeakPolarHBondContact O-CB 3.46Å; E135-L138 PolarHBondContact O-N 3.49Å; L138-Q142 WeakPolarHBondContact O-CB 3.43Å; L138-Q142 WeakPolarHBondContact O-CG 3.42Å; L138-Q142 PolarHBondContact O-N 3.18Å; L138-Q142 PolarHBondContact O-NE2 2.99Å; L138-Q142 VanDerWaalsContact O-NE2 3.11Å; L138-K176 HydrophobicContact CD1-CB 3.91Å; L138-K176 HydrophobicContact CD1-CD 3.9Å; L138-K176 HydrophobicContact CD2-CB 4.49Å; L138-L177 HydrophobicContact CD2-CB 3.73Å; L138-L177 HydrophobicContact CD2-CD1 4.23Å; L138-I180 HydrophobicContact CD2-CD1 4.35Å
139	E	95.9	Very high	95.7	Very high	99 Å²	99	45.4 Å²	45.4	46%	0.463	22%	0.223	S	C	.	.	H	α-helix	trans	-64	-43	175.5	-73.8	-173.6	-177.3	0	0	112.2	V99 E135 G136 W137 S143	V99-E139 HydrophobicContact CG2-CB 4.3Å; E135-E139 WeakPolarHBondContact O-CG 3.36Å; E135-E139 PolarHBondContact O-N 2.95Å; G136-E139 PolarHBondContact O-N 3.22Å; W137-E139 VanDerWaalsContact C-N 3.32Å; W137-E139 PolarHBondContact O-N 3.46Å; E139-S143 VanDerWaalsContact O-CB 3.31Å; E139-S143 WeakPolarHBondContact O-CB 3.48Å; E139-S143 PolarHBondContact O-N 3.15Å
140	V	96.6	Very high	95.6	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-51.1	176.4	172.8	0	0	0	0	110.5	V99 L127 M130 G136 W137 Q142 S143 L144	V99-V140 HydrophobicContact CG1-CG2 4.05Å; L127-V140 HydrophobicContact CD2-CG1 4.42Å; L127-V140 HydrophobicContact CD2-CG2 3.9Å; M130-V140 HydrophobicContact CB-CG2 4.46Å; G136-V140 WeakPolarHBondContact O-CG2 3.47Å; G136-V140 PolarHBondContact O-N 2.87Å; W137-V140 PolarHBondContact O-N 3.46Å; V140-Q142 PolarHBondContact O-N 2.67Å; V140-S143 WeakPolarHBondContact O-CB 2.96Å; V140-S143 PolarHBondContact O-N 3.28Å; V140-S143 VanDerWaalsContact O-N 3.11Å; V140-L144 HydrophobicContact CG1-CD1 4.25Å; V140-L144 HydrophobicContact CG1-CG 4.46Å; V140-L144 WeakPolarHBondContact O-CG 3.14Å; V140-L144 PolarHBondContact O-N 2.87Å
141	V	97	Very high	95.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-46.9	178.8	172.1	0	0	0	0	111.4	W137 S143 L144 I145 L163 L177 V204	W137-V141 HydrophobicContact CD2-CG2 3.87Å; W137-V141 HydrophobicContact CE3-CG2 4.08Å; W137-V141 HydrophobicContact CH2-CG2 3.9Å; W137-V141 HydrophobicContact CZ2-CG2 3.67Å; W137-V141 HydrophobicContact CZ3-CG2 4.1Å; W137-V141 WeakPolarHBondContact O-CG2 3.28Å; W137-V141 PolarHBondContact O-N 3.35Å; V141-S143 VanDerWaalsContact C-N 3.31Å; V141-S143 PolarHBondContact O-N 3.14Å; V141-L144 WeakPolarHBondContact O-CB 3.34Å; V141-L144 PolarHBondContact O-N 2.84Å; V141-I145 HydrophobicContact CG1-CD1 4.23Å; V141-I145 WeakPolarHBondContact O-CG1 3.08Å; V141-I145 PolarHBondContact O-N 2.86Å; V141-I145 VanDerWaalsContact O-N 3.11Å; V141-L163 HydrophobicContact CG2-CD2 3.92Å; V141-L177 HydrophobicContact CG1-CD1 3.75Å; V141-L177 HydrophobicContact CG1-CD2 4.11Å; V141-V204 HydrophobicContact CG1-CG1 3.71Å
142	Q	97	Very high	95.2	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-34.6	178.4	-68.3	172	64.2	0	0	112.2	L138 V140 I145 R146 I180	L138-Q142 WeakPolarHBondContact O-CB 3.43Å; L138-Q142 WeakPolarHBondContact O-CG 3.42Å; L138-Q142 PolarHBondContact O-N 3.18Å; L138-Q142 PolarHBondContact O-NE2 2.99Å; L138-Q142 VanDerWaalsContact O-NE2 3.11Å; V140-Q142 PolarHBondContact O-N 2.67Å; Q142-I145 PolarHBondContact O-N 2.69Å; Q142-R146 VanDerWaalsContact CB-NH1 3.28Å; Q142-R146 VanDerWaalsContact O-CG 3.31Å; Q142-R146 WeakPolarHBondContact O-CG 3.31Å; Q142-R146 PolarHBondContact O-N 3.07Å; Q142-I180 HydrophobicContact CG-CG2 4.34Å
143	S	97.3	Very high	94.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-49.4	173.5	178.9	0	0	0	0	111.3	V99 D100 V103 E139 V140 V141 I145 R146 V147	V99-S143 PolarHBondContact O-OG 3.03Å; D100-S143 VanDerWaalsContact CA-OG 3.26Å; D100-S143 WeakPolarHBondContact CA-OG 3.35Å; D100-S143 PolarHBondContact N-OG 2.85Å; D100-S143 WeakPolarHBondContact OD1-CB 3.43Å; D100-S143 PolarHBondContact OD1-OG 3.42Å; D100-S143 VanDerWaalsContact OD1-OG 3.11Å; V103-S143 WeakPolarHBondContact CG2-OG 3.31Å; E139-S143 VanDerWaalsContact O-CB 3.31Å; E139-S143 WeakPolarHBondContact O-CB 3.48Å; E139-S143 PolarHBondContact O-N 3.15Å; V140-S143 WeakPolarHBondContact O-CB 2.96Å; V140-S143 PolarHBondContact O-N 3.28Å; V140-S143 VanDerWaalsContact O-N 3.11Å; V141-S143 VanDerWaalsContact C-N 3.31Å; V141-S143 PolarHBondContact O-N 3.14Å; S143-I145 PolarHBondContact O-N 3.28Å; S143-R146 PolarHBondContact O-N 3.13Å; S143-V147 WeakPolarHBondContact O-CG2 3.4Å; S143-V147 PolarHBondContact O-N 3.29Å
144	L	97.3	Very high	94.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-52.4	-41.7	175	-67.2	172.6	0	0	0	111.8	V103 V140 V141 I148 I159 L162 L163 N200	V103-L144 HydrophobicContact CG1-CD2 3.87Å; V103-L144 HydrophobicContact CG2-CD2 4.03Å; V140-L144 HydrophobicContact CG1-CD1 4.25Å; V140-L144 HydrophobicContact CG1-CG 4.46Å; V140-L144 WeakPolarHBondContact O-CG 3.14Å; V140-L144 PolarHBondContact O-N 2.87Å; V141-L144 WeakPolarHBondContact O-CB 3.34Å; V141-L144 PolarHBondContact O-N 2.84Å; L144-I148 HydrophobicContact CB-CD1 4.35Å; L144-I148 HydrophobicContact CD2-CD1 3.74Å; L144-I159 HydrophobicContact CB-CG1 4.41Å; L144-I159 HydrophobicContact CD1-CG2 4.5Å; L144-I159 HydrophobicContact CD2-CG1 4.45Å; L144-L162 HydrophobicContact CD2-CB 4.48Å; L144-L162 HydrophobicContact CD2-CD1 3.67Å; L144-L163 HydrophobicContact CD1-CD1 4.41Å; L144-L163 HydrophobicContact CD1-CD2 3.86Å; L144-L163 HydrophobicContact CD1-CG 3.9Å; L144-N200 PolarHBondContact O-ND2 2.79Å
145	I	96.9	Very high	94.4	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-43.1	177.2	-67.4	172.4	0	0	0	112.1	V141 Q142 S143 L181 K197 N200 T201 V204	V141-I145 HydrophobicContact CG1-CD1 4.23Å; V141-I145 WeakPolarHBondContact O-CG1 3.08Å; V141-I145 PolarHBondContact O-N 2.86Å; V141-I145 VanDerWaalsContact O-N 3.11Å; Q142-I145 PolarHBondContact O-N 2.69Å; S143-I145 PolarHBondContact O-N 3.28Å; I145-L181 HydrophobicContact CD1-CD2 3.68Å; I145-K197 HydrophobicContact CG2-CG 3.79Å; I145-N200 HydrophobicContact CB-CB 4.5Å; I145-N200 PolarHBondContact O-ND2 2.9Å; I145-T201 WeakPolarHBondContact CG2-OG1 3.17Å; I145-V204 HydrophobicContact CD1-CG2 4.34Å; I145-V204 HydrophobicContact CG1-CB 4.46Å; I145-V204 HydrophobicContact CG1-CG2 3.86Å
146	R	95.4	Very high	94.4	Very high	130 Å²	130	31.4 Å²	31.4	49%	0.491	16%	0.155	S	C	.	.	H	α-helix	trans	-77.1	-42.5	-172.7	-74.3	-172.5	-52	-97.6	-4.6	114.3	D100 Q142 S143	D100-R146 IonicContact OD1-CZ 2.71Å; D100-R146 IonicContact OD1-NE 2.65Å; D100-R146 IonicContact OD1-NH2 2.69Å; D100-R146 PolarHBondContact OD1-NH2 2.91Å; D100-R146 IonicContact OD2-NH2 3.72Å; Q142-R146 VanDerWaalsContact CB-NH1 3.28Å; Q142-R146 VanDerWaalsContact O-CG 3.31Å; Q142-R146 WeakPolarHBondContact O-CG 3.31Å; Q142-R146 PolarHBondContact O-N 3.07Å; S143-R146 PolarHBondContact O-N 3.13Å
147	V	96.1	Very high	94.1	Very high	29 Å²	29	31.3 Å²	31.3	18%	0.176	15%	0.154	C	C	.	.	H	α-helix	trans	-106.1	-19.3	-158.2	-49.9	0	0	0	0	115	D100 V103 L104 S143 P149	D100-V147 HydrophobicContact CB-CG1 3.69Å; D100-V147 VanDerWaalsContact CG-CG1 3.46Å; V103-V147 HydrophobicContact CB-CG2 3.87Å; V103-V147 HydrophobicContact CG1-CG2 3.51Å; L104-V147 HydrophobicContact CD1-CB 4.46Å; L104-V147 HydrophobicContact CD2-CB 4.25Å; L104-V147 HydrophobicContact CD2-CG2 4.08Å; L104-V147 HydrophobicContact CG-CB 4.24Å; L104-V147 HydrophobicContact CG-CG2 3.98Å; S143-V147 WeakPolarHBondContact O-CG2 3.4Å; S143-V147 PolarHBondContact O-N 3.29Å; V147-P149 WeakPolarHBondContact O-CD 3.48Å
148	I	96.3	Very high	93.9	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.153	C	C	.	.			trans	-73.5	117.9	-176.4	-64.4	177.3	0	0	0	109.4	V103 L107 L144 G155 V158 I159 N200	V103-I148 HydrophobicContact CG1-CD1 4.07Å; V103-I148 HydrophobicContact CG1-CG1 3.81Å; L107-I148 HydrophobicContact CD2-CG2 4.46Å; L144-I148 HydrophobicContact CB-CD1 4.35Å; L144-I148 HydrophobicContact CD2-CD1 3.74Å; I148-G155 VanDerWaalsContact CG2-CA 3.4Å; I148-V158 HydrophobicContact CD1-CG1 4.48Å; I148-I159 HydrophobicContact CD1-CD1 3.97Å; I148-I159 HydrophobicContact CD1-CG1 3.34Å; I148-N200 PolarHBondContact O-ND2 3.1Å
149	P	95.3	Very high	93.8	Very high	45 Å²	45	30.8 Å²	30.8	29%	0.292	15%	0.152	S	C	.	.			trans	-70.6	154	-176.4	30.5	-36	0	0	0	111.6	L107 V147 E151 D152 R199	L107-P149 HydrophobicContact CD2-CG 4.17Å; V147-P149 WeakPolarHBondContact O-CD 3.48Å; P149-E151 VanDerWaalsContact C-N 3.3Å; P149-E151 PolarHBondContact O-N 2.8Å; P149-D152 HydrophobicContact CG-CB 3.79Å; P149-R199 PolarHBondContact O-NH2 2.82Å
150	L	92.7	Very high	93.7	Very high	27 Å²	27	26.5 Å²	26.5	14%	0.141	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-31.5	-177.4	-175.3	66.6	0	0	0	111.8	P195 A196 R199 T240	L150-P195 HydrophobicContact CD2-CB 3.93Å; L150-P195 HydrophobicContact CD2-CG 3.87Å; L150-A196 HydrophobicContact CB-CB 3.98Å; L150-R199 HydrophobicContact CD1-CB 4.13Å; L150-R199 HydrophobicContact CD1-CG 4.29Å; L150-T240 HydrophobicContact CD1-CG2 4.09Å
151	E	89.6	Confident	93.3	Very high	155 Å²	155	28.9 Å²	28.9	72%	0.724	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-12.5	-170.8	-61.5	69.8	-162.1	0	0	112.7	P149 P153	P149-E151 VanDerWaalsContact C-N 3.3Å; P149-E151 PolarHBondContact O-N 2.8Å; E151-P153 WeakPolarHBondContact O-CD 3.45Å
152	D	89.7	Confident	93	Very high	42 Å²	42	28.9 Å²	28.9	23%	0.225	15%	0.145	C	C	.	.			trans	-82	117.6	176.2	-166.5	-57.4	0	0	0	110.2	L107 P149 L154 G155	L107-D152 HydrophobicContact CD2-CB 4.21Å; P149-D152 HydrophobicContact CG-CB 3.79Å; D152-L154 PolarHBondContact O-N 3.3Å; D152-L154 WeakPolarHBondContact OD1-CA 3.24Å; D152-L154 PolarHBondContact OD1-N 2.79Å; D152-G155 PolarHBondContact O-N 3.49Å; D152-G155 PolarHBondContact OD1-N 3.13Å
153	P	84.8	Confident	92.8	Very high	41 Å²	41	26.7 Å²	26.7	27%	0.266	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.9	-176.3	28	-35.1	0	0	0	113.3	E151 S369	E151-P153 WeakPolarHBondContact O-CD 3.45Å; P153-S369 WeakPolarHBondContact CB-OG 3.47Å
154	L	89.6	Confident	92.4	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-7.8	178.2	-55.9	-178.1	0	0	0	112.3	L107 I110 R111 D152 A157 V158 V371	L107-L154 HydrophobicContact CD1-CB 4.44Å; I110-L154 HydrophobicContact CG2-CB 3.97Å; I110-L154 HydrophobicContact CG2-CD1 3.62Å; I110-L154 HydrophobicContact CG2-CG 4.44Å; R111-L154 HydrophobicContact CB-CD1 3.95Å; R111-L154 HydrophobicContact CG-CD1 4.48Å; D152-L154 PolarHBondContact O-N 3.3Å; D152-L154 WeakPolarHBondContact OD1-CA 3.24Å; D152-L154 PolarHBondContact OD1-N 2.79Å; L154-A157 WeakPolarHBondContact O-CA 3.39Å; L154-A157 WeakPolarHBondContact O-CB 3.23Å; L154-A157 PolarHBondContact O-N 3.14Å; L154-V158 PolarHBondContact O-N 2.95Å; L154-V371 HydrophobicContact CD2-CG2 4.02Å
155	G	93	Very high	91.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-46.8	-54.9	179.9	0	0	0	0	0	114.6	I148 D152 A157 V158 I159	I148-G155 VanDerWaalsContact CG2-CA 3.4Å; D152-G155 PolarHBondContact O-N 3.49Å; D152-G155 PolarHBondContact OD1-N 3.13Å; G155-A157 VanDerWaalsContact C-N 3.35Å; G155-A157 PolarHBondContact O-N 3.04Å; G155-V158 PolarHBondContact O-N 3.27Å; G155-I159 PolarHBondContact O-N 3.35Å
156	P	93.3	Very high	91.4	Very high	9 Å²	9	35.4 Å²	35.4	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-68.3	-32.5	178.6	6	1.8	0	0	0	113.1	V158 I159 T160 R199 F244 Y470	P156-V158 VanDerWaalsContact C-N 3.27Å; P156-V158 PolarHBondContact O-N 3.42Å; P156-I159 WeakPolarHBondContact O-CB 3.43Å; P156-I159 PolarHBondContact O-N 3.37Å; P156-T160 PolarHBondContact O-N 2.79Å; P156-T160 VanDerWaalsContact O-N 3.09Å; P156-T160 PolarHBondContact O-OG1 3.18Å; P156-R199 VanDerWaalsContact CD-NH1 3.3Å; P156-F244 HydrophobicContact CB-CD1 4.41Å; P156-F244 HydrophobicContact CB-CE1 3.38Å; P156-F244 HydrophobicContact CB-CE2 4.11Å; P156-F244 HydrophobicContact CB-CZ 3.21Å; P156-F244 HydrophobicContact CG-CE1 4.02Å; P156-F244 HydrophobicContact CG-CE2 3.84Å; P156-F244 HydrophobicContact CG-CZ 3.28Å; P156-Y470 HydrophobicContact CB-CD2 3.82Å; P156-Y470 HydrophobicContact CB-CE2 3.93Å; P156-Y470 HydrophobicContact CG-CD2 4.44Å
157	A	90.4	Very high	91.1	Very high	5 Å²	5	32.3 Å²	32.3	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-34.2	174.7	0	0	0	0	0	111.6	L154 G155 T160 L161 M468	L154-A157 WeakPolarHBondContact O-CA 3.39Å; L154-A157 WeakPolarHBondContact O-CB 3.23Å; L154-A157 PolarHBondContact O-N 3.14Å; G155-A157 VanDerWaalsContact C-N 3.35Å; G155-A157 PolarHBondContact O-N 3.04Å; A157-T160 PolarHBondContact O-N 2.85Å; A157-L161 WeakPolarHBondContact O-CB 3.44Å; A157-L161 PolarHBondContact O-N 2.9Å; A157-M468 HydrophobicContact CB-CE 4.26Å; A157-M468 HydrophobicContact CB-SD 4.45Å
158	V	91.6	Very high	90.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-37.1	173.3	169.6	0	0	0	0	112.1	T106 L107 I110 I148 L154 G155 P156 T160 L161 L162	T106-V158 HydrophobicContact CG2-CG1 4.39Å; L107-V158 HydrophobicContact CD1-CB 4.2Å; L107-V158 HydrophobicContact CD1-CG2 3.62Å; I110-V158 HydrophobicContact CB-CG2 3.96Å; I110-V158 HydrophobicContact CD1-CG2 4.24Å; I110-V158 HydrophobicContact CG1-CG2 3.86Å; I110-V158 HydrophobicContact CG2-CG2 3.82Å; I148-V158 HydrophobicContact CD1-CG1 4.48Å; L154-V158 PolarHBondContact O-N 2.95Å; G155-V158 PolarHBondContact O-N 3.27Å; P156-V158 VanDerWaalsContact C-N 3.27Å; P156-V158 PolarHBondContact O-N 3.42Å; V158-T160 VanDerWaalsContact C-N 3.34Å; V158-L161 PolarHBondContact O-N 3.49Å; V158-L162 HydrophobicContact CG1-CD1 3.71Å; V158-L162 HydrophobicContact CG1-CG 4.3Å; V158-L162 WeakPolarHBondContact O-CB 3.31Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 2.69Å
159	I	95.1	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-51.5	171.9	-63.6	174.3	0	0	0	109.5	L144 I148 G155 P156 L163 N200 A203 V204	L144-I159 HydrophobicContact CB-CG1 4.41Å; L144-I159 HydrophobicContact CD1-CG2 4.5Å; L144-I159 HydrophobicContact CD2-CG1 4.45Å; I148-I159 HydrophobicContact CD1-CD1 3.97Å; I148-I159 HydrophobicContact CD1-CG1 3.34Å; G155-I159 PolarHBondContact O-N 3.35Å; P156-I159 WeakPolarHBondContact O-CB 3.43Å; P156-I159 PolarHBondContact O-N 3.37Å; I159-L163 HydrophobicContact CG2-CD1 3.91Å; I159-L163 WeakPolarHBondContact O-CB 3.31Å; I159-L163 VanDerWaalsContact O-CG 3.3Å; I159-L163 WeakPolarHBondContact O-CG 3.16Å; I159-L163 PolarHBondContact O-N 3.49Å; I159-N200 HydrophobicContact CD1-CB 3.91Å; I159-A203 HydrophobicContact CD1-CB 3.84Å; I159-A203 HydrophobicContact CG2-CB 4.36Å; I159-V204 HydrophobicContact CG2-CG2 3.68Å
160	T	92.1	Very high	90.3	Very high	8 Å²	8	37.8 Å²	37.8	5%	0.049	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-50.5	179.8	-54.4	0	0	0	0	111.2	P156 A157 V158 L162 L163 D164 C207 Y470	P156-T160 PolarHBondContact O-N 2.79Å; P156-T160 VanDerWaalsContact O-N 3.09Å; P156-T160 PolarHBondContact O-OG1 3.18Å; A157-T160 PolarHBondContact O-N 2.85Å; V158-T160 VanDerWaalsContact C-N 3.34Å; T160-L162 PolarHBondContact O-N 3.06Å; T160-L163 CarbonylContact O-C 3.54Å; T160-L163 PolarHBondContact O-N 3.14Å; T160-D164 WeakPolarHBondContact O-CA 3.29Å; T160-D164 VanDerWaalsContact O-CB 3.32Å; T160-D164 WeakPolarHBondContact O-CB 3.05Å; T160-D164 PolarHBondContact O-N 3.34Å; T160-C207 PolarHBondContact OG1-SG 2.82Å; T160-C207 VanDerWaalsContact OG1-SG 3.34Å; T160-Y470 WeakPolarHBondContact OG1-CE2 3.32Å; T160-Y470 PolarHBondContact OG1-OH 3.12Å
161	L	88.9	Confident	90.3	Very high	52 Å²	52	44.8 Å²	44.8	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-61.1	-48.1	-177.3	-179	67.2	0	0	0	113	I110 M124 A157 V158 L163 D164 E165	I110-L161 HydrophobicContact CD1-CD2 3.26Å; I110-L161 HydrophobicContact CG1-CD2 4.33Å; M124-L161 HydrophobicContact CE-CD2 3.36Å; M124-L161 HydrophobicContact CE-CG 3.84Å; A157-L161 WeakPolarHBondContact O-CB 3.44Å; A157-L161 PolarHBondContact O-N 2.9Å; V158-L161 PolarHBondContact O-N 3.49Å; L161-L163 VanDerWaalsContact C-N 3.34Å; L161-L163 PolarHBondContact O-N 2.73Å; L161-D164 PolarHBondContact O-N 3.29Å; L161-D164 VanDerWaalsContact O-N 3.12Å; L161-E165 PolarHBondContact O-N 3.09Å
162	L	91.4	Very high	90.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-39	-179.5	-76.5	172.1	0	0	0	111.4	T106 M124 L127 L144 V158 T160 D164 C166	T106-L162 HydrophobicContact CG2-CD1 4.26Å; T106-L162 HydrophobicContact CG2-CD2 4.25Å; T106-L162 HydrophobicContact CG2-CG 4.44Å; M124-L162 HydrophobicContact CB-CD2 4.41Å; M124-L162 HydrophobicContact CE-CD2 4.07Å; M124-L162 HydrophobicContact CG-CD2 3.93Å; L127-L162 HydrophobicContact CB-CD2 4.42Å; L127-L162 HydrophobicContact CD1-CD1 3.97Å; L127-L162 HydrophobicContact CD1-CD2 3.97Å; L144-L162 HydrophobicContact CD2-CB 4.48Å; L144-L162 HydrophobicContact CD2-CD1 3.67Å; V158-L162 HydrophobicContact CG1-CD1 3.71Å; V158-L162 HydrophobicContact CG1-CG 4.3Å; V158-L162 WeakPolarHBondContact O-CB 3.31Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 2.69Å; T160-L162 PolarHBondContact O-N 3.06Å; L162-D164 VanDerWaalsContact C-N 3.28Å; L162-C166 PolarHBondContact O-N 2.62Å; L162-C166 PolarHBondContact O-SG 3.15Å
163	L	92.9	Very high	90.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-72	-25.5	173.8	-65.7	-178.9	0	0	0	112	V141 L144 I159 T160 L161 E165 C166 V204 C207 K211	V141-L163 HydrophobicContact CG2-CD2 3.92Å; L144-L163 HydrophobicContact CD1-CD1 4.41Å; L144-L163 HydrophobicContact CD1-CD2 3.86Å; L144-L163 HydrophobicContact CD1-CG 3.9Å; I159-L163 HydrophobicContact CG2-CD1 3.91Å; I159-L163 WeakPolarHBondContact O-CB 3.31Å; I159-L163 VanDerWaalsContact O-CG 3.3Å; I159-L163 WeakPolarHBondContact O-CG 3.16Å; I159-L163 PolarHBondContact O-N 3.49Å; T160-L163 CarbonylContact O-C 3.54Å; T160-L163 PolarHBondContact O-N 3.14Å; L161-L163 VanDerWaalsContact C-N 3.34Å; L161-L163 PolarHBondContact O-N 2.73Å; L163-E165 PolarHBondContact O-N 3.24Å; L163-C166 PolarHBondContact O-N 3.43Å; L163-V204 HydrophobicContact CD1-CB 4.48Å; L163-V204 HydrophobicContact CD1-CG1 4.32Å; L163-V204 HydrophobicContact CD1-CG2 4.22Å; L163-C207 HydrophobicContact CB-CB 4.41Å; L163-C207 HydrophobicContact CD1-CB 3.77Å; L163-K211 WeakPolarHBondContact O-CE 3.42Å; L163-K211 PolarHBondContact O-NZ 3.09Å
164	D	87.8	Confident	91.1	Very high	67 Å²	67	39 Å²	39	36%	0.358	21%	0.205	S	C	.	.	H	α-helix	trans	-64	-42.6	-176.9	-147.5	21.1	0	0	0	112.7	T160 L161 L162 K211	T160-D164 WeakPolarHBondContact O-CA 3.29Å; T160-D164 VanDerWaalsContact O-CB 3.32Å; T160-D164 WeakPolarHBondContact O-CB 3.05Å; T160-D164 PolarHBondContact O-N 3.34Å; L161-D164 PolarHBondContact O-N 3.29Å; L161-D164 VanDerWaalsContact O-N 3.12Å; L162-D164 VanDerWaalsContact C-N 3.28Å; D164-K211 PolarHBondContact O-NZ 3.4Å; D164-K211 WeakPolarHBondContact OD1-CE 3.29Å; D164-K211 IonicContact OD1-NZ 2.7Å; D164-K211 PolarHBondContact OD1-NZ 3.05Å
165	E	84.3	Confident	91.3	Very high	113 Å²	113	43.7 Å²	43.7	53%	0.528	23%	0.226	S	C	.	.	H	α-helix	trans	-89.6	-10	-178.2	-62.2	-59.2	131.5	0	0	113.4	H128 L161 L163	H128-E165 WeakPolarHBondContact CE1-CB 3.41Å; L161-E165 PolarHBondContact O-N 3.09Å; L163-E165 PolarHBondContact O-N 3.24Å
166	C	89.1	Confident	91.5	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.061	24%	0.243	C	C	.	.	S	Bend	trans	-70.2	146.8	174.3	-78.4	0	0	0	0	111.9	A131 L162 L163	A131-C166 HydrophobicContact CB-CB 4.31Å; A131-C166 WeakPolarHBondContact CB-SG 3.43Å; L162-C166 PolarHBondContact O-N 2.62Å; L162-C166 PolarHBondContact O-SG 3.15Å; L163-C166 PolarHBondContact O-N 3.43Å
167	P	88.6	Confident	91.5	Very high	65 Å²	65	47.1 Å²	47.1	42%	0.422	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-53.2	147.7	167.1	-24.6	34.9	0	0	0	111.9
168	L	88.7	Confident	91.8	Very high	113 Å²	113	48.8 Å²	48.8	59%	0.592	25%	0.25	S	C	*	.	P	Polyproline II helix	trans	-64	132.2	173	-70.7	175.5	0	0	0	109.6	K211	L168-K211 HydrophobicContact CD2-CB 3.94Å
169	P	91.2	Very high	91.9	Very high	18 Å²	18	54.5 Å²	54.5	12%	0.117	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-67.4	149.2	-178.5	28.6	-35.9	0	0	0	111.3	W137 A173 L174	W137-P169 HydrophobicContact CD2-CB 4.08Å; W137-P169 HydrophobicContact CE3-CB 4.13Å; W137-P169 HydrophobicContact CH2-CB 3.7Å; W137-P169 HydrophobicContact CH2-CG 3.83Å; W137-P169 HydrophobicContact CZ2-CB 3.62Å; W137-P169 HydrophobicContact CZ2-CG 3.57Å; W137-P169 HydrophobicContact CZ3-CB 3.96Å; P169-A173 HydrophobicContact CB-CB 4.08Å; P169-L174 HydrophobicContact CB-CD2 4.13Å; P169-L174 HydrophobicContact CB-CG 4.06Å; P169-L174 HydrophobicContact CG-CD1 4.21Å; P169-L174 HydrophobicContact CG-CD2 3.52Å; P169-L174 HydrophobicContact CG-CG 3.75Å
170	T	92.4	Very high	91.9	Very high	60 Å²	60	58.6 Å²	58.6	37%	0.368	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-67.6	163.1	169.7	68.6	0	0	0	0	110.8	D134 D172 A173 L174	D134-T170 VanDerWaalsContact CG-OG1 3.26Å; D134-T170 WeakPolarHBondContact OD1-CG2 3.47Å; D134-T170 PolarHBondContact OD1-OG1 3.12Å; D134-T170 WeakPolarHBondContact OD2-CG2 3.27Å; D134-T170 PolarHBondContact OD2-OG1 2.82Å; T170-D172 PolarHBondContact O-N 3.47Å; T170-A173 PolarHBondContact O-N 3.3Å; T170-A173 WeakPolarHBondContact OG1-CB 3.21Å; T170-A173 PolarHBondContact OG1-N 2.6Å; T170-A173 VanDerWaalsContact OG1-N 3.08Å; T170-L174 WeakPolarHBondContact O-CG 3.5Å; T170-L174 PolarHBondContact O-N 3.13Å
171	K	91.5	Very high	92	Very high	173 Å²	173	59.8 Å²	59.8	75%	0.752	30%	0.303	S	S	*	.	H	α-helix	trans	-56.8	-39.2	173	-174.3	-177.9	175.7	-175.2	0	111.8	L174 Q175	K171-L174 PolarHBondContact O-N 3.3Å; K171-Q175 WeakPolarHBondContact O-CB 3.34Å; K171-Q175 PolarHBondContact O-N 3.05Å
172	D	93.3	Very high	92.3	Very high	101 Å²	101	63.3 Å²	63.3	54%	0.54	32%	0.323	S	S	.	.	H	α-helix	trans	-69.1	-40	-179.8	-65.5	-12.8	0	0	0	111.3	T170 Q175 K176	T170-D172 PolarHBondContact O-N 3.47Å; D172-Q175 PolarHBondContact O-N 3.32Å; D172-K176 WeakPolarHBondContact O-CB 3.11Å; D172-K176 WeakPolarHBondContact O-CG 2.86Å; D172-K176 PolarHBondContact O-N 2.81Å
173	A	94.4	Very high	92.6	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-43.3	173	0	0	0	0	0	111.9	D134 W137 P169 T170 K176 L177	D134-A173 HydrophobicContact CB-CB 4.01Å; W137-A173 HydrophobicContact CE3-CB 4.29Å; W137-A173 HydrophobicContact CZ3-CB 4.39Å; P169-A173 HydrophobicContact CB-CB 4.08Å; T170-A173 PolarHBondContact O-N 3.3Å; T170-A173 WeakPolarHBondContact OG1-CB 3.21Å; T170-A173 PolarHBondContact OG1-N 2.6Å; T170-A173 VanDerWaalsContact OG1-N 3.08Å; A173-K176 PolarHBondContact O-N 2.93Å; A173-L177 WeakPolarHBondContact O-CB 3.48Å; A173-L177 PolarHBondContact O-N 3.41Å
174	L	94.2	Very high	92.7	Very high	16 Å²	16	65.9 Å²	65.9	8%	0.084	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-40.3	175.7	-72	175	0	0	0	112.6	W137 P169 T170 K171 L177 T178 L208 L212 L220	W137-L174 HydrophobicContact CH2-CD2 4.18Å; P169-L174 HydrophobicContact CB-CD2 4.13Å; P169-L174 HydrophobicContact CB-CG 4.06Å; P169-L174 HydrophobicContact CG-CD1 4.21Å; P169-L174 HydrophobicContact CG-CD2 3.52Å; P169-L174 HydrophobicContact CG-CG 3.75Å; T170-L174 WeakPolarHBondContact O-CG 3.5Å; T170-L174 PolarHBondContact O-N 3.13Å; K171-L174 PolarHBondContact O-N 3.3Å; L174-L177 PolarHBondContact O-N 3.49Å; L174-T178 PolarHBondContact O-N 3.42Å; L174-T178 PolarHBondContact O-OG1 3.21Å; L174-L208 HydrophobicContact CD2-CD1 4.46Å; L174-L212 HydrophobicContact CD1-CD1 3.65Å; L174-L212 HydrophobicContact CD1-CD2 4.15Å; L174-L212 HydrophobicContact CD2-CD1 4.05Å; L174-L220 HydrophobicContact CD2-CD1 4.41Å
175	Q	93.8	Very high	92.9	Very high	105 Å²	105	63 Å²	63	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-63.7	-49.6	175.7	-177.6	177.2	-17	0	0	110.9	K171 D172 L177 T178 E179	K171-Q175 WeakPolarHBondContact O-CB 3.34Å; K171-Q175 PolarHBondContact O-N 3.05Å; D172-Q175 PolarHBondContact O-N 3.32Å; Q175-L177 VanDerWaalsContact C-N 3.31Å; Q175-L177 PolarHBondContact O-N 3.21Å; Q175-T178 WeakPolarHBondContact O-CB 3.39Å; Q175-T178 PolarHBondContact O-N 2.97Å; Q175-T178 VanDerWaalsContact O-N 3.11Å; Q175-E179 WeakPolarHBondContact CG-OE1 3.32Å; Q175-E179 PolarHBondContact NE2-OE1 3.04Å; Q175-E179 WeakPolarHBondContact O-CG 3.3Å; Q175-E179 PolarHBondContact O-N 3.47Å
176	K	95.8	Very high	93.2	Very high	80 Å²	80	60.4 Å²	60.4	35%	0.348	32%	0.323	S	S	.	.	H	α-helix	trans	-57.3	-42.9	175.4	-75.3	175.1	177.7	177.4	0	112	E135 L138 D172 A173 T178 E179 I180	E135-K176 IonicContact OE1-NZ 2.79Å; E135-K176 PolarHBondContact OE1-NZ 3.38Å; L138-K176 HydrophobicContact CD1-CB 3.91Å; L138-K176 HydrophobicContact CD1-CD 3.9Å; L138-K176 HydrophobicContact CD2-CB 4.49Å; D172-K176 WeakPolarHBondContact O-CB 3.11Å; D172-K176 WeakPolarHBondContact O-CG 2.86Å; D172-K176 PolarHBondContact O-N 2.81Å; A173-K176 PolarHBondContact O-N 2.93Å; K176-T178 VanDerWaalsContact C-N 3.32Å; K176-T178 PolarHBondContact O-N 2.94Å; K176-E179 PolarHBondContact O-N 2.67Å; K176-I180 WeakPolarHBondContact O-CB 3.29Å; K176-I180 WeakPolarHBondContact O-CD1 3.36Å; K176-I180 WeakPolarHBondContact O-CG1 3.26Å; K176-I180 PolarHBondContact O-N 2.67Å
177	L	95.3	Very high	93.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-59.2	-46.2	176.4	179.4	63.5	0	0	0	110.8	W137 L138 V141 A173 L174 Q175 E179 I180 L181 L208	W137-L177 HydrophobicContact CH2-CD2 3.71Å; W137-L177 HydrophobicContact CZ3-CB 4.32Å; W137-L177 HydrophobicContact CZ3-CD2 3.99Å; L138-L177 HydrophobicContact CD2-CB 3.73Å; L138-L177 HydrophobicContact CD2-CD1 4.23Å; V141-L177 HydrophobicContact CG1-CD1 3.75Å; V141-L177 HydrophobicContact CG1-CD2 4.11Å; A173-L177 WeakPolarHBondContact O-CB 3.48Å; A173-L177 PolarHBondContact O-N 3.41Å; L174-L177 PolarHBondContact O-N 3.49Å; Q175-L177 VanDerWaalsContact C-N 3.31Å; Q175-L177 PolarHBondContact O-N 3.21Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.79Å; L177-I180 PolarHBondContact O-N 2.83Å; L177-L181 HydrophobicContact CD1-CD1 3.89Å; L177-L181 HydrophobicContact CD1-CD2 4.4Å; L177-L181 HydrophobicContact CD1-CG 3.92Å; L177-L181 HydrophobicContact CD2-CD1 4.48Å; L177-L181 HydrophobicContact CG-CD1 3.88Å; L177-L181 HydrophobicContact CG-CG 4.26Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 VanDerWaalsContact O-CG 3.26Å; L177-L181 WeakPolarHBondContact O-CG 3.43Å; L177-L181 PolarHBondContact O-N 3.49Å; L177-L208 HydrophobicContact CD2-CD1 3.7Å
178	T	94.8	Very high	93.4	Very high	39 Å²	39	58 Å²	58	24%	0.239	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-41.8	179.2	-55.9	0	0	0	0	111.4	L174 Q175 K176 N182 I225	L174-T178 PolarHBondContact O-N 3.42Å; L174-T178 PolarHBondContact O-OG1 3.21Å; Q175-T178 WeakPolarHBondContact O-CB 3.39Å; Q175-T178 PolarHBondContact O-N 2.97Å; Q175-T178 VanDerWaalsContact O-N 3.11Å; K176-T178 VanDerWaalsContact C-N 3.32Å; K176-T178 PolarHBondContact O-N 2.94Å; T178-N182 PolarHBondContact O-N 2.63Å; T178-I225 HydrophobicContact CG2-CD1 4.14Å
179	E	95.4	Very high	93.3	Very high	120 Å²	120	56.5 Å²	56.5	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-65.1	-41.6	175.4	-69.6	170.9	-170.2	0	0	112.4	Q175 K176 L177	Q175-E179 WeakPolarHBondContact CG-OE1 3.32Å; Q175-E179 PolarHBondContact NE2-OE1 3.04Å; Q175-E179 WeakPolarHBondContact O-CG 3.3Å; Q175-E179 PolarHBondContact O-N 3.47Å; K176-E179 PolarHBondContact O-N 2.67Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.79Å
180	I	94.9	Very high	92.9	Very high	86 Å²	86	62.4 Å²	62.4	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-44.1	177.6	-71.4	162.9	0	0	0	111.1	L138 Q142 K176 L177	L138-I180 HydrophobicContact CD2-CD1 4.35Å; Q142-I180 HydrophobicContact CG-CG2 4.34Å; K176-I180 WeakPolarHBondContact O-CB 3.29Å; K176-I180 WeakPolarHBondContact O-CD1 3.36Å; K176-I180 WeakPolarHBondContact O-CG1 3.26Å; K176-I180 PolarHBondContact O-N 2.67Å; L177-I180 PolarHBondContact O-N 2.83Å
181	L	94.2	Very high	92.2	Very high	33 Å²	33	61.2 Å²	61.2	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-72.5	-33.5	-179.2	-64.1	177.9	0	0	0	111.7	I145 L177 L183	I145-L181 HydrophobicContact CD1-CD2 3.68Å; L177-L181 HydrophobicContact CD1-CD1 3.89Å; L177-L181 HydrophobicContact CD1-CD2 4.4Å; L177-L181 HydrophobicContact CD1-CG 3.92Å; L177-L181 HydrophobicContact CD2-CD1 4.48Å; L177-L181 HydrophobicContact CG-CD1 3.88Å; L177-L181 HydrophobicContact CG-CG 4.26Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 VanDerWaalsContact O-CG 3.26Å; L177-L181 WeakPolarHBondContact O-CG 3.43Å; L177-L181 PolarHBondContact O-N 3.49Å; L181-L183 HydrophobicContact CB-CD1 4.13Å; L181-L183 HydrophobicContact CB-CD2 4.04Å; L181-L183 HydrophobicContact CB-CG 3.72Å; L181-L183 HydrophobicContact CD1-CD1 4.21Å; L181-L183 WeakPolarHBondContact O-CD2 3.44Å; L181-L183 PolarHBondContact O-N 3.24Å; L181-L183 VanDerWaalsContact O-N 3.16Å
182	N	95.1	Very high	91.6	Very high	126 Å²	126	55.8 Å²	55.8	67%	0.674	31%	0.312	S	S	*	.			trans	44.1	48.7	177.1	-168.5	33	0	0	0	113	T178	T178-N182 PolarHBondContact O-N 2.63Å
183	L	96.4	Very high	91.1	Very high	22 Å²	22	55.3 Å²	55.3	12%	0.115	32%	0.316	C	S	.	.			trans	-75.8	143.9	-171.3	-58.1	179	0	0	0	111.8	L181 T201 L205 G224 I225 Y228	L181-L183 HydrophobicContact CB-CD1 4.13Å; L181-L183 HydrophobicContact CB-CD2 4.04Å; L181-L183 HydrophobicContact CB-CG 3.72Å; L181-L183 HydrophobicContact CD1-CD1 4.21Å; L181-L183 WeakPolarHBondContact O-CD2 3.44Å; L181-L183 PolarHBondContact O-N 3.24Å; L181-L183 VanDerWaalsContact O-N 3.16Å; L183-T201 HydrophobicContact CD1-CG2 3.76Å; L183-T201 HydrophobicContact CD2-CG2 4.23Å; L183-L205 HydrophobicContact CD1-CD1 3.88Å; L183-G224 CarbonylContact C-O 3.58Å; L183-G224 CarbonylContact O-C 3.49Å; L183-G224 VanDerWaalsContact O-CA 3.26Å; L183-G224 WeakPolarHBondContact O-CA 3.03Å; L183-I225 HydrophobicContact CB-CG1 4.32Å; L183-I225 HydrophobicContact CD1-CG1 4.11Å; L183-Y228 HydrophobicContact CB-CD2 4.06Å; L183-Y228 HydrophobicContact CB-CG 3.97Å; L183-Y228 HydrophobicContact CD1-CD1 4.18Å; L183-Y228 HydrophobicContact CD1-CE1 4.42Å; L183-Y228 HydrophobicContact CD1-CG 4.31Å; L183-Y228 HydrophobicContact CD2-CD2 3.88Å; L183-Y228 HydrophobicContact CD2-CE2 3.78Å; L183-Y228 HydrophobicContact CD2-CG 4.33Å; L183-Y228 HydrophobicContact CG-CD2 4.4Å; L183-Y228 HydrophobicContact CG-CG 4.42Å
184	S	96	Very high	90.9	Very high	37 Å²	37	60.4 Å²	60.4	26%	0.259	34%	0.339	S	S	.	.			trans	-159.4	169.2	177.4	59.6	0	0	0	0	110.3	A186 A187 A188 G224	S184-A186 PolarHBondContact O-N 3.35Å; S184-A187 PolarHBondContact O-N 3.28Å; S184-A187 VanDerWaalsContact O-N 3.17Å; S184-A187 PolarHBondContact OG-N 3.08Å; S184-A187 VanDerWaalsContact OG-N 3.12Å; S184-A188 PolarHBondContact O-N 3Å; S184-G224 WeakPolarHBondContact CA-O 3.43Å
185	G	91.9	Very high	90.9	Very high	5 Å²	5	61.2 Å²	61.2	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-36.3	170.8	0	0	0	0	0	113.1	A188 C189 H231	G185-A188 WeakPolarHBondContact O-CB 3.29Å; G185-A188 PolarHBondContact O-N 2.98Å; G185-C189 PolarHBondContact O-N 3.35Å; G185-C189 VanDerWaalsContact O-N 3.16Å; G185-C189 PolarHBondContact O-SG 3.44Å; G185-C189 VanDerWaalsContact O-SG 3.42Å; G185-H231 WeakPolarHBondContact CA-ND1 3.34Å
186	A	91.3	Very high	91	Very high	59 Å²	59	57.6 Å²	57.6	49%	0.488	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-41.5	175.6	0	0	0	0	0	112.3	S184 A188 C189 Q190	S184-A186 PolarHBondContact O-N 3.35Å; A186-A188 VanDerWaalsContact C-N 3.29Å; A186-A188 PolarHBondContact O-N 3.22Å; A186-C189 PolarHBondContact O-N 3.44Å; A186-Q190 VanDerWaalsContact O-CG 3.3Å; A186-Q190 WeakPolarHBondContact O-CG 3.35Å; A186-Q190 PolarHBondContact O-N 3.07Å
187	A	90.6	Very high	90.9	Very high	17 Å²	17	57.9 Å²	57.9	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-63	-37.3	174.8	0	0	0	0	0	111.4	S184 C189 Q190 D191 Y228	S184-A187 PolarHBondContact O-N 3.28Å; S184-A187 VanDerWaalsContact O-N 3.17Å; S184-A187 PolarHBondContact OG-N 3.08Å; S184-A187 VanDerWaalsContact OG-N 3.12Å; A187-C189 PolarHBondContact O-N 3.19Å; A187-Q190 PolarHBondContact O-N 3.28Å; A187-D191 WeakPolarHBondContact O-CB 3.48Å; A187-D191 PolarHBondContact O-N 3.17Å; A187-Y228 HydrophobicContact CB-CD2 4.38Å
188	A	90.5	Very high	90.9	Very high	6 Å²	6	58 Å²	58	5%	0.05	34%	0.335	C	S	.	.	H	α-helix	trans	-60.4	-45.5	175.1	0	0	0	0	0	111.7	S184 G185 A186 H198 Y228 H231	S184-A188 PolarHBondContact O-N 3Å; G185-A188 WeakPolarHBondContact O-CB 3.29Å; G185-A188 PolarHBondContact O-N 2.98Å; A186-A188 VanDerWaalsContact C-N 3.29Å; A186-A188 PolarHBondContact O-N 3.22Å; A188-H198 PolarHBondContact O-CE1 2.79Å; A188-H198 PolarHBondContact O-NE2 2.8Å; A188-Y228 HydrophobicContact CB-CD2 3.66Å; A188-Y228 HydrophobicContact CB-CE2 4.03Å; A188-Y228 HydrophobicContact CB-CG 4.22Å; A188-H231 HydrophobicContact CB-CB 3.71Å
189	C	85.8	Confident	90.9	Very high	83 Å²	83	56.3 Å²	56.3	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-67.1	-39.9	178.3	-65.2	0	0	0	0	113.1	G185 A186 A187 A192	G185-C189 PolarHBondContact O-N 3.35Å; G185-C189 VanDerWaalsContact O-N 3.16Å; G185-C189 PolarHBondContact O-SG 3.44Å; G185-C189 VanDerWaalsContact O-SG 3.42Å; A186-C189 PolarHBondContact O-N 3.44Å; A187-C189 PolarHBondContact O-N 3.19Å; C189-A192 WeakPolarHBondContact O-CB 3.49Å
190	Q	82.5	Confident	91	Very high	142 Å²	142	50.6 Å²	50.6	66%	0.664	30%	0.298	S	S	*	.	H	α-helix	trans	-69.1	-40.8	-178	-72.7	172.7	17.7	0	0	112.5	A186 A187 A192	A186-Q190 VanDerWaalsContact O-CG 3.3Å; A186-Q190 WeakPolarHBondContact O-CG 3.35Å; A186-Q190 PolarHBondContact O-N 3.07Å; A187-Q190 PolarHBondContact O-N 3.28Å; Q190-A192 PolarHBondContact O-N 3.17Å
191	D	79.6	Confident	91.2	Very high	35 Å²	35	46.7 Å²	46.7	19%	0.187	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-83.4	6.7	-177.1	-82.5	7.5	0	0	0	112.7	A187 C193 H194 K197 H198	A187-D191 WeakPolarHBondContact O-CB 3.48Å; A187-D191 PolarHBondContact O-N 3.17Å; D191-C193 PolarHBondContact O-N 3.2Å; D191-C193 VanDerWaalsContact O-N 3.07Å; D191-H194 CarbonylContact O-C 3.59Å; D191-H194 WeakPolarHBondContact O-CA 3.38Å; D191-H194 PolarHBondContact O-N 3.2Å; D191-K197 IonicContact OD2-NZ 3.14Å; D191-K197 PolarHBondContact OD2-NZ 3.46Å; D191-H198 WeakPolarHBondContact CB-CD2 3.48Å; D191-H198 WeakPolarHBondContact CB-NE2 3.45Å
192	A	78	Confident	91.3	Very high	59 Å²	59	45.1 Å²	45.1	49%	0.488	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-57.2	-23.9	176.1	0	0	0	0	0	113.5	C189 Q190 H194	C189-A192 WeakPolarHBondContact O-CB 3.49Å; Q190-A192 PolarHBondContact O-N 3.17Å; A192-H194 VanDerWaalsContact C-N 3.27Å; A192-H194 PolarHBondContact O-N 3.46Å
193	C	82.1	Confident	91.4	Very high	91 Å²	91	39.2 Å²	39.2	62%	0.615	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-76.9	-7.6	173.3	57.7	0	0	0	0	114.3	D191 P195	D191-C193 PolarHBondContact O-N 3.2Å; D191-C193 VanDerWaalsContact O-N 3.07Å; C193-P195 VanDerWaalsContact C-CD 3.42Å; C193-P195 WeakPolarHBondContact O-CD 3.41Å
194	H	90.9	Very high	91.5	Very high	107 Å²	107	38.1 Å²	38.1	50%	0.495	23%	0.233	S	C	.	.			trans	-124.4	64.2	180	-57.7	105.2	0	0	0	111.7	D191 A192 A196 K197 H198	D191-H194 CarbonylContact O-C 3.59Å; D191-H194 WeakPolarHBondContact O-CA 3.38Å; D191-H194 PolarHBondContact O-N 3.2Å; A192-H194 VanDerWaalsContact C-N 3.27Å; A192-H194 PolarHBondContact O-N 3.46Å; H194-A196 PolarHBondContact O-N 2.86Å; H194-A196 VanDerWaalsContact O-N 3.15Å; H194-K197 HydrophobicContact CB-CB 4.26Å; H194-K197 PolarHBondContact O-N 3.25Å; H194-K197 VanDerWaalsContact O-N 3.16Å; H194-H198 PolarHBondContact O-N 2.75Å
195	P	94	Very high	91.5	Very high	32 Å²	32	36.4 Å²	36.4	21%	0.208	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-30.2	-173.9	22.9	-34.5	0	0	0	114.2	L150 C193 H198 R199 H238 V241	L150-P195 HydrophobicContact CD2-CB 3.93Å; L150-P195 HydrophobicContact CD2-CG 3.87Å; C193-P195 VanDerWaalsContact C-CD 3.42Å; C193-P195 WeakPolarHBondContact O-CD 3.41Å; P195-H198 PolarHBondContact O-N 3.25Å; P195-R199 VanDerWaalsContact O-CB 3.3Å; P195-R199 WeakPolarHBondContact O-CB 3.38Å; P195-R199 PolarHBondContact O-N 3.47Å; P195-H238 HydrophobicContact CB-CB 3.76Å; P195-V241 HydrophobicContact CB-CG2 4.14Å; P195-V241 WeakPolarHBondContact O-CG2 3.23Å
196	A	95.4	Very high	91.7	Very high	29 Å²	29	36.4 Å²	36.4	24%	0.24	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-52.8	175.6	0	0	0	0	0	111.8	L150 H194 H198 R199 N200	L150-A196 HydrophobicContact CB-CB 3.98Å; H194-A196 PolarHBondContact O-N 2.86Å; H194-A196 VanDerWaalsContact O-N 3.15Å; A196-H198 VanDerWaalsContact C-N 3.31Å; A196-H198 PolarHBondContact O-N 2.97Å; A196-R199 PolarHBondContact O-N 2.9Å; A196-N200 WeakPolarHBondContact O-CB 3.36Å; A196-N200 PolarHBondContact O-N 2.9Å; A196-N200 PolarHBondContact O-ND2 3.42Å; A196-N200 PolarHBondContact O-OD1 3.15Å
197	K	94.8	Very high	91.9	Very high	87 Å²	87	33.7 Å²	33.7	38%	0.378	20%	0.198	S	C	.	.	H	α-helix	trans	-58.7	-45.7	178.4	-174.9	-168.3	172.7	-154.6	0	110.5	I145 D191 H194 N200 T201	I145-K197 HydrophobicContact CG2-CG 3.79Å; D191-K197 IonicContact OD2-NZ 3.14Å; D191-K197 PolarHBondContact OD2-NZ 3.46Å; H194-K197 HydrophobicContact CB-CB 4.26Å; H194-K197 PolarHBondContact O-N 3.25Å; H194-K197 VanDerWaalsContact O-N 3.16Å; K197-N200 PolarHBondContact O-N 2.91Å; K197-T201 WeakPolarHBondContact O-CB 3.5Å; K197-T201 PolarHBondContact O-N 3.4Å; K197-T201 PolarHBondContact O-OG1 2.88Å
198	H	94.2	Very high	92.2	Very high	4 Å²	4	33 Å²	33	2%	0.019	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-52.3	176.9	-109	-136	0	0	0	112.7	A188 D191 H194 P195 A196 N200 T201 T202 Y228 V241	A188-H198 PolarHBondContact O-CE1 2.79Å; A188-H198 PolarHBondContact O-NE2 2.8Å; D191-H198 WeakPolarHBondContact CB-CD2 3.48Å; D191-H198 WeakPolarHBondContact CB-NE2 3.45Å; H194-H198 PolarHBondContact O-N 2.75Å; P195-H198 PolarHBondContact O-N 3.25Å; A196-H198 VanDerWaalsContact C-N 3.31Å; A196-H198 PolarHBondContact O-N 2.97Å; H198-N200 VanDerWaalsContact C-N 3.31Å; H198-N200 PolarHBondContact O-N 3.48Å; H198-T201 WeakPolarHBondContact O-CB 3.5Å; H198-T201 PolarHBondContact O-N 3.22Å; H198-T202 WeakPolarHBondContact O-CG2 3.31Å; H198-T202 PolarHBondContact O-N 3.1Å; H198-T202 PolarHBondContact O-OG1 3.38Å; H198-Y228 AromaticContact CD2-CZ 3.86Å; H198-Y228 PolarHBondContact CD2-OH 2.89Å; H198-Y228 AromaticContact CE1-CE2 3.92Å; H198-Y228 AromaticContact CE1-CZ 3.89Å; H198-Y228 VanDerWaalsContact CG-OH 3.29Å; H198-Y228 AromaticContact NE2-CE2 3.49Å; H198-Y228 WeakPolarHBondContact NE2-CE2 3.42Å; H198-Y228 AromaticContact NE2-CZ 3.6Å; H198-Y228 PolarHBondContact NE2-OH 3.21Å; H198-Y228 VanDerWaalsContact NE2-OH 3.14Å; H198-V241 HydrophobicContact CB-CB 4.42Å; H198-V241 HydrophobicContact CB-CG1 3.86Å; H198-V241 HydrophobicContact CB-CG2 3.63Å
199	R	95.9	Very high	92.4	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-56.5	-47.9	177.3	-176	-76.7	-55.5	-97.7	-1	110.3	P149 L150 P156 P195 A196 T201 T202 A203 T240 V241 F244	P149-R199 PolarHBondContact O-NH2 2.82Å; L150-R199 HydrophobicContact CD1-CB 4.13Å; L150-R199 HydrophobicContact CD1-CG 4.29Å; P156-R199 VanDerWaalsContact CD-NH1 3.3Å; P195-R199 VanDerWaalsContact O-CB 3.3Å; P195-R199 WeakPolarHBondContact O-CB 3.38Å; P195-R199 PolarHBondContact O-N 3.47Å; A196-R199 PolarHBondContact O-N 2.9Å; R199-T201 PolarHBondContact O-N 3.32Å; R199-T202 WeakPolarHBondContact CA-OG1 3.44Å; R199-T202 PolarHBondContact O-N 3.15Å; R199-T202 PolarHBondContact O-OG1 2.95Å; R199-A203 WeakPolarHBondContact O-CB 3.44Å; R199-A203 PolarHBondContact O-N 2.99Å; R199-T240 HydrophobicContact CG-CG2 3.6Å; R199-V241 HydrophobicContact CB-CG2 4.24Å; R199-F244 HydrophobicContact CG-CD2 3.65Å; R199-F244 HydrophobicContact CG-CE2 4.17Å; R199-F244 HydrophobicContact CG-CG 4.19Å
200	N	97.7	Very high	92.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-42.6	-179.2	-58.4	-20.4	0	0	0	111.5	L144 I145 I148 I159 A196 K197 H198 T202 A203 V204	L144-N200 PolarHBondContact O-ND2 2.79Å; I145-N200 HydrophobicContact CB-CB 4.5Å; I145-N200 PolarHBondContact O-ND2 2.9Å; I148-N200 PolarHBondContact O-ND2 3.1Å; I159-N200 HydrophobicContact CD1-CB 3.91Å; A196-N200 WeakPolarHBondContact O-CB 3.36Å; A196-N200 PolarHBondContact O-N 2.9Å; A196-N200 PolarHBondContact O-ND2 3.42Å; A196-N200 PolarHBondContact O-OD1 3.15Å; K197-N200 PolarHBondContact O-N 2.91Å; H198-N200 VanDerWaalsContact C-N 3.31Å; H198-N200 PolarHBondContact O-N 3.48Å; N200-T202 PolarHBondContact O-N 2.84Å; N200-A203 PolarHBondContact O-N 3.48Å; N200-V204 WeakPolarHBondContact O-CG2 3.45Å; N200-V204 PolarHBondContact O-N 3.04Å
201	T	97.4	Very high	93	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-48.4	173.7	-60.9	0	0	0	0	111	I145 L183 K197 H198 R199 A203 V204 L205 Y228	I145-T201 WeakPolarHBondContact CG2-OG1 3.17Å; L183-T201 HydrophobicContact CD1-CG2 3.76Å; L183-T201 HydrophobicContact CD2-CG2 4.23Å; K197-T201 WeakPolarHBondContact O-CB 3.5Å; K197-T201 PolarHBondContact O-N 3.4Å; K197-T201 PolarHBondContact O-OG1 2.88Å; H198-T201 WeakPolarHBondContact O-CB 3.5Å; H198-T201 PolarHBondContact O-N 3.22Å; R199-T201 PolarHBondContact O-N 3.32Å; T201-A203 PolarHBondContact O-N 2.89Å; T201-V204 PolarHBondContact O-N 3.43Å; T201-L205 HydrophobicContact CG2-CD1 4.17Å; T201-L205 VanDerWaalsContact O-CG 3.31Å; T201-L205 WeakPolarHBondContact O-CG 3.28Å; T201-L205 PolarHBondContact O-N 2.91Å; T201-Y228 HydrophobicContact CG2-CE1 4.16Å
202	T	97.3	Very high	93.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.6	-38.1	179.5	55.5	0	0	0	0	112.6	H198 R199 N200 L205 G206 Y228 L229 F244 A245 A248	H198-T202 WeakPolarHBondContact O-CG2 3.31Å; H198-T202 PolarHBondContact O-N 3.1Å; H198-T202 PolarHBondContact O-OG1 3.38Å; R199-T202 WeakPolarHBondContact CA-OG1 3.44Å; R199-T202 PolarHBondContact O-N 3.15Å; R199-T202 PolarHBondContact O-OG1 2.95Å; N200-T202 PolarHBondContact O-N 2.84Å; T202-L205 PolarHBondContact O-N 3.41Å; T202-G206 PolarHBondContact O-N 3.01Å; T202-Y228 HydrophobicContact CG2-CE1 3.98Å; T202-L229 HydrophobicContact CG2-CD2 3.88Å; T202-F244 WeakPolarHBondContact OG1-CB 3.32Å; T202-A245 HydrophobicContact CG2-CB 3.99Å; T202-A248 WeakPolarHBondContact O-CB 3.05Å
203	A	97.3	Very high	93.9	Very high	2 Å²	2	27.1 Å²	27.1	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-47	175.5	0	0	0	0	0	111.5	I159 R199 N200 T201 L205 G206 C207 F244	I159-A203 HydrophobicContact CD1-CB 3.84Å; I159-A203 HydrophobicContact CG2-CB 4.36Å; R199-A203 WeakPolarHBondContact O-CB 3.44Å; R199-A203 PolarHBondContact O-N 2.99Å; N200-A203 PolarHBondContact O-N 3.48Å; T201-A203 PolarHBondContact O-N 2.89Å; A203-L205 PolarHBondContact O-N 3.45Å; A203-G206 PolarHBondContact O-N 3.43Å; A203-G206 VanDerWaalsContact O-N 3.16Å; A203-C207 PolarHBondContact O-N 2.99Å; A203-C207 PolarHBondContact O-SG 3.04Å; A203-F244 HydrophobicContact CB-CD1 3.74Å; A203-F244 HydrophobicContact CB-CE1 4.21Å; A203-F244 HydrophobicContact CB-CG 4.42Å
204	V	97.6	Very high	94.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-55.9	-49.7	174.3	166	0	0	0	0	110.8	V141 I145 I159 L163 N200 T201 G206 C207 L208	V141-V204 HydrophobicContact CG1-CG1 3.71Å; I145-V204 HydrophobicContact CD1-CG2 4.34Å; I145-V204 HydrophobicContact CG1-CB 4.46Å; I145-V204 HydrophobicContact CG1-CG2 3.86Å; I159-V204 HydrophobicContact CG2-CG2 3.68Å; L163-V204 HydrophobicContact CD1-CB 4.48Å; L163-V204 HydrophobicContact CD1-CG1 4.32Å; L163-V204 HydrophobicContact CD1-CG2 4.22Å; N200-V204 WeakPolarHBondContact O-CG2 3.45Å; N200-V204 PolarHBondContact O-N 3.04Å; T201-V204 PolarHBondContact O-N 3.43Å; V204-G206 VanDerWaalsContact C-N 3.29Å; V204-G206 PolarHBondContact O-N 2.94Å; V204-C207 PolarHBondContact O-N 3.4Å; V204-L208 HydrophobicContact CG1-CD1 3.97Å; V204-L208 HydrophobicContact CG1-CG 4.34Å; V204-L208 VanDerWaalsContact O-CG 3.31Å; V204-L208 WeakPolarHBondContact O-CG 3.45Å; V204-L208 PolarHBondContact O-N 2.81Å
205	L	97.5	Very high	94	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-58.8	-41.3	178.4	-70.8	171.6	0	0	0	111.9	L183 T201 T202 A203 L208 A209 I225 L229 F252	L183-L205 HydrophobicContact CD1-CD1 3.88Å; T201-L205 HydrophobicContact CG2-CD1 4.17Å; T201-L205 VanDerWaalsContact O-CG 3.31Å; T201-L205 WeakPolarHBondContact O-CG 3.28Å; T201-L205 PolarHBondContact O-N 2.91Å; T202-L205 PolarHBondContact O-N 3.41Å; A203-L205 PolarHBondContact O-N 3.45Å; L205-L208 PolarHBondContact O-N 3.42Å; L205-A209 VanDerWaalsContact O-CB 3.27Å; L205-A209 WeakPolarHBondContact O-CB 3.4Å; L205-A209 PolarHBondContact O-N 2.85Å; L205-I225 HydrophobicContact CD1-CG2 4.02Å; L205-I225 HydrophobicContact CD2-CD1 4.17Å; L205-I225 HydrophobicContact CD2-CG2 4.32Å; L205-L229 HydrophobicContact CD1-CD2 4.2Å; L205-F252 HydrophobicContact CB-CE2 4.27Å
206	G	96.3	Very high	93.9	Very high	4 Å²	4	25 Å²	25	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-62.2	-45.6	174.9	0	0	0	0	0	113.3	T202 A203 V204 L208 A209 E210	T202-G206 PolarHBondContact O-N 3.01Å; A203-G206 PolarHBondContact O-N 3.43Å; A203-G206 VanDerWaalsContact O-N 3.16Å; V204-G206 VanDerWaalsContact C-N 3.29Å; V204-G206 PolarHBondContact O-N 2.94Å; G206-L208 PolarHBondContact O-N 3.15Å; G206-A209 PolarHBondContact O-N 3.5Å; G206-E210 PolarHBondContact O-N 2.94Å
207	C	95.6	Very high	93.8	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.02	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-42.7	176.5	-63.1	0	0	0	0	111.9	T160 L163 A203 V204 E210 K211	T160-C207 PolarHBondContact OG1-SG 2.82Å; T160-C207 VanDerWaalsContact OG1-SG 3.34Å; L163-C207 HydrophobicContact CB-CB 4.41Å; L163-C207 HydrophobicContact CD1-CB 3.77Å; A203-C207 PolarHBondContact O-N 2.99Å; A203-C207 PolarHBondContact O-SG 3.04Å; V204-C207 PolarHBondContact O-N 3.4Å; C207-E210 PolarHBondContact O-N 2.81Å; C207-K211 WeakPolarHBondContact O-CG 3.38Å; C207-K211 PolarHBondContact O-N 3.13Å
208	L	95.4	Very high	93.7	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-66.1	-42.1	176.7	-63.5	178.1	0	0	0	111.5	W137 L174 L177 V204 L205 G206 E210 K211 L212 L220	W137-L208 HydrophobicContact CH2-CD1 4.28Å; W137-L208 HydrophobicContact CH2-CD2 4.19Å; W137-L208 HydrophobicContact CZ2-CD2 3.68Å; L174-L208 HydrophobicContact CD2-CD1 4.46Å; L177-L208 HydrophobicContact CD2-CD1 3.7Å; V204-L208 HydrophobicContact CG1-CD1 3.97Å; V204-L208 HydrophobicContact CG1-CG 4.34Å; V204-L208 VanDerWaalsContact O-CG 3.31Å; V204-L208 WeakPolarHBondContact O-CG 3.45Å; V204-L208 PolarHBondContact O-N 2.81Å; L205-L208 PolarHBondContact O-N 3.42Å; G206-L208 PolarHBondContact O-N 3.15Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 3.46Å; L208-K211 PolarHBondContact O-N 3.08Å; L208-L212 HydrophobicContact CB-CD1 4.44Å; L208-L212 WeakPolarHBondContact O-CB 3.4Å; L208-L212 WeakPolarHBondContact O-CG 3.28Å; L208-L212 PolarHBondContact O-N 3.21Å; L208-L220 HydrophobicContact CB-CD2 3.62Å; L208-L220 HydrophobicContact CD1-CD2 4.26Å
209	A	94.8	Very high	93.6	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-35.6	178.6	0	0	0	0	0	112.9	L205 G206 K251 F252	L205-A209 VanDerWaalsContact O-CB 3.27Å; L205-A209 WeakPolarHBondContact O-CB 3.4Å; L205-A209 PolarHBondContact O-N 2.85Å; G206-A209 PolarHBondContact O-N 3.5Å; A209-K251 HydrophobicContact CB-CB 3.82Å; A209-F252 HydrophobicContact CB-CB 4.4Å; A209-F252 HydrophobicContact CB-CD1 3.55Å; A209-F252 HydrophobicContact CB-CD2 3.89Å; A209-F252 HydrophobicContact CB-CE1 3.68Å; A209-F252 HydrophobicContact CB-CE2 3.98Å; A209-F252 HydrophobicContact CB-CG 3.67Å; A209-F252 HydrophobicContact CB-CZ 3.88Å
210	E	91.9	Very high	93.6	Very high	51 Å²	51	24.9 Å²	24.9	24%	0.238	17%	0.174	C	C	.	.	H	α-helix	trans	-70.8	-36.2	176	-178.8	156.3	-134.7	0	0	112.8	G206 C207 L208 K251	G206-E210 PolarHBondContact O-N 2.94Å; C207-E210 PolarHBondContact O-N 2.81Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 3.46Å; E210-K251 HydrophobicContact CB-CB 4.45Å; E210-K251 HydrophobicContact CB-CD 4.1Å; E210-K251 HydrophobicContact CB-CG 4.35Å; E210-K251 HydrophobicContact CG-CD 4.39Å; E210-K251 IonicContact OE1-NZ 2.89Å; E210-K251 PolarHBondContact OE1-NZ 3.06Å; E210-K251 WeakPolarHBondContact OE2-CE 3.19Å; E210-K251 IonicContact OE2-NZ 2.68Å; E210-K251 PolarHBondContact OE2-NZ 2.99Å; E210-K251 VanDerWaalsContact OE2-NZ 3.09Å
211	K	90.2	Very high	93.6	Very high	54 Å²	54	25.6 Å²	25.6	24%	0.235	18%	0.178	C	C	.	.	H	α-helix	trans	-80.7	-36.2	-178.5	-79.8	170.4	164.4	-96.8	0	114	L163 D164 L168 C207 L208	L163-K211 WeakPolarHBondContact O-CE 3.42Å; L163-K211 PolarHBondContact O-NZ 3.09Å; D164-K211 PolarHBondContact O-NZ 3.4Å; D164-K211 WeakPolarHBondContact OD1-CE 3.29Å; D164-K211 IonicContact OD1-NZ 2.7Å; D164-K211 PolarHBondContact OD1-NZ 3.05Å; L168-K211 HydrophobicContact CD2-CB 3.94Å; C207-K211 WeakPolarHBondContact O-CG 3.38Å; C207-K211 PolarHBondContact O-N 3.13Å; L208-K211 PolarHBondContact O-N 3.08Å
212	L	91.4	Very high	93.5	Very high	15 Å²	15	27 Å²	27	8%	0.079	19%	0.188	C	C	.	.			trans	-82.7	133.2	-178.6	-62.6	174.8	0	0	0	109.2	L174 L208 A216 S217 L220	L174-L212 HydrophobicContact CD1-CD1 3.65Å; L174-L212 HydrophobicContact CD1-CD2 4.15Å; L174-L212 HydrophobicContact CD2-CD1 4.05Å; L208-L212 HydrophobicContact CB-CD1 4.44Å; L208-L212 WeakPolarHBondContact O-CB 3.4Å; L208-L212 WeakPolarHBondContact O-CG 3.28Å; L208-L212 PolarHBondContact O-N 3.21Å; L212-A216 HydrophobicContact CB-CB 4.25Å; L212-A216 HydrophobicContact CD2-CB 4.09Å; L212-S217 VanDerWaalsContact O-CB 3.3Å; L212-S217 WeakPolarHBondContact O-CB 3.31Å; L212-L220 HydrophobicContact CD1-CB 4.34Å; L212-L220 HydrophobicContact CD1-CD2 3.78Å
213	A	83.9	Confident	93.5	Very high	79 Å²	79	31.6 Å²	31.6	65%	0.653	22%	0.218	S	C	*	.			trans	-116.7	153	175.7	0	0	0	0	0	111.1
214	G	87.4	Confident	93.4	Very high	29 Å²	29	32.4 Å²	32.4	30%	0.299	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-134.7	173.9	0	0	0	0	0	113	A216 S217 I218	G214-A216 PolarHBondContact O-N 3.31Å; G214-A216 VanDerWaalsContact O-N 3.09Å; G214-S217 PolarHBondContact O-N 3.24Å; G214-S217 VanDerWaalsContact O-N 3.17Å; G214-I218 WeakPolarHBondContact O-CG1 3.33Å; G214-I218 PolarHBondContact O-N 3.5Å
215	P	89.1	Confident	93.4	Very high	114 Å²	114	32.5 Å²	32.5	74%	0.74	23%	0.227	S	C	*	.	H	α-helix	trans	-57.7	-28.3	-171.9	-27.3	35.2	0	0	0	115.5	G219	P215-G219 PolarHBondContact O-N 3Å
216	A	90.8	Very high	93.5	Very high	43 Å²	43	33.6 Å²	33.6	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-71.1	-41.6	-179.8	0	0	0	0	0	112.2	L212 G214 G219 L220	L212-A216 HydrophobicContact CB-CB 4.25Å; L212-A216 HydrophobicContact CD2-CB 4.09Å; G214-A216 PolarHBondContact O-N 3.31Å; G214-A216 VanDerWaalsContact O-N 3.09Å; A216-G219 PolarHBondContact O-N 3.36Å; A216-L220 PolarHBondContact O-N 3.27Å
217	S	93.4	Very high	93.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.2	-38.5	175.7	-169.1	0	0	0	0	111.4	L212 G214 L220 L221 N258	L212-S217 VanDerWaalsContact O-CB 3.3Å; L212-S217 WeakPolarHBondContact O-CB 3.31Å; G214-S217 PolarHBondContact O-N 3.24Å; G214-S217 VanDerWaalsContact O-N 3.17Å; S217-L220 PolarHBondContact O-N 3.13Å; S217-L221 PolarHBondContact O-N 2.88Å; S217-N258 PolarHBondContact O-ND2 2.72Å; S217-N258 VanDerWaalsContact O-ND2 3.15Å
218	I	93.3	Very high	93.6	Very high	55 Å²	55	38 Å²	38	28%	0.282	25%	0.251	S	S	.	.	H	α-helix	trans	-63	-45.8	174.9	-61.8	166	0	0	0	110.5	G214 L220 L221 E257 N258	G214-I218 WeakPolarHBondContact O-CG1 3.33Å; G214-I218 PolarHBondContact O-N 3.5Å; I218-L220 VanDerWaalsContact C-N 3.29Å; I218-L220 PolarHBondContact O-N 3.38Å; I218-L221 PolarHBondContact O-N 3.48Å; I218-E257 HydrophobicContact CD1-CB 3.75Å; I218-E257 HydrophobicContact CD1-CG 3.83Å; I218-E257 HydrophobicContact CG1-CB 4.05Å; I218-N258 WeakPolarHBondContact CA-OD1 3.22Å
219	G	92.4	Very high	93.7	Very high	60 Å²	60	37.9 Å²	37.9	62%	0.619	25%	0.251	S	S	*	.	H	α-helix	trans	-65.3	-30.1	177.6	0	0	0	0	0	113.9	P215 A216	P215-G219 PolarHBondContact O-N 3Å; A216-G219 PolarHBondContact O-N 3.36Å
220	L	95.8	Very high	93.8	Very high	5 Å²	5	39 Å²	39	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-71.5	-35.1	176.6	-178.7	62.9	0	0	0	112.3	L174 L208 L212 A216 S217 I218 S222 I225 F252	L174-L220 HydrophobicContact CD2-CD1 4.41Å; L208-L220 HydrophobicContact CB-CD2 3.62Å; L208-L220 HydrophobicContact CD1-CD2 4.26Å; L212-L220 HydrophobicContact CD1-CB 4.34Å; L212-L220 HydrophobicContact CD1-CD2 3.78Å; A216-L220 PolarHBondContact O-N 3.27Å; S217-L220 PolarHBondContact O-N 3.13Å; I218-L220 VanDerWaalsContact C-N 3.29Å; I218-L220 PolarHBondContact O-N 3.38Å; L220-S222 PolarHBondContact O-N 3.44Å; L220-I225 HydrophobicContact CD1-CD1 4.3Å; L220-I225 WeakPolarHBondContact O-CD1 3.41Å; L220-F252 HydrophobicContact CB-CE1 4.21Å; L220-F252 HydrophobicContact CD2-CE1 4.01Å; L220-F252 HydrophobicContact CD2-CZ 4.01Å; L220-F252 HydrophobicContact CG-CE1 4.01Å; L220-F252 HydrophobicContact CG-CZ 4.05Å
221	L	96.9	Very high	94	Very high	14 Å²	14	40.5 Å²	40.5	7%	0.073	26%	0.263	C	S	.	.	S	Bend	trans	-76.7	67	177.6	-170.1	63.3	0	0	0	111.4	S217 I218 I225 L226 L229 F252 N258 V262	S217-L221 PolarHBondContact O-N 2.88Å; I218-L221 PolarHBondContact O-N 3.48Å; L221-I225 HydrophobicContact CD1-CG2 4.09Å; L221-L226 HydrophobicContact CD1-CB 4.14Å; L221-L226 HydrophobicContact CD1-CD1 4.45Å; L221-L229 HydrophobicContact CD1-CD1 4.49Å; L221-F252 HydrophobicContact CB-CD1 3.8Å; L221-F252 HydrophobicContact CB-CE1 3.85Å; L221-F252 HydrophobicContact CB-CG 4.42Å; L221-F252 HydrophobicContact CD1-CD1 4.11Å; L221-F252 HydrophobicContact CD1-CD2 3.88Å; L221-F252 HydrophobicContact CD1-CE1 4.23Å; L221-F252 HydrophobicContact CD1-CE2 4.04Å; L221-F252 HydrophobicContact CD1-CG 3.93Å; L221-F252 HydrophobicContact CD1-CZ 4.2Å; L221-F252 HydrophobicContact CD2-CB 4.21Å; L221-F252 HydrophobicContact CD2-CD1 4.39Å; L221-F252 HydrophobicContact CD2-CG 4.31Å; L221-F252 HydrophobicContact CG-CD1 4.31Å; L221-F252 HydrophobicContact CG-CG 4.45Å; L221-N258 HydrophobicContact CD2-CB 3.78Å; L221-V262 HydrophobicContact CD2-CG2 3.88Å
222	S	95.8	Very high	94.2	Very high	32 Å²	32	37.9 Å²	37.9	22%	0.224	25%	0.252	C	S	.	.			trans	-65.7	157.9	173.8	70.6	0	0	0	0	111.6	L220 G224 I225 L226	L220-S222 PolarHBondContact O-N 3.44Å; S222-G224 PolarHBondContact O-N 3.37Å; S222-I225 PolarHBondContact O-N 3.1Å; S222-I225 VanDerWaalsContact O-N 3.08Å; S222-I225 WeakPolarHBondContact OG-CG1 3.05Å; S222-I225 PolarHBondContact OG-N 3.28Å; S222-L226 PolarHBondContact O-N 3.26Å
223	P	96.1	Very high	94.4	Very high	98 Å²	98	37.3 Å²	37.3	64%	0.636	25%	0.249	S	C	*	.	H	α-helix	trans	-53	-40.2	174.8	-28.2	35.6	0	0	0	113.3	L226 E227	P223-L226 PolarHBondContact O-N 3.4Å; P223-E227 WeakPolarHBondContact O-CB 3.27Å; P223-E227 WeakPolarHBondContact O-CG 3.45Å; P223-E227 PolarHBondContact O-N 2.83Å
224	G	96.8	Very high	94.8	Very high	18 Å²	18	36.9 Å²	36.9	19%	0.186	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-38.4	177.9	0	0	0	0	0	113.5	L183 S184 S222 Y228	L183-G224 CarbonylContact C-O 3.58Å; L183-G224 CarbonylContact O-C 3.49Å; L183-G224 VanDerWaalsContact O-CA 3.26Å; L183-G224 WeakPolarHBondContact O-CA 3.03Å; S184-G224 WeakPolarHBondContact CA-O 3.43Å; S222-G224 PolarHBondContact O-N 3.37Å; G224-Y228 VanDerWaalsContact O-CB 3.27Å; G224-Y228 WeakPolarHBondContact O-CB 3.26Å; G224-Y228 PolarHBondContact O-N 2.87Å
225	I	97.7	Very high	94.7	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-67.5	-45.6	174.6	-73.4	168.9	0	0	0	110.5	T178 L183 L205 L220 L221 S222 E227 Y228 L229 F252	T178-I225 HydrophobicContact CG2-CD1 4.14Å; L183-I225 HydrophobicContact CB-CG1 4.32Å; L183-I225 HydrophobicContact CD1-CG1 4.11Å; L205-I225 HydrophobicContact CD1-CG2 4.02Å; L205-I225 HydrophobicContact CD2-CD1 4.17Å; L205-I225 HydrophobicContact CD2-CG2 4.32Å; L220-I225 HydrophobicContact CD1-CD1 4.3Å; L220-I225 WeakPolarHBondContact O-CD1 3.41Å; L221-I225 HydrophobicContact CD1-CG2 4.09Å; S222-I225 PolarHBondContact O-N 3.1Å; S222-I225 VanDerWaalsContact O-N 3.08Å; S222-I225 WeakPolarHBondContact OG-CG1 3.05Å; S222-I225 PolarHBondContact OG-N 3.28Å; I225-E227 PolarHBondContact O-N 2.99Å; I225-Y228 PolarHBondContact O-N 2.84Å; I225-L229 HydrophobicContact CG2-CD1 3.94Å; I225-L229 HydrophobicContact CG2-CG 4.38Å; I225-L229 VanDerWaalsContact O-CG 3.32Å; I225-L229 WeakPolarHBondContact O-CG 3.31Å; I225-L229 PolarHBondContact O-N 2.82Å; I225-F252 HydrophobicContact CG2-CE2 4.41Å; I225-F252 HydrophobicContact CG2-CZ 4.44Å
226	L	98	Very high	94.5	Very high	23 Å²	23	42.8 Å²	42.8	12%	0.12	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-47.9	177	179.2	60.1	0	0	0	111.3	L221 S222 P223 Y228 L229 L230 L249 T261 V262	L221-L226 HydrophobicContact CD1-CB 4.14Å; L221-L226 HydrophobicContact CD1-CD1 4.45Å; S222-L226 PolarHBondContact O-N 3.26Å; P223-L226 PolarHBondContact O-N 3.4Å; L226-Y228 VanDerWaalsContact C-N 3.33Å; L226-Y228 PolarHBondContact O-N 2.97Å; L226-L229 PolarHBondContact O-N 3.47Å; L226-L230 HydrophobicContact CD1-CD1 3.9Å; L226-L230 HydrophobicContact CD1-CG 4.08Å; L226-L230 HydrophobicContact CG-CD1 3.9Å; L226-L230 HydrophobicContact CG-CG 4.47Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 VanDerWaalsContact O-CG 3.31Å; L226-L230 WeakPolarHBondContact O-CG 3.48Å; L226-L230 PolarHBondContact O-N 3.16Å; L226-L249 HydrophobicContact CD1-CD2 3.84Å; L226-T261 HydrophobicContact CD2-CG2 3.88Å; L226-V262 HydrophobicContact CD1-CG2 3.97Å
227	E	96.8	Very high	94.6	Very high	99 Å²	99	41.9 Å²	41.9	46%	0.463	24%	0.235	S	C	.	.	H	α-helix	trans	-58.8	-43.8	176	-77.7	179.3	-171.1	0	0	112.2	P223 I225 L230 H231	P223-E227 WeakPolarHBondContact O-CB 3.27Å; P223-E227 WeakPolarHBondContact O-CG 3.45Å; P223-E227 PolarHBondContact O-N 2.83Å; I225-E227 PolarHBondContact O-N 2.99Å; E227-L230 PolarHBondContact O-N 3.5Å; E227-H231 WeakPolarHBondContact O-CB 3.49Å; E227-H231 PolarHBondContact O-N 2.9Å; E227-H231 PolarHBondContact O-ND1 3.18Å
228	Y	97.4	Very high	94.6	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	25%	0.25	C	S	.	.	H	α-helix	trans	-60.8	-46.1	177.8	175.6	-86.5	0	0	0	111.7	L183 A187 A188 H198 T201 T202 G224 I225 L226 H231 S232	L183-Y228 HydrophobicContact CB-CD2 4.06Å; L183-Y228 HydrophobicContact CB-CG 3.97Å; L183-Y228 HydrophobicContact CD1-CD1 4.18Å; L183-Y228 HydrophobicContact CD1-CE1 4.42Å; L183-Y228 HydrophobicContact CD1-CG 4.31Å; L183-Y228 HydrophobicContact CD2-CD2 3.88Å; L183-Y228 HydrophobicContact CD2-CE2 3.78Å; L183-Y228 HydrophobicContact CD2-CG 4.33Å; L183-Y228 HydrophobicContact CG-CD2 4.4Å; L183-Y228 HydrophobicContact CG-CG 4.42Å; A187-Y228 HydrophobicContact CB-CD2 4.38Å; A188-Y228 HydrophobicContact CB-CD2 3.66Å; A188-Y228 HydrophobicContact CB-CE2 4.03Å; A188-Y228 HydrophobicContact CB-CG 4.22Å; H198-Y228 AromaticContact CD2-CZ 3.86Å; H198-Y228 PolarHBondContact CD2-OH 2.89Å; H198-Y228 AromaticContact CE1-CE2 3.92Å; H198-Y228 AromaticContact CE1-CZ 3.89Å; H198-Y228 VanDerWaalsContact CG-OH 3.29Å; H198-Y228 AromaticContact NE2-CE2 3.49Å; H198-Y228 WeakPolarHBondContact NE2-CE2 3.42Å; H198-Y228 AromaticContact NE2-CZ 3.6Å; H198-Y228 PolarHBondContact NE2-OH 3.21Å; H198-Y228 VanDerWaalsContact NE2-OH 3.14Å; T201-Y228 HydrophobicContact CG2-CE1 4.16Å; T202-Y228 HydrophobicContact CG2-CE1 3.98Å; G224-Y228 VanDerWaalsContact O-CB 3.27Å; G224-Y228 WeakPolarHBondContact O-CB 3.26Å; G224-Y228 PolarHBondContact O-N 2.87Å; I225-Y228 PolarHBondContact O-N 2.84Å; L226-Y228 VanDerWaalsContact C-N 3.33Å; L226-Y228 PolarHBondContact O-N 2.97Å; Y228-H231 PolarHBondContact O-N 3.29Å; Y228-S232 WeakPolarHBondContact O-CB 3.38Å; Y228-S232 PolarHBondContact O-N 2.92Å; Y228-S232 PolarHBondContact O-OG 3.4Å
229	L	97.6	Very high	94.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-44.2	178.7	-68.6	172.9	0	0	0	111.7	T202 L205 L221 I225 L226 S232 L233 A245 A248 L249 F252	T202-L229 HydrophobicContact CG2-CD2 3.88Å; L205-L229 HydrophobicContact CD1-CD2 4.2Å; L221-L229 HydrophobicContact CD1-CD1 4.49Å; I225-L229 HydrophobicContact CG2-CD1 3.94Å; I225-L229 HydrophobicContact CG2-CG 4.38Å; I225-L229 VanDerWaalsContact O-CG 3.32Å; I225-L229 WeakPolarHBondContact O-CG 3.31Å; I225-L229 PolarHBondContact O-N 2.82Å; L226-L229 PolarHBondContact O-N 3.47Å; L229-S232 WeakPolarHBondContact O-CB 3.25Å; L229-S232 PolarHBondContact O-N 3.3Å; L229-L233 PolarHBondContact O-N 2.75Å; L229-A245 HydrophobicContact CD2-CB 4.15Å; L229-A248 HydrophobicContact CD1-CB 4.38Å; L229-A248 HydrophobicContact CD2-CB 4.01Å; L229-L249 HydrophobicContact CB-CD1 4.04Å; L229-L249 HydrophobicContact CB-CD2 3.9Å; L229-L249 HydrophobicContact CB-CG 3.94Å; L229-L249 HydrophobicContact CD1-CD2 3.85Å; L229-L249 HydrophobicContact CD1-CG 4.08Å; L229-F252 HydrophobicContact CD1-CD2 4.07Å; L229-F252 HydrophobicContact CD1-CE2 3.91Å
230	L	97	Very high	94.9	Very high	26 Å²	26	41.2 Å²	41.2	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-67.3	-37.1	178.4	-68.1	172.8	0	0	0	112.9	L226 E227 S232 L233 L249 I267 Q270	L226-L230 HydrophobicContact CD1-CD1 3.9Å; L226-L230 HydrophobicContact CD1-CG 4.08Å; L226-L230 HydrophobicContact CG-CD1 3.9Å; L226-L230 HydrophobicContact CG-CG 4.47Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 VanDerWaalsContact O-CG 3.31Å; L226-L230 WeakPolarHBondContact O-CG 3.48Å; L226-L230 PolarHBondContact O-N 3.16Å; E227-L230 PolarHBondContact O-N 3.5Å; L230-S232 VanDerWaalsContact C-N 3.29Å; L230-L233 PolarHBondContact O-N 3.17Å; L230-L249 HydrophobicContact CD2-CD1 4.21Å; L230-I267 HydrophobicContact CD2-CB 3.81Å; L230-I267 HydrophobicContact CD2-CD1 4.31Å; L230-I267 HydrophobicContact CD2-CG1 3.99Å; L230-Q270 PolarHBondContact O-NE2 3.15Å; L230-Q270 VanDerWaalsContact O-NE2 3.09Å; L230-Q270 PolarHBondContact O-OE1 3.19Å
231	H	95.7	Very high	95	Very high	82 Å²	82	41 Å²	41	38%	0.38	22%	0.217	S	C	.	.	H	α-helix	trans	-68	-32.2	173.3	-79.7	79.4	0	0	0	111.8	G185 A188 E227 Y228 L233 N234	G185-H231 WeakPolarHBondContact CA-ND1 3.34Å; A188-H231 HydrophobicContact CB-CB 3.71Å; E227-H231 WeakPolarHBondContact O-CB 3.49Å; E227-H231 PolarHBondContact O-N 2.9Å; E227-H231 PolarHBondContact O-ND1 3.18Å; Y228-H231 PolarHBondContact O-N 3.29Å; H231-L233 PolarHBondContact O-N 3.26Å; H231-N234 VanDerWaalsContact O-CB 3.24Å; H231-N234 WeakPolarHBondContact O-CB 3.44Å; H231-N234 PolarHBondContact O-N 3.35Å; H231-N234 VanDerWaalsContact O-N 3.1Å
232	S	95.6	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-18.9	176.6	-62.5	0	0	0	0	113.2	Y228 L229 L230 N234 S237 M242	Y228-S232 WeakPolarHBondContact O-CB 3.38Å; Y228-S232 PolarHBondContact O-N 2.92Å; Y228-S232 PolarHBondContact O-OG 3.4Å; L229-S232 WeakPolarHBondContact O-CB 3.25Å; L229-S232 PolarHBondContact O-N 3.3Å; L230-S232 VanDerWaalsContact C-N 3.29Å; S232-N234 VanDerWaalsContact C-N 3.34Å; S232-S237 WeakPolarHBondContact O-CB 3.35Å; S232-S237 PolarHBondContact O-OG 3.02Å; S232-M242 VanDerWaalsContact O-CG 3.32Å; S232-M242 WeakPolarHBondContact O-CG 3.22Å
233	L	95.4	Very high	95.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.7	174.2	-60.5	-178.2	0	0	0	114.4	L229 L230 H231 M242 A245 L246 L249 I267 L274	L229-L233 PolarHBondContact O-N 2.75Å; L230-L233 PolarHBondContact O-N 3.17Å; H231-L233 PolarHBondContact O-N 3.26Å; L233-M242 VanDerWaalsContact CD2-O 3.31Å; L233-M242 WeakPolarHBondContact CD2-O 3.35Å; L233-A245 HydrophobicContact CD2-CB 4.03Å; L233-L246 HydrophobicContact CD2-CB 3.91Å; L233-L249 HydrophobicContact CD1-CD1 3.8Å; L233-L249 HydrophobicContact CG-CD1 4.45Å; L233-I267 HydrophobicContact CD1-CD1 4.39Å; L233-I267 HydrophobicContact CD1-CG1 4.07Å; L233-L274 HydrophobicContact CB-CD1 4.37Å; L233-L274 HydrophobicContact CD2-CD1 4.47Å
234	N	90.9	Very high	95.2	Very high	71 Å²	71	34.7 Å²	34.7	38%	0.38	18%	0.175	S	C	.	.	S	Bend	trans	-65.6	140.9	180	-172	-29.5	0	0	0	111.5	H231 S232 Q236 S237 M242	H231-N234 VanDerWaalsContact O-CB 3.24Å; H231-N234 WeakPolarHBondContact O-CB 3.44Å; H231-N234 PolarHBondContact O-N 3.35Å; H231-N234 VanDerWaalsContact O-N 3.1Å; S232-N234 VanDerWaalsContact C-N 3.34Å; N234-Q236 PolarHBondContact O-N 2.75Å; N234-Q236 PolarHBondContact OD1-N 2.68Å; N234-S237 VanDerWaalsContact O-CB 3.25Å; N234-S237 WeakPolarHBondContact O-CB 3.18Å; N234-S237 PolarHBondContact O-N 3.15Å; N234-S237 PolarHBondContact O-OG 2.82Å; N234-M242 WeakPolarHBondContact O-CE 3.45Å
235	F	86.2	Confident	95.3	Very high	89 Å²	89	33.9 Å²	33.9	39%	0.39	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-22.2	177.6	-78	-80	0	0	0	116.9	M242 L273 L274 W277	F235-M242 VanDerWaalsContact CA-CE 3.46Å; F235-L273 HydrophobicContact CE2-CB 3.37Å; F235-L273 HydrophobicContact CE2-CD1 3.68Å; F235-L273 HydrophobicContact CE2-CG 4.16Å; F235-L273 HydrophobicContact CZ-CB 3.28Å; F235-L273 HydrophobicContact CZ-CD1 4.44Å; F235-L273 HydrophobicContact CZ-CG 4.45Å; F235-L274 HydrophobicContact CE1-CD2 3.99Å; F235-L274 HydrophobicContact CE2-CD2 4.49Å; F235-L274 HydrophobicContact CZ-CD2 3.88Å; F235-L274 HydrophobicContact CZ-CG 4.5Å; F235-W277 AromaticContact CD1-CH2 3.88Å; F235-W277 HydrophobicContact CD1-CH2 3.88Å; F235-W277 AromaticContact CD1-CZ2 3.47Å; F235-W277 HydrophobicContact CD1-CZ2 3.47Å; F235-W277 VanDerWaalsContact CD1-CZ2 3.47Å; F235-W277 AromaticContact CE1-CE2 3.84Å; F235-W277 AromaticContact CE1-CH2 3.97Å; F235-W277 HydrophobicContact CE1-CH2 3.97Å; F235-W277 AromaticContact CE1-CZ2 3.39Å; F235-W277 HydrophobicContact CE1-CZ2 3.39Å
236	Q	85.3	Confident	95.3	Very high	178 Å²	178	33.7 Å²	33.7	83%	0.832	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-19.4	177	-63.6	-179.8	-7	0	0	113.2	N234	N234-Q236 PolarHBondContact O-N 2.75Å; N234-Q236 PolarHBondContact OD1-N 2.68Å
237	S	91.8	Very high	95.3	Very high	24 Å²	24	32.7 Å²	32.7	17%	0.168	16%	0.16	C	C	.	.	S	Bend	trans	-70	157.2	178.9	-58	0	0	0	0	111.5	S232 N234 M242	S232-S237 WeakPolarHBondContact O-CB 3.35Å; S232-S237 PolarHBondContact O-OG 3.02Å; N234-S237 VanDerWaalsContact O-CB 3.25Å; N234-S237 WeakPolarHBondContact O-CB 3.18Å; N234-S237 PolarHBondContact O-N 3.15Å; N234-S237 PolarHBondContact O-OG 2.82Å; S237-M242 WeakPolarHBondContact O-CE 3.27Å
238	H	94.9	Very high	95.4	Very high	67 Å²	67	28 Å²	28	31%	0.31	14%	0.138	S	C	.	.			trans	-66.6	136.2	173.4	-169.9	-83.5	0	0	0	110.3	P195 T240 V241 M242	P195-H238 HydrophobicContact CB-CB 3.76Å; H238-T240 VanDerWaalsContact C-N 3.3Å; H238-T240 PolarHBondContact CE1-OG1 3.24Å; H238-T240 PolarHBondContact ND1-N 3.05Å; H238-T240 PolarHBondContact ND1-OG1 3.1Å; H238-T240 PolarHBondContact O-N 2.93Å; H238-V241 HydrophobicContact CB-CB 4.46Å; H238-V241 HydrophobicContact CB-CG2 4.03Å; H238-V241 WeakPolarHBondContact O-CA 3.34Å; H238-V241 WeakPolarHBondContact O-CB 3.37Å; H238-V241 PolarHBondContact O-N 3.19Å; H238-M242 PolarHBondContact O-N 3.14Å; H238-M242 VanDerWaalsContact O-N 3.1Å
239	P	96.3	Very high	95.4	Very high	20 Å²	20	28 Å²	28	13%	0.13	14%	0.138	C	C	.	.	H	α-helix	trans	-53.4	-39.9	-177.1	-31.4	37.4	0	0	0	114.9	V241 M242 L243 L284 K285 V288	P239-V241 VanDerWaalsContact C-N 3.29Å; P239-V241 PolarHBondContact O-N 3.31Å; P239-M242 WeakPolarHBondContact O-CB 3.48Å; P239-M242 PolarHBondContact O-N 3.05Å; P239-L243 WeakPolarHBondContact O-CB 3.18Å; P239-L243 PolarHBondContact O-N 3.47Å; P239-L284 HydrophobicContact CB-CB 3.79Å; P239-K285 HydrophobicContact CB-CG 4.31Å; P239-K285 HydrophobicContact CG-CG 3.97Å; P239-V288 HydrophobicContact CB-CG2 4.37Å; P239-V288 VanDerWaalsContact O-CG2 3.23Å; P239-V288 WeakPolarHBondContact O-CG2 3.25Å
240	T	95.5	Very high	95.4	Very high	13 Å²	13	28.5 Å²	28.5	8%	0.08	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-35.7	175.7	-37.9	0	0	0	0	112.3	L150 R199 H238 L243 F244	L150-T240 HydrophobicContact CD1-CG2 4.09Å; R199-T240 HydrophobicContact CG-CG2 3.6Å; H238-T240 VanDerWaalsContact C-N 3.3Å; H238-T240 PolarHBondContact CE1-OG1 3.24Å; H238-T240 PolarHBondContact ND1-N 3.05Å; H238-T240 PolarHBondContact ND1-OG1 3.1Å; H238-T240 PolarHBondContact O-N 2.93Å; T240-L243 PolarHBondContact O-N 2.89Å; T240-F244 HydrophobicContact CG2-CD2 3.98Å; T240-F244 HydrophobicContact CG2-CE2 3.98Å; T240-F244 VanDerWaalsContact O-CD2 3.32Å; T240-F244 WeakPolarHBondContact O-CD2 3.32Å; T240-F244 PolarHBondContact O-N 3.19Å; T240-F244 VanDerWaalsContact O-N 3.14Å
241	V	96.6	Very high	95.4	Very high	2 Å²	2	28 Å²	28	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-68.2	-44.1	176.3	176.9	0	0	0	0	110	P195 H198 R199 H238 P239 L243 F244 A245	P195-V241 HydrophobicContact CB-CG2 4.14Å; P195-V241 WeakPolarHBondContact O-CG2 3.23Å; H198-V241 HydrophobicContact CB-CB 4.42Å; H198-V241 HydrophobicContact CB-CG1 3.86Å; H198-V241 HydrophobicContact CB-CG2 3.63Å; R199-V241 HydrophobicContact CB-CG2 4.24Å; H238-V241 HydrophobicContact CB-CB 4.46Å; H238-V241 HydrophobicContact CB-CG2 4.03Å; H238-V241 WeakPolarHBondContact O-CA 3.34Å; H238-V241 WeakPolarHBondContact O-CB 3.37Å; H238-V241 PolarHBondContact O-N 3.19Å; P239-V241 VanDerWaalsContact C-N 3.29Å; P239-V241 PolarHBondContact O-N 3.31Å; V241-L243 VanDerWaalsContact C-N 3.31Å; V241-L243 PolarHBondContact O-N 2.97Å; V241-F244 PolarHBondContact O-N 3.47Å; V241-A245 VanDerWaalsContact O-CB 3.24Å; V241-A245 WeakPolarHBondContact O-CB 3.44Å; V241-A245 PolarHBondContact O-N 3.1Å
242	M	97.7	Very high	95.5	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-57.5	-45.5	175	-60.7	161.7	167.8	0	0	111.4	S232 L233 N234 F235 S237 H238 P239 A245 L246 L274 W277 V288	S232-M242 VanDerWaalsContact O-CG 3.32Å; S232-M242 WeakPolarHBondContact O-CG 3.22Å; L233-M242 VanDerWaalsContact CD2-O 3.31Å; L233-M242 WeakPolarHBondContact CD2-O 3.35Å; N234-M242 WeakPolarHBondContact O-CE 3.45Å; F235-M242 VanDerWaalsContact CA-CE 3.46Å; S237-M242 WeakPolarHBondContact O-CE 3.27Å; H238-M242 PolarHBondContact O-N 3.14Å; H238-M242 VanDerWaalsContact O-N 3.1Å; P239-M242 WeakPolarHBondContact O-CB 3.48Å; P239-M242 PolarHBondContact O-N 3.05Å; M242-A245 PolarHBondContact O-N 2.92Å; M242-L246 WeakPolarHBondContact O-CB 3.46Å; M242-L246 PolarHBondContact O-N 2.92Å; M242-L274 HydrophobicContact SD-CD2 4.46Å; M242-W277 HydrophobicContact CE-CH2 3.97Å; M242-W277 HydrophobicContact CE-CZ3 4.3Å; M242-W277 HydrophobicContact SD-CH2 3.9Å; M242-W277 HydrophobicContact SD-CZ3 3.62Å; M242-V288 HydrophobicContact CB-CG1 4.24Å; M242-V288 HydrophobicContact CB-CG2 4.08Å
243	L	98.1	Very high	95.5	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-58.9	-52.2	-179.4	178.3	60.6	0	0	0	111.4	P239 T240 V241 L246 I247 Q287 V288 C291	P239-L243 WeakPolarHBondContact O-CB 3.18Å; P239-L243 PolarHBondContact O-N 3.47Å; T240-L243 PolarHBondContact O-N 2.89Å; V241-L243 VanDerWaalsContact C-N 3.31Å; V241-L243 PolarHBondContact O-N 2.97Å; L243-L246 PolarHBondContact O-N 2.83Å; L243-I247 HydrophobicContact CD1-CD1 3.97Å; L243-I247 HydrophobicContact CD1-CG1 4.46Å; L243-I247 HydrophobicContact CG-CD1 3.92Å; L243-I247 VanDerWaalsContact O-CG1 3.28Å; L243-I247 WeakPolarHBondContact O-CG1 3.24Å; L243-I247 PolarHBondContact O-N 2.99Å; L243-Q287 HydrophobicContact CD1-CB 4.2Å; L243-Q287 HydrophobicContact CD2-CB 3.85Å; L243-V288 HydrophobicContact CB-CG2 3.86Å; L243-C291 HydrophobicContact CD1-CB 4.21Å
244	F	98.1	Very high	95.3	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.035	14%	0.144	C	C	.	.	H	α-helix	trans	-74	-28.3	-178.3	-79.3	-86	0	0	0	112.9	P156 R199 T202 A203 T240 V241 I247 A248 Y470	P156-F244 HydrophobicContact CB-CD1 4.41Å; P156-F244 HydrophobicContact CB-CE1 3.38Å; P156-F244 HydrophobicContact CB-CE2 4.11Å; P156-F244 HydrophobicContact CB-CZ 3.21Å; P156-F244 HydrophobicContact CG-CE1 4.02Å; P156-F244 HydrophobicContact CG-CE2 3.84Å; P156-F244 HydrophobicContact CG-CZ 3.28Å; R199-F244 HydrophobicContact CG-CD2 3.65Å; R199-F244 HydrophobicContact CG-CE2 4.17Å; R199-F244 HydrophobicContact CG-CG 4.19Å; T202-F244 WeakPolarHBondContact OG1-CB 3.32Å; A203-F244 HydrophobicContact CB-CD1 3.74Å; A203-F244 HydrophobicContact CB-CE1 4.21Å; A203-F244 HydrophobicContact CB-CG 4.42Å; T240-F244 HydrophobicContact CG2-CD2 3.98Å; T240-F244 HydrophobicContact CG2-CE2 3.98Å; T240-F244 VanDerWaalsContact O-CD2 3.32Å; T240-F244 WeakPolarHBondContact O-CD2 3.32Å; T240-F244 PolarHBondContact O-N 3.19Å; T240-F244 VanDerWaalsContact O-N 3.14Å; V241-F244 PolarHBondContact O-N 3.47Å; F244-I247 HydrophobicContact CD1-CD1 4.45Å; F244-A248 VanDerWaalsContact O-CB 3.31Å; F244-A248 WeakPolarHBondContact O-CB 3.23Å; F244-A248 PolarHBondContact O-N 3.32Å; F244-Y470 AromaticContact CE1-CD1 3.78Å; F244-Y470 HydrophobicContact CE1-CD1 3.78Å; F244-Y470 AromaticContact CE1-CD2 3.92Å; F244-Y470 HydrophobicContact CE1-CD2 3.92Å; F244-Y470 AromaticContact CE1-CE1 3.79Å; F244-Y470 HydrophobicContact CE1-CE1 3.79Å; F244-Y470 AromaticContact CE1-CE2 3.89Å; F244-Y470 HydrophobicContact CE1-CE2 3.89Å; F244-Y470 AromaticContact CE1-CG 3.84Å; F244-Y470 HydrophobicContact CE1-CG 3.84Å; F244-Y470 AromaticContact CE1-CZ 3.83Å; F244-Y470 HydrophobicContact CZ-CD1 4.11Å; F244-Y470 HydrophobicContact CZ-CD2 4.03Å; F244-Y470 HydrophobicContact CZ-CE2 4.45Å; F244-Y470 AromaticContact CZ-CG 3.83Å; F244-Y470 HydrophobicContact CZ-CG 3.83Å
245	A	98.3	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-43.8	169.5	0	0	0	0	0	111.4	T202 L229 L233 V241 M242 A248 L249	T202-A245 HydrophobicContact CG2-CB 3.99Å; L229-A245 HydrophobicContact CD2-CB 4.15Å; L233-A245 HydrophobicContact CD2-CB 4.03Å; V241-A245 VanDerWaalsContact O-CB 3.24Å; V241-A245 WeakPolarHBondContact O-CB 3.44Å; V241-A245 PolarHBondContact O-N 3.1Å; M242-A245 PolarHBondContact O-N 2.92Å; A245-A248 PolarHBondContact O-N 2.78Å; A245-L249 WeakPolarHBondContact O-CG 3.41Å; A245-L249 PolarHBondContact O-N 3.43Å
246	L	98.5	Very high	95.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-49.4	175.7	178.7	52.6	0	0	0	111	L233 M242 L243 A248 L249 E250 L271 C291 A292	L233-L246 HydrophobicContact CD2-CB 3.91Å; M242-L246 WeakPolarHBondContact O-CB 3.46Å; M242-L246 PolarHBondContact O-N 2.92Å; L243-L246 PolarHBondContact O-N 2.83Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 2.94Å; L246-L249 WeakPolarHBondContact O-CB 3.46Å; L246-L249 PolarHBondContact O-N 2.88Å; L246-L249 VanDerWaalsContact O-N 3.13Å; L246-E250 HydrophobicContact CD1-CG 4.42Å; L246-E250 WeakPolarHBondContact O-CG 3.19Å; L246-E250 PolarHBondContact O-N 2.64Å; L246-L271 HydrophobicContact CD1-CD1 4.43Å; L246-L271 HydrophobicContact CD1-CD2 3.64Å; L246-L271 HydrophobicContact CD2-CD2 3.93Å; L246-L271 HydrophobicContact CG-CD2 4.42Å; L246-C291 HydrophobicContact CD2-CB 3.63Å; L246-C291 HydrophobicContact CG-CB 4.39Å; L246-A292 HydrophobicContact CD2-CB 4.13Å
247	I	98.2	Very high	96.1	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-56.8	-44.1	176.5	-67.3	163.4	0	0	0	110.4	L243 F244 L249 E250 K251 D342 Y470	L243-I247 HydrophobicContact CD1-CD1 3.97Å; L243-I247 HydrophobicContact CD1-CG1 4.46Å; L243-I247 HydrophobicContact CG-CD1 3.92Å; L243-I247 VanDerWaalsContact O-CG1 3.28Å; L243-I247 WeakPolarHBondContact O-CG1 3.24Å; L243-I247 PolarHBondContact O-N 2.99Å; F244-I247 HydrophobicContact CD1-CD1 4.45Å; I247-L249 PolarHBondContact O-N 3.46Å; I247-E250 WeakPolarHBondContact O-CB 3.49Å; I247-E250 PolarHBondContact O-N 2.95Å; I247-K251 HydrophobicContact CG2-CG 4.39Å; I247-K251 WeakPolarHBondContact O-CG 3.18Å; I247-K251 PolarHBondContact O-N 3.07Å; I247-D342 VanDerWaalsContact CD1-OD1 3.28Å; I247-D342 WeakPolarHBondContact CD1-OD1 3.31Å; I247-D342 HydrophobicContact CG2-CB 4.38Å; I247-Y470 HydrophobicContact CD1-CD1 4.06Å; I247-Y470 HydrophobicContact CD1-CE1 4.32Å; I247-Y470 HydrophobicContact CG2-CE1 4.29Å
248	A	98.2	Very high	96.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.9	-44.5	177.1	0	0	0	0	0	112.3	T202 L229 F244 A245 L246 E250 K251 F252	T202-A248 WeakPolarHBondContact O-CB 3.05Å; L229-A248 HydrophobicContact CD1-CB 4.38Å; L229-A248 HydrophobicContact CD2-CB 4.01Å; F244-A248 VanDerWaalsContact O-CB 3.31Å; F244-A248 WeakPolarHBondContact O-CB 3.23Å; F244-A248 PolarHBondContact O-N 3.32Å; A245-A248 PolarHBondContact O-N 2.78Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 2.94Å; A248-E250 VanDerWaalsContact C-N 3.31Å; A248-E250 PolarHBondContact O-N 3Å; A248-K251 PolarHBondContact O-N 3.4Å; A248-K251 VanDerWaalsContact O-N 3.16Å; A248-F252 WeakPolarHBondContact O-CD2 3.38Å; A248-F252 PolarHBondContact O-N 3.28Å
249	L	98.4	Very high	96.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.5	-38.8	175.5	-70.9	162	0	0	0	111.9	L226 L229 L230 L233 A245 L246 I247 F252 A253 V262 I267	L226-L249 HydrophobicContact CD1-CD2 3.84Å; L229-L249 HydrophobicContact CB-CD1 4.04Å; L229-L249 HydrophobicContact CB-CD2 3.9Å; L229-L249 HydrophobicContact CB-CG 3.94Å; L229-L249 HydrophobicContact CD1-CD2 3.85Å; L229-L249 HydrophobicContact CD1-CG 4.08Å; L230-L249 HydrophobicContact CD2-CD1 4.21Å; L233-L249 HydrophobicContact CD1-CD1 3.8Å; L233-L249 HydrophobicContact CG-CD1 4.45Å; A245-L249 WeakPolarHBondContact O-CG 3.41Å; A245-L249 PolarHBondContact O-N 3.43Å; L246-L249 WeakPolarHBondContact O-CB 3.46Å; L246-L249 PolarHBondContact O-N 2.88Å; L246-L249 VanDerWaalsContact O-N 3.13Å; I247-L249 PolarHBondContact O-N 3.46Å; L249-F252 PolarHBondContact O-N 3.48Å; L249-A253 WeakPolarHBondContact O-CB 3.32Å; L249-A253 PolarHBondContact O-N 2.88Å; L249-V262 HydrophobicContact CB-CG1 4.5Å; L249-V262 HydrophobicContact CD2-CG1 4.04Å; L249-V262 HydrophobicContact CD2-CG2 4.05Å; L249-I267 HydrophobicContact CB-CD1 4.24Å; L249-I267 HydrophobicContact CD1-CD1 3.75Å; L249-I267 HydrophobicContact CG-CD1 4.46Å
250	E	97.3	Very high	96.3	Very high	11 Å²	11	27 Å²	27	5%	0.051	14%	0.14	C	C	.	.	H	α-helix	trans	-62.7	-42.4	172.8	-64.4	-178	171.4	0	0	112.2	L246 I247 A248 A253 Q254 S295 L299 F300 K331	L246-E250 HydrophobicContact CD1-CG 4.42Å; L246-E250 WeakPolarHBondContact O-CG 3.19Å; L246-E250 PolarHBondContact O-N 2.64Å; I247-E250 WeakPolarHBondContact O-CB 3.49Å; I247-E250 PolarHBondContact O-N 2.95Å; A248-E250 VanDerWaalsContact C-N 3.31Å; A248-E250 PolarHBondContact O-N 3Å; E250-A253 PolarHBondContact O-N 3.42Å; E250-Q254 PolarHBondContact O-N 3.16Å; E250-S295 PolarHBondContact OE1-OG 3.26Å; E250-L299 HydrophobicContact CB-CD1 3.82Å; E250-L299 HydrophobicContact CG-CD1 3.75Å; E250-F300 HydrophobicContact CG-CE2 4.39Å; E250-K331 IonicContact OE1-NZ 2.67Å; E250-K331 PolarHBondContact OE1-NZ 3.28Å; E250-K331 IonicContact OE2-NZ 2.6Å; E250-K331 PolarHBondContact OE2-NZ 3.14Å
251	K	96.4	Very high	96.3	Very high	16 Å²	16	29.3 Å²	29.3	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-65.4	-42.8	177.1	-62.7	-54.5	-177	164.5	0	111.5	A209 E210 I247 A248 A253 Q254 D342	A209-K251 HydrophobicContact CB-CB 3.82Å; E210-K251 HydrophobicContact CB-CB 4.45Å; E210-K251 HydrophobicContact CB-CD 4.1Å; E210-K251 HydrophobicContact CB-CG 4.35Å; E210-K251 HydrophobicContact CG-CD 4.39Å; E210-K251 IonicContact OE1-NZ 2.89Å; E210-K251 PolarHBondContact OE1-NZ 3.06Å; E210-K251 WeakPolarHBondContact OE2-CE 3.19Å; E210-K251 IonicContact OE2-NZ 2.68Å; E210-K251 PolarHBondContact OE2-NZ 2.99Å; E210-K251 VanDerWaalsContact OE2-NZ 3.09Å; I247-K251 HydrophobicContact CG2-CG 4.39Å; I247-K251 WeakPolarHBondContact O-CG 3.18Å; I247-K251 PolarHBondContact O-N 3.07Å; A248-K251 PolarHBondContact O-N 3.4Å; A248-K251 VanDerWaalsContact O-N 3.16Å; K251-A253 VanDerWaalsContact C-N 3.28Å; K251-A253 PolarHBondContact O-N 3.42Å; K251-Q254 VanDerWaalsContact O-CB 3.29Å; K251-Q254 WeakPolarHBondContact O-CB 3.22Å; K251-Q254 VanDerWaalsContact O-CG 3.26Å; K251-Q254 WeakPolarHBondContact O-CG 3.32Å; K251-Q254 PolarHBondContact O-N 3.14Å; K251-Q254 VanDerWaalsContact O-N 3.16Å; K251-D342 VanDerWaalsContact CE-O 3.31Å; K251-D342 WeakPolarHBondContact CE-O 3.34Å; K251-D342 PolarHBondContact NZ-O 3.18Å
252	F	97.5	Very high	96.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.6	-40.7	173.4	-82	-66.5	0	0	0	112	L205 A209 L220 L221 I225 L229 A248 L249 Q254 T255 N258	L205-F252 HydrophobicContact CB-CE2 4.27Å; A209-F252 HydrophobicContact CB-CB 4.4Å; A209-F252 HydrophobicContact CB-CD1 3.55Å; A209-F252 HydrophobicContact CB-CD2 3.89Å; A209-F252 HydrophobicContact CB-CE1 3.68Å; A209-F252 HydrophobicContact CB-CE2 3.98Å; A209-F252 HydrophobicContact CB-CG 3.67Å; A209-F252 HydrophobicContact CB-CZ 3.88Å; L220-F252 HydrophobicContact CB-CE1 4.21Å; L220-F252 HydrophobicContact CD2-CE1 4.01Å; L220-F252 HydrophobicContact CD2-CZ 4.01Å; L220-F252 HydrophobicContact CG-CE1 4.01Å; L220-F252 HydrophobicContact CG-CZ 4.05Å; L221-F252 HydrophobicContact CB-CD1 3.8Å; L221-F252 HydrophobicContact CB-CE1 3.85Å; L221-F252 HydrophobicContact CB-CG 4.42Å; L221-F252 HydrophobicContact CD1-CD1 4.11Å; L221-F252 HydrophobicContact CD1-CD2 3.88Å; L221-F252 HydrophobicContact CD1-CE1 4.23Å; L221-F252 HydrophobicContact CD1-CE2 4.04Å; L221-F252 HydrophobicContact CD1-CG 3.93Å; L221-F252 HydrophobicContact CD1-CZ 4.2Å; L221-F252 HydrophobicContact CD2-CB 4.21Å; L221-F252 HydrophobicContact CD2-CD1 4.39Å; L221-F252 HydrophobicContact CD2-CG 4.31Å; L221-F252 HydrophobicContact CG-CD1 4.31Å; L221-F252 HydrophobicContact CG-CG 4.45Å; I225-F252 HydrophobicContact CG2-CE2 4.41Å; I225-F252 HydrophobicContact CG2-CZ 4.44Å; L229-F252 HydrophobicContact CD1-CD2 4.07Å; L229-F252 HydrophobicContact CD1-CE2 3.91Å; A248-F252 WeakPolarHBondContact O-CD2 3.38Å; A248-F252 PolarHBondContact O-N 3.28Å; L249-F252 PolarHBondContact O-N 3.48Å; F252-Q254 PolarHBondContact O-N 2.89Å; F252-T255 PolarHBondContact O-N 3.3Å; F252-T255 PolarHBondContact O-OG1 2.72Å; F252-N258 HydrophobicContact CB-CB 4.36Å; F252-N258 WeakPolarHBondContact O-CB 3.41Å
253	A	95.9	Very high	96.2	Very high	5 Å²	5	31.4 Å²	31.4	4%	0.041	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	4.7	178.9	0	0	0	0	0	114.9	L249 E250 K251 K259 F300	L249-A253 WeakPolarHBondContact O-CB 3.32Å; L249-A253 PolarHBondContact O-N 2.88Å; E250-A253 PolarHBondContact O-N 3.42Å; K251-A253 VanDerWaalsContact C-N 3.28Å; K251-A253 PolarHBondContact O-N 3.42Å; A253-K259 HydrophobicContact CB-CB 3.97Å; A253-K259 HydrophobicContact CB-CG 4.17Å; A253-F300 HydrophobicContact CB-CE1 3.71Å; A253-F300 HydrophobicContact CB-CZ 3.63Å
254	Q	91.4	Very high	96.1	Very high	109 Å²	109	38.3 Å²	38.3	51%	0.509	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.7	168	-66.7	-179.6	2.5	0	0	112.2	E250 K251 F252	E250-Q254 PolarHBondContact O-N 3.16Å; K251-Q254 VanDerWaalsContact O-CB 3.29Å; K251-Q254 WeakPolarHBondContact O-CB 3.22Å; K251-Q254 VanDerWaalsContact O-CG 3.26Å; K251-Q254 WeakPolarHBondContact O-CG 3.32Å; K251-Q254 PolarHBondContact O-N 3.14Å; K251-Q254 VanDerWaalsContact O-N 3.16Å; F252-Q254 PolarHBondContact O-N 2.89Å
255	T	92.1	Very high	95.8	Very high	19 Å²	19	39.1 Å²	39.1	12%	0.117	21%	0.208	C	C	.	.	S	Bend	trans	-91.6	140.8	169.1	62.9	0	0	0	0	110.5	F252 E257 N258 K259	F252-T255 PolarHBondContact O-N 3.3Å; F252-T255 PolarHBondContact O-OG1 2.72Å; T255-E257 VanDerWaalsContact C-N 3.31Å; T255-E257 PolarHBondContact O-N 2.89Å; T255-N258 PolarHBondContact O-N 3.4Å; T255-N258 VanDerWaalsContact OG1-CB 3.27Å; T255-N258 WeakPolarHBondContact OG1-CB 3.43Å; T255-N258 PolarHBondContact OG1-ND2 2.84Å; T255-K259 VanDerWaalsContact O-CB 3.31Å; T255-K259 WeakPolarHBondContact O-CB 3.27Å; T255-K259 PolarHBondContact O-N 2.67Å
256	S	91.1	Very high	95.4	Very high	92 Å²	92	43.4 Å²	43.4	64%	0.643	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-40.6	-175	-59.6	0	0	0	0	112.4	K259 M260	S256-K259 WeakPolarHBondContact O-CB 3.46Å; S256-K259 PolarHBondContact O-N 2.88Å; S256-M260 WeakPolarHBondContact O-CG 3.35Å; S256-M260 PolarHBondContact O-N 3.21Å
257	E	94.9	Very high	95.3	Very high	106 Å²	106	43.5 Å²	43.5	50%	0.495	24%	0.237	S	C	.	.	H	α-helix	trans	-69	-46.7	-177.7	-63.9	87	160	0	0	111.9	I218 T255 K259 M260 T261	I218-E257 HydrophobicContact CD1-CB 3.75Å; I218-E257 HydrophobicContact CD1-CG 3.83Å; I218-E257 HydrophobicContact CG1-CB 4.05Å; T255-E257 VanDerWaalsContact C-N 3.31Å; T255-E257 PolarHBondContact O-N 2.89Å; E257-K259 VanDerWaalsContact C-N 3.32Å; E257-K259 PolarHBondContact O-N 3.24Å; E257-M260 PolarHBondContact O-N 3.32Å; E257-T261 PolarHBondContact O-N 3.09Å; E257-T261 PolarHBondContact O-OG1 2.81Å
258	N	96.8	Very high	95.3	Very high	3 Å²	3	44 Å²	44	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-66.8	-36.6	174.2	-73.7	-14.7	0	0	0	111	S217 I218 L221 F252 T255 M260 T261 V262	S217-N258 PolarHBondContact O-ND2 2.72Å; S217-N258 VanDerWaalsContact O-ND2 3.15Å; I218-N258 WeakPolarHBondContact CA-OD1 3.22Å; L221-N258 HydrophobicContact CD2-CB 3.78Å; F252-N258 HydrophobicContact CB-CB 4.36Å; F252-N258 WeakPolarHBondContact O-CB 3.41Å; T255-N258 PolarHBondContact O-N 3.4Å; T255-N258 VanDerWaalsContact OG1-CB 3.27Å; T255-N258 WeakPolarHBondContact OG1-CB 3.43Å; T255-N258 PolarHBondContact OG1-ND2 2.84Å; N258-M260 VanDerWaalsContact C-N 3.33Å; N258-M260 PolarHBondContact O-N 3.44Å; N258-T261 PolarHBondContact O-N 3.32Å; N258-V262 WeakPolarHBondContact O-CB 3.45Å; N258-V262 VanDerWaalsContact O-CG2 3.24Å; N258-V262 WeakPolarHBondContact O-CG2 3.48Å; N258-V262 PolarHBondContact O-N 2.92Å
259	K	95.6	Very high	95.1	Very high	72 Å²	72	47.5 Å²	47.5	31%	0.313	26%	0.259	S	S	.	.	H	α-helix	trans	-58.4	-46.2	174.4	-177.5	175.8	177.6	177.4	0	111.2	A253 T255 S256 E257 S263 L299	A253-K259 HydrophobicContact CB-CB 3.97Å; A253-K259 HydrophobicContact CB-CG 4.17Å; T255-K259 VanDerWaalsContact O-CB 3.31Å; T255-K259 WeakPolarHBondContact O-CB 3.27Å; T255-K259 PolarHBondContact O-N 2.67Å; S256-K259 WeakPolarHBondContact O-CB 3.46Å; S256-K259 PolarHBondContact O-N 2.88Å; E257-K259 VanDerWaalsContact C-N 3.32Å; E257-K259 PolarHBondContact O-N 3.24Å; K259-S263 WeakPolarHBondContact O-CB 3.35Å; K259-S263 PolarHBondContact O-N 3.2Å; K259-S263 PolarHBondContact O-OG 3.12Å; K259-L299 VanDerWaalsContact CE-O 3.26Å; K259-L299 WeakPolarHBondContact CE-O 3.33Å
260	M	95	Very high	95	Very high	106 Å²	106	50 Å²	50	52%	0.522	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-50.6	175.2	-72.4	-58.6	-59.8	0	0	110.7	S256 E257 N258 V262 S263 E264	S256-M260 WeakPolarHBondContact O-CG 3.35Å; S256-M260 PolarHBondContact O-N 3.21Å; E257-M260 PolarHBondContact O-N 3.32Å; N258-M260 VanDerWaalsContact C-N 3.33Å; N258-M260 PolarHBondContact O-N 3.44Å; M260-V262 VanDerWaalsContact C-N 3.34Å; M260-V262 PolarHBondContact O-N 3.46Å; M260-S263 PolarHBondContact O-N 3Å; M260-E264 WeakPolarHBondContact O-CB 3.45Å; M260-E264 WeakPolarHBondContact O-CG 3.42Å; M260-E264 PolarHBondContact O-N 3.49Å
261	T	96.9	Very high	95	Very high	61 Å²	61	49.5 Å²	49.5	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-55.3	-46.2	179.4	-54.9	0	0	0	0	112.4	L226 E257 N258	L226-T261 HydrophobicContact CD2-CG2 3.88Å; E257-T261 PolarHBondContact O-N 3.09Å; E257-T261 PolarHBondContact O-OG1 2.81Å; N258-T261 PolarHBondContact O-N 3.32Å
262	V	97.2	Very high	95	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.3	-37.6	178	178	0	0	0	0	110.9	L221 L226 L249 N258 M260 S265 I267 F300	L221-V262 HydrophobicContact CD2-CG2 3.88Å; L226-V262 HydrophobicContact CD1-CG2 3.97Å; L249-V262 HydrophobicContact CB-CG1 4.5Å; L249-V262 HydrophobicContact CD2-CG1 4.04Å; L249-V262 HydrophobicContact CD2-CG2 4.05Å; N258-V262 WeakPolarHBondContact O-CB 3.45Å; N258-V262 VanDerWaalsContact O-CG2 3.24Å; N258-V262 WeakPolarHBondContact O-CG2 3.48Å; N258-V262 PolarHBondContact O-N 2.92Å; M260-V262 VanDerWaalsContact C-N 3.34Å; M260-V262 PolarHBondContact O-N 3.46Å; V262-S265 VanDerWaalsContact O-CB 3.29Å; V262-S265 WeakPolarHBondContact O-CB 3.41Å; V262-S265 PolarHBondContact O-N 3.33Å; V262-S265 PolarHBondContact O-OG 2.95Å; V262-I267 HydrophobicContact CG1-CD1 3.68Å; V262-I267 HydrophobicContact CG1-CG2 4.15Å; V262-I267 WeakPolarHBondContact O-CG2 3.35Å; V262-F300 HydrophobicContact CB-CE1 3.87Å; V262-F300 HydrophobicContact CB-CZ 4.35Å; V262-F300 HydrophobicContact CG1-CD1 4.06Å; V262-F300 HydrophobicContact CG1-CE1 3.39Å; V262-F300 HydrophobicContact CG1-CE2 4.38Å; V262-F300 HydrophobicContact CG1-CZ 3.58Å
263	S	95.3	Very high	95	Very high	47 Å²	47	54.4 Å²	54.4	33%	0.329	30%	0.295	S	S	.	.	H	α-helix	trans	-71.5	-30.4	-179.9	-57.3	0	0	0	0	113.3	K259 M260 S265	K259-S263 WeakPolarHBondContact O-CB 3.35Å; K259-S263 PolarHBondContact O-N 3.2Å; K259-S263 PolarHBondContact O-OG 3.12Å; M260-S263 PolarHBondContact O-N 3Å; S263-S265 PolarHBondContact O-N 3.09Å
264	E	94.9	Very high	95.1	Very high	148 Å²	148	54.2 Å²	54.2	69%	0.692	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.4	173.8	-73.3	173.2	-179.3	0	0	112.4	M260	M260-E264 WeakPolarHBondContact O-CB 3.45Å; M260-E264 WeakPolarHBondContact O-CG 3.42Å; M260-E264 PolarHBondContact O-N 3.49Å
265	S	92.9	Very high	95.3	Very high	25 Å²	25	50.4 Å²	50.4	18%	0.175	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	172.5	168	86.5	0	0	0	0	112	V262 S263 I267	V262-S265 VanDerWaalsContact O-CB 3.29Å; V262-S265 WeakPolarHBondContact O-CB 3.41Å; V262-S265 PolarHBondContact O-N 3.33Å; V262-S265 PolarHBondContact O-OG 2.95Å; S263-S265 PolarHBondContact O-N 3.09Å; S265-I267 PolarHBondContact O-N 3.36Å; S265-I267 VanDerWaalsContact O-N 3.17Å; S265-I267 WeakPolarHBondContact OG-CB 3.3Å; S265-I267 PolarHBondContact OG-N 2.93Å
266	C	89.1	Confident	95.5	Very high	90 Å²	90	56.5 Å²	56.5	61%	0.608	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	24.4	174.5	-57.5	0	0	0	0	113.8	S268 D269 Q270	C266-S268 VanDerWaalsContact C-N 3.29Å; C266-S268 PolarHBondContact O-N 3.32Å; C266-D269 WeakPolarHBondContact O-CB 3.31Å; C266-D269 PolarHBondContact O-N 3Å; C266-Q270 PolarHBondContact O-N 2.71Å
267	I	96.5	Very high	95.9	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-56.6	-42.5	-178.4	-169	176.3	0	0	0	112	L230 L233 L249 V262 S265 D269 Q270 L271 F300	L230-I267 HydrophobicContact CD2-CB 3.81Å; L230-I267 HydrophobicContact CD2-CD1 4.31Å; L230-I267 HydrophobicContact CD2-CG1 3.99Å; L233-I267 HydrophobicContact CD1-CD1 4.39Å; L233-I267 HydrophobicContact CD1-CG1 4.07Å; L249-I267 HydrophobicContact CB-CD1 4.24Å; L249-I267 HydrophobicContact CD1-CD1 3.75Å; L249-I267 HydrophobicContact CG-CD1 4.46Å; V262-I267 HydrophobicContact CG1-CD1 3.68Å; V262-I267 HydrophobicContact CG1-CG2 4.15Å; V262-I267 WeakPolarHBondContact O-CG2 3.35Å; S265-I267 PolarHBondContact O-N 3.36Å; S265-I267 VanDerWaalsContact O-N 3.17Å; S265-I267 WeakPolarHBondContact OG-CB 3.3Å; S265-I267 PolarHBondContact OG-N 2.93Å; I267-D269 VanDerWaalsContact C-N 3.25Å; I267-D269 PolarHBondContact O-N 3.33Å; I267-Q270 WeakPolarHBondContact O-CB 3.25Å; I267-Q270 PolarHBondContact O-N 2.65Å; I267-L271 HydrophobicContact CD1-CD1 4.37Å; I267-L271 HydrophobicContact CG1-CD1 4.03Å; I267-L271 HydrophobicContact CG1-CG 4.08Å; I267-L271 WeakPolarHBondContact O-CG 3.4Å; I267-L271 PolarHBondContact O-N 2.88Å; I267-F300 HydrophobicContact CD1-CD2 3.76Å; I267-F300 HydrophobicContact CD1-CE2 3.73Å; I267-F300 HydrophobicContact CD1-CG 4.26Å; I267-F300 HydrophobicContact CD1-CZ 4.22Å; I267-F300 HydrophobicContact CG2-CB 4.08Å; I267-F300 HydrophobicContact CG2-CD1 4.28Å; I267-F300 HydrophobicContact CG2-CG 4.06Å
268	S	96.9	Very high	95.9	Very high	14 Å²	14	49.8 Å²	49.8	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-33	-177.5	61.3	0	0	0	0	112.5	C266 L271 I272 K302	C266-S268 VanDerWaalsContact C-N 3.29Å; C266-S268 PolarHBondContact O-N 3.32Å; S268-L271 PolarHBondContact O-N 3.32Å; S268-I272 WeakPolarHBondContact O-CD1 3.4Å; S268-I272 VanDerWaalsContact O-CG1 3.28Å; S268-I272 WeakPolarHBondContact O-CG1 3.42Å; S268-I272 PolarHBondContact O-N 3.34Å; S268-I272 VanDerWaalsContact O-N 3.12Å; S268-K302 WeakPolarHBondContact OG-CD 3.45Å
269	D	95.4	Very high	95.8	Very high	73 Å²	73	55.7 Å²	55.7	39%	0.39	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-39.8	174.6	-69	-54.2	0	0	0	112.2	C266 I267 K302	C266-D269 WeakPolarHBondContact O-CB 3.31Å; C266-D269 PolarHBondContact O-N 3Å; I267-D269 VanDerWaalsContact C-N 3.25Å; I267-D269 PolarHBondContact O-N 3.33Å; D269-K302 VanDerWaalsContact CG-NZ 3.29Å; D269-K302 VanDerWaalsContact OD1-CE 3.32Å; D269-K302 WeakPolarHBondContact OD1-CE 3.45Å; D269-K302 IonicContact OD1-NZ 3.95Å; D269-K302 PolarHBondContact OD1-NZ 2.93Å; D269-K302 IonicContact OD2-NZ 3.56Å; D269-K302 PolarHBondContact OD2-NZ 3.13Å
270	Q	95.8	Very high	95.8	Very high	52 Å²	52	54 Å²	54	24%	0.243	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-43.5	175.4	-64	-179.5	-32	0	0	111.1	L230 C266 I267 I272 L273 L274	L230-Q270 PolarHBondContact O-NE2 3.15Å; L230-Q270 VanDerWaalsContact O-NE2 3.09Å; L230-Q270 PolarHBondContact O-OE1 3.19Å; C266-Q270 PolarHBondContact O-N 2.71Å; I267-Q270 WeakPolarHBondContact O-CB 3.25Å; I267-Q270 PolarHBondContact O-N 2.65Å; Q270-I272 VanDerWaalsContact C-N 3.31Å; Q270-I272 PolarHBondContact O-N 3.37Å; Q270-L273 WeakPolarHBondContact O-CB 3.34Å; Q270-L273 PolarHBondContact O-N 3.41Å; Q270-L274 PolarHBondContact O-N 2.86Å; Q270-L274 VanDerWaalsContact O-N 3.13Å
271	L	97.8	Very high	95.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-34.1	-178.8	-63.3	179.3	0	0	0	112.7	L246 I267 S268 L273 L274 E275 A292 L296 F300	L246-L271 HydrophobicContact CD1-CD1 4.43Å; L246-L271 HydrophobicContact CD1-CD2 3.64Å; L246-L271 HydrophobicContact CD2-CD2 3.93Å; L246-L271 HydrophobicContact CG-CD2 4.42Å; I267-L271 HydrophobicContact CD1-CD1 4.37Å; I267-L271 HydrophobicContact CG1-CD1 4.03Å; I267-L271 HydrophobicContact CG1-CG 4.08Å; I267-L271 WeakPolarHBondContact O-CG 3.4Å; I267-L271 PolarHBondContact O-N 2.88Å; S268-L271 PolarHBondContact O-N 3.32Å; L271-L273 PolarHBondContact O-N 3.4Å; L271-L274 HydrophobicContact CD2-CD1 4.39Å; L271-L274 PolarHBondContact O-N 3.33Å; L271-L274 VanDerWaalsContact O-N 3.14Å; L271-E275 PolarHBondContact O-N 2.74Å; L271-A292 HydrophobicContact CB-CB 4.34Å; L271-A292 HydrophobicContact CD2-CB 3.9Å; L271-L296 HydrophobicContact CB-CD1 3.8Å; L271-L296 HydrophobicContact CB-CD2 3.89Å; L271-L296 HydrophobicContact CB-CG 3.69Å; L271-L296 HydrophobicContact CD1-CD2 4.41Å; L271-L296 HydrophobicContact CD1-CG 4.26Å; L271-F300 HydrophobicContact CD1-CB 4.17Å; L271-F300 HydrophobicContact CD1-CD2 3.92Å
272	I	97.1	Very high	95.9	Very high	44 Å²	44	54.7 Å²	54.7	23%	0.226	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-30.9	174.4	-71.7	163.5	0	0	0	112	S268 Q270 E275 L296 K302	S268-I272 WeakPolarHBondContact O-CD1 3.4Å; S268-I272 VanDerWaalsContact O-CG1 3.28Å; S268-I272 WeakPolarHBondContact O-CG1 3.42Å; S268-I272 PolarHBondContact O-N 3.34Å; S268-I272 VanDerWaalsContact O-N 3.12Å; Q270-I272 VanDerWaalsContact C-N 3.31Å; Q270-I272 PolarHBondContact O-N 3.37Å; I272-E275 VanDerWaalsContact O-CG 3.28Å; I272-E275 WeakPolarHBondContact O-CG 3.46Å; I272-L296 HydrophobicContact CG1-CD1 4.25Å; I272-L296 HydrophobicContact CG1-CD2 4.35Å; I272-K302 HydrophobicContact CD1-CB 4.14Å; I272-K302 HydrophobicContact CD1-CD 3.84Å; I272-K302 HydrophobicContact CD1-CG 3.55Å
273	L	96.4	Very high	95.8	Very high	76 Å²	76	58 Å²	58	40%	0.398	31%	0.308	S	S	.	.	H	α-helix	trans	-79.3	-38.2	177	-56.5	174.4	0	0	0	110.5	F235 Q270 L271 K276	F235-L273 HydrophobicContact CE2-CB 3.37Å; F235-L273 HydrophobicContact CE2-CD1 3.68Å; F235-L273 HydrophobicContact CE2-CG 4.16Å; F235-L273 HydrophobicContact CZ-CB 3.28Å; F235-L273 HydrophobicContact CZ-CD1 4.44Å; F235-L273 HydrophobicContact CZ-CG 4.45Å; Q270-L273 WeakPolarHBondContact O-CB 3.34Å; Q270-L273 PolarHBondContact O-N 3.41Å; L271-L273 PolarHBondContact O-N 3.4Å; L273-K276 WeakPolarHBondContact O-CB 3.22Å
274	L	97.5	Very high	95.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-73.5	-33.7	-179.9	-65.3	179.2	0	0	0	113.3	L233 F235 M242 Q270 L271 K276 W277 V288 G289 A292	L233-L274 HydrophobicContact CB-CD1 4.37Å; L233-L274 HydrophobicContact CD2-CD1 4.47Å; F235-L274 HydrophobicContact CE1-CD2 3.99Å; F235-L274 HydrophobicContact CE2-CD2 4.49Å; F235-L274 HydrophobicContact CZ-CD2 3.88Å; F235-L274 HydrophobicContact CZ-CG 4.5Å; M242-L274 HydrophobicContact SD-CD2 4.46Å; Q270-L274 PolarHBondContact O-N 2.86Å; Q270-L274 VanDerWaalsContact O-N 3.13Å; L271-L274 HydrophobicContact CD2-CD1 4.39Å; L271-L274 PolarHBondContact O-N 3.33Å; L271-L274 VanDerWaalsContact O-N 3.14Å; L274-K276 PolarHBondContact O-N 2.7Å; L274-W277 HydrophobicContact CD2-CE3 4.07Å; L274-W277 HydrophobicContact CD2-CH2 4.05Å; L274-W277 HydrophobicContact CD2-CZ3 3.75Å; L274-W277 WeakPolarHBondContact O-CB 3.48Å; L274-W277 PolarHBondContact O-N 2.88Å; L274-V288 HydrophobicContact CB-CG1 4.16Å; L274-V288 HydrophobicContact CD1-CG1 4Å; L274-V288 HydrophobicContact CD2-CG1 4.05Å; L274-V288 HydrophobicContact CG-CG1 4.29Å; L274-G289 VanDerWaalsContact O-CA 3.29Å; L274-G289 WeakPolarHBondContact O-CA 3.42Å; L274-A292 HydrophobicContact CB-CB 3.78Å
275	E	97	Very high	96	Very high	30 Å²	30	54.9 Å²	54.9	14%	0.14	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.1	-21.2	177.6	68.5	169.6	-166.6	0	0	112.6	L271 I272 W277 T278 A292 Q293 L296 R305	L271-E275 PolarHBondContact O-N 2.74Å; I272-E275 VanDerWaalsContact O-CG 3.28Å; I272-E275 WeakPolarHBondContact O-CG 3.46Å; E275-W277 PolarHBondContact O-N 3.5Å; E275-W277 VanDerWaalsContact O-N 3.08Å; E275-T278 VanDerWaalsContact O-CG2 3.24Å; E275-T278 WeakPolarHBondContact O-CG2 3.39Å; E275-T278 PolarHBondContact O-N 3.47Å; E275-T278 PolarHBondContact O-OG1 3.41Å; E275-A292 HydrophobicContact CB-CB 4.47Å; E275-Q293 HydrophobicContact CB-CB 4.23Å; E275-L296 HydrophobicContact CB-CD1 4.17Å; E275-L296 HydrophobicContact CG-CD1 4.18Å; E275-L296 WeakPolarHBondContact OE2-CD1 3.5Å; E275-R305 IonicContact OE1-NE 2.7Å; E275-R305 IonicContact OE2-CZ 3.67Å; E275-R305 IonicContact OE2-NE 3.68Å; E275-R305 PolarHBondContact OE2-NE 2.9Å; E275-R305 IonicContact OE2-NH2 3.74Å; E275-R305 PolarHBondContact OE2-NH2 3.14Å
276	K	96.6	Very high	96.2	Very high	147 Å²	147	54.8 Å²	54.8	64%	0.639	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-65.6	-9.4	175.2	-60.5	177.3	-176.7	175.7	0	113.1	L273 L274	L273-K276 WeakPolarHBondContact O-CB 3.22Å; L274-K276 PolarHBondContact O-N 2.7Å
277	W	97.7	Very high	96.7	Very high	34 Å²	34	51.1 Å²	51.1	13%	0.129	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-92.8	3.7	178	-65.5	-9.7	0	0	0	114.1	F235 M242 L274 E275 D279 N280 K285 R286 V288	F235-W277 AromaticContact CD1-CH2 3.88Å; F235-W277 HydrophobicContact CD1-CH2 3.88Å; F235-W277 AromaticContact CD1-CZ2 3.47Å; F235-W277 HydrophobicContact CD1-CZ2 3.47Å; F235-W277 VanDerWaalsContact CD1-CZ2 3.47Å; F235-W277 AromaticContact CE1-CE2 3.84Å; F235-W277 AromaticContact CE1-CH2 3.97Å; F235-W277 HydrophobicContact CE1-CH2 3.97Å; F235-W277 AromaticContact CE1-CZ2 3.39Å; F235-W277 HydrophobicContact CE1-CZ2 3.39Å; M242-W277 HydrophobicContact CE-CH2 3.97Å; M242-W277 HydrophobicContact CE-CZ3 4.3Å; M242-W277 HydrophobicContact SD-CH2 3.9Å; M242-W277 HydrophobicContact SD-CZ3 3.62Å; L274-W277 HydrophobicContact CD2-CE3 4.07Å; L274-W277 HydrophobicContact CD2-CH2 4.05Å; L274-W277 HydrophobicContact CD2-CZ3 3.75Å; L274-W277 WeakPolarHBondContact O-CB 3.48Å; L274-W277 PolarHBondContact O-N 2.88Å; E275-W277 PolarHBondContact O-N 3.5Å; E275-W277 VanDerWaalsContact O-N 3.08Å; W277-D279 PolarHBondContact O-N 2.94Å; W277-D279 VanDerWaalsContact O-N 3.09Å; W277-N280 HydrophobicContact CB-CB 4.14Å; W277-N280 WeakPolarHBondContact O-CB 3.47Å; W277-N280 PolarHBondContact O-N 2.61Å; W277-K285 HydrophobicContact CB-CB 4.2Å; W277-K285 VanDerWaalsContact CB-O 3.3Å; W277-K285 WeakPolarHBondContact CB-O 3.49Å; W277-K285 HydrophobicContact CD2-CB 3.91Å; W277-K285 HydrophobicContact CD2-CD 4.22Å; W277-K285 HydrophobicContact CD2-CG 4.14Å; W277-K285 HydrophobicContact CE3-CB 3.73Å; W277-K285 HydrophobicContact CE3-CD 4.37Å; W277-K285 HydrophobicContact CE3-CG 3.86Å; W277-K285 HydrophobicContact CG-CB 4.16Å; W277-K285 HydrophobicContact CH2-CD 4.38Å; W277-K285 HydrophobicContact CH2-CG 4.34Å; W277-K285 HydrophobicContact CZ2-CD 4.21Å; W277-K285 HydrophobicContact CZ3-CB 4.35Å; W277-K285 HydrophobicContact CZ3-CD 4.46Å; W277-K285 HydrophobicContact CZ3-CG 3.97Å; W277-R286 VanDerWaalsContact O-CA 3.29Å; W277-R286 WeakPolarHBondContact O-CA 3.3Å; W277-V288 HydrophobicContact CE3-CB 4.04Å; W277-V288 HydrophobicContact CE3-CG1 3.95Å; W277-V288 HydrophobicContact CZ3-CB 4.37Å; W277-V288 HydrophobicContact CZ3-CG1 4.1Å
278	T	95.8	Very high	96.8	Very high	23 Å²	23	51.1 Å²	51.1	14%	0.141	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-36.2	-179.5	45.9	0	0	0	0	114	E275 R286 G289 Q293	E275-T278 VanDerWaalsContact O-CG2 3.24Å; E275-T278 WeakPolarHBondContact O-CG2 3.39Å; E275-T278 PolarHBondContact O-N 3.47Å; E275-T278 PolarHBondContact O-OG1 3.41Å; T278-R286 VanDerWaalsContact O-CG 3.32Å; T278-R286 WeakPolarHBondContact O-CG 3.08Å; T278-G289 WeakPolarHBondContact CG2-O 3.25Å; T278-Q293 HydrophobicContact CG2-CB 3.95Å
279	D	93.7	Very high	96.9	Very high	127 Å²	127	50.4 Å²	50.4	68%	0.679	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	22.4	-179.1	-55.1	-74.3	0	0	0	112.2	W277	W277-D279 PolarHBondContact O-N 2.94Å; W277-D279 VanDerWaalsContact O-N 3.09Å
280	N	97	Very high	97	Very high	37 Å²	37	47.3 Å²	47.3	20%	0.198	24%	0.237	C	C	.	.			trans	-65.3	136	-179.2	-158	-64	0	0	0	110.5	W277 D282 K285	W277-N280 HydrophobicContact CB-CB 4.14Å; W277-N280 WeakPolarHBondContact O-CB 3.47Å; W277-N280 PolarHBondContact O-N 2.61Å; N280-D282 PolarHBondContact O-N 3.22Å; N280-D282 VanDerWaalsContact OD1-CB 3.28Å; N280-D282 WeakPolarHBondContact OD1-CB 3.35Å; N280-D282 PolarHBondContact OD1-N 3.17Å; N280-K285 HydrophobicContact CB-CB 3.94Å
281	P	95.8	Very high	97.1	Very high	117 Å²	117	44.9 Å²	44.9	76%	0.76	23%	0.225	S	C	*	.	S	Bend	trans	-65.4	-22	174.6	26.4	-36.2	0	0	0	113.2	Y283	P281-Y283 PolarHBondContact O-N 2.82Å
282	D	97	Very high	97.2	Very high	63 Å²	63	44.9 Å²	44.9	34%	0.337	23%	0.225	S	C	.	.	S	Bend	trans	-77.1	112.5	169	-178	-48.2	0	0	0	109.5	N280 L284 K285 R286	N280-D282 PolarHBondContact O-N 3.22Å; N280-D282 VanDerWaalsContact OD1-CB 3.28Å; N280-D282 WeakPolarHBondContact OD1-CB 3.35Å; N280-D282 PolarHBondContact OD1-N 3.17Å; D282-L284 VanDerWaalsContact C-N 3.26Å; D282-L284 PolarHBondContact O-N 2.83Å; D282-L284 WeakPolarHBondContact OD1-CA 3.47Å; D282-L284 WeakPolarHBondContact OD1-CB 3.4Å; D282-L284 PolarHBondContact OD1-N 3.23Å; D282-K285 HydrophobicContact CB-CB 4.14Å; D282-K285 HydrophobicContact CB-CD 4.11Å; D282-K285 HydrophobicContact CB-CG 4.15Å; D282-K285 PolarHBondContact O-N 2.58Å; D282-K285 VanDerWaalsContact O-N 3.13Å; D282-K285 PolarHBondContact OD1-N 2.87Å; D282-K285 VanDerWaalsContact OD1-N 3.09Å; D282-R286 PolarHBondContact O-N 3.42Å
283	Y	96.7	Very high	97.2	Very high	70 Å²	70	44.2 Å²	44.2	28%	0.275	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-27.4	-176	-66.9	-64.2	0	0	0	113.9	P281 Q287 I367 E423 G424	P281-Y283 PolarHBondContact O-N 2.82Å; Y283-Q287 VanDerWaalsContact O-CG 3.26Å; Y283-Q287 WeakPolarHBondContact O-CG 3.12Å; Y283-Q287 PolarHBondContact O-N 3.3Å; Y283-Q287 VanDerWaalsContact O-N 3.14Å; Y283-Q287 PolarHBondContact O-NE2 3.44Å; Y283-I367 HydrophobicContact CD1-CD1 3.6Å; Y283-I367 HydrophobicContact CD1-CG2 4.14Å; Y283-I367 HydrophobicContact CE1-CD1 3.57Å; Y283-E423 HydrophobicContact CD2-CB 3.67Å; Y283-E423 HydrophobicContact CE2-CB 4.31Å; Y283-E423 HydrophobicContact CG-CB 4.11Å; Y283-G424 VanDerWaalsContact CE2-CA 3.47Å; Y283-G424 WeakPolarHBondContact OH-CA 3.44Å
284	L	95.6	Very high	97.3	Very high	65 Å²	65	43.6 Å²	43.6	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-72	-42.5	175	-64.2	173.6	0	0	0	110.5	P239 D282 R286 Q287 V288	P239-L284 HydrophobicContact CB-CB 3.79Å; D282-L284 VanDerWaalsContact C-N 3.26Å; D282-L284 PolarHBondContact O-N 2.83Å; D282-L284 WeakPolarHBondContact OD1-CA 3.47Å; D282-L284 WeakPolarHBondContact OD1-CB 3.4Å; D282-L284 PolarHBondContact OD1-N 3.23Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-Q287 PolarHBondContact O-N 3.48Å; L284-V288 PolarHBondContact O-N 3Å
285	K	97.6	Very high	97.3	Very high	65 Å²	65	43.6 Å²	43.6	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-38	174.3	-67.8	-177.2	-177.4	170.6	0	111.8	P239 W277 N280 D282 Q287 V288 G289	P239-K285 HydrophobicContact CB-CG 4.31Å; P239-K285 HydrophobicContact CG-CG 3.97Å; W277-K285 HydrophobicContact CB-CB 4.2Å; W277-K285 VanDerWaalsContact CB-O 3.3Å; W277-K285 WeakPolarHBondContact CB-O 3.49Å; W277-K285 HydrophobicContact CD2-CB 3.91Å; W277-K285 HydrophobicContact CD2-CD 4.22Å; W277-K285 HydrophobicContact CD2-CG 4.14Å; W277-K285 HydrophobicContact CE3-CB 3.73Å; W277-K285 HydrophobicContact CE3-CD 4.37Å; W277-K285 HydrophobicContact CE3-CG 3.86Å; W277-K285 HydrophobicContact CG-CB 4.16Å; W277-K285 HydrophobicContact CH2-CD 4.38Å; W277-K285 HydrophobicContact CH2-CG 4.34Å; W277-K285 HydrophobicContact CZ2-CD 4.21Å; W277-K285 HydrophobicContact CZ3-CB 4.35Å; W277-K285 HydrophobicContact CZ3-CD 4.46Å; W277-K285 HydrophobicContact CZ3-CG 3.97Å; N280-K285 HydrophobicContact CB-CB 3.94Å; D282-K285 HydrophobicContact CB-CB 4.14Å; D282-K285 HydrophobicContact CB-CD 4.11Å; D282-K285 HydrophobicContact CB-CG 4.15Å; D282-K285 PolarHBondContact O-N 2.58Å; D282-K285 VanDerWaalsContact O-N 3.13Å; D282-K285 PolarHBondContact OD1-N 2.87Å; D282-K285 VanDerWaalsContact OD1-N 3.09Å; K285-Q287 VanDerWaalsContact C-N 3.34Å; K285-Q287 PolarHBondContact O-N 2.96Å; K285-V288 WeakPolarHBondContact O-CB 3.3Å; K285-V288 PolarHBondContact O-N 2.91Å; K285-G289 PolarHBondContact O-N 3.14Å
286	R	98.2	Very high	97.3	Very high	23 Å²	23	42.2 Å²	42.2	9%	0.087	21%	0.207	C	C	.	.	H	α-helix	trans	-56.7	-45.3	173.5	175.1	158.7	-179.6	172.2	10.5	112.4	W277 T278 D282 L284 V288 G289 F290 E338 E474	W277-R286 VanDerWaalsContact O-CA 3.29Å; W277-R286 WeakPolarHBondContact O-CA 3.3Å; T278-R286 VanDerWaalsContact O-CG 3.32Å; T278-R286 WeakPolarHBondContact O-CG 3.08Å; D282-R286 PolarHBondContact O-N 3.42Å; L284-R286 VanDerWaalsContact C-N 3.33Å; R286-V288 PolarHBondContact O-N 3.14Å; R286-G289 PolarHBondContact O-N 2.93Å; R286-F290 WeakPolarHBondContact O-CB 3.39Å; R286-F290 PolarHBondContact O-N 3.25Å; R286-E338 IonicContact CZ-OE1 3.55Å; R286-E338 IonicContact CZ-OE2 3.44Å; R286-E338 IonicContact NE-OE1 2.97Å; R286-E338 PolarHBondContact NE-OE1 2.89Å; R286-E338 IonicContact NE-OE2 3.31Å; R286-E338 PolarHBondContact NE-OE2 3.4Å; R286-E338 VanDerWaalsContact NH2-CD 3.28Å; R286-E338 IonicContact NH2-OE1 3.45Å; R286-E338 PolarHBondContact NH2-OE1 2.96Å; R286-E338 IonicContact NH2-OE2 2.73Å; R286-E338 PolarHBondContact NH2-OE2 2.93Å; R286-E474 IonicContact CZ-OE1 3.8Å; R286-E474 IonicContact NH1-OE1 3.85Å; R286-E474 VanDerWaalsContact NH2-CD 3.27Å; R286-E474 IonicContact NH2-OE1 2.83Å; R286-E474 PolarHBondContact NH2-OE1 3.45Å; R286-E474 IonicContact NH2-OE2 3.96Å
287	Q	98.4	Very high	97.3	Very high	13 Å²	13	35.5 Å²	35.5	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-45.1	174.6	-67.9	172.9	71.5	0	0	112.1	L243 Y283 L284 K285 F290 C291 I367 T368	L243-Q287 HydrophobicContact CD1-CB 4.2Å; L243-Q287 HydrophobicContact CD2-CB 3.85Å; Y283-Q287 VanDerWaalsContact O-CG 3.26Å; Y283-Q287 WeakPolarHBondContact O-CG 3.12Å; Y283-Q287 PolarHBondContact O-N 3.3Å; Y283-Q287 VanDerWaalsContact O-N 3.14Å; Y283-Q287 PolarHBondContact O-NE2 3.44Å; L284-Q287 PolarHBondContact O-N 3.48Å; K285-Q287 VanDerWaalsContact C-N 3.34Å; K285-Q287 PolarHBondContact O-N 2.96Å; Q287-F290 PolarHBondContact O-N 3.36Å; Q287-C291 PolarHBondContact O-N 2.98Å; Q287-I367 HydrophobicContact CG-CG2 3.95Å; Q287-T368 VanDerWaalsContact CD-CG2 3.41Å; Q287-T368 HydrophobicContact CG-CG2 4.26Å
288	V	98.6	Very high	97.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-46.1	176.6	175.8	0	0	0	0	111.1	P239 M242 L243 L274 W277 L284 K285 R286 C291 A292	P239-V288 HydrophobicContact CB-CG2 4.37Å; P239-V288 VanDerWaalsContact O-CG2 3.23Å; P239-V288 WeakPolarHBondContact O-CG2 3.25Å; M242-V288 HydrophobicContact CB-CG1 4.24Å; M242-V288 HydrophobicContact CB-CG2 4.08Å; L243-V288 HydrophobicContact CB-CG2 3.86Å; L274-V288 HydrophobicContact CB-CG1 4.16Å; L274-V288 HydrophobicContact CD1-CG1 4Å; L274-V288 HydrophobicContact CD2-CG1 4.05Å; L274-V288 HydrophobicContact CG-CG1 4.29Å; W277-V288 HydrophobicContact CE3-CB 4.04Å; W277-V288 HydrophobicContact CE3-CG1 3.95Å; W277-V288 HydrophobicContact CZ3-CB 4.37Å; W277-V288 HydrophobicContact CZ3-CG1 4.1Å; L284-V288 PolarHBondContact O-N 3Å; K285-V288 WeakPolarHBondContact O-CB 3.3Å; K285-V288 PolarHBondContact O-N 2.91Å; R286-V288 PolarHBondContact O-N 3.14Å; V288-C291 PolarHBondContact O-N 3.29Å; V288-A292 VanDerWaalsContact O-CB 3.32Å; V288-A292 WeakPolarHBondContact O-CB 3.49Å; V288-A292 PolarHBondContact O-N 3.38Å
289	G	98.4	Very high	97.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-42.7	178.8	0	0	0	0	0	113	L274 T278 K285 R286 A292 Q293	L274-G289 VanDerWaalsContact O-CA 3.29Å; L274-G289 WeakPolarHBondContact O-CA 3.42Å; T278-G289 WeakPolarHBondContact CG2-O 3.25Å; K285-G289 PolarHBondContact O-N 3.14Å; R286-G289 PolarHBondContact O-N 2.93Å; G289-A292 PolarHBondContact O-N 3.25Å; G289-Q293 WeakPolarHBondContact O-CB 3.35Å; G289-Q293 PolarHBondContact O-N 2.97Å
290	F	98.6	Very high	97.3	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-57.2	-51.8	174.6	-179.9	-81.2	0	0	0	111.2	R286 Q287 Q293 W294 K331 E338 R340	R286-F290 WeakPolarHBondContact O-CB 3.39Å; R286-F290 PolarHBondContact O-N 3.25Å; Q287-F290 PolarHBondContact O-N 3.36Å; F290-Q293 PolarHBondContact O-N 2.84Å; F290-W294 WeakPolarHBondContact O-CB 3.44Å; F290-W294 PolarHBondContact O-N 2.91Å; F290-K331 HydrophobicContact CE1-CB 3.77Å; F290-K331 HydrophobicContact CE1-CD 4.33Å; F290-K331 HydrophobicContact CZ-CB 4.1Å; F290-E338 HydrophobicContact CD2-CB 4.49Å; F290-E338 HydrophobicContact CD2-CG 3.91Å; F290-E338 HydrophobicContact CE2-CB 4.06Å; F290-E338 HydrophobicContact CE2-CG 3.75Å; F290-R340 HydrophobicContact CD1-CB 4.05Å; F290-R340 HydrophobicContact CE1-CB 3.51Å; F290-R340 HydrophobicContact CE1-CG 4.46Å; F290-R340 HydrophobicContact CZ-CB 4.01Å
291	C	98.6	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-44.8	178.4	-72.6	0	0	0	0	111.4	L243 L246 Q287 V288 Q293 W294 S295 R340	L243-C291 HydrophobicContact CD1-CB 4.21Å; L246-C291 HydrophobicContact CD2-CB 3.63Å; L246-C291 HydrophobicContact CG-CB 4.39Å; Q287-C291 PolarHBondContact O-N 2.98Å; V288-C291 PolarHBondContact O-N 3.29Å; C291-Q293 PolarHBondContact O-N 3.43Å; C291-W294 CarbonylContact O-C 3.48Å; C291-W294 WeakPolarHBondContact O-CB 3.3Å; C291-W294 PolarHBondContact O-N 2.87Å; C291-W294 VanDerWaalsContact O-N 3.13Å; C291-S295 PolarHBondContact O-N 3.21Å; C291-S295 PolarHBondContact O-OG 3.17Å; C291-R340 VanDerWaalsContact SG-CD 3.53Å; C291-R340 PolarHBondContact SG-NE 2.89Å
292	A	98.4	Very high	97.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-43.7	-179.6	0	0	0	0	0	112.8	L246 L271 L274 E275 V288 G289 W294 S295 L296	L246-A292 HydrophobicContact CD2-CB 4.13Å; L271-A292 HydrophobicContact CB-CB 4.34Å; L271-A292 HydrophobicContact CD2-CB 3.9Å; L274-A292 HydrophobicContact CB-CB 3.78Å; E275-A292 HydrophobicContact CB-CB 4.47Å; V288-A292 VanDerWaalsContact O-CB 3.32Å; V288-A292 WeakPolarHBondContact O-CB 3.49Å; V288-A292 PolarHBondContact O-N 3.38Å; G289-A292 PolarHBondContact O-N 3.25Å; A292-W294 VanDerWaalsContact C-N 3.35Å; A292-S295 PolarHBondContact O-N 3.08Å; A292-L296 WeakPolarHBondContact O-CB 3.3Å; A292-L296 WeakPolarHBondContact O-CG 3.46Å; A292-L296 PolarHBondContact O-N 3.14Å
293	Q	98.2	Very high	96.9	Very high	31 Å²	31	35.4 Å²	35.4	15%	0.145	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-45.8	174.1	-178.1	-179.8	92.1	0	0	110.9	E275 T278 G289 F290 C291 L296 D297 T308 P334	E275-Q293 HydrophobicContact CB-CB 4.23Å; T278-Q293 HydrophobicContact CG2-CB 3.95Å; G289-Q293 WeakPolarHBondContact O-CB 3.35Å; G289-Q293 PolarHBondContact O-N 2.97Å; F290-Q293 PolarHBondContact O-N 2.84Å; C291-Q293 PolarHBondContact O-N 3.43Å; Q293-L296 PolarHBondContact O-N 2.91Å; Q293-D297 PolarHBondContact O-N 3.03Å; Q293-D297 VanDerWaalsContact O-N 3.13Å; Q293-T308 HydrophobicContact CG-CG2 4.23Å; Q293-T308 WeakPolarHBondContact CG-OG1 3.41Å; Q293-P334 VanDerWaalsContact OE1-CD 3.31Å
294	W	97.8	Very high	96.8	Very high	62 Å²	62	36.2 Å²	36.2	24%	0.235	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-44.5	178	-173.8	95.1	0	0	0	111.9	F290 C291 A292 L296 D297 N298 L299 K331	F290-W294 WeakPolarHBondContact O-CB 3.44Å; F290-W294 PolarHBondContact O-N 2.91Å; C291-W294 CarbonylContact O-C 3.48Å; C291-W294 WeakPolarHBondContact O-CB 3.3Å; C291-W294 PolarHBondContact O-N 2.87Å; C291-W294 VanDerWaalsContact O-N 3.13Å; A292-W294 VanDerWaalsContact C-N 3.35Å; W294-L296 PolarHBondContact O-N 3.42Å; W294-D297 PolarHBondContact O-N 3.04Å; W294-N298 HydrophobicContact CD2-CB 4.29Å; W294-N298 HydrophobicContact CE3-CB 4.29Å; W294-N298 HydrophobicContact CH2-CB 4.02Å; W294-N298 HydrophobicContact CZ2-CB 4.02Å; W294-N298 HydrophobicContact CZ3-CB 4.16Å; W294-N298 PolarHBondContact NE1-ND2 3.34Å; W294-N298 WeakPolarHBondContact O-CB 3.22Å; W294-N298 PolarHBondContact O-N 2.79Å; W294-N298 PolarHBondContact O-ND2 2.92Å; W294-L299 HydrophobicContact CH2-CD1 4.29Å; W294-L299 HydrophobicContact CH2-CG 4.45Å; W294-L299 HydrophobicContact CZ3-CD1 3.66Å; W294-L299 HydrophobicContact CZ3-CG 4.05Å; W294-K331 HydrophobicContact CD2-CD 3.85Å; W294-K331 HydrophobicContact CD2-CG 4.08Å; W294-K331 HydrophobicContact CE3-CD 4.21Å; W294-K331 HydrophobicContact CG-CB 4.4Å; W294-K331 HydrophobicContact CG-CD 4Å; W294-K331 HydrophobicContact CG-CG 4.24Å; W294-K331 HydrophobicContact CZ2-CG 4.26Å
295	S	97.8	Very high	96.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-37.4	179.4	-29.5	0	0	0	0	111.8	E250 C291 A292 D297 N298 L299 F300	E250-S295 PolarHBondContact OE1-OG 3.26Å; C291-S295 PolarHBondContact O-N 3.21Å; C291-S295 PolarHBondContact O-OG 3.17Å; A292-S295 PolarHBondContact O-N 3.08Å; S295-D297 VanDerWaalsContact C-N 3.28Å; S295-D297 PolarHBondContact O-N 3.02Å; S295-N298 PolarHBondContact O-N 2.98Å; S295-L299 WeakPolarHBondContact O-CA 3.23Å; S295-L299 PolarHBondContact O-N 3.47Å; S295-F300 PolarHBondContact O-N 2.87Å
296	L	97.7	Very high	96.6	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-30.6	175.8	-78.8	167.5	0	0	0	113	L271 I272 E275 A292 Q293 W294 L301 K302	L271-L296 HydrophobicContact CB-CD1 3.8Å; L271-L296 HydrophobicContact CB-CD2 3.89Å; L271-L296 HydrophobicContact CB-CG 3.69Å; L271-L296 HydrophobicContact CD1-CD2 4.41Å; L271-L296 HydrophobicContact CD1-CG 4.26Å; I272-L296 HydrophobicContact CG1-CD1 4.25Å; I272-L296 HydrophobicContact CG1-CD2 4.35Å; E275-L296 HydrophobicContact CB-CD1 4.17Å; E275-L296 HydrophobicContact CG-CD1 4.18Å; E275-L296 WeakPolarHBondContact OE2-CD1 3.5Å; A292-L296 WeakPolarHBondContact O-CB 3.3Å; A292-L296 WeakPolarHBondContact O-CG 3.46Å; A292-L296 PolarHBondContact O-N 3.14Å; Q293-L296 PolarHBondContact O-N 2.91Å; W294-L296 PolarHBondContact O-N 3.42Å; L296-L301 VanDerWaalsContact O-CD2 3.3Å; L296-L301 WeakPolarHBondContact O-CD2 3.11Å; L296-K302 HydrophobicContact CD2-CB 4.3Å
297	D	96.8	Very high	96.6	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-83.4	-28.7	176.8	-73.6	-20.2	0	0	0	112.6	Q293 W294 S295 R305 L307 T308 P508 H510	Q293-D297 PolarHBondContact O-N 3.03Å; Q293-D297 VanDerWaalsContact O-N 3.13Å; W294-D297 PolarHBondContact O-N 3.04Å; S295-D297 VanDerWaalsContact C-N 3.28Å; S295-D297 PolarHBondContact O-N 3.02Å; D297-R305 IonicContact OD1-CZ 2.9Å; D297-R305 IonicContact OD1-NH1 2.69Å; D297-R305 PolarHBondContact OD1-NH1 3.29Å; D297-R305 IonicContact OD1-NH2 3.2Å; D297-L307 HydrophobicContact CB-CD2 4.42Å; D297-T308 VanDerWaalsContact CG-OG1 3.27Å; D297-T308 PolarHBondContact OD1-N 3.37Å; D297-T308 VanDerWaalsContact OD1-N 3.09Å; D297-T308 PolarHBondContact OD1-OG1 3.26Å; D297-T308 WeakPolarHBondContact OD2-CB 3.38Å; D297-T308 PolarHBondContact OD2-N 2.97Å; D297-T308 PolarHBondContact OD2-OG1 2.74Å; D297-P508 HydrophobicContact CB-CB 4.43Å; D297-P508 HydrophobicContact CB-CG 4.12Å; D297-P508 VanDerWaalsContact O-CB 3.25Å; D297-P508 WeakPolarHBondContact O-CB 3.42Å; D297-H510 PolarHBondContact O-CE1 2.98Å; D297-H510 PolarHBondContact O-ND1 3.22Å
298	N	95	Very high	96.4	Very high	20 Å²	20	36.1 Å²	36.1	11%	0.107	19%	0.192	C	C	.	.	H	α-helix	trans	-113	-34.4	-167.9	-71.1	-81.3	0	0	0	115.6	W294 S295 P508 R509	W294-N298 HydrophobicContact CD2-CB 4.29Å; W294-N298 HydrophobicContact CE3-CB 4.29Å; W294-N298 HydrophobicContact CH2-CB 4.02Å; W294-N298 HydrophobicContact CZ2-CB 4.02Å; W294-N298 HydrophobicContact CZ3-CB 4.16Å; W294-N298 PolarHBondContact NE1-ND2 3.34Å; W294-N298 WeakPolarHBondContact O-CB 3.22Å; W294-N298 PolarHBondContact O-N 2.79Å; W294-N298 PolarHBondContact O-ND2 2.92Å; S295-N298 PolarHBondContact O-N 2.98Å; N298-P508 VanDerWaalsContact OD1-CA 3.31Å; N298-P508 WeakPolarHBondContact OD1-CA 3.42Å; N298-R509 PolarHBondContact OD1-N 2.97Å
299	L	94.4	Very high	96.3	Very high	31 Å²	31	38.3 Å²	38.3	16%	0.162	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123	-59.4	-166.7	-68.6	177.5	0	0	0	113	E250 K259 W294 S295	E250-L299 HydrophobicContact CB-CD1 3.82Å; E250-L299 HydrophobicContact CG-CD1 3.75Å; K259-L299 VanDerWaalsContact CE-O 3.26Å; K259-L299 WeakPolarHBondContact CE-O 3.33Å; W294-L299 HydrophobicContact CH2-CD1 4.29Å; W294-L299 HydrophobicContact CH2-CG 4.45Å; W294-L299 HydrophobicContact CZ3-CD1 3.66Å; W294-L299 HydrophobicContact CZ3-CG 4.05Å; S295-L299 WeakPolarHBondContact O-CA 3.23Å; S295-L299 PolarHBondContact O-N 3.47Å
300	F	96.4	Very high	96.1	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	22%	0.22	C	C	.	.	S	Bend	trans	-109.6	71.4	-170.2	-52.2	-55.9	0	0	0	110	E250 A253 V262 I267 L271 S295	E250-F300 HydrophobicContact CG-CE2 4.39Å; A253-F300 HydrophobicContact CB-CE1 3.71Å; A253-F300 HydrophobicContact CB-CZ 3.63Å; V262-F300 HydrophobicContact CB-CE1 3.87Å; V262-F300 HydrophobicContact CB-CZ 4.35Å; V262-F300 HydrophobicContact CG1-CD1 4.06Å; V262-F300 HydrophobicContact CG1-CE1 3.39Å; V262-F300 HydrophobicContact CG1-CE2 4.38Å; V262-F300 HydrophobicContact CG1-CZ 3.58Å; I267-F300 HydrophobicContact CD1-CD2 3.76Å; I267-F300 HydrophobicContact CD1-CE2 3.73Å; I267-F300 HydrophobicContact CD1-CG 4.26Å; I267-F300 HydrophobicContact CD1-CZ 4.22Å; I267-F300 HydrophobicContact CG2-CB 4.08Å; I267-F300 HydrophobicContact CG2-CD1 4.28Å; I267-F300 HydrophobicContact CG2-CG 4.06Å; L271-F300 HydrophobicContact CD1-CB 4.17Å; L271-F300 HydrophobicContact CD1-CD2 3.92Å; S295-F300 PolarHBondContact O-N 2.87Å
301	L	94.4	Very high	95.9	Very high	95 Å²	95	47.2 Å²	47.2	50%	0.497	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-62	140.2	-174.3	-54.6	-177.1	0	0	0	111.3	L296	L296-L301 VanDerWaalsContact O-CD2 3.3Å; L296-L301 WeakPolarHBondContact O-CD2 3.11Å
302	K	95.1	Very high	95.7	Very high	61 Å²	61	49.1 Å²	49.1	27%	0.265	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-102.6	126.1	170	-177.5	72.1	171.8	177.3	0	110.5	S268 D269 I272 L296 G304 R305	S268-K302 WeakPolarHBondContact OG-CD 3.45Å; D269-K302 VanDerWaalsContact CG-NZ 3.29Å; D269-K302 VanDerWaalsContact OD1-CE 3.32Å; D269-K302 WeakPolarHBondContact OD1-CE 3.45Å; D269-K302 IonicContact OD1-NZ 3.95Å; D269-K302 PolarHBondContact OD1-NZ 2.93Å; D269-K302 IonicContact OD2-NZ 3.56Å; D269-K302 PolarHBondContact OD2-NZ 3.13Å; I272-K302 HydrophobicContact CD1-CB 4.14Å; I272-K302 HydrophobicContact CD1-CD 3.84Å; I272-K302 HydrophobicContact CD1-CG 3.55Å; L296-K302 HydrophobicContact CD2-CB 4.3Å; K302-G304 PolarHBondContact O-N 3.33Å; K302-R305 HydrophobicContact CB-CB 3.81Å; K302-R305 HydrophobicContact CG-CB 4.19Å; K302-R305 WeakPolarHBondContact O-CB 3.45Å; K302-R305 PolarHBondContact O-N 3.49Å; K302-R305 VanDerWaalsContact O-N 3.13Å
303	E	93.1	Very high	95.5	Very high	190 Å²	190	54.3 Å²	54.3	89%	0.888	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	130.8	172.5	-169.6	177.8	-177	0	0	111.3	R305	E303-R305 PolarHBondContact O-N 3.25Å
304	G	92.8	Very high	95.5	Very high	86 Å²	86	54 Å²	54	89%	0.887	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-6	-178.8	0	0	0	0	0	115.6	K302	K302-G304 PolarHBondContact O-N 3.33Å
305	R	95.5	Very high	95.3	Very high	39 Å²	39	56 Å²	56	15%	0.147	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-79.7	125.1	172.4	-176.8	-177.4	170.5	-77.4	3	109.9	E275 D297 K302 E303 T308	E275-R305 IonicContact OE1-NE 2.7Å; E275-R305 IonicContact OE2-CZ 3.67Å; E275-R305 IonicContact OE2-NE 3.68Å; E275-R305 PolarHBondContact OE2-NE 2.9Å; E275-R305 IonicContact OE2-NH2 3.74Å; E275-R305 PolarHBondContact OE2-NH2 3.14Å; D297-R305 IonicContact OD1-CZ 2.9Å; D297-R305 IonicContact OD1-NH1 2.69Å; D297-R305 PolarHBondContact OD1-NH1 3.29Å; D297-R305 IonicContact OD1-NH2 3.2Å; K302-R305 HydrophobicContact CB-CB 3.81Å; K302-R305 HydrophobicContact CG-CB 4.19Å; K302-R305 WeakPolarHBondContact O-CB 3.45Å; K302-R305 PolarHBondContact O-N 3.49Å; K302-R305 VanDerWaalsContact O-N 3.13Å; E303-R305 PolarHBondContact O-N 3.25Å; R305-T308 PolarHBondContact NH2-OG1 2.97Å
306	Q	95.4	Very high	95.1	Very high	105 Å²	105	61.1 Å²	61.1	49%	0.491	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-68.3	136.3	170.7	-167.2	-178.7	20.2	0	0	110.7	E310	Q306-E310 HydrophobicContact CG-CB 3.98Å; Q306-E310 WeakPolarHBondContact CG-OE2 3.33Å
307	L	96.3	Very high	95.1	Very high	14 Å²	14	61.8 Å²	61.8	7%	0.073	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-69.1	145.3	-180	-65.7	173.1	0	0	0	110.1	D297 Y309 E310 R511	D297-L307 HydrophobicContact CB-CD2 4.42Å; L307-Y309 VanDerWaalsContact C-N 3.32Å; L307-Y309 HydrophobicContact CB-CD1 3.76Å; L307-Y309 HydrophobicContact CB-CE1 3.59Å; L307-Y309 HydrophobicContact CD1-CE1 3.63Å; L307-Y309 HydrophobicContact CG-CE1 4.23Å; L307-Y309 PolarHBondContact O-N 3.25Å; L307-E310 HydrophobicContact CB-CG 4.22Å; L307-E310 PolarHBondContact N-OE2 3.45Å; L307-E310 WeakPolarHBondContact O-CB 3.32Å; L307-E310 PolarHBondContact O-N 3.23Å; L307-R511 HydrophobicContact CD1-CG 4.26Å
308	T	96.3	Very high	95.1	Very high	7 Å²	7	67.1 Å²	67.1	4%	0.043	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-65.8	-35.3	-168.2	-41.9	0	0	0	0	113.2	Q293 D297 R305 E310 K311 V312 P334	Q293-T308 HydrophobicContact CG-CG2 4.23Å; Q293-T308 WeakPolarHBondContact CG-OG1 3.41Å; D297-T308 VanDerWaalsContact CG-OG1 3.27Å; D297-T308 PolarHBondContact OD1-N 3.37Å; D297-T308 VanDerWaalsContact OD1-N 3.09Å; D297-T308 PolarHBondContact OD1-OG1 3.26Å; D297-T308 WeakPolarHBondContact OD2-CB 3.38Å; D297-T308 PolarHBondContact OD2-N 2.97Å; D297-T308 PolarHBondContact OD2-OG1 2.74Å; R305-T308 PolarHBondContact NH2-OG1 2.97Å; T308-E310 PolarHBondContact O-N 3.4Å; T308-E310 VanDerWaalsContact O-N 3.13Å; T308-K311 WeakPolarHBondContact O-CG 3.24Å; T308-K311 PolarHBondContact O-N 2.88Å; T308-K311 VanDerWaalsContact O-N 3.13Å; T308-V312 PolarHBondContact O-N 2.85Å; T308-P334 HydrophobicContact CG2-CB 4.06Å; T308-P334 HydrophobicContact CG2-CG 3.62Å
309	Y	94.8	Very high	95.3	Very high	46 Å²	46	66.2 Å²	66.2	18%	0.18	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-61.7	-20.5	176.9	80.3	-91.1	0	0	0	113.4	L307 I505 L507 P508	L307-Y309 VanDerWaalsContact C-N 3.32Å; L307-Y309 HydrophobicContact CB-CD1 3.76Å; L307-Y309 HydrophobicContact CB-CE1 3.59Å; L307-Y309 HydrophobicContact CD1-CE1 3.63Å; L307-Y309 HydrophobicContact CG-CE1 4.23Å; L307-Y309 PolarHBondContact O-N 3.25Å; Y309-I505 HydrophobicContact CD2-CG2 3.72Å; Y309-I505 HydrophobicContact CE2-CG2 4.3Å; Y309-I505 HydrophobicContact CG-CG2 4.38Å; Y309-L507 HydrophobicContact CD2-CD2 4.33Å; Y309-L507 HydrophobicContact CE2-CD2 4Å; Y309-P508 HydrophobicContact CD1-CG 3.69Å; Y309-P508 HydrophobicContact CE1-CG 3.88Å
310	E	95.1	Very high	95.5	Very high	90 Å²	90	64.8 Å²	64.8	42%	0.421	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-83.3	-16.4	-179.4	-57.9	175.7	147.7	0	0	112.8	Q306 L307 T308	Q306-E310 HydrophobicContact CG-CB 3.98Å; Q306-E310 WeakPolarHBondContact CG-OE2 3.33Å; L307-E310 HydrophobicContact CB-CG 4.22Å; L307-E310 PolarHBondContact N-OE2 3.45Å; L307-E310 WeakPolarHBondContact O-CB 3.32Å; L307-E310 PolarHBondContact O-N 3.23Å; T308-E310 PolarHBondContact O-N 3.4Å; T308-E310 VanDerWaalsContact O-N 3.13Å
311	K	94.4	Very high	95.6	Very high	105 Å²	105	64.8 Å²	64.8	46%	0.457	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-12.3	-174.2	65.8	177.7	-179.2	-175.1	0	114.7	T308	T308-K311 WeakPolarHBondContact O-CG 3.24Å; T308-K311 PolarHBondContact O-N 2.88Å; T308-K311 VanDerWaalsContact O-N 3.13Å
312	V	94.9	Very high	95.7	Very high	39 Å²	39	62 Å²	62	24%	0.236	32%	0.321	C	S	.	.			trans	-66.7	136.4	-179.8	63.3	0	0	0	0	110.8	T308 L314 P334 H335	T308-V312 PolarHBondContact O-N 2.85Å; V312-L314 HydrophobicContact CB-CD2 4.43Å; V312-L314 HydrophobicContact CG1-CD1 4.03Å; V312-L314 HydrophobicContact CG1-CD2 3.82Å; V312-L314 HydrophobicContact CG1-CG 3.9Å; V312-L314 HydrophobicContact CG2-CD2 3.83Å; V312-L314 PolarHBondContact O-N 2.85Å; V312-P334 HydrophobicContact CB-CB 4.29Å; V312-P334 HydrophobicContact CG1-CB 4.07Å; V312-P334 HydrophobicContact CG2-CB 4.44Å; V312-H335 HydrophobicContact CG2-CB 3.91Å
313	D	94.4	Very high	95.6	Very high	109 Å²	109	60.3 Å²	60.3	58%	0.583	32%	0.318	S	S	*	.			trans	-83.6	114.6	175.6	-179.6	13.8	0	0	0	110.7	T315	D313-T315 WeakPolarHBondContact OD1-CB 3.1Å; D313-T315 PolarHBondContact OD1-N 3.34Å; D313-T315 PolarHBondContact OD1-OG1 3.09Å
314	L	96.3	Very high	95.5	Very high	25 Å²	25	58.3 Å²	58.3	13%	0.131	31%	0.313	C	S	.	.			trans	-112.3	12.3	-179.1	-51	176.3	0	0	0	112.2	V312 N316 I317 H335 K504	V312-L314 HydrophobicContact CB-CD2 4.43Å; V312-L314 HydrophobicContact CG1-CD1 4.03Å; V312-L314 HydrophobicContact CG1-CD2 3.82Å; V312-L314 HydrophobicContact CG1-CG 3.9Å; V312-L314 HydrophobicContact CG2-CD2 3.83Å; V312-L314 PolarHBondContact O-N 2.85Å; L314-N316 VanDerWaalsContact C-N 3.27Å; L314-N316 PolarHBondContact O-N 2.93Å; L314-I317 HydrophobicContact CD2-CG1 4.37Å; L314-I317 PolarHBondContact O-N 3.26Å; L314-I317 VanDerWaalsContact O-N 3.16Å; L314-H335 HydrophobicContact CD2-CB 3.95Å; L314-K504 HydrophobicContact CB-CB 4.49Å; L314-K504 HydrophobicContact CB-CD 4.02Å; L314-K504 HydrophobicContact CD1-CB 3.77Å; L314-K504 WeakPolarHBondContact CD1-O 3.28Å; L314-K504 PolarHBondContact O-NZ 3.28Å
315	T	94	Very high	95.5	Very high	105 Å²	105	55.8 Å²	55.8	64%	0.644	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-41.2	-174.5	-53.9	0	0	0	0	111.4	D313	D313-T315 WeakPolarHBondContact OD1-CB 3.1Å; D313-T315 PolarHBondContact OD1-N 3.34Å; D313-T315 PolarHBondContact OD1-OG1 3.09Å
316	N	94.1	Very high	95.4	Very high	107 Å²	107	55.9 Å²	55.9	57%	0.572	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	2.6	-177.7	-64.1	-36.7	0	0	0	114.1	L314 N494	L314-N316 VanDerWaalsContact C-N 3.27Å; L314-N316 PolarHBondContact O-N 2.93Å; N316-N494 PolarHBondContact O-ND2 2.95Å; N316-N494 PolarHBondContact O-OD1 3.41Å
317	I	97.4	Very high	95.3	Very high	15 Å²	15	51.5 Å²	51.5	8%	0.077	27%	0.265	C	S	.	.			trans	-95.1	119.3	-179.9	-54.5	-54.6	0	0	0	109.2	L314 M320 L337 A479 K504	L314-I317 HydrophobicContact CD2-CG1 4.37Å; L314-I317 PolarHBondContact O-N 3.26Å; L314-I317 VanDerWaalsContact O-N 3.16Å; I317-M320 HydrophobicContact CG2-CB 4.1Å; I317-L337 HydrophobicContact CD1-CD1 3.69Å; I317-L337 HydrophobicContact CD1-CG 4.32Å; I317-A479 HydrophobicContact CD1-CB 3.85Å; I317-K504 WeakPolarHBondContact O-CE 3.33Å; I317-K504 PolarHBondContact O-NZ 2.81Å
318	R	98	Very high	94.8	Very high	119 Å²	119	56 Å²	56	45%	0.449	29%	0.286	S	S	.	.	S	Bend	trans	-122.3	-15.4	176.4	-70.3	171.4	172.3	-169.2	5.2	113.3	N494 A497 L499	R318-N494 WeakPolarHBondContact CB-OD1 3.4Å; R318-N494 WeakPolarHBondContact CD-O 3.24Å; R318-N494 PolarHBondContact N-OD1 3Å; R318-A497 HydrophobicContact CB-CB 4.41Å; R318-A497 WeakPolarHBondContact CB-O 3.31Å; R318-A497 WeakPolarHBondContact O-CB 3.09Å; R318-L499 WeakPolarHBondContact O-CD1 3.49Å; R318-L499 WeakPolarHBondContact O-CG 3.24Å
319	A	98.2	Very high	94.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-136.9	144.4	167.8	0	0	0	0	0	109	F353 F477 F493 A497	A319-F353 HydrophobicContact CB-CB 4.35Å; A319-F477 HydrophobicContact CB-CB 4.08Å; A319-F477 HydrophobicContact CB-CD2 4.38Å; A319-F477 HydrophobicContact CB-CG 4.28Å; A319-F477 WeakPolarHBondContact O-CD2 3.18Å; A319-F493 HydrophobicContact CB-CB 3.69Å; A319-A497 HydrophobicContact CB-CB 3.87Å
320	M	98.3	Very high	94.7	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	30%	0.299	C	S	.	.			trans	-152.5	173.9	-177.9	64.8	-165.2	-63.8	0	0	110.4	I317 G336 L337 C351 T352 L499 K504 I506	I317-M320 HydrophobicContact CG2-CB 4.1Å; M320-G336 VanDerWaalsContact CE-CA 3.49Å; M320-L337 HydrophobicContact CB-CD2 4.39Å; M320-C351 CarbonylContact O-C 3.09Å; M320-C351 WeakPolarHBondContact O-CA 3.25Å; M320-C351 WeakPolarHBondContact O-CB 3.38Å; M320-T352 HydrophobicContact CG-CG2 3.77Å; M320-T352 PolarHBondContact N-OG1 2.65Å; M320-T352 PolarHBondContact O-N 2.95Å; M320-T352 PolarHBondContact O-OG1 3.44Å; M320-L499 HydrophobicContact CG-CD1 3.8Å; M320-L499 HydrophobicContact SD-CD1 3.77Å; M320-K504 HydrophobicContact SD-CB 4.36Å; M320-K504 HydrophobicContact SD-CG 4.44Å; M320-I506 HydrophobicContact CE-CD1 3.65Å; M320-I506 HydrophobicContact CE-CG1 3.84Å
321	L	98.6	Very high	94.8	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	133.4	167.3	-62.8	176.8	0	0	0	109.7	S323 I332 G336 A339 V349 F475 F477	L321-S323 PolarHBondContact O-N 2.96Å; L321-I332 HydrophobicContact CB-CD1 4.16Å; L321-I332 HydrophobicContact CB-CG2 4.24Å; L321-I332 HydrophobicContact CD1-CG2 4.39Å; L321-G336 WeakPolarHBondContact CB-O 3.49Å; L321-G336 WeakPolarHBondContact CG-O 3.49Å; L321-G336 PolarHBondContact N-O 3.49Å; L321-A339 HydrophobicContact CD1-CB 3.58Å; L321-V349 HydrophobicContact CB-CG2 4.01Å; L321-V349 HydrophobicContact CD2-CG1 3.97Å; L321-V349 HydrophobicContact CD2-CG2 4.24Å; L321-F475 HydrophobicContact CD1-CD2 3.75Å; L321-F475 HydrophobicContact CD1-CE2 3.81Å; L321-F475 HydrophobicContact CD2-CD1 4.25Å; L321-F475 HydrophobicContact CD2-CD2 3.89Å; L321-F475 HydrophobicContact CD2-CE1 4.22Å; L321-F475 HydrophobicContact CD2-CE2 3.86Å; L321-F475 HydrophobicContact CD2-CG 4.1Å; L321-F475 HydrophobicContact CD2-CZ 4.04Å; L321-F475 HydrophobicContact CG-CD2 4.08Å; L321-F475 HydrophobicContact CG-CE2 4.33Å; L321-F477 HydrophobicContact CD2-CE2 4.44Å; L321-F477 HydrophobicContact CD2-CZ 4.15Å
322	N	96.6	Very high	94.9	Very high	36 Å²	36	51 Å²	51	19%	0.193	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	109.1	-172.1	-173.9	-8	0	0	0	111	N324 D325 R350 T352	N322-N324 PolarHBondContact O-N 3.12Å; N322-N324 VanDerWaalsContact O-N 3.15Å; N322-N324 WeakPolarHBondContact OD1-CB 3.45Å; N322-N324 PolarHBondContact OD1-N 3.49Å; N322-D325 HydrophobicContact CB-CB 4Å; N322-D325 WeakPolarHBondContact ND2-CB 3.4Å; N322-D325 CarbonylContact O-C 3.59Å; N322-D325 PolarHBondContact O-N 3.17Å; N322-D325 VanDerWaalsContact O-N 3.08Å; N322-D325 PolarHBondContact OD1-N 3.41Å; N322-R350 WeakPolarHBondContact CB-O 3.49Å; N322-R350 PolarHBondContact N-O 3.48Å; N322-T352 HydrophobicContact CB-CG2 3.75Å
323	S	92.8	Very high	95.1	Very high	27 Å²	27	49.4 Å²	49.4	19%	0.189	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-7	178.3	61.1	0	0	0	0	114.8	L321 V326	L321-S323 PolarHBondContact O-N 2.96Å; S323-V326 WeakPolarHBondContact O-CG1 3.25Å
324	N	90.8	Very high	95.1	Very high	147 Å²	147	44.9 Å²	44.9	79%	0.786	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	-6.9	173.7	-58.6	-38.9	0	0	0	112.6	N322	N322-N324 PolarHBondContact O-N 3.12Å; N322-N324 VanDerWaalsContact O-N 3.15Å; N322-N324 WeakPolarHBondContact OD1-CB 3.45Å; N322-N324 PolarHBondContact OD1-N 3.49Å
325	D	93.2	Very high	95.1	Very high	34 Å²	34	45.7 Å²	45.7	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	62.2	179.3	-169.4	6.5	0	0	0	109.3	N322 R350	N322-D325 HydrophobicContact CB-CB 4Å; N322-D325 WeakPolarHBondContact ND2-CB 3.4Å; N322-D325 CarbonylContact O-C 3.59Å; N322-D325 PolarHBondContact O-N 3.17Å; N322-D325 VanDerWaalsContact O-N 3.08Å; N322-D325 PolarHBondContact OD1-N 3.41Å; D325-R350 PolarHBondContact O-N 3.37Å; D325-R350 VanDerWaalsContact O-N 3.14Å; D325-R350 IonicContact OD1-CZ 2.75Å; D325-R350 IonicContact OD1-NE 3.21Å; D325-R350 PolarHBondContact OD1-NE 3.47Å; D325-R350 IonicContact OD1-NH2 3.27Å; D325-R350 PolarHBondContact OD1-NH2 3.06Å; D325-R350 IonicContact OD2-CZ 3.4Å; D325-R350 IonicContact OD2-NE 2.8Å; D325-R350 PolarHBondContact OD2-NE 3.15Å; D325-R350 IonicContact OD2-NH2 2.67Å; D325-R350 PolarHBondContact OD2-NH2 2.83Å
326	V	93.4	Very high	95.3	Very high	40 Å²	40	40.7 Å²	40.7	24%	0.242	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149.1	-171.9	63	0	0	0	0	110.1	S323 L330 I332 S348 V349	S323-V326 WeakPolarHBondContact O-CG1 3.25Å; V326-L330 HydrophobicContact CG2-CB 3.58Å; V326-L330 HydrophobicContact CG2-CD2 3.58Å; V326-L330 HydrophobicContact CG2-CG 4.18Å; V326-I332 HydrophobicContact CB-CD1 4.46Å; V326-I332 HydrophobicContact CG2-CD1 4.15Å; V326-S348 CarbonylContact C-O 3.56Å; V326-S348 VanDerWaalsContact CA-O 3.31Å; V326-S348 WeakPolarHBondContact CA-O 3.47Å; V326-V349 HydrophobicContact CB-CB 4.19Å; V326-V349 HydrophobicContact CB-CG2 3.91Å; V326-V349 HydrophobicContact CG2-CB 3.85Å; V326-V349 HydrophobicContact CG2-CG2 3.94Å
327	S	92.9	Very high	95.5	Very high	13 Å²	13	36.4 Å²	36.4	9%	0.091	18%	0.178	C	C	.	.			trans	-66.9	152.3	170.3	-55.5	0	0	0	0	112.2	Y329 L330 E347 S348	S327-Y329 VanDerWaalsContact C-N 3.3Å; S327-Y329 PolarHBondContact O-N 2.98Å; S327-Y329 VanDerWaalsContact O-N 3.15Å; S327-L330 PolarHBondContact O-N 3.4Å; S327-E347 VanDerWaalsContact CB-CD 3.47Å; S327-E347 WeakPolarHBondContact CB-OE2 3.32Å; S327-S348 PolarHBondContact N-O 2.95Å; S327-S348 PolarHBondContact OG-N 3.37Å; S327-S348 PolarHBondContact OG-O 3.29Å
328	E	86.5	Confident	95.5	Very high	110 Å²	110	35.9 Å²	35.9	51%	0.514	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.5	-163.7	52.7	173.4	161.5	0	0	116.1	E347 H386	E328-E347 PolarHBondContact N-OE2 2.54Å; E328-H386 IonicContact OE1-CE1 3.33Å; E328-H386 IonicContact OE1-NE2 3.37Å; E328-H386 PolarHBondContact OE1-NE2 2.96Å
329	Y	91.9	Very high	95.5	Very high	103 Å²	103	30.2 Å²	30.2	40%	0.404	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-0.3	-172.4	-58.1	-58	0	0	0	114.1	S327 K331 A343 E347	S327-Y329 VanDerWaalsContact C-N 3.3Å; S327-Y329 PolarHBondContact O-N 2.98Å; S327-Y329 VanDerWaalsContact O-N 3.15Å; Y329-K331 PolarHBondContact O-N 3.48Å; Y329-A343 HydrophobicContact CD2-CB 4.07Å; Y329-A343 HydrophobicContact CG-CB 4.13Å; Y329-E347 WeakPolarHBondContact CA-OE2 3.26Å; Y329-E347 PolarHBondContact N-OE2 2.88Å
330	L	96.3	Very high	95.5	Very high	17 Å²	17	30.2 Å²	30.2	9%	0.089	15%	0.154	C	C	.	.			trans	-67.4	125.4	176.2	-163.8	68.8	0	0	0	110.5	V326 S327 I332 A339 C341 E347 V349 F467	V326-L330 HydrophobicContact CG2-CB 3.58Å; V326-L330 HydrophobicContact CG2-CD2 3.58Å; V326-L330 HydrophobicContact CG2-CG 4.18Å; S327-L330 PolarHBondContact O-N 3.4Å; L330-I332 HydrophobicContact CD2-CG1 4.45Å; L330-A339 HydrophobicContact CD1-CB 4.48Å; L330-A339 HydrophobicContact CD2-CB 4.09Å; L330-A339 HydrophobicContact CG-CB 4.3Å; L330-C341 HydrophobicContact CD1-CB 3.98Å; L330-E347 HydrophobicContact CB-CB 4.06Å; L330-E347 HydrophobicContact CD1-CB 3.89Å; L330-E347 PolarHBondContact N-OE2 2.65Å; L330-V349 HydrophobicContact CD2-CB 3.65Å; L330-V349 HydrophobicContact CD2-CG1 3.6Å; L330-V349 HydrophobicContact CD2-CG2 4.42Å; L330-F467 HydrophobicContact CD1-CB 4.3Å; L330-F467 HydrophobicContact CD1-CD2 3.7Å; L330-F467 HydrophobicContact CD1-CE2 4.23Å; L330-F467 HydrophobicContact CD1-CG 4.06Å; L330-F467 HydrophobicContact CD2-CD2 4.31Å; L330-F467 HydrophobicContact CD2-CE2 4.23Å
331	K	97.5	Very high	95.5	Very high	9 Å²	9	30.1 Å²	30.1	4%	0.039	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.4	173.3	-59.1	179.3	177.4	174.3	0	108.3	E250 F290 W294 Y329 A339 R340 D342	E250-K331 IonicContact OE1-NZ 2.67Å; E250-K331 PolarHBondContact OE1-NZ 3.28Å; E250-K331 IonicContact OE2-NZ 2.6Å; E250-K331 PolarHBondContact OE2-NZ 3.14Å; F290-K331 HydrophobicContact CE1-CB 3.77Å; F290-K331 HydrophobicContact CE1-CD 4.33Å; F290-K331 HydrophobicContact CZ-CB 4.1Å; W294-K331 HydrophobicContact CD2-CD 3.85Å; W294-K331 HydrophobicContact CD2-CG 4.08Å; W294-K331 HydrophobicContact CE3-CD 4.21Å; W294-K331 HydrophobicContact CG-CB 4.4Å; W294-K331 HydrophobicContact CG-CD 4Å; W294-K331 HydrophobicContact CG-CG 4.24Å; W294-K331 HydrophobicContact CZ2-CG 4.26Å; Y329-K331 PolarHBondContact O-N 3.48Å; K331-A339 CarbonylContact O-C 3.53Å; K331-A339 WeakPolarHBondContact O-CA 3.32Å; K331-R340 HydrophobicContact CB-CB 4.48Å; K331-R340 WeakPolarHBondContact CB-O 3.49Å; K331-R340 PolarHBondContact N-O 3.43Å; K331-R340 PolarHBondContact O-N 3.5Å; K331-D342 WeakPolarHBondContact CE-OD2 3.38Å; K331-D342 IonicContact NZ-OD2 2.71Å; K331-D342 PolarHBondContact NZ-OD2 3.09Å
332	I	97.8	Very high	95.4	Very high	14 Å²	14	30.3 Å²	30.3	7%	0.072	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.6	172.8	-53.8	177.7	0	0	0	108.7	L321 V326 L330 V349 I506	L321-I332 HydrophobicContact CB-CD1 4.16Å; L321-I332 HydrophobicContact CB-CG2 4.24Å; L321-I332 HydrophobicContact CD1-CG2 4.39Å; V326-I332 HydrophobicContact CB-CD1 4.46Å; V326-I332 HydrophobicContact CG2-CD1 4.15Å; L330-I332 HydrophobicContact CD2-CG1 4.45Å; I332-V349 HydrophobicContact CD1-CG2 4.32Å; I332-I506 HydrophobicContact CB-CD1 4.01Å; I332-I506 HydrophobicContact CG2-CD1 3.39Å
333	S	97.3	Very high	95.1	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.028	15%	0.147	C	C	.	.			trans	-55.2	153.7	171.7	47.8	0	0	0	0	112.4	H335 G336 L337 E338 I506	S333-H335 PolarHBondContact O-N 2.95Å; S333-H335 VanDerWaalsContact O-N 3.14Å; S333-H335 PolarHBondContact OG-CE1 3.41Å; S333-H335 PolarHBondContact OG-ND1 3.1Å; S333-G336 WeakPolarHBondContact O-CA 3.5Å; S333-G336 PolarHBondContact O-N 2.98Å; S333-G336 PolarHBondContact OG-N 2.98Å; S333-L337 PolarHBondContact OG-N 3.43Å; S333-E338 WeakPolarHBondContact CB-O 3.39Å; S333-E338 PolarHBondContact N-O 2.94Å; S333-E338 WeakPolarHBondContact OG-CA 3.28Å; S333-E338 PolarHBondContact OG-N 3.27Å; S333-E338 PolarHBondContact OG-O 3.29Å; S333-I506 WeakPolarHBondContact O-CD1 3.33Å
334	P	96.1	Very high	94.9	Very high	14 Å²	14	30 Å²	30	9%	0.091	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.6	177.9	-27	36.7	0	0	0	115.1	Q293 T308 V312 G336	Q293-P334 VanDerWaalsContact OE1-CD 3.31Å; T308-P334 HydrophobicContact CG2-CB 4.06Å; T308-P334 HydrophobicContact CG2-CG 3.62Å; V312-P334 HydrophobicContact CB-CB 4.29Å; V312-P334 HydrophobicContact CG1-CB 4.07Å; V312-P334 HydrophobicContact CG2-CB 4.44Å; P334-G336 VanDerWaalsContact C-N 3.35Å
335	H	95.7	Very high	94.9	Very high	42 Å²	42	23.4 Å²	23.4	19%	0.194	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.2	173.8	58.9	72.4	0	0	0	113.6	V312 L314 S333 L337	V312-H335 HydrophobicContact CG2-CB 3.91Å; L314-H335 HydrophobicContact CD2-CB 3.95Å; S333-H335 PolarHBondContact O-N 2.95Å; S333-H335 VanDerWaalsContact O-N 3.14Å; S333-H335 PolarHBondContact OG-CE1 3.41Å; S333-H335 PolarHBondContact OG-ND1 3.1Å; H335-L337 VanDerWaalsContact C-N 3.29Å; H335-L337 VanDerWaalsContact ND1-CB 3.31Å; H335-L337 WeakPolarHBondContact ND1-CB 3.4Å; H335-L337 PolarHBondContact ND1-N 3.42Å; H335-L337 VanDerWaalsContact ND1-N 3.13Å; H335-L337 PolarHBondContact O-N 2.97Å
336	G	97.6	Very high	94.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	67	19.9	175.8	0	0	0	0	0	116.1	M320 L321 S333 P334	M320-G336 VanDerWaalsContact CE-CA 3.49Å; L321-G336 WeakPolarHBondContact CB-O 3.49Å; L321-G336 WeakPolarHBondContact CG-O 3.49Å; L321-G336 PolarHBondContact N-O 3.49Å; S333-G336 WeakPolarHBondContact O-CA 3.5Å; S333-G336 PolarHBondContact O-N 2.98Å; S333-G336 PolarHBondContact OG-N 2.98Å; P334-G336 VanDerWaalsContact C-N 3.35Å
337	L	98.1	Very high	94.9	Very high	17 Å²	17	21 Å²	21	9%	0.089	11%	0.106	C	C	.	.	S	Bend	trans	-112.2	-14.5	-178.9	-58.1	-177.6	0	0	0	113.5	I317 M320 S333 H335 E474 F475 F477	I317-L337 HydrophobicContact CD1-CD1 3.69Å; I317-L337 HydrophobicContact CD1-CG 4.32Å; M320-L337 HydrophobicContact CB-CD2 4.39Å; S333-L337 PolarHBondContact OG-N 3.43Å; H335-L337 VanDerWaalsContact C-N 3.29Å; H335-L337 VanDerWaalsContact ND1-CB 3.31Å; H335-L337 WeakPolarHBondContact ND1-CB 3.4Å; H335-L337 PolarHBondContact ND1-N 3.42Å; H335-L337 VanDerWaalsContact ND1-N 3.13Å; H335-L337 PolarHBondContact O-N 2.97Å; L337-E474 CarbonylContact O-C 3.58Å; L337-E474 WeakPolarHBondContact O-CA 3.19Å; L337-F475 WeakPolarHBondContact CB-O 3.35Å; L337-F475 PolarHBondContact O-N 3.42Å; L337-F477 HydrophobicContact CD2-CD2 3.62Å; L337-F477 HydrophobicContact CD2-CE2 4.03Å
338	E	98.3	Very high	95.1	Very high	5 Å²	5	20.4 Å²	20.4	2%	0.023	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.8	176	-173.5	166.8	-166.2	0	0	109.9	R286 F290 S333 Q472 C473 E474	R286-E338 IonicContact CZ-OE1 3.55Å; R286-E338 IonicContact CZ-OE2 3.44Å; R286-E338 IonicContact NE-OE1 2.97Å; R286-E338 PolarHBondContact NE-OE1 2.89Å; R286-E338 IonicContact NE-OE2 3.31Å; R286-E338 PolarHBondContact NE-OE2 3.4Å; R286-E338 VanDerWaalsContact NH2-CD 3.28Å; R286-E338 IonicContact NH2-OE1 3.45Å; R286-E338 PolarHBondContact NH2-OE1 2.96Å; R286-E338 IonicContact NH2-OE2 2.73Å; R286-E338 PolarHBondContact NH2-OE2 2.93Å; F290-E338 HydrophobicContact CD2-CB 4.49Å; F290-E338 HydrophobicContact CD2-CG 3.91Å; F290-E338 HydrophobicContact CE2-CB 4.06Å; F290-E338 HydrophobicContact CE2-CG 3.75Å; S333-E338 WeakPolarHBondContact CB-O 3.39Å; S333-E338 PolarHBondContact N-O 2.94Å; S333-E338 WeakPolarHBondContact OG-CA 3.28Å; S333-E338 PolarHBondContact OG-N 3.27Å; S333-E338 PolarHBondContact OG-O 3.29Å; E338-Q472 HydrophobicContact CG-CG 4.27Å; E338-Q472 PolarHBondContact OE1-NE2 3.29Å; E338-C473 WeakPolarHBondContact CA-O 3.35Å; E338-E474 HydrophobicContact CB-CB 4.4Å; E338-E474 HydrophobicContact CB-CG 4.44Å; E338-E474 HydrophobicContact CG-CB 4.4Å
339	A	98.4	Very high	95.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.3	179.1	0	0	0	0	0	111.6	L321 L330 K331 F467 Q472 C473	L321-A339 HydrophobicContact CD1-CB 3.58Å; L330-A339 HydrophobicContact CD1-CB 4.48Å; L330-A339 HydrophobicContact CD2-CB 4.09Å; L330-A339 HydrophobicContact CG-CB 4.3Å; K331-A339 CarbonylContact O-C 3.53Å; K331-A339 WeakPolarHBondContact O-CA 3.32Å; A339-F467 HydrophobicContact CB-CE2 4.29Å; A339-F467 HydrophobicContact CB-CZ 3.96Å; A339-Q472 VanDerWaalsContact O-CA 3.27Å; A339-Q472 WeakPolarHBondContact O-CA 3.19Å; A339-Q472 WeakPolarHBondContact O-CG 3.4Å; A339-C473 PolarHBondContact N-O 3.48Å; A339-C473 PolarHBondContact O-N 3.49Å; A339-C473 VanDerWaalsContact O-N 3.15Å
340	R	98.2	Very high	96	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	137.5	177.5	-177.6	-176.6	179.4	78.3	14.9	111	F290 C291 K331 D342 Q471 Q472	F290-R340 HydrophobicContact CD1-CB 4.05Å; F290-R340 HydrophobicContact CE1-CB 3.51Å; F290-R340 HydrophobicContact CE1-CG 4.46Å; F290-R340 HydrophobicContact CZ-CB 4.01Å; C291-R340 VanDerWaalsContact SG-CD 3.53Å; C291-R340 PolarHBondContact SG-NE 2.89Å; K331-R340 HydrophobicContact CB-CB 4.48Å; K331-R340 WeakPolarHBondContact CB-O 3.49Å; K331-R340 PolarHBondContact N-O 3.43Å; K331-R340 PolarHBondContact O-N 3.5Å; R340-D342 IonicContact CZ-OD1 3.61Å; R340-D342 VanDerWaalsContact CZ-OD1 3.27Å; R340-D342 IonicContact NE-OD1 3.59Å; R340-D342 PolarHBondContact NE-OD1 3.16Å; R340-D342 IonicContact NE-OD2 2.73Å; R340-D342 PolarHBondContact NE-OD2 3.44Å; R340-D342 IonicContact NH2-OD1 2.89Å; R340-D342 PolarHBondContact NH2-OD1 2.81Å; R340-Q471 CarbonylContact C-O 3.6Å; R340-Q471 VanDerWaalsContact CA-O 3.23Å; R340-Q471 WeakPolarHBondContact CA-O 3.36Å; R340-Q472 HydrophobicContact CB-CB 4.13Å; R340-Q472 HydrophobicContact CB-CG 4.04Å; R340-Q472 VanDerWaalsContact CD-OE1 3.31Å; R340-Q472 HydrophobicContact CG-CB 4.1Å; R340-Q472 HydrophobicContact CG-CG 4.42Å
341	C	97.4	Very high	96.1	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.			trans	-104.7	129.9	168.9	-179	0	0	0	0	110.3	L330 A343 E347 F467 Y470 Q471	L330-C341 HydrophobicContact CD1-CB 3.98Å; C341-A343 PolarHBondContact SG-N 2.92Å; C341-E347 HydrophobicContact CB-CB 4.42Å; C341-E347 HydrophobicContact CB-CG 4.47Å; C341-E347 VanDerWaalsContact SG-CG 3.53Å; C341-F467 HydrophobicContact CB-CB 3.54Å; C341-F467 HydrophobicContact CB-CG 4.49Å; C341-Y470 CarbonylContact O-C 3.5Å; C341-Y470 WeakPolarHBondContact O-CA 3.49Å; C341-Y470 PolarHBondContact O-N 3.09Å; C341-Q471 PolarHBondContact N-O 3.25Å; C341-Q471 PolarHBondContact O-N 3.08Å
342	D	95.9	Very high	96.1	Very high	4 Å²	4	11.6 Å²	11.6	2%	0.021	7%	0.066	C	C	.	.			trans	-122.9	12.5	169	-65.2	-51.6	0	0	0	111.6	I247 K251 K331 R340 Y470	I247-D342 VanDerWaalsContact CD1-OD1 3.28Å; I247-D342 WeakPolarHBondContact CD1-OD1 3.31Å; I247-D342 HydrophobicContact CG2-CB 4.38Å; K251-D342 VanDerWaalsContact CE-O 3.31Å; K251-D342 WeakPolarHBondContact CE-O 3.34Å; K251-D342 PolarHBondContact NZ-O 3.18Å; K331-D342 WeakPolarHBondContact CE-OD2 3.38Å; K331-D342 IonicContact NZ-OD2 2.71Å; K331-D342 PolarHBondContact NZ-OD2 3.09Å; R340-D342 IonicContact CZ-OD1 3.61Å; R340-D342 VanDerWaalsContact CZ-OD1 3.27Å; R340-D342 IonicContact NE-OD1 3.59Å; R340-D342 PolarHBondContact NE-OD1 3.16Å; R340-D342 IonicContact NE-OD2 2.73Å; R340-D342 PolarHBondContact NE-OD2 3.44Å; R340-D342 IonicContact NH2-OD1 2.89Å; R340-D342 PolarHBondContact NH2-OD1 2.81Å; D342-Y470 HydrophobicContact CB-CD1 4.44Å
343	A	91.8	Very high	96.1	Very high	3 Å²	3	13.3 Å²	13.3	3%	0.025	7%	0.072	C	C	.	.	S	Bend	trans	-91.1	162	173.7	0	0	0	0	0	111	Y329 C341 S345 E347 S469	Y329-A343 HydrophobicContact CD2-CB 4.07Å; Y329-A343 HydrophobicContact CG-CB 4.13Å; C341-A343 PolarHBondContact SG-N 2.92Å; A343-S345 VanDerWaalsContact C-N 3.33Å; A343-E347 HydrophobicContact CB-CG 4.4Å; A343-S469 WeakPolarHBondContact O-CA 3.4Å; A343-S469 VanDerWaalsContact O-CB 3.27Å; A343-S469 WeakPolarHBondContact O-CB 3.27Å; A343-S469 PolarHBondContact O-OG 3.17Å
344	S	88.1	Confident	96.2	Very high	53 Å²	53	15 Å²	15	37%	0.371	8%	0.084	S	C	.	.	S	Bend	trans	-73.8	-25.5	173.1	56.9	0	0	0	0	113	S469	S344-S469 WeakPolarHBondContact CA-OG 3.32Å
345	S	89.9	Confident	96.2	Very high	10 Å²	10	14.3 Å²	14.3	7%	0.07	8%	0.08	C	C	.	.	S	Bend	trans	-72.6	157.8	178.6	47.5	0	0	0	0	113.3	A343 E347	A343-S345 VanDerWaalsContact C-N 3.33Å; S345-E347 VanDerWaalsContact CB-OE1 3.31Å; S345-E347 WeakPolarHBondContact CB-OE1 3.31Å; S345-E347 PolarHBondContact O-N 2.83Å; S345-E347 VanDerWaalsContact O-N 3.14Å; S345-E347 PolarHBondContact OG-OE1 3.27Å
346	F	91.9	Very high	96.3	Very high	23 Å²	23	16.8 Å²	16.8	10%	0.101	9%	0.094	C	C	.	.			trans	-87.9	78.6	-179.1	-163.6	-132.7	0	0	0	111.4	S348 Q373 N385 G388 F467 M468	F346-S348 PolarHBondContact O-OG 3.01Å; F346-Q373 HydrophobicContact CZ-CB 4.13Å; F346-Q373 HydrophobicContact CZ-CG 4.01Å; F346-Q373 VanDerWaalsContact CZ-OE1 3.27Å; F346-N385 PolarHBondContact N-O 2.7Å; F346-N385 WeakPolarHBondContact O-CA 3.31Å; F346-N385 VanDerWaalsContact O-CB 3.26Å; F346-N385 WeakPolarHBondContact O-CB 3.49Å; F346-G388 WeakPolarHBondContact CD1-O 3.32Å; F346-F467 VanDerWaalsContact CD2-C 3.4Å; F346-F467 WeakPolarHBondContact CD2-O 3.5Å; F346-M468 HydrophobicContact CD2-CB 4.42Å; F346-M468 HydrophobicContact CE2-CB 4.46Å
347	E	96.2	Very high	96.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	134.4	-171.8	-61.7	-61.5	111.4	0	0	112.1	S327 E328 Y329 L330 C341 A343 S345 N385 S466 F467	S327-E347 VanDerWaalsContact CB-CD 3.47Å; S327-E347 WeakPolarHBondContact CB-OE2 3.32Å; E328-E347 PolarHBondContact N-OE2 2.54Å; Y329-E347 WeakPolarHBondContact CA-OE2 3.26Å; Y329-E347 PolarHBondContact N-OE2 2.88Å; L330-E347 HydrophobicContact CB-CB 4.06Å; L330-E347 HydrophobicContact CD1-CB 3.89Å; L330-E347 PolarHBondContact N-OE2 2.65Å; C341-E347 HydrophobicContact CB-CB 4.42Å; C341-E347 HydrophobicContact CB-CG 4.47Å; C341-E347 VanDerWaalsContact SG-CG 3.53Å; A343-E347 HydrophobicContact CB-CG 4.4Å; S345-E347 VanDerWaalsContact CB-OE1 3.31Å; S345-E347 WeakPolarHBondContact CB-OE1 3.31Å; S345-E347 PolarHBondContact O-N 2.83Å; S345-E347 VanDerWaalsContact O-N 3.14Å; S345-E347 PolarHBondContact OG-OE1 3.27Å; E347-N385 PolarHBondContact OE1-ND2 2.78Å; E347-S466 CarbonylContact O-C 3.33Å; E347-S466 VanDerWaalsContact O-CA 3.24Å; E347-S466 WeakPolarHBondContact O-CA 3.29Å; E347-F467 PolarHBondContact N-O 3.47Å; E347-F467 PolarHBondContact O-N 3.05Å
348	S	97.3	Very high	96.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.1	-173.8	-58.3	0	0	0	0	112.5	V326 S327 F346 F383 A465 S466	V326-S348 CarbonylContact C-O 3.56Å; V326-S348 VanDerWaalsContact CA-O 3.31Å; V326-S348 WeakPolarHBondContact CA-O 3.47Å; S327-S348 PolarHBondContact N-O 2.95Å; S327-S348 PolarHBondContact OG-N 3.37Å; S327-S348 PolarHBondContact OG-O 3.29Å; F346-S348 PolarHBondContact O-OG 3.01Å; S348-F383 VanDerWaalsContact CB-CG 3.5Å; S348-A465 CarbonylContact C-O 3.48Å; S348-A465 VanDerWaalsContact CA-O 3.25Å; S348-A465 WeakPolarHBondContact CA-O 3.27Å; S348-S466 WeakPolarHBondContact CB-OG 3.49Å; S348-S466 WeakPolarHBondContact OG-CB 3.37Å; S348-S466 PolarHBondContact OG-OG 3.33Å
349	V	98.3	Very high	96.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	145.4	179.2	61.9	0	0	0	0	111.9	L321 V326 L330 I332 A464 A465 F467	L321-V349 HydrophobicContact CB-CG2 4.01Å; L321-V349 HydrophobicContact CD2-CG1 3.97Å; L321-V349 HydrophobicContact CD2-CG2 4.24Å; V326-V349 HydrophobicContact CB-CB 4.19Å; V326-V349 HydrophobicContact CB-CG2 3.91Å; V326-V349 HydrophobicContact CG2-CB 3.85Å; V326-V349 HydrophobicContact CG2-CG2 3.94Å; L330-V349 HydrophobicContact CD2-CB 3.65Å; L330-V349 HydrophobicContact CD2-CG1 3.6Å; L330-V349 HydrophobicContact CD2-CG2 4.42Å; I332-V349 HydrophobicContact CD1-CG2 4.32Å; V349-A464 CarbonylContact O-C 3.5Å; V349-A464 WeakPolarHBondContact O-CA 3.26Å; V349-A464 WeakPolarHBondContact O-CB 3.29Å; V349-A465 PolarHBondContact N-O 3.23Å; V349-A465 PolarHBondContact O-N 3.32Å; V349-F467 HydrophobicContact CG1-CE2 4.11Å
350	R	98.3	Very high	96.3	Very high	19 Å²	19	23.3 Å²	23.3	7%	0.072	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	156.3	164.9	-81.6	176	-68.6	-113.6	-8.7	111.2	N322 D325 T378 S381 F383 F462 A463 A464	N322-R350 WeakPolarHBondContact CB-O 3.49Å; N322-R350 PolarHBondContact N-O 3.48Å; D325-R350 PolarHBondContact O-N 3.37Å; D325-R350 VanDerWaalsContact O-N 3.14Å; D325-R350 IonicContact OD1-CZ 2.75Å; D325-R350 IonicContact OD1-NE 3.21Å; D325-R350 PolarHBondContact OD1-NE 3.47Å; D325-R350 IonicContact OD1-NH2 3.27Å; D325-R350 PolarHBondContact OD1-NH2 3.06Å; D325-R350 IonicContact OD2-CZ 3.4Å; D325-R350 IonicContact OD2-NE 2.8Å; D325-R350 PolarHBondContact OD2-NE 3.15Å; D325-R350 IonicContact OD2-NH2 2.67Å; D325-R350 PolarHBondContact OD2-NH2 2.83Å; R350-T378 PolarHBondContact NH1-O 3.3Å; R350-S381 PolarHBondContact NH1-O 2.89Å; R350-F383 HydrophobicContact CG-CE2 4.33Å; R350-F383 HydrophobicContact CG-CZ 3.87Å; R350-F383 VanDerWaalsContact CZ-CE2 3.44Å; R350-F462 HydrophobicContact CB-CB 4.07Å; R350-F462 HydrophobicContact CB-CG 4.43Å; R350-F462 HydrophobicContact CG-CB 3.93Å; R350-F462 HydrophobicContact CG-CG 4.45Å; R350-A463 CarbonylContact C-O 3.49Å; R350-A463 WeakPolarHBondContact CA-O 3.13Å; R350-A464 HydrophobicContact CG-CB 3.9Å
351	C	98.5	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	170.9	169.6	77	0	0	0	0	111.9	M320 F353 F462 A463 F477	M320-C351 CarbonylContact O-C 3.09Å; M320-C351 WeakPolarHBondContact O-CA 3.25Å; M320-C351 WeakPolarHBondContact O-CB 3.38Å; C351-F353 VanDerWaalsContact C-N 3.31Å; C351-F353 PolarHBondContact O-N 3.31Å; C351-F353 PolarHBondContact SG-O 3.27Å; C351-F462 WeakPolarHBondContact O-CD1 3.35Å; C351-A463 HydrophobicContact CB-CB 4.25Å; C351-A463 PolarHBondContact N-O 2.82Å; C351-A463 PolarHBondContact SG-N 3.19Å; C351-F477 HydrophobicContact CB-CE1 4.03Å; C351-F477 HydrophobicContact CB-CE2 4.18Å; C351-F477 HydrophobicContact CB-CZ 3.65Å
352	T	98.1	Very high	96.4	Very high	36 Å²	36	23.4 Å²	23.4	22%	0.221	14%	0.143	C	C	.	.	S	Bend	trans	-79.6	-8.4	-176.9	53.5	0	0	0	0	114.5	M320 N322 L499	M320-T352 HydrophobicContact CG-CG2 3.77Å; M320-T352 PolarHBondContact N-OG1 2.65Å; M320-T352 PolarHBondContact O-N 2.95Å; M320-T352 PolarHBondContact O-OG1 3.44Å; N322-T352 HydrophobicContact CB-CG2 3.75Å; T352-L499 HydrophobicContact CG2-CD2 4.1Å
353	F	98.1	Very high	96.5	Very high	49 Å²	49	23.5 Å²	23.5	22%	0.215	14%	0.144	C	C	.	.			trans	-123.7	127.4	-171.4	-175.6	-96.7	0	0	0	112.8	A319 C351 V355 W360 F462 F493 A497	A319-F353 HydrophobicContact CB-CB 4.35Å; C351-F353 VanDerWaalsContact C-N 3.31Å; C351-F353 PolarHBondContact O-N 3.31Å; C351-F353 PolarHBondContact SG-O 3.27Å; F353-V355 HydrophobicContact CD1-CG2 4.12Å; F353-V355 HydrophobicContact CE1-CG2 4.1Å; F353-W360 HydrophobicContact CD1-CZ3 4.4Å; F353-W360 AromaticContact CE1-CH2 3.49Å; F353-W360 HydrophobicContact CE1-CH2 3.49Å; F353-W360 VanDerWaalsContact CE1-CH2 3.49Å; F353-W360 HydrophobicContact CE1-CZ2 4.24Å; F353-W360 AromaticContact CE1-CZ3 3.73Å; F353-W360 HydrophobicContact CE1-CZ3 3.73Å; F353-W360 HydrophobicContact CZ-CH2 4.02Å; F353-F462 VanDerWaalsContact O-CD1 3.31Å; F353-F462 WeakPolarHBondContact O-CD1 3.35Å; F353-F493 HydrophobicContact CB-CD1 4.1Å; F353-F493 AromaticContact CD1-CD1 3.77Å; F353-F493 HydrophobicContact CD1-CD1 3.77Å; F353-F493 HydrophobicContact CD1-CE1 4.38Å; F353-F493 HydrophobicContact CG-CD1 4.39Å; F353-A497 HydrophobicContact CB-CB 3.84Å; F353-A497 HydrophobicContact CD1-CB 4.33Å; F353-A497 HydrophobicContact CD2-CB 3.37Å; F353-A497 HydrophobicContact CE2-CB 3.96Å; F353-A497 HydrophobicContact CG-CB 3.58Å
354	C	97.8	Very high	96.9	Very high	39 Å²	39	23.3 Å²	23.3	26%	0.264	14%	0.143	S	C	.	.			trans	-88.6	138.8	-179.6	-169.1	0	0	0	0	111	D356 G460 F462	C354-D356 PolarHBondContact SG-OD2 3.36Å; C354-G460 VanDerWaalsContact SG-CA 3.51Å; C354-F462 HydrophobicContact CB-CD1 4.42Å; C354-F462 HydrophobicContact CB-CE1 3.59Å; C354-F462 HydrophobicContact CB-CE2 3.92Å; C354-F462 HydrophobicContact CB-CZ 3.29Å; C354-F462 VanDerWaalsContact SG-CE2 3.58Å; C354-F462 VanDerWaalsContact SG-CZ 3.56Å
355	V	97.1	Very high	97.4	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-115.5	118.5	178.2	171.3	0	0	0	0	110.1	F353 W360 L431 L433 G460 F461 F493	F353-V355 HydrophobicContact CD1-CG2 4.12Å; F353-V355 HydrophobicContact CE1-CG2 4.1Å; V355-W360 HydrophobicContact CB-CD2 4.43Å; V355-W360 HydrophobicContact CB-CG 4.41Å; V355-W360 HydrophobicContact CG1-CB 4.33Å; V355-W360 HydrophobicContact CG1-CD2 3.87Å; V355-W360 HydrophobicContact CG1-CG 3.54Å; V355-W360 VanDerWaalsContact CG1-NE1 3.25Å; V355-W360 HydrophobicContact CG2-CD2 3.65Å; V355-W360 HydrophobicContact CG2-CE3 3.9Å; V355-W360 HydrophobicContact CG2-CG 3.95Å; V355-W360 HydrophobicContact CG2-CZ2 4.38Å; V355-W360 HydrophobicContact CG2-CZ3 4.37Å; V355-L431 HydrophobicContact CG1-CD2 4.05Å; V355-L433 HydrophobicContact CG1-CD1 3.75Å; V355-G460 PolarHBondContact O-N 2.97Å; V355-G460 VanDerWaalsContact O-N 3.15Å; V355-F461 WeakPolarHBondContact CB-O 3.47Å; V355-F461 PolarHBondContact N-O 2.84Å; V355-F461 PolarHBondContact O-N 3.44Å; V355-F493 HydrophobicContact CG2-CE1 3.93Å; V355-F493 HydrophobicContact CG2-CZ 4.17Å
356	D	96.7	Very high	97.8	Very high	93 Å²	93	21.3 Å²	21.3	50%	0.497	13%	0.128	S	C	.	.			trans	-115.3	-15.6	-174.5	-70.6	-66.4	0	0	0	115.1	C354 L433 G460	C354-D356 PolarHBondContact SG-OD2 3.36Å; D356-L433 VanDerWaalsContact C-CD1 3.4Å; D356-G460 VanDerWaalsContact OD1-CA 3.27Å; D356-G460 WeakPolarHBondContact OD1-CA 3.45Å; D356-G460 PolarHBondContact OD1-N 3.01Å
357	S	97.5	Very high	98.1	Very high	86 Å²	86	20.2 Å²	20.2	60%	0.601	12%	0.123	S	C	*	.	S	Bend	trans	-159	162.4	177.1	63.6	0	0	0	0	112.3	W360 L433	S357-W360 PolarHBondContact O-NE1 3.48Å; S357-L433 VanDerWaalsContact N-CD1 3.32Å
358	G	97.8	Very high	98.1	Very high	32 Å²	32	20.6 Å²	20.6	33%	0.33	13%	0.125	S	C	.	.	S	Bend	trans	86.6	-160.7	176.3	0	0	0	0	0	114	L433	G358-L433 PolarHBondContact O-N 2.99Å
359	V	98.6	Very high	98	Very high	25 Å²	25	21.2 Å²	21.2	15%	0.152	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.6	-177.4	-174.8	0	0	0	0	108.9	L430 L431 D432 I488 F490 S491	V359-L430 HydrophobicContact CG1-CD1 4.09Å; V359-L430 HydrophobicContact CG1-CD2 4.32Å; V359-L430 HydrophobicContact CG1-CG 4.22Å; V359-L431 CarbonylContact C-O 3.48Å; V359-L431 VanDerWaalsContact CA-O 3.27Å; V359-L431 WeakPolarHBondContact CA-O 3.41Å; V359-D432 HydrophobicContact CG1-CB 4.3Å; V359-D432 HydrophobicContact CG2-CB 4.15Å; V359-I488 HydrophobicContact CG1-CD1 4.01Å; V359-F490 HydrophobicContact CG1-CB 4.17Å; V359-F490 CarbonylContact O-C 3.39Å; V359-F490 WeakPolarHBondContact O-CA 3.33Å; V359-S491 PolarHBondContact O-N 3.03Å
360	W	98.7	Very high	97.7	Very high	17 Å²	17	21.2 Å²	21.2	6%	0.064	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.4	-171.6	-66.4	76.3	0	0	0	111.5	F353 V355 S357 W376 L430 L431 S491 T492 F493 Y496	F353-W360 HydrophobicContact CD1-CZ3 4.4Å; F353-W360 AromaticContact CE1-CH2 3.49Å; F353-W360 HydrophobicContact CE1-CH2 3.49Å; F353-W360 VanDerWaalsContact CE1-CH2 3.49Å; F353-W360 HydrophobicContact CE1-CZ2 4.24Å; F353-W360 AromaticContact CE1-CZ3 3.73Å; F353-W360 HydrophobicContact CE1-CZ3 3.73Å; F353-W360 HydrophobicContact CZ-CH2 4.02Å; V355-W360 HydrophobicContact CB-CD2 4.43Å; V355-W360 HydrophobicContact CB-CG 4.41Å; V355-W360 HydrophobicContact CG1-CB 4.33Å; V355-W360 HydrophobicContact CG1-CD2 3.87Å; V355-W360 HydrophobicContact CG1-CG 3.54Å; V355-W360 VanDerWaalsContact CG1-NE1 3.25Å; V355-W360 HydrophobicContact CG2-CD2 3.65Å; V355-W360 HydrophobicContact CG2-CE3 3.9Å; V355-W360 HydrophobicContact CG2-CG 3.95Å; V355-W360 HydrophobicContact CG2-CZ2 4.38Å; V355-W360 HydrophobicContact CG2-CZ3 4.37Å; S357-W360 PolarHBondContact O-NE1 3.48Å; W360-W376 HydrophobicContact CB-CH2 4.1Å; W360-L430 CarbonylContact O-C 3.53Å; W360-L430 WeakPolarHBondContact O-CA 3.33Å; W360-L431 PolarHBondContact N-O 3Å; W360-L431 PolarHBondContact O-N 3.29Å; W360-S491 WeakPolarHBondContact CA-O 3.33Å; W360-T492 WeakPolarHBondContact CZ3-O 3.38Å; W360-F493 HydrophobicContact CE3-CD2 4.36Å; W360-Y496 HydrophobicContact CH2-CD1 4.38Å; W360-Y496 AromaticContact CH2-CD2 3.76Å; W360-Y496 HydrophobicContact CH2-CD2 3.76Å; W360-Y496 AromaticContact CH2-CG 3.67Å; W360-Y496 HydrophobicContact CH2-CG 3.67Å; W360-Y496 AromaticContact CZ3-CD2 4Å; W360-Y496 HydrophobicContact CZ3-CD2 4Å; W360-Y496 HydrophobicContact CZ3-CG 4.26Å
361	Y	98.8	Very high	97.6	Very high	1 Å²	1	20.8 Å²	20.8	0%	0.004	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.4	179.8	-173.1	-103.8	0	0	0	112	E363 G428 F429 L430 Y441 F482 Y484 P486 F490 S491	Y361-E363 HydrophobicContact CE1-CG 3.56Å; Y361-E363 WeakPolarHBondContact OH-CG 3.39Å; Y361-E363 PolarHBondContact OH-OE1 3.49Å; Y361-G428 VanDerWaalsContact OH-CA 3.29Å; Y361-G428 WeakPolarHBondContact OH-CA 3.29Å; Y361-F429 VanDerWaalsContact CA-O 3.31Å; Y361-F429 WeakPolarHBondContact CA-O 3.3Å; Y361-F429 WeakPolarHBondContact CD2-O 3.47Å; Y361-L430 HydrophobicContact CD2-CB 4.03Å; Y361-L430 HydrophobicContact CD2-CD1 4.07Å; Y361-Y441 HydrophobicContact CE2-CD2 4.11Å; Y361-Y441 HydrophobicContact CE2-CE2 4.3Å; Y361-F482 HydrophobicContact CD1-CD1 4.34Å; Y361-F482 HydrophobicContact CD1-CD2 4.01Å; Y361-F482 HydrophobicContact CD1-CE1 4.31Å; Y361-F482 AromaticContact CD1-CE2 3.98Å; Y361-F482 HydrophobicContact CD1-CE2 3.98Å; Y361-F482 HydrophobicContact CD1-CG 4.2Å; Y361-F482 HydrophobicContact CD1-CZ 4.14Å; Y361-F482 HydrophobicContact CE1-CB 4.43Å; Y361-F482 HydrophobicContact CE1-CD1 4.16Å; Y361-F482 HydrophobicContact CE1-CD2 4.27Å; Y361-F482 HydrophobicContact CE1-CG 4.04Å; Y361-Y484 PolarHBondContact OH-O 3.25Å; Y361-Y484 VanDerWaalsContact OH-O 3.05Å; Y361-P486 HydrophobicContact CD2-CG 3.84Å; Y361-P486 HydrophobicContact CE2-CG 3.97Å; Y361-P486 HydrophobicContact CG-CG 4.12Å; Y361-F490 HydrophobicContact CD1-CE2 4.23Å; Y361-F490 HydrophobicContact CD1-CZ 4.32Å; Y361-F490 HydrophobicContact CG-CD2 4.44Å; Y361-S491 PolarHBondContact N-O 2.97Å; Y361-S491 VanDerWaalsContact N-O 3.12Å
362	Y	98.9	Very high	97.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	162.5	166.7	72.7	-85.3	0	0	0	110.4	V364 G375 W376 F429 A463 F475 N476 F477 F493	Y362-V364 HydrophobicContact CD2-CG2 3.97Å; Y362-V364 HydrophobicContact CE2-CG2 3.66Å; Y362-G375 PolarHBondContact OH-O 3.1Å; Y362-W376 AromaticContact CD1-CH2 3.81Å; Y362-W376 HydrophobicContact CD1-CH2 3.81Å; Y362-W376 AromaticContact CD1-CZ2 3.66Å; Y362-W376 HydrophobicContact CD1-CZ2 3.66Å; Y362-W376 HydrophobicContact CE1-CD2 4.25Å; Y362-W376 AromaticContact CE1-CE2 3.69Å; Y362-W376 AromaticContact CE1-CH2 3.83Å; Y362-W376 HydrophobicContact CE1-CH2 3.83Å; Y362-W376 AromaticContact CE1-CZ2 3.45Å; Y362-W376 HydrophobicContact CE1-CZ2 3.45Å; Y362-W376 VanDerWaalsContact CE1-CZ2 3.45Å; Y362-W376 HydrophobicContact CE1-CZ3 4.34Å; Y362-F429 HydrophobicContact CD1-CB 3.67Å; Y362-F429 HydrophobicContact CD1-CG 4.45Å; Y362-F429 HydrophobicContact CD2-CB 4.35Å; Y362-F429 AromaticContact CD2-CD2 3.85Å; Y362-F429 HydrophobicContact CD2-CD2 3.85Å; Y362-F429 HydrophobicContact CD2-CG 4.39Å; Y362-F429 HydrophobicContact CE1-CB 3.25Å; Y362-F429 HydrophobicContact CE1-CD2 4.22Å; Y362-F429 AromaticContact CE1-CG 3.79Å; Y362-F429 HydrophobicContact CE1-CG 3.79Å; Y362-F429 HydrophobicContact CE2-CB 3.99Å; Y362-F429 AromaticContact CE2-CD2 3.31Å; Y362-F429 HydrophobicContact CE2-CD2 3.31Å; Y362-F429 AromaticContact CE2-CE2 3.91Å; Y362-F429 HydrophobicContact CE2-CE2 3.91Å; Y362-F429 AromaticContact CE2-CG 3.71Å; Y362-F429 HydrophobicContact CE2-CG 3.71Å; Y362-F429 HydrophobicContact CG-CB 4.2Å; Y362-F429 HydrophobicContact CG-CD2 4.49Å; Y362-F429 VanDerWaalsContact CZ-CB 3.4Å; Y362-F429 AromaticContact CZ-CD2 3.5Å; Y362-F429 AromaticContact CZ-CG 3.35Å; Y362-F429 PolarHBondContact N-O 3.24Å; Y362-F429 PolarHBondContact O-N 3.26Å; Y362-F429 WeakPolarHBondContact OH-CD1 3.41Å; Y362-F429 WeakPolarHBondContact OH-CG 3.42Å; Y362-A463 HydrophobicContact CD1-CB 3.94Å; Y362-A463 HydrophobicContact CD2-CB 4.4Å; Y362-A463 HydrophobicContact CE1-CB 3.5Å; Y362-A463 VanDerWaalsContact CE1-CB 3.5Å; Y362-A463 HydrophobicContact CE2-CB 4.03Å; Y362-A463 HydrophobicContact CG-CB 4.37Å; Y362-F475 HydrophobicContact CD2-CD1 4.41Å; Y362-F475 HydrophobicContact CE2-CD1 4.14Å; Y362-F475 HydrophobicContact CE2-CE1 4.34Å; Y362-N476 WeakPolarHBondContact CB-O 3.31Å; Y362-F477 HydrophobicContact CD2-CE1 4.25Å; Y362-F477 HydrophobicContact CG-CD1 4.4Å; Y362-F477 HydrophobicContact CG-CE1 4.41Å; Y362-F493 AromaticContact CD1-CE2 3.75Å; Y362-F493 HydrophobicContact CD1-CE2 3.75Å; Y362-F493 HydrophobicContact CD1-CZ 4.13Å; Y362-F493 HydrophobicContact CG-CE2 4.19Å
363	E	98.9	Very high	97.5	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.028	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.6	175.8	-72.4	-178	159.6	0	0	111.2	Y361 T426 I427 N476 F482 K483 Y484	Y361-E363 HydrophobicContact CE1-CG 3.56Å; Y361-E363 WeakPolarHBondContact OH-CG 3.39Å; Y361-E363 PolarHBondContact OH-OE1 3.49Å; E363-T426 HydrophobicContact CB-CG2 3.88Å; E363-T426 HydrophobicContact CG-CG2 3.98Å; E363-I427 CarbonylContact C-O 3.55Å; E363-I427 VanDerWaalsContact CA-O 3.25Å; E363-I427 WeakPolarHBondContact CA-O 3.45Å; E363-N476 HydrophobicContact CB-CB 4.34Å; E363-N476 PolarHBondContact N-O 3.47Å; E363-N476 VanDerWaalsContact N-O 3.11Å; E363-N476 PolarHBondContact O-N 3.18Å; E363-F482 HydrophobicContact CB-CD1 4.01Å; E363-F482 HydrophobicContact CB-CE1 4.43Å; E363-F482 HydrophobicContact CG-CB 4.4Å; E363-F482 HydrophobicContact CG-CD1 3.64Å; E363-F482 HydrophobicContact CG-CE1 4.33Å; E363-F482 HydrophobicContact CG-CG 4.32Å; E363-F482 VanDerWaalsContact OE2-CA 3.26Å; E363-F482 WeakPolarHBondContact OE2-CA 3.16Å; E363-K483 PolarHBondContact OE1-N 2.71Å; E363-K483 PolarHBondContact OE2-N 3.25Å; E363-Y484 WeakPolarHBondContact OE1-CA 3.3Å; E363-Y484 PolarHBondContact OE1-N 3.13Å
364	V	98.9	Very high	97.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.6	170.2	179.4	0	0	0	0	109.4	Y362 I374 T426 I427 F429 C473 E474 F475	Y362-V364 HydrophobicContact CD2-CG2 3.97Å; Y362-V364 HydrophobicContact CE2-CG2 3.66Å; V364-I374 HydrophobicContact CG1-CD1 4.06Å; V364-I374 HydrophobicContact CG2-CG2 4.1Å; V364-T426 CarbonylContact O-C 3.56Å; V364-T426 WeakPolarHBondContact O-CA 3.34Å; V364-I427 PolarHBondContact N-O 3.36Å; V364-I427 PolarHBondContact O-N 3.33Å; V364-F429 HydrophobicContact CB-CE2 3.95Å; V364-F429 HydrophobicContact CG2-CD2 4.19Å; V364-F429 HydrophobicContact CG2-CE2 3.66Å; V364-C473 HydrophobicContact CG1-CB 3.61Å; V364-E474 CarbonylContact C-O 3.56Å; V364-E474 VanDerWaalsContact CA-O 3.27Å; V364-E474 WeakPolarHBondContact CA-O 3.45Å; V364-F475 HydrophobicContact CG2-CD1 3.54Å; V364-F475 HydrophobicContact CG2-CE1 3.72Å; V364-F475 HydrophobicContact CG2-CG 4.11Å; V364-F475 HydrophobicContact CG2-CZ 4.42Å
365	T	98.8	Very high	97.5	Very high	21 Å²	21	15 Å²	15	13%	0.129	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.8	170.5	-58.1	0	0	0	0	109.4	I367 D425 C473 E474	T365-I367 HydrophobicContact CG2-CD1 4.28Å; T365-I367 PolarHBondContact O-N 2.88Å; T365-D425 WeakPolarHBondContact CA-O 3.31Å; T365-C473 WeakPolarHBondContact O-CA 3.39Å; T365-C473 WeakPolarHBondContact O-CB 3.43Å; T365-E474 PolarHBondContact N-O 2.93Å; T365-E474 PolarHBondContact O-N 2.91Å
366	V	98.4	Very high	97.6	Very high	0 Å²	0	15 Å²	15	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122	177.7	179.5	0	0	0	0	108.9	T368 M372 W421 G424 D425 I427	V366-T368 WeakPolarHBondContact CG1-O 3.33Å; V366-M372 HydrophobicContact CG1-CE 4.33Å; V366-W421 HydrophobicContact CG1-CD2 4.36Å; V366-W421 HydrophobicContact CG1-CG 4.33Å; V366-W421 HydrophobicContact CG2-CB 4.43Å; V366-W421 HydrophobicContact CG2-CD2 4Å; V366-W421 HydrophobicContact CG2-CE3 3.73Å; V366-W421 HydrophobicContact CG2-CG 4.33Å; V366-W421 HydrophobicContact CG2-CZ3 4.42Å; V366-G424 PolarHBondContact O-N 2.83Å; V366-D425 HydrophobicContact CG2-CB 4.43Å; V366-D425 PolarHBondContact N-O 2.9Å; V366-I427 HydrophobicContact CG2-CD1 4.38Å; V366-I427 HydrophobicContact CG2-CG1 4.01Å
367	I	98.2	Very high	97.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	-99	-28.6	175.5	-54.2	-61	0	0	0	110.7	Y283 Q287 T365 E423 Q472	Y283-I367 HydrophobicContact CD1-CD1 3.6Å; Y283-I367 HydrophobicContact CD1-CG2 4.14Å; Y283-I367 HydrophobicContact CE1-CD1 3.57Å; Q287-I367 HydrophobicContact CG-CG2 3.95Å; T365-I367 HydrophobicContact CG2-CD1 4.28Å; T365-I367 PolarHBondContact O-N 2.88Å; I367-E423 VanDerWaalsContact O-CG 3.23Å; I367-E423 WeakPolarHBondContact O-CG 3.24Å; I367-Q472 HydrophobicContact CB-CB 4.06Å; I367-Q472 HydrophobicContact CB-CG 3.89Å; I367-Q472 WeakPolarHBondContact CB-O 3.46Å; I367-Q472 HydrophobicContact CG1-CG 4.22Å; I367-Q472 HydrophobicContact CG2-CB 4.26Å; I367-Q472 HydrophobicContact CG2-CG 3.97Å; I367-Q472 PolarHBondContact N-O 2.94Å; I367-Q472 VanDerWaalsContact N-O 3.12Å
368	T	96.9	Very high	97.7	Very high	8 Å²	8	6.6 Å²	6.6	5%	0.049	5%	0.045	C	C	.	.	S	Bend	trans	-131.6	141.7	173	60.5	0	0	0	0	111	Q287 V366 G370 M372 Q471 Q472	Q287-T368 VanDerWaalsContact CD-CG2 3.41Å; Q287-T368 HydrophobicContact CG-CG2 4.26Å; V366-T368 WeakPolarHBondContact CG1-O 3.33Å; T368-G370 PolarHBondContact O-N 3.12Å; T368-M372 VanDerWaalsContact O-CE 3.22Å; T368-M372 WeakPolarHBondContact O-CE 3.33Å; T368-Q471 VanDerWaalsContact OG1-CA 3.25Å; T368-Q471 WeakPolarHBondContact OG1-CA 3.47Å; T368-Q471 PolarHBondContact OG1-OE1 3.11Å; T368-Q472 HydrophobicContact CG2-CB 4.11Å; T368-Q472 PolarHBondContact N-O 2.96Å; T368-Q472 PolarHBondContact OG1-N 2.94Å; T368-Q472 PolarHBondContact OG1-O 3.46Å
369	S	94.3	Very high	97.6	Very high	13 Å²	13	12.3 Å²	12.3	9%	0.091	6%	0.06	C	C	.	.			trans	-88.9	12.4	-174.6	56.1	0	0	0	0	115.8	P153 C403 W421 E423	P153-S369 WeakPolarHBondContact CB-OG 3.47Å; S369-C403 PolarHBondContact O-SG 3.4Å; S369-W421 PolarHBondContact O-NE1 3.5Å; S369-W421 VanDerWaalsContact O-NE1 3.08Å; S369-E423 VanDerWaalsContact CB-OE1 3.27Å; S369-E423 WeakPolarHBondContact CB-OE1 3.33Å; S369-E423 PolarHBondContact N-OE1 3.23Å; S369-E423 PolarHBondContact OG-OE1 3.29Å
370	G	93.7	Very high	97.3	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	-83	-165.5	178	0	0	0	0	0	113.9	T368 M372 C403 W421 Q471	T368-G370 PolarHBondContact O-N 3.12Å; G370-M372 PolarHBondContact O-N 3.42Å; G370-C403 VanDerWaalsContact O-CB 3.26Å; G370-C403 WeakPolarHBondContact O-CB 3.44Å; G370-W421 VanDerWaalsContact O-CZ2 3.31Å; G370-W421 WeakPolarHBondContact O-CZ2 3.42Å; G370-W421 PolarHBondContact O-NE1 2.86Å; G370-Q471 VanDerWaalsContact CA-CD 3.46Å
371	V	94.4	Very high	97	Very high	9 Å²	9	15.4 Å²	15.4	6%	0.055	8%	0.078	C	C	.	.			trans	-76.8	115.2	-169.3	-179.4	0	0	0	0	112	L154 C403 R404 M468 Q471	L154-V371 HydrophobicContact CD2-CG2 4.02Å; V371-C403 HydrophobicContact CG2-CB 4.28Å; V371-R404 HydrophobicContact CG2-CG 4.3Å; V371-M468 HydrophobicContact CB-CB 4.01Å; V371-M468 HydrophobicContact CB-SD 3.92Å; V371-M468 HydrophobicContact CG1-CB 4.46Å; V371-M468 HydrophobicContact CG2-SD 4.15Å; V371-M468 WeakPolarHBondContact O-CB 3.28Å; V371-M468 PolarHBondContact O-N 2.88Å; V371-M468 VanDerWaalsContact O-N 3.1Å; V371-Q471 WeakPolarHBondContact O-CG 3.31Å
372	M	97	Very high	96.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148.8	169.3	-63	173	-76.4	0	0	108.4	V366 T368 G370 I374 D401 W421 S466 F467 Q471 C473	V366-M372 HydrophobicContact CG1-CE 4.33Å; T368-M372 VanDerWaalsContact O-CE 3.22Å; T368-M372 WeakPolarHBondContact O-CE 3.33Å; G370-M372 PolarHBondContact O-N 3.42Å; M372-I374 HydrophobicContact CB-CD1 4.3Å; M372-I374 HydrophobicContact CB-CG1 4.16Å; M372-D401 WeakPolarHBondContact O-CA 3.38Å; M372-W421 HydrophobicContact CB-CH2 3.8Å; M372-W421 HydrophobicContact CB-CZ2 3.94Å; M372-W421 HydrophobicContact CE-CH2 4.02Å; M372-W421 HydrophobicContact CE-CZ2 3.69Å; M372-W421 WeakPolarHBondContact O-CH2 3.43Å; M372-S466 CarbonylContact C-O 3.57Å; M372-S466 VanDerWaalsContact CA-O 3.3Å; M372-S466 WeakPolarHBondContact CA-O 3.14Å; M372-F467 HydrophobicContact CG-CD1 3.78Å; M372-F467 HydrophobicContact CG-CE1 4.32Å; M372-F467 HydrophobicContact CG-CG 4.46Å; M372-F467 HydrophobicContact SD-CD1 3.58Å; M372-F467 VanDerWaalsContact SD-CD1 3.58Å; M372-F467 HydrophobicContact SD-CE1 3.64Å; M372-Q471 HydrophobicContact CG-CB 3.54Å; M372-Q471 HydrophobicContact CG-CG 4.05Å; M372-Q471 HydrophobicContact SD-CB 3.84Å; M372-C473 HydrophobicContact CE-CB 4.47Å; M372-C473 HydrophobicContact SD-CB 4.08Å
373	Q	97.8	Very high	95.8	Very high	3 Å²	3	24.4 Å²	24.4	1%	0.014	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	114.9	171.9	-77.5	173.3	-17.7	0	0	107.7	F346 I391 A399 D401 W408 A465 S466	F346-Q373 HydrophobicContact CZ-CB 4.13Å; F346-Q373 HydrophobicContact CZ-CG 4.01Å; F346-Q373 VanDerWaalsContact CZ-OE1 3.27Å; Q373-I391 PolarHBondContact OE1-O 3.37Å; Q373-A399 HydrophobicContact CB-CB 3.72Å; Q373-A399 HydrophobicContact CG-CB 4.33Å; Q373-D401 HydrophobicContact CG-CB 4.42Å; Q373-W408 HydrophobicContact CG-CG 4.27Å; Q373-W408 VanDerWaalsContact NE2-CE2 3.31Å; Q373-A465 CarbonylContact O-C 3.58Å; Q373-A465 VanDerWaalsContact O-CA 3.23Å; Q373-A465 WeakPolarHBondContact O-CA 3.43Å; Q373-S466 PolarHBondContact N-O 3.39Å; Q373-S466 PolarHBondContact O-N 3.32Å
374	I	98.8	Very high	95.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.2	-173.2	-50.8	178.1	0	0	0	108.6	V364 M372 A399 Y400 W421 F429 A465 F475	V364-I374 HydrophobicContact CG1-CD1 4.06Å; V364-I374 HydrophobicContact CG2-CG2 4.1Å; M372-I374 HydrophobicContact CB-CD1 4.3Å; M372-I374 HydrophobicContact CB-CG1 4.16Å; I374-A399 WeakPolarHBondContact O-CA 3.4Å; I374-Y400 PolarHBondContact N-O 3.13Å; I374-Y400 PolarHBondContact O-N 3.09Å; I374-W421 HydrophobicContact CD1-CH2 4.24Å; I374-W421 HydrophobicContact CD1-CZ3 4.23Å; I374-F429 HydrophobicContact CB-CE1 4.11Å; I374-F429 HydrophobicContact CB-CZ 3.69Å; I374-F429 HydrophobicContact CG2-CE1 3.87Å; I374-F429 HydrophobicContact CG2-CE2 3.79Å; I374-F429 HydrophobicContact CG2-CZ 3.32Å; I374-F429 WeakPolarHBondContact O-CE1 3.19Å; I374-A465 HydrophobicContact CB-CB 4.38Å; I374-A465 HydrophobicContact CG1-CB 4Å; I374-A465 HydrophobicContact CG2-CB 4.22Å; I374-F475 HydrophobicContact CG2-CE1 4.27Å
375	G	98.5	Very high	94.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-134.9	179.1	0	0	0	0	0	113	Y362 C398 A464	Y362-G375 PolarHBondContact OH-O 3.1Å; G375-C398 WeakPolarHBondContact CA-O 3.35Å; G375-A464 PolarHBondContact N-O 3.42Å; G375-A464 PolarHBondContact O-N 2.89Å
376	W	98.6	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.2	-172.2	-60.8	95.4	0	0	0	110.7	W360 Y362 S397 C398 F429 L431 M438 F461 F462 F493	W360-W376 HydrophobicContact CB-CH2 4.1Å; Y362-W376 AromaticContact CD1-CH2 3.81Å; Y362-W376 HydrophobicContact CD1-CH2 3.81Å; Y362-W376 AromaticContact CD1-CZ2 3.66Å; Y362-W376 HydrophobicContact CD1-CZ2 3.66Å; Y362-W376 HydrophobicContact CE1-CD2 4.25Å; Y362-W376 AromaticContact CE1-CE2 3.69Å; Y362-W376 AromaticContact CE1-CH2 3.83Å; Y362-W376 HydrophobicContact CE1-CH2 3.83Å; Y362-W376 AromaticContact CE1-CZ2 3.45Å; Y362-W376 HydrophobicContact CE1-CZ2 3.45Å; Y362-W376 VanDerWaalsContact CE1-CZ2 3.45Å; Y362-W376 HydrophobicContact CE1-CZ3 4.34Å; W376-S397 CarbonylContact O-C 3.48Å; W376-S397 WeakPolarHBondContact O-CA 3.49Å; W376-S397 WeakPolarHBondContact O-CB 3.26Å; W376-C398 PolarHBondContact N-O 3.35Å; W376-C398 PolarHBondContact O-N 3.38Å; W376-F429 HydrophobicContact CZ2-CB 4.37Å; W376-L431 HydrophobicContact CD2-CB 4.02Å; W376-L431 HydrophobicContact CD2-CD2 4.04Å; W376-L431 HydrophobicContact CD2-CG 4.5Å; W376-L431 HydrophobicContact CE3-CB 4.34Å; W376-L431 HydrophobicContact CE3-CD2 3.73Å; W376-L431 HydrophobicContact CH2-CB 3.71Å; W376-L431 HydrophobicContact CH2-CD2 4.11Å; W376-L431 HydrophobicContact CZ2-CB 3.37Å; W376-L431 HydrophobicContact CZ2-CD2 4.44Å; W376-L431 HydrophobicContact CZ3-CB 4.18Å; W376-L431 HydrophobicContact CZ3-CD2 3.73Å; W376-M438 HydrophobicContact CB-CE 3.5Å; W376-M438 VanDerWaalsContact CB-CE 3.5Å; W376-M438 HydrophobicContact CB-SD 3.93Å; W376-M438 HydrophobicContact CG-CE 3.94Å; W376-M438 HydrophobicContact CG-SD 4.07Å; W376-F461 HydrophobicContact CB-CD1 3.96Å; W376-F461 HydrophobicContact CE3-CB 4Å; W376-F462 WeakPolarHBondContact CA-O 3.43Å; W376-F493 AromaticContact CH2-CE2 3.83Å; W376-F493 HydrophobicContact CH2-CE2 3.83Å; W376-F493 AromaticContact CH2-CZ 3.54Å; W376-F493 HydrophobicContact CH2-CZ 3.54Å; W376-F493 HydrophobicContact CZ3-CE1 4.43Å; W376-F493 HydrophobicContact CZ3-CE2 4.29Å; W376-F493 AromaticContact CZ3-CZ 3.52Å; W376-F493 HydrophobicContact CZ3-CZ 3.52Å
377	A	98.2	Very high	92.9	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.5	175.8	0	0	0	0	0	110.6	I391 F462 A464	A377-I391 HydrophobicContact CB-CD1 4.09Å; A377-I391 HydrophobicContact CB-CG2 4.34Å; A377-F462 PolarHBondContact N-O 3.11Å; A377-F462 PolarHBondContact O-N 3.45Å; A377-A464 HydrophobicContact CB-CB 3.75Å
378	T	97.8	Very high	92.1	Very high	4 Å²	4	39.3 Å²	39.3	3%	0.025	20%	0.195	C	C	.	.			trans	-89.1	-179.3	167.5	78.8	0	0	0	0	111.2	R350 D380 S381 Y396 A457 G460 F461	R350-T378 PolarHBondContact NH1-O 3.3Å; T378-D380 PolarHBondContact O-N 2.97Å; T378-D380 PolarHBondContact OG1-N 2.63Å; T378-D380 VanDerWaalsContact OG1-N 3.09Å; T378-S381 WeakPolarHBondContact O-CB 3.49Å; T378-S381 PolarHBondContact O-N 3.11Å; T378-Y396 PolarHBondContact N-O 3.04Å; T378-Y396 VanDerWaalsContact N-O 3.12Å; T378-Y396 WeakPolarHBondContact OG1-CB 3.5Å; T378-A457 HydrophobicContact CG2-CB 3.59Å; T378-G460 WeakPolarHBondContact CA-O 3.27Å; T378-G460 WeakPolarHBondContact CB-O 3.38Å; T378-F461 HydrophobicContact CG2-CD1 3.85Å; T378-F461 HydrophobicContact CG2-CE1 3.79Å; T378-F461 HydrophobicContact CG2-CG 4.36Å; T378-F461 HydrophobicContact CG2-CZ 4.26Å
379	K	94.6	Very high	91.6	Very high	151 Å²	151	42.8 Å²	42.8	66%	0.657	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.5	170.1	-72.6	-171.5	177.2	-177.6	0	113.5	S381 F462	K379-S381 PolarHBondContact O-N 3.34Å; K379-F462 HydrophobicContact CD-CE2 4.44Å; K379-F462 HydrophobicContact CD-CZ 4.45Å; K379-F462 HydrophobicContact CG-CE2 3.7Å; K379-F462 HydrophobicContact CG-CZ 4.13Å
380	D	93.7	Very high	91.5	Very high	104 Å²	104	42.2 Å²	42.2	56%	0.556	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.2	178.8	-58	-47.2	0	0	0	111.7	T378 Y396	T378-D380 PolarHBondContact O-N 2.97Å; T378-D380 PolarHBondContact OG1-N 2.63Å; T378-D380 VanDerWaalsContact OG1-N 3.09Å; D380-Y396 HydrophobicContact CB-CD1 4.11Å; D380-Y396 HydrophobicContact CB-CD2 3.66Å; D380-Y396 HydrophobicContact CB-CE1 4.34Å; D380-Y396 HydrophobicContact CB-CE2 3.89Å; D380-Y396 HydrophobicContact CB-CG 3.77Å
381	S	92.3	Very high	91.6	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.028	20%	0.204	C	C	.	.			trans	-64.7	134.1	171.4	-71.2	0	0	0	0	112	R350 T378 K379 D394 Y396 S397	R350-S381 PolarHBondContact NH1-O 2.89Å; T378-S381 WeakPolarHBondContact O-CB 3.49Å; T378-S381 PolarHBondContact O-N 3.11Å; K379-S381 PolarHBondContact O-N 3.34Å; S381-D394 WeakPolarHBondContact CA-OD2 3.4Å; S381-D394 WeakPolarHBondContact CB-OD2 3.27Å; S381-D394 PolarHBondContact OG-OD1 3.5Å; S381-D394 PolarHBondContact OG-OD2 3.46Å; S381-Y396 VanDerWaalsContact OG-CB 3.32Å; S381-Y396 WeakPolarHBondContact OG-CB 3.36Å; S381-Y396 PolarHBondContact OG-O 2.87Å; S381-S397 WeakPolarHBondContact OG-CB 3.18Å
382	K	85.6	Confident	91.6	Very high	152 Å²	152	41.8 Å²	41.8	66%	0.661	20%	0.201	S	C	*	.			trans	-106.6	131.5	-176.1	-64.8	-177.6	-178.1	177.6	0	110.3	D394	K382-D394 PolarHBondContact N-OD2 3.49Å
383	F	85.6	Confident	91.4	Very high	37 Å²	37	43 Å²	43	16%	0.162	21%	0.208	C	C	.	.			trans	-100.2	111.9	174.8	-52.2	-28	0	0	0	108.8	S348 R350 I391	S348-F383 VanDerWaalsContact CB-CG 3.5Å; R350-F383 HydrophobicContact CG-CE2 4.33Å; R350-F383 HydrophobicContact CG-CZ 3.87Å; R350-F383 VanDerWaalsContact CZ-CE2 3.44Å; F383-I391 HydrophobicContact CD1-CD1 3.99Å; F383-I391 HydrophobicContact CE1-CD1 3.2Å; F383-I391 HydrophobicContact CZ-CD1 3.69Å
384	L	85.1	Confident	91.3	Very high	70 Å²	70	44 Å²	44	37%	0.366	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-115.7	69.9	174.9	-52.4	171.2	0	0	0	107.5	H386 E387 G388 Y389	L384-H386 VanDerWaalsContact C-N 3.25Å; L384-H386 PolarHBondContact O-N 2.75Å; L384-E387 HydrophobicContact CB-CB 3.99Å; L384-E387 HydrophobicContact CB-CG 4.3Å; L384-E387 CarbonylContact O-C 3.48Å; L384-E387 WeakPolarHBondContact O-CA 3.43Å; L384-E387 PolarHBondContact O-N 2.99Å; L384-G388 PolarHBondContact O-N 3.47Å; L384-G388 VanDerWaalsContact O-N 3.13Å; L384-Y389 CarbonylContact C-O 3.57Å; L384-Y389 HydrophobicContact CB-CD2 4.13Å; L384-Y389 HydrophobicContact CD1-CD2 3.94Å; L384-Y389 PolarHBondContact N-O 3.28Å; L384-Y389 VanDerWaalsContact N-O 3.1Å; L384-Y389 PolarHBondContact O-N 3.05Å; L384-Y389 VanDerWaalsContact O-N 3.09Å
385	N	83.4	Confident	91.1	Very high	21 Å²	21	47.7 Å²	47.7	11%	0.112	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-53.7	-38	-173.9	62.3	-36.1	0	0	0	113.5	F346 E347 E387 G388	F346-N385 PolarHBondContact N-O 2.7Å; F346-N385 WeakPolarHBondContact O-CA 3.31Å; F346-N385 VanDerWaalsContact O-CB 3.26Å; F346-N385 WeakPolarHBondContact O-CB 3.49Å; E347-N385 PolarHBondContact OE1-ND2 2.78Å; N385-E387 VanDerWaalsContact C-N 3.32Å; N385-G388 PolarHBondContact O-N 3.2Å
386	H	84.4	Confident	91.1	Very high	113 Å²	113	51 Å²	51	52%	0.523	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-75.8	-17.4	177.6	-65.9	-68.9	0	0	0	113.8	E328 L384	E328-H386 IonicContact OE1-CE1 3.33Å; E328-H386 IonicContact OE1-NE2 3.37Å; E328-H386 PolarHBondContact OE1-NE2 2.96Å; L384-H386 VanDerWaalsContact C-N 3.25Å; L384-H386 PolarHBondContact O-N 2.75Å
387	E	82.2	Confident	91	Very high	110 Å²	110	51 Å²	51	51%	0.514	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-98	1.9	174.1	-61.7	-179.1	-154.9	0	0	111.6	N116 L384 N385 Y389	N116-E387 PolarHBondContact ND2-O 2.8Å; N116-E387 VanDerWaalsContact ND2-O 3.11Å; L384-E387 HydrophobicContact CB-CB 3.99Å; L384-E387 HydrophobicContact CB-CG 4.3Å; L384-E387 CarbonylContact O-C 3.48Å; L384-E387 WeakPolarHBondContact O-CA 3.43Å; L384-E387 PolarHBondContact O-N 2.99Å; N385-E387 VanDerWaalsContact C-N 3.32Å; E387-Y389 VanDerWaalsContact C-N 3.27Å; E387-Y389 HydrophobicContact CB-CD2 3.67Å; E387-Y389 HydrophobicContact CB-CE2 4.01Å; E387-Y389 PolarHBondContact O-N 3.11Å
388	G	82.1	Confident	91	Very high	27 Å²	27	51.1 Å²	51.1	28%	0.278	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	10.4	-178.6	0	0	0	0	0	114.5	F346 L384 N385	F346-G388 WeakPolarHBondContact CD1-O 3.32Å; L384-G388 PolarHBondContact O-N 3.47Å; L384-G388 VanDerWaalsContact O-N 3.13Å; N385-G388 PolarHBondContact O-N 3.2Å
389	Y	86.4	Confident	91	Very high	81 Å²	81	50.9 Å²	50.9	32%	0.318	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-91.3	123.1	178.7	-62.7	-61.1	0	0	0	112	L384 E387 D393	L384-Y389 CarbonylContact C-O 3.57Å; L384-Y389 HydrophobicContact CB-CD2 4.13Å; L384-Y389 HydrophobicContact CD1-CD2 3.94Å; L384-Y389 PolarHBondContact N-O 3.28Å; L384-Y389 VanDerWaalsContact N-O 3.1Å; L384-Y389 PolarHBondContact O-N 3.05Å; L384-Y389 VanDerWaalsContact O-N 3.09Å; E387-Y389 VanDerWaalsContact C-N 3.27Å; E387-Y389 HydrophobicContact CB-CD2 3.67Å; E387-Y389 HydrophobicContact CB-CE2 4.01Å; E387-Y389 PolarHBondContact O-N 3.11Å; Y389-D393 HydrophobicContact CD1-CB 3.75Å; Y389-D393 HydrophobicContact CG-CB 4.45Å
390	G	91.4	Very high	91.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.01	21%	0.212	C	C	.	.			trans	-131.6	-148	179	0	0	0	0	0	113.3	G392 D393 S466	G390-G392 PolarHBondContact O-N 3Å; G390-D393 PolarHBondContact N-OD2 3.43Å; G390-D393 PolarHBondContact O-N 2.92Å; G390-S466 WeakPolarHBondContact CA-OG 3.43Å
391	I	95.4	Very high	91.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	126	-178.3	-48.6	-45	0	0	0	110.1	Q373 A377 F383 A399 A464 S466	Q373-I391 PolarHBondContact OE1-O 3.37Å; A377-I391 HydrophobicContact CB-CD1 4.09Å; A377-I391 HydrophobicContact CB-CG2 4.34Å; F383-I391 HydrophobicContact CD1-CD1 3.99Å; F383-I391 HydrophobicContact CE1-CD1 3.2Å; F383-I391 HydrophobicContact CZ-CD1 3.69Å; I391-A399 HydrophobicContact CB-CB 4.14Å; I391-A399 HydrophobicContact CG2-CB 3.93Å; I391-A399 WeakPolarHBondContact O-CB 3.48Å; I391-A464 HydrophobicContact CD1-CB 3.68Å; I391-A464 HydrophobicContact CG1-CB 3.78Å; I391-A464 HydrophobicContact CG2-CB 4.34Å; I391-S466 WeakPolarHBondContact CG1-OG 3.1Å; I391-S466 PolarHBondContact N-OG 3.03Å
392	G	94.9	Very high	91.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-3.9	-176.6	0	0	0	0	0	113.5	G390 S397 Y409 N410 A411	G390-G392 PolarHBondContact O-N 3Å; G392-S397 WeakPolarHBondContact CA-OG 3.35Å; G392-S397 PolarHBondContact N-OG 3.21Å; G392-Y409 CarbonylContact O-C 3.53Å; G392-Y409 WeakPolarHBondContact O-CA 3.32Å; G392-Y409 PolarHBondContact O-N 3.21Å; G392-Y409 VanDerWaalsContact O-N 3.15Å; G392-N410 PolarHBondContact O-N 3.11Å; G392-A411 PolarHBondContact O-N 3.34Å
393	D	93.6	Very high	92.1	Very high	25 Å²	25	31.3 Å²	31.3	13%	0.134	15%	0.152	C	C	.	.	S	Bend	trans	-94.9	8.5	178.6	-59.1	-35.9	0	0	0	113.7	Y389 G390 A411	Y389-D393 HydrophobicContact CD1-CB 3.75Å; Y389-D393 HydrophobicContact CG-CB 4.45Å; G390-D393 PolarHBondContact N-OD2 3.43Å; G390-D393 PolarHBondContact O-N 2.92Å; D393-A411 HydrophobicContact CB-CB 4.5Å
394	D	94.4	Very high	92.5	Very high	25 Å²	25	31.6 Å²	31.6	13%	0.134	15%	0.152	C	C	.	.	S	Bend	trans	-134.7	175.7	171.5	62.9	39.6	0	0	0	111.8	S381 K382 Y396 S397 N410	S381-D394 WeakPolarHBondContact CA-OD2 3.4Å; S381-D394 WeakPolarHBondContact CB-OD2 3.27Å; S381-D394 PolarHBondContact OG-OD1 3.5Å; S381-D394 PolarHBondContact OG-OD2 3.46Å; K382-D394 PolarHBondContact N-OD2 3.49Å; D394-Y396 PolarHBondContact O-N 2.97Å; D394-Y396 WeakPolarHBondContact OD1-CA 3.37Å; D394-Y396 PolarHBondContact OD1-N 3.21Å; D394-S397 WeakPolarHBondContact OD1-CB 3.35Å; D394-S397 PolarHBondContact OD1-N 2.76Å; D394-S397 PolarHBondContact OD1-OG 3.35Å; D394-N410 VanDerWaalsContact O-CA 3.27Å; D394-N410 WeakPolarHBondContact O-CA 3.17Å; D394-N410 PolarHBondContact O-N 2.91Å
395	E	95.8	Very high	93.1	Very high	76 Å²	76	31.5 Å²	31.5	36%	0.355	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.2	-179.7	64.7	-179.5	165	0	0	114	S456	E395-S456 WeakPolarHBondContact O-CB 3.45Å; E395-S456 PolarHBondContact OE2-OG 3.43Å
396	Y	97.3	Very high	93.7	Very high	69 Å²	69	31.4 Å²	31.4	27%	0.271	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	4.5	-173.7	-56.2	-62.8	0	0	0	113.2	T378 D380 S381 D394 A457	T378-Y396 PolarHBondContact N-O 3.04Å; T378-Y396 VanDerWaalsContact N-O 3.12Å; T378-Y396 WeakPolarHBondContact OG1-CB 3.5Å; D380-Y396 HydrophobicContact CB-CD1 4.11Å; D380-Y396 HydrophobicContact CB-CD2 3.66Å; D380-Y396 HydrophobicContact CB-CE1 4.34Å; D380-Y396 HydrophobicContact CB-CE2 3.89Å; D380-Y396 HydrophobicContact CB-CG 3.77Å; S381-Y396 VanDerWaalsContact OG-CB 3.32Å; S381-Y396 WeakPolarHBondContact OG-CB 3.36Å; S381-Y396 PolarHBondContact OG-O 2.87Å; D394-Y396 PolarHBondContact O-N 2.97Å; D394-Y396 WeakPolarHBondContact OD1-CA 3.37Å; D394-Y396 PolarHBondContact OD1-N 3.21Å; Y396-A457 HydrophobicContact CD1-CB 4.45Å
397	S	97.6	Very high	94.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156	-179	57.4	0	0	0	0	113	W376 S381 G392 D394 Y409	W376-S397 CarbonylContact O-C 3.48Å; W376-S397 WeakPolarHBondContact O-CA 3.49Å; W376-S397 WeakPolarHBondContact O-CB 3.26Å; S381-S397 WeakPolarHBondContact OG-CB 3.18Å; G392-S397 WeakPolarHBondContact CA-OG 3.35Å; G392-S397 PolarHBondContact N-OG 3.21Å; D394-S397 WeakPolarHBondContact OD1-CB 3.35Å; D394-S397 PolarHBondContact OD1-N 2.76Å; D394-S397 PolarHBondContact OD1-OG 3.35Å; S397-Y409 WeakPolarHBondContact O-CD2 3.36Å
398	C	98.2	Very high	95.1	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.02	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	134.4	173.4	-176.8	0	0	0	0	109.8	G375 W376 W408 M438 V453	G375-C398 WeakPolarHBondContact CA-O 3.35Å; W376-C398 PolarHBondContact N-O 3.35Å; W376-C398 PolarHBondContact O-N 3.38Å; C398-W408 WeakPolarHBondContact CA-O 3.27Å; C398-W408 PolarHBondContact SG-O 3.44Å; C398-W408 VanDerWaalsContact SG-O 3.35Å; C398-M438 HydrophobicContact CB-SD 3.89Å; C398-V453 HydrophobicContact CB-CB 4.35Å; C398-V453 HydrophobicContact CB-CG1 4.5Å
399	A	98.3	Very high	95.7	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.4	-175.6	0	0	0	0	0	113.9	Q373 I374 I391 I407 W408	Q373-A399 HydrophobicContact CB-CB 3.72Å; Q373-A399 HydrophobicContact CG-CB 4.33Å; I374-A399 WeakPolarHBondContact O-CA 3.4Å; I391-A399 HydrophobicContact CB-CB 4.14Å; I391-A399 HydrophobicContact CG2-CB 3.93Å; I391-A399 WeakPolarHBondContact O-CB 3.48Å; A399-I407 CarbonylContact O-C 3.54Å; A399-I407 WeakPolarHBondContact O-CA 2.98Å; A399-W408 HydrophobicContact CB-CB 4.28Å; A399-W408 PolarHBondContact N-O 3.47Å; A399-W408 PolarHBondContact O-N 3.21Å
400	Y	98.7	Very high	96.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.8	167.1	177.3	-87.5	0	0	0	109.7	I374 G402 I407 H416 H418 W421 I427 F440 L447	I374-Y400 PolarHBondContact N-O 3.13Å; I374-Y400 PolarHBondContact O-N 3.09Å; Y400-G402 VanDerWaalsContact CE1-CA 3.47Å; Y400-I407 HydrophobicContact CD2-CD1 3.71Å; Y400-I407 HydrophobicContact CG-CD1 4.42Å; Y400-H416 AromaticContact CD2-NE2 3.85Å; Y400-H416 AromaticContact CE2-CD2 3.7Å; Y400-H416 AromaticContact CE2-CE1 3.76Å; Y400-H416 AromaticContact CE2-NE2 3.24Å; Y400-H416 WeakPolarHBondContact CE2-NE2 3.31Å; Y400-H416 AromaticContact CZ-CE1 3.87Å; Y400-H416 AromaticContact CZ-NE2 3.54Å; Y400-H418 AromaticContact CE2-ND1 3.75Å; Y400-H418 AromaticContact CZ-ND1 3.97Å; Y400-H418 PolarHBondContact OH-ND1 3.27Å; Y400-W421 HydrophobicContact CD1-CE3 4.39Å; Y400-W421 AromaticContact CD1-CZ3 3.96Å; Y400-W421 HydrophobicContact CD1-CZ3 3.96Å; Y400-W421 AromaticContact CE1-CE3 3.87Å; Y400-W421 HydrophobicContact CE1-CE3 3.87Å; Y400-W421 AromaticContact CE1-CZ3 3.91Å; Y400-W421 HydrophobicContact CE1-CZ3 3.91Å; Y400-I427 HydrophobicContact CD1-CG2 3.97Å; Y400-I427 HydrophobicContact CE1-CD1 4Å; Y400-I427 HydrophobicContact CE1-CG1 4.37Å; Y400-I427 HydrophobicContact CE1-CG2 4.09Å; Y400-I427 HydrophobicContact CG-CG2 4.45Å; Y400-F440 HydrophobicContact CD2-CB 3.81Å; Y400-F440 HydrophobicContact CD2-CD2 4.44Å; Y400-F440 HydrophobicContact CD2-CG 4.08Å; Y400-F440 HydrophobicContact CE2-CB 4.46Å; Y400-F440 HydrophobicContact CG-CB 4.42Å; Y400-F440 HydrophobicContact CG-CG 4.43Å; Y400-L447 HydrophobicContact CD2-CD1 4.1Å; Y400-L447 HydrophobicContact CE2-CD1 3.79Å
401	D	97.8	Very high	96.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	100.3	174	-179.7	-25	0	0	0	109.8	M372 Q373 C403 R404 Q405 L406 W408 H416	M372-D401 WeakPolarHBondContact O-CA 3.38Å; Q373-D401 HydrophobicContact CG-CB 4.42Å; D401-C403 VanDerWaalsContact C-N 3.32Å; D401-C403 PolarHBondContact O-N 3.34Å; D401-C403 PolarHBondContact OD1-N 2.95Å; D401-R404 PolarHBondContact OD1-N 3.48Å; D401-R404 IonicContact OD2-CZ 3.98Å; D401-R404 IonicContact OD2-NE 3.23Å; D401-R404 PolarHBondContact OD2-NE 2.93Å; D401-R404 IonicContact OD2-NH2 3.19Å; D401-R404 PolarHBondContact OD2-NH2 3.44Å; D401-Q405 CarbonylContact O-C 3.51Å; D401-Q405 VanDerWaalsContact O-CA 3.22Å; D401-Q405 WeakPolarHBondContact O-CA 3.39Å; D401-Q405 PolarHBondContact O-N 3.11Å; D401-L406 HydrophobicContact CB-CB 4.36Å; D401-L406 PolarHBondContact N-O 3.44Å; D401-L406 PolarHBondContact O-N 3.16Å; D401-W408 PolarHBondContact OD2-NE1 3.19Å; D401-H416 PolarHBondContact O-NE2 3.3Å
402	G	96.9	Very high	95.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-13.5	-177.8	0	0	0	0	0	114.4	Y400 C420 W421	Y400-G402 VanDerWaalsContact CE1-CA 3.47Å; G402-C420 VanDerWaalsContact O-CA 3.28Å; G402-C420 WeakPolarHBondContact O-CA 3.34Å; G402-W421 VanDerWaalsContact CA-CD2 3.45Å; G402-W421 PolarHBondContact O-N 3.07Å
403	C	94.8	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-46.6	178.9	-172	0	0	0	0	111.1	R111 S369 G370 V371 D401 W421	R111-C403 WeakPolarHBondContact CD-O 3.23Å; R111-C403 PolarHBondContact NE-O 2.96Å; S369-C403 PolarHBondContact O-SG 3.4Å; G370-C403 VanDerWaalsContact O-CB 3.26Å; G370-C403 WeakPolarHBondContact O-CB 3.44Å; V371-C403 HydrophobicContact CG2-CB 4.28Å; D401-C403 VanDerWaalsContact C-N 3.32Å; D401-C403 PolarHBondContact O-N 3.34Å; D401-C403 PolarHBondContact OD1-N 2.95Å; C403-W421 HydrophobicContact CB-CZ2 4.28Å
404	R	94.3	Very high	96	Very high	42 Å²	42	36.5 Å²	36.5	16%	0.158	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.4	178.2	-63.2	-177.6	-72.8	-176.8	0.2	112.3	R111 L113 V371 D401 L406 W408	R111-R404 HydrophobicContact CG-CG 3.99Å; R111-R404 WeakPolarHBondContact O-CD 3.26Å; R111-R404 WeakPolarHBondContact O-CG 3.37Å; L113-R404 PolarHBondContact O-NH1 2.95Å; V371-R404 HydrophobicContact CG2-CG 4.3Å; D401-R404 PolarHBondContact OD1-N 3.48Å; D401-R404 IonicContact OD2-CZ 3.98Å; D401-R404 IonicContact OD2-NE 3.23Å; D401-R404 PolarHBondContact OD2-NE 2.93Å; D401-R404 IonicContact OD2-NH2 3.19Å; D401-R404 PolarHBondContact OD2-NH2 3.44Å; R404-L406 HydrophobicContact CB-CD1 3.71Å; R404-L406 HydrophobicContact CB-CG 3.88Å; R404-W408 VanDerWaalsContact CZ-CZ2 3.44Å; R404-W408 VanDerWaalsContact NH2-CZ2 3.32Å
405	Q	96.6	Very high	96.1	Very high	69 Å²	69	40.6 Å²	40.6	32%	0.322	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	45.9	-178.2	-56.9	170.6	-99.5	0	0	112.4	D401 P415 H416 H418 C420	D401-Q405 CarbonylContact O-C 3.51Å; D401-Q405 VanDerWaalsContact O-CA 3.22Å; D401-Q405 WeakPolarHBondContact O-CA 3.39Å; D401-Q405 PolarHBondContact O-N 3.11Å; Q405-P415 WeakPolarHBondContact O-CA 3.31Å; Q405-H416 VanDerWaalsContact C-NE2 3.26Å; Q405-H416 WeakPolarHBondContact CA-CE1 3.39Å; Q405-H416 VanDerWaalsContact CA-NE2 3.33Å; Q405-H416 WeakPolarHBondContact CA-NE2 3.49Å; Q405-H416 PolarHBondContact O-N 2.9Å; Q405-H418 PolarHBondContact NE2-O 3.15Å; Q405-C420 HydrophobicContact CG-CB 4.31Å
406	L	96.8	Very high	96.2	Very high	19 Å²	19	38.1 Å²	38.1	10%	0.099	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.9	-172.9	-62.9	176.1	0	0	0	111.8	V114 D401 R404 W408 K414 P415 H416	V114-L406 HydrophobicContact CB-CD1 4.49Å; V114-L406 HydrophobicContact CG1-CD1 3.84Å; V114-L406 HydrophobicContact CG2-CD1 3.7Å; D401-L406 HydrophobicContact CB-CB 4.36Å; D401-L406 PolarHBondContact N-O 3.44Å; D401-L406 PolarHBondContact O-N 3.16Å; R404-L406 HydrophobicContact CB-CD1 3.71Å; R404-L406 HydrophobicContact CB-CG 3.88Å; L406-W408 HydrophobicContact CD1-CZ2 3.65Å; L406-K414 CarbonylContact C-O 3.53Å; L406-K414 WeakPolarHBondContact CA-O 3.08Å; L406-P415 HydrophobicContact CD2-CB 4.46Å; L406-H416 PolarHBondContact N-CD2 3.05Å; L406-H416 PolarHBondContact N-NE2 2.95Å; L406-H416 PolarHBondContact O-CD2 3.38Å
407	I	98.1	Very high	96.2	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129	161.6	-58.4	-57.7	0	0	0	108.1	A399 Y400 S413 K414 H416 F440 L447 E450	A399-I407 CarbonylContact O-C 3.54Å; A399-I407 WeakPolarHBondContact O-CA 2.98Å; Y400-I407 HydrophobicContact CD2-CD1 3.71Å; Y400-I407 HydrophobicContact CG-CD1 4.42Å; I407-S413 CarbonylContact O-C 3.57Å; I407-S413 WeakPolarHBondContact O-CA 3.49Å; I407-K414 HydrophobicContact CB-CG 4.07Å; I407-K414 PolarHBondContact N-O 3.08Å; I407-K414 PolarHBondContact O-N 3.3Å; I407-H416 HydrophobicContact CG1-CB 4.21Å; I407-F440 HydrophobicContact CD1-CD2 3.63Å; I407-F440 HydrophobicContact CD1-CE2 3.85Å; I407-F440 HydrophobicContact CD1-CG 4.5Å; I407-F440 HydrophobicContact CG2-CE2 4.31Å; I407-L447 HydrophobicContact CD1-CD1 4.17Å; I407-E450 HydrophobicContact CG2-CG 3.94Å
408	W	97.1	Very high	96.2	Very high	8 Å²	8	40.2 Å²	40.2	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134	-176.9	-67.7	91.3	0	0	0	111.6	V114 Q373 C398 A399 D401 R404 L406 R412	V114-W408 HydrophobicContact CB-CH2 4.13Å; V114-W408 HydrophobicContact CB-CZ2 4.42Å; V114-W408 HydrophobicContact CG1-CH2 3.16Å; V114-W408 HydrophobicContact CG1-CZ2 3.55Å; V114-W408 HydrophobicContact CG1-CZ3 4.09Å; V114-W408 VanDerWaalsContact O-CH2 3.26Å; V114-W408 WeakPolarHBondContact O-CH2 3.49Å; Q373-W408 HydrophobicContact CG-CG 4.27Å; Q373-W408 VanDerWaalsContact NE2-CE2 3.31Å; C398-W408 WeakPolarHBondContact CA-O 3.27Å; C398-W408 PolarHBondContact SG-O 3.44Å; C398-W408 VanDerWaalsContact SG-O 3.35Å; A399-W408 HydrophobicContact CB-CB 4.28Å; A399-W408 PolarHBondContact N-O 3.47Å; A399-W408 PolarHBondContact O-N 3.21Å; D401-W408 PolarHBondContact OD2-NE1 3.19Å; R404-W408 VanDerWaalsContact CZ-CZ2 3.44Å; R404-W408 VanDerWaalsContact NH2-CZ2 3.32Å; L406-W408 HydrophobicContact CD1-CZ2 3.65Å; W408-R412 WeakPolarHBondContact CA-O 3.4Å
409	Y	96.1	Very high	96.2	Very high	39 Å²	39	44 Å²	44	15%	0.153	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	132.3	173	169	-111.8	0	0	0	110.1	G392 S397 A411 R412 Q452 V453 S455	G392-Y409 CarbonylContact O-C 3.53Å; G392-Y409 WeakPolarHBondContact O-CA 3.32Å; G392-Y409 PolarHBondContact O-N 3.21Å; G392-Y409 VanDerWaalsContact O-N 3.15Å; S397-Y409 WeakPolarHBondContact O-CD2 3.36Å; Y409-A411 VanDerWaalsContact C-N 3.32Å; Y409-A411 PolarHBondContact O-N 3.36Å; Y409-R412 PolarHBondContact N-O 3.2Å; Y409-R412 PolarHBondContact O-N 3.16Å; Y409-R412 VanDerWaalsContact O-O 3.09Å; Y409-Q452 HydrophobicContact CD1-CB 3.61Å; Y409-Q452 HydrophobicContact CD1-CG 4.41Å; Y409-Q452 HydrophobicContact CE1-CB 3.52Å; Y409-Q452 HydrophobicContact CG-CB 4.21Å; Y409-Q452 PolarHBondContact OH-O 3.12Å; Y409-V453 HydrophobicContact CD2-CB 4.14Å; Y409-V453 VanDerWaalsContact CE2-CA 3.48Å; Y409-V453 HydrophobicContact CE2-CB 3.92Å; Y409-V453 HydrophobicContact CE2-CG2 4.2Å; Y409-S455 PolarHBondContact OH-OG 2.96Å
410	N	94.5	Very high	96.1	Very high	61 Å²	61	45.8 Å²	45.8	33%	0.326	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	47.8	175.8	-167.9	18.3	0	0	0	113	G392 D394 R412	G392-N410 PolarHBondContact O-N 3.11Å; D394-N410 VanDerWaalsContact O-CA 3.27Å; D394-N410 WeakPolarHBondContact O-CA 3.17Å; D394-N410 PolarHBondContact O-N 2.91Å; N410-R412 PolarHBondContact O-N 2.9Å
411	A	91.1	Very high	96	Very high	41 Å²	41	45.9 Å²	45.9	34%	0.339	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	20.8	-177.3	0	0	0	0	0	114.1	G392 D393 Y409	G392-A411 PolarHBondContact O-N 3.34Å; D393-A411 HydrophobicContact CB-CB 4.5Å; Y409-A411 VanDerWaalsContact C-N 3.32Å; Y409-A411 PolarHBondContact O-N 3.36Å
412	R	92.3	Very high	95.9	Very high	183 Å²	183	52.5 Å²	52.5	69%	0.691	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.2	174.8	-61.5	178.7	-152.2	-178.4	5.2	109.3	W408 Y409 N410	W408-R412 WeakPolarHBondContact CA-O 3.4Å; Y409-R412 PolarHBondContact N-O 3.2Å; Y409-R412 PolarHBondContact O-N 3.16Å; Y409-R412 VanDerWaalsContact O-O 3.09Å; N410-R412 PolarHBondContact O-N 2.9Å
413	S	93.8	Very high	95.9	Very high	47 Å²	47	56.7 Å²	56.7	33%	0.329	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.9	177.6	62.7	0	0	0	0	112.6	V114 I407	V114-S413 VanDerWaalsContact CG1-OG 3.28Å; V114-S413 WeakPolarHBondContact CG1-OG 3.28Å; I407-S413 CarbonylContact O-C 3.57Å; I407-S413 WeakPolarHBondContact O-CA 3.49Å
414	K	95	Very high	96.1	Very high	80 Å²	80	57.2 Å²	57.2	35%	0.348	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.3	167	64.8	175	-177.1	173.9	0	110.5	L406 I407 E450	L406-K414 CarbonylContact C-O 3.53Å; L406-K414 WeakPolarHBondContact CA-O 3.08Å; I407-K414 HydrophobicContact CB-CG 4.07Å; I407-K414 PolarHBondContact N-O 3.08Å; I407-K414 PolarHBondContact O-N 3.3Å; K414-E450 WeakPolarHBondContact CE-OE1 3.32Å; K414-E450 WeakPolarHBondContact CE-OE2 3.5Å; K414-E450 IonicContact NZ-OE1 2.95Å; K414-E450 PolarHBondContact NZ-OE1 2.96Å; K414-E450 IonicContact NZ-OE2 2.75Å; K414-E450 PolarHBondContact NZ-OE2 2.89Å
415	P	96.9	Very high	96.3	Very high	110 Å²	110	56.6 Å²	56.6	71%	0.714	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	148.8	177.1	29.1	-34.9	0	0	0	111.8	Q405 L406	Q405-P415 WeakPolarHBondContact O-CA 3.31Å; L406-P415 HydrophobicContact CD2-CB 4.46Å
416	H	97.6	Very high	96.4	Very high	25 Å²	25	53.5 Å²	53.5	12%	0.116	29%	0.287	C	S	.	.			trans	-121.1	166.6	171.9	67.4	54.8	0	0	0	112.3	Y400 D401 Q405 L406 I407 H418 L447	Y400-H416 AromaticContact CD2-NE2 3.85Å; Y400-H416 AromaticContact CE2-CD2 3.7Å; Y400-H416 AromaticContact CE2-CE1 3.76Å; Y400-H416 AromaticContact CE2-NE2 3.24Å; Y400-H416 WeakPolarHBondContact CE2-NE2 3.31Å; Y400-H416 AromaticContact CZ-CE1 3.87Å; Y400-H416 AromaticContact CZ-NE2 3.54Å; D401-H416 PolarHBondContact O-NE2 3.3Å; Q405-H416 VanDerWaalsContact C-NE2 3.26Å; Q405-H416 WeakPolarHBondContact CA-CE1 3.39Å; Q405-H416 VanDerWaalsContact CA-NE2 3.33Å; Q405-H416 WeakPolarHBondContact CA-NE2 3.49Å; Q405-H416 PolarHBondContact O-N 2.9Å; L406-H416 PolarHBondContact N-CD2 3.05Å; L406-H416 PolarHBondContact N-NE2 2.95Å; L406-H416 PolarHBondContact O-CD2 3.38Å; I407-H416 HydrophobicContact CG1-CB 4.21Å; H416-H418 PolarHBondContact ND1-N 3.22Å; H416-L447 HydrophobicContact CB-CD1 3.65Å; H416-L447 HydrophobicContact CB-CD2 4.1Å
417	S	98	Very high	96.5	Very high	101 Å²	101	52.6 Å²	52.6	71%	0.706	28%	0.282	S	S	*	.	S	Bend	trans	-87.9	-12.1	-172.2	55.7	0	0	0	0	115.7	L447	S417-L447 VanDerWaalsContact OG-CD2 3.31Å; S417-L447 WeakPolarHBondContact OG-CD2 3.26Å
418	H	98.4	Very high	96.5	Very high	12 Å²	12	52.4 Å²	52.4	6%	0.056	28%	0.282	C	S	.	.	S	Bend	trans	-61.9	143.5	174.9	-73.7	173.9	0	0	0	111.4	Y400 Q405 H416 L442 N445 L447	Y400-H418 AromaticContact CE2-ND1 3.75Å; Y400-H418 AromaticContact CZ-ND1 3.97Å; Y400-H418 PolarHBondContact OH-ND1 3.27Å; Q405-H418 PolarHBondContact NE2-O 3.15Å; H416-H418 PolarHBondContact ND1-N 3.22Å; H418-L442 HydrophobicContact CB-CB 4.4Å; H418-L442 HydrophobicContact CB-CD2 3.88Å; H418-L442 VanDerWaalsContact CE1-CB 3.46Å; H418-L442 WeakPolarHBondContact CE1-CB 3.33Å; H418-L442 PolarHBondContact CE1-N 3.15Å; H418-L442 WeakPolarHBondContact ND1-CB 3.36Å; H418-N445 PolarHBondContact CE1-O 3.11Å; H418-N445 PolarHBondContact NE2-O 2.91Å; H418-L447 VanDerWaalsContact CD2-CD2 3.48Å; H418-L447 WeakPolarHBondContact CD2-CD2 3.3Å; H418-L447 VanDerWaalsContact CE1-CG 3.45Å; H418-L447 WeakPolarHBondContact CE1-CG 2.88Å
419	P	97.5	Very high	96.6	Very high	83 Å²	83	52 Å²	52	54%	0.539	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-61.5	162	170.2	29	-36.6	0	0	0	111.2	W421 L442	P419-W421 PolarHBondContact O-N 3.16Å; P419-L442 HydrophobicContact CG-CD2 3.78Å
420	C	96	Very high	96.7	Very high	36 Å²	36	50.1 Å²	50.1	24%	0.243	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-57.1	131.8	170.7	-176.5	0	0	0	0	110.1	G402 Q405	G402-C420 VanDerWaalsContact O-CA 3.28Å; G402-C420 WeakPolarHBondContact O-CA 3.34Å; Q405-C420 HydrophobicContact CG-CB 4.31Å
421	W	96.8	Very high	96.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.008	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-67.6	159.3	-178.1	62	15.1	0	0	0	112.1	V366 S369 G370 M372 I374 Y400 G402 C403 P419 D425 I427	V366-W421 HydrophobicContact CG1-CD2 4.36Å; V366-W421 HydrophobicContact CG1-CG 4.33Å; V366-W421 HydrophobicContact CG2-CB 4.43Å; V366-W421 HydrophobicContact CG2-CD2 4Å; V366-W421 HydrophobicContact CG2-CE3 3.73Å; V366-W421 HydrophobicContact CG2-CG 4.33Å; V366-W421 HydrophobicContact CG2-CZ3 4.42Å; S369-W421 PolarHBondContact O-NE1 3.5Å; S369-W421 VanDerWaalsContact O-NE1 3.08Å; G370-W421 VanDerWaalsContact O-CZ2 3.31Å; G370-W421 WeakPolarHBondContact O-CZ2 3.42Å; G370-W421 PolarHBondContact O-NE1 2.86Å; M372-W421 HydrophobicContact CB-CH2 3.8Å; M372-W421 HydrophobicContact CB-CZ2 3.94Å; M372-W421 HydrophobicContact CE-CH2 4.02Å; M372-W421 HydrophobicContact CE-CZ2 3.69Å; M372-W421 WeakPolarHBondContact O-CH2 3.43Å; I374-W421 HydrophobicContact CD1-CH2 4.24Å; I374-W421 HydrophobicContact CD1-CZ3 4.23Å; Y400-W421 HydrophobicContact CD1-CE3 4.39Å; Y400-W421 AromaticContact CD1-CZ3 3.96Å; Y400-W421 HydrophobicContact CD1-CZ3 3.96Å; Y400-W421 AromaticContact CE1-CE3 3.87Å; Y400-W421 HydrophobicContact CE1-CE3 3.87Å; Y400-W421 AromaticContact CE1-CZ3 3.91Å; Y400-W421 HydrophobicContact CE1-CZ3 3.91Å; G402-W421 VanDerWaalsContact CA-CD2 3.45Å; G402-W421 PolarHBondContact O-N 3.07Å; C403-W421 HydrophobicContact CB-CZ2 4.28Å; P419-W421 PolarHBondContact O-N 3.16Å; W421-D425 WeakPolarHBondContact CA-OD2 3.48Å; W421-I427 HydrophobicContact CE3-CD1 4.02Å; W421-I427 HydrophobicContact CE3-CG1 4Å; W421-I427 HydrophobicContact CZ3-CG1 4.3Å
422	K	96.4	Very high	97.3	Very high	140 Å²	140	46 Å²	46	61%	0.609	25%	0.245	S	C	*	.			trans	-133.1	162.8	177.5	-61.6	-177.9	-176.8	178.8	0	110.5	G424 D425	K422-G424 PolarHBondContact O-N 3.49Å; K422-D425 PolarHBondContact N-OD2 3.47Å; K422-D425 VanDerWaalsContact O-CB 3.28Å; K422-D425 WeakPolarHBondContact O-CB 3.21Å; K422-D425 PolarHBondContact O-N 3.4Å
423	E	96.6	Very high	97.6	Very high	87 Å²	87	38.1 Å²	38.1	41%	0.407	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	126.4	173	-59.4	77.7	-167.3	0	0	110	Y283 I367 S369	Y283-E423 HydrophobicContact CD2-CB 3.67Å; Y283-E423 HydrophobicContact CE2-CB 4.31Å; Y283-E423 HydrophobicContact CG-CB 4.11Å; I367-E423 VanDerWaalsContact O-CG 3.23Å; I367-E423 WeakPolarHBondContact O-CG 3.24Å; S369-E423 VanDerWaalsContact CB-OE1 3.27Å; S369-E423 WeakPolarHBondContact CB-OE1 3.33Å; S369-E423 PolarHBondContact N-OE1 3.23Å; S369-E423 PolarHBondContact OG-OE1 3.29Å
424	G	97.7	Very high	97.6	Very high	11 Å²	11	43.1 Å²	43.1	11%	0.113	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-4.3	-177.1	0	0	0	0	0	116.4	Y283 V366 K422	Y283-G424 VanDerWaalsContact CE2-CA 3.47Å; Y283-G424 WeakPolarHBondContact OH-CA 3.44Å; V366-G424 PolarHBondContact O-N 2.83Å; K422-G424 PolarHBondContact O-N 3.49Å
425	D	98.6	Very high	97.7	Very high	30 Å²	30	44.5 Å²	44.5	16%	0.16	24%	0.242	C	C	.	.			trans	-63.2	148.6	167.4	-79	-23.7	0	0	0	111.1	T365 V366 W421 K422 L442 N443	T365-D425 WeakPolarHBondContact CA-O 3.31Å; V366-D425 HydrophobicContact CG2-CB 4.43Å; V366-D425 PolarHBondContact N-O 2.9Å; W421-D425 WeakPolarHBondContact CA-OD2 3.48Å; K422-D425 PolarHBondContact N-OD2 3.47Å; K422-D425 VanDerWaalsContact O-CB 3.28Å; K422-D425 WeakPolarHBondContact O-CB 3.21Å; K422-D425 PolarHBondContact O-N 3.4Å; D425-L442 HydrophobicContact CB-CD1 3.78Å; D425-N443 PolarHBondContact OD1-ND2 3.03Å
426	T	98.8	Very high	97.8	Very high	3 Å²	3	44 Å²	44	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.1	177.9	-54	0	0	0	0	110	E363 V364 N443 K483 Y484	E363-T426 HydrophobicContact CB-CG2 3.88Å; E363-T426 HydrophobicContact CG-CG2 3.98Å; V364-T426 CarbonylContact O-C 3.56Å; V364-T426 WeakPolarHBondContact O-CA 3.34Å; T426-N443 PolarHBondContact N-OD1 3.11Å; T426-N443 PolarHBondContact O-N 2.95Å; T426-K483 HydrophobicContact CG2-CB 4.48Å; T426-K483 WeakPolarHBondContact OG1-CD 3.44Å; T426-Y484 HydrophobicContact CG2-CD2 4.09Å
427	I	98.9	Very high	97.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126	177	-44.1	-56.3	0	0	0	108.9	E363 V364 V366 Y400 W421 F429 Y441 L442	E363-I427 CarbonylContact C-O 3.55Å; E363-I427 VanDerWaalsContact CA-O 3.25Å; E363-I427 WeakPolarHBondContact CA-O 3.45Å; V364-I427 PolarHBondContact N-O 3.36Å; V364-I427 PolarHBondContact O-N 3.33Å; V366-I427 HydrophobicContact CG2-CD1 4.38Å; V366-I427 HydrophobicContact CG2-CG1 4.01Å; Y400-I427 HydrophobicContact CD1-CG2 3.97Å; Y400-I427 HydrophobicContact CE1-CD1 4Å; Y400-I427 HydrophobicContact CE1-CG1 4.37Å; Y400-I427 HydrophobicContact CE1-CG2 4.09Å; Y400-I427 HydrophobicContact CG-CG2 4.45Å; W421-I427 HydrophobicContact CE3-CD1 4.02Å; W421-I427 HydrophobicContact CE3-CG1 4Å; W421-I427 HydrophobicContact CZ3-CG1 4.3Å; I427-F429 HydrophobicContact CB-CE2 3.65Å; I427-F429 HydrophobicContact CB-CZ 3.84Å; I427-F429 HydrophobicContact CG2-CD2 4.3Å; I427-F429 HydrophobicContact CG2-CE1 3.96Å; I427-F429 HydrophobicContact CG2-CE2 3.49Å; I427-F429 VanDerWaalsContact CG2-CE2 3.49Å; I427-F429 HydrophobicContact CG2-CZ 3.27Å; I427-Y441 CarbonylContact C-O 3.43Å; I427-Y441 WeakPolarHBondContact CA-O 3.48Å; I427-Y441 VanDerWaalsContact CG2-O 3.28Å; I427-Y441 WeakPolarHBondContact CG2-O 3.41Å; I427-L442 HydrophobicContact CD1-CB 4.4Å; I427-L442 HydrophobicContact CD1-CD1 3.35Å; I427-L442 HydrophobicContact CD1-CG 4.44Å
428	G	98.8	Very high	97.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.4	175.3	0	0	0	0	0	111.2	Y361 F440 Y441	Y361-G428 VanDerWaalsContact OH-CA 3.29Å; Y361-G428 WeakPolarHBondContact OH-CA 3.29Å; G428-F440 CarbonylContact O-C 3.55Å; G428-F440 WeakPolarHBondContact O-CA 3.31Å; G428-Y441 PolarHBondContact N-O 3.27Å; G428-Y441 PolarHBondContact O-N 3.18Å
429	F	98.8	Very high	97.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	107.2	-177.2	-63.1	-89.5	0	0	0	109.3	Y361 Y362 V364 I374 W376 I427 F440	Y361-F429 VanDerWaalsContact CA-O 3.31Å; Y361-F429 WeakPolarHBondContact CA-O 3.3Å; Y361-F429 WeakPolarHBondContact CD2-O 3.47Å; Y362-F429 HydrophobicContact CD1-CB 3.67Å; Y362-F429 HydrophobicContact CD1-CG 4.45Å; Y362-F429 HydrophobicContact CD2-CB 4.35Å; Y362-F429 AromaticContact CD2-CD2 3.85Å; Y362-F429 HydrophobicContact CD2-CD2 3.85Å; Y362-F429 HydrophobicContact CD2-CG 4.39Å; Y362-F429 HydrophobicContact CE1-CB 3.25Å; Y362-F429 HydrophobicContact CE1-CD2 4.22Å; Y362-F429 AromaticContact CE1-CG 3.79Å; Y362-F429 HydrophobicContact CE1-CG 3.79Å; Y362-F429 HydrophobicContact CE2-CB 3.99Å; Y362-F429 AromaticContact CE2-CD2 3.31Å; Y362-F429 HydrophobicContact CE2-CD2 3.31Å; Y362-F429 AromaticContact CE2-CE2 3.91Å; Y362-F429 HydrophobicContact CE2-CE2 3.91Å; Y362-F429 AromaticContact CE2-CG 3.71Å; Y362-F429 HydrophobicContact CE2-CG 3.71Å; Y362-F429 HydrophobicContact CG-CB 4.2Å; Y362-F429 HydrophobicContact CG-CD2 4.49Å; Y362-F429 VanDerWaalsContact CZ-CB 3.4Å; Y362-F429 AromaticContact CZ-CD2 3.5Å; Y362-F429 AromaticContact CZ-CG 3.35Å; Y362-F429 PolarHBondContact N-O 3.24Å; Y362-F429 PolarHBondContact O-N 3.26Å; Y362-F429 WeakPolarHBondContact OH-CD1 3.41Å; Y362-F429 WeakPolarHBondContact OH-CG 3.42Å; V364-F429 HydrophobicContact CB-CE2 3.95Å; V364-F429 HydrophobicContact CG2-CD2 4.19Å; V364-F429 HydrophobicContact CG2-CE2 3.66Å; I374-F429 HydrophobicContact CB-CE1 4.11Å; I374-F429 HydrophobicContact CB-CZ 3.69Å; I374-F429 HydrophobicContact CG2-CE1 3.87Å; I374-F429 HydrophobicContact CG2-CE2 3.79Å; I374-F429 HydrophobicContact CG2-CZ 3.32Å; I374-F429 WeakPolarHBondContact O-CE1 3.19Å; W376-F429 HydrophobicContact CZ2-CB 4.37Å; I427-F429 HydrophobicContact CB-CE2 3.65Å; I427-F429 HydrophobicContact CB-CZ 3.84Å; I427-F429 HydrophobicContact CG2-CD2 4.3Å; I427-F429 HydrophobicContact CG2-CE1 3.96Å; I427-F429 HydrophobicContact CG2-CE2 3.49Å; I427-F429 VanDerWaalsContact CG2-CE2 3.49Å; I427-F429 HydrophobicContact CG2-CZ 3.27Å; F429-F440 AromaticContact CD1-CD1 3.49Å; F429-F440 HydrophobicContact CD1-CD1 3.49Å; F429-F440 VanDerWaalsContact CD1-CD1 3.49Å; F429-F440 AromaticContact CD1-CE1 3.67Å; F429-F440 HydrophobicContact CD1-CE1 3.67Å; F429-F440 AromaticContact CE1-CD1 3.74Å; F429-F440 HydrophobicContact CE1-CD1 3.74Å; F429-F440 AromaticContact CE1-CE1 3.98Å; F429-F440 HydrophobicContact CE1-CE1 3.98Å
430	L	98.8	Very high	97.8	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	131.7	175.6	-170.2	113.5	0	0	0	110.3	V359 W360 Y361 D432 M438 I439 Y441 P486 I488	V359-L430 HydrophobicContact CG1-CD1 4.09Å; V359-L430 HydrophobicContact CG1-CD2 4.32Å; V359-L430 HydrophobicContact CG1-CG 4.22Å; W360-L430 CarbonylContact O-C 3.53Å; W360-L430 WeakPolarHBondContact O-CA 3.33Å; Y361-L430 HydrophobicContact CD2-CB 4.03Å; Y361-L430 HydrophobicContact CD2-CD1 4.07Å; L430-D432 HydrophobicContact CD2-CB 4.33Å; L430-M438 CarbonylContact O-C 3.59Å; L430-M438 VanDerWaalsContact O-CA 3.31Å; L430-M438 WeakPolarHBondContact O-CA 3.39Å; L430-I439 HydrophobicContact CB-CB 4.21Å; L430-I439 HydrophobicContact CD2-CB 4.3Å; L430-I439 HydrophobicContact CD2-CD1 4Å; L430-I439 HydrophobicContact CD2-CG1 4.23Å; L430-I439 PolarHBondContact N-O 2.78Å; L430-I439 PolarHBondContact O-N 3.12Å; L430-Y441 HydrophobicContact CB-CE2 3.77Å; L430-P486 HydrophobicContact CD1-CB 4.43Å; L430-P486 HydrophobicContact CD1-CG 3.77Å; L430-I488 HydrophobicContact CD1-CD1 3.45Å; L430-I488 VanDerWaalsContact CD1-CD1 3.45Å; L430-I488 HydrophobicContact CD1-CG1 3.8Å; L430-I488 HydrophobicContact CD2-CD1 3.55Å; L430-I488 HydrophobicContact CG-CD1 4.1Å
431	L	98.8	Very high	98	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.3	169.8	175.1	66.1	0	0	0	109	V355 V359 W360 W376 L433 M438 F454 F461	V355-L431 HydrophobicContact CG1-CD2 4.05Å; V359-L431 CarbonylContact C-O 3.48Å; V359-L431 VanDerWaalsContact CA-O 3.27Å; V359-L431 WeakPolarHBondContact CA-O 3.41Å; W360-L431 PolarHBondContact N-O 3Å; W360-L431 PolarHBondContact O-N 3.29Å; W376-L431 HydrophobicContact CD2-CB 4.02Å; W376-L431 HydrophobicContact CD2-CD2 4.04Å; W376-L431 HydrophobicContact CD2-CG 4.5Å; W376-L431 HydrophobicContact CE3-CB 4.34Å; W376-L431 HydrophobicContact CE3-CD2 3.73Å; W376-L431 HydrophobicContact CH2-CB 3.71Å; W376-L431 HydrophobicContact CH2-CD2 4.11Å; W376-L431 HydrophobicContact CZ2-CB 3.37Å; W376-L431 HydrophobicContact CZ2-CD2 4.44Å; W376-L431 HydrophobicContact CZ3-CB 4.18Å; W376-L431 HydrophobicContact CZ3-CD2 3.73Å; L431-L433 HydrophobicContact CD1-CD2 4.16Å; L431-L433 HydrophobicContact CD1-CG 4.42Å; L431-L433 HydrophobicContact CD2-CD1 4.28Å; L431-L433 HydrophobicContact CD2-CD2 4.21Å; L431-L433 HydrophobicContact CD2-CG 4.09Å; L431-L433 HydrophobicContact CG-CD2 4.27Å; L431-L433 HydrophobicContact CG-CG 4.04Å; L431-M438 HydrophobicContact CD1-CE 3.69Å; L431-M438 HydrophobicContact CD1-CG 3.64Å; L431-M438 HydrophobicContact CD1-SD 4.5Å; L431-F454 HydrophobicContact CD1-CE1 4.24Å; L431-F454 HydrophobicContact CD1-CZ 3.69Å; L431-F461 HydrophobicContact CD1-CD2 4.44Å; L431-F461 HydrophobicContact CD2-CB 3.62Å; L431-F461 HydrophobicContact CD2-CD2 4Å; L431-F461 HydrophobicContact CD2-CG 3.98Å
432	D	98.3	Very high	98.1	Very high	15 Å²	15	35 Å²	35	8%	0.08	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	102.2	173.7	-178.5	-16.3	0	0	0	108.6	V359 L430 Q434 E435 K436 Q437	V359-D432 HydrophobicContact CG1-CB 4.3Å; V359-D432 HydrophobicContact CG2-CB 4.15Å; L430-D432 HydrophobicContact CD2-CB 4.33Å; D432-Q434 VanDerWaalsContact C-N 3.27Å; D432-Q434 WeakPolarHBondContact OD1-CA 3.38Å; D432-Q434 WeakPolarHBondContact OD1-CB 3.26Å; D432-Q434 PolarHBondContact OD1-N 2.8Å; D432-E435 PolarHBondContact OD1-N 3.17Å; D432-K436 VanDerWaalsContact O-CA 3.29Å; D432-K436 WeakPolarHBondContact O-CA 3.34Å; D432-K436 PolarHBondContact O-N 2.84Å; D432-Q437 HydrophobicContact CB-CG 3.78Å; D432-Q437 PolarHBondContact N-O 3.18Å; D432-Q437 PolarHBondContact O-N 2.76Å
433	L	97.9	Very high	98.2	Very high	17 Å²	17	30.3 Å²	30.3	9%	0.089	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.2	-179.1	-70.6	169.4	0	0	0	112.8	V355 D356 S357 G358 L431 F454 V458 F461	V355-L433 HydrophobicContact CG1-CD1 3.75Å; D356-L433 VanDerWaalsContact C-CD1 3.4Å; S357-L433 VanDerWaalsContact N-CD1 3.32Å; G358-L433 PolarHBondContact O-N 2.99Å; L431-L433 HydrophobicContact CD1-CD2 4.16Å; L431-L433 HydrophobicContact CD1-CG 4.42Å; L431-L433 HydrophobicContact CD2-CD1 4.28Å; L431-L433 HydrophobicContact CD2-CD2 4.21Å; L431-L433 HydrophobicContact CD2-CG 4.09Å; L431-L433 HydrophobicContact CG-CD2 4.27Å; L431-L433 HydrophobicContact CG-CG 4.04Å; L433-F454 HydrophobicContact CD2-CE1 3.79Å; L433-V458 WeakPolarHBondContact CD2-O 3.42Å; L433-F461 HydrophobicContact CD2-CD2 3.67Å; L433-F461 HydrophobicContact CD2-CE2 3.8Å
434	Q	95.5	Very high	98.3	Very high	153 Å²	153	27.9 Å²	27.9	72%	0.715	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-49.5	177.2	-176.1	171.3	4.9	0	0	110.4	D432 K436	D432-Q434 VanDerWaalsContact C-N 3.27Å; D432-Q434 WeakPolarHBondContact OD1-CA 3.38Å; D432-Q434 WeakPolarHBondContact OD1-CB 3.26Å; D432-Q434 PolarHBondContact OD1-N 2.8Å; Q434-K436 VanDerWaalsContact C-N 3.28Å
435	E	97.1	Very high	98.3	Very high	108 Å²	108	32.5 Å²	32.5	51%	0.505	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.3	177.1	-64.8	-59.7	137.1	0	0	113.4	D432 Q437 K451	D432-E435 PolarHBondContact OD1-N 3.17Å; E435-Q437 HydrophobicContact CB-CG 3.97Å; E435-K451 PolarHBondContact O-NZ 2.72Å
436	K	97.9	Very high	98.3	Very high	100 Å²	100	37.3 Å²	37.3	44%	0.435	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	60	-179	-64.1	-176.5	179.7	-173.3	0	111.3	D432 Q434 K451 F454	D432-K436 VanDerWaalsContact O-CA 3.29Å; D432-K436 WeakPolarHBondContact O-CA 3.34Å; D432-K436 PolarHBondContact O-N 2.84Å; Q434-K436 VanDerWaalsContact C-N 3.28Å; K436-K451 WeakPolarHBondContact O-CG 3.46Å; K436-F454 VanDerWaalsContact C-CD2 3.4Å; K436-F454 HydrophobicContact CB-CB 4.03Å; K436-F454 HydrophobicContact CB-CD1 3.9Å; K436-F454 HydrophobicContact CB-CD2 4.03Å; K436-F454 HydrophobicContact CB-CE1 4.35Å; K436-F454 HydrophobicContact CB-CE2 4.48Å; K436-F454 HydrophobicContact CB-CG 3.71Å; K436-F454 HydrophobicContact CD-CB 4.36Å; K436-F454 HydrophobicContact CG-CD1 4.16Å; K436-F454 HydrophobicContact CG-CG 4.36Å; K436-F454 WeakPolarHBondContact O-CD2 3.49Å; K436-F454 VanDerWaalsContact O-CE2 3.31Å; K436-F454 WeakPolarHBondContact O-CE2 3.49Å
437	Q	97.4	Very high	98.3	Very high	36 Å²	36	37.6 Å²	37.6	17%	0.168	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	145.9	-178.7	62.1	-173.6	7	0	0	112.9	D432 E435 A449 E450 K451 F454	D432-Q437 HydrophobicContact CB-CG 3.78Å; D432-Q437 PolarHBondContact N-O 3.18Å; D432-Q437 PolarHBondContact O-N 2.76Å; E435-Q437 HydrophobicContact CB-CG 3.97Å; Q437-A449 HydrophobicContact CB-CB 4.02Å; Q437-E450 CarbonylContact C-O 3.47Å; Q437-E450 WeakPolarHBondContact CA-O 3.46Å; Q437-K451 HydrophobicContact CB-CG 4.2Å; Q437-F454 VanDerWaalsContact N-CE2 3.28Å
438	M	98.2	Very high	98.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.3	168.2	-66.5	174.4	-177.4	0	0	108.9	W376 C398 L430 L431 F440 A449 E450 V453 F454 F461	W376-M438 HydrophobicContact CB-CE 3.5Å; W376-M438 VanDerWaalsContact CB-CE 3.5Å; W376-M438 HydrophobicContact CB-SD 3.93Å; W376-M438 HydrophobicContact CG-CE 3.94Å; W376-M438 HydrophobicContact CG-SD 4.07Å; C398-M438 HydrophobicContact CB-SD 3.89Å; L430-M438 CarbonylContact O-C 3.59Å; L430-M438 VanDerWaalsContact O-CA 3.31Å; L430-M438 WeakPolarHBondContact O-CA 3.39Å; L431-M438 HydrophobicContact CD1-CE 3.69Å; L431-M438 HydrophobicContact CD1-CG 3.64Å; L431-M438 HydrophobicContact CD1-SD 4.5Å; M438-F440 HydrophobicContact CB-CZ 4.48Å; M438-A449 CarbonylContact O-C 3.58Å; M438-A449 WeakPolarHBondContact O-CA 3.38Å; M438-E450 HydrophobicContact CB-CB 4.4Å; M438-E450 PolarHBondContact N-O 2.72Å; M438-E450 PolarHBondContact O-N 3.23Å; M438-V453 HydrophobicContact CE-CG1 3.48Å; M438-V453 VanDerWaalsContact CE-CG1 3.48Å; M438-V453 HydrophobicContact SD-CG1 3.82Å; M438-F454 HydrophobicContact CE-CE2 4.48Å; M438-F454 HydrophobicContact CE-CZ 4.15Å; M438-F454 HydrophobicContact CG-CE2 4.12Å; M438-F454 HydrophobicContact CG-CZ 4.14Å; M438-F461 HydrophobicContact CE-CD1 3.74Å; M438-F461 HydrophobicContact CE-CE1 3.41Å; M438-F461 VanDerWaalsContact CE-CE1 3.41Å; M438-F461 HydrophobicContact CE-CE2 4.34Å; M438-F461 HydrophobicContact CE-CG 4.34Å; M438-F461 HydrophobicContact CE-CZ 3.73Å
439	I	98.6	Very high	98.2	Very high	18 Å²	18	43.9 Å²	43.9	9%	0.092	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.9	178.7	-53.1	177.2	0	0	0	108.6	L430 Y441 Q446 A449	L430-I439 HydrophobicContact CB-CB 4.21Å; L430-I439 HydrophobicContact CD2-CB 4.3Å; L430-I439 HydrophobicContact CD2-CD1 4Å; L430-I439 HydrophobicContact CD2-CG1 4.23Å; L430-I439 PolarHBondContact N-O 2.78Å; L430-I439 PolarHBondContact O-N 3.12Å; I439-Y441 HydrophobicContact CB-CE2 3.92Å; I439-Y441 HydrophobicContact CG2-CD2 4.27Å; I439-Y441 HydrophobicContact CG2-CE1 4.5Å; I439-Y441 HydrophobicContact CG2-CE2 3.55Å; I439-Q446 HydrophobicContact CG2-CB 4.18Å; I439-A449 HydrophobicContact CG1-CB 4.09Å
440	F	98.8	Very high	98.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.8	178.1	-53.8	-68.8	0	0	0	110.6	Y400 I407 G428 F429 M438 L447 E450	Y400-F440 HydrophobicContact CD2-CB 3.81Å; Y400-F440 HydrophobicContact CD2-CD2 4.44Å; Y400-F440 HydrophobicContact CD2-CG 4.08Å; Y400-F440 HydrophobicContact CE2-CB 4.46Å; Y400-F440 HydrophobicContact CG-CB 4.42Å; Y400-F440 HydrophobicContact CG-CG 4.43Å; I407-F440 HydrophobicContact CD1-CD2 3.63Å; I407-F440 HydrophobicContact CD1-CE2 3.85Å; I407-F440 HydrophobicContact CD1-CG 4.5Å; I407-F440 HydrophobicContact CG2-CE2 4.31Å; G428-F440 CarbonylContact O-C 3.55Å; G428-F440 WeakPolarHBondContact O-CA 3.31Å; F429-F440 AromaticContact CD1-CD1 3.49Å; F429-F440 HydrophobicContact CD1-CD1 3.49Å; F429-F440 VanDerWaalsContact CD1-CD1 3.49Å; F429-F440 AromaticContact CD1-CE1 3.67Å; F429-F440 HydrophobicContact CD1-CE1 3.67Å; F429-F440 AromaticContact CE1-CD1 3.74Å; F429-F440 HydrophobicContact CE1-CD1 3.74Å; F429-F440 AromaticContact CE1-CE1 3.98Å; F429-F440 HydrophobicContact CE1-CE1 3.98Å; M438-F440 HydrophobicContact CB-CZ 4.48Å; F440-L447 HydrophobicContact CB-CD1 4.35Å; F440-L447 PolarHBondContact O-N 2.9Å; F440-E450 HydrophobicContact CD2-CG 4.38Å; F440-E450 HydrophobicContact CE2-CG 3.83Å
441	Y	98.8	Very high	98.1	Very high	12 Å²	12	49 Å²	49	5%	0.047	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.8	-178.7	-58.4	-107.5	0	0	0	110.4	Y361 I427 G428 L430 I439 N445 Q446 P486	Y361-Y441 HydrophobicContact CE2-CD2 4.11Å; Y361-Y441 HydrophobicContact CE2-CE2 4.3Å; I427-Y441 CarbonylContact C-O 3.43Å; I427-Y441 WeakPolarHBondContact CA-O 3.48Å; I427-Y441 VanDerWaalsContact CG2-O 3.28Å; I427-Y441 WeakPolarHBondContact CG2-O 3.41Å; G428-Y441 PolarHBondContact N-O 3.27Å; G428-Y441 PolarHBondContact O-N 3.18Å; L430-Y441 HydrophobicContact CB-CE2 3.77Å; I439-Y441 HydrophobicContact CB-CE2 3.92Å; I439-Y441 HydrophobicContact CG2-CD2 4.27Å; I439-Y441 HydrophobicContact CG2-CE1 4.5Å; I439-Y441 HydrophobicContact CG2-CE2 3.55Å; Y441-N445 CarbonylContact C-O 3.57Å; Y441-N445 WeakPolarHBondContact CA-O 3.38Å; Y441-Q446 HydrophobicContact CD1-CB 3.63Å; Y441-Q446 HydrophobicContact CE1-CB 3.47Å; Y441-Q446 VanDerWaalsContact CE1-CB 3.47Å; Y441-Q446 HydrophobicContact CG-CB 4.42Å; Y441-P486 HydrophobicContact CE1-CB 4.18Å
442	L	98.8	Very high	97.9	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	113.6	167.2	172.4	63.5	0	0	0	108.5	H418 P419 D425 I427 G444 N445	H418-L442 HydrophobicContact CB-CB 4.4Å; H418-L442 HydrophobicContact CB-CD2 3.88Å; H418-L442 VanDerWaalsContact CE1-CB 3.46Å; H418-L442 WeakPolarHBondContact CE1-CB 3.33Å; H418-L442 PolarHBondContact CE1-N 3.15Å; H418-L442 WeakPolarHBondContact ND1-CB 3.36Å; P419-L442 HydrophobicContact CG-CD2 3.78Å; D425-L442 HydrophobicContact CB-CD1 3.78Å; I427-L442 HydrophobicContact CD1-CB 4.4Å; I427-L442 HydrophobicContact CD1-CD1 3.35Å; I427-L442 HydrophobicContact CD1-CG 4.44Å; L442-G444 PolarHBondContact O-N 3.1Å; L442-N445 PolarHBondContact N-O 2.8Å; L442-N445 WeakPolarHBondContact O-CB 3.48Å; L442-N445 PolarHBondContact O-N 3Å; L442-N445 PolarHBondContact O-ND2 3.39Å
443	N	98.7	Very high	97.8	Very high	40 Å²	40	52 Å²	52	21%	0.214	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	42.8	-176.1	-61.7	-43.9	0	0	0	112.4	D425 T426 N445 Y484	D425-N443 PolarHBondContact OD1-ND2 3.03Å; T426-N443 PolarHBondContact N-OD1 3.11Å; T426-N443 PolarHBondContact O-N 2.95Å; N443-N445 VanDerWaalsContact C-N 3.29Å; N443-N445 PolarHBondContact O-N 2.98Å; N443-Y484 HydrophobicContact CB-CD2 4.45Å; N443-Y484 HydrophobicContact CB-CE1 4.47Å; N443-Y484 HydrophobicContact CB-CE2 3.87Å; N443-Y484 WeakPolarHBondContact OD1-CE2 3.39Å
444	G	98.4	Very high	97.8	Very high	36 Å²	36	52 Å²	52	37%	0.371	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-8.4	-178.1	0	0	0	0	0	116	L442	L442-G444 PolarHBondContact O-N 3.1Å
445	N	98.4	Very high	97.8	Very high	109 Å²	109	49.3 Å²	49.3	58%	0.583	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	127	174.1	-56.7	-76.7	0	0	0	109.5	H418 Y441 L442 N443	H418-N445 PolarHBondContact CE1-O 3.11Å; H418-N445 PolarHBondContact NE2-O 2.91Å; Y441-N445 CarbonylContact C-O 3.57Å; Y441-N445 WeakPolarHBondContact CA-O 3.38Å; L442-N445 PolarHBondContact N-O 2.8Å; L442-N445 WeakPolarHBondContact O-CB 3.48Å; L442-N445 PolarHBondContact O-N 3Å; L442-N445 PolarHBondContact O-ND2 3.39Å; N443-N445 VanDerWaalsContact C-N 3.29Å; N443-N445 PolarHBondContact O-N 2.98Å
446	Q	98.1	Very high	97.7	Very high	130 Å²	130	46.3 Å²	46.3	61%	0.607	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	144.9	-175.3	73.1	-176.5	1.2	0	0	113.1	I439 Y441	I439-Q446 HydrophobicContact CG2-CB 4.18Å; Y441-Q446 HydrophobicContact CD1-CB 3.63Å; Y441-Q446 HydrophobicContact CE1-CB 3.47Å; Y441-Q446 VanDerWaalsContact CE1-CB 3.47Å; Y441-Q446 HydrophobicContact CG-CB 4.42Å
447	L	98.6	Very high	97.5	Very high	9 Å²	9	42 Å²	42	5%	0.047	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-87.3	166.3	163.3	-72.6	179.3	0	0	0	111.9	Y400 I407 H416 S417 H418 F440	Y400-L447 HydrophobicContact CD2-CD1 4.1Å; Y400-L447 HydrophobicContact CE2-CD1 3.79Å; I407-L447 HydrophobicContact CD1-CD1 4.17Å; H416-L447 HydrophobicContact CB-CD1 3.65Å; H416-L447 HydrophobicContact CB-CD2 4.1Å; S417-L447 VanDerWaalsContact OG-CD2 3.31Å; S417-L447 WeakPolarHBondContact OG-CD2 3.26Å; H418-L447 VanDerWaalsContact CD2-CD2 3.48Å; H418-L447 WeakPolarHBondContact CD2-CD2 3.3Å; H418-L447 VanDerWaalsContact CE1-CG 3.45Å; H418-L447 WeakPolarHBondContact CE1-CG 2.88Å; F440-L447 HydrophobicContact CB-CD1 4.35Å; F440-L447 PolarHBondContact O-N 2.9Å
448	P	98.1	Very high	97.3	Very high	97 Å²	97	44 Å²	44	63%	0.63	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-56.1	151.6	165.3	-23.8	35.2	0	0	0	112.4
449	A	97.9	Very high	97.2	Very high	37 Å²	37	46.7 Å²	46.7	31%	0.306	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-69	137.6	179.9	0	0	0	0	0	113	Q437 M438 I439	Q437-A449 HydrophobicContact CB-CB 4.02Å; M438-A449 CarbonylContact O-C 3.58Å; M438-A449 WeakPolarHBondContact O-CA 3.38Å; I439-A449 HydrophobicContact CG1-CB 4.09Å
450	E	98	Very high	97.1	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.037	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-96.9	132.2	169.5	-59.4	-54.8	139.7	0	0	110.5	I407 K414 Q437 M438 F440 Q452	I407-E450 HydrophobicContact CG2-CG 3.94Å; K414-E450 WeakPolarHBondContact CE-OE1 3.32Å; K414-E450 WeakPolarHBondContact CE-OE2 3.5Å; K414-E450 IonicContact NZ-OE1 2.95Å; K414-E450 PolarHBondContact NZ-OE1 2.96Å; K414-E450 IonicContact NZ-OE2 2.75Å; K414-E450 PolarHBondContact NZ-OE2 2.89Å; Q437-E450 CarbonylContact C-O 3.47Å; Q437-E450 WeakPolarHBondContact CA-O 3.46Å; M438-E450 HydrophobicContact CB-CB 4.4Å; M438-E450 PolarHBondContact N-O 2.72Å; M438-E450 PolarHBondContact O-N 3.23Å; F440-E450 HydrophobicContact CD2-CG 4.38Å; F440-E450 HydrophobicContact CE2-CG 3.83Å; E450-Q452 PolarHBondContact OE2-NE2 2.86Å; E450-Q452 PolarHBondContact OE2-OE1 3.25Å
451	K	97.6	Very high	97.1	Very high	100 Å²	100	46.5 Å²	46.5	44%	0.435	28%	0.277	S	S	.	.			trans	-128.2	-6.4	-176.4	-55.1	-160.9	179.1	-146	0	113.8	E435 K436 Q437 V453 F454	E435-K451 PolarHBondContact O-NZ 2.72Å; K436-K451 WeakPolarHBondContact O-CG 3.46Å; Q437-K451 HydrophobicContact CB-CG 4.2Å; K451-V453 PolarHBondContact O-N 3.5Å; K451-F454 WeakPolarHBondContact O-CD2 3.31Å; K451-F454 PolarHBondContact O-N 3.42Å
452	Q	95.3	Very high	97.1	Very high	76 Å²	76	46.4 Å²	46.4	36%	0.355	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-66	-41.3	-167.4	-61.5	86.9	-53	0	0	111.3	Y409 E450 F454 S455	Y409-Q452 HydrophobicContact CD1-CB 3.61Å; Y409-Q452 HydrophobicContact CD1-CG 4.41Å; Y409-Q452 HydrophobicContact CE1-CB 3.52Å; Y409-Q452 HydrophobicContact CG-CB 4.21Å; Y409-Q452 PolarHBondContact OH-O 3.12Å; E450-Q452 PolarHBondContact OE2-NE2 2.86Å; E450-Q452 PolarHBondContact OE2-OE1 3.25Å; Q452-F454 PolarHBondContact O-N 3.01Å; Q452-F454 VanDerWaalsContact O-N 3.1Å; Q452-S455 WeakPolarHBondContact O-CB 3.45Å; Q452-S455 PolarHBondContact O-N 3.41Å; Q452-S455 PolarHBondContact O-OG 2.73Å
453	V	95.5	Very high	97.1	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-58.1	-25.2	177.9	69.8	0	0	0	0	113.5	C398 Y409 M438 K451 S455 S456 A457 F461	C398-V453 HydrophobicContact CB-CB 4.35Å; C398-V453 HydrophobicContact CB-CG1 4.5Å; Y409-V453 HydrophobicContact CD2-CB 4.14Å; Y409-V453 VanDerWaalsContact CE2-CA 3.48Å; Y409-V453 HydrophobicContact CE2-CB 3.92Å; Y409-V453 HydrophobicContact CE2-CG2 4.2Å; M438-V453 HydrophobicContact CE-CG1 3.48Å; M438-V453 VanDerWaalsContact CE-CG1 3.48Å; M438-V453 HydrophobicContact SD-CG1 3.82Å; K451-V453 PolarHBondContact O-N 3.5Å; V453-S455 PolarHBondContact O-N 3.3Å; V453-S456 PolarHBondContact O-N 3.49Å; V453-A457 PolarHBondContact O-N 3.44Å; V453-F461 HydrophobicContact CG1-CZ 4.34Å; V453-F461 HydrophobicContact CG2-CE1 4.02Å; V453-F461 HydrophobicContact CG2-CZ 4.21Å
454	F	97.3	Very high	97.1	Very high	18 Å²	18	44.2 Å²	44.2	8%	0.079	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-74.9	-1.6	178.5	-58.5	-82.5	0	0	0	114.7	L431 L433 K436 Q437 M438 K451 Q452 S456 A457 F461	L431-F454 HydrophobicContact CD1-CE1 4.24Å; L431-F454 HydrophobicContact CD1-CZ 3.69Å; L433-F454 HydrophobicContact CD2-CE1 3.79Å; K436-F454 VanDerWaalsContact C-CD2 3.4Å; K436-F454 HydrophobicContact CB-CB 4.03Å; K436-F454 HydrophobicContact CB-CD1 3.9Å; K436-F454 HydrophobicContact CB-CD2 4.03Å; K436-F454 HydrophobicContact CB-CE1 4.35Å; K436-F454 HydrophobicContact CB-CE2 4.48Å; K436-F454 HydrophobicContact CB-CG 3.71Å; K436-F454 HydrophobicContact CD-CB 4.36Å; K436-F454 HydrophobicContact CG-CD1 4.16Å; K436-F454 HydrophobicContact CG-CG 4.36Å; K436-F454 WeakPolarHBondContact O-CD2 3.49Å; K436-F454 VanDerWaalsContact O-CE2 3.31Å; K436-F454 WeakPolarHBondContact O-CE2 3.49Å; Q437-F454 VanDerWaalsContact N-CE2 3.28Å; M438-F454 HydrophobicContact CE-CE2 4.48Å; M438-F454 HydrophobicContact CE-CZ 4.15Å; M438-F454 HydrophobicContact CG-CE2 4.12Å; M438-F454 HydrophobicContact CG-CZ 4.14Å; K451-F454 WeakPolarHBondContact O-CD2 3.31Å; K451-F454 PolarHBondContact O-N 3.42Å; Q452-F454 PolarHBondContact O-N 3.01Å; Q452-F454 VanDerWaalsContact O-N 3.1Å; F454-S456 VanDerWaalsContact C-N 3.29Å; F454-A457 VanDerWaalsContact CA-O 3.3Å; F454-A457 WeakPolarHBondContact CA-O 3.31Å; F454-A457 WeakPolarHBondContact CD1-O 3.26Å; F454-F461 HydrophobicContact CD1-CE2 4.35Å; F454-F461 AromaticContact CE1-CE2 3.85Å; F454-F461 HydrophobicContact CE1-CE2 3.85Å; F454-F461 HydrophobicContact CE1-CZ 4.21Å
455	S	95.4	Very high	97.1	Very high	96 Å²	96	42.5 Å²	42.5	67%	0.671	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-70.5	-28.5	164.5	64	0	0	0	0	112.5	Y409 Q452 V453	Y409-S455 PolarHBondContact OH-OG 2.96Å; Q452-S455 WeakPolarHBondContact O-CB 3.45Å; Q452-S455 PolarHBondContact O-N 3.41Å; Q452-S455 PolarHBondContact O-OG 2.73Å; V453-S455 PolarHBondContact O-N 3.3Å
456	S	95.3	Very high	97.1	Very high	44 Å²	44	37.3 Å²	37.3	31%	0.308	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-30.7	-172.1	-57.1	0	0	0	0	112.6	E395 V453 F454	E395-S456 WeakPolarHBondContact O-CB 3.45Å; E395-S456 PolarHBondContact OE2-OG 3.43Å; V453-S456 PolarHBondContact O-N 3.49Å; F454-S456 VanDerWaalsContact C-N 3.29Å
457	A	93.4	Very high	97	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	19%	0.191	C	C	.	.			trans	-134.2	128.4	179.5	0	0	0	0	0	112.8	T378 Y396 V453 F454 F461	T378-A457 HydrophobicContact CG2-CB 3.59Å; Y396-A457 HydrophobicContact CD1-CB 4.45Å; V453-A457 PolarHBondContact O-N 3.44Å; F454-A457 VanDerWaalsContact CA-O 3.3Å; F454-A457 WeakPolarHBondContact CA-O 3.31Å; F454-A457 WeakPolarHBondContact CD1-O 3.26Å; A457-F461 HydrophobicContact CB-CE1 4.18Å; A457-F461 HydrophobicContact CB-CE2 4.35Å; A457-F461 HydrophobicContact CB-CZ 3.67Å
458	V	94.3	Very high	96.8	Very high	79 Å²	79	33.1 Å²	33.1	48%	0.479	20%	0.2	S	C	.	.	S	Bend	trans	-115.7	-7.5	-178.1	-63.8	0	0	0	0	114.5	L433	L433-V458 WeakPolarHBondContact CD2-O 3.42Å
459	S	95.6	Very high	96.6	Very high	56 Å²	56	28.7 Å²	28.7	39%	0.392	17%	0.172	S	C	.	.	S	Bend	trans	-158.8	-178.4	179.1	66.4	0	0	0	0	108.9
460	G	96.9	Very high	96.5	Very high	14 Å²	14	27.5 Å²	27.5	14%	0.144	16%	0.16	C	C	.	.			trans	78.8	25.8	173.8	0	0	0	0	0	114.9	C354 V355 D356 T378 F462	C354-G460 VanDerWaalsContact SG-CA 3.51Å; V355-G460 PolarHBondContact O-N 2.97Å; V355-G460 VanDerWaalsContact O-N 3.15Å; D356-G460 VanDerWaalsContact OD1-CA 3.27Å; D356-G460 WeakPolarHBondContact OD1-CA 3.45Å; D356-G460 PolarHBondContact OD1-N 3.01Å; T378-G460 WeakPolarHBondContact CA-O 3.27Å; T378-G460 WeakPolarHBondContact CB-O 3.38Å; G460-F462 WeakPolarHBondContact O-CD2 3.09Å; G460-F462 WeakPolarHBondContact O-CE2 3.27Å
461	F	98.5	Very high	96.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-86.8	142.9	-174.7	-72.8	-78.3	0	0	0	112.5	V355 W376 T378 L431 L433 M438 V453 F454 A457	V355-F461 WeakPolarHBondContact CB-O 3.47Å; V355-F461 PolarHBondContact N-O 2.84Å; V355-F461 PolarHBondContact O-N 3.44Å; W376-F461 HydrophobicContact CB-CD1 3.96Å; W376-F461 HydrophobicContact CE3-CB 4Å; T378-F461 HydrophobicContact CG2-CD1 3.85Å; T378-F461 HydrophobicContact CG2-CE1 3.79Å; T378-F461 HydrophobicContact CG2-CG 4.36Å; T378-F461 HydrophobicContact CG2-CZ 4.26Å; L431-F461 HydrophobicContact CD1-CD2 4.44Å; L431-F461 HydrophobicContact CD2-CB 3.62Å; L431-F461 HydrophobicContact CD2-CD2 4Å; L431-F461 HydrophobicContact CD2-CG 3.98Å; L433-F461 HydrophobicContact CD2-CD2 3.67Å; L433-F461 HydrophobicContact CD2-CE2 3.8Å; M438-F461 HydrophobicContact CE-CD1 3.74Å; M438-F461 HydrophobicContact CE-CE1 3.41Å; M438-F461 VanDerWaalsContact CE-CE1 3.41Å; M438-F461 HydrophobicContact CE-CE2 4.34Å; M438-F461 HydrophobicContact CE-CG 4.34Å; M438-F461 HydrophobicContact CE-CZ 3.73Å; V453-F461 HydrophobicContact CG1-CZ 4.34Å; V453-F461 HydrophobicContact CG2-CE1 4.02Å; V453-F461 HydrophobicContact CG2-CZ 4.21Å; F454-F461 HydrophobicContact CD1-CE2 4.35Å; F454-F461 AromaticContact CE1-CE2 3.85Å; F454-F461 HydrophobicContact CE1-CE2 3.85Å; F454-F461 HydrophobicContact CE1-CZ 4.21Å; A457-F461 HydrophobicContact CB-CE1 4.18Å; A457-F461 HydrophobicContact CB-CE2 4.35Å; A457-F461 HydrophobicContact CB-CZ 3.67Å
462	F	98.7	Very high	96.5	Very high	10 Å²	10	22.6 Å²	22.6	4%	0.044	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.6	172.6	-63	-99.8	0	0	0	108.5	R350 C351 F353 C354 W376 A377 K379 G460 A464	R350-F462 HydrophobicContact CB-CB 4.07Å; R350-F462 HydrophobicContact CB-CG 4.43Å; R350-F462 HydrophobicContact CG-CB 3.93Å; R350-F462 HydrophobicContact CG-CG 4.45Å; C351-F462 WeakPolarHBondContact O-CD1 3.35Å; F353-F462 VanDerWaalsContact O-CD1 3.31Å; F353-F462 WeakPolarHBondContact O-CD1 3.35Å; C354-F462 HydrophobicContact CB-CD1 4.42Å; C354-F462 HydrophobicContact CB-CE1 3.59Å; C354-F462 HydrophobicContact CB-CE2 3.92Å; C354-F462 HydrophobicContact CB-CZ 3.29Å; C354-F462 VanDerWaalsContact SG-CE2 3.58Å; C354-F462 VanDerWaalsContact SG-CZ 3.56Å; W376-F462 WeakPolarHBondContact CA-O 3.43Å; A377-F462 PolarHBondContact N-O 3.11Å; A377-F462 PolarHBondContact O-N 3.45Å; K379-F462 HydrophobicContact CD-CE2 4.44Å; K379-F462 HydrophobicContact CD-CZ 4.45Å; K379-F462 HydrophobicContact CG-CE2 3.7Å; K379-F462 HydrophobicContact CG-CZ 4.13Å; G460-F462 WeakPolarHBondContact O-CD2 3.09Å; G460-F462 WeakPolarHBondContact O-CE2 3.27Å; F462-A464 PolarHBondContact O-N 3.24Å
463	A	98.7	Very high	96.6	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	133.7	160.8	0	0	0	0	0	108.3	R350 C351 Y362 F477 F493	R350-A463 CarbonylContact C-O 3.49Å; R350-A463 WeakPolarHBondContact CA-O 3.13Å; C351-A463 HydrophobicContact CB-CB 4.25Å; C351-A463 PolarHBondContact N-O 2.82Å; C351-A463 PolarHBondContact SG-N 3.19Å; Y362-A463 HydrophobicContact CD1-CB 3.94Å; Y362-A463 HydrophobicContact CD2-CB 4.4Å; Y362-A463 HydrophobicContact CE1-CB 3.5Å; Y362-A463 VanDerWaalsContact CE1-CB 3.5Å; Y362-A463 HydrophobicContact CE2-CB 4.03Å; Y362-A463 HydrophobicContact CG-CB 4.37Å; A463-F477 HydrophobicContact CB-CE1 3.6Å; A463-F477 HydrophobicContact CB-CZ 4.32Å; A463-F493 HydrophobicContact CB-CE1 4.31Å; A463-F493 HydrophobicContact CB-CZ 3.96Å
464	A	98.6	Very high	96.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	157.5	-172.9	0	0	0	0	0	111.7	V349 R350 G375 A377 I391 F462	V349-A464 CarbonylContact O-C 3.5Å; V349-A464 WeakPolarHBondContact O-CA 3.26Å; V349-A464 WeakPolarHBondContact O-CB 3.29Å; R350-A464 HydrophobicContact CG-CB 3.9Å; G375-A464 PolarHBondContact N-O 3.42Å; G375-A464 PolarHBondContact O-N 2.89Å; A377-A464 HydrophobicContact CB-CB 3.75Å; I391-A464 HydrophobicContact CD1-CB 3.68Å; I391-A464 HydrophobicContact CG1-CB 3.78Å; I391-A464 HydrophobicContact CG2-CB 4.34Å; F462-A464 PolarHBondContact O-N 3.24Å
465	A	98.6	Very high	96.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.2	173.8	0	0	0	0	0	112.8	S348 V349 Q373 I374 F467 F475	S348-A465 CarbonylContact C-O 3.48Å; S348-A465 VanDerWaalsContact CA-O 3.25Å; S348-A465 WeakPolarHBondContact CA-O 3.27Å; V349-A465 PolarHBondContact N-O 3.23Å; V349-A465 PolarHBondContact O-N 3.32Å; Q373-A465 CarbonylContact O-C 3.58Å; Q373-A465 VanDerWaalsContact O-CA 3.23Å; Q373-A465 WeakPolarHBondContact O-CA 3.43Å; I374-A465 HydrophobicContact CB-CB 4.38Å; I374-A465 HydrophobicContact CG1-CB 4Å; I374-A465 HydrophobicContact CG2-CB 4.22Å; A465-F467 HydrophobicContact CB-CD2 4.37Å; A465-F467 HydrophobicContact CB-CE2 3.52Å; A465-F467 HydrophobicContact CB-CZ 3.8Å; A465-F475 HydrophobicContact CB-CE1 4.31Å; A465-F475 HydrophobicContact CB-CZ 3.63Å
466	S	98.2	Very high	97	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.6	169.8	-56.9	0	0	0	0	110.7	E347 S348 M372 Q373 G390 I391	E347-S466 CarbonylContact O-C 3.33Å; E347-S466 VanDerWaalsContact O-CA 3.24Å; E347-S466 WeakPolarHBondContact O-CA 3.29Å; S348-S466 WeakPolarHBondContact CB-OG 3.49Å; S348-S466 WeakPolarHBondContact OG-CB 3.37Å; S348-S466 PolarHBondContact OG-OG 3.33Å; M372-S466 CarbonylContact C-O 3.57Å; M372-S466 VanDerWaalsContact CA-O 3.3Å; M372-S466 WeakPolarHBondContact CA-O 3.14Å; Q373-S466 PolarHBondContact N-O 3.39Å; Q373-S466 PolarHBondContact O-N 3.32Å; G390-S466 WeakPolarHBondContact CA-OG 3.43Å; I391-S466 WeakPolarHBondContact CG1-OG 3.1Å; I391-S466 PolarHBondContact N-OG 3.03Å
467	F	97.3	Very high	97.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.3	-169	-62	-99.4	0	0	0	110.8	L330 A339 C341 F346 E347 V349 M372 A465 Q471 C473 F475	L330-F467 HydrophobicContact CD1-CB 4.3Å; L330-F467 HydrophobicContact CD1-CD2 3.7Å; L330-F467 HydrophobicContact CD1-CE2 4.23Å; L330-F467 HydrophobicContact CD1-CG 4.06Å; L330-F467 HydrophobicContact CD2-CD2 4.31Å; L330-F467 HydrophobicContact CD2-CE2 4.23Å; A339-F467 HydrophobicContact CB-CE2 4.29Å; A339-F467 HydrophobicContact CB-CZ 3.96Å; C341-F467 HydrophobicContact CB-CB 3.54Å; C341-F467 HydrophobicContact CB-CG 4.49Å; F346-F467 VanDerWaalsContact CD2-C 3.4Å; F346-F467 WeakPolarHBondContact CD2-O 3.5Å; E347-F467 PolarHBondContact N-O 3.47Å; E347-F467 PolarHBondContact O-N 3.05Å; V349-F467 HydrophobicContact CG1-CE2 4.11Å; M372-F467 HydrophobicContact CG-CD1 3.78Å; M372-F467 HydrophobicContact CG-CE1 4.32Å; M372-F467 HydrophobicContact CG-CG 4.46Å; M372-F467 HydrophobicContact SD-CD1 3.58Å; M372-F467 VanDerWaalsContact SD-CD1 3.58Å; M372-F467 HydrophobicContact SD-CE1 3.64Å; A465-F467 HydrophobicContact CB-CD2 4.37Å; A465-F467 HydrophobicContact CB-CE2 3.52Å; A465-F467 HydrophobicContact CB-CZ 3.8Å; F467-Q471 HydrophobicContact CD1-CB 4.28Å; F467-C473 HydrophobicContact CE1-CB 4.39Å; F467-C473 WeakPolarHBondContact CE1-SG 3.37Å; F467-C473 VanDerWaalsContact CZ-SG 3.51Å; F467-F475 HydrophobicContact CZ-CE2 4.17Å; F467-F475 HydrophobicContact CZ-CZ 4.33Å
468	M	93.9	Very high	97.4	Very high	50 Å²	50	13.2 Å²	13.2	25%	0.246	8%	0.083	C	C	.	.			trans	-71.7	169.1	163.6	-161.5	178.8	-172.1	0	0	109.9	A157 F346 V371 Y470 Q471	A157-M468 HydrophobicContact CB-CE 4.26Å; A157-M468 HydrophobicContact CB-SD 4.45Å; F346-M468 HydrophobicContact CD2-CB 4.42Å; F346-M468 HydrophobicContact CE2-CB 4.46Å; V371-M468 HydrophobicContact CB-CB 4.01Å; V371-M468 HydrophobicContact CB-SD 3.92Å; V371-M468 HydrophobicContact CG1-CB 4.46Å; V371-M468 HydrophobicContact CG2-SD 4.15Å; V371-M468 WeakPolarHBondContact O-CB 3.28Å; V371-M468 PolarHBondContact O-N 2.88Å; V371-M468 VanDerWaalsContact O-N 3.1Å; M468-Y470 PolarHBondContact O-N 3.28Å; M468-Q471 HydrophobicContact CB-CG 4.23Å; M468-Q471 WeakPolarHBondContact O-CB 3.39Å; M468-Q471 WeakPolarHBondContact O-CG 3.44Å; M468-Q471 PolarHBondContact O-N 3.3Å
469	S	92.9	Very high	97.5	Very high	4 Å²	4	11 Å²	11	3%	0.028	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	137	173.8	-47	0	0	0	0	112.9	A343 S344 Q471	A343-S469 WeakPolarHBondContact O-CA 3.4Å; A343-S469 VanDerWaalsContact O-CB 3.27Å; A343-S469 WeakPolarHBondContact O-CB 3.27Å; A343-S469 PolarHBondContact O-OG 3.17Å; S344-S469 WeakPolarHBondContact CA-OG 3.32Å; S469-Q471 PolarHBondContact O-N 3.17Å; S469-Q471 PolarHBondContact O-NE2 3.46Å
470	Y	96.1	Very high	97.5	Very high	13 Å²	13	12.2 Å²	12.2	5%	0.051	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	18	175.3	-41.8	-56.4	0	0	0	115.1	P156 T160 F244 I247 C341 D342 M468	P156-Y470 HydrophobicContact CB-CD2 3.82Å; P156-Y470 HydrophobicContact CB-CE2 3.93Å; P156-Y470 HydrophobicContact CG-CD2 4.44Å; T160-Y470 WeakPolarHBondContact OG1-CE2 3.32Å; T160-Y470 PolarHBondContact OG1-OH 3.12Å; F244-Y470 AromaticContact CE1-CD1 3.78Å; F244-Y470 HydrophobicContact CE1-CD1 3.78Å; F244-Y470 AromaticContact CE1-CD2 3.92Å; F244-Y470 HydrophobicContact CE1-CD2 3.92Å; F244-Y470 AromaticContact CE1-CE1 3.79Å; F244-Y470 HydrophobicContact CE1-CE1 3.79Å; F244-Y470 AromaticContact CE1-CE2 3.89Å; F244-Y470 HydrophobicContact CE1-CE2 3.89Å; F244-Y470 AromaticContact CE1-CG 3.84Å; F244-Y470 HydrophobicContact CE1-CG 3.84Å; F244-Y470 AromaticContact CE1-CZ 3.83Å; F244-Y470 HydrophobicContact CZ-CD1 4.11Å; F244-Y470 HydrophobicContact CZ-CD2 4.03Å; F244-Y470 HydrophobicContact CZ-CE2 4.45Å; F244-Y470 AromaticContact CZ-CG 3.83Å; F244-Y470 HydrophobicContact CZ-CG 3.83Å; I247-Y470 HydrophobicContact CD1-CD1 4.06Å; I247-Y470 HydrophobicContact CD1-CE1 4.32Å; I247-Y470 HydrophobicContact CG2-CE1 4.29Å; C341-Y470 CarbonylContact O-C 3.5Å; C341-Y470 WeakPolarHBondContact O-CA 3.49Å; C341-Y470 PolarHBondContact O-N 3.09Å; D342-Y470 HydrophobicContact CB-CD1 4.44Å; M468-Y470 PolarHBondContact O-N 3.28Å
471	Q	97.2	Very high	97.5	Very high	5 Å²	5	17.6 Å²	17.6	2%	0.023	10%	0.103	C	C	.	.			trans	-97.6	146.7	-179.9	-54.4	-45.4	-50.7	0	0	113.4	R340 C341 T368 G370 V371 M372 F467 M468 S469	R340-Q471 CarbonylContact C-O 3.6Å; R340-Q471 VanDerWaalsContact CA-O 3.23Å; R340-Q471 WeakPolarHBondContact CA-O 3.36Å; C341-Q471 PolarHBondContact N-O 3.25Å; C341-Q471 PolarHBondContact O-N 3.08Å; T368-Q471 VanDerWaalsContact OG1-CA 3.25Å; T368-Q471 WeakPolarHBondContact OG1-CA 3.47Å; T368-Q471 PolarHBondContact OG1-OE1 3.11Å; G370-Q471 VanDerWaalsContact CA-CD 3.46Å; V371-Q471 WeakPolarHBondContact O-CG 3.31Å; M372-Q471 HydrophobicContact CG-CB 3.54Å; M372-Q471 HydrophobicContact CG-CG 4.05Å; M372-Q471 HydrophobicContact SD-CB 3.84Å; F467-Q471 HydrophobicContact CD1-CB 4.28Å; M468-Q471 HydrophobicContact CB-CG 4.23Å; M468-Q471 WeakPolarHBondContact O-CB 3.39Å; M468-Q471 WeakPolarHBondContact O-CG 3.44Å; M468-Q471 PolarHBondContact O-N 3.3Å; S469-Q471 PolarHBondContact O-N 3.17Å; S469-Q471 PolarHBondContact O-NE2 3.46Å
472	Q	98.5	Very high	97.6	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139.5	-174.4	-174.4	168.2	-16.8	0	0	112.1	E338 A339 R340 I367 T368	E338-Q472 HydrophobicContact CG-CG 4.27Å; E338-Q472 PolarHBondContact OE1-NE2 3.29Å; A339-Q472 VanDerWaalsContact O-CA 3.27Å; A339-Q472 WeakPolarHBondContact O-CA 3.19Å; A339-Q472 WeakPolarHBondContact O-CG 3.4Å; R340-Q472 HydrophobicContact CB-CB 4.13Å; R340-Q472 HydrophobicContact CB-CG 4.04Å; R340-Q472 VanDerWaalsContact CD-OE1 3.31Å; R340-Q472 HydrophobicContact CG-CB 4.1Å; R340-Q472 HydrophobicContact CG-CG 4.42Å; I367-Q472 HydrophobicContact CB-CB 4.06Å; I367-Q472 HydrophobicContact CB-CG 3.89Å; I367-Q472 WeakPolarHBondContact CB-O 3.46Å; I367-Q472 HydrophobicContact CG1-CG 4.22Å; I367-Q472 HydrophobicContact CG2-CB 4.26Å; I367-Q472 HydrophobicContact CG2-CG 3.97Å; I367-Q472 PolarHBondContact N-O 2.94Å; I367-Q472 VanDerWaalsContact N-O 3.12Å; T368-Q472 HydrophobicContact CG2-CB 4.11Å; T368-Q472 PolarHBondContact N-O 2.96Å; T368-Q472 PolarHBondContact OG1-N 2.94Å; T368-Q472 PolarHBondContact OG1-O 3.46Å
473	C	98.6	Very high	97.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	162	171.5	74.8	0	0	0	0	112.2	E338 A339 V364 T365 M372 F467 F475	E338-C473 WeakPolarHBondContact CA-O 3.35Å; A339-C473 PolarHBondContact N-O 3.48Å; A339-C473 PolarHBondContact O-N 3.49Å; A339-C473 VanDerWaalsContact O-N 3.15Å; V364-C473 HydrophobicContact CG1-CB 3.61Å; T365-C473 WeakPolarHBondContact O-CA 3.39Å; T365-C473 WeakPolarHBondContact O-CB 3.43Å; M372-C473 HydrophobicContact CE-CB 4.47Å; M372-C473 HydrophobicContact SD-CB 4.08Å; F467-C473 HydrophobicContact CE1-CB 4.39Å; F467-C473 WeakPolarHBondContact CE1-SG 3.37Å; F467-C473 VanDerWaalsContact CZ-SG 3.51Å; C473-F475 WeakPolarHBondContact SG-CE2 3.4Å
474	E	98.7	Very high	97.5	Very high	24 Å²	24	28 Å²	28	11%	0.112	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.8	179.1	-178.2	-163.3	-126.6	0	0	110.9	R286 L337 E338 V364 T365 K480	R286-E474 IonicContact CZ-OE1 3.8Å; R286-E474 IonicContact NH1-OE1 3.85Å; R286-E474 VanDerWaalsContact NH2-CD 3.27Å; R286-E474 IonicContact NH2-OE1 2.83Å; R286-E474 PolarHBondContact NH2-OE1 3.45Å; R286-E474 IonicContact NH2-OE2 3.96Å; L337-E474 CarbonylContact O-C 3.58Å; L337-E474 WeakPolarHBondContact O-CA 3.19Å; E338-E474 HydrophobicContact CB-CB 4.4Å; E338-E474 HydrophobicContact CB-CG 4.44Å; E338-E474 HydrophobicContact CG-CB 4.4Å; V364-E474 CarbonylContact C-O 3.56Å; V364-E474 VanDerWaalsContact CA-O 3.27Å; V364-E474 WeakPolarHBondContact CA-O 3.45Å; T365-E474 PolarHBondContact N-O 2.93Å; T365-E474 PolarHBondContact O-N 2.91Å; E474-K480 IonicContact OE1-NZ 3.47Å; E474-K480 PolarHBondContact OE1-NZ 2.94Å; E474-K480 IonicContact OE2-NZ 2.62Å; E474-K480 PolarHBondContact OE2-NZ 3.12Å
475	F	98.8	Very high	97.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	138.9	178.2	-64.4	-102.8	0	0	0	111.4	L321 L337 Y362 V364 I374 A465 F467 C473 F477	L321-F475 HydrophobicContact CD1-CD2 3.75Å; L321-F475 HydrophobicContact CD1-CE2 3.81Å; L321-F475 HydrophobicContact CD2-CD1 4.25Å; L321-F475 HydrophobicContact CD2-CD2 3.89Å; L321-F475 HydrophobicContact CD2-CE1 4.22Å; L321-F475 HydrophobicContact CD2-CE2 3.86Å; L321-F475 HydrophobicContact CD2-CG 4.1Å; L321-F475 HydrophobicContact CD2-CZ 4.04Å; L321-F475 HydrophobicContact CG-CD2 4.08Å; L321-F475 HydrophobicContact CG-CE2 4.33Å; L337-F475 WeakPolarHBondContact CB-O 3.35Å; L337-F475 PolarHBondContact O-N 3.42Å; Y362-F475 HydrophobicContact CD2-CD1 4.41Å; Y362-F475 HydrophobicContact CE2-CD1 4.14Å; Y362-F475 HydrophobicContact CE2-CE1 4.34Å; V364-F475 HydrophobicContact CG2-CD1 3.54Å; V364-F475 HydrophobicContact CG2-CE1 3.72Å; V364-F475 HydrophobicContact CG2-CG 4.11Å; V364-F475 HydrophobicContact CG2-CZ 4.42Å; I374-F475 HydrophobicContact CG2-CE1 4.27Å; A465-F475 HydrophobicContact CB-CE1 4.31Å; A465-F475 HydrophobicContact CB-CZ 3.63Å; F467-F475 HydrophobicContact CZ-CE2 4.17Å; F467-F475 HydrophobicContact CZ-CZ 4.33Å; C473-F475 WeakPolarHBondContact SG-CE2 3.4Å; F475-F477 HydrophobicContact CB-CD2 4.35Å; F475-F477 HydrophobicContact CB-CE1 4.26Å; F475-F477 HydrophobicContact CB-CE2 3.75Å; F475-F477 HydrophobicContact CB-CZ 3.7Å; F475-F477 HydrophobicContact CD1-CE1 4.04Å; F475-F477 AromaticContact CD1-CZ 3.68Å; F475-F477 HydrophobicContact CD1-CZ 3.68Å; F475-F477 HydrophobicContact CG-CE2 4.32Å; F475-F477 AromaticContact CG-CZ 3.89Å; F475-F477 HydrophobicContact CG-CZ 3.89Å
476	N	98.8	Very high	97.4	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	105.4	166.6	-179	15.3	0	0	0	108.9	Y362 E363 G478 A479 K480 F482	Y362-N476 WeakPolarHBondContact CB-O 3.31Å; E363-N476 HydrophobicContact CB-CB 4.34Å; E363-N476 PolarHBondContact N-O 3.47Å; E363-N476 VanDerWaalsContact N-O 3.11Å; E363-N476 PolarHBondContact O-N 3.18Å; N476-G478 PolarHBondContact O-N 2.79Å; N476-G478 PolarHBondContact OD1-N 3.33Å; N476-A479 PolarHBondContact OD1-N 3.21Å; N476-K480 HydrophobicContact CB-CG 4.27Å; N476-K480 VanDerWaalsContact CG-CG 3.42Å; N476-K480 VanDerWaalsContact ND2-CG 3.32Å; N476-K480 WeakPolarHBondContact ND2-CG 3.01Å; N476-K480 PolarHBondContact ND2-O 3.29Å; N476-K480 WeakPolarHBondContact OD1-CG 3.41Å; N476-K480 PolarHBondContact OD1-N 2.93Å; N476-K480 PolarHBondContact OD1-O 2.75Å; N476-F482 HydrophobicContact CB-CE1 4.41Å; N476-F482 VanDerWaalsContact ND2-CD1 3.3Å; N476-F482 WeakPolarHBondContact ND2-CD1 3.21Å; N476-F482 WeakPolarHBondContact O-CE1 3.33Å
477	F	98.8	Very high	97.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-86.4	10.5	176.9	-68.6	-50.5	0	0	0	113.4	A319 L321 L337 C351 Y362 A463 F475 F493 N494	A319-F477 HydrophobicContact CB-CB 4.08Å; A319-F477 HydrophobicContact CB-CD2 4.38Å; A319-F477 HydrophobicContact CB-CG 4.28Å; A319-F477 WeakPolarHBondContact O-CD2 3.18Å; L321-F477 HydrophobicContact CD2-CE2 4.44Å; L321-F477 HydrophobicContact CD2-CZ 4.15Å; L337-F477 HydrophobicContact CD2-CD2 3.62Å; L337-F477 HydrophobicContact CD2-CE2 4.03Å; C351-F477 HydrophobicContact CB-CE1 4.03Å; C351-F477 HydrophobicContact CB-CE2 4.18Å; C351-F477 HydrophobicContact CB-CZ 3.65Å; Y362-F477 HydrophobicContact CD2-CE1 4.25Å; Y362-F477 HydrophobicContact CG-CD1 4.4Å; Y362-F477 HydrophobicContact CG-CE1 4.41Å; A463-F477 HydrophobicContact CB-CE1 3.6Å; A463-F477 HydrophobicContact CB-CZ 4.32Å; F475-F477 HydrophobicContact CB-CD2 4.35Å; F475-F477 HydrophobicContact CB-CE1 4.26Å; F475-F477 HydrophobicContact CB-CE2 3.75Å; F475-F477 HydrophobicContact CB-CZ 3.7Å; F475-F477 HydrophobicContact CD1-CE1 4.04Å; F475-F477 AromaticContact CD1-CZ 3.68Å; F475-F477 HydrophobicContact CD1-CZ 3.68Å; F475-F477 HydrophobicContact CG-CE2 4.32Å; F475-F477 AromaticContact CG-CZ 3.89Å; F475-F477 HydrophobicContact CG-CZ 3.89Å; F477-F493 HydrophobicContact CB-CB 3.89Å; F477-F493 HydrophobicContact CB-CG 4.43Å; F477-F493 HydrophobicContact CD1-CB 4.47Å; F477-F493 HydrophobicContact CD1-CD1 4.46Å; F477-F493 HydrophobicContact CD1-CD2 4.14Å; F477-F493 HydrophobicContact CD1-CE2 4.49Å; F477-F493 HydrophobicContact CD1-CG 4.13Å; F477-F493 HydrophobicContact CG-CB 4.46Å; F477-F493 WeakPolarHBondContact O-CB 3.3Å; F477-F493 PolarHBondContact O-N 3.03Å; F477-N494 WeakPolarHBondContact O-CB 3.39Å; F477-N494 PolarHBondContact O-N 3.47Å
478	G	98.1	Very high	97.2	Very high	19 Å²	19	41.8 Å²	41.8	20%	0.196	23%	0.234	C	C	.	.	S	Bend	trans	101.8	7.6	-174.3	0	0	0	0	0	113.9	N476 K480	N476-G478 PolarHBondContact O-N 2.79Å; N476-G478 PolarHBondContact OD1-N 3.33Å; G478-K480 VanDerWaalsContact C-N 3.29Å
479	A	96.3	Very high	97.4	Very high	31 Å²	31	48.8 Å²	48.8	26%	0.256	26%	0.264	S	S	.	.	S	Bend	trans	-71.5	-25.7	174.5	0	0	0	0	0	112.6	I317 N476 N494	I317-A479 HydrophobicContact CD1-CB 3.85Å; N476-A479 PolarHBondContact OD1-N 3.21Å; A479-N494 WeakPolarHBondContact CA-ND2 3.42Å
480	K	95.9	Very high	97.6	Very high	83 Å²	83	51.4 Å²	51.4	36%	0.361	28%	0.275	S	S	.	.	S	Bend	trans	-123	155.4	169.8	63.4	-176.6	176.2	-176.1	0	109.9	E474 N476 G478 F482	E474-K480 IonicContact OE1-NZ 3.47Å; E474-K480 PolarHBondContact OE1-NZ 2.94Å; E474-K480 IonicContact OE2-NZ 2.62Å; E474-K480 PolarHBondContact OE2-NZ 3.12Å; N476-K480 HydrophobicContact CB-CG 4.27Å; N476-K480 VanDerWaalsContact CG-CG 3.42Å; N476-K480 VanDerWaalsContact ND2-CG 3.32Å; N476-K480 WeakPolarHBondContact ND2-CG 3.01Å; N476-K480 PolarHBondContact ND2-O 3.29Å; N476-K480 WeakPolarHBondContact OD1-CG 3.41Å; N476-K480 PolarHBondContact OD1-N 2.93Å; N476-K480 PolarHBondContact OD1-O 2.75Å; G478-K480 VanDerWaalsContact C-N 3.29Å; K480-F482 PolarHBondContact O-N 2.89Å
481	P	97.6	Very high	97.7	Very high	126 Å²	126	51.9 Å²	51.9	82%	0.818	28%	0.28	S	S	*	.			trans	-53.4	136.5	175.4	-25.7	34.8	0	0	0	111.9
482	F	98.6	Very high	97.7	Very high	33 Å²	33	52.3 Å²	52.3	15%	0.145	28%	0.283	C	S	.	.			trans	-67.6	143.4	173.6	-63.9	-55.6	0	0	0	111	Y361 E363 N476 K480 P485 F490 T492	Y361-F482 HydrophobicContact CD1-CD1 4.34Å; Y361-F482 HydrophobicContact CD1-CD2 4.01Å; Y361-F482 HydrophobicContact CD1-CE1 4.31Å; Y361-F482 AromaticContact CD1-CE2 3.98Å; Y361-F482 HydrophobicContact CD1-CE2 3.98Å; Y361-F482 HydrophobicContact CD1-CG 4.2Å; Y361-F482 HydrophobicContact CD1-CZ 4.14Å; Y361-F482 HydrophobicContact CE1-CB 4.43Å; Y361-F482 HydrophobicContact CE1-CD1 4.16Å; Y361-F482 HydrophobicContact CE1-CD2 4.27Å; Y361-F482 HydrophobicContact CE1-CG 4.04Å; E363-F482 HydrophobicContact CB-CD1 4.01Å; E363-F482 HydrophobicContact CB-CE1 4.43Å; E363-F482 HydrophobicContact CG-CB 4.4Å; E363-F482 HydrophobicContact CG-CD1 3.64Å; E363-F482 HydrophobicContact CG-CE1 4.33Å; E363-F482 HydrophobicContact CG-CG 4.32Å; E363-F482 VanDerWaalsContact OE2-CA 3.26Å; E363-F482 WeakPolarHBondContact OE2-CA 3.16Å; N476-F482 HydrophobicContact CB-CE1 4.41Å; N476-F482 VanDerWaalsContact ND2-CD1 3.3Å; N476-F482 WeakPolarHBondContact ND2-CD1 3.21Å; N476-F482 WeakPolarHBondContact O-CE1 3.33Å; K480-F482 PolarHBondContact O-N 2.89Å; F482-P485 HydrophobicContact CB-CB 4.16Å; F482-F490 AromaticContact CD2-CE2 3.98Å; F482-F490 HydrophobicContact CD2-CE2 3.98Å; F482-F490 HydrophobicContact CD2-CZ 4.14Å; F482-F490 AromaticContact CE2-CE2 3.73Å; F482-F490 HydrophobicContact CE2-CE2 3.73Å; F482-F490 HydrophobicContact CE2-CZ 4.35Å; F482-T492 HydrophobicContact CE2-CG2 3.56Å; F482-T492 HydrophobicContact CZ-CG2 4.04Å
483	K	98.4	Very high	97.7	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.517	28%	0.283	S	S	.	.	S	Bend	trans	-79.1	-35.9	179.5	-169.7	177.3	174.6	-172.7	0	111.6	E363 T426	E363-K483 PolarHBondContact OE1-N 2.71Å; E363-K483 PolarHBondContact OE2-N 3.25Å; T426-K483 HydrophobicContact CG2-CB 4.48Å; T426-K483 WeakPolarHBondContact OG1-CD 3.44Å
484	Y	98.5	Very high	97.6	Very high	78 Å²	78	53.1 Å²	53.1	31%	0.306	29%	0.287	S	S	.	.	S	Bend	trans	-136.1	60.2	-176.9	-55.1	-74.1	0	0	0	112.1	Y361 E363 T426 N443	Y361-Y484 PolarHBondContact OH-O 3.25Å; Y361-Y484 VanDerWaalsContact OH-O 3.05Å; E363-Y484 WeakPolarHBondContact OE1-CA 3.3Å; E363-Y484 PolarHBondContact OE1-N 3.13Å; T426-Y484 HydrophobicContact CG2-CD2 4.09Å; N443-Y484 HydrophobicContact CB-CD2 4.45Å; N443-Y484 HydrophobicContact CB-CE1 4.47Å; N443-Y484 HydrophobicContact CB-CE2 3.87Å; N443-Y484 WeakPolarHBondContact OD1-CE2 3.39Å
485	P	97.9	Very high	97.6	Very high	73 Å²	73	56.7 Å²	56.7	47%	0.474	31%	0.307	S	S	.	.			trans	-61.3	138.4	179.1	27.5	-34.7	0	0	0	111.2	F482 F490	F482-P485 HydrophobicContact CB-CB 4.16Å; P485-F490 HydrophobicContact CB-CE1 4.19Å; P485-F490 HydrophobicContact CB-CZ 3.93Å
486	P	96.9	Very high	97.5	Very high	17 Å²	17	63.6 Å²	63.6	11%	0.11	33%	0.334	C	S	.	.			trans	-69.5	159.2	176.9	29.5	-35.1	0	0	0	111	Y361 L430 Y441 I488 F490	Y361-P486 HydrophobicContact CD2-CG 3.84Å; Y361-P486 HydrophobicContact CE2-CG 3.97Å; Y361-P486 HydrophobicContact CG-CG 4.12Å; L430-P486 HydrophobicContact CD1-CB 4.43Å; L430-P486 HydrophobicContact CD1-CG 3.77Å; Y441-P486 HydrophobicContact CE1-CB 4.18Å; P486-I488 HydrophobicContact CB-CG1 4.39Å; P486-I488 HydrophobicContact CG-CG1 4.43Å; P486-I488 PolarHBondContact O-N 3.44Å; P486-F490 HydrophobicContact CG-CD1 3.67Å; P486-F490 HydrophobicContact CG-CE1 3.71Å
487	S	95.1	Very high	97.4	Very high	130 Å²	130	63.7 Å²	63.7	91%	0.909	34%	0.335	S	S	*	.	S	Bend	trans	-73.7	-13.8	-178.9	57.5	0	0	0	0	114.3
488	I	95.4	Very high	97.3	Very high	68 Å²	68	71.3 Å²	71.3	35%	0.349	37%	0.369	S	S	.	.	S	Bend	trans	-80.8	158.3	179	71.9	175.3	0	0	0	110.5	V359 L430 P486 F490	V359-I488 HydrophobicContact CG1-CD1 4.01Å; L430-I488 HydrophobicContact CD1-CD1 3.45Å; L430-I488 VanDerWaalsContact CD1-CD1 3.45Å; L430-I488 HydrophobicContact CD1-CG1 3.8Å; L430-I488 HydrophobicContact CD2-CD1 3.55Å; L430-I488 HydrophobicContact CG-CD1 4.1Å; P486-I488 HydrophobicContact CB-CG1 4.39Å; P486-I488 HydrophobicContact CG-CG1 4.43Å; P486-I488 PolarHBondContact O-N 3.44Å; I488-F490 WeakPolarHBondContact O-CD1 3.24Å
489	K	97.4	Very high	97.2	Very high	198 Å²	198	71.1 Å²	71.1	86%	0.861	36%	0.363	S	S	*	.			trans	-74.1	133.9	173.2	-68.9	-174.6	178.6	-178	0	109.7
490	F	98.1	Very high	97.2	Very high	58 Å²	58	71.9 Å²	71.9	25%	0.254	37%	0.365	S	S	.	.			trans	-144.2	161.1	178.5	58.2	-95.2	0	0	0	110.6	V359 Y361 F482 P485 P486 I488 T492	V359-F490 HydrophobicContact CG1-CB 4.17Å; V359-F490 CarbonylContact O-C 3.39Å; V359-F490 WeakPolarHBondContact O-CA 3.33Å; Y361-F490 HydrophobicContact CD1-CE2 4.23Å; Y361-F490 HydrophobicContact CD1-CZ 4.32Å; Y361-F490 HydrophobicContact CG-CD2 4.44Å; F482-F490 AromaticContact CD2-CE2 3.98Å; F482-F490 HydrophobicContact CD2-CE2 3.98Å; F482-F490 HydrophobicContact CD2-CZ 4.14Å; F482-F490 AromaticContact CE2-CE2 3.73Å; F482-F490 HydrophobicContact CE2-CE2 3.73Å; F482-F490 HydrophobicContact CE2-CZ 4.35Å; P485-F490 HydrophobicContact CB-CE1 4.19Å; P485-F490 HydrophobicContact CB-CZ 3.93Å; P486-F490 HydrophobicContact CG-CD1 3.67Å; P486-F490 HydrophobicContact CG-CE1 3.71Å; I488-F490 WeakPolarHBondContact O-CD1 3.24Å; F490-T492 HydrophobicContact CD2-CG2 4.23Å; F490-T492 HydrophobicContact CE2-CG2 3.98Å
491	S	98.4	Very high	97.1	Very high	24 Å²	24	71.2 Å²	71.2	17%	0.168	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-96.5	152.6	168.2	-65.7	0	0	0	0	110.4	V359 W360 Y361 Y496	V359-S491 PolarHBondContact O-N 3.03Å; W360-S491 WeakPolarHBondContact CA-O 3.33Å; Y361-S491 PolarHBondContact N-O 2.97Å; Y361-S491 VanDerWaalsContact N-O 3.12Å; S491-Y496 WeakPolarHBondContact OG-CE2 3.44Å
492	T	97.9	Very high	96.8	Very high	13 Å²	13	71.6 Å²	71.6	8%	0.08	37%	0.366	C	S	.	.			trans	-110.2	148.9	173	83.9	0	0	0	0	109.7	W360 F482 F490 N494 D495 Y496	W360-T492 WeakPolarHBondContact CZ3-O 3.38Å; F482-T492 HydrophobicContact CE2-CG2 3.56Å; F482-T492 HydrophobicContact CZ-CG2 4.04Å; F490-T492 HydrophobicContact CD2-CG2 4.23Å; F490-T492 HydrophobicContact CE2-CG2 3.98Å; T492-N494 VanDerWaalsContact C-N 3.27Å; T492-N494 PolarHBondContact O-N 3.38Å; T492-D495 WeakPolarHBondContact CG2-OD2 3.37Å; T492-D495 PolarHBondContact O-N 3.45Å; T492-D495 PolarHBondContact OG1-N 2.91Å; T492-D495 PolarHBondContact OG1-OD2 2.89Å; T492-Y496 WeakPolarHBondContact O-CD2 3.49Å
493	F	98.2	Very high	96.5	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-42.5	177.6	-67.4	-109.7	0	0	0	110.7	A319 F353 V355 W360 Y362 W376 A463 F477 D495 Y496 A497	A319-F493 HydrophobicContact CB-CB 3.69Å; F353-F493 HydrophobicContact CB-CD1 4.1Å; F353-F493 AromaticContact CD1-CD1 3.77Å; F353-F493 HydrophobicContact CD1-CD1 3.77Å; F353-F493 HydrophobicContact CD1-CE1 4.38Å; F353-F493 HydrophobicContact CG-CD1 4.39Å; V355-F493 HydrophobicContact CG2-CE1 3.93Å; V355-F493 HydrophobicContact CG2-CZ 4.17Å; W360-F493 HydrophobicContact CE3-CD2 4.36Å; Y362-F493 AromaticContact CD1-CE2 3.75Å; Y362-F493 HydrophobicContact CD1-CE2 3.75Å; Y362-F493 HydrophobicContact CD1-CZ 4.13Å; Y362-F493 HydrophobicContact CG-CE2 4.19Å; W376-F493 AromaticContact CH2-CE2 3.83Å; W376-F493 HydrophobicContact CH2-CE2 3.83Å; W376-F493 AromaticContact CH2-CZ 3.54Å; W376-F493 HydrophobicContact CH2-CZ 3.54Å; W376-F493 HydrophobicContact CZ3-CE1 4.43Å; W376-F493 HydrophobicContact CZ3-CE2 4.29Å; W376-F493 AromaticContact CZ3-CZ 3.52Å; W376-F493 HydrophobicContact CZ3-CZ 3.52Å; A463-F493 HydrophobicContact CB-CE1 4.31Å; A463-F493 HydrophobicContact CB-CZ 3.96Å; F477-F493 HydrophobicContact CB-CB 3.89Å; F477-F493 HydrophobicContact CB-CG 4.43Å; F477-F493 HydrophobicContact CD1-CB 4.47Å; F477-F493 HydrophobicContact CD1-CD1 4.46Å; F477-F493 HydrophobicContact CD1-CD2 4.14Å; F477-F493 HydrophobicContact CD1-CE2 4.49Å; F477-F493 HydrophobicContact CD1-CG 4.13Å; F477-F493 HydrophobicContact CG-CB 4.46Å; F477-F493 WeakPolarHBondContact O-CB 3.3Å; F477-F493 PolarHBondContact O-N 3.03Å; F493-D495 PolarHBondContact O-N 3.42Å; F493-Y496 PolarHBondContact O-N 2.78Å; F493-A497 WeakPolarHBondContact O-CB 3.4Å; F493-A497 PolarHBondContact O-N 2.95Å
494	N	96.9	Very high	96.4	Very high	17 Å²	17	71.1 Å²	71.1	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-66.2	-24.6	-176.4	-149	63.6	0	0	0	113.4	N316 R318 F477 A479 T492	N316-N494 PolarHBondContact O-ND2 2.95Å; N316-N494 PolarHBondContact O-OD1 3.41Å; R318-N494 WeakPolarHBondContact CB-OD1 3.4Å; R318-N494 WeakPolarHBondContact CD-O 3.24Å; R318-N494 PolarHBondContact N-OD1 3Å; F477-N494 WeakPolarHBondContact O-CB 3.39Å; F477-N494 PolarHBondContact O-N 3.47Å; A479-N494 WeakPolarHBondContact CA-ND2 3.42Å; T492-N494 VanDerWaalsContact C-N 3.27Å; T492-N494 PolarHBondContact O-N 3.38Å
495	D	96.7	Very high	96.1	Very high	100 Å²	100	70.6 Å²	70.6	54%	0.535	37%	0.367	S	S	.	.	H	α-helix	trans	-74.1	-29.4	177	-67.1	-38.7	0	0	0	112.9	T492 F493	T492-D495 WeakPolarHBondContact CG2-OD2 3.37Å; T492-D495 PolarHBondContact O-N 3.45Å; T492-D495 PolarHBondContact OG1-N 2.91Å; T492-D495 PolarHBondContact OG1-OD2 2.89Å; F493-D495 PolarHBondContact O-N 3.42Å
496	Y	97.6	Very high	95.9	Very high	145 Å²	145	68.3 Å²	68.3	57%	0.569	35%	0.351	S	S	*	.	H	α-helix	trans	-114.4	-28.7	-169.2	-71.1	-94	0	0	0	114.3	W360 S491 T492 F493	W360-Y496 HydrophobicContact CH2-CD1 4.38Å; W360-Y496 AromaticContact CH2-CD2 3.76Å; W360-Y496 HydrophobicContact CH2-CD2 3.76Å; W360-Y496 AromaticContact CH2-CG 3.67Å; W360-Y496 HydrophobicContact CH2-CG 3.67Å; W360-Y496 AromaticContact CZ3-CD2 4Å; W360-Y496 HydrophobicContact CZ3-CD2 4Å; W360-Y496 HydrophobicContact CZ3-CG 4.26Å; S491-Y496 WeakPolarHBondContact OG-CE2 3.44Å; T492-Y496 WeakPolarHBondContact O-CD2 3.49Å; F493-Y496 PolarHBondContact O-N 2.78Å
497	A	97.3	Very high	95.7	Very high	5 Å²	5	70.1 Å²	70.1	4%	0.041	36%	0.359	C	S	.	.			trans	-71.5	157.4	-179.7	0	0	0	0	0	111.6	R318 A319 F353 F493	R318-A497 HydrophobicContact CB-CB 4.41Å; R318-A497 WeakPolarHBondContact CB-O 3.31Å; R318-A497 WeakPolarHBondContact O-CB 3.09Å; A319-A497 HydrophobicContact CB-CB 3.87Å; F353-A497 HydrophobicContact CB-CB 3.84Å; F353-A497 HydrophobicContact CD1-CB 4.33Å; F353-A497 HydrophobicContact CD2-CB 3.37Å; F353-A497 HydrophobicContact CE2-CB 3.96Å; F353-A497 HydrophobicContact CG-CB 3.58Å; F493-A497 WeakPolarHBondContact O-CB 3.4Å; F493-A497 PolarHBondContact O-N 2.95Å
498	F	96.3	Very high	95.6	Very high	160 Å²	160	64.2 Å²	64.2	70%	0.702	32%	0.317	S	S	*	.			trans	-140.1	136.8	173	176	-94.4	0	0	0	108.3	T500	F498-T500 HydrophobicContact CE1-CG2 4Å
499	L	96.6	Very high	95.1	Very high	15 Å²	15	68.2 Å²	68.2	8%	0.079	33%	0.328	C	S	.	.			trans	-132.1	134.3	172.6	-65.8	167.1	0	0	0	107.8	R318 M320 T352 E503 K504	R318-L499 WeakPolarHBondContact O-CD1 3.49Å; R318-L499 WeakPolarHBondContact O-CG 3.24Å; M320-L499 HydrophobicContact CG-CD1 3.8Å; M320-L499 HydrophobicContact SD-CD1 3.77Å; T352-L499 HydrophobicContact CG2-CD2 4.1Å; L499-E503 WeakPolarHBondContact CA-OE2 3.5Å; L499-E503 HydrophobicContact CB-CB 4.19Å; L499-E503 HydrophobicContact CD2-CB 4.01Å; L499-K504 HydrophobicContact CB-CD 4.39Å; L499-K504 HydrophobicContact CB-CG 3.67Å; L499-K504 HydrophobicContact CD1-CG 4.14Å; L499-K504 WeakPolarHBondContact O-CE 3.44Å
500	T	95.8	Very high	94.6	Very high	47 Å²	47	61.4 Å²	61.4	29%	0.288	30%	0.299	S	S	.	.			trans	-65.1	168.4	170	80.4	0	0	0	0	110.7	F498 E502 E503 K504	F498-T500 HydrophobicContact CE1-CG2 4Å; T500-E502 VanDerWaalsContact CB-OE2 3.29Å; T500-E502 WeakPolarHBondContact CB-OE2 3.35Å; T500-E502 PolarHBondContact O-N 3.19Å; T500-E502 PolarHBondContact OG1-N 3.25Å; T500-E502 PolarHBondContact OG1-OE2 2.95Å; T500-E503 PolarHBondContact N-OE2 3.31Å; T500-E503 PolarHBondContact O-N 3.38Å; T500-E503 PolarHBondContact OG1-N 2.95Å; T500-K504 VanDerWaalsContact O-CG 3.31Å; T500-K504 WeakPolarHBondContact O-CG 3.35Å; T500-K504 PolarHBondContact O-N 2.99Å
501	A	93.1	Very high	94.2	Very high	69 Å²	69	64.1 Å²	64.1	57%	0.57	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.7	176.1	0	0	0	0	0	111.2	K504 I505	A501-K504 PolarHBondContact O-N 3.41Å; A501-I505 WeakPolarHBondContact O-CG1 3.45Å
502	E	91.3	Very high	93.7	Very high	135 Å²	135	68.2 Å²	68.2	63%	0.631	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-42.4	179.8	-58.1	72.2	-157.1	0	0	112	T500 K504 I505	T500-E502 VanDerWaalsContact CB-OE2 3.29Å; T500-E502 WeakPolarHBondContact CB-OE2 3.35Å; T500-E502 PolarHBondContact O-N 3.19Å; T500-E502 PolarHBondContact OG1-N 3.25Å; T500-E502 PolarHBondContact OG1-OE2 2.95Å; E502-K504 PolarHBondContact O-N 3.23Å; E502-I505 PolarHBondContact O-N 3.01Å; E502-I505 VanDerWaalsContact O-N 3.09Å
503	E	93	Very high	93	Very high	110 Å²	110	71.4 Å²	71.4	51%	0.514	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-22.2	178.3	-69.9	174.9	145.4	0	0	113.1	L499 T500 I505	L499-E503 WeakPolarHBondContact CA-OE2 3.5Å; L499-E503 HydrophobicContact CB-CB 4.19Å; L499-E503 HydrophobicContact CD2-CB 4.01Å; T500-E503 PolarHBondContact N-OE2 3.31Å; T500-E503 PolarHBondContact O-N 3.38Å; T500-E503 PolarHBondContact OG1-N 2.95Å; E503-I505 VanDerWaalsContact C-N 3.34Å
504	K	95	Very high	92.4	Very high	31 Å²	31	73.2 Å²	73.2	14%	0.135	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-12.3	176	-66.8	174.5	-177.7	-164.3	0	113.6	L314 I317 M320 L499 T500 A501 E502 I506	L314-K504 HydrophobicContact CB-CB 4.49Å; L314-K504 HydrophobicContact CB-CD 4.02Å; L314-K504 HydrophobicContact CD1-CB 3.77Å; L314-K504 WeakPolarHBondContact CD1-O 3.28Å; L314-K504 PolarHBondContact O-NZ 3.28Å; I317-K504 WeakPolarHBondContact O-CE 3.33Å; I317-K504 PolarHBondContact O-NZ 2.81Å; M320-K504 HydrophobicContact SD-CB 4.36Å; M320-K504 HydrophobicContact SD-CG 4.44Å; L499-K504 HydrophobicContact CB-CD 4.39Å; L499-K504 HydrophobicContact CB-CG 3.67Å; L499-K504 HydrophobicContact CD1-CG 4.14Å; L499-K504 WeakPolarHBondContact O-CE 3.44Å; T500-K504 VanDerWaalsContact O-CG 3.31Å; T500-K504 WeakPolarHBondContact O-CG 3.35Å; T500-K504 PolarHBondContact O-N 2.99Å; A501-K504 PolarHBondContact O-N 3.41Å; E502-K504 PolarHBondContact O-N 3.23Å; K504-I506 PolarHBondContact O-N 3.13Å
505	I	93.9	Very high	91.8	Very high	68 Å²	68	76.4 Å²	76.4	35%	0.349	37%	0.367	S	S	.	.			trans	-85	113.1	-174.7	-61.5	171	0	0	0	110	Y309 A501 E502 E503 L507	Y309-I505 HydrophobicContact CD2-CG2 3.72Å; Y309-I505 HydrophobicContact CE2-CG2 4.3Å; Y309-I505 HydrophobicContact CG-CG2 4.38Å; A501-I505 WeakPolarHBondContact O-CG1 3.45Å; E502-I505 PolarHBondContact O-N 3.01Å; E502-I505 VanDerWaalsContact O-N 3.09Å; E503-I505 VanDerWaalsContact C-N 3.34Å; I505-L507 HydrophobicContact CG2-CD2 3.55Å; I505-L507 HydrophobicContact CG2-CG 3.78Å; I505-L507 PolarHBondContact O-N 3.35Å
506	I	93.8	Very high	91	Very high	25 Å²	25	76.9 Å²	76.9	13%	0.128	37%	0.369	C	S	.	.			trans	-90.2	102.5	165.3	-60.6	-176.6	0	0	0	108.4	M320 I332 S333 K504	M320-I506 HydrophobicContact CE-CD1 3.65Å; M320-I506 HydrophobicContact CE-CG1 3.84Å; I332-I506 HydrophobicContact CB-CD1 4.01Å; I332-I506 HydrophobicContact CG2-CD1 3.39Å; S333-I506 WeakPolarHBondContact O-CD1 3.33Å; K504-I506 PolarHBondContact O-N 3.13Å
507	L	91.9	Very high	89.9	Confident	54 Å²	54	78.7 Å²	78.7	28%	0.283	38%	0.38	S	S	.	.			trans	-77	136.9	-177.7	-71.8	173.9	0	0	0	112.2	Y309 I505 R511 R512 L515	Y309-L507 HydrophobicContact CD2-CD2 4.33Å; Y309-L507 HydrophobicContact CE2-CD2 4Å; I505-L507 HydrophobicContact CG2-CD2 3.55Å; I505-L507 HydrophobicContact CG2-CG 3.78Å; I505-L507 PolarHBondContact O-N 3.35Å; L507-R511 HydrophobicContact CD2-CB 4.41Å; L507-R512 HydrophobicContact CB-CB 4.24Å; L507-L515 HydrophobicContact CD1-CD1 3.35Å
508	P	92.4	Very high	88.6	Confident	6 Å²	6	85.5 Å²	85.5	4%	0.039	41%	0.411	C	S	.	.			trans	-58.6	148.2	167.2	-22.9	33.2	0	0	0	111.7	D297 N298 Y309 H510 R511 R512	D297-P508 HydrophobicContact CB-CB 4.43Å; D297-P508 HydrophobicContact CB-CG 4.12Å; D297-P508 VanDerWaalsContact O-CB 3.25Å; D297-P508 WeakPolarHBondContact O-CB 3.42Å; N298-P508 VanDerWaalsContact OD1-CA 3.31Å; N298-P508 WeakPolarHBondContact OD1-CA 3.42Å; Y309-P508 HydrophobicContact CD1-CG 3.69Å; Y309-P508 HydrophobicContact CE1-CG 3.88Å; P508-H510 VanDerWaalsContact C-N 3.28Å; P508-H510 PolarHBondContact O-N 2.87Å; P508-H510 VanDerWaalsContact O-N 3.14Å; P508-R511 WeakPolarHBondContact O-CB 3.41Å; P508-R511 PolarHBondContact O-N 2.91Å; P508-R512 PolarHBondContact O-N 2.98Å
509	R	84.6	Confident	87.1	Confident	153 Å²	153	82.4 Å²	82.4	58%	0.577	41%	0.405	S	S	*	.	H	α-helix	trans	-52.5	-44	-171.7	-173.8	177.4	-179.9	175.4	2.8	113	N298 R511 R512 L513	N298-R509 PolarHBondContact OD1-N 2.97Å; R509-R511 PolarHBondContact O-N 3.35Å; R509-R512 PolarHBondContact O-N 3.37Å; R509-L513 HydrophobicContact CG-CD1 3.99Å; R509-L513 HydrophobicContact CG-CG 4.44Å; R509-L513 WeakPolarHBondContact O-CB 3.25Å; R509-L513 VanDerWaalsContact O-CG 3.25Å; R509-L513 WeakPolarHBondContact O-CG 3.49Å; R509-L513 PolarHBondContact O-N 3.43Å
510	H	87.8	Confident	85	Confident	55 Å²	55	86.3 Å²	86.3	26%	0.255	43%	0.434	S	S	.	.	H	α-helix	trans	-67.3	-34.4	-178.9	73	-84	0	0	0	112.8	D297 P508 A514	D297-H510 PolarHBondContact O-CE1 2.98Å; D297-H510 PolarHBondContact O-ND1 3.22Å; P508-H510 VanDerWaalsContact C-N 3.28Å; P508-H510 PolarHBondContact O-N 2.87Å; P508-H510 VanDerWaalsContact O-N 3.14Å; H510-A514 WeakPolarHBondContact O-CB 3.34Å; H510-A514 PolarHBondContact O-N 3.41Å
511	R	90.7	Very high	83.1	Confident	114 Å²	114	89.1 Å²	89.1	43%	0.43	45%	0.446	S	S	.	.	H	α-helix	trans	-71.4	-44.9	173.9	-67	-57.7	-172.9	166.2	3.5	111.2	L307 L507 P508 R509 L513 A514 L515	L307-R511 HydrophobicContact CD1-CG 4.26Å; L507-R511 HydrophobicContact CD2-CB 4.41Å; P508-R511 WeakPolarHBondContact O-CB 3.41Å; P508-R511 PolarHBondContact O-N 2.91Å; R509-R511 PolarHBondContact O-N 3.35Å; R511-L513 VanDerWaalsContact C-N 3.34Å; R511-L513 PolarHBondContact O-N 3.25Å; R511-A514 PolarHBondContact O-N 2.94Å; R511-A514 VanDerWaalsContact O-N 3.14Å; R511-L515 WeakPolarHBondContact O-CG 3.45Å; R511-L515 PolarHBondContact O-N 3.17Å
512	R	86.3	Confident	81.5	Confident	111 Å²	111	94.3 Å²	94.3	42%	0.419	45%	0.45	S	S	.	.	H	α-helix	trans	-56.6	-48.2	174.8	-172.2	173	70.1	174.6	1.7	111.1	L507 P508 R509 A514 L515 L516	L507-R512 HydrophobicContact CB-CB 4.24Å; P508-R512 PolarHBondContact O-N 2.98Å; R509-R512 PolarHBondContact O-N 3.37Å; R512-A514 VanDerWaalsContact C-N 3.35Å; R512-A514 PolarHBondContact O-N 2.88Å; R512-L515 PolarHBondContact O-N 3.38Å; R512-L516 HydrophobicContact CG-CD1 4.29Å; R512-L516 WeakPolarHBondContact O-CG 3.42Å; R512-L516 PolarHBondContact O-N 3.01Å
513	L	84.1	Confident	80	Confident	80 Å²	80	97.1 Å²	97.1	42%	0.419	46%	0.464	S	S	.	.	H	α-helix	trans	-62.6	-38.5	175.9	-72.6	170.5	0	0	0	112.7	R509 R511 L516 K517	R509-L513 HydrophobicContact CG-CD1 3.99Å; R509-L513 HydrophobicContact CG-CG 4.44Å; R509-L513 WeakPolarHBondContact O-CB 3.25Å; R509-L513 VanDerWaalsContact O-CG 3.25Å; R509-L513 WeakPolarHBondContact O-CG 3.49Å; R509-L513 PolarHBondContact O-N 3.43Å; R511-L513 VanDerWaalsContact C-N 3.34Å; R511-L513 PolarHBondContact O-N 3.25Å; L513-L516 PolarHBondContact O-N 3.42Å; L513-K517 VanDerWaalsContact O-CG 3.29Å; L513-K517 WeakPolarHBondContact O-CG 3.49Å; L513-K517 PolarHBondContact O-N 3.39Å
514	A	86.2	Confident	79.2	Confident	38 Å²	38	97.2 Å²	97.2	31%	0.314	47%	0.468	S	S	.	.	H	α-helix	trans	-65.3	-41.1	176.3	0	0	0	0	0	112	H510 R511 R512 K517 Q518	H510-A514 WeakPolarHBondContact O-CB 3.34Å; H510-A514 PolarHBondContact O-N 3.41Å; R511-A514 PolarHBondContact O-N 2.94Å; R511-A514 VanDerWaalsContact O-N 3.14Å; R512-A514 VanDerWaalsContact C-N 3.35Å; R512-A514 PolarHBondContact O-N 2.88Å; A514-K517 PolarHBondContact O-N 3.44Å; A514-Q518 VanDerWaalsContact O-CG 3.3Å; A514-Q518 WeakPolarHBondContact O-CG 3.45Å; A514-Q518 PolarHBondContact O-N 3.32Å; A514-Q518 VanDerWaalsContact O-N 3.1Å
515	L	83.8	Confident	78.7	Confident	84 Å²	84	96.3 Å²	96.3	44%	0.44	47%	0.465	S	S	.	.	H	α-helix	trans	-65.2	-45.2	174.5	-69.4	177.3	0	0	0	111.5	L507 R511 R512 K517 Q518 V519	L507-L515 HydrophobicContact CD1-CD1 3.35Å; R511-L515 WeakPolarHBondContact O-CG 3.45Å; R511-L515 PolarHBondContact O-N 3.17Å; R512-L515 PolarHBondContact O-N 3.38Å; L515-K517 PolarHBondContact O-N 3.36Å; L515-Q518 CarbonylContact O-C 3.56Å; L515-Q518 WeakPolarHBondContact O-CA 3.46Å; L515-Q518 WeakPolarHBondContact O-CB 3.5Å; L515-Q518 PolarHBondContact O-N 3.09Å; L515-V519 WeakPolarHBondContact O-CG2 3.38Å; L515-V519 PolarHBondContact O-N 3.21Å
516	L	78.6	Confident	78.2	Confident	109 Å²	109	93 Å²	93	57%	0.571	45%	0.448	S	S	*	.	H	α-helix	trans	-58.9	-36.4	175.8	-72.1	170.5	0	0	0	112.1	R512 L513 Q518 V519	R512-L516 HydrophobicContact CG-CD1 4.29Å; R512-L516 WeakPolarHBondContact O-CG 3.42Å; R512-L516 PolarHBondContact O-N 3.01Å; L513-L516 PolarHBondContact O-N 3.42Å; L516-Q518 VanDerWaalsContact C-N 3.3Å; L516-Q518 PolarHBondContact O-N 3.49Å; L516-V519 PolarHBondContact O-N 2.8Å
517	K	75.8	Confident	77.8	Confident	183 Å²	183	94.9 Å²	94.9	80%	0.796	46%	0.461	S	S	*	.	H	α-helix	trans	-69.1	-26.1	172.7	-73.6	176	-179.4	-172.5	0	113.6	L513 A514 L515	L513-K517 VanDerWaalsContact O-CG 3.29Å; L513-K517 WeakPolarHBondContact O-CG 3.49Å; L513-K517 PolarHBondContact O-N 3.39Å; A514-K517 PolarHBondContact O-N 3.44Å; L515-K517 PolarHBondContact O-N 3.36Å
518	Q	69.9	Low	77.3	Confident	148 Å²	148	94.1 Å²	94.1	69%	0.692	46%	0.457	S	S	*	.	H	α-helix	trans	-85.3	-21.9	177.9	-72.8	172.1	8.6	0	0	112.7	A514 L515 L516 S520	A514-Q518 VanDerWaalsContact O-CG 3.3Å; A514-Q518 WeakPolarHBondContact O-CG 3.45Å; A514-Q518 PolarHBondContact O-N 3.32Å; A514-Q518 VanDerWaalsContact O-N 3.1Å; L515-Q518 CarbonylContact O-C 3.56Å; L515-Q518 WeakPolarHBondContact O-CA 3.46Å; L515-Q518 WeakPolarHBondContact O-CB 3.5Å; L515-Q518 PolarHBondContact O-N 3.09Å; L516-Q518 VanDerWaalsContact C-N 3.3Å; L516-Q518 PolarHBondContact O-N 3.49Å; Q518-S520 VanDerWaalsContact C-N 3.27Å; Q518-S520 PolarHBondContact O-N 3.17Å
519	V	63.8	Low	76.8	Confident	96 Å²	96	94.8 Å²	94.8	58%	0.582	46%	0.461	S	S	*	.	S	Bend	trans	-66.5	93	166.5	-179.9	0	0	0	0	106.8	L515 L516 I521	L515-V519 WeakPolarHBondContact O-CG2 3.38Å; L515-V519 PolarHBondContact O-N 3.21Å; L516-V519 PolarHBondContact O-N 2.8Å; V519-I521 PolarHBondContact O-N 3.39Å
520	S	52.6	Low	76.4	Confident	97 Å²	97	89.4 Å²	89.4	68%	0.678	45%	0.447	S	S	*	.			trans	-63.5	104.4	167.2	70.5	0	0	0	0	106.7	Q518 R522	Q518-S520 VanDerWaalsContact C-N 3.27Å; Q518-S520 PolarHBondContact O-N 3.17Å; S520-R522 PolarHBondContact O-N 2.79Å
521	I	56.7	Low	75.9	Confident	105 Å²	105	90.4 Å²	90.4	54%	0.538	45%	0.454	S	S	.	.			trans	-43.4	112	150.6	-69.1	178.6	0	0	0	104.3	V519 E523 C525	V519-I521 PolarHBondContact O-N 3.39Å; I521-E523 PolarHBondContact O-N 2.94Å; I521-C525 WeakPolarHBondContact CG2-SG 3.48Å
522	R	59	Low	75.5	Confident	178 Å²	178	89.7 Å²	89.7	67%	0.672	46%	0.456	S	S	*	.			trans	-51.4	131.4	178.7	-68.9	179.7	-178.9	176	2	105.4	S520 N524 C525	S520-R522 PolarHBondContact O-N 2.79Å; R522-N524 PolarHBondContact O-N 3.35Å; R522-C525 PolarHBondContact O-N 3.31Å; R522-C525 PolarHBondContact O-SG 3.05Å
523	E	61.3	Low	75.5	Confident	194 Å²	194	89 Å²	89	91%	0.907	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-20.7	-174.4	-69.1	-177.4	161.6	0	0	113.1	I521	I521-E523 PolarHBondContact O-N 2.94Å
524	N	75.6	Confident	75.7	Confident	113 Å²	113	86.4 Å²	86.4	60%	0.604	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	13.5	-179.1	-54.4	-1.2	0	0	0	114.3	R522 I533 A534	R522-N524 PolarHBondContact O-N 3.35Å; N524-I533 HydrophobicContact CB-CG2 4.47Å; N524-I533 CarbonylContact O-C 3.6Å; N524-I533 VanDerWaalsContact O-CA 3.3Å; N524-I533 WeakPolarHBondContact O-CA 3.33Å; N524-I533 WeakPolarHBondContact O-CG2 3.28Å; N524-A534 PolarHBondContact O-N 3.19Å
525	C	84.1	Confident	76	Confident	11 Å²	11	85.9 Å²	85.9	7%	0.074	44%	0.441	C	S	.	.	B	Isolated β-bridge	trans	-89.6	152.4	175.6	68.1	0	0	0	0	112.6	I521 R522 T527 E532	I521-C525 WeakPolarHBondContact CG2-SG 3.48Å; R522-C525 PolarHBondContact O-N 3.31Å; R522-C525 PolarHBondContact O-SG 3.05Å; C525-T527 PolarHBondContact O-N 3.13Å; C525-E532 CarbonylContact C-O 3.43Å; C525-E532 VanDerWaalsContact CA-O 3.27Å; C525-E532 WeakPolarHBondContact CA-O 3.42Å; C525-E532 WeakPolarHBondContact CB-O 3.3Å
526	C	84.3	Confident	76.4	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	42%	0.42	C	S	.	.			trans	-51.2	126.3	177.1	176.3	0	0	0	0	110.4	L528 C529 C530 E532 C547 C550	C526-L528 PolarHBondContact O-N 3.47Å; C526-L528 PolarHBondContact SG-N 3.5Å; C526-L528 VanDerWaalsContact SG-N 3.42Å; C526-C529 WeakPolarHBondContact CB-SG 3.1Å; C526-C529 VanDerWaalsContact SG-SG 3.65Å; C526-C530 WeakPolarHBondContact O-CA 3.3Å; C526-C530 PolarHBondContact O-N 3.38Å; C526-E532 WeakPolarHBondContact CB-O 3.49Å; C526-E532 PolarHBondContact N-O 3.19Å; C526-C547 HydrophobicContact CB-CB 3.8Å; C526-C547 PolarHBondContact SG-N 2.77Å; C526-C550 VanDerWaalsContact SG-SG 3.66Å
527	T	83.8	Confident	77.1	Confident	64 Å²	64	78.3 Å²	78.3	39%	0.393	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.9	178.7	51.3	0	0	0	0	113.9	C525 D545 L546	C525-T527 PolarHBondContact O-N 3.13Å; T527-D545 WeakPolarHBondContact CB-O 3.4Å; T527-D545 HydrophobicContact CG2-CB 3.71Å; T527-D545 PolarHBondContact N-O 2.98Å; T527-D545 PolarHBondContact OG1-O 2.72Å; T527-L546 WeakPolarHBondContact OG1-CD2 3.45Å
528	L	81.8	Confident	78	Confident	38 Å²	38	69.7 Å²	69.7	20%	0.199	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-48.7	179.5	-155.7	104.1	0	0	0	112.9	C526 L546 C550 L554	C526-L528 PolarHBondContact O-N 3.47Å; C526-L528 PolarHBondContact SG-N 3.5Å; C526-L528 VanDerWaalsContact SG-N 3.42Å; L528-L546 HydrophobicContact CB-CD2 3.63Å; L528-L546 HydrophobicContact CD1-CD2 4.47Å; L528-C550 HydrophobicContact CB-CB 3.99Å; L528-C550 HydrophobicContact CD2-CB 3.75Å; L528-C550 HydrophobicContact CG-CB 4.49Å; L528-L554 HydrophobicContact CD1-CD1 4.23Å
529	C	82.8	Confident	79.1	Confident	19 Å²	19	68 Å²	68	13%	0.128	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-15.9	178.9	65.8	0	0	0	0	114	C526 D531 C550	C526-C529 WeakPolarHBondContact CB-SG 3.1Å; C526-C529 VanDerWaalsContact SG-SG 3.65Å; C529-D531 HydrophobicContact CB-CB 4.37Å; C529-D531 PolarHBondContact O-N 3.33Å; C529-C550 VanDerWaalsContact CB-SG 3.56Å
530	C	75.3	Confident	80.4	Confident	41 Å²	41	66.7 Å²	66.7	28%	0.277	34%	0.344	S	S	.	.	S	Bend	trans	53.6	20.3	-175.9	-58	0	0	0	0	114.7	C526	C526-C530 WeakPolarHBondContact O-CA 3.3Å; C526-C530 PolarHBondContact O-N 3.38Å
531	D	77.6	Confident	82.3	Confident	76 Å²	76	63.5 Å²	63.5	41%	0.406	32%	0.321	S	S	.	.	S	Bend	trans	-118.3	-66.5	-172.2	-170.6	3.1	0	0	0	110.4	F30 C529	F30-D531 WeakPolarHBondContact CE2-OD1 3.33Å; C529-D531 HydrophobicContact CB-CB 4.37Å; C529-D531 PolarHBondContact O-N 3.33Å
532	E	82.5	Confident	83.9	Confident	99 Å²	99	60.4 Å²	60.4	46%	0.463	32%	0.315	S	S	.	.	S	Bend	trans	-77.9	158	-178.9	-70.4	-61	149.5	0	0	112.8	C525 C526 C547	C525-E532 CarbonylContact C-O 3.43Å; C525-E532 VanDerWaalsContact CA-O 3.27Å; C525-E532 WeakPolarHBondContact CA-O 3.42Å; C525-E532 WeakPolarHBondContact CB-O 3.3Å; C526-E532 WeakPolarHBondContact CB-O 3.49Å; C526-E532 PolarHBondContact N-O 3.19Å; E532-C547 HydrophobicContact CB-CB 3.58Å
533	I	85.5	Confident	85.5	Confident	96 Å²	96	55 Å²	55	49%	0.492	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-64.9	136.1	176.4	-63.3	174.5	0	0	0	109.9	N524 D535 C547	N524-I533 HydrophobicContact CB-CG2 4.47Å; N524-I533 CarbonylContact O-C 3.6Å; N524-I533 VanDerWaalsContact O-CA 3.3Å; N524-I533 WeakPolarHBondContact O-CA 3.33Å; N524-I533 WeakPolarHBondContact O-CG2 3.28Å; I533-D535 VanDerWaalsContact C-N 3.33Å; I533-D535 HydrophobicContact CG2-CB 4.47Å; I533-D535 PolarHBondContact O-N 3.39Å; I533-C547 WeakPolarHBondContact O-CA 3.22Å; I533-C547 VanDerWaalsContact O-CB 3.24Å; I533-C547 WeakPolarHBondContact O-CB 3.29Å
534	A	89.5	Confident	87	Confident	25 Å²	25	47.7 Å²	47.7	21%	0.207	27%	0.268	C	S	.	.			trans	-66.9	91.4	169.4	0	0	0	0	0	109	N524	N524-A534 PolarHBondContact O-N 3.19Å
535	D	91.4	Very high	87.6	Confident	28 Å²	28	45.4 Å²	45.4	15%	0.15	26%	0.256	C	S	.	.			trans	-119.7	11.5	-169.3	72.1	-6.4	0	0	0	112.8	I533 L546 C547 M548 R569 Q570	I533-D535 VanDerWaalsContact C-N 3.33Å; I533-D535 HydrophobicContact CG2-CB 4.47Å; I533-D535 PolarHBondContact O-N 3.39Å; D535-L546 PolarHBondContact N-O 3.3Å; D535-L546 VanDerWaalsContact N-O 3.12Å; D535-C547 WeakPolarHBondContact OD1-CA 3.34Å; D535-M548 PolarHBondContact OD1-N 2.78Å; D535-R569 CarbonylContact O-C 3.45Å; D535-R569 VanDerWaalsContact O-CA 3.3Å; D535-R569 WeakPolarHBondContact O-CA 3.41Å; D535-R569 IonicContact OD1-NE 3.84Å; D535-R569 IonicContact OD2-CZ 2.74Å; D535-R569 VanDerWaalsContact OD2-CZ 3.23Å; D535-R569 IonicContact OD2-NE 3.45Å; D535-R569 PolarHBondContact OD2-NE 3.21Å; D535-R569 IonicContact OD2-NH2 3.41Å; D535-R569 PolarHBondContact OD2-NH2 3.42Å; D535-Q570 PolarHBondContact O-N 3.49Å
536	T	92.5	Very high	87.8	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	118	-170	-62.2	0	0	0	0	112.9	S544 L546 M548 A551 R567 V568	T536-S544 VanDerWaalsContact O-CA 3.3Å; T536-S544 WeakPolarHBondContact O-CA 3.37Å; T536-L546 WeakPolarHBondContact CB-O 3.48Å; T536-L546 PolarHBondContact N-O 3.32Å; T536-M548 HydrophobicContact CG2-CE 3.77Å; T536-M548 HydrophobicContact CG2-SD 4.04Å; T536-M548 WeakPolarHBondContact OG1-CA 3.5Å; T536-M548 WeakPolarHBondContact OG1-CB 3.42Å; T536-M548 WeakPolarHBondContact OG1-CE 3.08Å; T536-M548 PolarHBondContact OG1-N 3.25Å; T536-A551 HydrophobicContact CG2-CB 3.67Å; T536-R567 HydrophobicContact CG2-CB 3.94Å; T536-V568 CarbonylContact C-O 3.6Å; T536-V568 WeakPolarHBondContact CA-O 3.35Å
537	E	94.4	Very high	88.2	Confident	33 Å²	33	45.2 Å²	45.2	15%	0.154	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.1	173	-173	-170.7	128.7	0	0	110.9	R539 H543 R567 V568 Q570	E537-R539 IonicContact OE1-CZ 3.26Å; E537-R539 VanDerWaalsContact OE1-CZ 3.26Å; E537-R539 IonicContact OE1-NE 3.09Å; E537-R539 PolarHBondContact OE1-NE 3.31Å; E537-R539 IonicContact OE1-NH2 2.91Å; E537-R539 PolarHBondContact OE1-NH2 3.44Å; E537-R539 IonicContact OE2-NH2 2.76Å; E537-H543 WeakPolarHBondContact CA-O 3.34Å; E537-R567 WeakPolarHBondContact O-CA 3.29Å; E537-V568 HydrophobicContact CB-CB 4.48Å; E537-V568 PolarHBondContact N-O 3.25Å; E537-V568 PolarHBondContact O-N 3.22Å; E537-Q570 HydrophobicContact CB-CG 4.1Å; E537-Q570 PolarHBondContact OE2-NE2 3.37Å
538	L	94.6	Very high	88.6	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.3	175	-58.6	-175.8	0	0	0	110.6	C541 G542 H543 L546 A551 C557 I564 R567	L538-C541 PolarHBondContact O-N 3.08Å; L538-C541 PolarHBondContact O-SG 2.68Å; L538-G542 WeakPolarHBondContact O-CA 3.48Å; L538-G542 PolarHBondContact O-N 3.39Å; L538-H543 PolarHBondContact N-O 2.98Å; L538-L546 HydrophobicContact CD1-CD1 3.83Å; L538-L546 HydrophobicContact CG-CD1 4.48Å; L538-A551 HydrophobicContact CD2-CB 3.89Å; L538-C557 HydrophobicContact CD1-CB 3.94Å; L538-I564 HydrophobicContact CB-CG1 4.49Å; L538-I564 HydrophobicContact CB-CG2 4.47Å; L538-I564 HydrophobicContact CD1-CD1 3.75Å; L538-I564 HydrophobicContact CD1-CG1 4.11Å; L538-I564 HydrophobicContact CD2-CD1 4Å; L538-I564 HydrophobicContact CD2-CG1 4.39Å; L538-I564 HydrophobicContact CD2-CG2 3.98Å; L538-I564 HydrophobicContact CG-CD1 4.41Å; L538-R567 HydrophobicContact CD2-CG 3.87Å
539	R	92.9	Very high	89	Confident	113 Å²	113	48.6 Å²	48.6	43%	0.426	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	142.4	178.3	-70.1	-175.4	177.2	-155	-3.4	112	E537 Q565 T566	E537-R539 IonicContact OE1-CZ 3.26Å; E537-R539 VanDerWaalsContact OE1-CZ 3.26Å; E537-R539 IonicContact OE1-NE 3.09Å; E537-R539 PolarHBondContact OE1-NE 3.31Å; E537-R539 IonicContact OE1-NH2 2.91Å; E537-R539 PolarHBondContact OE1-NH2 3.44Å; E537-R539 IonicContact OE2-NH2 2.76Å; R539-Q565 PolarHBondContact O-N 3.44Å; R539-T566 VanDerWaalsContact CB-OG1 3.29Å; R539-T566 WeakPolarHBondContact CB-OG1 3.44Å; R539-T566 PolarHBondContact N-O 2.69Å; R539-T566 PolarHBondContact O-N 3.32Å
540	P	90.1	Very high	89.4	Confident	68 Å²	68	48.4 Å²	48.4	44%	0.442	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.5	-2.1	11.9	35.7	-38.5	0	0	0	115.9	G542 Q562	P540-G542 VanDerWaalsContact C-N 3.32Å; P540-G542 PolarHBondContact O-N 3.18Å; P540-Q562 HydrophobicContact CG-CG 4.44Å; P540-Q562 VanDerWaalsContact CG-NE2 3.34Å
541	C	93	Very high	90.1	Very high	30 Å²	30	46.4 Å²	46.4	20%	0.203	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-21.3	-172	56.8	0	0	0	0	115.8	L538 H543 C560 Q562	L538-C541 PolarHBondContact O-N 3.08Å; L538-C541 PolarHBondContact O-SG 2.68Å; C541-H543 VanDerWaalsContact C-N 3.31Å; C541-H543 PolarHBondContact O-N 3.04Å; C541-C560 WeakPolarHBondContact CB-SG 3.47Å; C541-Q562 HydrophobicContact CB-CB 4.33Å
542	G	90.5	Very high	90.8	Very high	40 Å²	40	48 Å²	48	41%	0.412	26%	0.258	S	S	.	.			trans	78.6	-1.2	178.5	0	0	0	0	0	116.1	L538 P540	L538-G542 WeakPolarHBondContact O-CA 3.48Å; L538-G542 PolarHBondContact O-N 3.39Å; P540-G542 VanDerWaalsContact C-N 3.32Å; P540-G542 PolarHBondContact O-N 3.18Å
543	H	92.6	Very high	91.3	Very high	63 Å²	63	51 Å²	51	29%	0.292	27%	0.272	S	S	.	.			trans	-66.1	138.3	176.8	-68.2	111.9	0	0	0	112.1	E537 L538 C541 C557 L559	E537-H543 WeakPolarHBondContact CA-O 3.34Å; L538-H543 PolarHBondContact N-O 2.98Å; C541-H543 VanDerWaalsContact C-N 3.31Å; C541-H543 PolarHBondContact O-N 3.04Å; H543-C557 PolarHBondContact ND1-SG 2.74Å; H543-C557 VanDerWaalsContact ND1-SG 3.44Å; H543-L559 HydrophobicContact CB-CD1 3.85Å
544	S	92	Very high	91.4	Very high	41 Å²	41	47.6 Å²	47.6	29%	0.287	26%	0.255	S	S	.	.			trans	-126.2	16.3	-173.4	58.1	0	0	0	0	114.7	T536 L546	T536-S544 VanDerWaalsContact O-CA 3.3Å; T536-S544 WeakPolarHBondContact O-CA 3.37Å; S544-L546 PolarHBondContact O-N 3.08Å; S544-L546 VanDerWaalsContact O-N 3.13Å
545	D	87.5	Confident	91.5	Very high	66 Å²	66	54.2 Å²	54.2	35%	0.353	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-83.2	18.8	-170.6	-51.7	-66	0	0	0	114.2	T527 L559	T527-D545 WeakPolarHBondContact CB-O 3.4Å; T527-D545 HydrophobicContact CG2-CB 3.71Å; T527-D545 PolarHBondContact N-O 2.98Å; T527-D545 PolarHBondContact OG1-O 2.72Å; D545-L559 HydrophobicContact CB-CD1 4.15Å; D545-L559 WeakPolarHBondContact OD2-CD1 3.22Å
546	L	89.1	Confident	91.6	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-129.1	145.9	-174.5	-62.7	175.3	0	0	0	111.3	T527 L528 D535 T536 L538 S544 A551 L554 P558	T527-L546 WeakPolarHBondContact OG1-CD2 3.45Å; L528-L546 HydrophobicContact CB-CD2 3.63Å; L528-L546 HydrophobicContact CD1-CD2 4.47Å; D535-L546 PolarHBondContact N-O 3.3Å; D535-L546 VanDerWaalsContact N-O 3.12Å; T536-L546 WeakPolarHBondContact CB-O 3.48Å; T536-L546 PolarHBondContact N-O 3.32Å; L538-L546 HydrophobicContact CD1-CD1 3.83Å; L538-L546 HydrophobicContact CG-CD1 4.48Å; S544-L546 PolarHBondContact O-N 3.08Å; S544-L546 VanDerWaalsContact O-N 3.13Å; L546-A551 HydrophobicContact CB-CB 4.37Å; L546-L554 HydrophobicContact CD1-CD1 3.7Å; L546-P558 HydrophobicContact CD1-CG 4.07Å
547	C	92.1	Very high	91.4	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.02	30%	0.296	C	S	.	.			trans	-75.5	160	164.9	73.6	0	0	0	0	110.3	C526 E532 I533 D535 E549 C550 A551	C526-C547 HydrophobicContact CB-CB 3.8Å; C526-C547 PolarHBondContact SG-N 2.77Å; E532-C547 HydrophobicContact CB-CB 3.58Å; I533-C547 WeakPolarHBondContact O-CA 3.22Å; I533-C547 VanDerWaalsContact O-CB 3.24Å; I533-C547 WeakPolarHBondContact O-CB 3.29Å; D535-C547 WeakPolarHBondContact OD1-CA 3.34Å; C547-E549 VanDerWaalsContact C-N 3.3Å; C547-E549 PolarHBondContact O-N 2.66Å; C547-C550 PolarHBondContact O-N 2.81Å; C547-A551 WeakPolarHBondContact O-CB 3.49Å; C547-A551 PolarHBondContact O-N 2.83Å
548	M	92.6	Very high	90.9	Very high	32 Å²	32	57.2 Å²	57.2	16%	0.158	30%	0.304	C	S	.	.	H	α-helix	trans	-57.3	-41.1	-178.5	-175.8	57.6	71.4	0	0	113.2	D535 T536 C550 A551 L552 R567 R569	D535-M548 PolarHBondContact OD1-N 2.78Å; T536-M548 HydrophobicContact CG2-CE 3.77Å; T536-M548 HydrophobicContact CG2-SD 4.04Å; T536-M548 WeakPolarHBondContact OG1-CA 3.5Å; T536-M548 WeakPolarHBondContact OG1-CB 3.42Å; T536-M548 WeakPolarHBondContact OG1-CE 3.08Å; T536-M548 PolarHBondContact OG1-N 3.25Å; M548-C550 PolarHBondContact O-N 3.38Å; M548-A551 PolarHBondContact O-N 3.32Å; M548-L552 HydrophobicContact CG-CD1 4.13Å; M548-L552 HydrophobicContact CG-CG 4.49Å; M548-L552 VanDerWaalsContact O-CG 3.28Å; M548-L552 WeakPolarHBondContact O-CG 3.49Å; M548-L552 PolarHBondContact O-N 3.39Å; M548-L552 HydrophobicContact SD-CD1 4.36Å; M548-L552 HydrophobicContact SD-CG 4.18Å; M548-R567 HydrophobicContact SD-CB 4.31Å; M548-R569 HydrophobicContact CE-CB 3.58Å; M548-R569 HydrophobicContact CE-CG 4.04Å
549	E	90.8	Very high	90.5	Very high	141 Å²	141	61.3 Å²	61.3	66%	0.659	33%	0.326	S	S	*	.	H	α-helix	trans	-63.9	-44	-178.2	-65.7	-172.7	171.2	0	0	111.9	C547 L552	C547-E549 VanDerWaalsContact C-N 3.3Å; C547-E549 PolarHBondContact O-N 2.66Å; E549-L552 PolarHBondContact O-N 3.44Å
550	C	90.7	Very high	90.3	Very high	15 Å²	15	58.6 Å²	58.6	10%	0.101	32%	0.323	C	S	.	.	H	α-helix	trans	-68.1	-41.5	176.1	-71.5	0	0	0	0	111.8	C526 L528 C529 C547 M548 L552 Q553	C526-C550 VanDerWaalsContact SG-SG 3.66Å; L528-C550 HydrophobicContact CB-CB 3.99Å; L528-C550 HydrophobicContact CD2-CB 3.75Å; L528-C550 HydrophobicContact CG-CB 4.49Å; C529-C550 VanDerWaalsContact CB-SG 3.56Å; C547-C550 PolarHBondContact O-N 2.81Å; M548-C550 PolarHBondContact O-N 3.38Å; C550-L552 VanDerWaalsContact C-N 3.25Å; C550-L552 PolarHBondContact O-N 2.89Å; C550-Q553 PolarHBondContact O-N 3.22Å; C550-Q553 VanDerWaalsContact O-N 3.17Å
551	A	90.9	Very high	90.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-35.3	178.5	0	0	0	0	0	112.4	T536 L538 L546 C547 M548 Q553 L554 R567	T536-A551 HydrophobicContact CG2-CB 3.67Å; L538-A551 HydrophobicContact CD2-CB 3.89Å; L546-A551 HydrophobicContact CB-CB 4.37Å; C547-A551 WeakPolarHBondContact O-CB 3.49Å; C547-A551 PolarHBondContact O-N 2.83Å; M548-A551 PolarHBondContact O-N 3.32Å; A551-Q553 VanDerWaalsContact C-N 3.27Å; A551-Q553 PolarHBondContact O-N 3.24Å; A551-L554 PolarHBondContact O-N 3.19Å; A551-R567 HydrophobicContact CB-CG 4.28Å; A551-R567 WeakPolarHBondContact O-CD 3.04Å; A551-R567 PolarHBondContact O-NE 2.82Å
552	L	92	Very high	90.3	Very high	108 Å²	108	68.2 Å²	68.2	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-68.1	-22.9	179.1	-74.4	169.1	0	0	0	113.7	M548 E549 C550 L554	M548-L552 HydrophobicContact CG-CD1 4.13Å; M548-L552 HydrophobicContact CG-CG 4.49Å; M548-L552 VanDerWaalsContact O-CG 3.28Å; M548-L552 WeakPolarHBondContact O-CG 3.49Å; M548-L552 PolarHBondContact O-N 3.39Å; M548-L552 HydrophobicContact SD-CD1 4.36Å; M548-L552 HydrophobicContact SD-CG 4.18Å; E549-L552 PolarHBondContact O-N 3.44Å; C550-L552 VanDerWaalsContact C-N 3.25Å; C550-L552 PolarHBondContact O-N 2.89Å; L552-L554 VanDerWaalsContact C-N 3.31Å
553	Q	91.9	Very high	90.5	Very high	162 Å²	162	73 Å²	73	76%	0.757	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.8	179.1	-59.6	-63.3	-14.6	0	0	113.6	C550 A551	C550-Q553 PolarHBondContact O-N 3.22Å; C550-Q553 VanDerWaalsContact O-N 3.17Å; A551-Q553 VanDerWaalsContact C-N 3.27Å; A551-Q553 PolarHBondContact O-N 3.24Å
554	L	88.3	Confident	90.6	Very high	26 Å²	26	70.6 Å²	70.6	14%	0.136	35%	0.351	C	S	.	.			trans	-115.3	131.1	-171.6	-60.8	171	0	0	0	110.7	L528 L546 A551 L552 P558 I564 R567	L528-L554 HydrophobicContact CD1-CD1 4.23Å; L546-L554 HydrophobicContact CD1-CD1 3.7Å; A551-L554 PolarHBondContact O-N 3.19Å; L552-L554 VanDerWaalsContact C-N 3.31Å; L554-P558 HydrophobicContact CD1-CG 4.07Å; L554-I564 HydrophobicContact CB-CD1 3.95Å; L554-I564 WeakPolarHBondContact O-CD1 3.42Å; L554-R567 PolarHBondContact O-NH2 3.35Å
555	E	91.9	Very high	90.6	Very high	164 Å²	164	75.2 Å²	75.2	77%	0.766	37%	0.368	S	S	*	.	S	Bend	trans	-89.1	-26	172.4	-64.7	-175.6	169.1	0	0	112.3	I564	E555-I564 PolarHBondContact O-N 3.45Å
556	T	92.8	Very high	90.9	Very high	75 Å²	75	75.4 Å²	75.4	46%	0.46	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-125	143.6	178.4	56.9	0	0	0	0	111.1	Q562 I564	T556-Q562 CarbonylContact C-O 3.56Å; T556-Q562 WeakPolarHBondContact CA-O 3.4Å; T556-I564 VanDerWaalsContact C-CD1 3.42Å
557	C	88.3	Confident	91.1	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	38%	0.384	C	S	.	.			trans	-61.9	125.3	177.3	177.8	0	0	0	0	109.9	L538 H543 L559 C560 R561 Q562 I564	L538-C557 HydrophobicContact CD1-CB 3.94Å; H543-C557 PolarHBondContact ND1-SG 2.74Å; H543-C557 VanDerWaalsContact ND1-SG 3.44Å; C557-L559 PolarHBondContact O-N 3.18Å; C557-C560 VanDerWaalsContact SG-SG 3.66Å; C557-R561 WeakPolarHBondContact O-CA 3.46Å; C557-R561 PolarHBondContact O-N 3.11Å; C557-Q562 PolarHBondContact N-O 3.13Å; C557-I564 HydrophobicContact CB-CG1 4.28Å
558	P	85.1	Confident	91.2	Very high	49 Å²	49	81.2 Å²	81.2	32%	0.318	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.6	-177	26.3	-32	0	0	0	112.5	L546 L554	L546-P558 HydrophobicContact CD1-CG 4.07Å; L554-P558 HydrophobicContact CD1-CG 4.07Å
559	L	84.6	Confident	91.1	Very high	89 Å²	89	86.4 Å²	86.4	47%	0.466	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-44.3	-176.3	-60.1	172.1	0	0	0	112.9	H543 D545 C557	H543-L559 HydrophobicContact CB-CD1 3.85Å; D545-L559 HydrophobicContact CB-CD1 4.15Å; D545-L559 WeakPolarHBondContact OD2-CD1 3.22Å; C557-L559 PolarHBondContact O-N 3.18Å
560	C	89.9	Confident	90.8	Very high	55 Å²	55	83.9 Å²	83.9	37%	0.372	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-0.4	-178.1	66.7	0	0	0	0	114.9	C541 C557 Q562	C541-C560 WeakPolarHBondContact CB-SG 3.47Å; C557-C560 VanDerWaalsContact SG-SG 3.66Å; C560-Q562 PolarHBondContact O-N 3.15Å; C560-Q562 VanDerWaalsContact O-N 3.13Å; C560-Q562 VanDerWaalsContact SG-CB 3.55Å
561	R	89.8	Confident	89.9	Confident	212 Å²	212	90.3 Å²	90.3	80%	0.8	44%	0.437	S	S	*	.			trans	61.8	13.4	-179.2	-51.6	-178.7	-179.9	-141.5	-1.5	114.9	C557	C557-R561 WeakPolarHBondContact O-CA 3.46Å; C557-R561 PolarHBondContact O-N 3.11Å
562	Q	93.4	Very high	88.3	Confident	89 Å²	89	95 Å²	95	42%	0.416	47%	0.47	S	S	.	.			trans	-75.2	141.4	175.6	-170.4	165	17.6	0	0	111.1	P540 C541 T556 C557 C560 I564	P540-Q562 HydrophobicContact CG-CG 4.44Å; P540-Q562 VanDerWaalsContact CG-NE2 3.34Å; C541-Q562 HydrophobicContact CB-CB 4.33Å; T556-Q562 CarbonylContact C-O 3.56Å; T556-Q562 WeakPolarHBondContact CA-O 3.4Å; C557-Q562 PolarHBondContact N-O 3.13Å; C560-Q562 PolarHBondContact O-N 3.15Å; C560-Q562 VanDerWaalsContact O-N 3.13Å; C560-Q562 VanDerWaalsContact SG-CB 3.55Å; Q562-I564 PolarHBondContact O-N 2.78Å
563	E	93.9	Very high	86	Confident	141 Å²	141	97.8 Å²	97.8	66%	0.659	48%	0.48	S	S	*	.	B	Isolated β-bridge	trans	-60.7	130.6	176.1	-167	-179.5	-179.1	0	0	111.4	Q565	E563-Q565 PolarHBondContact O-N 2.88Å
564	I	94.6	Very high	83.5	Confident	11 Å²	11	98.2 Å²	98.2	6%	0.056	49%	0.485	C	S	.	.			trans	-87.7	108.3	-177.3	-58.5	164.5	0	0	0	108.8	L538 L554 E555 T556 C557 Q562 R567	L538-I564 HydrophobicContact CB-CG1 4.49Å; L538-I564 HydrophobicContact CB-CG2 4.47Å; L538-I564 HydrophobicContact CD1-CD1 3.75Å; L538-I564 HydrophobicContact CD1-CG1 4.11Å; L538-I564 HydrophobicContact CD2-CD1 4Å; L538-I564 HydrophobicContact CD2-CG1 4.39Å; L538-I564 HydrophobicContact CD2-CG2 3.98Å; L538-I564 HydrophobicContact CG-CD1 4.41Å; L554-I564 HydrophobicContact CB-CD1 3.95Å; L554-I564 WeakPolarHBondContact O-CD1 3.42Å; E555-I564 PolarHBondContact O-N 3.45Å; T556-I564 VanDerWaalsContact C-CD1 3.42Å; C557-I564 HydrophobicContact CB-CG1 4.28Å; Q562-I564 PolarHBondContact O-N 2.78Å; I564-R567 HydrophobicContact CG2-CG 3.75Å; I564-R567 VanDerWaalsContact CG2-CZ 3.43Å
565	Q	93.4	Very high	80.8	Confident	138 Å²	138	105.5 Å²	105.5	65%	0.645	54%	0.538	S	S	*	.			trans	-84.1	-43	178	-64.3	-178.1	-3.5	0	0	111.7	R539 E563	R539-Q565 PolarHBondContact O-N 3.44Å; E563-Q565 PolarHBondContact O-N 2.88Å
566	T	92.8	Very high	80.2	Confident	71 Å²	71	102.6 Å²	102.6	44%	0.436	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.5	179.7	50.2	0	0	0	0	111.5	R539	R539-T566 VanDerWaalsContact CB-OG1 3.29Å; R539-T566 WeakPolarHBondContact CB-OG1 3.44Å; R539-T566 PolarHBondContact N-O 2.69Å; R539-T566 PolarHBondContact O-N 3.32Å
567	R	94.1	Very high	79.5	Confident	70 Å²	70	104 Å²	104	26%	0.264	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	118	180	-64.8	157.7	-167.3	73	2.1	107.2	T536 E537 L538 M548 A551 L554 I564	T536-R567 HydrophobicContact CG2-CB 3.94Å; E537-R567 WeakPolarHBondContact O-CA 3.29Å; L538-R567 HydrophobicContact CD2-CG 3.87Å; M548-R567 HydrophobicContact SD-CB 4.31Å; A551-R567 HydrophobicContact CB-CG 4.28Å; A551-R567 WeakPolarHBondContact O-CD 3.04Å; A551-R567 PolarHBondContact O-NE 2.82Å; L554-R567 PolarHBondContact O-NH2 3.35Å; I564-R567 HydrophobicContact CG2-CG 3.75Å; I564-R567 VanDerWaalsContact CG2-CZ 3.43Å
568	V	93.3	Very high	79.1	Confident	58 Å²	58	109.8 Å²	109.8	35%	0.352	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.2	119.9	-173.3	-177.5	0	0	0	0	109.1	T536 E537 Q570	T536-V568 CarbonylContact C-O 3.6Å; T536-V568 WeakPolarHBondContact CA-O 3.35Å; E537-V568 HydrophobicContact CB-CB 4.48Å; E537-V568 PolarHBondContact N-O 3.25Å; E537-V568 PolarHBondContact O-N 3.22Å; V568-Q570 PolarHBondContact O-N 2.87Å
569	R	90.6	Very high	78.7	Confident	141 Å²	141	113.4 Å²	113.4	53%	0.532	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.8	119.6	174.9	-150.8	170.4	-151.8	161.2	8.4	109.7	D535 M548 I571	D535-R569 CarbonylContact O-C 3.45Å; D535-R569 VanDerWaalsContact O-CA 3.3Å; D535-R569 WeakPolarHBondContact O-CA 3.41Å; D535-R569 IonicContact OD1-NE 3.84Å; D535-R569 IonicContact OD2-CZ 2.74Å; D535-R569 VanDerWaalsContact OD2-CZ 3.23Å; D535-R569 IonicContact OD2-NE 3.45Å; D535-R569 PolarHBondContact OD2-NE 3.21Å; D535-R569 IonicContact OD2-NH2 3.41Å; D535-R569 PolarHBondContact OD2-NH2 3.42Å; M548-R569 HydrophobicContact CE-CB 3.58Å; M548-R569 HydrophobicContact CE-CG 4.04Å; R569-I571 PolarHBondContact O-N 2.88Å
570	Q	85.3	Confident	78.3	Confident	87 Å²	87	114.9 Å²	114.9	41%	0.407	58%	0.581	S	S	.	*			trans	-83.2	110.5	173.1	-65	-165.4	-18.1	0	0	108.7	D535 E537 V568 S572	D535-Q570 PolarHBondContact O-N 3.49Å; E537-Q570 HydrophobicContact CB-CG 4.1Å; E537-Q570 PolarHBondContact OE2-NE2 3.37Å; V568-Q570 PolarHBondContact O-N 2.87Å; Q570-S572 PolarHBondContact O-N 3.32Å
571	I	71.8	Confident	77.6	Confident	151 Å²	151	118.9 Å²	118.9	77%	0.774	60%	0.595	S	S	*	*			trans	-82.4	99.4	173.7	-57.6	171	0	0	0	106.8	R569 H573	R569-I571 PolarHBondContact O-N 2.88Å; I571-H573 PolarHBondContact O-N 2.74Å
572	S	56.8	Low	76.7	Confident	99 Å²	99	112.2 Å²	112.2	69%	0.692	58%	0.58	S	S	*	*			trans	-69.8	112.9	169	53.6	0	0	0	0	109	Q570 I574	Q570-S572 PolarHBondContact O-N 3.32Å; S572-I574 PolarHBondContact O-N 2.76Å; S572-I574 VanDerWaalsContact O-N 3.13Å
573	H	43.2	Very low	75.4	Confident	165 Å²	165	114 Å²	114	76%	0.764	59%	0.593	S	S	*	*			trans	-59.9	114.5	163.3	-86.2	-84.4	0	0	0	108.2	I571 S575	I571-H573 PolarHBondContact O-N 2.74Å; H573-S575 PolarHBondContact O-N 2.91Å; H573-S575 PolarHBondContact O-OG 3.43Å
574	I	39.2	Very low	73.9	Confident	171 Å²	171	111.8 Å²	111.8	88%	0.877	59%	0.588	S	S	*	*			trans	-58.4	111	167.6	-58.7	170.2	0	0	0	106.3	S572	S572-I574 PolarHBondContact O-N 2.76Å; S572-I574 VanDerWaalsContact O-N 3.13Å
575	S	31.4	Very low	72	Confident	179 Å²	179	120.9 Å²	120.9	100%	1.252	64%	0.636	S	S	*	*			trans	-116.5	0	169.9	-47.8	0	0	0	0	108.4	H573	H573-S575 PolarHBondContact O-N 2.91Å; H573-S575 PolarHBondContact O-OG 3.43Å

Retrieved 575 of 575 residues in 929.5 ms (Link to these results)

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