A0A077Z9N1_TRITR Loading...

Sulfurtransferase

AlphaFold DB , UniProt , Accession A0A077Z9N1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 378 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	42.5	Very low	41.3	Very low	234 Å²	234	148.1 Å²	148.1	100%	1.153	77%	0.77	S	S	*	*				0	123.5	0	-91.8	179	171.2	0	0	107.6
2	L	40	Very low	41.2	Very low	163 Å²	163	143.4 Å²	143.4	85%	0.853	76%	0.76	S	S	*	*			trans	55.9	125	161.9	-57.4	166.1	0	0	0	117.9
3	S	39.6	Very low	41.7	Very low	82 Å²	82	150.5 Å²	150.5	57%	0.573	77%	0.772	S	S	*	*			cis	152	129.8	-18.3	53.6	0	0	0	0	106.5
4	T	43.9	Very low	41.8	Very low	124 Å²	124	151.1 Å²	151.1	76%	0.761	78%	0.778	S	S	*	*			trans	66.4	150.1	136.8	57.5	0	0	0	0	118.8
5	R	42.7	Very low	41.7	Very low	198 Å²	198	145.9 Å²	145.9	75%	0.747	78%	0.777	S	S	*	*			cis	-175.2	135.8	23.4	-126.8	179.1	-179.8	-176.4	0.6	105.2
6	R	42.7	Very low	42.2	Very low	188 Å²	188	144.7 Å²	144.7	71%	0.709	78%	0.779	S	S	*	*				85.4	138.1	91.1	-94.2	-164	-161.1	173.4	-1.9	118.4
7	D	42.6	Very low	42.3	Very low	118 Å²	118	143.3 Å²	143.3	63%	0.631	77%	0.772	S	S	*	*			trans	100.1	107.3	133.6	-66.5	-12.5	0	0	0	121.8
8	N	40.3	Very low	42.3	Very low	131 Å²	131	146.4 Å²	146.4	70%	0.701	77%	0.77	S	S	*	*				67.5	120.4	111.8	-73.8	-11.9	0	0	0	123.9
9	T	38.7	Very low	42.5	Very low	115 Å²	115	149.1 Å²	149.1	71%	0.706	78%	0.775	S	S	*	*				79.5	142	124.2	60.3	0	0	0	0	123.8
10	L	38.5	Very low	42.3	Very low	165 Å²	165	153.2 Å²	153.2	86%	0.864	78%	0.782	S	S	*	*			trans	85.2	118.3	150.8	-75.1	147.1	0	0	0	119.8
11	S	43.4	Very low	42.7	Very low	111 Å²	111	151.5 Å²	151.5	78%	0.776	78%	0.781	S	S	*	*				179.1	142.7	113.3	-174.7	0	0	0	0	113.7
12	S	39.7	Very low	42.5	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	77%	0.769	S	S	*	*			trans	-54.2	160	174.7	46.1	0	0	0	0	118.3
13	Y	47.1	Very low	42.7	Very low	235 Å²	235	152.9 Å²	152.9	92%	0.922	77%	0.772	S	S	*	*			trans	-156.6	139.9	137.3	-120.5	-87	0	0	0	113.1
14	N	43.8	Very low	42.8	Very low	159 Å²	159	154.2 Å²	154.2	85%	0.85	78%	0.782	S	S	*	*			trans	-105.4	145.1	-169.6	-90.5	-36.8	0	0	0	114.1
15	G	40.8	Very low	42.4	Very low	74 Å²	74	157.2 Å²	157.2	76%	0.763	79%	0.787	S	S	*	*			trans	67.4	173.1	141	0	0	0	0	0	120.9
16	P	49	Very low	42.5	Very low	126 Å²	126	153.8 Å²	153.8	82%	0.818	79%	0.793	S	S	*	*			cis	-144.1	170.2	5.3	42.2	-22.1	0	0	0	118.9
17	D	44.1	Very low	42.5	Very low	121 Å²	121	151.4 Å²	151.4	65%	0.647	80%	0.799	S	S	*	*			trans	51.5	127.4	140.5	-84	9	0	0	0	128.3
18	R	42.9	Very low	42.8	Very low	199 Å²	199	151.5 Å²	151.5	75%	0.751	81%	0.806	S	S	*	*			trans	72.3	123.8	133.7	-64.8	177.3	-154.5	-160.8	2.2	122.7
19	F	45	Very low	42.8	Very low	197 Å²	197	151.1 Å²	151.1	86%	0.864	81%	0.814	S	S	*	*				170.5	134.3	104.6	-104.3	-86.4	0	0	0	112.1
20	Y	39.4	Very low	42.9	Very low	232 Å²	232	153.6 Å²	153.6	91%	0.91	82%	0.821	S	S	*	*			trans	-132.4	148.8	165.2	-101.1	-81.6	0	0	0	108.3
21	P	50.3	Low	43	Very low	118 Å²	118	149.4 Å²	149.4	77%	0.766	81%	0.81	S	S	*	*			trans	-121.8	138.4	157.3	30.8	-15.7	0	0	0	113.4
22	Q	37.3	Very low	43	Very low	192 Å²	192	151.9 Å²	151.9	90%	0.897	82%	0.815	S	S	*	*			trans	-77.6	154.3	165.4	-71.3	-178.4	-34.7	0	0	111
23	Y	45.8	Very low	43	Very low	234 Å²	234	158.6 Å²	158.6	92%	0.918	83%	0.826	S	S	*	*			trans	-134	137.9	157.6	-110.4	-87.7	0	0	0	111.8
24	S	40.7	Very low	42.5	Very low	110 Å²	110	151.7 Å²	151.7	77%	0.769	81%	0.812	S	S	*	*			trans	-90.8	160.9	-165.2	51.5	0	0	0	0	114.8
25	Q	36.4	Very low	42.4	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	81%	0.807	S	S	*	*			trans	-68.5	148.7	173.7	-62.9	178.8	-20.4	0	0	114.5
26	S	43.6	Very low	42.5	Very low	125 Å²	125	158.7 Å²	158.7	87%	0.874	81%	0.806	S	S	*	*			trans	-160.6	154.6	141.7	57.1	0	0	0	0	111.8
27	V	42.4	Very low	42.1	Very low	139 Å²	139	157.3 Å²	157.3	84%	0.842	80%	0.799	S	S	*	*			trans	-107.6	165.9	-151.3	155.5	0	0	0	0	111.9
28	P	48.9	Very low	41.9	Very low	120 Å²	120	157.8 Å²	157.8	78%	0.779	81%	0.807	S	S	*	*			trans	-105.5	179.9	-149	40.7	-32.5	0	0	0	115.4
29	S	41.6	Very low	42	Very low	122 Å²	122	157.1 Å²	157.1	85%	0.853	81%	0.812	S	S	*	*			trans	-150.7	157.8	155.3	80.8	0	0	0	0	114.1
30	I	40.6	Very low	41.7	Very low	167 Å²	167	153.1 Å²	153.1	86%	0.856	81%	0.806	S	S	*	*			trans	-91.3	144	-165	-72.7	155.8	0	0	0	111.2
31	A	40.3	Very low	42	Very low	77 Å²	77	151.7 Å²	151.7	64%	0.636	80%	0.804	S	S	*	*			trans	149.6	111.3	132.1	0	0	0	0	0	111
32	D	42.9	Very low	41.6	Very low	164 Å²	164	153.3 Å²	153.3	88%	0.877	80%	0.802	S	S	*	*				-170.8	122.7	106	-97.8	-27	0	0	0	112.4
33	R	39.3	Very low	41.8	Very low	233 Å²	233	156.2 Å²	156.2	88%	0.879	80%	0.804	S	S	*	*			trans	-64.6	155.3	163.7	-71.2	172.1	171.3	173.8	-2.9	107.5
34	S	38.3	Very low	41.8	Very low	90 Å²	90	153.5 Å²	153.5	63%	0.629	80%	0.8	S	S	*	*			cis	172.2	157.3	39.5	19	0	0	0	0	105.9
35	Y	41.3	Very low	42.1	Very low	189 Å²	189	157.3 Å²	157.3	74%	0.741	80%	0.797	S	S	*	*				163.4	115	122.3	-101.4	-108.6	0	0	0	110.5
36	Y	43	Very low	42.6	Very low	191 Å²	191	157.8 Å²	157.8	75%	0.749	80%	0.797	S	S	*	*			trans	46.5	144.1	144.4	-60.9	-101.8	0	0	0	120.1
37	S	41.1	Very low	42.9	Very low	96 Å²	96	153.6 Å²	153.6	67%	0.671	77%	0.773	S	S	*	*			cis	-174.3	135.8	3.1	44.9	0	0	0	0	108.5
38	V	39.8	Very low	43.7	Very low	132 Å²	132	150.4 Å²	150.4	80%	0.8	76%	0.757	S	S	*	*			trans	46.5	116.7	140.6	-163	0	0	0	0	120.5
39	E	44.3	Very low	44.3	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	75%	0.751	S	S	*	*				-175.9	154.2	109.1	-98.2	-162.9	178.8	0	0	113.9
40	P	38.3	Very low	45.7	Very low	113 Å²	113	147.9 Å²	147.9	73%	0.734	74%	0.738	S	S	*	*			trans	-107.2	105.6	-159.6	36.3	-24.4	0	0	0	113.3
41	K	45.3	Very low	47.3	Very low	203 Å²	203	148.9 Å²	148.9	88%	0.883	73%	0.731	S	S	*	*			trans	-149.5	68.2	169.7	-80.8	-171.6	179.2	167.6	0	113.4
42	Q	42.8	Very low	49.1	Very low	152 Å²	152	150.2 Å²	150.2	71%	0.71	73%	0.726	S	S	*	*			trans	-142.5	61.7	159.3	-78.5	-145.1	-6.9	0	0	112.6
43	R	41.2	Very low	50.9	Low	253 Å²	253	146.2 Å²	146.2	96%	0.955	71%	0.711	S	S	*	*	S	Bend	trans	-116.1	71.1	153.5	-84.6	-168.2	-177.3	-161.5	2.3	108.6
44	Q	45.1	Very low	53.1	Low	176 Å²	176	138.2 Å²	138.2	82%	0.822	69%	0.688	S	S	*	*			trans	-159.5	-1.8	170.5	-119.6	173.6	0.5	0	0	116.3
45	R	47.4	Very low	55.4	Low	190 Å²	190	137.5 Å²	137.5	72%	0.717	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-2.9	-176.5	-79.7	-173.3	171.4	-173.1	-1.7	116.3
46	F	46.7	Very low	57.7	Low	197 Å²	197	133.6 Å²	133.6	86%	0.864	67%	0.671	S	S	*	*	H	α-helix	trans	-85.1	-11.1	173.7	-86.1	-82.6	0	0	0	114.2
47	G	50	Low	59.9	Low	37 Å²	37	130.6 Å²	130.6	38%	0.381	66%	0.662	S	S	.	*	H	α-helix	trans	-75.2	-40.3	174.8	0	0	0	0	0	113	C49 V50 W51	G47-C49 PolarHBondContact O-N 3.12Å; G47-V50 PolarHBondContact O-N 2.86Å; G47-W51 PolarHBondContact O-N 2.92Å
48	S	59	Low	62.4	Low	72 Å²	72	130.3 Å²	130.3	50%	0.503	65%	0.652	S	S	.	*	H	α-helix	trans	-68.8	-33	-167.3	-47.4	0	0	0	0	114.7	I52	S48-I52 WeakPolarHBondContact O-CG1 3.07Å; S48-I52 PolarHBondContact O-N 2.69Å
49	C	61.7	Low	64.9	Low	97 Å²	97	128.2 Å²	128.2	66%	0.655	64%	0.636	S	S	*	*	H	α-helix	trans	-70.1	-34.3	175.3	-86.4	0	0	0	0	112.8	G47 I52 S53	G47-C49 PolarHBondContact O-N 3.12Å; C49-I52 PolarHBondContact O-N 2.72Å; C49-S53 PolarHBondContact O-N 3.49Å; C49-S53 VanDerWaalsContact O-N 3.12Å
50	V	71.3	Confident	67.2	Low	93 Å²	93	125.3 Å²	125.3	56%	0.564	62%	0.62	S	S	*	*	H	α-helix	trans	-67.8	-42.3	177.2	-177.8	0	0	0	0	109.8	G47 I52 S53 V54	G47-V50 PolarHBondContact O-N 2.86Å; V50-I52 PolarHBondContact O-N 3.2Å; V50-S53 PolarHBondContact O-N 3.33Å; V50-V54 HydrophobicContact CG1-CG2 4.29Å; V50-V54 WeakPolarHBondContact O-CB 3Å; V50-V54 VanDerWaalsContact O-CG2 3.25Å; V50-V54 WeakPolarHBondContact O-CG2 3.25Å; V50-V54 PolarHBondContact O-N 3.01Å
51	W	73.3	Confident	69.9	Low	188 Å²	188	123.2 Å²	123.2	71%	0.712	60%	0.602	S	S	*	*	H	α-helix	trans	-62	-41.4	176.3	-80.2	98.5	0	0	0	113	G47 S53 V54 V55	G47-W51 PolarHBondContact O-N 2.92Å; W51-S53 PolarHBondContact O-N 3Å; W51-V54 PolarHBondContact O-N 2.69Å; W51-V55 WeakPolarHBondContact O-CB 3.33Å; W51-V55 VanDerWaalsContact O-CG2 3.22Å; W51-V55 WeakPolarHBondContact O-CG2 3.31Å; W51-V55 PolarHBondContact O-N 3.19Å
52	I	79	Confident	72.2	Confident	104 Å²	104	117.7 Å²	117.7	53%	0.533	58%	0.582	S	S	.	*	H	α-helix	trans	-63.9	-42.8	176.6	-66.6	165.6	0	0	0	110.9	S48 C49 V50 V55 L56	S48-I52 WeakPolarHBondContact O-CG1 3.07Å; S48-I52 PolarHBondContact O-N 2.69Å; C49-I52 PolarHBondContact O-N 2.72Å; V50-I52 PolarHBondContact O-N 3.2Å; I52-V55 PolarHBondContact O-N 3.46Å; I52-L56 HydrophobicContact CG2-CD1 3.97Å; I52-L56 HydrophobicContact CG2-CG 4.47Å; I52-L56 WeakPolarHBondContact O-CB 3.23Å; I52-L56 WeakPolarHBondContact O-CG 3.38Å; I52-L56 PolarHBondContact O-N 2.95Å
53	S	80.5	Confident	74.6	Confident	80 Å²	80	115.1 Å²	115.1	56%	0.559	57%	0.572	S	S	*	*	H	α-helix	trans	-66.5	-39.4	178.8	-162.5	0	0	0	0	112.2	C49 V50 W51 L56 F57	C49-S53 PolarHBondContact O-N 3.49Å; C49-S53 VanDerWaalsContact O-N 3.12Å; V50-S53 PolarHBondContact O-N 3.33Å; W51-S53 PolarHBondContact O-N 3Å; S53-L56 PolarHBondContact O-N 3.36Å; S53-F57 WeakPolarHBondContact O-CB 3.41Å; S53-F57 PolarHBondContact O-N 3.16Å
54	V	85	Confident	77.1	Confident	65 Å²	65	107 Å²	107	39%	0.394	55%	0.547	S	S	.	.	H	α-helix	trans	-64.8	-43.5	174.3	171.6	0	0	0	0	111.3	V50 W51 F57 I58	V50-V54 HydrophobicContact CG1-CG2 4.29Å; V50-V54 WeakPolarHBondContact O-CB 3Å; V50-V54 VanDerWaalsContact O-CG2 3.25Å; V50-V54 WeakPolarHBondContact O-CG2 3.25Å; V50-V54 PolarHBondContact O-N 3.01Å; W51-V54 PolarHBondContact O-N 2.69Å; V54-F57 PolarHBondContact O-N 2.84Å; V54-I58 HydrophobicContact CG1-CD1 3.74Å; V54-I58 HydrophobicContact CG1-CG1 4.4Å; V54-I58 WeakPolarHBondContact O-CB 3.34Å; V54-I58 VanDerWaalsContact O-CG1 3.25Å; V54-I58 WeakPolarHBondContact O-CG1 3.35Å; V54-I58 PolarHBondContact O-N 2.88Å
55	V	86.6	Confident	79.3	Confident	75 Å²	75	102.4 Å²	102.4	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-42.8	177.7	170.6	0	0	0	0	111.4	W51 I52 F57 I58 L59	W51-V55 WeakPolarHBondContact O-CB 3.33Å; W51-V55 VanDerWaalsContact O-CG2 3.22Å; W51-V55 WeakPolarHBondContact O-CG2 3.31Å; W51-V55 PolarHBondContact O-N 3.19Å; I52-V55 PolarHBondContact O-N 3.46Å; V55-F57 VanDerWaalsContact C-N 3.34Å; V55-F57 PolarHBondContact O-N 3.12Å; V55-I58 PolarHBondContact O-N 3.36Å; V55-L59 HydrophobicContact CG1-CD1 4Å; V55-L59 WeakPolarHBondContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CG 3.45Å; V55-L59 PolarHBondContact O-N 2.74Å
56	L	89.3	Confident	81.4	Confident	108 Å²	108	98 Å²	98	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-38.7	175.5	-72.9	171	0	0	0	112.1	I52 S53 L59 F60	I52-L56 HydrophobicContact CG2-CD1 3.97Å; I52-L56 HydrophobicContact CG2-CG 4.47Å; I52-L56 WeakPolarHBondContact O-CB 3.23Å; I52-L56 WeakPolarHBondContact O-CG 3.38Å; I52-L56 PolarHBondContact O-N 2.95Å; S53-L56 PolarHBondContact O-N 3.36Å; L56-L59 PolarHBondContact O-N 2.9Å; L56-F60 WeakPolarHBondContact O-CB 3.37Å; L56-F60 PolarHBondContact O-N 3.3Å
57	F	90.7	Very high	83.4	Confident	128 Å²	128	92.1 Å²	92.1	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-66.9	-41.2	176	-171	-105.3	0	0	0	112.1	S53 V54 V55 F60 I61	S53-F57 WeakPolarHBondContact O-CB 3.41Å; S53-F57 PolarHBondContact O-N 3.16Å; V54-F57 PolarHBondContact O-N 2.84Å; V55-F57 VanDerWaalsContact C-N 3.34Å; V55-F57 PolarHBondContact O-N 3.12Å; F57-F60 PolarHBondContact O-N 2.71Å; F57-I61 HydrophobicContact CD1-CD1 3.85Å; F57-I61 HydrophobicContact CE1-CD1 3.35Å; F57-I61 HydrophobicContact CE1-CG1 4.26Å; F57-I61 HydrophobicContact CZ-CD1 3.8Å; F57-I61 HydrophobicContact CZ-CG1 4.43Å; F57-I61 WeakPolarHBondContact O-CG1 3.39Å; F57-I61 PolarHBondContact O-N 2.79Å
58	I	92.2	Very high	85.1	Confident	90 Å²	90	94.9 Å²	94.9	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-63.6	-43.6	174.3	-68.9	166.8	0	0	0	110.8	V54 V55 F60 I61 L62	V54-I58 HydrophobicContact CG1-CD1 3.74Å; V54-I58 HydrophobicContact CG1-CG1 4.4Å; V54-I58 WeakPolarHBondContact O-CB 3.34Å; V54-I58 VanDerWaalsContact O-CG1 3.25Å; V54-I58 WeakPolarHBondContact O-CG1 3.35Å; V54-I58 PolarHBondContact O-N 2.88Å; V55-I58 PolarHBondContact O-N 3.36Å; I58-F60 VanDerWaalsContact C-N 3.34Å; I58-F60 PolarHBondContact O-N 2.72Å; I58-I61 PolarHBondContact O-N 3.35Å; I58-L62 HydrophobicContact CG2-CD1 3.9Å; I58-L62 WeakPolarHBondContact O-CB 3.04Å; I58-L62 WeakPolarHBondContact O-CG 3.43Å; I58-L62 PolarHBondContact O-N 2.82Å
59	L	92.8	Very high	86.3	Confident	88 Å²	88	95.8 Å²	95.8	46%	0.461	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-41.8	175	-82.3	161.7	0	0	0	111.9	V55 L56 L62 I63	V55-L59 HydrophobicContact CG1-CD1 4Å; V55-L59 WeakPolarHBondContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CG 3.45Å; V55-L59 PolarHBondContact O-N 2.74Å; L56-L59 PolarHBondContact O-N 2.9Å; L59-L62 PolarHBondContact O-N 3.22Å; L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.48Å; L59-I63 PolarHBondContact O-N 3.15Å
60	F	93.6	Very high	87.2	Confident	122 Å²	122	95 Å²	95	54%	0.535	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176	-179.8	-104	0	0	0	112.2	L56 F57 I58 I63 L64	L56-F60 WeakPolarHBondContact O-CB 3.37Å; L56-F60 PolarHBondContact O-N 3.3Å; F57-F60 PolarHBondContact O-N 2.71Å; I58-F60 VanDerWaalsContact C-N 3.34Å; I58-F60 PolarHBondContact O-N 2.72Å; F60-I63 PolarHBondContact O-N 2.8Å; F60-L64 HydrophobicContact CD1-CD1 3.82Å; F60-L64 HydrophobicContact CE1-CD1 3.33Å; F60-L64 HydrophobicContact CE1-CG 4.3Å; F60-L64 HydrophobicContact CZ-CD1 3.73Å; F60-L64 HydrophobicContact CZ-CG 4.33Å; F60-L64 PolarHBondContact O-N 3.32Å
61	I	94.1	Very high	87.5	Confident	69 Å²	69	97.6 Å²	97.6	35%	0.354	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-42.5	174.2	-71.4	-177.8	0	0	0	111.1	F57 I58 I63 L64 I65	F57-I61 HydrophobicContact CD1-CD1 3.85Å; F57-I61 HydrophobicContact CE1-CD1 3.35Å; F57-I61 HydrophobicContact CE1-CG1 4.26Å; F57-I61 HydrophobicContact CZ-CD1 3.8Å; F57-I61 HydrophobicContact CZ-CG1 4.43Å; F57-I61 WeakPolarHBondContact O-CG1 3.39Å; F57-I61 PolarHBondContact O-N 2.79Å; I58-I61 PolarHBondContact O-N 3.35Å; I61-I63 VanDerWaalsContact C-N 3.34Å; I61-I63 PolarHBondContact O-N 2.79Å; I61-L64 PolarHBondContact O-N 2.78Å; I61-I65 HydrophobicContact CG2-CD1 3.67Å; I61-I65 HydrophobicContact CG2-CG1 4.24Å; I61-I65 WeakPolarHBondContact O-CB 3.18Å; I61-I65 VanDerWaalsContact O-CG1 3.28Å; I61-I65 WeakPolarHBondContact O-CG1 2.83Å; I61-I65 PolarHBondContact O-N 3.46Å
62	L	94	Very high	87.6	Confident	87 Å²	87	95.5 Å²	95.5	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-43	175.7	-84.8	160.1	0	0	0	111.7	I58 L59 I65 I66	I58-L62 HydrophobicContact CG2-CD1 3.9Å; I58-L62 WeakPolarHBondContact O-CB 3.04Å; I58-L62 WeakPolarHBondContact O-CG 3.43Å; I58-L62 PolarHBondContact O-N 2.82Å; L59-L62 PolarHBondContact O-N 3.22Å; L62-I65 PolarHBondContact O-N 3.4Å; L62-I66 WeakPolarHBondContact O-CB 3.26Å; L62-I66 VanDerWaalsContact O-CG1 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.22Å; L62-I66 PolarHBondContact O-N 3.31Å
63	I	93.8	Very high	87.2	Confident	99 Å²	99	95.6 Å²	95.6	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-43.9	175.3	-69.2	165.3	0	0	0	110.6	L59 F60 I61 I66 C67	L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.48Å; L59-I63 PolarHBondContact O-N 3.15Å; F60-I63 PolarHBondContact O-N 2.8Å; I61-I63 VanDerWaalsContact C-N 3.34Å; I61-I63 PolarHBondContact O-N 2.79Å; I63-I66 PolarHBondContact O-N 2.84Å; I63-C67 WeakPolarHBondContact O-CB 3.27Å; I63-C67 PolarHBondContact O-N 2.86Å; I63-C67 PolarHBondContact O-SG 3.35Å
64	L	92.6	Very high	85.6	Confident	81 Å²	81	101 Å²	101	42%	0.424	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-42.6	175.6	-82.9	168.5	0	0	0	112.4	F60 I61 C67 L68	F60-L64 HydrophobicContact CD1-CD1 3.82Å; F60-L64 HydrophobicContact CE1-CD1 3.33Å; F60-L64 HydrophobicContact CE1-CG 4.3Å; F60-L64 HydrophobicContact CZ-CD1 3.73Å; F60-L64 HydrophobicContact CZ-CG 4.33Å; F60-L64 PolarHBondContact O-N 3.32Å; I61-L64 PolarHBondContact O-N 2.78Å; L64-C67 PolarHBondContact O-N 3.29Å; L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 VanDerWaalsContact O-CG 3.32Å; L64-L68 WeakPolarHBondContact O-CG 3.23Å; L64-L68 PolarHBondContact O-N 2.83Å
65	I	92.2	Very high	83.7	Confident	81 Å²	81	105.8 Å²	105.8	42%	0.415	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-43.8	175.6	-69.3	168.7	0	0	0	110.2	I61 L62 L68 I69	I61-I65 HydrophobicContact CG2-CD1 3.67Å; I61-I65 HydrophobicContact CG2-CG1 4.24Å; I61-I65 WeakPolarHBondContact O-CB 3.18Å; I61-I65 VanDerWaalsContact O-CG1 3.28Å; I61-I65 WeakPolarHBondContact O-CG1 2.83Å; I61-I65 PolarHBondContact O-N 3.46Å; L62-I65 PolarHBondContact O-N 3.4Å; I65-L68 PolarHBondContact O-N 2.96Å; I65-I69 HydrophobicContact CG2-CD1 3.7Å; I65-I69 HydrophobicContact CG2-CG1 4.28Å; I65-I69 WeakPolarHBondContact O-CB 3.47Å; I65-I69 VanDerWaalsContact O-CG1 3.23Å; I65-I69 WeakPolarHBondContact O-CG1 3.43Å; I65-I69 PolarHBondContact O-N 3.24Å
66	I	91.2	Very high	81.8	Confident	98 Å²	98	105.9 Å²	105.9	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-43.8	176	-68.8	164	0	0	0	110.6	L62 I63 L68 I69 V70	L62-I66 WeakPolarHBondContact O-CB 3.26Å; L62-I66 VanDerWaalsContact O-CG1 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.22Å; L62-I66 PolarHBondContact O-N 3.31Å; I63-I66 PolarHBondContact O-N 2.84Å; I66-L68 VanDerWaalsContact C-N 3.33Å; I66-L68 PolarHBondContact O-N 3.24Å; I66-I69 PolarHBondContact O-N 3.29Å; I66-V70 HydrophobicContact CG2-CG2 4.35Å; I66-V70 WeakPolarHBondContact O-CB 3.26Å; I66-V70 VanDerWaalsContact O-CG2 3.27Å; I66-V70 WeakPolarHBondContact O-CG2 3.39Å; I66-V70 PolarHBondContact O-N 3.38Å
67	C	87.6	Confident	79.4	Confident	73 Å²	73	107.7 Å²	107.7	49%	0.493	54%	0.542	S	S	.	.	H	α-helix	trans	-61.4	-40.4	175.4	-73.5	0	0	0	0	112	I63 L64 F71	I63-C67 WeakPolarHBondContact O-CB 3.27Å; I63-C67 PolarHBondContact O-N 2.86Å; I63-C67 PolarHBondContact O-SG 3.35Å; L64-C67 PolarHBondContact O-N 3.29Å; C67-F71 VanDerWaalsContact O-CB 3.25Å; C67-F71 WeakPolarHBondContact O-CB 3.49Å; C67-F71 PolarHBondContact O-N 3.17Å
68	L	86	Confident	77	Confident	94 Å²	94	111 Å²	111	49%	0.492	55%	0.553	S	S	.	*	H	α-helix	trans	-68.1	-44.1	175.2	-76.5	167.9	0	0	0	111.5	L64 I65 I66 F71 F72	L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 VanDerWaalsContact O-CG 3.32Å; L64-L68 WeakPolarHBondContact O-CG 3.23Å; L64-L68 PolarHBondContact O-N 2.83Å; I65-L68 PolarHBondContact O-N 2.96Å; I66-L68 VanDerWaalsContact C-N 3.33Å; I66-L68 PolarHBondContact O-N 3.24Å; L68-F71 PolarHBondContact O-N 3.31Å; L68-F72 HydrophobicContact CD2-CD2 4.48Å; L68-F72 HydrophobicContact CD2-CE2 4.13Å; L68-F72 WeakPolarHBondContact O-CB 3.28Å; L68-F72 VanDerWaalsContact O-CD2 3.26Å; L68-F72 WeakPolarHBondContact O-CD2 3.25Å; L68-F72 PolarHBondContact O-N 3.36Å
69	I	85.1	Confident	74.3	Confident	91 Å²	91	111.2 Å²	111.2	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-59.1	-50.9	174.4	-70.1	167.6	0	0	0	108.7	I65 I66 F71 F72 T73	I65-I69 HydrophobicContact CG2-CD1 3.7Å; I65-I69 HydrophobicContact CG2-CG1 4.28Å; I65-I69 WeakPolarHBondContact O-CB 3.47Å; I65-I69 VanDerWaalsContact O-CG1 3.23Å; I65-I69 WeakPolarHBondContact O-CG1 3.43Å; I65-I69 PolarHBondContact O-N 3.24Å; I66-I69 PolarHBondContact O-N 3.29Å; I69-F71 VanDerWaalsContact C-N 3.32Å; I69-F71 PolarHBondContact O-N 3.23Å; I69-F72 CarbonylContact O-C 3.55Å; I69-F72 PolarHBondContact O-N 2.77Å; I69-F72 VanDerWaalsContact O-N 3.15Å; I69-T73 HydrophobicContact CG2-CG2 3.78Å; I69-T73 VanDerWaalsContact O-CB 3.31Å; I69-T73 WeakPolarHBondContact O-CB 3.32Å; I69-T73 WeakPolarHBondContact O-CG2 3.49Å; I69-T73 PolarHBondContact O-N 2.92Å; I69-T73 PolarHBondContact O-OG1 3.05Å
70	V	80.3	Confident	71.8	Confident	80 Å²	80	116.5 Å²	116.5	49%	0.485	59%	0.587	S	S	.	*	H	α-helix	trans	-56.6	-46.1	175.8	172.1	0	0	0	0	110.3	I66 F72 W74	I66-V70 HydrophobicContact CG2-CG2 4.35Å; I66-V70 WeakPolarHBondContact O-CB 3.26Å; I66-V70 VanDerWaalsContact O-CG2 3.27Å; I66-V70 WeakPolarHBondContact O-CG2 3.39Å; I66-V70 PolarHBondContact O-N 3.38Å; V70-F72 PolarHBondContact O-N 3.2Å; V70-W74 HydrophobicContact CG1-CB 4.49Å; V70-W74 VanDerWaalsContact O-CA 3.26Å; V70-W74 WeakPolarHBondContact O-CA 3.44Å; V70-W74 WeakPolarHBondContact O-CB 3.25Å; V70-W74 PolarHBondContact O-N 2.75Å
71	F	78.3	Confident	69.1	Low	149 Å²	149	117.9 Å²	117.9	65%	0.654	60%	0.595	S	S	*	*	H	α-helix	trans	-63	-37.3	178.1	-171.9	-95.5	0	0	0	113.5	C67 L68 I69 W74	C67-F71 VanDerWaalsContact O-CB 3.25Å; C67-F71 WeakPolarHBondContact O-CB 3.49Å; C67-F71 PolarHBondContact O-N 3.17Å; L68-F71 PolarHBondContact O-N 3.31Å; I69-F71 VanDerWaalsContact C-N 3.32Å; I69-F71 PolarHBondContact O-N 3.23Å; F71-W74 CarbonylContact O-C 3.37Å
72	F	73.8	Confident	66.3	Low	144 Å²	144	122.6 Å²	122.6	63%	0.632	62%	0.619	S	S	*	*	H	α-helix	trans	-87.5	-27.9	-178.8	-83.2	-75.3	0	0	0	114	L68 I69 V70	L68-F72 HydrophobicContact CD2-CD2 4.48Å; L68-F72 HydrophobicContact CD2-CE2 4.13Å; L68-F72 WeakPolarHBondContact O-CB 3.28Å; L68-F72 VanDerWaalsContact O-CD2 3.26Å; L68-F72 WeakPolarHBondContact O-CD2 3.25Å; L68-F72 PolarHBondContact O-N 3.36Å; I69-F72 CarbonylContact O-C 3.55Å; I69-F72 PolarHBondContact O-N 2.77Å; I69-F72 VanDerWaalsContact O-N 3.15Å; V70-F72 PolarHBondContact O-N 3.2Å
73	T	71.5	Confident	63.6	Low	105 Å²	105	124 Å²	124	64%	0.644	63%	0.632	S	S	*	*	H	α-helix	trans	-87.2	-30.4	174.6	62.2	0	0	0	0	111.6	I69 K75	I69-T73 HydrophobicContact CG2-CG2 3.78Å; I69-T73 VanDerWaalsContact O-CB 3.31Å; I69-T73 WeakPolarHBondContact O-CB 3.32Å; I69-T73 WeakPolarHBondContact O-CG2 3.49Å; I69-T73 PolarHBondContact O-N 2.92Å; I69-T73 PolarHBondContact O-OG1 3.05Å; T73-K75 PolarHBondContact O-N 2.75Å
74	W	47.6	Very low	60.8	Low	195 Å²	195	126.4 Å²	126.4	74%	0.739	65%	0.646	S	S	*	*			trans	-81	57.2	162.1	-156	61.9	0	0	0	108.1	V70 F71 P76	V70-W74 HydrophobicContact CG1-CB 4.49Å; V70-W74 VanDerWaalsContact O-CA 3.26Å; V70-W74 WeakPolarHBondContact O-CA 3.44Å; V70-W74 WeakPolarHBondContact O-CB 3.25Å; V70-W74 PolarHBondContact O-N 2.75Å; F71-W74 CarbonylContact O-C 3.37Å; W74-P76 WeakPolarHBondContact O-CD 2.85Å; W74-P76 VanDerWaalsContact O-N 3.17Å
75	K	44.1	Very low	58	Low	164 Å²	164	126.9 Å²	126.9	71%	0.713	67%	0.67	S	S	*	*			trans	-57.9	116.8	151.5	-87	-169.7	174.7	-172.6	0	105.3	T73 T77	T73-K75 PolarHBondContact O-N 2.75Å; K75-T77 PolarHBondContact O-N 2.92Å
76	P	46.1	Very low	55.3	Low	78 Å²	78	131.6 Å²	131.6	51%	0.506	69%	0.691	S	S	.	*			trans	-59.2	136.8	160.7	29.3	-30.8	0	0	0	104.8	W74 Y78	W74-P76 WeakPolarHBondContact O-CD 2.85Å; W74-P76 VanDerWaalsContact O-N 3.17Å; P76-Y78 HydrophobicContact CB-CD2 4.13Å; P76-Y78 PolarHBondContact O-N 2.94Å
77	T	40.1	Very low	52.6	Low	145 Å²	145	132 Å²	132	89%	0.89	71%	0.708	S	S	*	*	S	Bend	trans	-63.4	25.6	171.2	-23.6	0	0	0	0	112.2	K75 A79	K75-T77 PolarHBondContact O-N 2.92Å; T77-A79 PolarHBondContact O-N 3.46Å
78	Y	40.1	Very low	50.4	Low	199 Å²	199	131.9 Å²	131.9	78%	0.78	71%	0.708	S	S	*	*			trans	-97.6	62.3	175.1	-84.3	-93.2	0	0	0	109.8	P76	P76-Y78 HydrophobicContact CB-CD2 4.13Å; P76-Y78 PolarHBondContact O-N 2.94Å
79	A	36.2	Very low	48.4	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	72%	0.718	S	S	*	*			trans	-165.9	64.9	165.3	0	0	0	0	0	110.5	T77	T77-A79 PolarHBondContact O-N 3.46Å
80	K	38.9	Very low	46.8	Very low	198 Å²	198	131.8 Å²	131.8	86%	0.861	71%	0.705	S	S	*	*			trans	-168.8	118.8	166.8	-103	178.2	179.6	-178.4	0	103.9
81	Q	37.1	Very low	45	Very low	151 Å²	151	132.8 Å²	132.8	71%	0.706	71%	0.711	S	S	*	*			cis	-146.7	104.9	34.3	-67.5	161.1	-58.1	0	0	109.4
82	I	35.9	Very low	43.8	Very low	168 Å²	168	126.8 Å²	126.8	86%	0.862	69%	0.685	S	S	*	*	S	Bend	trans	-111.6	88.5	150.1	-60.5	-179.6	0	0	0	104
83	T	36.6	Very low	42.3	Very low	118 Å²	118	125 Å²	125	72%	0.724	69%	0.688	S	S	*	*	S	Bend	trans	169.4	124.5	161.1	29.6	0	0	0	0	108
84	N	36.6	Very low	41	Very low	149 Å²	149	128.5 Å²	128.5	80%	0.797	69%	0.694	S	S	*	*			trans	75.5	85.3	168.7	-56.4	-15.9	0	0	0	118.2	Q86	N84-Q86 VanDerWaalsContact C-N 3.3Å; N84-Q86 PolarHBondContact O-N 3.31Å
85	G	32.2	Very low	41	Very low	91 Å²	91	122 Å²	122	94%	0.938	67%	0.672	S	S	*	*				57.2	19.4	106.3	0	0	0	0	0	120.9
86	Q	35.6	Very low	41	Very low	180 Å²	180	115.7 Å²	115.7	84%	0.841	65%	0.647	S	S	*	*			trans	-128.2	125.3	167.9	-72	-170.6	-42.3	0	0	109.9	N84 S88	N84-Q86 VanDerWaalsContact C-N 3.3Å; N84-Q86 PolarHBondContact O-N 3.31Å; Q86-S88 PolarHBondContact O-N 3.2Å
87	A	35.5	Very low	40.5	Very low	106 Å²	106	121.8 Å²	121.8	88%	0.876	67%	0.666	S	S	*	*			trans	-54.3	100.4	-176.5	0	0	0	0	0	111.4	E89	A87-E89 PolarHBondContact O-N 3.07Å; A87-E89 VanDerWaalsContact O-N 3.12Å
88	S	41.6	Very low	40.6	Very low	71 Å²	71	116.4 Å²	116.4	50%	0.497	63%	0.632	S	S	.	*			trans	-73.9	98.6	159.5	58.3	0	0	0	0	107.1	Q86	Q86-S88 PolarHBondContact O-N 3.2Å
89	E	44.4	Very low	40.3	Very low	146 Å²	146	108.8 Å²	108.8	68%	0.682	61%	0.607	S	S	*	*			trans	-58.1	131.5	161.4	-161.7	165.8	-150.2	0	0	107	A87 T91	A87-E89 PolarHBondContact O-N 3.07Å; A87-E89 VanDerWaalsContact O-N 3.12Å; E89-T91 HydrophobicContact CB-CG2 4.36Å; E89-T91 PolarHBondContact O-N 3.34Å
90	L	49.7	Very low	40.4	Very low	37 Å²	37	111.6 Å²	111.6	19%	0.194	61%	0.609	C	S	.	*			trans	-63.5	82.6	171.1	-86.6	160.9	0	0	0	107.4	F92 A271 P331	L90-F92 PolarHBondContact O-N 3.16Å; L90-A271 HydrophobicContact CD1-CB 3.69Å; L90-P331 WeakPolarHBondContact O-CG 3.39Å
91	T	43.4	Very low	40.8	Very low	101 Å²	101	109.6 Å²	109.6	62%	0.62	60%	0.603	S	S	*	*			trans	-84	109.3	171	45.9	0	0	0	0	105.5	E89 P93	E89-T91 HydrophobicContact CB-CG2 4.36Å; E89-T91 PolarHBondContact O-N 3.34Å; T91-P93 WeakPolarHBondContact O-CD 3.5Å
92	F	52.6	Low	42.2	Very low	23 Å²	23	110.9 Å²	110.9	10%	0.101	60%	0.601	C	S	.	*			trans	-75	98.4	167.7	-62.2	-63	0	0	0	106.9	L90 F94 Y260 P331 N355 K357	L90-F92 PolarHBondContact O-N 3.16Å; F92-F94 PolarHBondContact O-N 3.08Å; F92-Y260 HydrophobicContact CB-CE2 4.22Å; F92-P331 HydrophobicContact CD2-CB 4.1Å; F92-P331 HydrophobicContact CD2-CG 4.18Å; F92-P331 HydrophobicContact CE2-CB 3.53Å; F92-P331 HydrophobicContact CE2-CG 4.1Å; F92-P331 HydrophobicContact CZ-CB 4.4Å; F92-N355 WeakPolarHBondContact CB-OD1 3.39Å; F92-N355 HydrophobicContact CD2-CB 4.45Å; F92-N355 VanDerWaalsContact CD2-ND2 3.31Å; F92-N355 WeakPolarHBondContact CD2-ND2 3.43Å; F92-N355 WeakPolarHBondContact CD2-OD1 3.49Å; F92-N355 WeakPolarHBondContact CG-OD1 3.03Å; F92-K357 HydrophobicContact CD1-CD 4.19Å; F92-K357 HydrophobicContact CD1-CG 4.36Å; F92-K357 HydrophobicContact CE1-CD 3.33Å; F92-K357 HydrophobicContact CE1-CG 3.64Å; F92-K357 HydrophobicContact CZ-CD 3.87Å; F92-K357 HydrophobicContact CZ-CG 3.86Å
93	P	42.4	Very low	44.8	Very low	107 Å²	107	103.3 Å²	103.3	70%	0.695	56%	0.562	S	S	*	*			trans	-74.4	118.7	-174.3	18.2	-3.5	0	0	0	107.2	T91	T91-P93 WeakPolarHBondContact O-CD 3.5Å
94	F	44.3	Very low	47.5	Very low	178 Å²	178	100.5 Å²	100.5	78%	0.781	54%	0.542	S	S	*	.			trans	68.5	98	176.3	-158.4	-98.4	0	0	0	115.1	F92	F92-F94 PolarHBondContact O-N 3.08Å
95	Q	46.9	Very low	50.2	Low	59 Å²	59	94.2 Å²	94.2	28%	0.276	51%	0.508	S	S	.	.			trans	-64.7	125.7	160.4	-72.2	-114.1	-41.1	0	0	109.2	K97 Y260 N355	Q95-K97 PolarHBondContact O-N 3.15Å; Q95-Y260 WeakPolarHBondContact CA-OH 3.48Å; Q95-Y260 WeakPolarHBondContact CG-OH 3.46Å; Q95-Y260 PolarHBondContact NE2-OH 3.09Å; Q95-N355 PolarHBondContact NE2-OD1 2.91Å
96	P	44.4	Very low	53.1	Low	30 Å²	30	93.5 Å²	93.5	20%	0.195	49%	0.485	C	S	.	.			trans	-58	128.8	162.7	23.1	-26.2	0	0	0	107	L98 Y260 W261	P96-L98 VanDerWaalsContact C-N 3.3Å; P96-L98 PolarHBondContact O-N 3.15Å; P96-Y260 VanDerWaalsContact CD-CZ 3.42Å; P96-Y260 HydrophobicContact CG-CD1 4.2Å; P96-Y260 HydrophobicContact CG-CE1 3.84Å; P96-W261 HydrophobicContact CG-CH2 3.91Å; P96-W261 HydrophobicContact CG-CZ2 3.55Å
97	K	37.2	Very low	55.8	Low	206 Å²	206	85.2 Å²	85.2	90%	0.896	45%	0.448	S	S	*	.			trans	-57.3	98.8	172.9	-84.2	-175.5	177	179.2	0	107.8	Q95 S99	Q95-K97 PolarHBondContact O-N 3.15Å; K97-S99 PolarHBondContact O-N 2.88Å
98	L	41.6	Very low	58.5	Low	33 Å²	33	83.7 Å²	83.7	17%	0.173	43%	0.425	C	S	.	.			trans	-58	123.1	170.4	-69.7	159	0	0	0	106.7	P96 N100 W261 V350	P96-L98 VanDerWaalsContact C-N 3.3Å; P96-L98 PolarHBondContact O-N 3.15Å; L98-N100 PolarHBondContact O-N 3.46Å; L98-W261 HydrophobicContact CD2-CH2 4.02Å; L98-V350 HydrophobicContact CD1-CB 4.5Å; L98-V350 HydrophobicContact CD1-CG1 3.42Å; L98-V350 VanDerWaalsContact CD1-CG1 3.42Å; L98-V350 WeakPolarHBondContact CD1-O 3.44Å; L98-V350 HydrophobicContact CD2-CG1 3.4Å; L98-V350 VanDerWaalsContact CD2-CG1 3.4Å; L98-V350 HydrophobicContact CG-CG1 4.04Å
99	S	33	Very low	60.9	Low	38 Å²	38	81.9 Å²	81.9	27%	0.266	41%	0.414	S	S	.	.			trans	-63.7	125.7	178.6	69.3	0	0	0	0	108.2	K97 H101 R102	K97-S99 PolarHBondContact O-N 2.88Å; S99-H101 PolarHBondContact O-N 3.15Å; S99-R102 PolarHBondContact O-N 3Å; S99-R102 WeakPolarHBondContact OG-CB 3.33Å; S99-R102 WeakPolarHBondContact OG-CD 3.27Å; S99-R102 WeakPolarHBondContact OG-CG 3.21Å
100	N	37.7	Very low	63.2	Low	153 Å²	153	74.9 Å²	74.9	82%	0.818	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-5	-160.6	-77.3	-11.7	0	0	0	117.6	L98	L98-N100 PolarHBondContact O-N 3.46Å
101	H	48.1	Very low	65.2	Low	157 Å²	157	73.2 Å²	73.2	73%	0.727	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-160.4	15	170.7	-79.8	-60.3	0	0	0	114.5	S99	S99-H101 PolarHBondContact O-N 3.15Å
102	R	65.8	Low	67.4	Low	177 Å²	177	72.7 Å²	72.7	67%	0.668	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-19.4	-164.9	-48	-179.1	-179.5	-179.9	-1.9	116.3	S99 M104 S216	S99-R102 PolarHBondContact O-N 3Å; S99-R102 WeakPolarHBondContact OG-CB 3.33Å; S99-R102 WeakPolarHBondContact OG-CD 3.27Å; S99-R102 WeakPolarHBondContact OG-CG 3.21Å; R102-M104 PolarHBondContact O-N 3.23Å; R102-S216 WeakPolarHBondContact O-CB 3.45Å; R102-S216 PolarHBondContact O-OG 2.85Å
103	D	92.2	Very high	69.3	Low	9 Å²	9	73.6 Å²	73.6	5%	0.048	37%	0.372	C	S	.	.	S	Bend	trans	-82.1	-5.3	-173	-72.8	31.7	0	0	0	112	W204 K208 S216 V217 F347 Q351	D103-W204 HydrophobicContact CB-CZ2 4.49Å; D103-W204 WeakPolarHBondContact OD2-CZ2 3.35Å; D103-W204 PolarHBondContact OD2-NE1 2.89Å; D103-K208 WeakPolarHBondContact OD2-CE 3.43Å; D103-K208 IonicContact OD2-NZ 2.9Å; D103-K208 PolarHBondContact OD2-NZ 3.47Å; D103-S216 CarbonylContact O-C 3.59Å; D103-S216 WeakPolarHBondContact O-CA 3.38Å; D103-V217 PolarHBondContact O-N 3.44Å; D103-F347 HydrophobicContact CB-CE2 4.24Å; D103-F347 VanDerWaalsContact O-CZ 3.29Å; D103-F347 WeakPolarHBondContact O-CZ 3.31Å; D103-Q351 VanDerWaalsContact CB-NE2 3.28Å
104	M	93.2	Very high	71.6	Confident	60 Å²	60	71.5 Å²	71.5	30%	0.296	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.9	171.3	-170.4	173.7	69	0	0	110	R102 V217 N219 L311 F347	R102-M104 PolarHBondContact O-N 3.23Å; M104-V217 WeakPolarHBondContact CA-O 3.41Å; M104-N219 HydrophobicContact CG-CB 3.81Å; M104-N219 HydrophobicContact SD-CB 3.97Å; M104-L311 HydrophobicContact SD-CB 4.4Å; M104-L311 HydrophobicContact SD-CD1 4.11Å; M104-F347 HydrophobicContact CB-CE1 4.16Å; M104-F347 HydrophobicContact CB-CZ 3.92Å; M104-F347 HydrophobicContact CG-CE1 4.39Å; M104-F347 HydrophobicContact CG-CZ 4.47Å; M104-F347 HydrophobicContact SD-CE1 4.31Å
105	L	93.5	Very high	73.8	Confident	17 Å²	17	70.3 Å²	70.3	9%	0.089	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	147.5	176	-63.8	174.5	0	0	0	110	L110 M113 V186 V217 N219	L105-L110 HydrophobicContact CD1-CD1 4.5Å; L105-M113 HydrophobicContact CD1-CE 4.35Å; L105-M113 HydrophobicContact CD1-SD 3.76Å; L105-M113 HydrophobicContact CD2-SD 3.82Å; L105-M113 HydrophobicContact CG-SD 4.47Å; L105-V186 HydrophobicContact CD1-CG1 4.32Å; L105-V186 HydrophobicContact CD1-CG2 3.76Å; L105-V217 PolarHBondContact N-O 2.94Å; L105-N219 WeakPolarHBondContact O-CB 3.32Å; L105-N219 PolarHBondContact O-N 3.41Å
106	V	92.5	Very high	75.8	Confident	75 Å²	75	72.6 Å²	72.6	46%	0.455	36%	0.362	S	S	.	.			trans	-97.9	159.8	163.7	-63.2	0	0	0	0	109.5	D108 A109 L110	V106-D108 VanDerWaalsContact C-N 3.32Å; V106-D108 PolarHBondContact O-N 2.82Å; V106-A109 HydrophobicContact CG2-CB 3.9Å; V106-A109 PolarHBondContact O-N 3.36Å; V106-A109 VanDerWaalsContact O-N 3.08Å; V106-L110 PolarHBondContact O-N 3.23Å
107	A	92.7	Very high	77.9	Confident	6 Å²	6	73.9 Å²	73.9	5%	0.05	38%	0.38	C	S	.	.	H	α-helix	trans	-54.3	-43.6	-175	0	0	0	0	0	113.6	A109 L110 G111 L218 W225 L228	A107-A109 PolarHBondContact O-N 2.92Å; A107-L110 PolarHBondContact O-N 2.91Å; A107-G111 PolarHBondContact O-N 3.26Å; A107-L218 HydrophobicContact CB-CD1 4.47Å; A107-W225 HydrophobicContact CB-CE3 4.17Å; A107-L228 HydrophobicContact CB-CB 4.25Å; A107-L228 HydrophobicContact CB-CD2 3.72Å
108	D	90.9	Very high	80.5	Confident	74 Å²	74	68.5 Å²	68.5	40%	0.396	37%	0.368	S	S	.	.	H	α-helix	trans	-59.6	-45.7	176.9	-66.4	-88.2	0	0	0	112.1	V106 L110 G111 D112 L228	V106-D108 VanDerWaalsContact C-N 3.32Å; V106-D108 PolarHBondContact O-N 2.82Å; D108-L110 PolarHBondContact O-N 3.43Å; D108-G111 PolarHBondContact O-N 3.35Å; D108-G111 VanDerWaalsContact O-N 3.15Å; D108-D112 PolarHBondContact O-N 2.82Å; D108-L228 WeakPolarHBondContact OD1-CD1 3.44Å
109	A	92	Very high	82.8	Confident	33 Å²	33	69.2 Å²	69.2	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-64.5	-39.5	179.3	0	0	0	0	0	112.1	V106 A107 G111 D112 M113	V106-A109 HydrophobicContact CG2-CB 3.9Å; V106-A109 PolarHBondContact O-N 3.36Å; V106-A109 VanDerWaalsContact O-N 3.08Å; A107-A109 PolarHBondContact O-N 2.92Å; A109-G111 VanDerWaalsContact C-N 3.34Å; A109-D112 PolarHBondContact O-N 3.46Å; A109-M113 WeakPolarHBondContact O-CG 3.47Å; A109-M113 PolarHBondContact O-N 2.95Å
110	L	93.4	Very high	85.6	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.9	-43.8	172.8	175.8	59.6	0	0	0	111.1	L105 V106 A107 D108 D112 M113 M114 I121 L123 L142 V186 L218 W225	L105-L110 HydrophobicContact CD1-CD1 4.5Å; V106-L110 PolarHBondContact O-N 3.23Å; A107-L110 PolarHBondContact O-N 2.91Å; D108-L110 PolarHBondContact O-N 3.43Å; L110-D112 VanDerWaalsContact C-N 3.3Å; L110-D112 PolarHBondContact O-N 3.33Å; L110-M113 PolarHBondContact O-N 3.49Å; L110-M114 HydrophobicContact CD1-CG 4.13Å; L110-M114 HydrophobicContact CD1-SD 4.24Å; L110-M114 HydrophobicContact CG-CG 4.4Å; L110-M114 HydrophobicContact CG-SD 4.02Å; L110-M114 WeakPolarHBondContact O-CG 3.32Å; L110-M114 PolarHBondContact O-N 3.32Å; L110-I121 HydrophobicContact CD1-CD1 4.25Å; L110-I121 HydrophobicContact CD1-CG2 4.32Å; L110-L123 HydrophobicContact CD1-CD2 4.26Å; L110-L123 HydrophobicContact CD2-CD2 3.91Å; L110-L142 HydrophobicContact CD2-CD2 3.53Å; L110-V186 HydrophobicContact CD1-CG1 4.35Å; L110-V186 HydrophobicContact CD1-CG2 4.11Å; L110-V186 HydrophobicContact CD2-CG1 4.28Å; L110-L218 HydrophobicContact CB-CD1 4.31Å; L110-L218 HydrophobicContact CD2-CD1 4.01Å; L110-L218 HydrophobicContact CD2-CD2 3.97Å; L110-W225 HydrophobicContact CB-CZ3 4.34Å; L110-W225 HydrophobicContact CD2-CE3 4.27Å; L110-W225 HydrophobicContact CD2-CZ3 4.1Å; L110-W225 HydrophobicContact CG-CZ3 4.12Å
111	G	91.5	Very high	88.4	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-65.4	-30.5	176.5	0	0	0	0	0	114	A107 D108 A109 K115 R237	A107-G111 PolarHBondContact O-N 3.26Å; D108-G111 PolarHBondContact O-N 3.35Å; D108-G111 VanDerWaalsContact O-N 3.15Å; A109-G111 VanDerWaalsContact C-N 3.34Å; G111-K115 WeakPolarHBondContact O-CB 3.12Å; G111-K115 PolarHBondContact O-N 3.5Å; G111-R237 VanDerWaalsContact C-NH2 3.27Å; G111-R237 PolarHBondContact O-NE 2.88Å; G111-R237 PolarHBondContact O-NH2 2.76Å
112	D	89.8	Confident	90.6	Very high	90 Å²	90	60.2 Å²	60.2	48%	0.481	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-49.7	167.7	-72.5	-24	0	0	0	111.7	D108 A109 L110 M114 K115 D116 R237	D108-D112 PolarHBondContact O-N 2.82Å; A109-D112 PolarHBondContact O-N 3.46Å; L110-D112 VanDerWaalsContact C-N 3.3Å; L110-D112 PolarHBondContact O-N 3.33Å; D112-M114 PolarHBondContact O-N 3.37Å; D112-K115 PolarHBondContact O-N 2.86Å; D112-D116 WeakPolarHBondContact O-CB 3.34Å; D112-D116 PolarHBondContact O-N 3.37Å; D112-R237 IonicContact OD1-CZ 3.68Å; D112-R237 IonicContact OD1-NH1 3.98Å; D112-R237 PolarHBondContact OD1-NH1 3.33Å; D112-R237 VanDerWaalsContact OD1-NH1 3.07Å; D112-R237 IonicContact OD1-NH2 2.73Å; D112-R237 PolarHBondContact OD1-NH2 2.94Å
113	M	91.4	Very high	92.2	Very high	43 Å²	43	52.1 Å²	52.1	21%	0.212	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-42.6	177.3	-65.7	173.1	60.5	0	0	112.5	L105 A109 L110 K115 D116 G117 I121	L105-M113 HydrophobicContact CD1-CE 4.35Å; L105-M113 HydrophobicContact CD1-SD 3.76Å; L105-M113 HydrophobicContact CD2-SD 3.82Å; L105-M113 HydrophobicContact CG-SD 4.47Å; A109-M113 WeakPolarHBondContact O-CG 3.47Å; A109-M113 PolarHBondContact O-N 2.95Å; L110-M113 PolarHBondContact O-N 3.49Å; M113-K115 VanDerWaalsContact C-N 3.3Å; M113-K115 PolarHBondContact O-N 2.91Å; M113-D116 PolarHBondContact O-N 2.91Å; M113-G117 PolarHBondContact O-N 3.41Å; M113-I121 HydrophobicContact CB-CD1 3.58Å; M113-I121 HydrophobicContact CE-CD1 4.39Å
114	M	91.6	Very high	92.4	Very high	63 Å²	63	51.7 Å²	51.7	31%	0.31	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-34.1	179	-72	176.4	74.7	0	0	112.5	L110 D112 I121 L123 W225	L110-M114 HydrophobicContact CD1-CG 4.13Å; L110-M114 HydrophobicContact CD1-SD 4.24Å; L110-M114 HydrophobicContact CG-CG 4.4Å; L110-M114 HydrophobicContact CG-SD 4.02Å; L110-M114 WeakPolarHBondContact O-CG 3.32Å; L110-M114 PolarHBondContact O-N 3.32Å; D112-M114 PolarHBondContact O-N 3.37Å; M114-I121 HydrophobicContact CB-CD1 4.31Å; M114-I121 HydrophobicContact CG-CD1 3.63Å; M114-L123 HydrophobicContact CE-CD1 4.06Å; M114-L123 HydrophobicContact SD-CD1 4.25Å; M114-W225 HydrophobicContact SD-CH2 3.84Å; M114-W225 HydrophobicContact SD-CZ3 4.46Å
115	K	89.4	Confident	92.6	Very high	152 Å²	152	48.9 Å²	48.9	66%	0.661	28%	0.28	S	S	*	.	H	α-helix	trans	-77	-41	179	-177.7	-176.9	176.2	-172.8	0	112.3	G111 D112 M113 G117	G111-K115 WeakPolarHBondContact O-CB 3.12Å; G111-K115 PolarHBondContact O-N 3.5Å; D112-K115 PolarHBondContact O-N 2.86Å; M113-K115 VanDerWaalsContact C-N 3.3Å; M113-K115 PolarHBondContact O-N 2.91Å; K115-G117 VanDerWaalsContact C-N 3.29Å; K115-G117 PolarHBondContact O-N 2.91Å
116	D	90	Very high	92.7	Very high	108 Å²	108	48 Å²	48	58%	0.578	28%	0.276	S	S	*	.	H	α-helix	trans	-60.9	-39.5	-179.7	173.1	69	0	0	0	111.7	D112 M113 S118	D112-D116 WeakPolarHBondContact O-CB 3.34Å; D112-D116 PolarHBondContact O-N 3.37Å; M113-D116 PolarHBondContact O-N 2.91Å; D116-S118 PolarHBondContact O-N 2.89Å; D116-S118 WeakPolarHBondContact OD2-CB 3.35Å; D116-S118 PolarHBondContact OD2-N 3.3Å; D116-S118 PolarHBondContact OD2-OG 2.93Å
117	G	88.7	Confident	92.8	Very high	56 Å²	56	45 Å²	45	58%	0.577	26%	0.257	S	S	*	.			trans	68.9	-1	172.1	0	0	0	0	0	115	M113 K115 T119	M113-G117 PolarHBondContact O-N 3.41Å; K115-G117 VanDerWaalsContact C-N 3.29Å; K115-G117 PolarHBondContact O-N 2.91Å; G117-T119 PolarHBondContact O-N 3.5Å
118	S	90.5	Very high	92.7	Very high	93 Å²	93	46.8 Å²	46.8	65%	0.65	26%	0.264	S	S	*	.	S	Bend	trans	-66.4	-24.5	174.9	73.2	0	0	0	0	112.6	D116	D116-S118 PolarHBondContact O-N 2.89Å; D116-S118 WeakPolarHBondContact OD2-CB 3.35Å; D116-S118 PolarHBondContact OD2-N 3.3Å; D116-S118 PolarHBondContact OD2-OG 2.93Å
119	T	90.3	Very high	92.4	Very high	48 Å²	48	47.3 Å²	47.3	29%	0.294	26%	0.263	S	S	.	.	S	Bend	trans	-113.7	125.1	179.9	-60.1	0	0	0	0	109.6	G117 I121 H184	G117-T119 PolarHBondContact O-N 3.5Å; T119-I121 PolarHBondContact O-N 3.27Å; T119-H184 HydrophobicContact CG2-CB 3.58Å
120	Q	93.2	Very high	92.1	Very high	105 Å²	105	47.8 Å²	47.8	49%	0.491	26%	0.264	S	S	.	.			trans	-68.4	113.1	169.8	-178.1	-179.8	-5.1	0	0	109.2	C183 H184	Q120-C183 HydrophobicContact CG-CB 4.4Å; Q120-C183 CarbonylContact O-C 3.6Å; Q120-C183 WeakPolarHBondContact O-CA 3.31Å; Q120-H184 PolarHBondContact O-N 2.83Å
121	I	94.8	Very high	91.7	Very high	36 Å²	36	57.8 Å²	57.8	19%	0.185	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	135.6	178.8	-58.5	171	0	0	0	109.4	L110 M113 M114 T119 L123 H184 V186	L110-I121 HydrophobicContact CD1-CD1 4.25Å; L110-I121 HydrophobicContact CD1-CG2 4.32Å; M113-I121 HydrophobicContact CB-CD1 3.58Å; M113-I121 HydrophobicContact CE-CD1 4.39Å; M114-I121 HydrophobicContact CB-CD1 4.31Å; M114-I121 HydrophobicContact CG-CD1 3.63Å; T119-I121 PolarHBondContact O-N 3.27Å; I121-L123 HydrophobicContact CG2-CD2 4.34Å; I121-L123 HydrophobicContact CG2-CG 4.08Å; I121-H184 WeakPolarHBondContact CA-O 3.31Å; I121-V186 HydrophobicContact CG2-CG2 4.02Å
122	C	96.2	Very high	91.7	Very high	19 Å²	19	62 Å²	62	13%	0.128	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	116	168.6	-75.1	0	0	0	0	109.2	L179 C183 H184 I185 V186	C122-L179 HydrophobicContact CB-CD2 3.57Å; C122-C183 HydrophobicContact CB-CB 3.89Å; C122-C183 WeakPolarHBondContact SG-CB 3.31Å; C122-C183 VanDerWaalsContact SG-SG 3.64Å; C122-H184 PolarHBondContact N-O 3.48Å; C122-I185 HydrophobicContact CB-CG1 4.47Å; C122-I185 CarbonylContact O-C 3.46Å; C122-I185 WeakPolarHBondContact O-CA 3.5Å; C122-V186 PolarHBondContact O-N 3.48Å
123	L	97.4	Very high	91.8	Very high	7 Å²	7	59 Å²	59	4%	0.037	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.8	-178.9	-71.8	160.9	0	0	0	109.9	L110 M114 I121 L142 P143 S145 R146 V186 Y188	L110-L123 HydrophobicContact CD1-CD2 4.26Å; L110-L123 HydrophobicContact CD2-CD2 3.91Å; M114-L123 HydrophobicContact CE-CD1 4.06Å; M114-L123 HydrophobicContact SD-CD1 4.25Å; I121-L123 HydrophobicContact CG2-CD2 4.34Å; I121-L123 HydrophobicContact CG2-CG 4.08Å; L123-L142 HydrophobicContact CD1-CB 4.12Å; L123-L142 HydrophobicContact CD1-CD2 4.39Å; L123-L142 HydrophobicContact CD2-CD2 3.88Å; L123-P143 VanDerWaalsContact CD1-O 3.26Å; L123-P143 WeakPolarHBondContact CD1-O 3.42Å; L123-S145 WeakPolarHBondContact O-CA 3.43Å; L123-S145 PolarHBondContact O-OG 2.92Å; L123-R146 PolarHBondContact O-N 2.93Å; L123-V186 HydrophobicContact CD2-CB 3.87Å; L123-V186 HydrophobicContact CD2-CG1 4.06Å; L123-Y188 HydrophobicContact CB-CE1 4.44Å
124	L	97.9	Very high	91.9	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117	178.1	-62.2	-179.2	0	0	0	109.5	T126 R146 F148 L177 L179 I185 V186 T187 Y188 V203 F207	L124-T126 HydrophobicContact CB-CG2 4.21Å; L124-R146 CarbonylContact C-O 3.56Å; L124-R146 WeakPolarHBondContact CA-O 3.5Å; L124-R146 HydrophobicContact CD2-CB 3.98Å; L124-F148 HydrophobicContact CB-CB 4.24Å; L124-F148 HydrophobicContact CD1-CD2 3.83Å; L124-F148 HydrophobicContact CD1-CE2 4.39Å; L124-F148 HydrophobicContact CD2-CB 4.48Å; L124-F148 HydrophobicContact CD2-CD2 4.39Å; L124-L177 HydrophobicContact CD2-CD1 4.3Å; L124-L179 HydrophobicContact CD1-CD1 4Å; L124-L179 HydrophobicContact CD2-CD1 4.24Å; L124-L179 HydrophobicContact CD2-CD2 4.17Å; L124-I185 HydrophobicContact CD1-CG2 3.56Å; L124-I185 HydrophobicContact CG-CG2 4.09Å; L124-V186 PolarHBondContact N-O 3.44Å; L124-T187 HydrophobicContact CB-CG2 4.48Å; L124-T187 HydrophobicContact CD1-CG2 4.38Å; L124-Y188 WeakPolarHBondContact O-CD1 3.23Å; L124-Y188 PolarHBondContact O-N 2.92Å; L124-V203 HydrophobicContact CD1-CG1 4.37Å; L124-F207 HydrophobicContact CD1-CE2 3.59Å; L124-F207 HydrophobicContact CD1-CZ 3.84Å
125	D	96.9	Very high	92	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	114.6	166.2	-164.9	-53	0	0	0	108.8	L127 F137 S145 R146 F148 Y188 H190	D125-L127 WeakPolarHBondContact OD1-CB 3.34Å; D125-L127 PolarHBondContact OD1-N 2.93Å; D125-F137 HydrophobicContact CB-CD2 3.55Å; D125-F137 HydrophobicContact CB-CE2 3.93Å; D125-S145 PolarHBondContact N-OG 3.49Å; D125-R146 PolarHBondContact N-O 2.9Å; D125-F148 PolarHBondContact O-N 3.46Å; D125-Y188 HydrophobicContact CB-CE1 4.2Å; D125-Y188 HydrophobicContact CB-CE2 4.06Å; D125-Y188 VanDerWaalsContact CB-OH 3.3Å; D125-Y188 WeakPolarHBondContact CB-OH 3.02Å; D125-Y188 WeakPolarHBondContact OD2-CE2 3.42Å; D125-Y188 PolarHBondContact OD2-OH 3.42Å; D125-H190 IonicContact OD1-CD2 3.37Å; D125-H190 IonicContact OD1-NE2 2.87Å; D125-H190 PolarHBondContact OD1-NE2 2.89Å; D125-H190 IonicContact OD2-CD2 2.75Å; D125-H190 IonicContact OD2-CE1 3.5Å; D125-H190 IonicContact OD2-NE2 3.61Å; D125-H190 PolarHBondContact OD2-NE2 2.98Å
126	T	96.5	Very high	92.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.			trans	-109.2	16.3	-171.1	65	0	0	0	0	112.7	L124 H128 F148 T187 Y188 S199 A200 V203	L124-T126 HydrophobicContact CB-CG2 4.21Å; T126-H128 PolarHBondContact O-N 3.45Å; T126-F148 HydrophobicContact CG2-CB 4.28Å; T126-T187 HydrophobicContact CG2-CG2 4.25Å; T126-Y188 PolarHBondContact N-O 3.3Å; T126-Y188 PolarHBondContact OG1-O 3.25Å; T126-Y188 VanDerWaalsContact OG1-O 3.09Å; T126-S199 WeakPolarHBondContact O-CB 3.48Å; T126-S199 PolarHBondContact O-OG 2.93Å; T126-A200 WeakPolarHBondContact OG1-CA 3.48Å; T126-A200 PolarHBondContact OG1-N 2.87Å; T126-V203 HydrophobicContact CG2-CB 3.79Å; T126-V203 HydrophobicContact CG2-CG1 4Å; T126-V203 HydrophobicContact CG2-CG2 3.6Å
127	L	93.2	Very high	92.3	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.063	29%	0.286	C	S	.	.			trans	-52.7	127	-179.4	-177.5	66.8	0	0	0	110.7	D125 P133 V136 H190	D125-L127 WeakPolarHBondContact OD1-CB 3.34Å; D125-L127 PolarHBondContact OD1-N 2.93Å; L127-P133 HydrophobicContact CB-CB 4.31Å; L127-P133 HydrophobicContact CD2-CB 4.29Å; L127-P133 HydrophobicContact CG-CB 4.15Å; L127-P133 WeakPolarHBondContact O-CB 3.45Å; L127-V136 HydrophobicContact CD2-CB 3.65Å; L127-V136 HydrophobicContact CD2-CG1 3.73Å; L127-V136 HydrophobicContact CD2-CG2 3.95Å; L127-H190 HydrophobicContact CD1-CB 4.31Å
128	H	90.4	Very high	92.7	Very high	42 Å²	42	51.7 Å²	51.7	19%	0.194	27%	0.274	C	S	.	.			trans	-122.7	-44.9	-178.6	-176.4	59.9	0	0	0	112.4	T126 S130 I150 D151	T126-H128 PolarHBondContact O-N 3.45Å; H128-S130 PolarHBondContact O-N 3.47Å; H128-I150 HydrophobicContact CB-CD1 3.78Å; H128-D151 IonicContact CE1-OD1 2.8Å; H128-D151 PolarHBondContact CE1-OD1 3.4Å; H128-D151 IonicContact ND1-OD1 3.76Å
129	F	85.4	Confident	92.8	Very high	85 Å²	85	53.9 Å²	53.9	37%	0.373	27%	0.274	S	S	.	.	S	Bend	trans	-81.2	55.5	-177	-52.4	-75.7	0	0	0	112.9	T198 I340	F129-T198 VanDerWaalsContact CE2-OG1 3.25Å; F129-T198 WeakPolarHBondContact CE2-OG1 3.38Å; F129-I340 HydrophobicContact CE2-CG2 4.08Å; F129-I340 HydrophobicContact CZ-CG2 3.65Å
130	S	85.4	Confident	93	Very high	43 Å²	43	52.3 Å²	52.3	30%	0.301	27%	0.267	S	S	.	.	S	Bend	trans	-133.4	148.2	170.4	168.3	0	0	0	0	108.4	H128 N132 P133 V136	H128-S130 PolarHBondContact O-N 3.47Å; S130-N132 PolarHBondContact O-N 2.9Å; S130-N132 PolarHBondContact OG-N 3.03Å; S130-P133 VanDerWaalsContact O-CD 3.27Å; S130-P133 WeakPolarHBondContact O-CD 3.44Å; S130-P133 WeakPolarHBondContact O-CG 3.23Å; S130-V136 WeakPolarHBondContact OG-CG2 3.46Å
131	E	86	Confident	93.1	Very high	211 Å²	211	47.6 Å²	47.6	99%	0.986	25%	0.245	S	C	*	.	S	Bend	trans	-58.4	-29.6	175.5	-66	-173.1	167.8	0	0	112.2
132	N	91	Very high	93.2	Very high	90 Å²	90	45.9 Å²	45.9	48%	0.481	24%	0.236	S	C	.	.			trans	-146.3	78.4	176.9	-170.3	-16.9	0	0	0	110.7	S130 K134 S135 V136	S130-N132 PolarHBondContact O-N 2.9Å; S130-N132 PolarHBondContact OG-N 3.03Å; N132-K134 PolarHBondContact O-N 3.46Å; N132-K134 VanDerWaalsContact O-N 3.16Å; N132-S135 WeakPolarHBondContact O-CB 3.39Å; N132-S135 PolarHBondContact O-N 3.03Å; N132-S135 PolarHBondContact OD1-N 3.36Å; N132-V136 PolarHBondContact O-N 2.94Å
133	P	91.6	Very high	93	Very high	26 Å²	26	45.8 Å²	45.8	17%	0.169	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-32.2	-174.3	-22.2	33.4	0	0	0	113	L127 S130 V136 F137	L127-P133 HydrophobicContact CB-CB 4.31Å; L127-P133 HydrophobicContact CD2-CB 4.29Å; L127-P133 HydrophobicContact CG-CB 4.15Å; L127-P133 WeakPolarHBondContact O-CB 3.45Å; S130-P133 VanDerWaalsContact O-CD 3.27Å; S130-P133 WeakPolarHBondContact O-CD 3.44Å; S130-P133 WeakPolarHBondContact O-CG 3.23Å; P133-V136 PolarHBondContact O-N 3.37Å; P133-F137 PolarHBondContact O-N 3.39Å
134	K	92.7	Very high	92.8	Very high	122 Å²	122	51.5 Å²	51.5	53%	0.53	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-40.2	174.5	-173.8	176.8	179.8	179.7	0	112.3	N132 F137 L138	N132-K134 PolarHBondContact O-N 3.46Å; N132-K134 VanDerWaalsContact O-N 3.16Å; K134-F137 WeakPolarHBondContact O-CB 3.48Å; K134-F137 PolarHBondContact O-N 2.83Å; K134-L138 VanDerWaalsContact O-CG 3.31Å; K134-L138 WeakPolarHBondContact O-CG 3.5Å; K134-L138 PolarHBondContact O-N 3.16Å; K134-L138 VanDerWaalsContact O-N 3.12Å
135	S	93.8	Very high	92.8	Very high	44 Å²	44	51.5 Å²	51.5	31%	0.308	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-45.9	174.7	-169	0	0	0	0	111	N132 F137 L138 E139	N132-S135 WeakPolarHBondContact O-CB 3.39Å; N132-S135 PolarHBondContact O-N 3.03Å; N132-S135 PolarHBondContact OD1-N 3.36Å; S135-F137 VanDerWaalsContact C-N 3.31Å; S135-F137 PolarHBondContact O-N 2.94Å; S135-L138 WeakPolarHBondContact O-CB 3.46Å; S135-L138 PolarHBondContact O-N 3.32Å; S135-E139 PolarHBondContact O-N 3.22Å; S135-E139 VanDerWaalsContact O-N 3.13Å; S135-E139 PolarHBondContact OG-OE1 3.2Å
136	V	92.7	Very high	92.8	Very high	35 Å²	35	53.3 Å²	53.3	21%	0.212	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-41.3	178.8	-169.5	0	0	0	0	111.1	L127 S130 N132 P133 L138 E139 G140 H190	L127-V136 HydrophobicContact CD2-CB 3.65Å; L127-V136 HydrophobicContact CD2-CG1 3.73Å; L127-V136 HydrophobicContact CD2-CG2 3.95Å; S130-V136 WeakPolarHBondContact OG-CG2 3.46Å; N132-V136 PolarHBondContact O-N 2.94Å; P133-V136 PolarHBondContact O-N 3.37Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 2.96Å; V136-E139 WeakPolarHBondContact O-CB 3.29Å; V136-E139 PolarHBondContact O-N 3.33Å; V136-E139 VanDerWaalsContact O-N 3.15Å; V136-G140 PolarHBondContact O-N 2.88Å; V136-H190 VanDerWaalsContact CG1-CE1 3.45Å; V136-H190 WeakPolarHBondContact CG1-CE1 3.23Å; V136-H190 WeakPolarHBondContact CG1-ND1 3.41Å
137	F	94.7	Very high	92.7	Very high	7 Å²	7	55 Å²	55	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-56.6	-43.4	171.9	173.5	-92.5	0	0	0	112.2	D125 P133 K134 S135 E139 G140 H141 H147 A245	D125-F137 HydrophobicContact CB-CD2 3.55Å; D125-F137 HydrophobicContact CB-CE2 3.93Å; P133-F137 PolarHBondContact O-N 3.39Å; K134-F137 WeakPolarHBondContact O-CB 3.48Å; K134-F137 PolarHBondContact O-N 2.83Å; S135-F137 VanDerWaalsContact C-N 3.31Å; S135-F137 PolarHBondContact O-N 2.94Å; F137-E139 PolarHBondContact O-N 3.29Å; F137-G140 PolarHBondContact O-N 3.29Å; F137-H141 HydrophobicContact CD2-CB 3.67Å; F137-H141 AromaticContact CD2-CG 3.89Å; F137-H141 AromaticContact CE1-CE1 3.85Å; F137-H141 AromaticContact CE1-ND1 3.95Å; F137-H141 HydrophobicContact CE2-CB 3.56Å; F137-H141 AromaticContact CE2-CD2 3.67Å; F137-H141 AromaticContact CE2-CG 3.46Å; F137-H141 VanDerWaalsContact CE2-CG 3.46Å; F137-H141 AromaticContact CE2-ND1 3.89Å; F137-H141 HydrophobicContact CZ-CB 4.29Å; F137-H141 AromaticContact CZ-CD2 3.58Å; F137-H141 AromaticContact CZ-CE1 3.78Å; F137-H141 AromaticContact CZ-CG 3.68Å; F137-H141 AromaticContact CZ-ND1 3.79Å; F137-H141 AromaticContact CZ-NE2 3.68Å; F137-H141 PolarHBondContact O-ND1 2.99Å; F137-H147 HydrophobicContact CB-CB 4.31Å; F137-H147 HydrophobicContact CD1-CB 3.99Å; F137-H147 HydrophobicContact CD2-CB 3.93Å; F137-H147 HydrophobicContact CE1-CB 4.33Å; F137-H147 HydrophobicContact CE2-CB 4.25Å; F137-H147 HydrophobicContact CG-CB 3.79Å; F137-H147 HydrophobicContact CZ-CB 4.45Å; F137-A245 HydrophobicContact CE1-CB 4.38Å; F137-A245 HydrophobicContact CZ-CB 4.16Å
138	L	95.5	Very high	92.9	Very high	61 Å²	61	54.4 Å²	54.4	32%	0.319	28%	0.277	S	S	.	.	H	α-helix	trans	-66.2	-27	179.7	-64.5	174	0	0	0	112.7	K134 S135 V136 S242 G243 L244	K134-L138 VanDerWaalsContact O-CG 3.31Å; K134-L138 WeakPolarHBondContact O-CG 3.5Å; K134-L138 PolarHBondContact O-N 3.16Å; K134-L138 VanDerWaalsContact O-N 3.12Å; S135-L138 WeakPolarHBondContact O-CB 3.46Å; S135-L138 PolarHBondContact O-N 3.32Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 2.96Å; L138-S242 WeakPolarHBondContact O-CB 3.45Å; L138-G243 VanDerWaalsContact CD2-C 3.45Å; L138-G243 WeakPolarHBondContact CD2-O 3.36Å; L138-G243 PolarHBondContact O-N 3.03Å; L138-L244 HydrophobicContact CD2-CD2 3.85Å; L138-L244 HydrophobicContact CD2-CG 4.26Å
139	E	94.1	Very high	93.2	Very high	138 Å²	138	54.6 Å²	54.6	65%	0.645	28%	0.28	S	S	*	.	H	α-helix	trans	-74.3	-38.9	177.9	-69.1	166.3	-151.8	0	0	111.9	S135 V136 F137 S242	S135-E139 PolarHBondContact O-N 3.22Å; S135-E139 VanDerWaalsContact O-N 3.13Å; S135-E139 PolarHBondContact OG-OE1 3.2Å; V136-E139 WeakPolarHBondContact O-CB 3.29Å; V136-E139 PolarHBondContact O-N 3.33Å; V136-E139 VanDerWaalsContact O-N 3.15Å; F137-E139 PolarHBondContact O-N 3.29Å; E139-S242 WeakPolarHBondContact O-CB 3.29Å
140	G	93.7	Very high	93.7	Very high	15 Å²	15	50.6 Å²	50.6	16%	0.155	26%	0.263	C	S	.	.			trans	-170.9	134.7	178.1	0	0	0	0	0	113.8	V136 F137 L222 A241	V136-G140 PolarHBondContact O-N 2.88Å; F137-G140 PolarHBondContact O-N 3.29Å; G140-L222 WeakPolarHBondContact O-CD2 3.36Å; G140-A241 CarbonylContact C-O 3.55Å; G140-A241 WeakPolarHBondContact CA-O 3.46Å
141	H	95.6	Very high	94.2	Very high	6 Å²	6	53.1 Å²	53.1	3%	0.028	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-152.8	170.6	178.4	53	-85.6	0	0	0	111.5	F137 Y188 A241 G243	F137-H141 HydrophobicContact CD2-CB 3.67Å; F137-H141 AromaticContact CD2-CG 3.89Å; F137-H141 AromaticContact CE1-CE1 3.85Å; F137-H141 AromaticContact CE1-ND1 3.95Å; F137-H141 HydrophobicContact CE2-CB 3.56Å; F137-H141 AromaticContact CE2-CD2 3.67Å; F137-H141 AromaticContact CE2-CG 3.46Å; F137-H141 VanDerWaalsContact CE2-CG 3.46Å; F137-H141 AromaticContact CE2-ND1 3.89Å; F137-H141 HydrophobicContact CZ-CB 4.29Å; F137-H141 AromaticContact CZ-CD2 3.58Å; F137-H141 AromaticContact CZ-CE1 3.78Å; F137-H141 AromaticContact CZ-CG 3.68Å; F137-H141 AromaticContact CZ-ND1 3.79Å; F137-H141 AromaticContact CZ-NE2 3.68Å; F137-H141 PolarHBondContact O-ND1 2.99Å; H141-Y188 WeakPolarHBondContact CB-OH 3.41Å; H141-A241 PolarHBondContact N-O 3.16Å; H141-A241 PolarHBondContact ND1-O 3.17Å; H141-A241 PolarHBondContact O-N 2.93Å; H141-G243 PolarHBondContact CE1-O 3.42Å; H141-G243 VanDerWaalsContact CE1-O 3.25Å
142	L	96	Very high	94.7	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.			trans	-66.7	143.3	171.3	-88.5	69.8	0	0	0	110.4	L110 L123 N144 S145 Y188 L218 L222 W225	L110-L142 HydrophobicContact CD2-CD2 3.53Å; L123-L142 HydrophobicContact CD1-CB 4.12Å; L123-L142 HydrophobicContact CD1-CD2 4.39Å; L123-L142 HydrophobicContact CD2-CD2 3.88Å; L142-N144 PolarHBondContact O-N 2.89Å; L142-S145 WeakPolarHBondContact O-CB 3.44Å; L142-S145 PolarHBondContact O-N 2.94Å; L142-Y188 HydrophobicContact CB-CE1 4.1Å; L142-Y188 HydrophobicContact CD1-CD2 4.1Å; L142-Y188 HydrophobicContact CD1-CE1 4.2Å; L142-Y188 HydrophobicContact CD1-CE2 3.83Å; L142-Y188 HydrophobicContact CD1-CG 4.48Å; L142-Y188 HydrophobicContact CD2-CD1 4.47Å; L142-Y188 HydrophobicContact CD2-CE1 4.43Å; L142-Y188 HydrophobicContact CG-CE1 4.47Å; L142-Y188 PolarHBondContact N-OH 3.17Å; L142-L218 HydrophobicContact CD1-CD2 4.48Å; L142-L218 HydrophobicContact CD2-CD2 3.86Å; L142-L222 HydrophobicContact CD1-CD1 3.49Å; L142-L222 VanDerWaalsContact CD1-CD1 3.49Å; L142-W225 HydrophobicContact CD1-CB 3.98Å; L142-W225 HydrophobicContact CD1-CD2 4.41Å; L142-W225 HydrophobicContact CD1-CG 3.83Å; L142-W225 HydrophobicContact CD2-CD2 4.03Å; L142-W225 HydrophobicContact CD2-CE3 4.17Å; L142-W225 HydrophobicContact CD2-CG 4.28Å; L142-W225 HydrophobicContact CG-CB 4.49Å; L142-W225 HydrophobicContact CG-CD2 3.97Å; L142-W225 HydrophobicContact CG-CG 3.89Å
143	P	93.3	Very high	95	Very high	17 Å²	17	43.7 Å²	43.7	11%	0.11	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	136.4	178.8	-25.7	33.4	0	0	0	113.1	L123 S145 T239	L123-P143 VanDerWaalsContact CD1-O 3.26Å; L123-P143 WeakPolarHBondContact CD1-O 3.42Å; P143-S145 PolarHBondContact O-N 2.9Å; P143-T239 WeakPolarHBondContact CD-O 3.17Å; P143-T239 VanDerWaalsContact CG-O 3.29Å; P143-T239 WeakPolarHBondContact CG-O 3.29Å; P143-T239 WeakPolarHBondContact CG-OG1 3.17Å
144	N	92.7	Very high	95.3	Very high	127 Å²	127	43.5 Å²	43.5	68%	0.679	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.8	10.3	-177.2	-52.6	-56.3	0	0	0	115.6	L142	L142-N144 PolarHBondContact O-N 2.89Å
145	S	96.7	Very high	95.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.221	C	C	.	.			trans	-65.9	157.4	175.2	-171.8	0	0	0	0	112.9	L123 D125 L142 P143 Y188 A245	L123-S145 WeakPolarHBondContact O-CA 3.43Å; L123-S145 PolarHBondContact O-OG 2.92Å; D125-S145 PolarHBondContact N-OG 3.49Å; L142-S145 WeakPolarHBondContact O-CB 3.44Å; L142-S145 PolarHBondContact O-N 2.94Å; P143-S145 PolarHBondContact O-N 2.9Å; S145-Y188 WeakPolarHBondContact CB-OH 3.29Å; S145-Y188 VanDerWaalsContact OG-CE1 3.25Å; S145-Y188 WeakPolarHBondContact OG-CE1 3.27Å; S145-Y188 PolarHBondContact OG-OH 3.03Å; S145-A245 WeakPolarHBondContact O-CB 3.22Å
146	R	96.9	Very high	95.3	Very high	38 Å²	38	45.9 Å²	45.9	14%	0.143	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.2	172.6	-54.9	-68.2	157.7	-178.2	-8.3	108.7	L123 L124 D125 F148 A246 V248	L123-R146 PolarHBondContact O-N 2.93Å; L124-R146 CarbonylContact C-O 3.56Å; L124-R146 WeakPolarHBondContact CA-O 3.5Å; L124-R146 HydrophobicContact CD2-CB 3.98Å; D125-R146 PolarHBondContact N-O 2.9Å; R146-F148 PolarHBondContact O-N 2.85Å; R146-A246 PolarHBondContact NH1-O 2.97Å; R146-A246 PolarHBondContact NH2-O 3.01Å; R146-V248 VanDerWaalsContact CZ-CG1 3.47Å
147	H	96.2	Very high	95	Very high	35 Å²	35	45.4 Å²	45.4	16%	0.162	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	120.3	165.6	-178.3	53.9	0	0	0	109.8	F137	F137-H147 HydrophobicContact CB-CB 4.31Å; F137-H147 HydrophobicContact CD1-CB 3.99Å; F137-H147 HydrophobicContact CD2-CB 3.93Å; F137-H147 HydrophobicContact CE1-CB 4.33Å; F137-H147 HydrophobicContact CE2-CB 4.25Å; F137-H147 HydrophobicContact CG-CB 3.79Å; F137-H147 HydrophobicContact CZ-CB 4.45Å
148	F	97.2	Very high	94.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.			trans	-100.8	106.6	171.8	-171.9	-77.1	0	0	0	108.2	L124 D125 T126 R146 I150 V153 F170 Y173 V174 L177 V203 F207	L124-F148 HydrophobicContact CB-CB 4.24Å; L124-F148 HydrophobicContact CD1-CD2 3.83Å; L124-F148 HydrophobicContact CD1-CE2 4.39Å; L124-F148 HydrophobicContact CD2-CB 4.48Å; L124-F148 HydrophobicContact CD2-CD2 4.39Å; D125-F148 PolarHBondContact O-N 3.46Å; T126-F148 HydrophobicContact CG2-CB 4.28Å; R146-F148 PolarHBondContact O-N 2.85Å; F148-I150 HydrophobicContact CD1-CG1 4.03Å; F148-I150 HydrophobicContact CE1-CG1 4.06Å; F148-I150 PolarHBondContact O-N 2.64Å; F148-V153 HydrophobicContact CE1-CG1 4.21Å; F148-V153 HydrophobicContact CE1-CG2 3.87Å; F148-V153 HydrophobicContact CZ-CG1 3.73Å; F148-V153 HydrophobicContact CZ-CG2 4.06Å; F148-F170 HydrophobicContact CZ-CE2 4.31Å; F148-Y173 WeakPolarHBondContact CA-OH 3.2Å; F148-Y173 HydrophobicContact CD1-CE1 4.43Å; F148-Y173 AromaticContact CD2-CE1 3.84Å; F148-Y173 HydrophobicContact CD2-CE1 3.84Å; F148-Y173 HydrophobicContact CE1-CE1 4.23Å; F148-Y173 HydrophobicContact CE2-CD1 4.22Å; F148-Y173 AromaticContact CE2-CE1 3.64Å; F148-Y173 HydrophobicContact CE2-CE1 3.64Å; F148-Y173 HydrophobicContact CG-CE1 4.26Å; F148-Y173 HydrophobicContact CZ-CD1 4.39Å; F148-Y173 AromaticContact CZ-CE1 3.85Å; F148-Y173 HydrophobicContact CZ-CE1 3.85Å; F148-V174 HydrophobicContact CE2-CG1 4.06Å; F148-L177 HydrophobicContact CD2-CD1 3.81Å; F148-V203 HydrophobicContact CD1-CG1 4.18Å; F148-V203 HydrophobicContact CD1-CG2 3.69Å; F148-V203 HydrophobicContact CD2-CG1 4.29Å; F148-V203 HydrophobicContact CE1-CB 4.47Å; F148-V203 HydrophobicContact CE1-CG1 4Å; F148-V203 HydrophobicContact CE1-CG2 3.61Å; F148-V203 HydrophobicContact CE2-CG1 4.08Å; F148-V203 HydrophobicContact CG-CG1 4.32Å; F148-V203 HydrophobicContact CG-CG2 4.48Å; F148-V203 HydrophobicContact CZ-CG1 3.92Å; F148-V203 HydrophobicContact CZ-CG2 4.33Å; F148-F207 HydrophobicContact CE2-CE2 4.27Å; F148-F207 HydrophobicContact CE2-CZ 4.32Å
149	D	96.4	Very high	93.7	Very high	46 Å²	46	50 Å²	50	25%	0.246	27%	0.27	C	S	.	.			trans	-81.3	104.8	175.3	178.2	6	0	0	0	108.9	D151 Q152 Y173	D149-D151 PolarHBondContact O-N 2.88Å; D149-D151 WeakPolarHBondContact OD1-CB 3.33Å; D149-D151 PolarHBondContact OD1-N 3.27Å; D149-D151 VanDerWaalsContact OD1-N 3.11Å; D149-Q152 HydrophobicContact CB-CG 3.8Å; D149-Q152 WeakPolarHBondContact O-CB 3.44Å; D149-Q152 PolarHBondContact O-N 2.87Å; D149-Q152 VanDerWaalsContact O-N 3.13Å; D149-Q152 WeakPolarHBondContact OD2-CG 3.25Å; D149-Q152 PolarHBondContact OD2-NE2 2.9Å; D149-Y173 PolarHBondContact N-OH 3.04Å
150	I	96.3	Very high	93.1	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-59.3	-29.2	-179.4	-82.9	163.2	0	0	0	111.6	H128 F148 Q152 V153 L154 F202 V203 I340	H128-I150 HydrophobicContact CB-CD1 3.78Å; F148-I150 HydrophobicContact CD1-CG1 4.03Å; F148-I150 HydrophobicContact CE1-CG1 4.06Å; F148-I150 PolarHBondContact O-N 2.64Å; I150-Q152 PolarHBondContact O-N 3.17Å; I150-Q152 VanDerWaalsContact O-N 3.16Å; I150-V153 WeakPolarHBondContact O-CG2 3.49Å; I150-V153 PolarHBondContact O-N 2.97Å; I150-L154 HydrophobicContact CG2-CD1 3.5Å; I150-L154 VanDerWaalsContact CG2-CD1 3.5Å; I150-L154 HydrophobicContact CG2-CG 4.18Å; I150-L154 PolarHBondContact O-N 2.89Å; I150-F202 HydrophobicContact CD1-CD1 4.14Å; I150-F202 HydrophobicContact CG1-CD1 4.31Å; I150-F202 HydrophobicContact CG2-CD1 4.27Å; I150-F202 HydrophobicContact CG2-CE1 3.93Å; I150-V203 HydrophobicContact CD1-CG2 3.89Å; I150-V203 HydrophobicContact CG1-CG2 3.78Å; I150-I340 HydrophobicContact CG2-CD1 4.17Å
151	D	94.9	Very high	92.7	Very high	95 Å²	95	48 Å²	48	51%	0.508	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-64.7	-24.8	179.9	-63.2	-14.8	0	0	0	111.8	H128 D149 V153 L154	H128-D151 IonicContact CE1-OD1 2.8Å; H128-D151 PolarHBondContact CE1-OD1 3.4Å; H128-D151 IonicContact ND1-OD1 3.76Å; D149-D151 PolarHBondContact O-N 2.88Å; D149-D151 WeakPolarHBondContact OD1-CB 3.33Å; D149-D151 PolarHBondContact OD1-N 3.27Å; D149-D151 VanDerWaalsContact OD1-N 3.11Å; D151-V153 PolarHBondContact O-N 3.27Å; D151-L154 PolarHBondContact O-N 2.81Å
152	Q	97	Very high	92.5	Very high	104 Å²	104	50.2 Å²	50.2	49%	0.486	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-71.3	-17.1	177.9	-57.9	-60.6	-45.7	0	0	113.5	D149 I150 Y173	D149-Q152 HydrophobicContact CB-CG 3.8Å; D149-Q152 WeakPolarHBondContact O-CB 3.44Å; D149-Q152 PolarHBondContact O-N 2.87Å; D149-Q152 VanDerWaalsContact O-N 3.13Å; D149-Q152 WeakPolarHBondContact OD2-CG 3.25Å; D149-Q152 PolarHBondContact OD2-NE2 2.9Å; I150-Q152 PolarHBondContact O-N 3.17Å; I150-Q152 VanDerWaalsContact O-N 3.16Å; Q152-Y173 HydrophobicContact CB-CD1 4.03Å; Q152-Y173 HydrophobicContact CB-CD2 3.68Å; Q152-Y173 HydrophobicContact CB-CE1 3.96Å; Q152-Y173 HydrophobicContact CB-CE2 3.64Å; Q152-Y173 HydrophobicContact CB-CG 3.89Å; Q152-Y173 HydrophobicContact CG-CD2 3.97Å; Q152-Y173 HydrophobicContact CG-CE2 3.57Å
153	V	97.3	Very high	92.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-110.9	3.2	-178.2	-58.2	0	0	0	0	113	F148 I150 D151 V165 F170 Y173 I206	F148-V153 HydrophobicContact CE1-CG1 4.21Å; F148-V153 HydrophobicContact CE1-CG2 3.87Å; F148-V153 HydrophobicContact CZ-CG1 3.73Å; F148-V153 HydrophobicContact CZ-CG2 4.06Å; I150-V153 WeakPolarHBondContact O-CG2 3.49Å; I150-V153 PolarHBondContact O-N 2.97Å; D151-V153 PolarHBondContact O-N 3.27Å; V153-V165 HydrophobicContact CB-CG2 4.44Å; V153-V165 PolarHBondContact O-N 3.43Å; V153-V165 VanDerWaalsContact O-N 3.1Å; V153-F170 HydrophobicContact CB-CD2 4.26Å; V153-F170 HydrophobicContact CG1-CD2 3.63Å; V153-F170 HydrophobicContact CG1-CE2 4.05Å; V153-Y173 HydrophobicContact CG1-CD1 3.51Å; V153-Y173 HydrophobicContact CG1-CE1 3.91Å; V153-Y173 HydrophobicContact CG1-CG 4.47Å; V153-I206 HydrophobicContact CG2-CD1 3.72Å
154	L	96.5	Very high	92.6	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.9	176.8	-65.6	176.4	0	0	0	111.5	I150 D151 E162 R163 L164 F202 I340	I150-L154 HydrophobicContact CG2-CD1 3.5Å; I150-L154 VanDerWaalsContact CG2-CD1 3.5Å; I150-L154 HydrophobicContact CG2-CG 4.18Å; I150-L154 PolarHBondContact O-N 2.89Å; D151-L154 PolarHBondContact O-N 2.81Å; L154-E162 HydrophobicContact CD1-CB 4.44Å; L154-E162 WeakPolarHBondContact CD1-OE2 3.45Å; L154-E162 HydrophobicContact CD2-CB 4.17Å; L154-R163 CarbonylContact C-O 3.48Å; L154-R163 VanDerWaalsContact CA-O 3.27Å; L154-R163 WeakPolarHBondContact CA-O 3.18Å; L154-L164 HydrophobicContact CD2-CD2 4.25Å; L154-F202 HydrophobicContact CD2-CE1 4.25Å; L154-F202 HydrophobicContact CD2-CZ 3.87Å; L154-I340 HydrophobicContact CD1-CD1 4.06Å
155	R	95.4	Very high	92.9	Very high	128 Å²	128	44.8 Å²	44.8	48%	0.483	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.2	170.5	64.7	177.9	178.3	81.7	0.2	109.2	G157 R163 L164 V165	R155-G157 PolarHBondContact O-N 3.28Å; R155-R163 HydrophobicContact CG-CB 3.87Å; R155-R163 WeakPolarHBondContact CG-O 3.4Å; R155-R163 PolarHBondContact N-O 2.7Å; R155-R163 PolarHBondContact O-N 2.66Å; R155-L164 PolarHBondContact NE-O 2.76Å; R155-V165 HydrophobicContact CB-CG1 4.33Å
156	A	91.8	Very high	92.9	Very high	88 Å²	88	48.1 Å²	48.1	73%	0.727	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	132	173.6	0	0	0	0	0	111.7
157	G	86.9	Confident	92.9	Very high	25 Å²	25	48.1 Å²	48.1	26%	0.258	27%	0.274	S	S	.	.			trans	-103.9	-160	167.1	0	0	0	0	0	111.8	R155 S161	R155-G157 PolarHBondContact O-N 3.28Å; G157-S161 WeakPolarHBondContact CA-O 3.47Å; G157-S161 PolarHBondContact N-O 2.75Å
158	V	80.1	Confident	93	Very high	64 Å²	64	52.6 Å²	52.6	39%	0.388	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-71.6	136.9	178	-176.4	0	0	0	0	109.7	S160 S161 R369	V158-S160 VanDerWaalsContact C-N 3.34Å; V158-S160 PolarHBondContact O-N 3.39Å; V158-S161 PolarHBondContact N-OG 3.35Å; V158-S161 WeakPolarHBondContact O-CB 3.39Å; V158-S161 PolarHBondContact O-N 3.38Å; V158-S161 PolarHBondContact O-OG 3.08Å; V158-R369 HydrophobicContact CG1-CG 4.28Å
159	N	81.9	Confident	93	Very high	100 Å²	100	57.4 Å²	57.4	54%	0.535	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	48	51.6	177.7	-65.5	-35.2	0	0	0	113.4	S161 T364 A368	N159-S161 PolarHBondContact O-N 2.97Å; N159-T364 WeakPolarHBondContact O-CG2 3.38Å; N159-A368 HydrophobicContact CB-CB 4.21Å; N159-A368 WeakPolarHBondContact ND2-CB 3.32Å
160	S	81.7	Confident	93.1	Very high	108 Å²	108	55.2 Å²	55.2	76%	0.755	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	58.8	10.9	-178.9	51.1	0	0	0	0	116.1	V158	V158-S160 VanDerWaalsContact C-N 3.34Å; V158-S160 PolarHBondContact O-N 3.39Å
161	S	86.3	Confident	93.2	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.021	32%	0.316	C	S	.	.			trans	-60.4	143.5	166.3	58.7	0	0	0	0	110.1	G157 V158 N159	G157-S161 WeakPolarHBondContact CA-O 3.47Å; G157-S161 PolarHBondContact N-O 2.75Å; V158-S161 PolarHBondContact N-OG 3.35Å; V158-S161 WeakPolarHBondContact O-CB 3.39Å; V158-S161 PolarHBondContact O-N 3.38Å; V158-S161 PolarHBondContact O-OG 3.08Å; N159-S161 PolarHBondContact O-N 2.97Å
162	E	90.8	Very high	93.4	Very high	53 Å²	53	54.8 Å²	54.8	25%	0.248	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	147.3	176	-59.6	-175.4	146.3	0	0	110.6	L154 I340	L154-E162 HydrophobicContact CD1-CB 4.44Å; L154-E162 WeakPolarHBondContact CD1-OE2 3.45Å; L154-E162 HydrophobicContact CD2-CB 4.17Å; E162-I340 VanDerWaalsContact OE2-CD1 3.27Å; E162-I340 WeakPolarHBondContact OE2-CD1 3.39Å
163	R	95.1	Very high	93.4	Very high	19 Å²	19	51.3 Å²	51.3	7%	0.072	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.6	177.9	-63.3	-66.2	166.3	172	-4.6	110.9	L154 R155 E360 G361 E365	L154-R163 CarbonylContact C-O 3.48Å; L154-R163 VanDerWaalsContact CA-O 3.27Å; L154-R163 WeakPolarHBondContact CA-O 3.18Å; R155-R163 HydrophobicContact CG-CB 3.87Å; R155-R163 WeakPolarHBondContact CG-O 3.4Å; R155-R163 PolarHBondContact N-O 2.7Å; R155-R163 PolarHBondContact O-N 2.66Å; R163-E360 VanDerWaalsContact CD-CD 3.4Å; R163-E360 WeakPolarHBondContact CD-OE2 3.45Å; R163-E360 IonicContact CZ-OE2 3.94Å; R163-E360 IonicContact NE-OE2 3.58Å; R163-E360 IonicContact NH1-OE2 3.91Å; R163-E360 PolarHBondContact NH1-OE2 2.77Å; R163-G361 VanDerWaalsContact NH2-CA 3.32Å; R163-E365 IonicContact CZ-OE1 2.75Å; R163-E365 IonicContact CZ-OE2 3.8Å; R163-E365 IonicContact NH1-OE2 3.6Å; R163-E365 IonicContact NH2-OE1 3.74Å; R163-E365 PolarHBondContact NH2-OE1 3.37Å; R163-E365 IonicContact NH2-OE2 3.74Å; R163-E365 PolarHBondContact NH2-OE2 3.25Å
164	L	97.2	Very high	93.5	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.4	169.5	-62	-176.2	0	0	0	111	L154 R155 F202 W205 I206 V209 W257 L262 E360	L154-L164 HydrophobicContact CD2-CD2 4.25Å; R155-L164 PolarHBondContact NE-O 2.76Å; L164-F202 HydrophobicContact CD2-CZ 4.22Å; L164-W205 HydrophobicContact CD1-CH2 3.66Å; L164-W205 HydrophobicContact CD1-CZ2 4.46Å; L164-W205 HydrophobicContact CD1-CZ3 3.74Å; L164-W205 HydrophobicContact CD2-CZ3 3.97Å; L164-W205 HydrophobicContact CG-CH2 4.14Å; L164-W205 HydrophobicContact CG-CZ3 4.06Å; L164-I206 HydrophobicContact CD2-CD1 4.19Å; L164-I206 HydrophobicContact CD2-CG1 3.75Å; L164-V209 HydrophobicContact CD1-CB 4.17Å; L164-V209 HydrophobicContact CD1-CG1 3.75Å; L164-V209 HydrophobicContact CD1-CG2 4.33Å; L164-W257 HydrophobicContact CB-CH2 4.41Å; L164-W257 HydrophobicContact CB-CZ3 4.35Å; L164-W257 HydrophobicContact CD1-CH2 4.35Å; L164-W257 HydrophobicContact CD1-CZ3 4.4Å; L164-L262 HydrophobicContact CD1-CD1 4.33Å; L164-E360 WeakPolarHBondContact CB-OE1 3.37Å; L164-E360 WeakPolarHBondContact CG-OE1 3.18Å; L164-E360 PolarHBondContact N-OE1 2.64Å
165	V	97.6	Very high	93.5	Very high	8 Å²	8	53.1 Å²	53.1	5%	0.048	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-68	173.8	171.4	-65.6	0	0	0	0	111.4	V153 R155 Q169 F170 Y210	V153-V165 HydrophobicContact CB-CG2 4.44Å; V153-V165 PolarHBondContact O-N 3.43Å; V153-V165 VanDerWaalsContact O-N 3.1Å; R155-V165 HydrophobicContact CB-CG1 4.33Å; V165-Q169 HydrophobicContact CB-CB 3.85Å; V165-Q169 HydrophobicContact CG2-CB 3.86Å; V165-F170 HydrophobicContact CG2-CB 4Å; V165-Y210 PolarHBondContact N-OH 2.92Å; V165-Y210 PolarHBondContact O-OH 3.23Å
166	T	96.9	Very high	93.6	Very high	69 Å²	69	50.4 Å²	50.4	42%	0.423	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-67.7	155.1	174.9	63.4	0	0	0	0	111.4	L168 Q169 F170	T166-L168 PolarHBondContact O-N 3.12Å; T166-L168 VanDerWaalsContact O-N 3.11Å; T166-Q169 PolarHBondContact O-N 3.45Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.43Å; T166-Q169 PolarHBondContact OG1-N 2.85Å; T166-Q169 PolarHBondContact OG1-OE1 3.19Å; T166-F170 PolarHBondContact O-N 2.74Å
167	P	97.7	Very high	93.9	Very high	39 Å²	39	47.5 Å²	47.5	25%	0.253	27%	0.274	S	S	.	.	H	α-helix	trans	-52.4	-34.6	175	-28.9	35.1	0	0	0	114.1	Q171 Y210 A255 W257	P167-Q171 WeakPolarHBondContact O-CB 3.37Å; P167-Q171 PolarHBondContact O-N 3.46Å; P167-Y210 HydrophobicContact CB-CD1 4.16Å; P167-Y210 HydrophobicContact CB-CE1 4.23Å; P167-Y210 HydrophobicContact CG-CD1 4.2Å; P167-Y210 HydrophobicContact CG-CE1 4.05Å; P167-A255 HydrophobicContact CB-CB 4.12Å; P167-A255 WeakPolarHBondContact O-CB 3.2Å; P167-W257 HydrophobicContact CG-CB 4.08Å; P167-W257 HydrophobicContact CG-CE3 4.16Å
168	L	97.8	Very high	94.3	Very high	128 Å²	128	46.9 Å²	46.9	67%	0.67	27%	0.268	S	S	*	.	H	α-helix	trans	-69.2	-39.8	178.2	-69.6	177.3	0	0	0	112.8	T166 A172	T166-L168 PolarHBondContact O-N 3.12Å; T166-L168 VanDerWaalsContact O-N 3.11Å; L168-A172 WeakPolarHBondContact O-CB 3.44Å; L168-A172 PolarHBondContact O-N 3.19Å
169	Q	97.9	Very high	95.2	Very high	101 Å²	101	44 Å²	44	47%	0.472	25%	0.25	S	S	.	.	H	α-helix	trans	-66.6	-48.9	175.7	-74	167.9	-60.6	0	0	110.8	V165 T166 Q171 A172 Y173	V165-Q169 HydrophobicContact CB-CB 3.85Å; V165-Q169 HydrophobicContact CG2-CB 3.86Å; T166-Q169 PolarHBondContact O-N 3.45Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.43Å; T166-Q169 PolarHBondContact OG1-N 2.85Å; T166-Q169 PolarHBondContact OG1-OE1 3.19Å; Q169-Q171 VanDerWaalsContact C-N 3.34Å; Q169-Q171 PolarHBondContact O-N 3.12Å; Q169-A172 PolarHBondContact O-N 3.39Å; Q169-A172 VanDerWaalsContact O-N 3.15Å; Q169-Y173 PolarHBondContact O-N 2.82Å
170	F	98.3	Very high	95.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56	-48.8	175.1	176.6	-104.1	0	0	0	111.4	F148 V153 V165 T166 A172 Y173 V174 I206 F207 Y210 F253 A255	F148-F170 HydrophobicContact CZ-CE2 4.31Å; V153-F170 HydrophobicContact CB-CD2 4.26Å; V153-F170 HydrophobicContact CG1-CD2 3.63Å; V153-F170 HydrophobicContact CG1-CE2 4.05Å; V165-F170 HydrophobicContact CG2-CB 4Å; T166-F170 PolarHBondContact O-N 2.74Å; F170-A172 VanDerWaalsContact C-N 3.32Å; F170-A172 PolarHBondContact O-N 2.69Å; F170-Y173 PolarHBondContact O-N 2.9Å; F170-V174 HydrophobicContact CD1-CG1 4.45Å; F170-V174 HydrophobicContact CD1-CG2 4.46Å; F170-V174 HydrophobicContact CD2-CG1 4.06Å; F170-V174 HydrophobicContact CE1-CG1 4.01Å; F170-V174 HydrophobicContact CE1-CG2 4.23Å; F170-V174 HydrophobicContact CE2-CG1 3.56Å; F170-V174 HydrophobicContact CG-CG1 4.48Å; F170-V174 HydrophobicContact CZ-CG1 3.54Å; F170-V174 WeakPolarHBondContact O-CG2 3.49Å; F170-V174 PolarHBondContact O-N 2.95Å; F170-I206 HydrophobicContact CD2-CG2 3.95Å; F170-I206 HydrophobicContact CE2-CG2 3.39Å; F170-I206 HydrophobicContact CZ-CG2 3.87Å; F170-F207 HydrophobicContact CE1-CD1 4.25Å; F170-F207 HydrophobicContact CE1-CE1 4.14Å; F170-F207 AromaticContact CZ-CD1 3.81Å; F170-F207 HydrophobicContact CZ-CD1 3.81Å; F170-F207 AromaticContact CZ-CE1 3.6Å; F170-F207 HydrophobicContact CZ-CE1 3.6Å; F170-F207 HydrophobicContact CZ-CE2 4.48Å; F170-F207 HydrophobicContact CZ-CG 4.33Å; F170-F207 AromaticContact CZ-CZ 3.95Å; F170-F207 HydrophobicContact CZ-CZ 3.95Å; F170-Y210 HydrophobicContact CB-CD1 4.31Å; F170-Y210 HydrophobicContact CB-CD2 4.01Å; F170-Y210 HydrophobicContact CB-CE1 3.93Å; F170-Y210 HydrophobicContact CB-CE2 3.57Å; F170-Y210 HydrophobicContact CB-CG 4.34Å; F170-Y210 HydrophobicContact CD1-CD1 4.04Å; F170-Y210 AromaticContact CD1-CD2 3.22Å; F170-Y210 HydrophobicContact CD1-CD2 3.22Å; F170-Y210 HydrophobicContact CD1-CE1 4.48Å; F170-Y210 AromaticContact CD1-CE2 3.72Å; F170-Y210 HydrophobicContact CD1-CE2 3.72Å; F170-Y210 AromaticContact CD1-CG 3.39Å; F170-Y210 HydrophobicContact CD1-CG 3.39Å; F170-Y210 AromaticContact CD2-CD2 3.58Å; F170-Y210 HydrophobicContact CD2-CD2 3.58Å; F170-Y210 AromaticContact CD2-CE2 3.37Å; F170-Y210 HydrophobicContact CD2-CE2 3.37Å; F170-Y210 AromaticContact CE1-CD2 3.4Å; F170-Y210 HydrophobicContact CE1-CD2 3.4Å; F170-Y210 VanDerWaalsContact CE1-CD2 3.4Å; F170-Y210 HydrophobicContact CE1-CE2 4.21Å; F170-Y210 AromaticContact CE1-CG 3.7Å; F170-Y210 HydrophobicContact CE1-CG 3.7Å; F170-Y210 AromaticContact CE2-CD2 3.76Å; F170-Y210 HydrophobicContact CE2-CD2 3.76Å; F170-Y210 AromaticContact CE2-CE2 3.92Å; F170-Y210 HydrophobicContact CE2-CE2 3.92Å; F170-Y210 HydrophobicContact CG-CD1 4.3Å; F170-Y210 AromaticContact CG-CD2 3.31Å; F170-Y210 HydrophobicContact CG-CD2 3.31Å; F170-Y210 HydrophobicContact CG-CE1 4.28Å; F170-Y210 AromaticContact CG-CE2 3.25Å; F170-Y210 HydrophobicContact CG-CE2 3.25Å; F170-Y210 AromaticContact CG-CG 3.84Å; F170-Y210 HydrophobicContact CG-CG 3.84Å; F170-Y210 AromaticContact CG-CZ 3.77Å; F170-Y210 AromaticContact CZ-CD2 3.66Å; F170-Y210 HydrophobicContact CZ-CD2 3.66Å; F170-Y210 HydrophobicContact CZ-CE2 4.3Å; F170-Y210 HydrophobicContact CZ-CG 4.39Å; F170-F253 HydrophobicContact CD1-CE1 4.14Å; F170-F253 HydrophobicContact CE1-CD1 4.5Å; F170-F253 AromaticContact CE1-CE1 3.61Å; F170-F253 HydrophobicContact CE1-CE1 3.61Å; F170-F253 AromaticContact CE1-CZ 3.85Å; F170-F253 HydrophobicContact CE1-CZ 3.85Å; F170-A255 HydrophobicContact CD1-CB 3.93Å
171	Q	98.4	Very high	96.5	Very high	34 Å²	34	40.8 Å²	40.8	16%	0.159	22%	0.22	C	C	.	.	H	α-helix	trans	-57.4	-43.6	177.1	-175.7	-177.1	-88.6	0	0	112.2	P167 Q169 Y173 R175 F253 A255	P167-Q171 WeakPolarHBondContact O-CB 3.37Å; P167-Q171 PolarHBondContact O-N 3.46Å; Q169-Q171 VanDerWaalsContact C-N 3.34Å; Q169-Q171 PolarHBondContact O-N 3.12Å; Q171-Y173 VanDerWaalsContact C-N 3.34Å; Q171-R175 HydrophobicContact CG-CG 4.39Å; Q171-R175 VanDerWaalsContact O-CB 3.27Å; Q171-R175 WeakPolarHBondContact O-CB 3.49Å; Q171-R175 WeakPolarHBondContact O-CG 3.46Å; Q171-R175 PolarHBondContact O-N 3.48Å; Q171-R175 VanDerWaalsContact O-N 3.08Å; Q171-F253 WeakPolarHBondContact CG-O 3.46Å; Q171-A255 HydrophobicContact CB-CB 3.89Å
172	A	98.1	Very high	96.8	Very high	55 Å²	55	44.9 Å²	44.9	46%	0.455	24%	0.242	S	C	.	.	H	α-helix	trans	-62.6	-43.6	178.9	0	0	0	0	0	111.4	L168 Q169 F170 S176	L168-A172 WeakPolarHBondContact O-CB 3.44Å; L168-A172 PolarHBondContact O-N 3.19Å; Q169-A172 PolarHBondContact O-N 3.39Å; Q169-A172 VanDerWaalsContact O-N 3.15Å; F170-A172 VanDerWaalsContact C-N 3.32Å; F170-A172 PolarHBondContact O-N 2.69Å; A172-S176 PolarHBondContact O-N 3.24Å
173	Y	98.2	Very high	96.9	Very high	31 Å²	31	42.4 Å²	42.4	12%	0.122	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-57	177.4	176	-118.8	0	0	0	112.1	F148 D149 Q152 V153 Q169 F170 Q171 R175 S176 L177	F148-Y173 WeakPolarHBondContact CA-OH 3.2Å; F148-Y173 HydrophobicContact CD1-CE1 4.43Å; F148-Y173 AromaticContact CD2-CE1 3.84Å; F148-Y173 HydrophobicContact CD2-CE1 3.84Å; F148-Y173 HydrophobicContact CE1-CE1 4.23Å; F148-Y173 HydrophobicContact CE2-CD1 4.22Å; F148-Y173 AromaticContact CE2-CE1 3.64Å; F148-Y173 HydrophobicContact CE2-CE1 3.64Å; F148-Y173 HydrophobicContact CG-CE1 4.26Å; F148-Y173 HydrophobicContact CZ-CD1 4.39Å; F148-Y173 AromaticContact CZ-CE1 3.85Å; F148-Y173 HydrophobicContact CZ-CE1 3.85Å; D149-Y173 PolarHBondContact N-OH 3.04Å; Q152-Y173 HydrophobicContact CB-CD1 4.03Å; Q152-Y173 HydrophobicContact CB-CD2 3.68Å; Q152-Y173 HydrophobicContact CB-CE1 3.96Å; Q152-Y173 HydrophobicContact CB-CE2 3.64Å; Q152-Y173 HydrophobicContact CB-CG 3.89Å; Q152-Y173 HydrophobicContact CG-CD2 3.97Å; Q152-Y173 HydrophobicContact CG-CE2 3.57Å; V153-Y173 HydrophobicContact CG1-CD1 3.51Å; V153-Y173 HydrophobicContact CG1-CE1 3.91Å; V153-Y173 HydrophobicContact CG1-CG 4.47Å; Q169-Y173 PolarHBondContact O-N 2.82Å; F170-Y173 PolarHBondContact O-N 2.9Å; Q171-Y173 VanDerWaalsContact C-N 3.34Å; Y173-R175 VanDerWaalsContact C-N 3.25Å; Y173-R175 PolarHBondContact O-N 3.39Å; Y173-S176 WeakPolarHBondContact O-CA 3.48Å; Y173-S176 WeakPolarHBondContact O-CB 3.37Å; Y173-S176 PolarHBondContact O-N 2.89Å; Y173-S176 PolarHBondContact O-OG 3.23Å; Y173-L177 HydrophobicContact CE1-CD1 3.98Å; Y173-L177 HydrophobicContact CE2-CD1 4.38Å; Y173-L177 HydrophobicContact CE2-CD2 4.37Å; Y173-L177 HydrophobicContact CE2-CG 4.38Å; Y173-L177 PolarHBondContact O-N 3.24Å
174	V	98.2	Very high	97	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-27.6	-176.4	-59.3	0	0	0	0	113.2	F148 F170 S176 L177 L179 F207 F253	F148-V174 HydrophobicContact CE2-CG1 4.06Å; F170-V174 HydrophobicContact CD1-CG1 4.45Å; F170-V174 HydrophobicContact CD1-CG2 4.46Å; F170-V174 HydrophobicContact CD2-CG1 4.06Å; F170-V174 HydrophobicContact CE1-CG1 4.01Å; F170-V174 HydrophobicContact CE1-CG2 4.23Å; F170-V174 HydrophobicContact CE2-CG1 3.56Å; F170-V174 HydrophobicContact CG-CG1 4.48Å; F170-V174 HydrophobicContact CZ-CG1 3.54Å; F170-V174 WeakPolarHBondContact O-CG2 3.49Å; F170-V174 PolarHBondContact O-N 2.95Å; V174-S176 VanDerWaalsContact C-N 3.34Å; V174-L177 PolarHBondContact O-N 2.94Å; V174-L179 HydrophobicContact CB-CB 4.39Å; V174-L179 HydrophobicContact CB-CD1 3.91Å; V174-L179 HydrophobicContact CB-CG 4.33Å; V174-L179 HydrophobicContact CG1-CD1 4.36Å; V174-L179 WeakPolarHBondContact O-CB 3.36Å; V174-L179 WeakPolarHBondContact O-CG 3.32Å; V174-L179 PolarHBondContact O-N 2.7Å; V174-L179 VanDerWaalsContact O-N 3.11Å; V174-F207 HydrophobicContact CG1-CE1 4.25Å; V174-F207 HydrophobicContact CG1-CZ 4.04Å; V174-F253 HydrophobicContact CG2-CB 3.92Å; V174-F253 HydrophobicContact CG2-CD1 3.46Å; V174-F253 VanDerWaalsContact CG2-CD1 3.46Å; V174-F253 HydrophobicContact CG2-CD2 4.31Å; V174-F253 HydrophobicContact CG2-CE1 4.04Å; V174-F253 HydrophobicContact CG2-CG 3.63Å
175	R	98	Very high	97	Very high	58 Å²	58	42.6 Å²	42.6	22%	0.219	23%	0.232	C	C	.	.	H	α-helix	trans	-68.5	-31.6	170.2	-74.9	-176.6	178.6	-177.3	2.5	112.5	Q171 Y173 L177 G178 K250 G251 F253	Q171-R175 HydrophobicContact CG-CG 4.39Å; Q171-R175 VanDerWaalsContact O-CB 3.27Å; Q171-R175 WeakPolarHBondContact O-CB 3.49Å; Q171-R175 WeakPolarHBondContact O-CG 3.46Å; Q171-R175 PolarHBondContact O-N 3.48Å; Q171-R175 VanDerWaalsContact O-N 3.08Å; Y173-R175 VanDerWaalsContact C-N 3.25Å; Y173-R175 PolarHBondContact O-N 3.39Å; R175-L177 PolarHBondContact O-N 3.44Å; R175-G178 PolarHBondContact O-N 2.94Å; R175-K250 HydrophobicContact CB-CG 4.03Å; R175-K250 WeakPolarHBondContact O-CA 3.26Å; R175-G251 WeakPolarHBondContact CD-O 3.37Å; R175-G251 WeakPolarHBondContact CG-O 3.41Å; R175-G251 PolarHBondContact O-N 3.11Å; R175-F253 HydrophobicContact CG-CB 4.12Å; R175-F253 PolarHBondContact NE-O 3.3Å; R175-F253 PolarHBondContact NH2-O 3.36Å
176	S	96.9	Very high	97	Very high	72 Å²	72	42.2 Å²	42.2	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-67.4	-28.5	175.7	86.2	0	0	0	0	111.6	A172 Y173 V174 G178	A172-S176 PolarHBondContact O-N 3.24Å; Y173-S176 WeakPolarHBondContact O-CA 3.48Å; Y173-S176 WeakPolarHBondContact O-CB 3.37Å; Y173-S176 PolarHBondContact O-N 2.89Å; Y173-S176 PolarHBondContact O-OG 3.23Å; V174-S176 VanDerWaalsContact C-N 3.34Å; S176-G178 PolarHBondContact O-N 2.68Å
177	L	97	Very high	97	Very high	26 Å²	26	38.9 Å²	38.9	14%	0.136	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-0.1	170.9	-55.6	-178.5	0	0	0	113.8	L124 F148 Y173 V174 R175 L179	L124-L177 HydrophobicContact CD2-CD1 4.3Å; F148-L177 HydrophobicContact CD2-CD1 3.81Å; Y173-L177 HydrophobicContact CE1-CD1 3.98Å; Y173-L177 HydrophobicContact CE2-CD1 4.38Å; Y173-L177 HydrophobicContact CE2-CD2 4.37Å; Y173-L177 HydrophobicContact CE2-CG 4.38Å; Y173-L177 PolarHBondContact O-N 3.24Å; V174-L177 PolarHBondContact O-N 2.94Å; R175-L177 PolarHBondContact O-N 3.44Å; L177-L179 HydrophobicContact CB-CG 4.33Å
178	G	96.8	Very high	97	Very high	13 Å²	13	37 Å²	37	13%	0.134	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	10.5	179.9	0	0	0	0	0	115.1	R175 S176 A249	R175-G178 PolarHBondContact O-N 2.94Å; S176-G178 PolarHBondContact O-N 2.68Å; G178-A249 WeakPolarHBondContact CA-O 3.46Å
179	L	97.7	Very high	96.7	Very high	2 Å²	2	31 Å²	31	1%	0.01	17%	0.165	C	C	.	.			trans	-69.2	136.1	-176.3	-56.6	-166.2	0	0	0	112.4	C122 L124 V174 L177 I185 F207 G251 N252 F253	C122-L179 HydrophobicContact CB-CD2 3.57Å; L124-L179 HydrophobicContact CD1-CD1 4Å; L124-L179 HydrophobicContact CD2-CD1 4.24Å; L124-L179 HydrophobicContact CD2-CD2 4.17Å; V174-L179 HydrophobicContact CB-CB 4.39Å; V174-L179 HydrophobicContact CB-CD1 3.91Å; V174-L179 HydrophobicContact CB-CG 4.33Å; V174-L179 HydrophobicContact CG1-CD1 4.36Å; V174-L179 WeakPolarHBondContact O-CB 3.36Å; V174-L179 WeakPolarHBondContact O-CG 3.32Å; V174-L179 PolarHBondContact O-N 2.7Å; V174-L179 VanDerWaalsContact O-N 3.11Å; L177-L179 HydrophobicContact CB-CG 4.33Å; L179-I185 HydrophobicContact CD1-CD1 3.89Å; L179-F207 HydrophobicContact CD1-CE1 4.05Å; L179-F207 HydrophobicContact CD1-CZ 3.61Å; L179-G251 CarbonylContact O-C 3.59Å; L179-G251 WeakPolarHBondContact O-CA 3.29Å; L179-N252 PolarHBondContact O-N 3.16Å; L179-F253 WeakPolarHBondContact O-CB 3.47Å; L179-F253 PolarHBondContact O-N 2.78Å
180	T	96	Very high	96.4	Very high	22 Å²	22	26.6 Å²	26.6	14%	0.135	15%	0.145	C	C	.	.			trans	-117	159.3	-176.4	74.8	0	0	0	0	111.3	N182 C183 N252	T180-N182 PolarHBondContact O-N 3.28Å; T180-N182 VanDerWaalsContact O-N 3.14Å; T180-N182 PolarHBondContact OG1-N 2.65Å; T180-C183 PolarHBondContact O-N 3.38Å; T180-C183 PolarHBondContact O-SG 3.01Å; T180-C183 PolarHBondContact OG1-N 3.25Å; T180-N252 WeakPolarHBondContact CA-OD1 3.41Å; T180-N252 WeakPolarHBondContact CB-OD1 3.36Å
181	K	94.9	Very high	95.4	Very high	119 Å²	119	27 Å²	27	52%	0.517	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.7	173.3	68.2	179.5	-176.6	175.3	0	114	N252	K181-N252 PolarHBondContact N-OD1 2.71Å
182	N	93.3	Very high	93.9	Very high	90 Å²	90	31.3 Å²	31.3	48%	0.481	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-7.3	-174.9	-66.2	-22	0	0	0	113.1	T180 R214	T180-N182 PolarHBondContact O-N 3.28Å; T180-N182 VanDerWaalsContact O-N 3.14Å; T180-N182 PolarHBondContact OG1-N 2.65Å; N182-R214 VanDerWaalsContact O-CZ 3.23Å; N182-R214 PolarHBondContact O-NH1 3.03Å; N182-R214 VanDerWaalsContact O-NH1 3.11Å; N182-R214 PolarHBondContact O-NH2 2.79Å
183	C	92.9	Very high	92.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-77.5	151	-179.7	71	0	0	0	0	112.1	Q120 C122 T180 I185 F212 R214	Q120-C183 HydrophobicContact CG-CB 4.4Å; Q120-C183 CarbonylContact O-C 3.6Å; Q120-C183 WeakPolarHBondContact O-CA 3.31Å; C122-C183 HydrophobicContact CB-CB 3.89Å; C122-C183 WeakPolarHBondContact SG-CB 3.31Å; C122-C183 VanDerWaalsContact SG-SG 3.64Å; T180-C183 PolarHBondContact O-N 3.38Å; T180-C183 PolarHBondContact O-SG 3.01Å; T180-C183 PolarHBondContact OG1-N 3.25Å; C183-I185 WeakPolarHBondContact SG-CG1 3.34Å; C183-F212 WeakPolarHBondContact O-CZ 3.42Å; C183-R214 PolarHBondContact O-NE 3.26Å; C183-R214 PolarHBondContact O-NH2 3.33Å; C183-R214 VanDerWaalsContact O-NH2 3.16Å
184	H	96	Very high	90.5	Very high	27 Å²	27	39.2 Å²	39.2	13%	0.125	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.1	160.3	-171.6	119.3	0	0	0	106.2	T119 Q120 I121 C122 S216	T119-H184 HydrophobicContact CG2-CB 3.58Å; Q120-H184 PolarHBondContact O-N 2.83Å; I121-H184 WeakPolarHBondContact CA-O 3.31Å; C122-H184 PolarHBondContact N-O 3.48Å; H184-S216 PolarHBondContact CE1-OG 3.36Å; H184-S216 PolarHBondContact NE2-OG 2.68Å
185	I	97.4	Very high	89.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.5	-177.9	-61.7	175.5	0	0	0	108.4	C122 L124 L179 C183 T187 F207 F212 R214 V215 S216 F253	C122-I185 HydrophobicContact CB-CG1 4.47Å; C122-I185 CarbonylContact O-C 3.46Å; C122-I185 WeakPolarHBondContact O-CA 3.5Å; L124-I185 HydrophobicContact CD1-CG2 3.56Å; L124-I185 HydrophobicContact CG-CG2 4.09Å; L179-I185 HydrophobicContact CD1-CD1 3.89Å; C183-I185 WeakPolarHBondContact SG-CG1 3.34Å; I185-T187 HydrophobicContact CG2-CG2 4.2Å; I185-F207 HydrophobicContact CD1-CD1 3.61Å; I185-F207 HydrophobicContact CD1-CD2 4.43Å; I185-F207 HydrophobicContact CD1-CE1 3.25Å; I185-F207 HydrophobicContact CD1-CE2 4.15Å; I185-F207 HydrophobicContact CD1-CG 4.22Å; I185-F207 HydrophobicContact CD1-CZ 3.58Å; I185-F207 HydrophobicContact CG2-CD2 4.35Å; I185-F207 HydrophobicContact CG2-CE2 4.03Å; I185-F207 HydrophobicContact CG2-CZ 4.36Å; I185-F212 HydrophobicContact CB-CE1 4.46Å; I185-F212 HydrophobicContact CD1-CD1 3.79Å; I185-F212 HydrophobicContact CD1-CE1 3.48Å; I185-F212 VanDerWaalsContact CD1-CE1 3.48Å; I185-F212 HydrophobicContact CD1-CZ 4.19Å; I185-F212 HydrophobicContact CG1-CD1 4.49Å; I185-F212 HydrophobicContact CG1-CE1 3.78Å; I185-F212 HydrophobicContact CG1-CZ 4.45Å; I185-R214 PolarHBondContact N-O 2.69Å; I185-V215 HydrophobicContact CB-CB 4.27Å; I185-V215 HydrophobicContact CB-CG2 4.1Å; I185-V215 HydrophobicContact CG2-CG2 4Å; I185-V215 CarbonylContact O-C 3.54Å; I185-V215 VanDerWaalsContact O-CA 3.3Å; I185-V215 WeakPolarHBondContact O-CA 3.38Å; I185-S216 PolarHBondContact O-N 3.11Å; I185-F253 HydrophobicContact CD1-CE2 4.27Å
186	V	97.5	Very high	87.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.4	172.9	179.9	0	0	0	0	108.1	L105 L110 I121 C122 L123 L124 S216 L218	L105-V186 HydrophobicContact CD1-CG1 4.32Å; L105-V186 HydrophobicContact CD1-CG2 3.76Å; L110-V186 HydrophobicContact CD1-CG1 4.35Å; L110-V186 HydrophobicContact CD1-CG2 4.11Å; L110-V186 HydrophobicContact CD2-CG1 4.28Å; I121-V186 HydrophobicContact CG2-CG2 4.02Å; C122-V186 PolarHBondContact O-N 3.48Å; L123-V186 HydrophobicContact CD2-CB 3.87Å; L123-V186 HydrophobicContact CD2-CG1 4.06Å; L124-V186 PolarHBondContact N-O 3.44Å; V186-S216 CarbonylContact C-O 3.57Å; V186-S216 VanDerWaalsContact CA-O 3.29Å; V186-S216 WeakPolarHBondContact CA-O 3.41Å; V186-L218 HydrophobicContact CG1-CB 4.07Å
187	T	98	Very high	87.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.9	176.8	61.3	0	0	0	0	109.7	L124 T126 I185 A200 V203 V215 S216 V217 L218	L124-T187 HydrophobicContact CB-CG2 4.48Å; L124-T187 HydrophobicContact CD1-CG2 4.38Å; T126-T187 HydrophobicContact CG2-CG2 4.25Å; I185-T187 HydrophobicContact CG2-CG2 4.2Å; T187-A200 PolarHBondContact OG1-O 3.26Å; T187-V203 HydrophobicContact CG2-CB 3.94Å; T187-V203 HydrophobicContact CG2-CG1 3.57Å; T187-V215 HydrophobicContact CG2-CG2 4.18Å; T187-S216 PolarHBondContact N-O 2.84Å; T187-S216 PolarHBondContact OG1-O 3.42Å; T187-V217 CarbonylContact O-C 3.48Å; T187-V217 WeakPolarHBondContact O-CA 3.04Å; T187-L218 PolarHBondContact O-N 2.93Å
188	Y	96.6	Very high	87.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.9	176.5	74.5	-89.7	0	0	0	110.9	L123 L124 D125 T126 H141 L142 S145 L218 L222	L123-Y188 HydrophobicContact CB-CE1 4.44Å; L124-Y188 WeakPolarHBondContact O-CD1 3.23Å; L124-Y188 PolarHBondContact O-N 2.92Å; D125-Y188 HydrophobicContact CB-CE1 4.2Å; D125-Y188 HydrophobicContact CB-CE2 4.06Å; D125-Y188 VanDerWaalsContact CB-OH 3.3Å; D125-Y188 WeakPolarHBondContact CB-OH 3.02Å; D125-Y188 WeakPolarHBondContact OD2-CE2 3.42Å; D125-Y188 PolarHBondContact OD2-OH 3.42Å; T126-Y188 PolarHBondContact N-O 3.3Å; T126-Y188 PolarHBondContact OG1-O 3.25Å; T126-Y188 VanDerWaalsContact OG1-O 3.09Å; H141-Y188 WeakPolarHBondContact CB-OH 3.41Å; L142-Y188 HydrophobicContact CB-CE1 4.1Å; L142-Y188 HydrophobicContact CD1-CD2 4.1Å; L142-Y188 HydrophobicContact CD1-CE1 4.2Å; L142-Y188 HydrophobicContact CD1-CE2 3.83Å; L142-Y188 HydrophobicContact CD1-CG 4.48Å; L142-Y188 HydrophobicContact CD2-CD1 4.47Å; L142-Y188 HydrophobicContact CD2-CE1 4.43Å; L142-Y188 HydrophobicContact CG-CE1 4.47Å; L142-Y188 PolarHBondContact N-OH 3.17Å; S145-Y188 WeakPolarHBondContact CB-OH 3.29Å; S145-Y188 VanDerWaalsContact OG-CE1 3.25Å; S145-Y188 WeakPolarHBondContact OG-CE1 3.27Å; S145-Y188 PolarHBondContact OG-OH 3.03Å; Y188-L218 HydrophobicContact CG-CD2 4.35Å; Y188-L222 HydrophobicContact CD2-CB 4.29Å; Y188-L222 HydrophobicContact CE2-CB 4.23Å
189	D	93.2	Very high	87.3	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.172	C	C	.	.			trans	-104.9	-173.2	168.8	64.1	83.9	0	0	0	110.6	G191 A196 I197 S199 A200 G221 L222	D189-G191 VanDerWaalsContact OD1-CA 3.31Å; D189-G191 WeakPolarHBondContact OD1-CA 3.28Å; D189-G191 PolarHBondContact OD1-N 3.36Å; D189-A196 HydrophobicContact CB-CB 4.29Å; D189-A196 WeakPolarHBondContact CB-O 3.33Å; D189-A196 WeakPolarHBondContact OD1-CB 3.48Å; D189-I197 WeakPolarHBondContact OD2-CA 3.38Å; D189-S199 WeakPolarHBondContact CB-OG 3.41Å; D189-A200 HydrophobicContact CB-CB 4.36Å; D189-G221 CarbonylContact O-C 3.54Å; D189-G221 WeakPolarHBondContact O-CA 3.5Å; D189-L222 PolarHBondContact O-N 2.99Å
190	H	91.6	Very high	87.2	Confident	9 Å²	9	34 Å²	34	4%	0.042	17%	0.171	C	C	.	.			trans	-86.3	-16.6	-175.3	-75.9	-130.8	0	0	0	114.8	D125 L127 V136 E192 L222 E223	D125-H190 IonicContact OD1-CD2 3.37Å; D125-H190 IonicContact OD1-NE2 2.87Å; D125-H190 PolarHBondContact OD1-NE2 2.89Å; D125-H190 IonicContact OD2-CD2 2.75Å; D125-H190 IonicContact OD2-CE1 3.5Å; D125-H190 IonicContact OD2-NE2 3.61Å; D125-H190 PolarHBondContact OD2-NE2 2.98Å; L127-H190 HydrophobicContact CD1-CB 4.31Å; V136-H190 VanDerWaalsContact CG1-CE1 3.45Å; V136-H190 WeakPolarHBondContact CG1-CE1 3.23Å; V136-H190 WeakPolarHBondContact CG1-ND1 3.41Å; H190-E192 PolarHBondContact O-N 2.83Å; H190-L222 HydrophobicContact CB-CB 4.48Å; H190-L222 VanDerWaalsContact CE1-CD2 3.48Å; H190-L222 WeakPolarHBondContact CE1-CD2 3.46Å; H190-L222 WeakPolarHBondContact ND1-CD2 3.48Å; H190-E223 VanDerWaalsContact O-CB 3.23Å; H190-E223 WeakPolarHBondContact O-CB 3.45Å; H190-E223 PolarHBondContact O-N 3.39Å
191	G	77.1	Confident	87.3	Confident	9 Å²	9	33 Å²	33	9%	0.093	17%	0.165	C	C	.	.	S	Bend	trans	77.5	-2.6	176.5	0	0	0	0	0	115.6	D189	D189-G191 VanDerWaalsContact OD1-CA 3.31Å; D189-G191 WeakPolarHBondContact OD1-CA 3.28Å; D189-G191 PolarHBondContact OD1-N 3.36Å
192	E	66.8	Low	87.4	Confident	124 Å²	124	27.3 Å²	27.3	58%	0.579	14%	0.14	S	C	*	.			trans	-91.9	-17.7	-171.9	-64.9	-178.2	-174.1	0	0	114.3	H190 R226	H190-E192 PolarHBondContact O-N 2.83Å; E192-R226 IonicContact OE1-CZ 2.96Å; E192-R226 IonicContact OE1-NH1 2.67Å; E192-R226 PolarHBondContact OE1-NH1 3.15Å; E192-R226 IonicContact OE1-NH2 3.45Å
193	V	62.3	Low	87.6	Confident	74 Å²	74	23 Å²	23	45%	0.448	12%	0.118	S	C	.	.	S	Bend	trans	-107.9	144.8	-172.9	-165.5	0	0	0	0	110.1	L195 A196	V193-L195 PolarHBondContact O-N 3.1Å; V193-A196 HydrophobicContact CB-CB 4.38Å; V193-A196 VanDerWaalsContact O-CB 3.29Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 3.27Å
194	E	62.2	Low	87.8	Confident	177 Å²	177	23 Å²	23	83%	0.827	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.8	130.2	163.1	-71.2	-172.4	173.9	0	0	108.6	A196	E194-A196 PolarHBondContact O-N 3.24Å
195	L	68.6	Low	87.9	Confident	56 Å²	56	21.8 Å²	21.8	29%	0.293	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	6.4	-177	-44.8	171.6	0	0	0	116.4	V193 I197 T198 T301	V193-L195 PolarHBondContact O-N 3.1Å; L195-I197 PolarHBondContact O-N 3.41Å; L195-T198 HydrophobicContact CB-CG2 4.06Å; L195-T198 WeakPolarHBondContact O-CB 2.97Å; L195-T198 WeakPolarHBondContact O-CG2 3.36Å; L195-T198 PolarHBondContact O-N 2.92Å; L195-T198 PolarHBondContact O-OG1 3.13Å; L195-T301 HydrophobicContact CD2-CG2 3.58Å
196	A	71.8	Confident	88	Confident	6 Å²	6	21.8 Å²	21.8	5%	0.05	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-36.6	-173.2	0	0	0	0	0	114.6	D189 V193 E194 T198 S199	D189-A196 HydrophobicContact CB-CB 4.29Å; D189-A196 WeakPolarHBondContact CB-O 3.33Å; D189-A196 WeakPolarHBondContact OD1-CB 3.48Å; V193-A196 HydrophobicContact CB-CB 4.38Å; V193-A196 VanDerWaalsContact O-CB 3.29Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 3.27Å; E194-A196 PolarHBondContact O-N 3.24Å; A196-T198 PolarHBondContact O-N 3.42Å; A196-S199 PolarHBondContact O-N 2.86Å; A196-S199 PolarHBondContact O-OG 2.94Å
197	I	90.9	Very high	88	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-62.1	-23.1	178.6	-149.2	-177.5	0	0	0	114.7	D189 L195 S199 A200 T201 V217 L305 L311 A344	D189-I197 WeakPolarHBondContact OD2-CA 3.38Å; L195-I197 PolarHBondContact O-N 3.41Å; I197-S199 VanDerWaalsContact C-N 3.26Å; I197-S199 PolarHBondContact O-N 2.99Å; I197-A200 PolarHBondContact O-N 3Å; I197-T201 HydrophobicContact CD1-CG2 4.45Å; I197-T201 HydrophobicContact CG1-CG2 4.23Å; I197-T201 PolarHBondContact O-N 3.37Å; I197-T201 PolarHBondContact O-OG1 3.32Å; I197-V217 HydrophobicContact CD1-CG1 4.27Å; I197-V217 HydrophobicContact CG1-CG1 4.18Å; I197-L305 HydrophobicContact CB-CD2 4.49Å; I197-L305 HydrophobicContact CG2-CD2 3.65Å; I197-L311 HydrophobicContact CD1-CB 4.44Å; I197-L311 HydrophobicContact CD1-CD1 3.57Å; I197-L311 HydrophobicContact CD1-CD2 4.49Å; I197-L311 HydrophobicContact CD1-CG 3.5Å; I197-A344 HydrophobicContact CG2-CB 3.92Å
198	T	93.3	Very high	87.9	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-41.4	-179.9	57.6	0	0	0	0	110.9	F129 L195 A196 A200 T201 F202 T301 I340 S343 A344	F129-T198 VanDerWaalsContact CE2-OG1 3.25Å; F129-T198 WeakPolarHBondContact CE2-OG1 3.38Å; L195-T198 HydrophobicContact CB-CG2 4.06Å; L195-T198 WeakPolarHBondContact O-CB 2.97Å; L195-T198 WeakPolarHBondContact O-CG2 3.36Å; L195-T198 PolarHBondContact O-N 2.92Å; L195-T198 PolarHBondContact O-OG1 3.13Å; A196-T198 PolarHBondContact O-N 3.42Å; T198-A200 PolarHBondContact O-N 3.39Å; T198-T201 WeakPolarHBondContact CA-OG1 3.47Å; T198-T201 PolarHBondContact O-N 2.96Å; T198-T201 PolarHBondContact O-OG1 3.31Å; T198-F202 WeakPolarHBondContact O-CB 3.47Å; T198-F202 PolarHBondContact O-N 3.23Å; T198-T301 HydrophobicContact CG2-CG2 3.77Å; T198-I340 WeakPolarHBondContact CB-O 3.39Å; T198-S343 PolarHBondContact O-OG 3.13Å; T198-A344 HydrophobicContact CG2-CB 3.85Å
199	S	94.6	Very high	88	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.9	-41.9	179.1	67.8	0	0	0	0	112.6	T126 D189 A196 I197 F202 V203	T126-S199 WeakPolarHBondContact O-CB 3.48Å; T126-S199 PolarHBondContact O-OG 2.93Å; D189-S199 WeakPolarHBondContact CB-OG 3.41Å; A196-S199 PolarHBondContact O-N 2.86Å; A196-S199 PolarHBondContact O-OG 2.94Å; I197-S199 VanDerWaalsContact C-N 3.26Å; I197-S199 PolarHBondContact O-N 2.99Å; S199-F202 PolarHBondContact O-N 3.43Å; S199-V203 WeakPolarHBondContact O-CG2 3.27Å; S199-V203 PolarHBondContact O-N 3.21Å; S199-V203 VanDerWaalsContact O-N 3.09Å
200	A	96.7	Very high	88.2	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.9	-40.5	178.4	0	0	0	0	0	112.5	T126 T187 D189 I197 T198 W204 V217	T126-A200 WeakPolarHBondContact OG1-CA 3.48Å; T126-A200 PolarHBondContact OG1-N 2.87Å; T187-A200 PolarHBondContact OG1-O 3.26Å; D189-A200 HydrophobicContact CB-CB 4.36Å; I197-A200 PolarHBondContact O-N 3Å; T198-A200 PolarHBondContact O-N 3.39Å; A200-W204 PolarHBondContact O-N 3.38Å; A200-V217 HydrophobicContact CB-CG1 3.92Å
201	T	97.1	Very high	88.4	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70	-32.3	175.3	50.7	0	0	0	0	112.4	I197 T198 W204 W205 V217 S343 A344 F347	I197-T201 HydrophobicContact CD1-CG2 4.45Å; I197-T201 HydrophobicContact CG1-CG2 4.23Å; I197-T201 PolarHBondContact O-N 3.37Å; I197-T201 PolarHBondContact O-OG1 3.32Å; T198-T201 WeakPolarHBondContact CA-OG1 3.47Å; T198-T201 PolarHBondContact O-N 2.96Å; T198-T201 PolarHBondContact O-OG1 3.31Å; T201-W204 PolarHBondContact O-N 2.67Å; T201-W205 PolarHBondContact O-N 2.66Å; T201-V217 HydrophobicContact CG2-CG1 4.27Å; T201-V217 HydrophobicContact CG2-CG2 4.08Å; T201-S343 PolarHBondContact OG1-OG 3.34Å; T201-A344 WeakPolarHBondContact OG1-CA 3.34Å; T201-A344 PolarHBondContact OG1-N 2.95Å; T201-F347 HydrophobicContact CG2-CB 3.72Å; T201-F347 HydrophobicContact CG2-CD1 3.96Å; T201-F347 HydrophobicContact CG2-CD2 4.19Å; T201-F347 HydrophobicContact CG2-CG 3.71Å
202	F	97.5	Very high	89.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-48.9	175.4	179.5	-114.1	0	0	0	110.9	I150 L154 L164 T198 S199 W204 W205 I206 S339 I340 S343	I150-F202 HydrophobicContact CD1-CD1 4.14Å; I150-F202 HydrophobicContact CG1-CD1 4.31Å; I150-F202 HydrophobicContact CG2-CD1 4.27Å; I150-F202 HydrophobicContact CG2-CE1 3.93Å; L154-F202 HydrophobicContact CD2-CE1 4.25Å; L154-F202 HydrophobicContact CD2-CZ 3.87Å; L164-F202 HydrophobicContact CD2-CZ 4.22Å; T198-F202 WeakPolarHBondContact O-CB 3.47Å; T198-F202 PolarHBondContact O-N 3.23Å; S199-F202 PolarHBondContact O-N 3.43Å; F202-W204 VanDerWaalsContact C-N 3.31Å; F202-W204 PolarHBondContact O-N 3.26Å; F202-W205 AromaticContact CD2-CE3 3.82Å; F202-W205 HydrophobicContact CD2-CE3 3.82Å; F202-W205 HydrophobicContact CD2-CZ3 4.15Å; F202-W205 AromaticContact CE2-CE3 3.61Å; F202-W205 HydrophobicContact CE2-CE3 3.61Å; F202-W205 AromaticContact CE2-CZ3 3.46Å; F202-W205 HydrophobicContact CE2-CZ3 3.46Å; F202-W205 VanDerWaalsContact CE2-CZ3 3.46Å; F202-W205 HydrophobicContact CZ-CE3 4.48Å; F202-W205 HydrophobicContact CZ-CZ3 4.18Å; F202-W205 WeakPolarHBondContact O-CB 3.13Å; F202-W205 PolarHBondContact O-N 3.31Å; F202-W205 VanDerWaalsContact O-N 3.09Å; F202-I206 HydrophobicContact CD1-CD1 3.54Å; F202-I206 HydrophobicContact CD1-CG1 4.42Å; F202-I206 HydrophobicContact CE1-CD1 3.18Å; F202-I206 HydrophobicContact CE1-CG1 4.09Å; F202-I206 HydrophobicContact CE2-CD1 4.28Å; F202-I206 HydrophobicContact CE2-CG1 4.33Å; F202-I206 HydrophobicContact CG-CD1 4.22Å; F202-I206 HydrophobicContact CZ-CD1 3.59Å; F202-I206 HydrophobicContact CZ-CG1 4.01Å; F202-I206 WeakPolarHBondContact O-CG1 3.41Å; F202-I206 PolarHBondContact O-N 2.8Å; F202-S339 WeakPolarHBondContact CE2-OG 3.38Å; F202-I340 HydrophobicContact CB-CG2 4.26Å; F202-I340 HydrophobicContact CD1-CD1 4.46Å; F202-I340 HydrophobicContact CD1-CG1 3.86Å; F202-I340 HydrophobicContact CD1-CG2 4.48Å; F202-I340 HydrophobicContact CD2-CB 4.32Å; F202-I340 HydrophobicContact CD2-CG1 3.98Å; F202-I340 HydrophobicContact CE1-CD1 4.27Å; F202-I340 HydrophobicContact CE1-CG1 3.79Å; F202-I340 HydrophobicContact CE2-CG1 3.91Å; F202-I340 HydrophobicContact CG-CB 4.28Å; F202-I340 HydrophobicContact CG-CG1 3.96Å; F202-I340 HydrophobicContact CG-CG2 4.27Å; F202-I340 HydrophobicContact CZ-CG1 3.84Å; F202-S343 VanDerWaalsContact CA-CB 3.48Å; F202-S343 PolarHBondContact N-OG 3.39Å
203	V	97.9	Very high	90.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.3	-38.6	176.1	178.4	0	0	0	0	111.2	L124 T126 F148 I150 T187 S199 W205 I206 F207	L124-V203 HydrophobicContact CD1-CG1 4.37Å; T126-V203 HydrophobicContact CG2-CB 3.79Å; T126-V203 HydrophobicContact CG2-CG1 4Å; T126-V203 HydrophobicContact CG2-CG2 3.6Å; F148-V203 HydrophobicContact CD1-CG1 4.18Å; F148-V203 HydrophobicContact CD1-CG2 3.69Å; F148-V203 HydrophobicContact CD2-CG1 4.29Å; F148-V203 HydrophobicContact CE1-CB 4.47Å; F148-V203 HydrophobicContact CE1-CG1 4Å; F148-V203 HydrophobicContact CE1-CG2 3.61Å; F148-V203 HydrophobicContact CE2-CG1 4.08Å; F148-V203 HydrophobicContact CG-CG1 4.32Å; F148-V203 HydrophobicContact CG-CG2 4.48Å; F148-V203 HydrophobicContact CZ-CG1 3.92Å; F148-V203 HydrophobicContact CZ-CG2 4.33Å; I150-V203 HydrophobicContact CD1-CG2 3.89Å; I150-V203 HydrophobicContact CG1-CG2 3.78Å; T187-V203 HydrophobicContact CG2-CB 3.94Å; T187-V203 HydrophobicContact CG2-CG1 3.57Å; S199-V203 WeakPolarHBondContact O-CG2 3.27Å; S199-V203 PolarHBondContact O-N 3.21Å; S199-V203 VanDerWaalsContact O-N 3.09Å; V203-W205 VanDerWaalsContact C-N 3.33Å; V203-W205 PolarHBondContact O-N 3.37Å; V203-I206 WeakPolarHBondContact O-CB 3.35Å; V203-I206 PolarHBondContact O-N 3.05Å; V203-F207 HydrophobicContact CG1-CD2 3.9Å; V203-F207 HydrophobicContact CG1-CE2 3.61Å; V203-F207 WeakPolarHBondContact O-CD2 3.21Å; V203-F207 PolarHBondContact O-N 3.28Å; V203-F207 VanDerWaalsContact O-N 3.11Å
204	W	97.9	Very high	92.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.9	-47.3	171	166.9	97.3	0	0	0	111.6	D103 A200 T201 F202 I206 F207 K208 V215 V217 W261 Y346 F347 V350	D103-W204 HydrophobicContact CB-CZ2 4.49Å; D103-W204 WeakPolarHBondContact OD2-CZ2 3.35Å; D103-W204 PolarHBondContact OD2-NE1 2.89Å; A200-W204 PolarHBondContact O-N 3.38Å; T201-W204 PolarHBondContact O-N 2.67Å; F202-W204 VanDerWaalsContact C-N 3.31Å; F202-W204 PolarHBondContact O-N 3.26Å; W204-I206 PolarHBondContact O-N 3.47Å; W204-F207 PolarHBondContact O-N 3.36Å; W204-K208 HydrophobicContact CD2-CG 4.33Å; W204-K208 HydrophobicContact CH2-CG 4.25Å; W204-K208 HydrophobicContact CZ2-CD 4.37Å; W204-K208 HydrophobicContact CZ2-CG 3.95Å; W204-K208 WeakPolarHBondContact O-CG 3.44Å; W204-K208 PolarHBondContact O-N 3.44Å; W204-V215 HydrophobicContact CB-CG2 4.19Å; W204-V215 HydrophobicContact CG-CG1 4.22Å; W204-V215 HydrophobicContact CG-CG2 4.33Å; W204-V215 PolarHBondContact NE1-O 3.34Å; W204-V217 HydrophobicContact CB-CG2 3.62Å; W204-V217 HydrophobicContact CG-CG2 3.93Å; W204-W261 HydrophobicContact CH2-CZ3 4.09Å; W204-Y346 HydrophobicContact CH2-CE1 4.16Å; W204-Y346 AromaticContact CZ3-CD1 3.91Å; W204-Y346 HydrophobicContact CZ3-CD1 3.91Å; W204-Y346 AromaticContact CZ3-CE1 3.71Å; W204-Y346 HydrophobicContact CZ3-CE1 3.71Å; W204-F347 AromaticContact CD2-CD2 3.62Å; W204-F347 HydrophobicContact CD2-CD2 3.62Å; W204-F347 AromaticContact CD2-CE2 3.85Å; W204-F347 HydrophobicContact CD2-CE2 3.85Å; W204-F347 AromaticContact CE2-CD2 3.83Å; W204-F347 AromaticContact CE2-CE2 3.8Å; W204-F347 AromaticContact CE3-CD2 3.57Å; W204-F347 HydrophobicContact CE3-CD2 3.57Å; W204-F347 HydrophobicContact CE3-CE2 4.28Å; W204-F347 HydrophobicContact CG-CD2 4.23Å; W204-F347 HydrophobicContact CG-CE2 4.11Å; W204-F347 HydrophobicContact CH2-CD2 4.05Å; W204-F347 HydrophobicContact CZ2-CD2 4.06Å; W204-F347 HydrophobicContact CZ2-CE2 4.25Å; W204-F347 HydrophobicContact CZ3-CB 4.46Å; W204-F347 AromaticContact CZ3-CD2 3.79Å; W204-F347 HydrophobicContact CZ3-CD2 3.79Å; W204-F347 AromaticContact NE1-CE2 3.95Å; W204-V350 HydrophobicContact CH2-CB 4.27Å; W204-V350 HydrophobicContact CH2-CG1 3.93Å; W204-V350 HydrophobicContact CH2-CG2 4.26Å; W204-V350 HydrophobicContact CZ2-CG1 4.33Å
205	W	97.9	Very high	93.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63	-42.2	178.9	167.9	75.2	0	0	0	111.8	L164 T201 F202 V203 F207 K208 V209 W261 L262 Y346 L358 E360	L164-W205 HydrophobicContact CD1-CH2 3.66Å; L164-W205 HydrophobicContact CD1-CZ2 4.46Å; L164-W205 HydrophobicContact CD1-CZ3 3.74Å; L164-W205 HydrophobicContact CD2-CZ3 3.97Å; L164-W205 HydrophobicContact CG-CH2 4.14Å; L164-W205 HydrophobicContact CG-CZ3 4.06Å; T201-W205 PolarHBondContact O-N 2.66Å; F202-W205 AromaticContact CD2-CE3 3.82Å; F202-W205 HydrophobicContact CD2-CE3 3.82Å; F202-W205 HydrophobicContact CD2-CZ3 4.15Å; F202-W205 AromaticContact CE2-CE3 3.61Å; F202-W205 HydrophobicContact CE2-CE3 3.61Å; F202-W205 AromaticContact CE2-CZ3 3.46Å; F202-W205 HydrophobicContact CE2-CZ3 3.46Å; F202-W205 VanDerWaalsContact CE2-CZ3 3.46Å; F202-W205 HydrophobicContact CZ-CE3 4.48Å; F202-W205 HydrophobicContact CZ-CZ3 4.18Å; F202-W205 WeakPolarHBondContact O-CB 3.13Å; F202-W205 PolarHBondContact O-N 3.31Å; F202-W205 VanDerWaalsContact O-N 3.09Å; V203-W205 VanDerWaalsContact C-N 3.33Å; V203-W205 PolarHBondContact O-N 3.37Å; W205-F207 VanDerWaalsContact C-N 3.31Å; W205-F207 PolarHBondContact O-N 3.33Å; W205-K208 WeakPolarHBondContact O-CA 3.3Å; W205-K208 WeakPolarHBondContact O-CB 3.37Å; W205-K208 PolarHBondContact O-N 3.23Å; W205-V209 HydrophobicContact CD2-CG2 3.92Å; W205-V209 HydrophobicContact CG-CG2 4.36Å; W205-V209 HydrophobicContact CH2-CG2 4.28Å; W205-V209 HydrophobicContact CZ2-CG2 3.61Å; W205-V209 WeakPolarHBondContact O-CG2 3.07Å; W205-V209 PolarHBondContact O-N 3.05Å; W205-W261 PolarHBondContact NE1-O 3.4Å; W205-L262 HydrophobicContact CH2-CD1 3.98Å; W205-L262 HydrophobicContact CZ2-CB 4.07Å; W205-L262 HydrophobicContact CZ2-CD1 3.83Å; W205-L262 HydrophobicContact CZ2-CG 4.09Å; W205-Y346 AromaticContact CD1-CD1 3.9Å; W205-Y346 AromaticContact CD1-CE1 3.42Å; W205-Y346 VanDerWaalsContact CD1-CE1 3.42Å; W205-Y346 HydrophobicContact CG-CD1 4.43Å; W205-Y346 HydrophobicContact CG-CE1 4.29Å; W205-L358 HydrophobicContact CD2-CD2 3.48Å; W205-L358 VanDerWaalsContact CD2-CD2 3.48Å; W205-L358 VanDerWaalsContact CE2-CD2 3.48Å; W205-L358 HydrophobicContact CE3-CD2 3.86Å; W205-L358 HydrophobicContact CG-CD2 3.85Å; W205-L358 HydrophobicContact CH2-CD2 4.21Å; W205-L358 HydrophobicContact CZ2-CB 4.2Å; W205-L358 HydrophobicContact CZ2-CD2 3.86Å; W205-L358 HydrophobicContact CZ2-CG 4.3Å; W205-L358 HydrophobicContact CZ3-CD2 4.21Å; W205-E360 HydrophobicContact CH2-CB 4.42Å; W205-E360 HydrophobicContact CH2-CG 4.3Å
206	I	97.9	Very high	95	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-55.1	-47	175.6	-70.6	165.5	0	0	0	111	V153 L164 F170 F202 V203 W204 K208 V209 Y210	V153-I206 HydrophobicContact CG2-CD1 3.72Å; L164-I206 HydrophobicContact CD2-CD1 4.19Å; L164-I206 HydrophobicContact CD2-CG1 3.75Å; F170-I206 HydrophobicContact CD2-CG2 3.95Å; F170-I206 HydrophobicContact CE2-CG2 3.39Å; F170-I206 HydrophobicContact CZ-CG2 3.87Å; F202-I206 HydrophobicContact CD1-CD1 3.54Å; F202-I206 HydrophobicContact CD1-CG1 4.42Å; F202-I206 HydrophobicContact CE1-CD1 3.18Å; F202-I206 HydrophobicContact CE1-CG1 4.09Å; F202-I206 HydrophobicContact CE2-CD1 4.28Å; F202-I206 HydrophobicContact CE2-CG1 4.33Å; F202-I206 HydrophobicContact CG-CD1 4.22Å; F202-I206 HydrophobicContact CZ-CD1 3.59Å; F202-I206 HydrophobicContact CZ-CG1 4.01Å; F202-I206 WeakPolarHBondContact O-CG1 3.41Å; F202-I206 PolarHBondContact O-N 2.8Å; V203-I206 WeakPolarHBondContact O-CB 3.35Å; V203-I206 PolarHBondContact O-N 3.05Å; W204-I206 PolarHBondContact O-N 3.47Å; I206-K208 VanDerWaalsContact C-N 3.29Å; I206-K208 PolarHBondContact O-N 3.43Å; I206-V209 PolarHBondContact O-N 2.86Å; I206-Y210 HydrophobicContact CG2-CD2 3.46Å; I206-Y210 VanDerWaalsContact CG2-CD2 3.46Å; I206-Y210 HydrophobicContact CG2-CE2 3.44Å; I206-Y210 VanDerWaalsContact CG2-CE2 3.44Å; I206-Y210 WeakPolarHBondContact O-CD2 3.4Å; I206-Y210 PolarHBondContact O-N 3.04Å
207	F	97.8	Very high	96.2	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.4	-39.1	177.3	-83.7	-73.2	0	0	0	112.2	L124 F148 F170 V174 L179 I185 V203 W204 W205 Y210 G211 F212 V215 F253	L124-F207 HydrophobicContact CD1-CE2 3.59Å; L124-F207 HydrophobicContact CD1-CZ 3.84Å; F148-F207 HydrophobicContact CE2-CE2 4.27Å; F148-F207 HydrophobicContact CE2-CZ 4.32Å; F170-F207 HydrophobicContact CE1-CD1 4.25Å; F170-F207 HydrophobicContact CE1-CE1 4.14Å; F170-F207 AromaticContact CZ-CD1 3.81Å; F170-F207 HydrophobicContact CZ-CD1 3.81Å; F170-F207 AromaticContact CZ-CE1 3.6Å; F170-F207 HydrophobicContact CZ-CE1 3.6Å; F170-F207 HydrophobicContact CZ-CE2 4.48Å; F170-F207 HydrophobicContact CZ-CG 4.33Å; F170-F207 AromaticContact CZ-CZ 3.95Å; F170-F207 HydrophobicContact CZ-CZ 3.95Å; V174-F207 HydrophobicContact CG1-CE1 4.25Å; V174-F207 HydrophobicContact CG1-CZ 4.04Å; L179-F207 HydrophobicContact CD1-CE1 4.05Å; L179-F207 HydrophobicContact CD1-CZ 3.61Å; I185-F207 HydrophobicContact CD1-CD1 3.61Å; I185-F207 HydrophobicContact CD1-CD2 4.43Å; I185-F207 HydrophobicContact CD1-CE1 3.25Å; I185-F207 HydrophobicContact CD1-CE2 4.15Å; I185-F207 HydrophobicContact CD1-CG 4.22Å; I185-F207 HydrophobicContact CD1-CZ 3.58Å; I185-F207 HydrophobicContact CG2-CD2 4.35Å; I185-F207 HydrophobicContact CG2-CE2 4.03Å; I185-F207 HydrophobicContact CG2-CZ 4.36Å; V203-F207 HydrophobicContact CG1-CD2 3.9Å; V203-F207 HydrophobicContact CG1-CE2 3.61Å; V203-F207 WeakPolarHBondContact O-CD2 3.21Å; V203-F207 PolarHBondContact O-N 3.28Å; V203-F207 VanDerWaalsContact O-N 3.11Å; W204-F207 PolarHBondContact O-N 3.36Å; W205-F207 VanDerWaalsContact C-N 3.31Å; W205-F207 PolarHBondContact O-N 3.33Å; F207-Y210 CarbonylContact O-C 3.44Å; F207-Y210 PolarHBondContact O-N 2.92Å; F207-G211 PolarHBondContact O-N 2.78Å; F207-F212 CarbonylContact C-O 3.44Å; F207-F212 HydrophobicContact CB-CB 4.39Å; F207-F212 HydrophobicContact CD1-CB 4.16Å; F207-F212 HydrophobicContact CD1-CD1 4.14Å; F207-F212 HydrophobicContact CD1-CG 4.38Å; F207-F212 WeakPolarHBondContact O-CB 3.12Å; F207-F212 PolarHBondContact O-N 2.58Å; F207-V215 HydrophobicContact CB-CB 4.2Å; F207-V215 HydrophobicContact CB-CG1 3.93Å; F207-V215 HydrophobicContact CB-CG2 4.25Å; F207-V215 HydrophobicContact CD2-CG2 4.16Å; F207-V215 HydrophobicContact CG-CG2 4.41Å; F207-F253 AromaticContact CD1-CE2 3.73Å; F207-F253 HydrophobicContact CD1-CE2 3.73Å; F207-F253 AromaticContact CD1-CZ 3.72Å; F207-F253 HydrophobicContact CD1-CZ 3.72Å; F207-F253 HydrophobicContact CE1-CD2 4.41Å; F207-F253 AromaticContact CE1-CE2 3.62Å; F207-F253 HydrophobicContact CE1-CE2 3.62Å; F207-F253 AromaticContact CE1-CZ 3.82Å; F207-F253 HydrophobicContact CE1-CZ 3.82Å
208	K	96.7	Very high	96.5	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.017	6%	0.06	C	C	.	.	H	α-helix	trans	-64.3	-45.2	174.6	-62.8	-62.2	-168.9	176.1	0	112.2	D103 W204 W205 I206 Y210 G211 E213 V215 W261	D103-K208 WeakPolarHBondContact OD2-CE 3.43Å; D103-K208 IonicContact OD2-NZ 2.9Å; D103-K208 PolarHBondContact OD2-NZ 3.47Å; W204-K208 HydrophobicContact CD2-CG 4.33Å; W204-K208 HydrophobicContact CH2-CG 4.25Å; W204-K208 HydrophobicContact CZ2-CD 4.37Å; W204-K208 HydrophobicContact CZ2-CG 3.95Å; W204-K208 WeakPolarHBondContact O-CG 3.44Å; W204-K208 PolarHBondContact O-N 3.44Å; W205-K208 WeakPolarHBondContact O-CA 3.3Å; W205-K208 WeakPolarHBondContact O-CB 3.37Å; W205-K208 PolarHBondContact O-N 3.23Å; I206-K208 VanDerWaalsContact C-N 3.29Å; I206-K208 PolarHBondContact O-N 3.43Å; K208-Y210 VanDerWaalsContact C-N 3.25Å; K208-Y210 PolarHBondContact O-N 2.74Å; K208-G211 PolarHBondContact O-N 3.41Å; K208-E213 PolarHBondContact NZ-O 2.75Å; K208-E213 IonicContact NZ-OE2 3.91Å; K208-E213 PolarHBondContact NZ-OE2 3.45Å; K208-V215 HydrophobicContact CD-CG1 4.08Å; K208-V215 HydrophobicContact CG-CG1 4.36Å; K208-W261 VanDerWaalsContact C-CD1 3.45Å; K208-W261 HydrophobicContact CB-CB 4.5Å; K208-W261 HydrophobicContact CB-CD2 3.58Å; K208-W261 HydrophobicContact CB-CE3 4Å; K208-W261 HydrophobicContact CB-CG 3.75Å; K208-W261 HydrophobicContact CB-CZ2 4.24Å; K208-W261 HydrophobicContact CD-CH2 4.21Å; K208-W261 HydrophobicContact CD-CZ2 3.94Å; K208-W261 HydrophobicContact CG-CD2 4.27Å; K208-W261 HydrophobicContact CG-CE3 4.28Å; K208-W261 HydrophobicContact CG-CH2 4.42Å; K208-W261 HydrophobicContact CG-CZ2 4.31Å; K208-W261 HydrophobicContact CG-CZ3 4.4Å; K208-W261 PolarHBondContact O-NE1 3.27Å
209	V	97.6	Very high	96.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.5	-37.1	174.6	174.9	0	0	0	0	111.3	L164 W205 I206 G211 W257 N258 W261 L262	L164-V209 HydrophobicContact CD1-CB 4.17Å; L164-V209 HydrophobicContact CD1-CG1 3.75Å; L164-V209 HydrophobicContact CD1-CG2 4.33Å; W205-V209 HydrophobicContact CD2-CG2 3.92Å; W205-V209 HydrophobicContact CG-CG2 4.36Å; W205-V209 HydrophobicContact CH2-CG2 4.28Å; W205-V209 HydrophobicContact CZ2-CG2 3.61Å; W205-V209 WeakPolarHBondContact O-CG2 3.07Å; W205-V209 PolarHBondContact O-N 3.05Å; I206-V209 PolarHBondContact O-N 2.86Å; V209-G211 PolarHBondContact O-N 3.18Å; V209-W257 HydrophobicContact CG1-CD2 4.28Å; V209-W257 HydrophobicContact CG1-CE3 3.97Å; V209-W257 HydrophobicContact CG1-CH2 3.92Å; V209-W257 HydrophobicContact CG1-CZ2 4.21Å; V209-W257 HydrophobicContact CG1-CZ3 3.78Å; V209-W257 CarbonylContact O-C 3.54Å; V209-N258 PolarHBondContact O-N 2.9Å; V209-W261 HydrophobicContact CG2-CB 3.79Å; V209-L262 HydrophobicContact CG1-CD1 4.41Å; V209-L262 HydrophobicContact CG2-CB 4.3Å
210	Y	97.8	Very high	96.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	20.7	174.5	-65.6	-63.5	0	0	0	114.2	V165 P167 F170 I206 F207 K208 F212 A255 S256 W257	V165-Y210 PolarHBondContact N-OH 2.92Å; V165-Y210 PolarHBondContact O-OH 3.23Å; P167-Y210 HydrophobicContact CB-CD1 4.16Å; P167-Y210 HydrophobicContact CB-CE1 4.23Å; P167-Y210 HydrophobicContact CG-CD1 4.2Å; P167-Y210 HydrophobicContact CG-CE1 4.05Å; F170-Y210 HydrophobicContact CB-CD1 4.31Å; F170-Y210 HydrophobicContact CB-CD2 4.01Å; F170-Y210 HydrophobicContact CB-CE1 3.93Å; F170-Y210 HydrophobicContact CB-CE2 3.57Å; F170-Y210 HydrophobicContact CB-CG 4.34Å; F170-Y210 HydrophobicContact CD1-CD1 4.04Å; F170-Y210 AromaticContact CD1-CD2 3.22Å; F170-Y210 HydrophobicContact CD1-CD2 3.22Å; F170-Y210 HydrophobicContact CD1-CE1 4.48Å; F170-Y210 AromaticContact CD1-CE2 3.72Å; F170-Y210 HydrophobicContact CD1-CE2 3.72Å; F170-Y210 AromaticContact CD1-CG 3.39Å; F170-Y210 HydrophobicContact CD1-CG 3.39Å; F170-Y210 AromaticContact CD2-CD2 3.58Å; F170-Y210 HydrophobicContact CD2-CD2 3.58Å; F170-Y210 AromaticContact CD2-CE2 3.37Å; F170-Y210 HydrophobicContact CD2-CE2 3.37Å; F170-Y210 AromaticContact CE1-CD2 3.4Å; F170-Y210 HydrophobicContact CE1-CD2 3.4Å; F170-Y210 VanDerWaalsContact CE1-CD2 3.4Å; F170-Y210 HydrophobicContact CE1-CE2 4.21Å; F170-Y210 AromaticContact CE1-CG 3.7Å; F170-Y210 HydrophobicContact CE1-CG 3.7Å; F170-Y210 AromaticContact CE2-CD2 3.76Å; F170-Y210 HydrophobicContact CE2-CD2 3.76Å; F170-Y210 AromaticContact CE2-CE2 3.92Å; F170-Y210 HydrophobicContact CE2-CE2 3.92Å; F170-Y210 HydrophobicContact CG-CD1 4.3Å; F170-Y210 AromaticContact CG-CD2 3.31Å; F170-Y210 HydrophobicContact CG-CD2 3.31Å; F170-Y210 HydrophobicContact CG-CE1 4.28Å; F170-Y210 AromaticContact CG-CE2 3.25Å; F170-Y210 HydrophobicContact CG-CE2 3.25Å; F170-Y210 AromaticContact CG-CG 3.84Å; F170-Y210 HydrophobicContact CG-CG 3.84Å; F170-Y210 AromaticContact CG-CZ 3.77Å; F170-Y210 AromaticContact CZ-CD2 3.66Å; F170-Y210 HydrophobicContact CZ-CD2 3.66Å; F170-Y210 HydrophobicContact CZ-CE2 4.3Å; F170-Y210 HydrophobicContact CZ-CG 4.39Å; I206-Y210 HydrophobicContact CG2-CD2 3.46Å; I206-Y210 VanDerWaalsContact CG2-CD2 3.46Å; I206-Y210 HydrophobicContact CG2-CE2 3.44Å; I206-Y210 VanDerWaalsContact CG2-CE2 3.44Å; I206-Y210 WeakPolarHBondContact O-CD2 3.4Å; I206-Y210 PolarHBondContact O-N 3.04Å; F207-Y210 CarbonylContact O-C 3.44Å; F207-Y210 PolarHBondContact O-N 2.92Å; K208-Y210 VanDerWaalsContact C-N 3.25Å; K208-Y210 PolarHBondContact O-N 2.74Å; Y210-F212 PolarHBondContact O-N 3.45Å; Y210-A255 HydrophobicContact CD1-CB 4.34Å; Y210-A255 HydrophobicContact CG-CB 4.49Å; Y210-S256 CarbonylContact C-O 3.43Å; Y210-S256 VanDerWaalsContact CA-O 3.22Å; Y210-S256 WeakPolarHBondContact CA-O 3.38Å; Y210-S256 PolarHBondContact O-N 3.32Å; Y210-S256 VanDerWaalsContact O-O 3.06Å; Y210-W257 HydrophobicContact CD1-CE3 4.21Å; Y210-W257 AromaticContact CE1-CE3 3.85Å; Y210-W257 HydrophobicContact CE1-CE3 3.85Å; Y210-W257 AromaticContact CE1-CZ3 3.92Å; Y210-W257 HydrophobicContact CE1-CZ3 3.92Å
211	G	95.7	Very high	96.2	Very high	37 Å²	37	12.6 Å²	12.6	38%	0.381	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	20	164.7	0	0	0	0	0	114.5	F207 K208 V209 S256	F207-G211 PolarHBondContact O-N 2.78Å; K208-G211 PolarHBondContact O-N 3.41Å; V209-G211 PolarHBondContact O-N 3.18Å; G211-S256 WeakPolarHBondContact CA-O 3.32Å; G211-S256 PolarHBondContact N-O 3.01Å
212	F	95.6	Very high	96.1	Very high	19 Å²	19	12.7 Å²	12.7	8%	0.083	7%	0.065	C	C	.	.			trans	-109.2	113.7	179.9	-166.4	-97.2	0	0	0	111.8	C183 I185 F207 Y210 R214 F253	C183-F212 WeakPolarHBondContact O-CZ 3.42Å; I185-F212 HydrophobicContact CB-CE1 4.46Å; I185-F212 HydrophobicContact CD1-CD1 3.79Å; I185-F212 HydrophobicContact CD1-CE1 3.48Å; I185-F212 VanDerWaalsContact CD1-CE1 3.48Å; I185-F212 HydrophobicContact CD1-CZ 4.19Å; I185-F212 HydrophobicContact CG1-CD1 4.49Å; I185-F212 HydrophobicContact CG1-CE1 3.78Å; I185-F212 HydrophobicContact CG1-CZ 4.45Å; F207-F212 CarbonylContact C-O 3.44Å; F207-F212 HydrophobicContact CB-CB 4.39Å; F207-F212 HydrophobicContact CD1-CB 4.16Å; F207-F212 HydrophobicContact CD1-CD1 4.14Å; F207-F212 HydrophobicContact CD1-CG 4.38Å; F207-F212 WeakPolarHBondContact O-CB 3.12Å; F207-F212 PolarHBondContact O-N 2.58Å; Y210-F212 PolarHBondContact O-N 3.45Å; F212-R214 HydrophobicContact CE1-CB 3.91Å; F212-R214 WeakPolarHBondContact CE1-O 3.5Å; F212-R214 HydrophobicContact CZ-CB 4.14Å; F212-F253 HydrophobicContact CB-CE2 3.75Å; F212-F253 HydrophobicContact CB-CZ 3.6Å; F212-F253 HydrophobicContact CD1-CE2 4.01Å; F212-F253 HydrophobicContact CD2-CD2 4.09Å; F212-F253 AromaticContact CD2-CE2 3.37Å; F212-F253 HydrophobicContact CD2-CE2 3.37Å; F212-F253 AromaticContact CD2-CZ 3.96Å; F212-F253 HydrophobicContact CD2-CZ 3.96Å; F212-F253 HydrophobicContact CE1-CE2 4.45Å; F212-F253 HydrophobicContact CE2-CD2 4.24Å; F212-F253 AromaticContact CE2-CE2 3.9Å; F212-F253 HydrophobicContact CE2-CE2 3.9Å; F212-F253 HydrophobicContact CG-CD2 4.49Å; F212-F253 AromaticContact CG-CE2 3.42Å; F212-F253 HydrophobicContact CG-CE2 3.42Å; F212-F253 VanDerWaalsContact CG-CE2 3.42Å; F212-F253 AromaticContact CG-CZ 3.84Å; F212-F253 HydrophobicContact CG-CZ 3.84Å; F212-F253 HydrophobicContact CZ-CE2 4.4Å
213	E	92.9	Very high	95.9	Very high	82 Å²	82	14.4 Å²	14.4	38%	0.383	7%	0.073	S	C	.	.			trans	-87.1	-29.2	-170.3	-68.7	-60	155.7	0	0	114.6	K208 V215	K208-E213 PolarHBondContact NZ-O 2.75Å; K208-E213 IonicContact NZ-OE2 3.91Å; K208-E213 PolarHBondContact NZ-OE2 3.45Å; E213-V215 PolarHBondContact O-N 2.98Å
214	R	94.7	Very high	95.7	Very high	102 Å²	102	15.2 Å²	15.2	39%	0.385	8%	0.08	S	C	.	.			trans	-83.8	62.1	-171.8	-70	176.2	46.7	-179.4	-8.3	112.4	N182 C183 I185 F212	N182-R214 VanDerWaalsContact O-CZ 3.23Å; N182-R214 PolarHBondContact O-NH1 3.03Å; N182-R214 VanDerWaalsContact O-NH1 3.11Å; N182-R214 PolarHBondContact O-NH2 2.79Å; C183-R214 PolarHBondContact O-NE 3.26Å; C183-R214 PolarHBondContact O-NH2 3.33Å; C183-R214 VanDerWaalsContact O-NH2 3.16Å; I185-R214 PolarHBondContact N-O 2.69Å; F212-R214 HydrophobicContact CE1-CB 3.91Å; F212-R214 WeakPolarHBondContact CE1-O 3.5Å; F212-R214 HydrophobicContact CZ-CB 4.14Å
215	V	96.4	Very high	95.5	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.9	-179.6	57.7	0	0	0	0	110.2	I185 T187 W204 F207 K208 E213	I185-V215 HydrophobicContact CB-CB 4.27Å; I185-V215 HydrophobicContact CB-CG2 4.1Å; I185-V215 HydrophobicContact CG2-CG2 4Å; I185-V215 CarbonylContact O-C 3.54Å; I185-V215 VanDerWaalsContact O-CA 3.3Å; I185-V215 WeakPolarHBondContact O-CA 3.38Å; T187-V215 HydrophobicContact CG2-CG2 4.18Å; W204-V215 HydrophobicContact CB-CG2 4.19Å; W204-V215 HydrophobicContact CG-CG1 4.22Å; W204-V215 HydrophobicContact CG-CG2 4.33Å; W204-V215 PolarHBondContact NE1-O 3.34Å; F207-V215 HydrophobicContact CB-CB 4.2Å; F207-V215 HydrophobicContact CB-CG1 3.93Å; F207-V215 HydrophobicContact CB-CG2 4.25Å; F207-V215 HydrophobicContact CD2-CG2 4.16Å; F207-V215 HydrophobicContact CG-CG2 4.41Å; K208-V215 HydrophobicContact CD-CG1 4.08Å; K208-V215 HydrophobicContact CG-CG1 4.36Å; E213-V215 PolarHBondContact O-N 2.98Å
216	S	97	Very high	95.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.007	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.7	175.4	-53.4	0	0	0	0	111.2	R102 D103 H184 I185 V186 T187	R102-S216 WeakPolarHBondContact O-CB 3.45Å; R102-S216 PolarHBondContact O-OG 2.85Å; D103-S216 CarbonylContact O-C 3.59Å; D103-S216 WeakPolarHBondContact O-CA 3.38Å; H184-S216 PolarHBondContact CE1-OG 3.36Å; H184-S216 PolarHBondContact NE2-OG 2.68Å; I185-S216 PolarHBondContact O-N 3.11Å; V186-S216 CarbonylContact C-O 3.57Å; V186-S216 VanDerWaalsContact CA-O 3.29Å; V186-S216 WeakPolarHBondContact CA-O 3.41Å; T187-S216 PolarHBondContact N-O 2.84Å; T187-S216 PolarHBondContact OG1-O 3.42Å
217	V	96.9	Very high	95	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.8	171.8	179.7	0	0	0	0	109.1	D103 M104 L105 T187 I197 A200 T201 W204 N219 F347	D103-V217 PolarHBondContact O-N 3.44Å; M104-V217 WeakPolarHBondContact CA-O 3.41Å; L105-V217 PolarHBondContact N-O 2.94Å; T187-V217 CarbonylContact O-C 3.48Å; T187-V217 WeakPolarHBondContact O-CA 3.04Å; I197-V217 HydrophobicContact CD1-CG1 4.27Å; I197-V217 HydrophobicContact CG1-CG1 4.18Å; A200-V217 HydrophobicContact CB-CG1 3.92Å; T201-V217 HydrophobicContact CG2-CG1 4.27Å; T201-V217 HydrophobicContact CG2-CG2 4.08Å; W204-V217 HydrophobicContact CB-CG2 3.62Å; W204-V217 HydrophobicContact CG-CG2 3.93Å; V217-N219 PolarHBondContact O-N 2.83Å; V217-F347 HydrophobicContact CB-CE2 4.26Å; V217-F347 HydrophobicContact CB-CZ 3.97Å; V217-F347 HydrophobicContact CG2-CD2 4.21Å; V217-F347 HydrophobicContact CG2-CE2 3.63Å; V217-F347 HydrophobicContact CG2-CZ 3.86Å
218	L	95.7	Very high	94.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	107.1	169.8	178.1	62.5	0	0	0	109.6	A107 L110 L142 V186 T187 Y188 G220 G221	A107-L218 HydrophobicContact CB-CD1 4.47Å; L110-L218 HydrophobicContact CB-CD1 4.31Å; L110-L218 HydrophobicContact CD2-CD1 4.01Å; L110-L218 HydrophobicContact CD2-CD2 3.97Å; L142-L218 HydrophobicContact CD1-CD2 4.48Å; L142-L218 HydrophobicContact CD2-CD2 3.86Å; V186-L218 HydrophobicContact CG1-CB 4.07Å; T187-L218 PolarHBondContact O-N 2.93Å; Y188-L218 HydrophobicContact CG-CD2 4.35Å; L218-G220 PolarHBondContact O-N 2.74Å; L218-G221 PolarHBondContact O-N 3.28Å; L218-G221 VanDerWaalsContact O-N 3.09Å
219	N	94	Very high	94.6	Very high	19 Å²	19	22.2 Å²	22.2	10%	0.102	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	124.6	-177.7	-165.5	20.5	0	0	0	111.4	M104 L105 V217 G221 A310 L311	M104-N219 HydrophobicContact CG-CB 3.81Å; M104-N219 HydrophobicContact SD-CB 3.97Å; L105-N219 WeakPolarHBondContact O-CB 3.32Å; L105-N219 PolarHBondContact O-N 3.41Å; V217-N219 PolarHBondContact O-N 2.83Å; N219-G221 VanDerWaalsContact C-N 3.29Å; N219-A310 WeakPolarHBondContact OD1-CA 3.4Å; N219-L311 PolarHBondContact ND2-O 2.97Å; N219-L311 PolarHBondContact OD1-N 3.2Å
220	G	92.1	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	4.8	-175.2	0	0	0	0	0	114.8	L218 A224	L218-G220 PolarHBondContact O-N 2.74Å; G220-A224 VanDerWaalsContact O-CB 3.32Å; G220-A224 WeakPolarHBondContact O-CB 3.35Å; G220-A224 PolarHBondContact O-N 2.97Å
221	G	94	Very high	94.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	61.3	-154.1	166.1	0	0	0	0	0	115.9	D189 L218 N219 E223 A224 W225	D189-G221 CarbonylContact O-C 3.54Å; D189-G221 WeakPolarHBondContact O-CA 3.5Å; L218-G221 PolarHBondContact O-N 3.28Å; L218-G221 VanDerWaalsContact O-N 3.09Å; N219-G221 VanDerWaalsContact C-N 3.29Å; G221-E223 VanDerWaalsContact C-N 3.26Å; G221-E223 PolarHBondContact O-N 3.44Å; G221-A224 PolarHBondContact O-N 3.13Å; G221-W225 PolarHBondContact O-N 2.84Å
222	L	94.6	Very high	93.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-38.3	177.3	-178.7	60.8	0	0	0	111.7	G140 L142 Y188 D189 H190 W225 R226 L240	G140-L222 WeakPolarHBondContact O-CD2 3.36Å; L142-L222 HydrophobicContact CD1-CD1 3.49Å; L142-L222 VanDerWaalsContact CD1-CD1 3.49Å; Y188-L222 HydrophobicContact CD2-CB 4.29Å; Y188-L222 HydrophobicContact CE2-CB 4.23Å; D189-L222 PolarHBondContact O-N 2.99Å; H190-L222 HydrophobicContact CB-CB 4.48Å; H190-L222 VanDerWaalsContact CE1-CD2 3.48Å; H190-L222 WeakPolarHBondContact CE1-CD2 3.46Å; H190-L222 WeakPolarHBondContact ND1-CD2 3.48Å; L222-W225 CarbonylContact O-C 3.17Å; L222-W225 WeakPolarHBondContact O-CA 3.39Å; L222-W225 WeakPolarHBondContact O-CB 3.5Å; L222-W225 PolarHBondContact O-N 2.61Å; L222-W225 VanDerWaalsContact O-N 3.14Å; L222-R226 WeakPolarHBondContact O-CB 3.16Å; L222-R226 PolarHBondContact O-N 2.81Å; L222-L240 HydrophobicContact CD1-CD2 3.75Å
223	E	93	Very high	93.4	Very high	37 Å²	37	40.5 Å²	40.5	17%	0.173	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-39	-177.8	175.4	49.5	-148.1	0	0	112.2	H190 G221 W225 R226 R227	H190-E223 VanDerWaalsContact O-CB 3.23Å; H190-E223 WeakPolarHBondContact O-CB 3.45Å; H190-E223 PolarHBondContact O-N 3.39Å; G221-E223 VanDerWaalsContact C-N 3.26Å; G221-E223 PolarHBondContact O-N 3.44Å; E223-W225 VanDerWaalsContact C-N 3.3Å; E223-W225 PolarHBondContact O-N 3.33Å; E223-R226 PolarHBondContact O-N 3.25Å; E223-R226 IonicContact OE2-CZ 3.66Å; E223-R226 IonicContact OE2-NE 3.53Å; E223-R226 IonicContact OE2-NH1 3.19Å; E223-R226 PolarHBondContact OE2-NH1 3.2Å; E223-R227 WeakPolarHBondContact O-CG 3.22Å; E223-R227 PolarHBondContact O-N 3.07Å; E223-R227 IonicContact OE1-CZ 3.53Å; E223-R227 IonicContact OE1-NE 3.68Å; E223-R227 IonicContact OE1-NH1 2.94Å; E223-R227 PolarHBondContact OE1-NH1 3.18Å
224	A	92.5	Very high	93.1	Very high	17 Å²	17	49 Å²	49	14%	0.14	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-36.9	169.8	0	0	0	0	0	112.6	G220 G221 L228	G220-A224 VanDerWaalsContact O-CB 3.32Å; G220-A224 WeakPolarHBondContact O-CB 3.35Å; G220-A224 PolarHBondContact O-N 2.97Å; G221-A224 PolarHBondContact O-N 3.13Å; A224-L228 PolarHBondContact O-N 3.26Å
225	W	94.3	Very high	92.7	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-67.1	-43.2	174	-177.8	-93.8	0	0	0	112.2	A107 L110 M114 L142 G221 L222 E223 R227 L228 V229 F238 T239	A107-W225 HydrophobicContact CB-CE3 4.17Å; L110-W225 HydrophobicContact CB-CZ3 4.34Å; L110-W225 HydrophobicContact CD2-CE3 4.27Å; L110-W225 HydrophobicContact CD2-CZ3 4.1Å; L110-W225 HydrophobicContact CG-CZ3 4.12Å; M114-W225 HydrophobicContact SD-CH2 3.84Å; M114-W225 HydrophobicContact SD-CZ3 4.46Å; L142-W225 HydrophobicContact CD1-CB 3.98Å; L142-W225 HydrophobicContact CD1-CD2 4.41Å; L142-W225 HydrophobicContact CD1-CG 3.83Å; L142-W225 HydrophobicContact CD2-CD2 4.03Å; L142-W225 HydrophobicContact CD2-CE3 4.17Å; L142-W225 HydrophobicContact CD2-CG 4.28Å; L142-W225 HydrophobicContact CG-CB 4.49Å; L142-W225 HydrophobicContact CG-CD2 3.97Å; L142-W225 HydrophobicContact CG-CG 3.89Å; G221-W225 PolarHBondContact O-N 2.84Å; L222-W225 CarbonylContact O-C 3.17Å; L222-W225 WeakPolarHBondContact O-CA 3.39Å; L222-W225 WeakPolarHBondContact O-CB 3.5Å; L222-W225 PolarHBondContact O-N 2.61Å; L222-W225 VanDerWaalsContact O-N 3.14Å; E223-W225 VanDerWaalsContact C-N 3.3Å; E223-W225 PolarHBondContact O-N 3.33Å; W225-R227 PolarHBondContact O-N 3.39Å; W225-L228 HydrophobicContact CE3-CD2 4.49Å; W225-L228 WeakPolarHBondContact O-CA 3.41Å; W225-L228 VanDerWaalsContact O-CB 3.31Å; W225-L228 WeakPolarHBondContact O-CB 3.43Å; W225-L228 PolarHBondContact O-N 3.4Å; W225-V229 WeakPolarHBondContact O-CG2 3.12Å; W225-V229 PolarHBondContact O-N 3.41Å; W225-F238 AromaticContact CH2-CD1 3.92Å; W225-F238 HydrophobicContact CH2-CD1 3.92Å; W225-F238 HydrophobicContact CZ2-CD1 4.28Å; W225-F238 HydrophobicContact CZ3-CD1 4.31Å; W225-T239 PolarHBondContact NE1-O 3.12Å
226	R	94.3	Very high	91.9	Very high	67 Å²	67	51.9 Å²	51.9	25%	0.253	26%	0.259	S	S	.	.	H	α-helix	trans	-58.3	-48	177.5	-173.2	-176.8	-67	143	-9.7	111.3	E192 L222 E223 L228 V229 E230 L240	E192-R226 IonicContact OE1-CZ 2.96Å; E192-R226 IonicContact OE1-NH1 2.67Å; E192-R226 PolarHBondContact OE1-NH1 3.15Å; E192-R226 IonicContact OE1-NH2 3.45Å; L222-R226 WeakPolarHBondContact O-CB 3.16Å; L222-R226 PolarHBondContact O-N 2.81Å; E223-R226 PolarHBondContact O-N 3.25Å; E223-R226 IonicContact OE2-CZ 3.66Å; E223-R226 IonicContact OE2-NE 3.53Å; E223-R226 IonicContact OE2-NH1 3.19Å; E223-R226 PolarHBondContact OE2-NH1 3.2Å; R226-L228 PolarHBondContact O-N 2.76Å; R226-V229 WeakPolarHBondContact O-CB 3.36Å; R226-V229 PolarHBondContact O-N 2.87Å; R226-V229 VanDerWaalsContact O-N 3.09Å; R226-E230 WeakPolarHBondContact O-CG 3.35Å; R226-E230 PolarHBondContact O-N 3.43Å; R226-L240 HydrophobicContact CG-CD1 4.32Å
227	R	92.3	Very high	91.2	Very high	54 Å²	54	55.7 Å²	55.7	20%	0.204	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-36.4	173.1	-71.3	-175.2	-72.8	-111.2	9	112.9	E223 W225 R231 Q308	E223-R227 WeakPolarHBondContact O-CG 3.22Å; E223-R227 PolarHBondContact O-N 3.07Å; E223-R227 IonicContact OE1-CZ 3.53Å; E223-R227 IonicContact OE1-NE 3.68Å; E223-R227 IonicContact OE1-NH1 2.94Å; E223-R227 PolarHBondContact OE1-NH1 3.18Å; W225-R227 PolarHBondContact O-N 3.39Å; R227-R231 WeakPolarHBondContact O-CG 3.03Å; R227-R231 PolarHBondContact O-N 3.09Å; R227-Q308 PolarHBondContact NH2-O 3.23Å
228	L	91.7	Very high	90.8	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-42.3	175.9	-176.4	65	0	0	0	111.8	A107 D108 A224 W225 R226 N232 F238	A107-L228 HydrophobicContact CB-CB 4.25Å; A107-L228 HydrophobicContact CB-CD2 3.72Å; D108-L228 WeakPolarHBondContact OD1-CD1 3.44Å; A224-L228 PolarHBondContact O-N 3.26Å; W225-L228 HydrophobicContact CE3-CD2 4.49Å; W225-L228 WeakPolarHBondContact O-CA 3.41Å; W225-L228 VanDerWaalsContact O-CB 3.31Å; W225-L228 WeakPolarHBondContact O-CB 3.43Å; W225-L228 PolarHBondContact O-N 3.4Å; R226-L228 PolarHBondContact O-N 2.76Å; L228-N232 VanDerWaalsContact CD1-ND2 3.33Å; L228-N232 WeakPolarHBondContact CD1-ND2 3.36Å; L228-N232 WeakPolarHBondContact O-CB 3.15Å; L228-N232 PolarHBondContact O-N 2.86Å; L228-N232 VanDerWaalsContact O-N 3.15Å; L228-N232 PolarHBondContact O-ND2 3.43Å; L228-F238 HydrophobicContact CD1-CZ 4.49Å; L228-F238 HydrophobicContact CD2-CD1 3.62Å; L228-F238 HydrophobicContact CD2-CE1 3.42Å; L228-F238 VanDerWaalsContact CD2-CE1 3.42Å; L228-F238 HydrophobicContact CD2-CG 4.3Å; L228-F238 HydrophobicContact CD2-CZ 3.96Å; L228-F238 HydrophobicContact CG-CD1 4.05Å; L228-F238 HydrophobicContact CG-CD2 4.47Å; L228-F238 HydrophobicContact CG-CE1 4.07Å; L228-F238 HydrophobicContact CG-CE2 4.47Å; L228-F238 HydrophobicContact CG-CG 4.24Å; L228-F238 HydrophobicContact CG-CZ 4.27Å
229	V	93.5	Very high	90.6	Very high	27 Å²	27	59.2 Å²	59.2	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-58.1	-49.3	173.9	174.7	0	0	0	0	110.3	W225 R226 R231 N232 A233 F238 L240	W225-V229 WeakPolarHBondContact O-CG2 3.12Å; W225-V229 PolarHBondContact O-N 3.41Å; R226-V229 WeakPolarHBondContact O-CB 3.36Å; R226-V229 PolarHBondContact O-N 2.87Å; R226-V229 VanDerWaalsContact O-N 3.09Å; V229-R231 PolarHBondContact O-N 2.78Å; V229-N232 CarbonylContact O-C 3.59Å; V229-N232 PolarHBondContact O-N 3.3Å; V229-N232 VanDerWaalsContact O-N 3.07Å; V229-A233 PolarHBondContact O-N 2.94Å; V229-F238 HydrophobicContact CB-CB 4.43Å; V229-F238 HydrophobicContact CG2-CB 3.79Å; V229-L240 HydrophobicContact CG2-CG 4.47Å
230	E	93.1	Very high	90.6	Very high	124 Å²	124	61.9 Å²	61.9	58%	0.579	31%	0.308	S	S	*	.	H	α-helix	trans	-60	-47.1	-180	-71.2	171.2	-177.9	0	0	112.5	R226 N232 A233	R226-E230 WeakPolarHBondContact O-CG 3.35Å; R226-E230 PolarHBondContact O-N 3.43Å; E230-N232 PolarHBondContact O-N 2.94Å; E230-A233 PolarHBondContact O-N 3.38Å
231	R	92.4	Very high	90.8	Very high	172 Å²	172	63.2 Å²	63.2	65%	0.649	32%	0.319	S	S	*	.	H	α-helix	trans	-63.3	-23.1	176.3	-71	-170.8	-55	-132.4	5.6	113.2	R227 V229	R227-R231 WeakPolarHBondContact O-CG 3.03Å; R227-R231 PolarHBondContact O-N 3.09Å; V229-R231 PolarHBondContact O-N 2.78Å
232	N	91.7	Very high	90.8	Very high	58 Å²	58	67.4 Å²	67.4	31%	0.31	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	32.5	-177.8	-67.1	-86.5	0	0	0	112.2	L228 V229 E230 R234 S235 F238	L228-N232 VanDerWaalsContact CD1-ND2 3.33Å; L228-N232 WeakPolarHBondContact CD1-ND2 3.36Å; L228-N232 WeakPolarHBondContact O-CB 3.15Å; L228-N232 PolarHBondContact O-N 2.86Å; L228-N232 VanDerWaalsContact O-N 3.15Å; L228-N232 PolarHBondContact O-ND2 3.43Å; V229-N232 CarbonylContact O-C 3.59Å; V229-N232 PolarHBondContact O-N 3.3Å; V229-N232 VanDerWaalsContact O-N 3.07Å; E230-N232 PolarHBondContact O-N 2.94Å; N232-R234 PolarHBondContact O-N 3.06Å; N232-S235 WeakPolarHBondContact O-CA 3.39Å; N232-S235 WeakPolarHBondContact O-CB 3.43Å; N232-S235 PolarHBondContact O-N 2.83Å; N232-F238 HydrophobicContact CB-CD2 3.55Å; N232-F238 HydrophobicContact CB-CE2 3.94Å
233	A	85.3	Confident	90.9	Very high	86 Å²	86	68.7 Å²	68.7	71%	0.711	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-21.2	-172.6	0	0	0	0	0	115.7	V229 E230 S235	V229-A233 PolarHBondContact O-N 2.94Å; E230-A233 PolarHBondContact O-N 3.38Å; A233-S235 VanDerWaalsContact C-N 3.33Å
234	R	86.5	Confident	90.7	Very high	259 Å²	259	73.8 Å²	73.8	98%	0.977	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.2	175.2	-62.9	-176.9	-176.9	169.8	1.3	114	N232	N232-R234 PolarHBondContact O-N 3.06Å
235	S	84.6	Confident	90.6	Very high	45 Å²	45	74.3 Å²	74.3	32%	0.315	39%	0.394	S	S	.	.			trans	-99.1	125	-176.9	-171.2	0	0	0	0	109.8	N232 A233 R237	N232-S235 WeakPolarHBondContact O-CA 3.39Å; N232-S235 WeakPolarHBondContact O-CB 3.43Å; N232-S235 PolarHBondContact O-N 2.83Å; A233-S235 VanDerWaalsContact C-N 3.33Å; S235-R237 PolarHBondContact O-N 3.19Å; S235-R237 WeakPolarHBondContact OG-CB 3.35Å; S235-R237 PolarHBondContact OG-N 2.68Å
236	S	81.3	Confident	90.3	Very high	119 Å²	119	77.1 Å²	77.1	83%	0.832	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	0.6	168.5	62.9	0	0	0	0	113
237	R	81.3	Confident	90.1	Very high	81 Å²	81	80.4 Å²	80.4	31%	0.306	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-36.3	-175.9	-173.6	-177.1	-178.9	172.6	15	112.9	G111 D112 S235	G111-R237 VanDerWaalsContact C-NH2 3.27Å; G111-R237 PolarHBondContact O-NE 2.88Å; G111-R237 PolarHBondContact O-NH2 2.76Å; D112-R237 IonicContact OD1-CZ 3.68Å; D112-R237 IonicContact OD1-NH1 3.98Å; D112-R237 PolarHBondContact OD1-NH1 3.33Å; D112-R237 VanDerWaalsContact OD1-NH1 3.07Å; D112-R237 IonicContact OD1-NH2 2.73Å; D112-R237 PolarHBondContact OD1-NH2 2.94Å; S235-R237 PolarHBondContact O-N 3.19Å; S235-R237 WeakPolarHBondContact OG-CB 3.35Å; S235-R237 PolarHBondContact OG-N 2.68Å
238	F	88.1	Confident	90	Very high	11 Å²	11	81.1 Å²	81.1	5%	0.048	46%	0.457	C	S	.	.	S	Bend	trans	-115.7	111.8	-175.2	-51.9	-74.4	0	0	0	107	W225 L228 V229 N232	W225-F238 AromaticContact CH2-CD1 3.92Å; W225-F238 HydrophobicContact CH2-CD1 3.92Å; W225-F238 HydrophobicContact CZ2-CD1 4.28Å; W225-F238 HydrophobicContact CZ3-CD1 4.31Å; L228-F238 HydrophobicContact CD1-CZ 4.49Å; L228-F238 HydrophobicContact CD2-CD1 3.62Å; L228-F238 HydrophobicContact CD2-CE1 3.42Å; L228-F238 VanDerWaalsContact CD2-CE1 3.42Å; L228-F238 HydrophobicContact CD2-CG 4.3Å; L228-F238 HydrophobicContact CD2-CZ 3.96Å; L228-F238 HydrophobicContact CG-CD1 4.05Å; L228-F238 HydrophobicContact CG-CD2 4.47Å; L228-F238 HydrophobicContact CG-CE1 4.07Å; L228-F238 HydrophobicContact CG-CE2 4.47Å; L228-F238 HydrophobicContact CG-CG 4.24Å; L228-F238 HydrophobicContact CG-CZ 4.27Å; V229-F238 HydrophobicContact CB-CB 4.43Å; V229-F238 HydrophobicContact CG2-CB 3.79Å; N232-F238 HydrophobicContact CB-CD2 3.55Å; N232-F238 HydrophobicContact CB-CE2 3.94Å
239	T	92.4	Very high	90.1	Very high	63 Å²	63	85.2 Å²	85.2	39%	0.387	49%	0.491	S	S	.	.			trans	-131.4	164	-179.7	58.4	0	0	0	0	110.1	P143 W225	P143-T239 WeakPolarHBondContact CD-O 3.17Å; P143-T239 VanDerWaalsContact CG-O 3.29Å; P143-T239 WeakPolarHBondContact CG-O 3.29Å; P143-T239 WeakPolarHBondContact CG-OG1 3.17Å; W225-T239 PolarHBondContact NE1-O 3.12Å
240	L	94.1	Very high	90.2	Very high	76 Å²	76	91.4 Å²	91.4	40%	0.398	52%	0.516	S	S	.	.			trans	-107.8	152.9	166.2	-68.4	170.7	0	0	0	108.6	L222 R226 V229	L222-L240 HydrophobicContact CD1-CD2 3.75Å; R226-L240 HydrophobicContact CG-CD1 4.32Å; V229-L240 HydrophobicContact CG2-CG 4.47Å
241	A	95.2	Very high	90.4	Very high	28 Å²	28	86 Å²	86	23%	0.231	49%	0.493	C	S	.	.	B	Isolated β-bridge	trans	-117	160.3	169.7	0	0	0	0	0	109.9	G140 H141	G140-A241 CarbonylContact C-O 3.55Å; G140-A241 WeakPolarHBondContact CA-O 3.46Å; H141-A241 PolarHBondContact N-O 3.16Å; H141-A241 PolarHBondContact ND1-O 3.17Å; H141-A241 PolarHBondContact O-N 2.93Å
242	S	95.1	Very high	90.7	Very high	87 Å²	87	81 Å²	81	61%	0.608	48%	0.48	S	S	*	.			trans	-145.5	165.4	175	61.4	0	0	0	0	109.7	L138 E139	L138-S242 WeakPolarHBondContact O-CB 3.45Å; E139-S242 WeakPolarHBondContact O-CB 3.29Å
243	G	95.2	Very high	91	Very high	29 Å²	29	78.3 Å²	78.3	30%	0.299	47%	0.465	S	S	.	.	S	Bend	trans	80.5	-161.5	-176.5	0	0	0	0	0	114	L138 H141	L138-G243 VanDerWaalsContact CD2-C 3.45Å; L138-G243 WeakPolarHBondContact CD2-O 3.36Å; L138-G243 PolarHBondContact O-N 3.03Å; H141-G243 PolarHBondContact CE1-O 3.42Å; H141-G243 VanDerWaalsContact CE1-O 3.25Å
244	L	90.8	Very high	91.5	Very high	144 Å²	144	79.3 Å²	79.3	75%	0.754	46%	0.457	S	S	*	.	S	Bend	trans	-71.8	137.1	-176.9	-68.2	169.5	0	0	0	111.1	L138 A246	L138-L244 HydrophobicContact CD2-CD2 3.85Å; L138-L244 HydrophobicContact CD2-CG 4.26Å; L244-A246 PolarHBondContact O-N 3Å
245	A	89.2	Confident	92.1	Very high	28 Å²	28	67.7 Å²	67.7	23%	0.231	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-60.4	135.7	170.2	0	0	0	0	0	110.4	F137 S145	F137-A245 HydrophobicContact CE1-CB 4.38Å; F137-A245 HydrophobicContact CZ-CB 4.16Å; S145-A245 WeakPolarHBondContact O-CB 3.22Å
246	A	87.8	Confident	92.6	Very high	60 Å²	60	69.2 Å²	69.2	50%	0.496	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-55.5	140.3	-177.9	0	0	0	0	0	111.9	R146 L244	R146-A246 PolarHBondContact NH1-O 2.97Å; R146-A246 PolarHBondContact NH2-O 3.01Å; L244-A246 PolarHBondContact O-N 3Å
247	P	89.7	Confident	93.3	Very high	137 Å²	137	68.8 Å²	68.8	89%	0.89	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-52.6	143.3	-180	-26.3	34.3	0	0	0	113.3
248	V	91.8	Very high	94	Very high	68 Å²	68	67.3 Å²	67.3	41%	0.412	41%	0.405	S	S	.	.			trans	-126.5	148.3	178.2	-76.5	0	0	0	0	111.4	R146	R146-V248 VanDerWaalsContact CZ-CG1 3.47Å
249	A	93.8	Very high	94.2	Very high	87 Å²	87	69.8 Å²	69.8	72%	0.719	42%	0.424	S	S	*	.			trans	-65.1	151.6	164.8	0	0	0	0	0	110.1	G178 G251	G178-A249 WeakPolarHBondContact CA-O 3.46Å; A249-G251 PolarHBondContact O-N 2.72Å
250	K	95.7	Very high	94.2	Very high	158 Å²	158	68.1 Å²	68.1	69%	0.687	41%	0.411	S	S	*	.			trans	-58.1	129	173.9	-172.3	174.5	-175.9	172.3	0	110	R175	R175-K250 HydrophobicContact CB-CG 4.03Å; R175-K250 WeakPolarHBondContact O-CA 3.26Å
251	G	97.1	Very high	94.2	Very high	9 Å²	9	64.7 Å²	64.7	9%	0.093	39%	0.393	C	S	.	.			trans	-70.5	175.1	179.4	0	0	0	0	0	113.8	R175 L179 A249	R175-G251 WeakPolarHBondContact CD-O 3.37Å; R175-G251 WeakPolarHBondContact CG-O 3.41Å; R175-G251 PolarHBondContact O-N 3.11Å; L179-G251 CarbonylContact O-C 3.59Å; L179-G251 WeakPolarHBondContact O-CA 3.29Å; A249-G251 PolarHBondContact O-N 2.72Å
252	N	97.7	Very high	94.3	Very high	69 Å²	69	63.8 Å²	63.8	37%	0.369	38%	0.384	S	S	.	.			trans	-121.4	18.7	-179.9	70.3	6	0	0	0	113.7	L179 T180 K181	L179-N252 PolarHBondContact O-N 3.16Å; T180-N252 WeakPolarHBondContact CA-OD1 3.41Å; T180-N252 WeakPolarHBondContact CB-OD1 3.36Å; K181-N252 PolarHBondContact N-OD1 2.71Å
253	F	97.6	Very high	94.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	36%	0.355	C	S	.	.			trans	-49.2	141.5	175.6	-173	-85.4	0	0	0	112.4	F170 Q171 V174 R175 L179 I185 F207 F212 A255	F170-F253 HydrophobicContact CD1-CE1 4.14Å; F170-F253 HydrophobicContact CE1-CD1 4.5Å; F170-F253 AromaticContact CE1-CE1 3.61Å; F170-F253 HydrophobicContact CE1-CE1 3.61Å; F170-F253 AromaticContact CE1-CZ 3.85Å; F170-F253 HydrophobicContact CE1-CZ 3.85Å; Q171-F253 WeakPolarHBondContact CG-O 3.46Å; V174-F253 HydrophobicContact CG2-CB 3.92Å; V174-F253 HydrophobicContact CG2-CD1 3.46Å; V174-F253 VanDerWaalsContact CG2-CD1 3.46Å; V174-F253 HydrophobicContact CG2-CD2 4.31Å; V174-F253 HydrophobicContact CG2-CE1 4.04Å; V174-F253 HydrophobicContact CG2-CG 3.63Å; R175-F253 HydrophobicContact CG-CB 4.12Å; R175-F253 PolarHBondContact NE-O 3.3Å; R175-F253 PolarHBondContact NH2-O 3.36Å; L179-F253 WeakPolarHBondContact O-CB 3.47Å; L179-F253 PolarHBondContact O-N 2.78Å; I185-F253 HydrophobicContact CD1-CE2 4.27Å; F207-F253 AromaticContact CD1-CE2 3.73Å; F207-F253 HydrophobicContact CD1-CE2 3.73Å; F207-F253 AromaticContact CD1-CZ 3.72Å; F207-F253 HydrophobicContact CD1-CZ 3.72Å; F207-F253 HydrophobicContact CE1-CD2 4.41Å; F207-F253 AromaticContact CE1-CE2 3.62Å; F207-F253 HydrophobicContact CE1-CE2 3.62Å; F207-F253 AromaticContact CE1-CZ 3.82Å; F207-F253 HydrophobicContact CE1-CZ 3.82Å; F212-F253 HydrophobicContact CB-CE2 3.75Å; F212-F253 HydrophobicContact CB-CZ 3.6Å; F212-F253 HydrophobicContact CD1-CE2 4.01Å; F212-F253 HydrophobicContact CD2-CD2 4.09Å; F212-F253 AromaticContact CD2-CE2 3.37Å; F212-F253 HydrophobicContact CD2-CE2 3.37Å; F212-F253 AromaticContact CD2-CZ 3.96Å; F212-F253 HydrophobicContact CD2-CZ 3.96Å; F212-F253 HydrophobicContact CE1-CE2 4.45Å; F212-F253 HydrophobicContact CE2-CD2 4.24Å; F212-F253 AromaticContact CE2-CE2 3.9Å; F212-F253 HydrophobicContact CE2-CE2 3.9Å; F212-F253 HydrophobicContact CG-CD2 4.49Å; F212-F253 AromaticContact CG-CE2 3.42Å; F212-F253 HydrophobicContact CG-CE2 3.42Å; F212-F253 VanDerWaalsContact CG-CE2 3.42Å; F212-F253 AromaticContact CG-CZ 3.84Å; F212-F253 HydrophobicContact CG-CZ 3.84Å; F212-F253 HydrophobicContact CZ-CE2 4.4Å; F253-A255 HydrophobicContact CD1-CB 4.45Å; F253-A255 HydrophobicContact CE1-CB 3.96Å
254	I	97.2	Very high	94.4	Very high	108 Å²	108	60.9 Å²	60.9	55%	0.554	36%	0.355	S	S	*	.			trans	-122.3	118.2	176.6	-60.9	172.9	0	0	0	107.9
255	A	97.9	Very high	94.6	Very high	14 Å²	14	54.6 Å²	54.6	12%	0.116	32%	0.322	C	S	.	.			trans	-89.4	136	178.6	0	0	0	0	0	110.6	P167 F170 Q171 Y210 F253	P167-A255 HydrophobicContact CB-CB 4.12Å; P167-A255 WeakPolarHBondContact O-CB 3.2Å; F170-A255 HydrophobicContact CD1-CB 3.93Å; Q171-A255 HydrophobicContact CB-CB 3.89Å; Y210-A255 HydrophobicContact CD1-CB 4.34Å; Y210-A255 HydrophobicContact CG-CB 4.49Å; F253-A255 HydrophobicContact CD1-CB 4.45Å; F253-A255 HydrophobicContact CE1-CB 3.96Å
256	S	96.5	Very high	95	Very high	77 Å²	77	58.2 Å²	58.2	54%	0.538	34%	0.338	S	S	.	.			trans	-137.5	127.1	174.7	-171.5	0	0	0	0	109.9	Y210 G211 N258	Y210-S256 CarbonylContact C-O 3.43Å; Y210-S256 VanDerWaalsContact CA-O 3.22Å; Y210-S256 WeakPolarHBondContact CA-O 3.38Å; Y210-S256 PolarHBondContact O-N 3.32Å; Y210-S256 VanDerWaalsContact O-O 3.06Å; G211-S256 WeakPolarHBondContact CA-O 3.32Å; G211-S256 PolarHBondContact N-O 3.01Å; S256-N258 PolarHBondContact O-N 3.11Å
257	W	95.8	Very high	95.4	Very high	110 Å²	110	57 Å²	57	42%	0.417	32%	0.323	S	S	.	.			trans	-69.5	127.5	-177	-171.5	-93.1	0	0	0	111.5	L164 P167 V209 Y210 L262	L164-W257 HydrophobicContact CB-CH2 4.41Å; L164-W257 HydrophobicContact CB-CZ3 4.35Å; L164-W257 HydrophobicContact CD1-CH2 4.35Å; L164-W257 HydrophobicContact CD1-CZ3 4.4Å; P167-W257 HydrophobicContact CG-CB 4.08Å; P167-W257 HydrophobicContact CG-CE3 4.16Å; V209-W257 HydrophobicContact CG1-CD2 4.28Å; V209-W257 HydrophobicContact CG1-CE3 3.97Å; V209-W257 HydrophobicContact CG1-CH2 3.92Å; V209-W257 HydrophobicContact CG1-CZ2 4.21Å; V209-W257 HydrophobicContact CG1-CZ3 3.78Å; V209-W257 CarbonylContact O-C 3.54Å; Y210-W257 HydrophobicContact CD1-CE3 4.21Å; Y210-W257 AromaticContact CE1-CE3 3.85Å; Y210-W257 HydrophobicContact CE1-CE3 3.85Å; Y210-W257 AromaticContact CE1-CZ3 3.92Å; Y210-W257 HydrophobicContact CE1-CZ3 3.92Å; W257-L262 HydrophobicContact CH2-CD1 3.95Å; W257-L262 HydrophobicContact CZ2-CD1 3.89Å
258	N	94.8	Very high	95.7	Very high	50 Å²	50	50.5 Å²	50.5	27%	0.267	28%	0.281	S	S	.	.			trans	-123.7	100.4	177.1	-173.9	-7	0	0	0	110.1	V209 S256 Y260 W261	V209-N258 PolarHBondContact O-N 2.9Å; S256-N258 PolarHBondContact O-N 3.11Å; N258-Y260 PolarHBondContact O-N 2.9Å; N258-Y260 VanDerWaalsContact O-N 3.15Å; N258-Y260 WeakPolarHBondContact OD1-CB 3.37Å; N258-Y260 PolarHBondContact OD1-N 3.3Å; N258-Y260 VanDerWaalsContact OD1-N 3.08Å; N258-W261 PolarHBondContact ND2-NE1 2.8Å
259	S	92.1	Very high	95.9	Very high	64 Å²	64	50.4 Å²	50.4	45%	0.448	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-1.9	-179.4	57.4	0	0	0	0	114.3	W261 L262 K357	S259-W261 VanDerWaalsContact C-N 3.33Å; S259-L262 VanDerWaalsContact O-O 3.06Å; S259-K357 WeakPolarHBondContact O-CE 3.45Å; S259-K357 PolarHBondContact O-NZ 3.44Å; S259-K357 VanDerWaalsContact O-NZ 3.15Å
260	Y	92.6	Very high	96	Very high	28 Å²	28	49.1 Å²	49.1	11%	0.11	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-37.5	174.4	176.1	-94.3	0	0	0	112.3	F92 Q95 P96 N258 K357	F92-Y260 HydrophobicContact CB-CE2 4.22Å; Q95-Y260 WeakPolarHBondContact CA-OH 3.48Å; Q95-Y260 WeakPolarHBondContact CG-OH 3.46Å; Q95-Y260 PolarHBondContact NE2-OH 3.09Å; P96-Y260 VanDerWaalsContact CD-CZ 3.42Å; P96-Y260 HydrophobicContact CG-CD1 4.2Å; P96-Y260 HydrophobicContact CG-CE1 3.84Å; N258-Y260 PolarHBondContact O-N 2.9Å; N258-Y260 VanDerWaalsContact O-N 3.15Å; N258-Y260 WeakPolarHBondContact OD1-CB 3.37Å; N258-Y260 PolarHBondContact OD1-N 3.3Å; N258-Y260 VanDerWaalsContact OD1-N 3.08Å; Y260-K357 WeakPolarHBondContact O-CE 3.29Å; Y260-K357 VanDerWaalsContact O-CG 3.32Å; Y260-K357 WeakPolarHBondContact O-CG 3.3Å
261	W	95.8	Very high	96	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.011	23%	0.231	C	C	.	.	S	Bend	trans	-84.4	-12.4	-172.9	-59.5	99.9	0	0	0	113.8	P96 L98 W204 W205 K208 V209 N258 S259 Y346 V350 L358	P96-W261 HydrophobicContact CG-CH2 3.91Å; P96-W261 HydrophobicContact CG-CZ2 3.55Å; L98-W261 HydrophobicContact CD2-CH2 4.02Å; W204-W261 HydrophobicContact CH2-CZ3 4.09Å; W205-W261 PolarHBondContact NE1-O 3.4Å; K208-W261 VanDerWaalsContact C-CD1 3.45Å; K208-W261 HydrophobicContact CB-CB 4.5Å; K208-W261 HydrophobicContact CB-CD2 3.58Å; K208-W261 HydrophobicContact CB-CE3 4Å; K208-W261 HydrophobicContact CB-CG 3.75Å; K208-W261 HydrophobicContact CB-CZ2 4.24Å; K208-W261 HydrophobicContact CD-CH2 4.21Å; K208-W261 HydrophobicContact CD-CZ2 3.94Å; K208-W261 HydrophobicContact CG-CD2 4.27Å; K208-W261 HydrophobicContact CG-CE3 4.28Å; K208-W261 HydrophobicContact CG-CH2 4.42Å; K208-W261 HydrophobicContact CG-CZ2 4.31Å; K208-W261 HydrophobicContact CG-CZ3 4.4Å; K208-W261 PolarHBondContact O-NE1 3.27Å; V209-W261 HydrophobicContact CG2-CB 3.79Å; N258-W261 PolarHBondContact ND2-NE1 2.8Å; S259-W261 VanDerWaalsContact C-N 3.33Å; W261-Y346 HydrophobicContact CE3-CE1 4.35Å; W261-Y346 PolarHBondContact O-OH 3.26Å; W261-V350 HydrophobicContact CZ3-CG1 4.23Å; W261-V350 HydrophobicContact CZ3-CG2 4.42Å; W261-L358 PolarHBondContact O-N 3.09Å
262	L	96.2	Very high	95.9	Very high	9 Å²	9	42 Å²	42	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133	-169	-179.2	151.3	0	0	0	110.3	L164 W205 V209 W257 S259 D264 K357 E360	L164-L262 HydrophobicContact CD1-CD1 4.33Å; W205-L262 HydrophobicContact CH2-CD1 3.98Å; W205-L262 HydrophobicContact CZ2-CB 4.07Å; W205-L262 HydrophobicContact CZ2-CD1 3.83Å; W205-L262 HydrophobicContact CZ2-CG 4.09Å; V209-L262 HydrophobicContact CG1-CD1 4.41Å; V209-L262 HydrophobicContact CG2-CB 4.3Å; W257-L262 HydrophobicContact CH2-CD1 3.95Å; W257-L262 HydrophobicContact CZ2-CD1 3.89Å; S259-L262 VanDerWaalsContact O-O 3.06Å; L262-D264 HydrophobicContact CD2-CB 4.3Å; L262-K357 VanDerWaalsContact O-CD 3.31Å; L262-K357 WeakPolarHBondContact O-CD 3.33Å; L262-K357 WeakPolarHBondContact O-CE 3.41Å; L262-K357 PolarHBondContact O-NZ 3.19Å; L262-E360 HydrophobicContact CD1-CB 3.93Å; L262-E360 HydrophobicContact CD1-CG 4.22Å; L262-E360 HydrophobicContact CG-CB 4.12Å
263	A	97.1	Very high	95.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.8	161.9	0	0	0	0	0	109.2	D267 I333 K357 L358 Y359 E360	A263-D267 WeakPolarHBondContact CA-OD2 3.5Å; A263-D267 HydrophobicContact CB-CB 3.94Å; A263-I333 HydrophobicContact CB-CD1 4.45Å; A263-I333 HydrophobicContact CB-CG2 4.2Å; A263-K357 HydrophobicContact CB-CB 3.78Å; A263-K357 HydrophobicContact CB-CD 3.99Å; A263-L358 PolarHBondContact N-O 3.33Å; A263-Y359 WeakPolarHBondContact O-CA 3.36Å; A263-Y359 WeakPolarHBondContact O-CD2 3.5Å; A263-E360 PolarHBondContact O-N 2.85Å; A263-E360 VanDerWaalsContact O-N 3.08Å
264	D	95.7	Very high	94.5	Very high	56 Å²	56	46.3 Å²	46.3	30%	0.299	26%	0.264	S	S	.	.			trans	-99.9	-175.6	167.6	64.1	24	0	0	0	110.9	L262 D266 D267 V268	L262-D264 HydrophobicContact CD2-CB 4.3Å; D264-D266 VanDerWaalsContact C-N 3.27Å; D264-D266 PolarHBondContact O-N 3.36Å; D264-D266 WeakPolarHBondContact OD1-CA 3.44Å; D264-D266 WeakPolarHBondContact OD1-CB 3.36Å; D264-D266 PolarHBondContact OD1-N 3.14Å; D264-D267 PolarHBondContact N-OD2 2.75Å; D264-D267 PolarHBondContact O-N 2.9Å; D264-D267 PolarHBondContact OD1-N 3.19Å; D264-V268 WeakPolarHBondContact O-CG2 3.37Å; D264-V268 PolarHBondContact O-N 3.08Å; D264-V268 VanDerWaalsContact O-N 3.15Å
265	L	95.5	Very high	93.6	Very high	11 Å²	11	52.6 Å²	52.6	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-35.9	177.9	-178.7	61	0	0	0	111.8	V268 L269 E365 F366 R369	L265-V268 PolarHBondContact O-N 3.41Å; L265-L269 HydrophobicContact CD1-CD1 4.36Å; L265-L269 HydrophobicContact CD1-CD2 4.32Å; L265-L269 HydrophobicContact CD1-CG 4.02Å; L265-L269 HydrophobicContact CD2-CD1 4.44Å; L265-L269 HydrophobicContact CG-CD1 3.94Å; L265-L269 HydrophobicContact CG-CG 4.06Å; L265-L269 WeakPolarHBondContact O-CB 3.1Å; L265-L269 VanDerWaalsContact O-CG 3.23Å; L265-L269 WeakPolarHBondContact O-CG 3.38Å; L265-L269 PolarHBondContact O-N 2.93Å; L265-E365 HydrophobicContact CD2-CG 4.46Å; L265-F366 HydrophobicContact CD1-CD2 4.16Å; L265-R369 HydrophobicContact CD2-CB 3.86Å; L265-R369 VanDerWaalsContact CD2-CZ 3.48Å
266	D	95.8	Very high	93.2	Very high	105 Å²	105	53.4 Å²	53.4	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-69.5	-38.2	-178.1	-69.4	-19.8	0	0	0	111.1	D264 V268 S270	D264-D266 VanDerWaalsContact C-N 3.27Å; D264-D266 PolarHBondContact O-N 3.36Å; D264-D266 WeakPolarHBondContact OD1-CA 3.44Å; D264-D266 WeakPolarHBondContact OD1-CB 3.36Å; D264-D266 PolarHBondContact OD1-N 3.14Å; D266-V268 VanDerWaalsContact C-N 3.35Å; D266-S270 WeakPolarHBondContact O-CB 3.4Å; D266-S270 PolarHBondContact O-N 3.04Å; D266-S270 PolarHBondContact O-OG 3.19Å
267	D	96.3	Very high	93.1	Very high	35 Å²	35	50.5 Å²	50.5	19%	0.187	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-46.5	169.5	-81.4	-37	0	0	0	111	A263 D264 S270 A271 K357	A263-D267 WeakPolarHBondContact CA-OD2 3.5Å; A263-D267 HydrophobicContact CB-CB 3.94Å; D264-D267 PolarHBondContact N-OD2 2.75Å; D264-D267 PolarHBondContact O-N 2.9Å; D264-D267 PolarHBondContact OD1-N 3.19Å; D267-S270 PolarHBondContact O-N 2.69Å; D267-A271 PolarHBondContact O-N 3.35Å; D267-A271 VanDerWaalsContact O-N 3.16Å; D267-K357 IonicContact OD1-NZ 3.77Å; D267-K357 IonicContact OD2-NZ 2.88Å; D267-K357 PolarHBondContact OD2-NZ 2.95Å
268	V	97.1	Very high	93.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-52	178.2	172	0	0	0	0	111.1	D264 L265 D266 S270 A271 L272 F279 I293 I333 Y359 F366	D264-V268 WeakPolarHBondContact O-CG2 3.37Å; D264-V268 PolarHBondContact O-N 3.08Å; D264-V268 VanDerWaalsContact O-N 3.15Å; L265-V268 PolarHBondContact O-N 3.41Å; D266-V268 VanDerWaalsContact C-N 3.35Å; V268-S270 PolarHBondContact O-N 2.9Å; V268-A271 WeakPolarHBondContact O-CA 3.19Å; V268-A271 WeakPolarHBondContact O-CB 3.34Å; V268-A271 PolarHBondContact O-N 3.1Å; V268-L272 HydrophobicContact CG1-CD2 4.44Å; V268-L272 WeakPolarHBondContact O-CG 3.33Å; V268-L272 PolarHBondContact O-N 2.91Å; V268-L272 VanDerWaalsContact O-N 3.12Å; V268-F279 HydrophobicContact CG1-CE1 3.98Å; V268-F279 HydrophobicContact CG1-CZ 4.32Å; V268-F279 HydrophobicContact CG2-CE1 4.48Å; V268-I293 HydrophobicContact CG1-CD1 4.04Å; V268-I333 HydrophobicContact CG2-CD1 4.39Å; V268-I333 HydrophobicContact CG2-CG2 4.29Å; V268-Y359 HydrophobicContact CG2-CD1 3.85Å; V268-Y359 HydrophobicContact CG2-CD2 3.67Å; V268-Y359 HydrophobicContact CG2-CE1 4.07Å; V268-Y359 HydrophobicContact CG2-CE2 3.95Å; V268-Y359 HydrophobicContact CG2-CG 3.65Å; V268-F366 HydrophobicContact CG1-CD2 3.73Å; V268-F366 HydrophobicContact CG1-CE2 3.71Å
269	L	96.4	Very high	93.2	Very high	66 Å²	66	44.2 Å²	44.2	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-58.4	-38.8	179.1	-69.1	178.7	0	0	0	111.5	L265 A271 L272 P371	L265-L269 HydrophobicContact CD1-CD1 4.36Å; L265-L269 HydrophobicContact CD1-CD2 4.32Å; L265-L269 HydrophobicContact CD1-CG 4.02Å; L265-L269 HydrophobicContact CD2-CD1 4.44Å; L265-L269 HydrophobicContact CG-CD1 3.94Å; L265-L269 HydrophobicContact CG-CG 4.06Å; L265-L269 WeakPolarHBondContact O-CB 3.1Å; L265-L269 VanDerWaalsContact O-CG 3.23Å; L265-L269 WeakPolarHBondContact O-CG 3.38Å; L265-L269 PolarHBondContact O-N 2.93Å; L269-A271 PolarHBondContact O-N 2.77Å; L269-L272 HydrophobicContact CD2-CD1 3.75Å; L269-L272 PolarHBondContact O-N 3.39Å; L269-P371 VanDerWaalsContact CD2-CD 3.42Å; L269-P371 HydrophobicContact CD2-CG 4.07Å
270	S	95.3	Very high	93.5	Very high	60 Å²	60	41.2 Å²	41.2	42%	0.42	22%	0.222	S	C	.	.	H	α-helix	trans	-67.8	-22.6	176.2	-63.9	0	0	0	0	113.3	D266 D267 V268 K274	D266-S270 WeakPolarHBondContact O-CB 3.4Å; D266-S270 PolarHBondContact O-N 3.04Å; D266-S270 PolarHBondContact O-OG 3.19Å; D267-S270 PolarHBondContact O-N 2.69Å; V268-S270 PolarHBondContact O-N 2.9Å; S270-K274 VanDerWaalsContact O-CD 3.25Å; S270-K274 WeakPolarHBondContact O-CD 3.49Å; S270-K274 WeakPolarHBondContact O-CE 3.2Å; S270-K274 PolarHBondContact O-NZ 3.15Å
271	A	95.4	Very high	93.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-90.3	-20.4	177.4	0	0	0	0	0	113.5	L90 D267 V268 L269 K274 T277 F279 I333	L90-A271 HydrophobicContact CD1-CB 3.69Å; D267-A271 PolarHBondContact O-N 3.35Å; D267-A271 VanDerWaalsContact O-N 3.16Å; V268-A271 WeakPolarHBondContact O-CA 3.19Å; V268-A271 WeakPolarHBondContact O-CB 3.34Å; V268-A271 PolarHBondContact O-N 3.1Å; L269-A271 PolarHBondContact O-N 2.77Å; A271-K274 PolarHBondContact O-N 2.7Å; A271-T277 HydrophobicContact CB-CG2 3.96Å; A271-F279 HydrophobicContact CB-CE1 4.45Å; A271-F279 HydrophobicContact CB-CE2 4.25Å; A271-F279 HydrophobicContact CB-CZ 3.63Å; A271-I333 HydrophobicContact CB-CD1 4.07Å
272	L	94.8	Very high	93.9	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.089	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	140.5	-177.9	-66	-179.8	0	0	0	112.5	V268 L269 K274 F279 I293 F366 P371 Y374	V268-L272 HydrophobicContact CG1-CD2 4.44Å; V268-L272 WeakPolarHBondContact O-CG 3.33Å; V268-L272 PolarHBondContact O-N 2.91Å; V268-L272 VanDerWaalsContact O-N 3.12Å; L269-L272 HydrophobicContact CD2-CD1 3.75Å; L269-L272 PolarHBondContact O-N 3.39Å; L272-K274 PolarHBondContact O-N 3.01Å; L272-F279 HydrophobicContact CD2-CE2 4.25Å; L272-F279 HydrophobicContact CD2-CZ 4.07Å; L272-I293 HydrophobicContact CD2-CG2 3.64Å; L272-F366 HydrophobicContact CD1-CE2 3.96Å; L272-F366 HydrophobicContact CD1-CZ 4.06Å; L272-F366 HydrophobicContact CD2-CE2 4.16Å; L272-F366 HydrophobicContact CD2-CZ 4.1Å; L272-P371 HydrophobicContact CD1-CG 3.79Å; L272-Y374 HydrophobicContact CB-CD1 3.92Å; L272-Y374 HydrophobicContact CB-CD2 4.4Å; L272-Y374 HydrophobicContact CB-CE1 3.9Å; L272-Y374 HydrophobicContact CB-CE2 4.37Å; L272-Y374 HydrophobicContact CB-CG 4.16Å; L272-Y374 HydrophobicContact CD1-CD1 4.3Å; L272-Y374 HydrophobicContact CD1-CD2 3.81Å; L272-Y374 HydrophobicContact CD1-CE2 4.4Å; L272-Y374 HydrophobicContact CD1-CG 3.73Å; L272-Y374 HydrophobicContact CD2-CD1 4.19Å; L272-Y374 HydrophobicContact CD2-CG 4.24Å; L272-Y374 HydrophobicContact CG-CD1 4.36Å; L272-Y374 HydrophobicContact CG-CG 4.26Å
273	G	82.4	Confident	93.9	Very high	64 Å²	64	39.8 Å²	39.8	66%	0.66	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	-7.5	177.6	0	0	0	0	0	115.3
274	K	84.4	Confident	93.8	Very high	95 Å²	95	42.7 Å²	42.7	41%	0.413	24%	0.236	S	C	.	.			trans	-88.8	135.1	177.1	-60.4	-179.7	-177.9	170.8	0	109.9	S270 A271 L272 G276	S270-K274 VanDerWaalsContact O-CD 3.25Å; S270-K274 WeakPolarHBondContact O-CD 3.49Å; S270-K274 WeakPolarHBondContact O-CE 3.2Å; S270-K274 PolarHBondContact O-NZ 3.15Å; A271-K274 PolarHBondContact O-N 2.7Å; L272-K274 PolarHBondContact O-N 3.01Å; K274-G276 PolarHBondContact O-N 2.99Å
275	R	78.7	Confident	93.8	Very high	241 Å²	241	43.3 Å²	43.3	91%	0.909	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-9.7	175.1	-70.7	-175.8	174.2	174.3	-1.2	114
276	G	87.9	Confident	93.8	Very high	31 Å²	31	46 Å²	46	32%	0.32	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-15.2	-172.3	0	0	0	0	0	115.6	K274 P331	K274-G276 PolarHBondContact O-N 2.99Å; G276-P331 WeakPolarHBondContact O-CD 3.33Å
277	T	94.3	Very high	93.8	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.098	25%	0.25	C	C	.	.			trans	-122.4	131.9	-179.1	-55	0	0	0	0	110.5	A271 P331 I333	A271-T277 HydrophobicContact CB-CG2 3.96Å; T277-P331 CarbonylContact C-O 3.59Å; T277-P331 WeakPolarHBondContact CA-O 3.32Å; T277-P331 HydrophobicContact CG2-CB 4.37Å; T277-I333 HydrophobicContact CG2-CD1 4.03Å; T277-I333 HydrophobicContact CG2-CG1 3.93Å
278	L	96.3	Very high	93.9	Very high	18 Å²	18	44 Å²	44	9%	0.094	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.8	173.6	-177.5	63.8	0	0	0	110.2	L280 V297 V326 R330 P331 M332 I333	L278-L280 HydrophobicContact CD2-CD2 3.83Å; L278-L280 HydrophobicContact CG-CD2 3.9Å; L278-V297 HydrophobicContact CD1-CG2 3.96Å; L278-V326 HydrophobicContact CD2-CB 4.35Å; L278-V326 HydrophobicContact CD2-CG1 4.07Å; L278-V326 HydrophobicContact CD2-CG2 4.13Å; L278-R330 HydrophobicContact CB-CG 4.23Å; L278-P331 PolarHBondContact N-O 3.39Å; L278-M332 HydrophobicContact CB-CG 4.27Å; L278-M332 HydrophobicContact CD2-CE 4.33Å; L278-M332 CarbonylContact O-C 2.81Å; L278-M332 WeakPolarHBondContact O-CA 3.14Å; L278-I333 PolarHBondContact O-N 2.71Å
279	F	97.6	Very high	93.8	Very high	10 Å²	10	48.6 Å²	48.6	4%	0.044	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.9	172.3	-67.4	-82.9	0	0	0	110.3	V268 A271 L272 I293 S296 V297 I333 Y335	V268-F279 HydrophobicContact CG1-CE1 3.98Å; V268-F279 HydrophobicContact CG1-CZ 4.32Å; V268-F279 HydrophobicContact CG2-CE1 4.48Å; A271-F279 HydrophobicContact CB-CE1 4.45Å; A271-F279 HydrophobicContact CB-CE2 4.25Å; A271-F279 HydrophobicContact CB-CZ 3.63Å; L272-F279 HydrophobicContact CD2-CE2 4.25Å; L272-F279 HydrophobicContact CD2-CZ 4.07Å; F279-I293 HydrophobicContact CD1-CD1 4.12Å; F279-I293 HydrophobicContact CD1-CG2 4.41Å; F279-I293 HydrophobicContact CD2-CG2 4.2Å; F279-I293 HydrophobicContact CE1-CD1 4.3Å; F279-I293 HydrophobicContact CE2-CG2 4.33Å; F279-I293 HydrophobicContact CG-CG2 4.23Å; F279-I293 HydrophobicContact CZ-CG2 4.47Å; F279-S296 VanDerWaalsContact CB-OG 3.27Å; F279-S296 WeakPolarHBondContact CB-OG 3.33Å; F279-S296 CarbonylContact O-C 3.47Å; F279-S296 WeakPolarHBondContact O-CA 3.42Å; F279-V297 PolarHBondContact O-N 3.01Å; F279-I333 WeakPolarHBondContact CA-O 3.48Å; F279-I333 HydrophobicContact CD1-CB 3.89Å; F279-I333 HydrophobicContact CD1-CG2 4.21Å; F279-I333 HydrophobicContact CE1-CB 4Å; F279-I333 HydrophobicContact CE1-CD1 3.91Å; F279-I333 HydrophobicContact CE1-CG1 4.47Å; F279-I333 HydrophobicContact CE1-CG2 4.26Å; F279-I333 HydrophobicContact CZ-CD1 4.46Å; F279-Y335 HydrophobicContact CB-CE1 4.19Å
280	L	98.2	Very high	93.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.3	177.5	-58.2	-177.5	0	0	0	109.5	L278 V297 V326 M332 I333 V334 Y335 L345 V349	L278-L280 HydrophobicContact CD2-CD2 3.83Å; L278-L280 HydrophobicContact CG-CD2 3.9Å; L280-V297 WeakPolarHBondContact CA-O 3.38Å; L280-V297 HydrophobicContact CD2-CB 3.99Å; L280-V326 HydrophobicContact CD1-CG1 4.02Å; L280-V326 HydrophobicContact CD2-CG1 4.11Å; L280-V326 HydrophobicContact CD2-CG2 3.68Å; L280-M332 HydrophobicContact CD1-SD 3.81Å; L280-I333 PolarHBondContact N-O 3.03Å; L280-V334 HydrophobicContact CB-CG2 3.93Å; L280-V334 HydrophobicContact CD1-CG2 3.96Å; L280-V334 HydrophobicContact CG-CG2 4.41Å; L280-V334 CarbonylContact O-C 3.54Å; L280-V334 WeakPolarHBondContact O-CA 3.29Å; L280-Y335 VanDerWaalsContact O-CD1 3.31Å; L280-Y335 WeakPolarHBondContact O-CD1 3.49Å; L280-Y335 PolarHBondContact O-N 3.46Å; L280-L345 HydrophobicContact CB-CD2 4.04Å; L280-V349 HydrophobicContact CD1-CG2 3.82Å
281	D	98.2	Very high	93.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.7	-175.7	-166.6	-35	0	0	0	110.8	R283 F288 V297 N298 M299 Y335	D281-R283 VanDerWaalsContact C-N 3.34Å; D281-R283 VanDerWaalsContact OD1-CB 3.32Å; D281-R283 WeakPolarHBondContact OD1-CB 3.4Å; D281-R283 WeakPolarHBondContact OD1-CG 3.15Å; D281-R283 IonicContact OD1-CZ 3.07Å; D281-R283 PolarHBondContact OD1-N 2.92Å; D281-R283 VanDerWaalsContact OD1-N 3.07Å; D281-R283 IonicContact OD1-NE 2.7Å; D281-R283 PolarHBondContact OD1-NE 3.4Å; D281-R283 IonicContact OD1-NH2 3.34Å; D281-R283 IonicContact OD2-CZ 3.21Å; D281-R283 IonicContact OD2-NE 2.68Å; D281-R283 PolarHBondContact OD2-NE 3.46Å; D281-R283 IonicContact OD2-NH2 2.61Å; D281-R283 PolarHBondContact OD2-NH2 3.01Å; D281-F288 HydrophobicContact CB-CD2 3.69Å; D281-F288 HydrophobicContact CB-CE2 3.94Å; D281-F288 WeakPolarHBondContact OD2-CD2 3.46Å; D281-V297 PolarHBondContact N-O 3.5Å; D281-N298 CarbonylContact O-C 3.56Å; D281-N298 WeakPolarHBondContact O-CA 3.44Å; D281-N298 PolarHBondContact O-ND2 2.98Å; D281-M299 PolarHBondContact O-N 2.87Å; D281-Y335 WeakPolarHBondContact CA-O 3.33Å; D281-Y335 HydrophobicContact CB-CE1 3.92Å; D281-Y335 HydrophobicContact CB-CE2 4.11Å; D281-Y335 VanDerWaalsContact CG-CE2 3.46Å; D281-Y335 VanDerWaalsContact CG-CZ 3.46Å; D281-Y335 WeakPolarHBondContact OD2-CE2 3.36Å; D281-Y335 PolarHBondContact OD2-OH 2.84Å
282	A	97.6	Very high	93.9	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.033	27%	0.272	C	S	.	.			trans	-82.2	-7.9	-174.4	0	0	0	0	0	114.7	M299 P300 T301 Y335 A342 L345	A282-M299 WeakPolarHBondContact CA-O 3.44Å; A282-P300 WeakPolarHBondContact O-CA 3.08Å; A282-T301 PolarHBondContact O-N 3.21Å; A282-T301 VanDerWaalsContact O-N 3.15Å; A282-Y335 PolarHBondContact N-O 3.04Å; A282-A342 HydrophobicContact CB-CB 4.01Å; A282-L345 HydrophobicContact CB-CB 3.92Å; A282-L345 HydrophobicContact CB-CD2 3.85Å
283	R	96.4	Very high	94	Very high	7 Å²	7	49.8 Å²	49.8	3%	0.026	27%	0.267	C	S	.	.	S	Bend	trans	-70.3	160.6	-174.1	-65.3	176.9	-64.5	150.6	1.5	112.4	D281 E287 G291 N298 S337	D281-R283 VanDerWaalsContact C-N 3.34Å; D281-R283 VanDerWaalsContact OD1-CB 3.32Å; D281-R283 WeakPolarHBondContact OD1-CB 3.4Å; D281-R283 WeakPolarHBondContact OD1-CG 3.15Å; D281-R283 IonicContact OD1-CZ 3.07Å; D281-R283 PolarHBondContact OD1-N 2.92Å; D281-R283 VanDerWaalsContact OD1-N 3.07Å; D281-R283 IonicContact OD1-NE 2.7Å; D281-R283 PolarHBondContact OD1-NE 3.4Å; D281-R283 IonicContact OD1-NH2 3.34Å; D281-R283 IonicContact OD2-CZ 3.21Å; D281-R283 IonicContact OD2-NE 2.68Å; D281-R283 PolarHBondContact OD2-NE 3.46Å; D281-R283 IonicContact OD2-NH2 2.61Å; D281-R283 PolarHBondContact OD2-NH2 3.01Å; R283-E287 HydrophobicContact CB-CB 4.02Å; R283-E287 WeakPolarHBondContact CD-OE2 3.45Å; R283-E287 PolarHBondContact NH1-O 2.61Å; R283-G291 PolarHBondContact NH1-O 2.78Å; R283-G291 PolarHBondContact NH2-O 2.78Å; R283-N298 PolarHBondContact O-ND2 3.43Å; R283-S337 VanDerWaalsContact CD-N 3.35Å; R283-S337 WeakPolarHBondContact CD-OG 3.4Å
284	P	95.4	Very high	94.7	Very high	60 Å²	60	49.9 Å²	49.9	39%	0.39	26%	0.255	S	S	.	.			trans	-51.5	151.5	168.7	-25.9	35.1	0	0	0	112.6	S286 E287 F288	P284-S286 PolarHBondContact O-N 2.95Å; P284-E287 PolarHBondContact O-N 2.74Å; P284-E287 VanDerWaalsContact O-N 3.09Å; P284-F288 PolarHBondContact O-N 3.33Å; P284-F288 VanDerWaalsContact O-N 3.1Å
285	V	96	Very high	95.1	Very high	69 Å²	69	48.3 Å²	48.3	42%	0.418	27%	0.266	S	S	.	.	H	α-helix	trans	-55	-38.9	-177.5	178.8	0	0	0	0	112.1	F288 Q289 P300	V285-F288 PolarHBondContact O-N 3.04Å; V285-Q289 HydrophobicContact CG1-CG 4.43Å; V285-Q289 VanDerWaalsContact O-CG 3.32Å; V285-Q289 WeakPolarHBondContact O-CG 3.42Å; V285-Q289 PolarHBondContact O-N 3.3Å; V285-P300 HydrophobicContact CG2-CG 3.93Å
286	S	95.7	Very high	96	Very high	67 Å²	67	37.5 Å²	37.5	47%	0.469	23%	0.227	S	C	.	.	H	α-helix	trans	-60.8	-43.8	178.6	48.3	0	0	0	0	112.7	P284 Q289 N290	P284-S286 PolarHBondContact O-N 2.95Å; S286-Q289 PolarHBondContact O-N 2.97Å; S286-N290 VanDerWaalsContact O-CG 3.27Å; S286-N290 PolarHBondContact O-N 2.9Å; S286-N290 VanDerWaalsContact O-N 3.13Å; S286-N290 PolarHBondContact O-ND2 3.03Å
287	E	96.4	Very high	96.4	Very high	71 Å²	71	37.7 Å²	37.7	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-70.5	-38.4	177.9	-69.7	-178.3	-149.5	0	0	112.2	R283 P284 Q289 N290 G291 S337	R283-E287 HydrophobicContact CB-CB 4.02Å; R283-E287 WeakPolarHBondContact CD-OE2 3.45Å; R283-E287 PolarHBondContact NH1-O 2.61Å; P284-E287 PolarHBondContact O-N 2.74Å; P284-E287 VanDerWaalsContact O-N 3.09Å; E287-Q289 VanDerWaalsContact C-N 3.28Å; E287-Q289 PolarHBondContact O-N 3.46Å; E287-N290 PolarHBondContact O-N 3.15Å; E287-G291 PolarHBondContact O-N 3.07Å; E287-S337 PolarHBondContact OE2-OG 3.47Å
288	F	97.1	Very high	96.6	Very high	28 Å²	28	37.4 Å²	37.4	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-35.1	174.3	176.7	-96.2	0	0	0	112.8	D281 P284 V285 R292 S296 N298	D281-F288 HydrophobicContact CB-CD2 3.69Å; D281-F288 HydrophobicContact CB-CE2 3.94Å; D281-F288 WeakPolarHBondContact OD2-CD2 3.46Å; P284-F288 PolarHBondContact O-N 3.33Å; P284-F288 VanDerWaalsContact O-N 3.1Å; V285-F288 PolarHBondContact O-N 3.04Å; F288-R292 HydrophobicContact CD2-CB 3.91Å; F288-R292 HydrophobicContact CD2-CG 4.42Å; F288-R292 VanDerWaalsContact CE1-CD 3.45Å; F288-R292 HydrophobicContact CE2-CB 4.02Å; F288-R292 HydrophobicContact CE2-CG 4.21Å; F288-R292 HydrophobicContact CZ-CG 4.45Å; F288-R292 PolarHBondContact O-NH1 3.34Å; F288-S296 WeakPolarHBondContact CZ-O 3.42Å; F288-N298 HydrophobicContact CB-CB 4.29Å; F288-N298 HydrophobicContact CD1-CB 3.74Å; F288-N298 HydrophobicContact CD2-CB 3.57Å; F288-N298 HydrophobicContact CE1-CB 3.82Å; F288-N298 HydrophobicContact CE2-CB 3.62Å; F288-N298 HydrophobicContact CG-CB 3.6Å; F288-N298 HydrophobicContact CZ-CB 3.74Å
289	Q	95.8	Very high	96.6	Very high	96 Å²	96	36.6 Å²	36.6	45%	0.449	22%	0.216	S	C	.	.	H	α-helix	trans	-70.1	-42.6	174.8	-75.2	173.1	-27.9	0	0	111.6	V285 S286 E287 G291 G378	V285-Q289 HydrophobicContact CG1-CG 4.43Å; V285-Q289 VanDerWaalsContact O-CG 3.32Å; V285-Q289 WeakPolarHBondContact O-CG 3.42Å; V285-Q289 PolarHBondContact O-N 3.3Å; S286-Q289 PolarHBondContact O-N 2.97Å; E287-Q289 VanDerWaalsContact C-N 3.28Å; E287-Q289 PolarHBondContact O-N 3.46Å; Q289-G291 PolarHBondContact O-N 3.08Å; Q289-G378 PolarHBondContact O-N 3.44Å
290	N	95.3	Very high	96.5	Very high	122 Å²	122	36.3 Å²	36.3	65%	0.652	22%	0.215	S	C	*	.	H	α-helix	trans	-69.5	-14.9	-178.9	-71.5	-22.4	0	0	0	114.7	S286 E287 Q377	S286-N290 VanDerWaalsContact O-CG 3.27Å; S286-N290 PolarHBondContact O-N 2.9Å; S286-N290 VanDerWaalsContact O-N 3.13Å; S286-N290 PolarHBondContact O-ND2 3.03Å; E287-N290 PolarHBondContact O-N 3.15Å; N290-Q377 PolarHBondContact O-NE2 3.27Å
291	G	96.2	Very high	96.3	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	22%	0.216	C	C	.	.			trans	169.2	136.3	173.8	0	0	0	0	0	111.1	R283 E287 Q289 W363 A376	R283-G291 PolarHBondContact NH1-O 2.78Å; R283-G291 PolarHBondContact NH2-O 2.78Å; E287-G291 PolarHBondContact O-N 3.07Å; Q289-G291 PolarHBondContact O-N 3.08Å; G291-W363 VanDerWaalsContact CA-CZ2 3.49Å; G291-A376 CarbonylContact C-O 3.55Å; G291-A376 VanDerWaalsContact CA-O 3.27Å; G291-A376 WeakPolarHBondContact CA-O 3.47Å
292	R	97.2	Very high	96	Very high	46 Å²	46	40.2 Å²	40.2	17%	0.174	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	165.6	178.1	61.4	-177.7	173.1	-79.8	-3.4	112	F288 W363 A376	F288-R292 HydrophobicContact CD2-CB 3.91Å; F288-R292 HydrophobicContact CD2-CG 4.42Å; F288-R292 VanDerWaalsContact CE1-CD 3.45Å; F288-R292 HydrophobicContact CE2-CB 4.02Å; F288-R292 HydrophobicContact CE2-CG 4.21Å; F288-R292 HydrophobicContact CZ-CG 4.45Å; F288-R292 PolarHBondContact O-NH1 3.34Å; R292-W363 VanDerWaalsContact CA-CH2 3.42Å; R292-W363 VanDerWaalsContact N-CZ2 3.31Å; R292-W363 VanDerWaalsContact O-CH2 3.23Å; R292-W363 WeakPolarHBondContact O-CH2 3.18Å; R292-W363 WeakPolarHBondContact O-CZ3 3.27Å; R292-A376 HydrophobicContact CG-CB 3.95Å; R292-A376 PolarHBondContact N-O 2.81Å; R292-A376 PolarHBondContact O-N 3.22Å
293	I	97.6	Very high	95.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	133.6	168.1	-56.7	177.3	0	0	0	107.6	V268 L272 F279 G295 S296 Y335 W363 F366	V268-I293 HydrophobicContact CG1-CD1 4.04Å; L272-I293 HydrophobicContact CD2-CG2 3.64Å; F279-I293 HydrophobicContact CD1-CD1 4.12Å; F279-I293 HydrophobicContact CD1-CG2 4.41Å; F279-I293 HydrophobicContact CD2-CG2 4.2Å; F279-I293 HydrophobicContact CE1-CD1 4.3Å; F279-I293 HydrophobicContact CE2-CG2 4.33Å; F279-I293 HydrophobicContact CG-CG2 4.23Å; F279-I293 HydrophobicContact CZ-CG2 4.47Å; I293-G295 PolarHBondContact O-N 3.3Å; I293-S296 WeakPolarHBondContact CB-OG 3.33Å; I293-S296 WeakPolarHBondContact O-CB 3.19Å; I293-S296 PolarHBondContact O-N 3.29Å; I293-S296 PolarHBondContact O-OG 2.5Å; I293-Y335 HydrophobicContact CB-CE1 4.29Å; I293-Y335 HydrophobicContact CD1-CD1 4.04Å; I293-Y335 HydrophobicContact CD1-CE1 3.85Å; I293-Y335 HydrophobicContact CD1-CE2 4.38Å; I293-Y335 HydrophobicContact CD1-CG 4.39Å; I293-Y335 HydrophobicContact CG1-CE1 4.14Å; I293-Y335 HydrophobicContact CG1-CE2 4.3Å; I293-Y335 PolarHBondContact N-OH 2.94Å; I293-Y335 VanDerWaalsContact N-OH 3.17Å; I293-W363 HydrophobicContact CG1-CE3 4.16Å; I293-W363 HydrophobicContact CG1-CZ3 3.96Å; I293-F366 HydrophobicContact CB-CE1 4.41Å; I293-F366 HydrophobicContact CD1-CD1 4.37Å; I293-F366 HydrophobicContact CD1-CD2 4.1Å; I293-F366 HydrophobicContact CD1-CE2 4.33Å; I293-F366 HydrophobicContact CD1-CG 4.11Å; I293-F366 HydrophobicContact CG1-CD1 3.71Å; I293-F366 HydrophobicContact CG1-CD2 4.26Å; I293-F366 HydrophobicContact CG1-CE1 3.75Å; I293-F366 HydrophobicContact CG1-CE2 4.3Å; I293-F366 HydrophobicContact CG1-CG 3.96Å; I293-F366 HydrophobicContact CG1-CZ 4.05Å; I293-F366 HydrophobicContact CG2-CE1 4.5Å; I293-F366 HydrophobicContact CG2-CZ 4.22Å
294	V	95.7	Very high	95.8	Very high	66 Å²	66	42.3 Å²	42.3	40%	0.4	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	130	179.1	167	0	0	0	0	110.2	Y374 A376	V294-Y374 VanDerWaalsContact CG2-C 3.41Å; V294-Y374 WeakPolarHBondContact CG2-O 3.27Å; V294-Y374 PolarHBondContact N-O 3.45Å; V294-A376 HydrophobicContact CG2-CB 3.81Å
295	G	93.7	Very high	95.7	Very high	62 Å²	62	40.4 Å²	40.4	64%	0.639	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.2	-0.7	178.6	0	0	0	0	0	115.2	I293	I293-G295 PolarHBondContact O-N 3.3Å
296	S	96.8	Very high	95.4	Very high	13 Å²	13	39.5 Å²	39.5	9%	0.091	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-62	146	175.3	-64.9	0	0	0	0	113.1	F279 F288 I293 Y335	F279-S296 VanDerWaalsContact CB-OG 3.27Å; F279-S296 WeakPolarHBondContact CB-OG 3.33Å; F279-S296 CarbonylContact O-C 3.47Å; F279-S296 WeakPolarHBondContact O-CA 3.42Å; F288-S296 WeakPolarHBondContact CZ-O 3.42Å; I293-S296 WeakPolarHBondContact CB-OG 3.33Å; I293-S296 WeakPolarHBondContact O-CB 3.19Å; I293-S296 PolarHBondContact O-N 3.29Å; I293-S296 PolarHBondContact O-OG 2.5Å; S296-Y335 WeakPolarHBondContact CB-OH 3.35Å; S296-Y335 VanDerWaalsContact OG-CE1 3.31Å; S296-Y335 WeakPolarHBondContact OG-CE1 3.26Å; S296-Y335 PolarHBondContact OG-OH 3.46Å
297	V	97	Very high	95	Very high	36 Å²	36	44.4 Å²	44.4	22%	0.218	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.3	167.3	176	0	0	0	0	108.3	L278 F279 L280 D281 M299 R324 V326	L278-V297 HydrophobicContact CD1-CG2 3.96Å; F279-V297 PolarHBondContact O-N 3.01Å; L280-V297 WeakPolarHBondContact CA-O 3.38Å; L280-V297 HydrophobicContact CD2-CB 3.99Å; D281-V297 PolarHBondContact N-O 3.5Å; V297-M299 HydrophobicContact CG1-CG 4.35Å; V297-R324 HydrophobicContact CG1-CB 3.85Å; V297-V326 HydrophobicContact CG1-CG2 4.06Å
298	N	97.7	Very high	94.5	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.053	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.6	173.9	-174	-130.7	0	0	0	110.4	D281 R283 F288 P300 R324	D281-N298 CarbonylContact O-C 3.56Å; D281-N298 WeakPolarHBondContact O-CA 3.44Å; D281-N298 PolarHBondContact O-ND2 2.98Å; R283-N298 PolarHBondContact O-ND2 3.43Å; F288-N298 HydrophobicContact CB-CB 4.29Å; F288-N298 HydrophobicContact CD1-CB 3.74Å; F288-N298 HydrophobicContact CD2-CB 3.57Å; F288-N298 HydrophobicContact CE1-CB 3.82Å; F288-N298 HydrophobicContact CE2-CB 3.62Å; F288-N298 HydrophobicContact CG-CB 3.6Å; F288-N298 HydrophobicContact CZ-CB 3.74Å; N298-P300 WeakPolarHBondContact OD1-CD 3.42Å; N298-P300 VanDerWaalsContact OD1-CG 3.27Å; N298-P300 WeakPolarHBondContact OD1-CG 3.4Å; N298-R324 WeakPolarHBondContact O-CD 3.37Å; N298-R324 PolarHBondContact O-NH1 3.42Å
299	M	96.9	Very high	94	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.264	C	S	.	.			trans	-148.3	79.9	173.3	-72.9	-159.4	67.6	0	0	108.5	D281 A282 V297 T301 L304 L320 M321 V326 L345	D281-M299 PolarHBondContact O-N 2.87Å; A282-M299 WeakPolarHBondContact CA-O 3.44Å; V297-M299 HydrophobicContact CG1-CG 4.35Å; M299-T301 PolarHBondContact O-N 3.43Å; M299-L304 HydrophobicContact CE-CD2 4.39Å; M299-L320 HydrophobicContact CE-CD2 4.25Å; M299-L320 HydrophobicContact CE-CG 4.1Å; M299-M321 HydrophobicContact CE-CB 4.48Å; M299-M321 HydrophobicContact CE-CG 3.66Å; M299-M321 HydrophobicContact SD-CG 4.01Å; M299-V326 HydrophobicContact SD-CG2 3.95Å; M299-L345 HydrophobicContact CB-CD1 3.87Å; M299-L345 HydrophobicContact CB-CD2 3.71Å; M299-L345 HydrophobicContact CB-CG 4.47Å; M299-L345 HydrophobicContact CE-CD1 4.26Å; M299-L345 HydrophobicContact SD-CD1 4.15Å
300	P	95.6	Very high	93.7	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.026	25%	0.25	C	S	.	.			trans	-56.3	136.1	-176.1	-24.7	34.5	0	0	0	111.8	A282 V285 N298 S302 E303	A282-P300 WeakPolarHBondContact O-CA 3.08Å; V285-P300 HydrophobicContact CG2-CG 3.93Å; N298-P300 WeakPolarHBondContact OD1-CD 3.42Å; N298-P300 VanDerWaalsContact OD1-CG 3.27Å; N298-P300 WeakPolarHBondContact OD1-CG 3.4Å; P300-S302 PolarHBondContact O-N 3.09Å; P300-S302 VanDerWaalsContact O-N 3.13Å; P300-E303 HydrophobicContact CB-CG 4.5Å; P300-E303 PolarHBondContact O-N 2.86Å
301	T	94	Very high	93.6	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.025	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.4	-34.6	179.2	-68.2	0	0	0	0	112.5	L195 T198 A282 M299 E303 L304 D341 A344	L195-T301 HydrophobicContact CD2-CG2 3.58Å; T198-T301 HydrophobicContact CG2-CG2 3.77Å; A282-T301 PolarHBondContact O-N 3.21Å; A282-T301 VanDerWaalsContact O-N 3.15Å; M299-T301 PolarHBondContact O-N 3.43Å; T301-E303 PolarHBondContact O-N 2.97Å; T301-L304 VanDerWaalsContact O-CB 3.29Å; T301-L304 WeakPolarHBondContact O-CB 3.21Å; T301-L304 WeakPolarHBondContact O-CG 3.38Å; T301-L304 PolarHBondContact O-N 2.76Å; T301-D341 PolarHBondContact OG1-O 3.25Å; T301-A344 HydrophobicContact CG2-CB 3.64Å
302	S	93	Very high	93.5	Very high	77 Å²	77	39.6 Å²	39.6	54%	0.538	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-57.8	-30.4	176.9	55.3	0	0	0	0	113.8	P300 L304 L305	P300-S302 PolarHBondContact O-N 3.09Å; P300-S302 VanDerWaalsContact O-N 3.13Å; S302-L304 VanDerWaalsContact C-N 3.26Å; S302-L304 PolarHBondContact O-N 2.88Å; S302-L305 PolarHBondContact O-N 3.23Å
303	E	94.2	Very high	93.3	Very high	54 Å²	54	41.1 Å²	41.1	25%	0.252	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-75.2	-15.9	177.9	-66.2	-174.7	-153.3	0	0	113.3	P300 T301 L305 K312 L320 R324	P300-E303 HydrophobicContact CB-CG 4.5Å; P300-E303 PolarHBondContact O-N 2.86Å; T301-E303 PolarHBondContact O-N 2.97Å; E303-L305 VanDerWaalsContact C-N 3.34Å; E303-K312 PolarHBondContact O-NZ 3.09Å; E303-L320 HydrophobicContact CB-CD2 4.02Å; E303-L320 WeakPolarHBondContact O-CD2 3.44Å; E303-R324 IonicContact OE1-CZ 2.83Å; E303-R324 IonicContact OE1-NH2 3.72Å; E303-R324 PolarHBondContact OE1-NH2 2.99Å; E303-R324 IonicContact OE2-CZ 3.82Å; E303-R324 IonicContact OE2-NE 2.69Å; E303-R324 IonicContact OE2-NH2 3.82Å; E303-R324 PolarHBondContact OE2-NH2 3.39Å
304	L	94.3	Very high	93.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-80.5	-20.5	178.7	-48.6	178.8	0	0	0	112	M299 T301 S302 L311 K312 L317 L320 L345 V348	M299-L304 HydrophobicContact CE-CD2 4.39Å; T301-L304 VanDerWaalsContact O-CB 3.29Å; T301-L304 WeakPolarHBondContact O-CB 3.21Å; T301-L304 WeakPolarHBondContact O-CG 3.38Å; T301-L304 PolarHBondContact O-N 2.76Å; S302-L304 VanDerWaalsContact C-N 3.26Å; S302-L304 PolarHBondContact O-N 2.88Å; L304-L311 HydrophobicContact CB-CD2 3.8Å; L304-K312 WeakPolarHBondContact O-CG 3.35Å; L304-K312 PolarHBondContact O-N 3.3Å; L304-L317 HydrophobicContact CB-CD2 4.03Å; L304-L317 HydrophobicContact CD2-CD2 4.07Å; L304-L320 HydrophobicContact CD2-CD2 3.95Å; L304-L345 HydrophobicContact CD1-CB 3.96Å; L304-L345 HydrophobicContact CD1-CD1 4.09Å; L304-L345 HydrophobicContact CD2-CD1 4.23Å; L304-V348 HydrophobicContact CD1-CG2 4.12Å
305	L	92.6	Very high	93.1	Very high	20 Å²	20	44.6 Å²	44.6	11%	0.105	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-93.5	151.5	-172.1	-50.8	-179.9	0	0	0	111.7	I197 S302 E303 A310 L311 K312	I197-L305 HydrophobicContact CB-CD2 4.49Å; I197-L305 HydrophobicContact CG2-CD2 3.65Å; S302-L305 PolarHBondContact O-N 3.23Å; E303-L305 VanDerWaalsContact C-N 3.34Å; L305-A310 CarbonylContact C-O 3.58Å; L305-A310 WeakPolarHBondContact CA-O 3.42Å; L305-L311 HydrophobicContact CD2-CD2 3.96Å; L305-L311 HydrophobicContact CD2-CG 4.37Å; L305-K312 WeakPolarHBondContact O-CE 3.16Å
306	T	90.8	Very high	93.1	Very high	51 Å²	51	46 Å²	46	31%	0.313	26%	0.259	S	S	.	.			trans	-80.7	165	162.3	62.7	0	0	0	0	109.4	Q308 G309 A310 K312	T306-Q308 PolarHBondContact O-N 3.19Å; T306-Q308 PolarHBondContact OG1-N 2.86Å; T306-G309 PolarHBondContact O-N 2.91Å; T306-A310 PolarHBondContact N-O 3.33Å; T306-A310 PolarHBondContact OG1-N 2.99Å; T306-A310 PolarHBondContact OG1-O 3.17Å; T306-K312 HydrophobicContact CG2-CG 3.91Å
307	D	87.8	Confident	93.1	Very high	170 Å²	170	45.8 Å²	45.8	91%	0.909	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-11.9	175.1	-55.6	-17	0	0	0	113.4
308	Q	84.8	Confident	93	Very high	112 Å²	112	47.9 Å²	47.9	52%	0.523	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	11.2	179.2	-62.2	-61.8	-32	0	0	113.4	R227 T306 A310	R227-Q308 PolarHBondContact NH2-O 3.23Å; T306-Q308 PolarHBondContact O-N 3.19Å; T306-Q308 PolarHBondContact OG1-N 2.86Å; Q308-A310 PolarHBondContact O-N 3.41Å
309	G	86.7	Confident	93	Very high	16 Å²	16	53 Å²	53	17%	0.165	29%	0.287	C	S	.	.	S	Bend	trans	76.8	-3.8	179.3	0	0	0	0	0	115.1	T306	T306-G309 PolarHBondContact O-N 2.91Å
310	A	90.3	Very high	93	Very high	18 Å²	18	54.1 Å²	54.1	15%	0.149	29%	0.293	C	S	.	.	S	Bend	trans	-84.6	149.8	175.4	0	0	0	0	0	111.4	N219 L305 T306 Q308	N219-A310 WeakPolarHBondContact OD1-CA 3.4Å; L305-A310 CarbonylContact C-O 3.58Å; L305-A310 WeakPolarHBondContact CA-O 3.42Å; T306-A310 PolarHBondContact N-O 3.33Å; T306-A310 PolarHBondContact OG1-N 2.99Å; T306-A310 PolarHBondContact OG1-O 3.17Å; Q308-A310 PolarHBondContact O-N 3.41Å
311	L	92.9	Very high	93.1	Very high	8 Å²	8	54 Å²	54	4%	0.042	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-58.1	139.5	166.7	-76.5	169.3	0	0	0	110.8	M104 I197 N219 L304 L305 F347 V348	M104-L311 HydrophobicContact SD-CB 4.4Å; M104-L311 HydrophobicContact SD-CD1 4.11Å; I197-L311 HydrophobicContact CD1-CB 4.44Å; I197-L311 HydrophobicContact CD1-CD1 3.57Å; I197-L311 HydrophobicContact CD1-CD2 4.49Å; I197-L311 HydrophobicContact CD1-CG 3.5Å; N219-L311 PolarHBondContact ND2-O 2.97Å; N219-L311 PolarHBondContact OD1-N 3.2Å; L304-L311 HydrophobicContact CB-CD2 3.8Å; L305-L311 HydrophobicContact CD2-CD2 3.96Å; L305-L311 HydrophobicContact CD2-CG 4.37Å; L311-F347 HydrophobicContact CD1-CD1 3.8Å; L311-F347 HydrophobicContact CD1-CE1 3.89Å; L311-V348 HydrophobicContact CD1-CG2 4.13Å; L311-V348 HydrophobicContact CD2-CG2 3.59Å; L311-V348 HydrophobicContact CG-CG2 4.5Å
312	K	93.5	Very high	93.3	Very high	63 Å²	63	55.8 Å²	55.8	27%	0.274	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-56.5	162.1	167.1	-71.8	170.3	177.7	158.5	0	110.9	E303 L304 L305 T306 E316 L317	E303-K312 PolarHBondContact O-NZ 3.09Å; L304-K312 WeakPolarHBondContact O-CG 3.35Å; L304-K312 PolarHBondContact O-N 3.3Å; L305-K312 WeakPolarHBondContact O-CE 3.16Å; T306-K312 HydrophobicContact CG2-CG 3.91Å; K312-E316 HydrophobicContact CB-CB 4.05Å; K312-L317 HydrophobicContact CB-CD2 3.94Å; K312-L317 HydrophobicContact CB-CG 3.96Å; K312-L317 WeakPolarHBondContact O-CD1 3.21Å
313	T	93.3	Very high	93.5	Very high	77 Å²	77	59.5 Å²	59.5	47%	0.472	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-64	152.6	177.8	67.3	0	0	0	0	111.1	P315 E316 L317	T313-P315 VanDerWaalsContact C-CD 3.49Å; T313-P315 VanDerWaalsContact C-N 3.32Å; T313-E316 WeakPolarHBondContact CB-OE2 3.09Å; T313-E316 WeakPolarHBondContact CG2-OE2 3.26Å; T313-E316 PolarHBondContact N-OE2 3.26Å; T313-E316 WeakPolarHBondContact O-CB 3.25Å; T313-E316 PolarHBondContact O-N 3.11Å; T313-E316 VanDerWaalsContact OG1-CD 3.26Å; T313-E316 VanDerWaalsContact OG1-CG 3.29Å; T313-E316 WeakPolarHBondContact OG1-CG 3.13Å; T313-E316 PolarHBondContact OG1-OE2 3.46Å; T313-L317 WeakPolarHBondContact O-CG 3.43Å; T313-L317 PolarHBondContact O-N 3.35Å
314	L	93.3	Very high	93.6	Very high	43 Å²	43	60.4 Å²	60.4	23%	0.225	32%	0.315	C	S	.	.	H	α-helix	trans	-55	-39.5	179.9	-174.2	62.1	0	0	0	113.7	L317 K318 Q351 A352	L314-L317 PolarHBondContact O-N 3.18Å; L314-K318 HydrophobicContact CD1-CG 4.42Å; L314-K318 HydrophobicContact CG-CD 4.45Å; L314-K318 WeakPolarHBondContact O-CB 3.27Å; L314-K318 WeakPolarHBondContact O-CG 3.18Å; L314-K318 PolarHBondContact O-N 3.05Å; L314-Q351 HydrophobicContact CD1-CB 4.25Å; L314-Q351 WeakPolarHBondContact CD2-O 3.2Å; L314-A352 HydrophobicContact CD1-CB 4.33Å
315	P	94.9	Very high	93.6	Very high	96 Å²	96	69.7 Å²	69.7	62%	0.623	35%	0.35	S	S	*	.	H	α-helix	trans	-59.9	-44.3	172.3	-26.2	36.9	0	0	0	114	T313 K318 Q319	T313-P315 VanDerWaalsContact C-CD 3.49Å; T313-P315 VanDerWaalsContact C-N 3.32Å; P315-K318 PolarHBondContact O-N 2.9Å; P315-Q319 WeakPolarHBondContact O-CB 3.33Å; P315-Q319 PolarHBondContact O-N 3.11Å
316	E	95.8	Very high	93.8	Very high	92 Å²	92	68.8 Å²	68.8	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-42.2	177.3	-69.4	167.2	130.8	0	0	111.5	K312 T313 Q319 L320	K312-E316 HydrophobicContact CB-CB 4.05Å; T313-E316 WeakPolarHBondContact CB-OE2 3.09Å; T313-E316 WeakPolarHBondContact CG2-OE2 3.26Å; T313-E316 PolarHBondContact N-OE2 3.26Å; T313-E316 WeakPolarHBondContact O-CB 3.25Å; T313-E316 PolarHBondContact O-N 3.11Å; T313-E316 VanDerWaalsContact OG1-CD 3.26Å; T313-E316 VanDerWaalsContact OG1-CG 3.29Å; T313-E316 WeakPolarHBondContact OG1-CG 3.13Å; T313-E316 PolarHBondContact OG1-OE2 3.46Å; E316-Q319 WeakPolarHBondContact O-CB 3.13Å; E316-Q319 PolarHBondContact O-N 2.83Å; E316-L320 PolarHBondContact O-N 2.89Å
317	L	95.7	Very high	94	Very high	8 Å²	8	70.7 Å²	70.7	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-64.1	-43.1	176.6	-67.6	170	0	0	0	111.6	L304 K312 T313 L314 Q319 L320 M321 V348	L304-L317 HydrophobicContact CB-CD2 4.03Å; L304-L317 HydrophobicContact CD2-CD2 4.07Å; K312-L317 HydrophobicContact CB-CD2 3.94Å; K312-L317 HydrophobicContact CB-CG 3.96Å; K312-L317 WeakPolarHBondContact O-CD1 3.21Å; T313-L317 WeakPolarHBondContact O-CG 3.43Å; T313-L317 PolarHBondContact O-N 3.35Å; L314-L317 PolarHBondContact O-N 3.18Å; L317-Q319 VanDerWaalsContact C-N 3.31Å; L317-Q319 PolarHBondContact O-N 3.19Å; L317-L320 WeakPolarHBondContact O-CB 3.37Å; L317-L320 PolarHBondContact O-N 3.07Å; L317-M321 PolarHBondContact O-N 3.46Å; L317-V348 HydrophobicContact CB-CG1 3.91Å; L317-V348 HydrophobicContact CD1-CB 4.46Å; L317-V348 HydrophobicContact CD1-CG1 3.9Å; L317-V348 HydrophobicContact CD1-CG2 3.8Å; L317-V348 HydrophobicContact CD2-CG1 4.12Å; L317-V348 HydrophobicContact CD2-CG2 4.26Å; L317-V348 HydrophobicContact CG-CG1 4.2Å
318	K	95.8	Very high	94.2	Very high	80 Å²	80	64.5 Å²	64.5	35%	0.348	33%	0.325	S	S	.	.	H	α-helix	trans	-62.4	-38.2	173.5	-77.9	-174.9	174.3	-170.9	0	111.9	L314 P315 M321 A322 A352	L314-K318 HydrophobicContact CD1-CG 4.42Å; L314-K318 HydrophobicContact CG-CD 4.45Å; L314-K318 WeakPolarHBondContact O-CB 3.27Å; L314-K318 WeakPolarHBondContact O-CG 3.18Å; L314-K318 PolarHBondContact O-N 3.05Å; P315-K318 PolarHBondContact O-N 2.9Å; K318-M321 HydrophobicContact CG-CE 4.1Å; K318-M321 PolarHBondContact O-N 3.16Å; K318-A322 WeakPolarHBondContact O-CB 3.49Å; K318-A322 PolarHBondContact O-N 3.17Å; K318-A352 VanDerWaalsContact CE-CA 3.5Å; K318-A352 WeakPolarHBondContact CE-O 3.39Å; K318-A352 HydrophobicContact CG-CB 4.2Å; K318-A352 PolarHBondContact NZ-O 3.29Å
319	Q	97.5	Very high	94.5	Very high	117 Å²	117	64.1 Å²	64.1	55%	0.547	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-41.1	174.9	-167.9	-175.4	16.2	0	0	111.7	P315 E316 L317 A322 K323	P315-Q319 WeakPolarHBondContact O-CB 3.33Å; P315-Q319 PolarHBondContact O-N 3.11Å; E316-Q319 WeakPolarHBondContact O-CB 3.13Å; E316-Q319 PolarHBondContact O-N 2.83Å; L317-Q319 VanDerWaalsContact C-N 3.31Å; L317-Q319 PolarHBondContact O-N 3.19Å; Q319-A322 PolarHBondContact O-N 3.36Å; Q319-K323 WeakPolarHBondContact O-CG 3.47Å; Q319-K323 PolarHBondContact O-N 3.33Å
320	L	96.7	Very high	94.8	Very high	26 Å²	26	67.5 Å²	67.5	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-46	175.3	-177.5	65	0	0	0	111.6	M299 E303 L304 E316 L317 K323 R324	M299-L320 HydrophobicContact CE-CD2 4.25Å; M299-L320 HydrophobicContact CE-CG 4.1Å; E303-L320 HydrophobicContact CB-CD2 4.02Å; E303-L320 WeakPolarHBondContact O-CD2 3.44Å; L304-L320 HydrophobicContact CD2-CD2 3.95Å; E316-L320 PolarHBondContact O-N 2.89Å; L317-L320 WeakPolarHBondContact O-CB 3.37Å; L317-L320 PolarHBondContact O-N 3.07Å; L320-K323 PolarHBondContact O-N 3.32Å; L320-R324 PolarHBondContact O-N 2.85Å
321	M	97.6	Very high	95	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-47.1	173.4	-79.6	-174.2	-76.5	0	0	112.1	M299 L317 K318 K323 R324 R325 V326 V348 V349 A352 Y354	M299-M321 HydrophobicContact CE-CB 4.48Å; M299-M321 HydrophobicContact CE-CG 3.66Å; M299-M321 HydrophobicContact SD-CG 4.01Å; L317-M321 PolarHBondContact O-N 3.46Å; K318-M321 HydrophobicContact CG-CE 4.1Å; K318-M321 PolarHBondContact O-N 3.16Å; M321-K323 VanDerWaalsContact C-N 3.34Å; M321-K323 PolarHBondContact O-N 3.46Å; M321-R324 CarbonylContact O-C 3.59Å; M321-R324 WeakPolarHBondContact O-CA 3.17Å; M321-R324 PolarHBondContact O-N 3.36Å; M321-R325 PolarHBondContact O-N 2.99Å; M321-V326 HydrophobicContact CB-CB 3.96Å; M321-V326 HydrophobicContact CB-CG1 4.28Å; M321-V326 HydrophobicContact CG-CB 4.32Å; M321-V326 HydrophobicContact CG-CG1 4.24Å; M321-V326 WeakPolarHBondContact O-CB 3.35Å; M321-V326 PolarHBondContact O-N 3.2Å; M321-V326 HydrophobicContact SD-CG1 4.29Å; M321-V348 HydrophobicContact CE-CG1 4.1Å; M321-V349 HydrophobicContact SD-CG2 4.09Å; M321-A352 HydrophobicContact CE-CB 3.51Å; M321-A352 HydrophobicContact SD-CB 4.5Å; M321-Y354 HydrophobicContact CE-CE2 4.11Å; M321-Y354 HydrophobicContact SD-CD2 4.07Å; M321-Y354 HydrophobicContact SD-CE2 3.74Å
322	A	97.4	Very high	95.2	Very high	42 Å²	42	67.4 Å²	67.4	35%	0.347	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-38.2	-180	0	0	0	0	0	112.8	K318 Q319 R324 R325 F327	K318-A322 WeakPolarHBondContact O-CB 3.49Å; K318-A322 PolarHBondContact O-N 3.17Å; Q319-A322 PolarHBondContact O-N 3.36Å; A322-R324 PolarHBondContact O-N 2.79Å; A322-R325 PolarHBondContact O-N 3.44Å; A322-F327 HydrophobicContact CB-CE1 4.07Å
323	K	97.4	Very high	95.4	Very high	155 Å²	155	64.5 Å²	64.5	67%	0.674	32%	0.32	S	S	*	.	H	α-helix	trans	-58.6	-30.6	174.1	-75	174.7	-179.4	177.9	0	112.5	Q319 L320 M321	Q319-K323 WeakPolarHBondContact O-CG 3.47Å; Q319-K323 PolarHBondContact O-N 3.33Å; L320-K323 PolarHBondContact O-N 3.32Å; M321-K323 VanDerWaalsContact C-N 3.34Å; M321-K323 PolarHBondContact O-N 3.46Å
324	R	96.1	Very high	95.6	Very high	73 Å²	73	60.8 Å²	60.8	28%	0.275	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.4	176.8	-63.3	-178.7	-178.4	-106	-4.4	113.1	V297 N298 E303 L320 M321 A322 V326	V297-R324 HydrophobicContact CG1-CB 3.85Å; N298-R324 WeakPolarHBondContact O-CD 3.37Å; N298-R324 PolarHBondContact O-NH1 3.42Å; E303-R324 IonicContact OE1-CZ 2.83Å; E303-R324 IonicContact OE1-NH2 3.72Å; E303-R324 PolarHBondContact OE1-NH2 2.99Å; E303-R324 IonicContact OE2-CZ 3.82Å; E303-R324 IonicContact OE2-NE 2.69Å; E303-R324 IonicContact OE2-NH2 3.82Å; E303-R324 PolarHBondContact OE2-NH2 3.39Å; L320-R324 PolarHBondContact O-N 2.85Å; M321-R324 CarbonylContact O-C 3.59Å; M321-R324 WeakPolarHBondContact O-CA 3.17Å; M321-R324 PolarHBondContact O-N 3.36Å; A322-R324 PolarHBondContact O-N 2.79Å; R324-V326 HydrophobicContact CB-CG2 4.2Å; R324-V326 PolarHBondContact O-N 3.21Å
325	R	95.6	Very high	95.9	Very high	197 Å²	197	58.8 Å²	58.8	74%	0.743	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	28.6	-179.6	-50.4	176.3	71.4	170.9	3.6	113.3	M321 A322 F327	M321-R325 PolarHBondContact O-N 2.99Å; A322-R325 PolarHBondContact O-N 3.44Å; R325-F327 HydrophobicContact CB-CE2 4.06Å; R325-F327 WeakPolarHBondContact O-CD2 3.33Å
326	V	96.5	Very high	96	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.257	C	S	.	.			trans	-90.1	106.8	173.7	-178.3	0	0	0	0	108.2	L278 L280 V297 M299 M321 R324 M332	L278-V326 HydrophobicContact CD2-CB 4.35Å; L278-V326 HydrophobicContact CD2-CG1 4.07Å; L278-V326 HydrophobicContact CD2-CG2 4.13Å; L280-V326 HydrophobicContact CD1-CG1 4.02Å; L280-V326 HydrophobicContact CD2-CG1 4.11Å; L280-V326 HydrophobicContact CD2-CG2 3.68Å; V297-V326 HydrophobicContact CG1-CG2 4.06Å; M299-V326 HydrophobicContact SD-CG2 3.95Å; M321-V326 HydrophobicContact CB-CB 3.96Å; M321-V326 HydrophobicContact CB-CG1 4.28Å; M321-V326 HydrophobicContact CG-CB 4.32Å; M321-V326 HydrophobicContact CG-CG1 4.24Å; M321-V326 WeakPolarHBondContact O-CB 3.35Å; M321-V326 PolarHBondContact O-N 3.2Å; M321-V326 HydrophobicContact SD-CG1 4.29Å; R324-V326 HydrophobicContact CB-CG2 4.2Å; R324-V326 PolarHBondContact O-N 3.21Å; V326-M332 HydrophobicContact CG1-CE 3.65Å; V326-M332 HydrophobicContact CG1-SD 3.92Å
327	F	94	Very high	96	Very high	92 Å²	92	50.9 Å²	50.9	40%	0.404	24%	0.244	S	C	.	.			trans	-121.2	147	178.6	-55.4	-72.3	0	0	0	109.2	A322 R325 D329 M332	A322-F327 HydrophobicContact CB-CE1 4.07Å; R325-F327 HydrophobicContact CB-CE2 4.06Å; R325-F327 WeakPolarHBondContact O-CD2 3.33Å; F327-D329 HydrophobicContact CB-CB 4.42Å; F327-D329 PolarHBondContact O-N 2.81Å; F327-M332 WeakPolarHBondContact O-CE 3.13Å
328	G	91.8	Very high	95.9	Very high	39 Å²	39	52 Å²	52	40%	0.402	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	27.6	176.8	0	0	0	0	0	114.9
329	D	92.3	Very high	95.9	Very high	105 Å²	105	48.2 Å²	48.2	56%	0.561	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.8	-174.1	65	-2.7	0	0	0	113.5	F327	F327-D329 HydrophobicContact CB-CB 4.42Å; F327-D329 PolarHBondContact O-N 2.81Å
330	R	92.2	Very high	95.8	Very high	87 Å²	87	42.8 Å²	42.8	33%	0.328	21%	0.208	S	C	.	.	S	Bend	trans	-151.9	157.7	-178.1	76.5	-167.2	92.3	170.9	6.1	112.1	L278	L278-R330 HydrophobicContact CB-CG 4.23Å
331	P	94.7	Very high	95.6	Very high	24 Å²	24	43.1 Å²	43.1	16%	0.156	21%	0.21	C	C	.	.			trans	-41.8	138.3	165.3	-36.8	40.6	0	0	0	114.2	L90 F92 G276 T277 L278 N355	L90-P331 WeakPolarHBondContact O-CG 3.39Å; F92-P331 HydrophobicContact CD2-CB 4.1Å; F92-P331 HydrophobicContact CD2-CG 4.18Å; F92-P331 HydrophobicContact CE2-CB 3.53Å; F92-P331 HydrophobicContact CE2-CG 4.1Å; F92-P331 HydrophobicContact CZ-CB 4.4Å; G276-P331 WeakPolarHBondContact O-CD 3.33Å; T277-P331 CarbonylContact C-O 3.59Å; T277-P331 WeakPolarHBondContact CA-O 3.32Å; T277-P331 HydrophobicContact CG2-CB 4.37Å; L278-P331 PolarHBondContact N-O 3.39Å; P331-N355 CarbonylContact C-O 3.58Å
332	M	97	Very high	95.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.8	175.3	-55.9	-176.4	-176.2	0	0	111.1	L278 L280 V326 F327 V349 Y354 N355 V356 K357	L278-M332 HydrophobicContact CB-CG 4.27Å; L278-M332 HydrophobicContact CD2-CE 4.33Å; L278-M332 CarbonylContact O-C 2.81Å; L278-M332 WeakPolarHBondContact O-CA 3.14Å; L280-M332 HydrophobicContact CD1-SD 3.81Å; V326-M332 HydrophobicContact CG1-CE 3.65Å; V326-M332 HydrophobicContact CG1-SD 3.92Å; F327-M332 WeakPolarHBondContact O-CE 3.13Å; M332-V349 HydrophobicContact SD-CG1 3.71Å; M332-Y354 HydrophobicContact CE-CD2 3.76Å; M332-Y354 HydrophobicContact CE-CE2 4.43Å; M332-Y354 HydrophobicContact CE-CG 4.31Å; M332-Y354 HydrophobicContact SD-CD2 4.24Å; M332-N355 WeakPolarHBondContact CB-O 3.31Å; M332-N355 PolarHBondContact N-O 3.26Å; M332-V356 HydrophobicContact CB-CB 4.06Å; M332-V356 HydrophobicContact CB-CG2 3.9Å; M332-V356 WeakPolarHBondContact O-CA 3.4Å; M332-K357 PolarHBondContact O-N 2.89Å
333	I	98	Very high	95.6	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.4	166.7	-63.3	175.7	0	0	0	107.4	A263 V268 A271 T277 L278 F279 L280 K357	A263-I333 HydrophobicContact CB-CD1 4.45Å; A263-I333 HydrophobicContact CB-CG2 4.2Å; V268-I333 HydrophobicContact CG2-CD1 4.39Å; V268-I333 HydrophobicContact CG2-CG2 4.29Å; A271-I333 HydrophobicContact CB-CD1 4.07Å; T277-I333 HydrophobicContact CG2-CD1 4.03Å; T277-I333 HydrophobicContact CG2-CG1 3.93Å; L278-I333 PolarHBondContact O-N 2.71Å; F279-I333 WeakPolarHBondContact CA-O 3.48Å; F279-I333 HydrophobicContact CD1-CB 3.89Å; F279-I333 HydrophobicContact CD1-CG2 4.21Å; F279-I333 HydrophobicContact CE1-CB 4Å; F279-I333 HydrophobicContact CE1-CD1 3.91Å; F279-I333 HydrophobicContact CE1-CG1 4.47Å; F279-I333 HydrophobicContact CE1-CG2 4.26Å; F279-I333 HydrophobicContact CZ-CD1 4.46Å; L280-I333 PolarHBondContact N-O 3.03Å; I333-K357 WeakPolarHBondContact CA-O 3.1Å
334	V	98.4	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.6	175.1	175.3	0	0	0	0	108.8	L280 A342 L345 Y346 V349 V356 K357 L358 Y359	L280-V334 HydrophobicContact CB-CG2 3.93Å; L280-V334 HydrophobicContact CD1-CG2 3.96Å; L280-V334 HydrophobicContact CG-CG2 4.41Å; L280-V334 CarbonylContact O-C 3.54Å; L280-V334 WeakPolarHBondContact O-CA 3.29Å; V334-A342 HydrophobicContact CG1-CB 3.93Å; V334-L345 HydrophobicContact CG1-CB 4.1Å; V334-L345 HydrophobicContact CG1-CD2 3.94Å; V334-L345 HydrophobicContact CG1-CG 3.99Å; V334-L345 HydrophobicContact CG2-CG 4.4Å; V334-Y346 HydrophobicContact CB-CD2 4.34Å; V334-Y346 HydrophobicContact CG2-CD2 4.49Å; V334-V349 HydrophobicContact CG2-CG2 4.32Å; V334-V356 HydrophobicContact CB-CG2 4.25Å; V334-V356 HydrophobicContact CG2-CG2 3.47Å; V334-V356 VanDerWaalsContact CG2-CG2 3.47Å; V334-K357 PolarHBondContact N-O 2.8Å; V334-L358 HydrophobicContact CB-CD1 4.43Å; V334-L358 HydrophobicContact CG1-CD1 4.23Å; V334-Y359 PolarHBondContact O-N 2.97Å
335	Y	98.3	Very high	95.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157.3	174.1	73.6	-82.6	0	0	0	111.7	F279 L280 D281 A282 I293 S296 W363	F279-Y335 HydrophobicContact CB-CE1 4.19Å; L280-Y335 VanDerWaalsContact O-CD1 3.31Å; L280-Y335 WeakPolarHBondContact O-CD1 3.49Å; L280-Y335 PolarHBondContact O-N 3.46Å; D281-Y335 WeakPolarHBondContact CA-O 3.33Å; D281-Y335 HydrophobicContact CB-CE1 3.92Å; D281-Y335 HydrophobicContact CB-CE2 4.11Å; D281-Y335 VanDerWaalsContact CG-CE2 3.46Å; D281-Y335 VanDerWaalsContact CG-CZ 3.46Å; D281-Y335 WeakPolarHBondContact OD2-CE2 3.36Å; D281-Y335 PolarHBondContact OD2-OH 2.84Å; A282-Y335 PolarHBondContact N-O 3.04Å; I293-Y335 HydrophobicContact CB-CE1 4.29Å; I293-Y335 HydrophobicContact CD1-CD1 4.04Å; I293-Y335 HydrophobicContact CD1-CE1 3.85Å; I293-Y335 HydrophobicContact CD1-CE2 4.38Å; I293-Y335 HydrophobicContact CD1-CG 4.39Å; I293-Y335 HydrophobicContact CG1-CE1 4.14Å; I293-Y335 HydrophobicContact CG1-CE2 4.3Å; I293-Y335 PolarHBondContact N-OH 2.94Å; I293-Y335 VanDerWaalsContact N-OH 3.17Å; S296-Y335 WeakPolarHBondContact CB-OH 3.35Å; S296-Y335 VanDerWaalsContact OG-CE1 3.31Å; S296-Y335 WeakPolarHBondContact OG-CE1 3.26Å; S296-Y335 PolarHBondContact OG-OH 3.46Å; Y335-W363 HydrophobicContact CD2-CB 4.27Å; Y335-W363 HydrophobicContact CE2-CB 4.25Å; Y335-W363 HydrophobicContact CE2-CE3 4.18Å
336	G	96.9	Very high	95.7	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.			trans	-126.8	-151.4	177.6	0	0	0	0	0	109.5	D338 W363	G336-D338 VanDerWaalsContact C-N 3.29Å; G336-D338 WeakPolarHBondContact CA-O 3.25Å; G336-D338 PolarHBondContact N-O 3.3Å; G336-W363 WeakPolarHBondContact O-CB 3.19Å; G336-W363 PolarHBondContact O-N 3.07Å
337	S	95.2	Very high	95.7	Very high	22 Å²	22	21 Å²	21	15%	0.154	11%	0.114	C	C	.	.	S	Bend	trans	-68.9	-39.3	163.8	-71.6	0	0	0	0	109.7	R283 E287 D341 W363 T364	R283-S337 VanDerWaalsContact CD-N 3.35Å; R283-S337 WeakPolarHBondContact CD-OG 3.4Å; E287-S337 PolarHBondContact OE2-OG 3.47Å; S337-D341 WeakPolarHBondContact CB-OD2 3.44Å; S337-W363 PolarHBondContact O-N 3.2Å; S337-T364 WeakPolarHBondContact O-CB 3.47Å; S337-T364 PolarHBondContact O-N 3.43Å; S337-T364 PolarHBondContact O-OG1 2.85Å
338	D	94.9	Very high	95.8	Very high	32 Å²	32	16.6 Å²	16.6	17%	0.171	10%	0.095	C	C	.	.	S	Bend	trans	-133.4	-166.2	167	54.9	48.3	0	0	0	110.1	G336 I340 D341	G336-D338 VanDerWaalsContact C-N 3.29Å; G336-D338 WeakPolarHBondContact CA-O 3.25Å; G336-D338 PolarHBondContact N-O 3.3Å; D338-I340 WeakPolarHBondContact OD1-CA 3.14Å; D338-I340 WeakPolarHBondContact OD1-CB 3.46Å; D338-I340 PolarHBondContact OD1-N 2.78Å; D338-D341 PolarHBondContact OD1-N 3.19Å
339	S	96.2	Very high	96	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-81.9	-19.7	177.3	44.1	0	0	0	0	114.2	F202 S343 E360	F202-S339 WeakPolarHBondContact CE2-OG 3.38Å; S339-S343 WeakPolarHBondContact O-CB 3.38Å; S339-S343 PolarHBondContact O-N 2.8Å; S339-S343 VanDerWaalsContact O-N 3.16Å; S339-E360 PolarHBondContact OG-O 3.26Å
340	I	94.7	Very high	96.2	Very high	2 Å²	2	10 Å²	10	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-67.2	-53.3	175.7	-52.6	-179.2	0	0	0	108.5	F129 I150 L154 E162 T198 F202 D338 A342 S343	F129-I340 HydrophobicContact CE2-CG2 4.08Å; F129-I340 HydrophobicContact CZ-CG2 3.65Å; I150-I340 HydrophobicContact CG2-CD1 4.17Å; L154-I340 HydrophobicContact CD1-CD1 4.06Å; E162-I340 VanDerWaalsContact OE2-CD1 3.27Å; E162-I340 WeakPolarHBondContact OE2-CD1 3.39Å; T198-I340 WeakPolarHBondContact CB-O 3.39Å; F202-I340 HydrophobicContact CB-CG2 4.26Å; F202-I340 HydrophobicContact CD1-CD1 4.46Å; F202-I340 HydrophobicContact CD1-CG1 3.86Å; F202-I340 HydrophobicContact CD1-CG2 4.48Å; F202-I340 HydrophobicContact CD2-CB 4.32Å; F202-I340 HydrophobicContact CD2-CG1 3.98Å; F202-I340 HydrophobicContact CE1-CD1 4.27Å; F202-I340 HydrophobicContact CE1-CG1 3.79Å; F202-I340 HydrophobicContact CE2-CG1 3.91Å; F202-I340 HydrophobicContact CG-CB 4.28Å; F202-I340 HydrophobicContact CG-CG1 3.96Å; F202-I340 HydrophobicContact CG-CG2 4.27Å; F202-I340 HydrophobicContact CZ-CG1 3.84Å; D338-I340 WeakPolarHBondContact OD1-CA 3.14Å; D338-I340 WeakPolarHBondContact OD1-CB 3.46Å; D338-I340 PolarHBondContact OD1-N 2.78Å; I340-A342 PolarHBondContact O-N 3.22Å; I340-S343 WeakPolarHBondContact O-CB 3.41Å; I340-S343 PolarHBondContact O-N 3.4Å; I340-S343 VanDerWaalsContact O-N 3.12Å; I340-S343 PolarHBondContact O-OG 3.35Å
341	D	92.9	Very high	96.2	Very high	34 Å²	34	7.5 Å²	7.5	18%	0.182	4%	0.042	C	C	.	.	H	α-helix	trans	-57.6	-34.8	-178.2	-76.5	-16.4	0	0	0	113.3	T301 S337 D338	T301-D341 PolarHBondContact OG1-O 3.25Å; S337-D341 WeakPolarHBondContact CB-OD2 3.44Å; D338-D341 PolarHBondContact OD1-N 3.19Å
342	A	97	Very high	96.2	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-88.8	-12.5	-177	0	0	0	0	0	115.2	A282 V334 I340 A344 L345 Y346 L358	A282-A342 HydrophobicContact CB-CB 4.01Å; V334-A342 HydrophobicContact CG1-CB 3.93Å; I340-A342 PolarHBondContact O-N 3.22Å; A342-A344 VanDerWaalsContact C-N 3.27Å; A342-A344 PolarHBondContact O-N 2.88Å; A342-L345 PolarHBondContact O-N 2.86Å; A342-Y346 WeakPolarHBondContact O-CB 3.44Å; A342-Y346 PolarHBondContact O-N 3.15Å; A342-L358 HydrophobicContact CB-CD1 3.52Å
343	S	97.3	Very high	96	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.8	-34.3	-173.5	65.3	0	0	0	0	113.3	T198 T201 F202 S339 I340 Y346 F347	T198-S343 PolarHBondContact O-OG 3.13Å; T201-S343 PolarHBondContact OG1-OG 3.34Å; F202-S343 VanDerWaalsContact CA-CB 3.48Å; F202-S343 PolarHBondContact N-OG 3.39Å; S339-S343 WeakPolarHBondContact O-CB 3.38Å; S339-S343 PolarHBondContact O-N 2.8Å; S339-S343 VanDerWaalsContact O-N 3.16Å; I340-S343 WeakPolarHBondContact O-CB 3.41Å; I340-S343 PolarHBondContact O-N 3.4Å; I340-S343 VanDerWaalsContact O-N 3.12Å; I340-S343 PolarHBondContact O-OG 3.35Å; S343-Y346 WeakPolarHBondContact O-CB 3.5Å; S343-Y346 PolarHBondContact O-N 3.07Å; S343-F347 VanDerWaalsContact O-CB 3.3Å; S343-F347 WeakPolarHBondContact O-CB 3.41Å; S343-F347 PolarHBondContact O-N 3.18Å
344	A	96.4	Very high	95.9	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-69	-46.8	179.5	0	0	0	0	0	111.8	I197 T198 T201 T301 A342 Y346 F347 V348	I197-A344 HydrophobicContact CG2-CB 3.92Å; T198-A344 HydrophobicContact CG2-CB 3.85Å; T201-A344 WeakPolarHBondContact OG1-CA 3.34Å; T201-A344 PolarHBondContact OG1-N 2.95Å; T301-A344 HydrophobicContact CG2-CB 3.64Å; A342-A344 VanDerWaalsContact C-N 3.27Å; A342-A344 PolarHBondContact O-N 2.88Å; A344-Y346 VanDerWaalsContact C-N 3.31Å; A344-Y346 PolarHBondContact O-N 2.83Å; A344-F347 PolarHBondContact O-N 2.94Å; A344-V348 WeakPolarHBondContact O-CG2 3.48Å; A344-V348 PolarHBondContact O-N 3.03Å
345	L	97.3	Very high	95.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.5	-43.4	173.5	178.4	59.8	0	0	0	110.9	L280 A282 M299 L304 V334 A342 F347 V348 V349	L280-L345 HydrophobicContact CB-CD2 4.04Å; A282-L345 HydrophobicContact CB-CB 3.92Å; A282-L345 HydrophobicContact CB-CD2 3.85Å; M299-L345 HydrophobicContact CB-CD1 3.87Å; M299-L345 HydrophobicContact CB-CD2 3.71Å; M299-L345 HydrophobicContact CB-CG 4.47Å; M299-L345 HydrophobicContact CE-CD1 4.26Å; M299-L345 HydrophobicContact SD-CD1 4.15Å; L304-L345 HydrophobicContact CD1-CB 3.96Å; L304-L345 HydrophobicContact CD1-CD1 4.09Å; L304-L345 HydrophobicContact CD2-CD1 4.23Å; V334-L345 HydrophobicContact CG1-CB 4.1Å; V334-L345 HydrophobicContact CG1-CD2 3.94Å; V334-L345 HydrophobicContact CG1-CG 3.99Å; V334-L345 HydrophobicContact CG2-CG 4.4Å; A342-L345 PolarHBondContact O-N 2.86Å; L345-F347 PolarHBondContact O-N 3.09Å; L345-V348 PolarHBondContact O-N 3.27Å; L345-V349 HydrophobicContact CD1-CG2 4.17Å; L345-V349 HydrophobicContact CG-CG2 4.44Å; L345-V349 VanDerWaalsContact O-CG2 3.26Å; L345-V349 WeakPolarHBondContact O-CG2 3.47Å; L345-V349 PolarHBondContact O-N 3.06Å
346	Y	97.8	Very high	95.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-57	-50.3	175.9	176.6	-102.4	0	0	0	111.9	W204 W205 W261 V334 A342 S343 A344 V348 V349 V350 V356 L358	W204-Y346 HydrophobicContact CH2-CE1 4.16Å; W204-Y346 AromaticContact CZ3-CD1 3.91Å; W204-Y346 HydrophobicContact CZ3-CD1 3.91Å; W204-Y346 AromaticContact CZ3-CE1 3.71Å; W204-Y346 HydrophobicContact CZ3-CE1 3.71Å; W205-Y346 AromaticContact CD1-CD1 3.9Å; W205-Y346 AromaticContact CD1-CE1 3.42Å; W205-Y346 VanDerWaalsContact CD1-CE1 3.42Å; W205-Y346 HydrophobicContact CG-CD1 4.43Å; W205-Y346 HydrophobicContact CG-CE1 4.29Å; W261-Y346 HydrophobicContact CE3-CE1 4.35Å; W261-Y346 PolarHBondContact O-OH 3.26Å; V334-Y346 HydrophobicContact CB-CD2 4.34Å; V334-Y346 HydrophobicContact CG2-CD2 4.49Å; A342-Y346 WeakPolarHBondContact O-CB 3.44Å; A342-Y346 PolarHBondContact O-N 3.15Å; S343-Y346 WeakPolarHBondContact O-CB 3.5Å; S343-Y346 PolarHBondContact O-N 3.07Å; A344-Y346 VanDerWaalsContact C-N 3.31Å; A344-Y346 PolarHBondContact O-N 2.83Å; Y346-V348 VanDerWaalsContact C-N 3.32Å; Y346-V348 PolarHBondContact O-N 3.24Å; Y346-V349 PolarHBondContact O-N 3.31Å; Y346-V349 VanDerWaalsContact O-N 3.17Å; Y346-V350 HydrophobicContact CD1-CG2 4.23Å; Y346-V350 HydrophobicContact CD2-CG2 4.45Å; Y346-V350 HydrophobicContact CE1-CG2 3.72Å; Y346-V350 HydrophobicContact CE2-CG2 3.99Å; Y346-V350 WeakPolarHBondContact O-CG2 3.05Å; Y346-V350 PolarHBondContact O-N 3.41Å; Y346-V356 HydrophobicContact CD2-CB 4.47Å; Y346-V356 HydrophobicContact CD2-CG1 4.01Å; Y346-V356 HydrophobicContact CD2-CG2 3.75Å; Y346-V356 HydrophobicContact CE2-CB 4.18Å; Y346-V356 HydrophobicContact CE2-CG1 3.62Å; Y346-V356 HydrophobicContact CE2-CG2 3.84Å; Y346-V356 WeakPolarHBondContact CE2-O 3.3Å; Y346-V356 PolarHBondContact OH-O 3.01Å; Y346-L358 HydrophobicContact CD1-CB 4.25Å; Y346-L358 HydrophobicContact CD2-CB 3.71Å; Y346-L358 HydrophobicContact CE1-CB 4.49Å; Y346-L358 HydrophobicContact CE2-CB 3.96Å; Y346-L358 VanDerWaalsContact CE2-N 3.31Å; Y346-L358 HydrophobicContact CG-CB 3.85Å; Y346-L358 HydrophobicContact CG-CD1 4.28Å; Y346-L358 HydrophobicContact CG-CG 4.46Å
347	F	96.9	Very high	95.6	Very high	1 Å²	1	13.3 Å²	13.3	0%	0.004	8%	0.08	C	C	.	.	H	α-helix	trans	-55.9	-46.3	176.6	-179	-97.2	0	0	0	111.3	D103 M104 T201 W204 V217 L311 S343 A344 L345 V349 V350 Q351	D103-F347 HydrophobicContact CB-CE2 4.24Å; D103-F347 VanDerWaalsContact O-CZ 3.29Å; D103-F347 WeakPolarHBondContact O-CZ 3.31Å; M104-F347 HydrophobicContact CB-CE1 4.16Å; M104-F347 HydrophobicContact CB-CZ 3.92Å; M104-F347 HydrophobicContact CG-CE1 4.39Å; M104-F347 HydrophobicContact CG-CZ 4.47Å; M104-F347 HydrophobicContact SD-CE1 4.31Å; T201-F347 HydrophobicContact CG2-CB 3.72Å; T201-F347 HydrophobicContact CG2-CD1 3.96Å; T201-F347 HydrophobicContact CG2-CD2 4.19Å; T201-F347 HydrophobicContact CG2-CG 3.71Å; W204-F347 AromaticContact CD2-CD2 3.62Å; W204-F347 HydrophobicContact CD2-CD2 3.62Å; W204-F347 AromaticContact CD2-CE2 3.85Å; W204-F347 HydrophobicContact CD2-CE2 3.85Å; W204-F347 AromaticContact CE2-CD2 3.83Å; W204-F347 AromaticContact CE2-CE2 3.8Å; W204-F347 AromaticContact CE3-CD2 3.57Å; W204-F347 HydrophobicContact CE3-CD2 3.57Å; W204-F347 HydrophobicContact CE3-CE2 4.28Å; W204-F347 HydrophobicContact CG-CD2 4.23Å; W204-F347 HydrophobicContact CG-CE2 4.11Å; W204-F347 HydrophobicContact CH2-CD2 4.05Å; W204-F347 HydrophobicContact CZ2-CD2 4.06Å; W204-F347 HydrophobicContact CZ2-CE2 4.25Å; W204-F347 HydrophobicContact CZ3-CB 4.46Å; W204-F347 AromaticContact CZ3-CD2 3.79Å; W204-F347 HydrophobicContact CZ3-CD2 3.79Å; W204-F347 AromaticContact NE1-CE2 3.95Å; V217-F347 HydrophobicContact CB-CE2 4.26Å; V217-F347 HydrophobicContact CB-CZ 3.97Å; V217-F347 HydrophobicContact CG2-CD2 4.21Å; V217-F347 HydrophobicContact CG2-CE2 3.63Å; V217-F347 HydrophobicContact CG2-CZ 3.86Å; L311-F347 HydrophobicContact CD1-CD1 3.8Å; L311-F347 HydrophobicContact CD1-CE1 3.89Å; S343-F347 VanDerWaalsContact O-CB 3.3Å; S343-F347 WeakPolarHBondContact O-CB 3.41Å; S343-F347 PolarHBondContact O-N 3.18Å; A344-F347 PolarHBondContact O-N 2.94Å; L345-F347 PolarHBondContact O-N 3.09Å; F347-V349 PolarHBondContact O-N 2.78Å; F347-V350 WeakPolarHBondContact O-CB 3.23Å; F347-V350 PolarHBondContact O-N 3.14Å; F347-Q351 HydrophobicContact CD1-CG 3.98Å; F347-Q351 HydrophobicContact CE1-CG 3.77Å; F347-Q351 HydrophobicContact CE2-CG 4.43Å; F347-Q351 HydrophobicContact CG-CG 4.42Å; F347-Q351 HydrophobicContact CZ-CG 4.04Å; F347-Q351 WeakPolarHBondContact O-CG 3.29Å; F347-Q351 PolarHBondContact O-N 3.28Å
348	V	95.8	Very high	95.7	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.006	7%	0.073	C	C	.	.	H	α-helix	trans	-59.1	-44.9	176.8	165.9	0	0	0	0	112.4	L304 L311 L317 M321 A344 L345 Y346 V350 Q351 A352	L304-V348 HydrophobicContact CD1-CG2 4.12Å; L311-V348 HydrophobicContact CD1-CG2 4.13Å; L311-V348 HydrophobicContact CD2-CG2 3.59Å; L311-V348 HydrophobicContact CG-CG2 4.5Å; L317-V348 HydrophobicContact CB-CG1 3.91Å; L317-V348 HydrophobicContact CD1-CB 4.46Å; L317-V348 HydrophobicContact CD1-CG1 3.9Å; L317-V348 HydrophobicContact CD1-CG2 3.8Å; L317-V348 HydrophobicContact CD2-CG1 4.12Å; L317-V348 HydrophobicContact CD2-CG2 4.26Å; L317-V348 HydrophobicContact CG-CG1 4.2Å; M321-V348 HydrophobicContact CE-CG1 4.1Å; A344-V348 WeakPolarHBondContact O-CG2 3.48Å; A344-V348 PolarHBondContact O-N 3.03Å; L345-V348 PolarHBondContact O-N 3.27Å; Y346-V348 VanDerWaalsContact C-N 3.32Å; Y346-V348 PolarHBondContact O-N 3.24Å; V348-V350 VanDerWaalsContact C-N 3.35Å; V348-Q351 PolarHBondContact O-N 3.47Å; V348-A352 PolarHBondContact O-N 2.88Å
349	V	96.6	Very high	95.8	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.9	-39.9	-179.7	177.1	0	0	0	0	110.7	L280 M321 M332 V334 L345 Y346 F347 A352 Y354 V356	L280-V349 HydrophobicContact CD1-CG2 3.82Å; M321-V349 HydrophobicContact SD-CG2 4.09Å; M332-V349 HydrophobicContact SD-CG1 3.71Å; V334-V349 HydrophobicContact CG2-CG2 4.32Å; L345-V349 HydrophobicContact CD1-CG2 4.17Å; L345-V349 HydrophobicContact CG-CG2 4.44Å; L345-V349 VanDerWaalsContact O-CG2 3.26Å; L345-V349 WeakPolarHBondContact O-CG2 3.47Å; L345-V349 PolarHBondContact O-N 3.06Å; Y346-V349 PolarHBondContact O-N 3.31Å; Y346-V349 VanDerWaalsContact O-N 3.17Å; F347-V349 PolarHBondContact O-N 2.78Å; V349-A352 WeakPolarHBondContact O-CB 3.36Å; V349-A352 PolarHBondContact O-N 3.18Å; V349-Y354 HydrophobicContact CG1-CD2 4.17Å; V349-Y354 HydrophobicContact CG1-CG 4.44Å; V349-Y354 WeakPolarHBondContact O-CB 3.48Å; V349-Y354 PolarHBondContact O-N 3.06Å; V349-V356 HydrophobicContact CB-CB 4.43Å; V349-V356 HydrophobicContact CB-CG1 4.06Å; V349-V356 HydrophobicContact CB-CG2 4.38Å; V349-V356 HydrophobicContact CG1-CB 3.6Å; V349-V356 HydrophobicContact CG1-CG1 3.58Å; V349-V356 HydrophobicContact CG1-CG2 3.86Å
350	V	95.5	Very high	95.9	Very high	4 Å²	4	11.3 Å²	11.3	2%	0.024	7%	0.068	C	C	.	.	H	α-helix	trans	-59.6	-51.9	171.4	172	0	0	0	0	110.2	L98 W204 W261 Y346 F347 V348 A352 G353 V356	L98-V350 HydrophobicContact CD1-CB 4.5Å; L98-V350 HydrophobicContact CD1-CG1 3.42Å; L98-V350 VanDerWaalsContact CD1-CG1 3.42Å; L98-V350 WeakPolarHBondContact CD1-O 3.44Å; L98-V350 HydrophobicContact CD2-CG1 3.4Å; L98-V350 VanDerWaalsContact CD2-CG1 3.4Å; L98-V350 HydrophobicContact CG-CG1 4.04Å; W204-V350 HydrophobicContact CH2-CB 4.27Å; W204-V350 HydrophobicContact CH2-CG1 3.93Å; W204-V350 HydrophobicContact CH2-CG2 4.26Å; W204-V350 HydrophobicContact CZ2-CG1 4.33Å; W261-V350 HydrophobicContact CZ3-CG1 4.23Å; W261-V350 HydrophobicContact CZ3-CG2 4.42Å; Y346-V350 HydrophobicContact CD1-CG2 4.23Å; Y346-V350 HydrophobicContact CD2-CG2 4.45Å; Y346-V350 HydrophobicContact CE1-CG2 3.72Å; Y346-V350 HydrophobicContact CE2-CG2 3.99Å; Y346-V350 WeakPolarHBondContact O-CG2 3.05Å; Y346-V350 PolarHBondContact O-N 3.41Å; F347-V350 WeakPolarHBondContact O-CB 3.23Å; F347-V350 PolarHBondContact O-N 3.14Å; V348-V350 VanDerWaalsContact C-N 3.35Å; V350-A352 PolarHBondContact O-N 3.34Å; V350-A352 VanDerWaalsContact O-N 3.16Å; V350-G353 WeakPolarHBondContact O-CA 3.39Å; V350-G353 PolarHBondContact O-N 3.22Å; V350-V356 HydrophobicContact CB-CG1 4.5Å; V350-V356 HydrophobicContact CG2-CG1 3.49Å; V350-V356 VanDerWaalsContact CG2-CG1 3.49Å
351	Q	93.4	Very high	95.9	Very high	36 Å²	36	11.2 Å²	11.2	17%	0.168	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-24.5	-179.6	-63.7	-67.9	23.2	0	0	113.4	D103 L314 F347 V348 G353	D103-Q351 VanDerWaalsContact CB-NE2 3.28Å; L314-Q351 HydrophobicContact CD1-CB 4.25Å; L314-Q351 WeakPolarHBondContact CD2-O 3.2Å; F347-Q351 HydrophobicContact CD1-CG 3.98Å; F347-Q351 HydrophobicContact CE1-CG 3.77Å; F347-Q351 HydrophobicContact CE2-CG 4.43Å; F347-Q351 HydrophobicContact CG-CG 4.42Å; F347-Q351 HydrophobicContact CZ-CG 4.04Å; F347-Q351 WeakPolarHBondContact O-CG 3.29Å; F347-Q351 PolarHBondContact O-N 3.28Å; V348-Q351 PolarHBondContact O-N 3.47Å; Q351-G353 PolarHBondContact O-N 2.73Å
352	A	94.2	Very high	96.1	Very high	6 Å²	6	9.6 Å²	9.6	5%	0.05	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.3	171.5	0	0	0	0	0	113.9	L314 K318 M321 V348 V349 V350 Y354	L314-A352 HydrophobicContact CD1-CB 4.33Å; K318-A352 VanDerWaalsContact CE-CA 3.5Å; K318-A352 WeakPolarHBondContact CE-O 3.39Å; K318-A352 HydrophobicContact CG-CB 4.2Å; K318-A352 PolarHBondContact NZ-O 3.29Å; M321-A352 HydrophobicContact CE-CB 3.51Å; M321-A352 HydrophobicContact SD-CB 4.5Å; V348-A352 PolarHBondContact O-N 2.88Å; V349-A352 WeakPolarHBondContact O-CB 3.36Å; V349-A352 PolarHBondContact O-N 3.18Å; V350-A352 PolarHBondContact O-N 3.34Å; V350-A352 VanDerWaalsContact O-N 3.16Å; A352-Y354 HydrophobicContact CB-CD1 4.16Å; A352-Y354 HydrophobicContact CB-CD2 4.08Å; A352-Y354 HydrophobicContact CB-CE1 4.15Å; A352-Y354 HydrophobicContact CB-CE2 4.08Å; A352-Y354 HydrophobicContact CB-CG 4.12Å
353	G	92.8	Very high	96.1	Very high	47 Å²	47	11.6 Å²	11.6	49%	0.485	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	25.1	-176.4	0	0	0	0	0	112.7	V350 Q351	V350-G353 WeakPolarHBondContact O-CA 3.39Å; V350-G353 PolarHBondContact O-N 3.22Å; Q351-G353 PolarHBondContact O-N 2.73Å
354	Y	94.5	Very high	96	Very high	37 Å²	37	14 Å²	14	15%	0.145	8%	0.081	C	C	.	.			trans	-95.9	159.1	-176.2	-62.3	-8.5	0	0	0	112	M321 M332 V349 A352 V356	M321-Y354 HydrophobicContact CE-CE2 4.11Å; M321-Y354 HydrophobicContact SD-CD2 4.07Å; M321-Y354 HydrophobicContact SD-CE2 3.74Å; M332-Y354 HydrophobicContact CE-CD2 3.76Å; M332-Y354 HydrophobicContact CE-CE2 4.43Å; M332-Y354 HydrophobicContact CE-CG 4.31Å; M332-Y354 HydrophobicContact SD-CD2 4.24Å; V349-Y354 HydrophobicContact CG1-CD2 4.17Å; V349-Y354 HydrophobicContact CG1-CG 4.44Å; V349-Y354 WeakPolarHBondContact O-CB 3.48Å; V349-Y354 PolarHBondContact O-N 3.06Å; A352-Y354 HydrophobicContact CB-CD1 4.16Å; A352-Y354 HydrophobicContact CB-CD2 4.08Å; A352-Y354 HydrophobicContact CB-CE1 4.15Å; A352-Y354 HydrophobicContact CB-CE2 4.08Å; A352-Y354 HydrophobicContact CB-CG 4.12Å; Y354-V356 PolarHBondContact O-N 3.41Å
355	N	93.6	Very high	96	Very high	36 Å²	36	14.2 Å²	14.2	19%	0.193	8%	0.082	C	C	.	.			trans	-88.4	102.6	-176.6	-159.8	-0.7	0	0	0	112.6	F92 Q95 P331 M332	F92-N355 WeakPolarHBondContact CB-OD1 3.39Å; F92-N355 HydrophobicContact CD2-CB 4.45Å; F92-N355 VanDerWaalsContact CD2-ND2 3.31Å; F92-N355 WeakPolarHBondContact CD2-ND2 3.43Å; F92-N355 WeakPolarHBondContact CD2-OD1 3.49Å; F92-N355 WeakPolarHBondContact CG-OD1 3.03Å; Q95-N355 PolarHBondContact NE2-OD1 2.91Å; P331-N355 CarbonylContact C-O 3.58Å; M332-N355 WeakPolarHBondContact CB-O 3.31Å; M332-N355 PolarHBondContact N-O 3.26Å
356	V	96.4	Very high	95.9	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.012	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	141.1	-166.5	64.6	0	0	0	0	113.1	M332 V334 Y346 V349 V350 Y354	M332-V356 HydrophobicContact CB-CB 4.06Å; M332-V356 HydrophobicContact CB-CG2 3.9Å; M332-V356 WeakPolarHBondContact O-CA 3.4Å; V334-V356 HydrophobicContact CB-CG2 4.25Å; V334-V356 HydrophobicContact CG2-CG2 3.47Å; V334-V356 VanDerWaalsContact CG2-CG2 3.47Å; Y346-V356 HydrophobicContact CD2-CB 4.47Å; Y346-V356 HydrophobicContact CD2-CG1 4.01Å; Y346-V356 HydrophobicContact CD2-CG2 3.75Å; Y346-V356 HydrophobicContact CE2-CB 4.18Å; Y346-V356 HydrophobicContact CE2-CG1 3.62Å; Y346-V356 HydrophobicContact CE2-CG2 3.84Å; Y346-V356 WeakPolarHBondContact CE2-O 3.3Å; Y346-V356 PolarHBondContact OH-O 3.01Å; V349-V356 HydrophobicContact CB-CB 4.43Å; V349-V356 HydrophobicContact CB-CG1 4.06Å; V349-V356 HydrophobicContact CB-CG2 4.38Å; V349-V356 HydrophobicContact CG1-CB 3.6Å; V349-V356 HydrophobicContact CG1-CG1 3.58Å; V349-V356 HydrophobicContact CG1-CG2 3.86Å; V350-V356 HydrophobicContact CB-CG1 4.5Å; V350-V356 HydrophobicContact CG2-CG1 3.49Å; V350-V356 VanDerWaalsContact CG2-CG1 3.49Å; Y354-V356 PolarHBondContact O-N 3.41Å
357	K	97.4	Very high	95.8	Very high	18 Å²	18	15.6 Å²	15.6	8%	0.078	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	150.8	164.4	-76.6	-172.6	164.4	-160.3	0	111.2	F92 S259 Y260 L262 A263 D267 M332 I333 V334	F92-K357 HydrophobicContact CD1-CD 4.19Å; F92-K357 HydrophobicContact CD1-CG 4.36Å; F92-K357 HydrophobicContact CE1-CD 3.33Å; F92-K357 HydrophobicContact CE1-CG 3.64Å; F92-K357 HydrophobicContact CZ-CD 3.87Å; F92-K357 HydrophobicContact CZ-CG 3.86Å; S259-K357 WeakPolarHBondContact O-CE 3.45Å; S259-K357 PolarHBondContact O-NZ 3.44Å; S259-K357 VanDerWaalsContact O-NZ 3.15Å; Y260-K357 WeakPolarHBondContact O-CE 3.29Å; Y260-K357 VanDerWaalsContact O-CG 3.32Å; Y260-K357 WeakPolarHBondContact O-CG 3.3Å; L262-K357 VanDerWaalsContact O-CD 3.31Å; L262-K357 WeakPolarHBondContact O-CD 3.33Å; L262-K357 WeakPolarHBondContact O-CE 3.41Å; L262-K357 PolarHBondContact O-NZ 3.19Å; A263-K357 HydrophobicContact CB-CB 3.78Å; A263-K357 HydrophobicContact CB-CD 3.99Å; D267-K357 IonicContact OD1-NZ 3.77Å; D267-K357 IonicContact OD2-NZ 2.88Å; D267-K357 PolarHBondContact OD2-NZ 2.95Å; M332-K357 PolarHBondContact O-N 2.89Å; I333-K357 WeakPolarHBondContact CA-O 3.1Å; V334-K357 PolarHBondContact N-O 2.8Å
358	L	98.3	Very high	95.7	Very high	0 Å²	0	18 Å²	18	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.8	169.7	-177.7	64.4	0	0	0	109.3	W205 W261 A263 V334 A342 Y346 E360	W205-L358 HydrophobicContact CD2-CD2 3.48Å; W205-L358 VanDerWaalsContact CD2-CD2 3.48Å; W205-L358 VanDerWaalsContact CE2-CD2 3.48Å; W205-L358 HydrophobicContact CE3-CD2 3.86Å; W205-L358 HydrophobicContact CG-CD2 3.85Å; W205-L358 HydrophobicContact CH2-CD2 4.21Å; W205-L358 HydrophobicContact CZ2-CB 4.2Å; W205-L358 HydrophobicContact CZ2-CD2 3.86Å; W205-L358 HydrophobicContact CZ2-CG 4.3Å; W205-L358 HydrophobicContact CZ3-CD2 4.21Å; W261-L358 PolarHBondContact O-N 3.09Å; A263-L358 PolarHBondContact N-O 3.33Å; V334-L358 HydrophobicContact CB-CD1 4.43Å; V334-L358 HydrophobicContact CG1-CD1 4.23Å; A342-L358 HydrophobicContact CB-CD1 3.52Å; Y346-L358 HydrophobicContact CD1-CB 4.25Å; Y346-L358 HydrophobicContact CD2-CB 3.71Å; Y346-L358 HydrophobicContact CE1-CB 4.49Å; Y346-L358 HydrophobicContact CE2-CB 3.96Å; Y346-L358 VanDerWaalsContact CE2-N 3.31Å; Y346-L358 HydrophobicContact CG-CB 3.85Å; Y346-L358 HydrophobicContact CG-CD1 4.28Å; Y346-L358 HydrophobicContact CG-CG 4.46Å; L358-E360 PolarHBondContact O-N 3.33Å
359	Y	97.9	Very high	95.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	108.3	174.9	176.1	-147.1	0	0	0	110.4	A263 V268 V334 G361 G362 E365 F366	A263-Y359 WeakPolarHBondContact O-CA 3.36Å; A263-Y359 WeakPolarHBondContact O-CD2 3.5Å; V268-Y359 HydrophobicContact CG2-CD1 3.85Å; V268-Y359 HydrophobicContact CG2-CD2 3.67Å; V268-Y359 HydrophobicContact CG2-CE1 4.07Å; V268-Y359 HydrophobicContact CG2-CE2 3.95Å; V268-Y359 HydrophobicContact CG2-CG 3.65Å; V334-Y359 PolarHBondContact O-N 2.97Å; Y359-G361 VanDerWaalsContact C-N 3.34Å; Y359-G361 PolarHBondContact O-N 3.19Å; Y359-G362 WeakPolarHBondContact CE1-O 3.5Å; Y359-G362 PolarHBondContact O-N 2.74Å; Y359-E365 VanDerWaalsContact CE2-OE2 3.29Å; Y359-E365 WeakPolarHBondContact CE2-OE2 3.27Å; Y359-E365 WeakPolarHBondContact OH-CB 3.44Å; Y359-E365 WeakPolarHBondContact OH-CG 3.37Å; Y359-E365 PolarHBondContact OH-OE2 2.72Å; Y359-F366 HydrophobicContact CE1-CB 3.94Å
360	E	97	Very high	95.6	Very high	13 Å²	13	24.2 Å²	24.2	6%	0.061	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-43.8	-173	-176.3	-171.6	-142.1	0	0	112.6	R163 L164 W205 L262 A263 S339 L358 G362	R163-E360 VanDerWaalsContact CD-CD 3.4Å; R163-E360 WeakPolarHBondContact CD-OE2 3.45Å; R163-E360 IonicContact CZ-OE2 3.94Å; R163-E360 IonicContact NE-OE2 3.58Å; R163-E360 IonicContact NH1-OE2 3.91Å; R163-E360 PolarHBondContact NH1-OE2 2.77Å; L164-E360 WeakPolarHBondContact CB-OE1 3.37Å; L164-E360 WeakPolarHBondContact CG-OE1 3.18Å; L164-E360 PolarHBondContact N-OE1 2.64Å; W205-E360 HydrophobicContact CH2-CB 4.42Å; W205-E360 HydrophobicContact CH2-CG 4.3Å; L262-E360 HydrophobicContact CD1-CB 3.93Å; L262-E360 HydrophobicContact CD1-CG 4.22Å; L262-E360 HydrophobicContact CG-CB 4.12Å; A263-E360 PolarHBondContact O-N 2.85Å; A263-E360 VanDerWaalsContact O-N 3.08Å; S339-E360 PolarHBondContact OG-O 3.26Å; L358-E360 PolarHBondContact O-N 3.33Å; E360-G362 VanDerWaalsContact C-N 3.31Å; E360-G362 PolarHBondContact O-N 2.9Å
361	G	95.8	Very high	95.6	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.6	-173.8	0	0	0	0	0	115	R163 Y359 E365	R163-G361 VanDerWaalsContact NH2-CA 3.32Å; Y359-G361 VanDerWaalsContact C-N 3.34Å; Y359-G361 PolarHBondContact O-N 3.19Å; G361-E365 WeakPolarHBondContact O-CB 3.2Å; G361-E365 PolarHBondContact O-N 3.38Å
362	G	96.6	Very high	95.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	54.8	-165.2	-179.5	0	0	0	0	0	114.8	Y359 E360 T364 E365 F366	Y359-G362 WeakPolarHBondContact CE1-O 3.5Å; Y359-G362 PolarHBondContact O-N 2.74Å; E360-G362 VanDerWaalsContact C-N 3.31Å; E360-G362 PolarHBondContact O-N 2.9Å; G362-T364 PolarHBondContact O-N 2.89Å; G362-E365 PolarHBondContact O-N 3.05Å; G362-F366 PolarHBondContact O-N 3.36Å
363	W	96.6	Very high	95.7	Very high	42 Å²	42	34.7 Å²	34.7	16%	0.159	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-28.4	174.5	-176.4	-110.3	0	0	0	112.2	G291 R292 I293 Y335 G336 S337 E365 F366 G367 K375	G291-W363 VanDerWaalsContact CA-CZ2 3.49Å; R292-W363 VanDerWaalsContact CA-CH2 3.42Å; R292-W363 VanDerWaalsContact N-CZ2 3.31Å; R292-W363 VanDerWaalsContact O-CH2 3.23Å; R292-W363 WeakPolarHBondContact O-CH2 3.18Å; R292-W363 WeakPolarHBondContact O-CZ3 3.27Å; I293-W363 HydrophobicContact CG1-CE3 4.16Å; I293-W363 HydrophobicContact CG1-CZ3 3.96Å; Y335-W363 HydrophobicContact CD2-CB 4.27Å; Y335-W363 HydrophobicContact CE2-CB 4.25Å; Y335-W363 HydrophobicContact CE2-CE3 4.18Å; G336-W363 WeakPolarHBondContact O-CB 3.19Å; G336-W363 PolarHBondContact O-N 3.07Å; S337-W363 PolarHBondContact O-N 3.2Å; W363-E365 PolarHBondContact O-N 3.48Å; W363-F366 HydrophobicContact CE3-CB 4.47Å; W363-F366 AromaticContact CE3-CD1 3.99Å; W363-F366 HydrophobicContact CE3-CD1 3.99Å; W363-F366 HydrophobicContact CH2-CD1 4.21Å; W363-F366 AromaticContact CZ3-CD1 3.43Å; W363-F366 HydrophobicContact CZ3-CD1 3.43Å; W363-F366 VanDerWaalsContact CZ3-CD1 3.43Å; W363-F366 AromaticContact CZ3-CE1 3.97Å; W363-F366 HydrophobicContact CZ3-CE1 3.97Å; W363-F366 HydrophobicContact CZ3-CG 4.44Å; W363-F366 PolarHBondContact O-N 2.94Å; W363-G367 WeakPolarHBondContact O-CA 3.44Å; W363-G367 PolarHBondContact O-N 2.75Å; W363-K375 HydrophobicContact CH2-CB 4.18Å; W363-K375 HydrophobicContact CH2-CG 4.03Å
364	T	95.2	Very high	95.8	Very high	50 Å²	50	36 Å²	36	31%	0.307	19%	0.193	S	C	.	.	H	α-helix	trans	-59.3	-47.3	178	-59.6	0	0	0	0	111.9	N159 S337 G362	N159-T364 WeakPolarHBondContact O-CG2 3.38Å; S337-T364 WeakPolarHBondContact O-CB 3.47Å; S337-T364 PolarHBondContact O-N 3.43Å; S337-T364 PolarHBondContact O-OG1 2.85Å; G362-T364 PolarHBondContact O-N 2.89Å
365	E	96.1	Very high	95.9	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.023	20%	0.198	C	C	.	.	H	α-helix	trans	-70	-50.1	174.9	177.9	179.4	-132.4	0	0	111.6	R163 L265 Y359 G361 G362 W363 G367 A368 R369	R163-E365 IonicContact CZ-OE1 2.75Å; R163-E365 IonicContact CZ-OE2 3.8Å; R163-E365 IonicContact NH1-OE2 3.6Å; R163-E365 IonicContact NH2-OE1 3.74Å; R163-E365 PolarHBondContact NH2-OE1 3.37Å; R163-E365 IonicContact NH2-OE2 3.74Å; R163-E365 PolarHBondContact NH2-OE2 3.25Å; L265-E365 HydrophobicContact CD2-CG 4.46Å; Y359-E365 VanDerWaalsContact CE2-OE2 3.29Å; Y359-E365 WeakPolarHBondContact CE2-OE2 3.27Å; Y359-E365 WeakPolarHBondContact OH-CB 3.44Å; Y359-E365 WeakPolarHBondContact OH-CG 3.37Å; Y359-E365 PolarHBondContact OH-OE2 2.72Å; G361-E365 WeakPolarHBondContact O-CB 3.2Å; G361-E365 PolarHBondContact O-N 3.38Å; G362-E365 PolarHBondContact O-N 3.05Å; W363-E365 PolarHBondContact O-N 3.48Å; E365-G367 PolarHBondContact O-N 3.25Å; E365-A368 PolarHBondContact O-N 3.15Å; E365-A368 VanDerWaalsContact O-N 3.12Å; E365-R369 HydrophobicContact CG-CG 4.41Å; E365-R369 PolarHBondContact O-N 3.13Å; E365-R369 IonicContact OE1-CZ 3.69Å; E365-R369 IonicContact OE1-NH1 2.7Å; E365-R369 PolarHBondContact OE1-NH1 3.12Å
366	F	96.4	Very high	95.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.2	-40.9	-173.3	-173.2	-86.4	0	0	0	112.3	L265 V268 L272 I293 Y359 G362 W363 A368 R369 G370 K375	L265-F366 HydrophobicContact CD1-CD2 4.16Å; V268-F366 HydrophobicContact CG1-CD2 3.73Å; V268-F366 HydrophobicContact CG1-CE2 3.71Å; L272-F366 HydrophobicContact CD1-CE2 3.96Å; L272-F366 HydrophobicContact CD1-CZ 4.06Å; L272-F366 HydrophobicContact CD2-CE2 4.16Å; L272-F366 HydrophobicContact CD2-CZ 4.1Å; I293-F366 HydrophobicContact CB-CE1 4.41Å; I293-F366 HydrophobicContact CD1-CD1 4.37Å; I293-F366 HydrophobicContact CD1-CD2 4.1Å; I293-F366 HydrophobicContact CD1-CE2 4.33Å; I293-F366 HydrophobicContact CD1-CG 4.11Å; I293-F366 HydrophobicContact CG1-CD1 3.71Å; I293-F366 HydrophobicContact CG1-CD2 4.26Å; I293-F366 HydrophobicContact CG1-CE1 3.75Å; I293-F366 HydrophobicContact CG1-CE2 4.3Å; I293-F366 HydrophobicContact CG1-CG 3.96Å; I293-F366 HydrophobicContact CG1-CZ 4.05Å; I293-F366 HydrophobicContact CG2-CE1 4.5Å; I293-F366 HydrophobicContact CG2-CZ 4.22Å; Y359-F366 HydrophobicContact CE1-CB 3.94Å; G362-F366 PolarHBondContact O-N 3.36Å; W363-F366 HydrophobicContact CE3-CB 4.47Å; W363-F366 AromaticContact CE3-CD1 3.99Å; W363-F366 HydrophobicContact CE3-CD1 3.99Å; W363-F366 HydrophobicContact CH2-CD1 4.21Å; W363-F366 AromaticContact CZ3-CD1 3.43Å; W363-F366 HydrophobicContact CZ3-CD1 3.43Å; W363-F366 VanDerWaalsContact CZ3-CD1 3.43Å; W363-F366 AromaticContact CZ3-CE1 3.97Å; W363-F366 HydrophobicContact CZ3-CE1 3.97Å; W363-F366 HydrophobicContact CZ3-CG 4.44Å; W363-F366 PolarHBondContact O-N 2.94Å; F366-A368 PolarHBondContact O-N 3.34Å; F366-R369 PolarHBondContact O-N 3Å; F366-G370 VanDerWaalsContact O-CA 3.23Å; F366-G370 WeakPolarHBondContact O-CA 3.41Å; F366-G370 PolarHBondContact O-N 3.38Å; F366-K375 HydrophobicContact CD1-CG 4.34Å; F366-K375 HydrophobicContact CE1-CG 3.85Å; F366-K375 VanDerWaalsContact O-CE 3.28Å; F366-K375 WeakPolarHBondContact O-CE 3.49Å
367	G	95.3	Very high	95.4	Very high	29 Å²	29	44 Å²	44	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-55.5	-33.9	174.8	0	0	0	0	0	112	W363 E365 K375	W363-G367 WeakPolarHBondContact O-CA 3.44Å; W363-G367 PolarHBondContact O-N 2.75Å; E365-G367 PolarHBondContact O-N 3.25Å; G367-K375 WeakPolarHBondContact O-CE 3.31Å; G367-K375 PolarHBondContact O-NZ 3.16Å
368	A	94.4	Very high	93.8	Very high	50 Å²	50	47.9 Å²	47.9	41%	0.413	28%	0.279	S	S	.	.	H	α-helix	trans	-91.2	-36.9	-179.7	0	0	0	0	0	114.8	N159 E365 F366	N159-A368 HydrophobicContact CB-CB 4.21Å; N159-A368 WeakPolarHBondContact ND2-CB 3.32Å; E365-A368 PolarHBondContact O-N 3.15Å; E365-A368 VanDerWaalsContact O-N 3.12Å; F366-A368 PolarHBondContact O-N 3.34Å
369	R	94.9	Very high	93.6	Very high	126 Å²	126	50.3 Å²	50.3	48%	0.475	29%	0.292	S	S	.	.	H	α-helix	trans	-111.4	-18.7	-171.7	-61.6	178.4	68.1	-163.6	-3.6	114.6	V158 L265 E365 F366	V158-R369 HydrophobicContact CG1-CG 4.28Å; L265-R369 HydrophobicContact CD2-CB 3.86Å; L265-R369 VanDerWaalsContact CD2-CZ 3.48Å; E365-R369 HydrophobicContact CG-CG 4.41Å; E365-R369 PolarHBondContact O-N 3.13Å; E365-R369 IonicContact OE1-CZ 3.69Å; E365-R369 IonicContact OE1-NH1 2.7Å; E365-R369 PolarHBondContact OE1-NH1 3.12Å; F366-R369 PolarHBondContact O-N 3Å
370	G	95	Very high	93.3	Very high	6 Å²	6	52.9 Å²	52.9	6%	0.062	31%	0.308	C	S	.	.	S	Bend	trans	-68.9	152.4	-179.6	0	0	0	0	0	111.9	F366 K375	F366-G370 VanDerWaalsContact O-CA 3.23Å; F366-G370 WeakPolarHBondContact O-CA 3.41Å; F366-G370 PolarHBondContact O-N 3.38Å; G370-K375 WeakPolarHBondContact O-CE 3.47Å; G370-K375 PolarHBondContact O-NZ 3.44Å
371	P	96	Very high	93.1	Very high	36 Å²	36	55.2 Å²	55.2	23%	0.234	32%	0.322	C	S	.	.			trans	-61.3	136.9	174.1	24.4	-33.7	0	0	0	111.7	L269 L272 E373 Y374	L269-P371 VanDerWaalsContact CD2-CD 3.42Å; L269-P371 HydrophobicContact CD2-CG 4.07Å; L272-P371 HydrophobicContact CD1-CG 3.79Å; P371-E373 VanDerWaalsContact C-N 3.31Å; P371-E373 WeakPolarHBondContact CB-OE2 3.4Å; P371-E373 PolarHBondContact O-N 3.41Å; P371-Y374 HydrophobicContact CB-CD2 4.09Å; P371-Y374 HydrophobicContact CG-CD2 3.57Å; P371-Y374 HydrophobicContact CG-CE2 4.41Å; P371-Y374 HydrophobicContact CG-CG 4.34Å; P371-Y374 PolarHBondContact O-N 3.26Å; P371-Y374 VanDerWaalsContact O-N 3.16Å
372	S	94.9	Very high	93	Very high	90 Å²	90	58.4 Å²	58.4	63%	0.629	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-63.7	-33.8	-172.9	-63.3	0	0	0	0	113.3	Y374 K375	S372-Y374 PolarHBondContact O-N 3.06Å; S372-K375 PolarHBondContact O-N 2.96Å; S372-K375 VanDerWaalsContact O-N 3.07Å
373	E	94.8	Very high	92.7	Very high	141 Å²	141	62 Å²	62	66%	0.659	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-66.9	-14.5	178.5	66.7	-86.3	-158.1	0	0	113.8	P371	P371-E373 VanDerWaalsContact C-N 3.31Å; P371-E373 WeakPolarHBondContact CB-OE2 3.4Å; P371-E373 PolarHBondContact O-N 3.41Å
374	Y	95.8	Very high	92.5	Very high	75 Å²	75	63.3 Å²	63.3	29%	0.294	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-105.7	12.4	174.3	-67.1	-79.9	0	0	0	113.3	L272 V294 P371 S372	L272-Y374 HydrophobicContact CB-CD1 3.92Å; L272-Y374 HydrophobicContact CB-CD2 4.4Å; L272-Y374 HydrophobicContact CB-CE1 3.9Å; L272-Y374 HydrophobicContact CB-CE2 4.37Å; L272-Y374 HydrophobicContact CB-CG 4.16Å; L272-Y374 HydrophobicContact CD1-CD1 4.3Å; L272-Y374 HydrophobicContact CD1-CD2 3.81Å; L272-Y374 HydrophobicContact CD1-CE2 4.4Å; L272-Y374 HydrophobicContact CD1-CG 3.73Å; L272-Y374 HydrophobicContact CD2-CD1 4.19Å; L272-Y374 HydrophobicContact CD2-CG 4.24Å; L272-Y374 HydrophobicContact CG-CD1 4.36Å; L272-Y374 HydrophobicContact CG-CG 4.26Å; V294-Y374 VanDerWaalsContact CG2-C 3.41Å; V294-Y374 WeakPolarHBondContact CG2-O 3.27Å; V294-Y374 PolarHBondContact N-O 3.45Å; P371-Y374 HydrophobicContact CB-CD2 4.09Å; P371-Y374 HydrophobicContact CG-CD2 3.57Å; P371-Y374 HydrophobicContact CG-CE2 4.41Å; P371-Y374 HydrophobicContact CG-CG 4.34Å; P371-Y374 PolarHBondContact O-N 3.26Å; P371-Y374 VanDerWaalsContact O-N 3.16Å; S372-Y374 PolarHBondContact O-N 3.06Å
375	K	96.1	Very high	92.3	Very high	59 Å²	59	64.3 Å²	64.3	26%	0.257	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120	170	-61.8	174.7	-168	168.5	0	108.8	W363 F366 G367 G370 S372	W363-K375 HydrophobicContact CH2-CB 4.18Å; W363-K375 HydrophobicContact CH2-CG 4.03Å; F366-K375 HydrophobicContact CD1-CG 4.34Å; F366-K375 HydrophobicContact CE1-CG 3.85Å; F366-K375 VanDerWaalsContact O-CE 3.28Å; F366-K375 WeakPolarHBondContact O-CE 3.49Å; G367-K375 WeakPolarHBondContact O-CE 3.31Å; G367-K375 PolarHBondContact O-NZ 3.16Å; G370-K375 WeakPolarHBondContact O-CE 3.47Å; G370-K375 PolarHBondContact O-NZ 3.44Å; S372-K375 PolarHBondContact O-N 2.96Å; S372-K375 VanDerWaalsContact O-N 3.07Å
376	A	92	Very high	92	Very high	21 Å²	21	68.8 Å²	68.8	17%	0.174	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141	173.1	0	0	0	0	0	110.3	G291 R292 V294	G291-A376 CarbonylContact C-O 3.55Å; G291-A376 VanDerWaalsContact CA-O 3.27Å; G291-A376 WeakPolarHBondContact CA-O 3.47Å; R292-A376 HydrophobicContact CG-CB 3.95Å; R292-A376 PolarHBondContact N-O 2.81Å; R292-A376 PolarHBondContact O-N 3.22Å; V294-A376 HydrophobicContact CG2-CB 3.81Å
377	Q	85.9	Confident	91.6	Very high	161 Å²	161	74.6 Å²	74.6	75%	0.752	44%	0.441	S	S	*	.			trans	-117.9	141.6	162.4	-63.8	179.9	-21.5	0	0	106.4	N290	N290-Q377 PolarHBondContact O-NE2 3.27Å
378	G	64.5	Low	91.3	Very high	101 Å²	101	78.7 Å²	78.7	100%	1.041	45%	0.454	S	S	*	.			trans	-113.4	0	-176.4	0	0	0	0	0	110.5	Q289	Q289-G378 PolarHBondContact O-N 3.44Å

Retrieved 378 of 378 residues in 559.5 ms (Link to these results)

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