A0A061HVT3_CRIGR Loading...

Protein phosphatase Mn(2+)-dependent 1K

AlphaFold DB , UniProt , Accession A0A061HVT3, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ppm1k, Length 372 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	36.3	Very low	32	Very low	225 Å²	225	146.8 Å²	146.8	100%	1.108	82%	0.821	S	S	*	*				0	78.8	0	-67.8	-77.7	-177.4	0	0	106.2
2	L	30	Very low	31.8	Very low	162 Å²	162	144.8 Å²	144.8	85%	0.848	82%	0.824	S	S	*	*				71.4	125	104.9	-78.5	153.4	0	0	0	111
3	S	30.9	Very low	31.6	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	82%	0.822	S	S	*	*			cis	-158.6	148.1	28.9	-157.2	0	0	0	0	111.9
4	A	32.9	Very low	31.4	Very low	93 Å²	93	134.5 Å²	134.5	77%	0.769	81%	0.813	S	S	*	*			trans	-85	158.2	167	0	0	0	0	0	110.6
5	A	34.7	Very low	31.3	Very low	111 Å²	111	136.9 Å²	136.9	92%	0.917	82%	0.82	S	S	*	*			trans	-141.5	114.6	155.6	0	0	0	0	0	110
6	L	29.8	Very low	31.4	Very low	148 Å²	148	139.4 Å²	139.4	78%	0.775	82%	0.82	S	S	*	*			trans	-99.2	132.2	178	-159.6	108.2	0	0	0	106.9
7	I	34.3	Very low	31.4	Very low	179 Å²	179	139.3 Å²	139.3	92%	0.918	82%	0.821	S	S	*	*			trans	-139.8	135.9	149.3	-62.6	-173.2	0	0	0	108.7
8	T	30.4	Very low	31.5	Very low	90 Å²	90	142.5 Å²	142.5	55%	0.552	82%	0.823	S	S	*	*			trans	-126.1	155	-164.7	-10.6	0	0	0	0	109.5
9	L	31.1	Very low	31.5	Very low	140 Å²	140	145.5 Å²	145.5	73%	0.733	83%	0.825	S	S	*	*			trans	71.9	139.2	147.6	-81.7	146.2	0	0	0	117.3
10	V	29.6	Very low	31.5	Very low	127 Å²	127	150 Å²	150	77%	0.77	83%	0.828	S	S	*	*				-166.1	130.1	56.2	165.7	0	0	0	0	106.4
11	R	31.6	Very low	31.4	Very low	229 Å²	229	149.1 Å²	149.1	86%	0.864	83%	0.827	S	S	*	*				73.5	111.9	61.1	-144.4	-172.1	-168.4	-173.7	4.1	116.5
12	S	30	Very low	31.1	Very low	122 Å²	122	145.1 Å²	145.1	85%	0.853	81%	0.809	S	S	*	*			trans	-175.9	116.7	143.6	-173.4	0	0	0	0	106.9
13	G	28.9	Very low	31	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	81%	0.808	S	S	*	*				92.2	127.6	66.9	0	0	0	0	0	108.1
14	G	28.7	Very low	30.9	Very low	68 Å²	68	150.7 Å²	150.7	70%	0.701	81%	0.813	S	S	*	*			cis	157.7	146.4	6.7	0	0	0	0	0	107.4
15	N	30.8	Very low	30.6	Very low	171 Å²	171	151.3 Å²	151.3	91%	0.914	81%	0.812	S	S	*	*			trans	132.1	113.2	145.3	-74	-12.3	0	0	0	117.5
16	H	32	Very low	30.5	Very low	176 Å²	176	152.4 Å²	152.4	82%	0.815	81%	0.807	S	S	*	*			trans	-67.5	149.1	154	-75.5	-77.9	0	0	0	112
17	V	32.2	Very low	30.3	Very low	138 Å²	138	152.7 Å²	152.7	84%	0.836	81%	0.808	S	S	*	*			trans	-149.9	119.3	132.8	179.2	0	0	0	0	110.2
18	K	33.5	Very low	30.1	Very low	197 Å²	197	152.1 Å²	152.1	86%	0.857	81%	0.806	S	S	*	*			trans	-81.1	144	155.3	-76.1	177.1	174.8	175.3	0	108.4
19	K	31.9	Very low	30.1	Very low	200 Å²	200	155.8 Å²	155.8	87%	0.87	82%	0.817	S	S	*	*			trans	-159.9	121.9	141.6	-112.1	170.8	-172.2	-177.5	0	112.5
20	R	31.5	Very low	30	Very low	234 Å²	234	157 Å²	157	88%	0.883	82%	0.824	S	S	*	*			trans	-93.2	133.4	167.8	-150.3	-177.3	-166.7	-178.2	3.4	105.8
21	V	29.1	Very low	30	Very low	132 Å²	132	158.3 Å²	158.3	80%	0.8	83%	0.827	S	S	*	*			trans	-138.1	124.2	163	177.3	0	0	0	0	109.2
22	L	29.2	Very low	30	Very low	141 Å²	141	159.1 Å²	159.1	74%	0.738	83%	0.83	S	S	*	*			trans	-99.1	151.8	168.5	-105.4	144	0	0	0	108
23	L	29.1	Very low	29.9	Very low	158 Å²	158	162.7 Å²	162.7	83%	0.827	83%	0.833	S	S	*	*			trans	172.1	112.2	146.4	-90.9	153.8	0	0	0	106.8
24	R	26.8	Very low	29.9	Very low	233 Å²	233	165.6 Å²	165.6	88%	0.879	84%	0.835	S	S	*	*				41.2	132.6	84	-78	-171.1	177.1	-161.4	0.2	112.6
25	S	27.4	Very low	30.2	Very low	106 Å²	106	168.6 Å²	168.6	74%	0.741	84%	0.84	S	S	*	*			cis	-163.2	165.7	24.7	40.6	0	0	0	0	108.1
26	V	31.9	Very low	30.2	Very low	134 Å²	134	165.5 Å²	165.5	81%	0.812	83%	0.829	S	S	*	*				-177.1	144	92.7	159.3	0	0	0	0	109.3
27	L	27.3	Very low	30	Very low	154 Å²	154	163 Å²	163	81%	0.806	83%	0.826	S	S	*	*			trans	-66.3	149.9	174.9	-74.9	116.8	0	0	0	114.1
28	L	30	Very low	29.8	Very low	167 Å²	167	162 Å²	162	87%	0.874	82%	0.824	S	S	*	*				-160.9	138.3	123.4	-104.4	158.1	0	0	0	110.6
29	Q	29.7	Very low	29.6	Very low	167 Å²	167	163.3 Å²	163.3	78%	0.78	83%	0.825	S	S	*	*			trans	-63.2	144.2	-176.6	-71.8	156.8	-56.7	0	0	112.2
30	D	30	Very low	29.4	Very low	166 Å²	166	158.9 Å²	158.9	89%	0.888	82%	0.819	S	S	*	*				-155.2	135.9	120	-123	-19.9	0	0	0	112.6
31	N	29.1	Very low	29.2	Very low	153 Å²	153	152.5 Å²	152.5	82%	0.818	81%	0.81	S	S	*	*			trans	-78.5	128.9	-179.1	-100.7	-22.2	0	0	0	110.3
32	R	30.4	Very low	29.2	Very low	247 Å²	247	153.3 Å²	153.3	93%	0.932	81%	0.809	S	S	*	*			trans	-172.5	109.1	139.5	-103.4	159.4	-170.9	-158.6	3.2	110.7
33	Q	27.8	Very low	29.1	Very low	196 Å²	196	151.4 Å²	151.4	92%	0.916	81%	0.808	S	S	*	*			trans	-69.7	121.4	164.5	-78	173.8	-26.8	0	0	109.7
34	V	30.7	Very low	29.2	Very low	139 Å²	139	152.9 Å²	152.9	84%	0.842	81%	0.81	S	S	*	*			trans	-145	126.1	143.5	-176.3	0	0	0	0	107
35	T	33.3	Very low	29.6	Very low	132 Å²	132	147.5 Å²	147.5	81%	0.81	81%	0.805	S	S	*	*			trans	-62.1	149.9	-175.9	41.7	0	0	0	0	113.5
36	P	31.4	Very low	29.9	Very low	106 Å²	106	154.5 Å²	154.5	69%	0.688	82%	0.815	S	S	*	*			trans	-100.7	141.6	-162.4	40.9	-35.2	0	0	0	113.9
37	T	28.4	Very low	29.9	Very low	123 Å²	123	153.6 Å²	153.6	76%	0.755	81%	0.814	S	S	*	*				51.5	153.6	125.9	65.2	0	0	0	0	120.5
38	C	27.1	Very low	30.3	Very low	116 Å²	116	151 Å²	151	78%	0.784	81%	0.809	S	S	*	*			cis	-172.9	157.8	-6.5	-105.2	0	0	0	0	106.7
39	Y	28.7	Very low	31	Very low	226 Å²	226	153.9 Å²	153.9	89%	0.886	81%	0.808	S	S	*	*			trans	-66.3	141.1	157.8	-85.8	-101.7	0	0	0	111.2
40	S	27.7	Very low	31.5	Very low	106 Å²	106	154.8 Å²	154.8	74%	0.741	81%	0.81	S	S	*	*				158.6	114.3	120.2	66	0	0	0	0	113.3
41	S	28.8	Very low	32.3	Very low	100 Å²	100	150.1 Å²	150.1	70%	0.699	79%	0.785	S	S	*	*				38.4	128.1	129.9	71.9	0	0	0	0	122
42	I	27.8	Very low	33.2	Very low	149 Å²	149	147.7 Å²	147.7	76%	0.764	78%	0.777	S	S	*	*				155.7	139	112.6	-77.2	164.4	0	0	0	110.7
43	S	28.3	Very low	34.5	Very low	102 Å²	102	140.9 Å²	140.9	71%	0.713	76%	0.759	S	S	*	*			trans	66.6	101.3	158.5	65.4	0	0	0	0	119.7
44	E	31.6	Very low	35.2	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.883	75%	0.745	S	S	*	*			trans	-96.7	128.2	147	-76	-168.7	164.1	0	0	109.5	R46	E44-R46 PolarHBondContact O-N 3.49Å
45	P	34.2	Very low	36.6	Very low	120 Å²	120	130.9 Å²	130.9	78%	0.779	73%	0.727	S	S	*	*			trans	-75.4	125.9	172.7	29.1	-27.5	0	0	0	109.2	C47	P45-C47 PolarHBondContact O-N 3.38Å
46	R	33.1	Very low	37.1	Very low	252 Å²	252	127.7 Å²	127.7	95%	0.951	72%	0.72	S	S	*	*			trans	-54.4	102.9	163.3	-76.1	179.2	174.6	-176.4	-2.3	108.8	E44 S48	E44-R46 PolarHBondContact O-N 3.49Å; R46-S48 PolarHBondContact O-N 2.93Å
47	C	32.5	Very low	37.6	Very low	115 Å²	115	129.5 Å²	129.5	78%	0.777	72%	0.719	S	S	*	*			trans	-85.1	99.1	162.2	-158.3	0	0	0	0	106.7	P45 R49	P45-C47 PolarHBondContact O-N 3.38Å; C47-R49 VanDerWaalsContact C-N 3.34Å; C47-R49 PolarHBondContact O-N 3.08Å
48	S	36.2	Very low	38	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	72%	0.715	S	S	*	*			trans	-60.6	98.3	167	50.4	0	0	0	0	107.9	R46 F50	R46-S48 PolarHBondContact O-N 2.93Å; S48-F50 PolarHBondContact O-N 3.11Å
49	R	44.7	Very low	38.5	Very low	226 Å²	226	125.1 Å²	125.1	85%	0.853	70%	0.695	S	S	*	*			trans	-64.5	116.6	170.9	-72.8	-179	-179.2	154.3	0.9	107.3	C47 D51	C47-R49 VanDerWaalsContact C-N 3.34Å; C47-R49 PolarHBondContact O-N 3.08Å; R49-D51 PolarHBondContact O-N 3.43Å
50	F	39.3	Very low	38.8	Very low	187 Å²	187	117.8 Å²	117.8	82%	0.82	67%	0.674	S	S	*	*			trans	-66.5	117.5	170	-114.5	-97.4	0	0	0	107.6	S48 P52	S48-F50 PolarHBondContact O-N 3.11Å; F50-P52 WeakPolarHBondContact O-CD 3.32Å
51	D	48	Very low	39.5	Very low	68 Å²	68	122.2 Å²	122.2	36%	0.364	68%	0.675	S	S	.	*			trans	-109.7	90.6	174.7	-169.2	-9.7	0	0	0	106.8	R49 D53 G54 S55 G56	R49-D51 PolarHBondContact O-N 3.43Å; D51-D53 VanDerWaalsContact C-N 3.27Å; D51-D53 PolarHBondContact O-N 3.18Å; D51-G54 PolarHBondContact OD1-N 3.32Å; D51-S55 PolarHBondContact OD1-N 3.49Å; D51-G56 PolarHBondContact OD2-N 2.93Å; D51-G56 VanDerWaalsContact OD2-N 3.11Å
52	P	48	Very low	40.4	Very low	102 Å²	102	121.5 Å²	121.5	66%	0.662	66%	0.663	S	S	*	*	S	Bend	trans	-72.7	-17.8	-169.4	27	-32.6	0	0	0	113.6	F50	F50-P52 WeakPolarHBondContact O-CD 3.32Å
53	D	57.2	Low	41.2	Very low	103 Å²	103	119.2 Å²	119.2	55%	0.551	65%	0.652	S	S	*	*	S	Bend	trans	-116.6	-1.9	178.9	56.8	23.7	0	0	0	113.7	D51 S55	D51-D53 VanDerWaalsContact C-N 3.27Å; D51-D53 PolarHBondContact O-N 3.18Å; D53-S55 PolarHBondContact O-N 3.06Å; D53-S55 VanDerWaalsContact OD1-CB 3.32Å; D53-S55 WeakPolarHBondContact OD1-CB 3.39Å; D53-S55 PolarHBondContact OD1-N 3.38Å; D53-S55 PolarHBondContact OD1-OG 3.21Å
54	G	41.8	Very low	42	Very low	60 Å²	60	122.1 Å²	122.1	62%	0.619	65%	0.652	S	S	*	*			trans	64.7	18.4	174.7	0	0	0	0	0	113.3	D51 G56	D51-G54 PolarHBondContact OD1-N 3.32Å; G54-G56 VanDerWaalsContact C-N 3.26Å; G54-G56 PolarHBondContact O-N 2.69Å
55	S	61.3	Low	42.6	Very low	65 Å²	65	114 Å²	114	46%	0.455	62%	0.62	S	S	.	*			trans	-78.3	-11.1	-174.3	64.2	0	0	0	0	112.8	D51 D53 Q57	D51-S55 PolarHBondContact OD1-N 3.49Å; D53-S55 PolarHBondContact O-N 3.06Å; D53-S55 VanDerWaalsContact OD1-CB 3.32Å; D53-S55 WeakPolarHBondContact OD1-CB 3.39Å; D53-S55 PolarHBondContact OD1-N 3.38Å; D53-S55 PolarHBondContact OD1-OG 3.21Å; S55-Q57 PolarHBondContact O-N 3.31Å; S55-Q57 VanDerWaalsContact O-N 3.08Å
56	G	43.3	Very low	43.1	Very low	65 Å²	65	113.4 Å²	113.4	67%	0.67	61%	0.609	S	S	*	*			trans	66.3	4.9	-176.4	0	0	0	0	0	113.5	D51 G54	D51-G56 PolarHBondContact OD2-N 2.93Å; D51-G56 VanDerWaalsContact OD2-N 3.11Å; G54-G56 VanDerWaalsContact C-N 3.26Å; G54-G56 PolarHBondContact O-N 2.69Å
57	Q	42.7	Very low	43.9	Very low	144 Å²	144	104 Å²	104	67%	0.673	57%	0.573	S	S	*	*	S	Bend	trans	-80	139.6	168.5	-64.1	-164.6	-6.9	0	0	108.4	S55 A59	S55-Q57 PolarHBondContact O-N 3.31Å; S55-Q57 VanDerWaalsContact O-N 3.08Å; Q57-A59 PolarHBondContact O-N 2.73Å
58	P	36.9	Very low	44.3	Very low	103 Å²	103	105.4 Å²	105.4	67%	0.669	57%	0.573	S	S	*	*			trans	-55.3	129	170.6	-14.1	26.2	0	0	0	107.4	T60	P58-T60 VanDerWaalsContact C-N 3.25Å; P58-T60 PolarHBondContact O-N 3.18Å
59	A	37.5	Very low	45	Very low	44 Å²	44	101.9 Å²	101.9	36%	0.364	55%	0.546	S	S	.	.			trans	-55.6	98.5	166.2	0	0	0	0	0	106.9	Q57	Q57-A59 PolarHBondContact O-N 2.73Å
60	T	34.7	Very low	45.3	Very low	72 Å²	72	96.5 Å²	96.5	44%	0.442	53%	0.526	S	S	.	.			trans	-67	148.9	174.1	59	0	0	0	0	106.4	P58 D62 N63	P58-T60 VanDerWaalsContact C-N 3.25Å; P58-T60 PolarHBondContact O-N 3.18Å; T60-D62 WeakPolarHBondContact CB-OD2 3.42Å; T60-D62 PolarHBondContact O-N 2.88Å; T60-D62 PolarHBondContact OG1-OD2 3.41Å; T60-N63 PolarHBondContact O-N 2.87Å
61	W	41.5	Very low	46	Very low	200 Å²	200	89.3 Å²	89.3	76%	0.758	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-55.3	-12.9	-179.1	-79	70.2	0	0	0	113.2	N63 F64 I66	W61-N63 VanDerWaalsContact C-N 3.3Å; W61-N63 PolarHBondContact O-N 3.04Å; W61-F64 PolarHBondContact O-N 3.43Å; W61-I66 HydrophobicContact CE3-CD1 3.86Å; W61-I66 HydrophobicContact CZ3-CD1 3.88Å
62	D	47.7	Very low	46.7	Very low	84 Å²	84	94.2 Å²	94.2	45%	0.449	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-58.8	-30.4	167.5	-56.7	-64.1	0	0	0	114.5	T60 F64	T60-D62 WeakPolarHBondContact CB-OD2 3.42Å; T60-D62 PolarHBondContact O-N 2.88Å; T60-D62 PolarHBondContact OG1-OD2 3.41Å; D62-F64 VanDerWaalsContact C-N 3.29Å; D62-F64 PolarHBondContact O-N 2.89Å
63	N	45.3	Very low	47.9	Very low	101 Å²	101	91.3 Å²	91.3	54%	0.54	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-76.9	-13.6	-179.1	-85.1	-6	0	0	0	113.7	T60 W61	T60-N63 PolarHBondContact O-N 2.87Å; W61-N63 VanDerWaalsContact C-N 3.3Å; W61-N63 PolarHBondContact O-N 3.04Å
64	F	44.7	Very low	49	Very low	163 Å²	163	90 Å²	90	72%	0.715	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-103.3	7.2	-179.6	-78.2	-81.6	0	0	0	113.8	W61 D62	W61-F64 PolarHBondContact O-N 3.43Å; D62-F64 VanDerWaalsContact C-N 3.29Å; D62-F64 PolarHBondContact O-N 2.89Å
65	G	45	Very low	51.1	Low	19 Å²	19	90.7 Å²	90.7	20%	0.196	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	25.5	171.4	0	0	0	0	0	115
66	I	42.9	Very low	52.2	Low	107 Å²	107	89.5 Å²	89.5	55%	0.549	47%	0.474	S	S	.	.			trans	-94	97.3	162.1	-49.1	-172.8	0	0	0	106.5	W61 D68	W61-I66 HydrophobicContact CE3-CD1 3.86Å; W61-I66 HydrophobicContact CZ3-CD1 3.88Å; I66-D68 PolarHBondContact O-N 3.36Å; I66-D68 VanDerWaalsContact O-N 3.12Å
67	W	50.1	Low	54.2	Low	56 Å²	56	92 Å²	92	21%	0.212	47%	0.471	C	S	.	.			trans	-57.8	108.4	173.2	-59.6	86.9	0	0	0	108	N69 P88 H287	W67-N69 HydrophobicContact CB-CB 4.2Å; W67-N69 WeakPolarHBondContact CB-ND2 3.03Å; W67-N69 PolarHBondContact O-N 3.29Å; W67-P88 HydrophobicContact CH2-CG 4.14Å; W67-P88 HydrophobicContact CZ2-CB 4.34Å; W67-P88 HydrophobicContact CZ2-CG 3.8Å; W67-H287 HydrophobicContact CE3-CB 4.46Å; W67-H287 HydrophobicContact CH2-CB 3.1Å; W67-H287 HydrophobicContact CZ2-CB 4.16Å; W67-H287 HydrophobicContact CZ3-CB 3.27Å; W67-H287 WeakPolarHBondContact CZ3-O 3.24Å
68	D	41.7	Very low	56.5	Low	144 Å²	144	90 Å²	90	77%	0.77	47%	0.47	S	S	*	.			trans	-74.1	59.3	164.9	-172.3	20.3	0	0	0	109	I66	I66-D68 PolarHBondContact O-N 3.36Å; I66-D68 VanDerWaalsContact O-N 3.12Å
69	N	50.6	Low	58.9	Low	26 Å²	26	85.7 Å²	85.7	14%	0.139	44%	0.442	C	S	.	.	S	Bend	trans	-131.5	150.1	-174.9	-57.3	-59.4	0	0	0	108	W67 I71 G347	W67-N69 HydrophobicContact CB-CB 4.2Å; W67-N69 WeakPolarHBondContact CB-ND2 3.03Å; W67-N69 PolarHBondContact O-N 3.29Å; N69-I71 PolarHBondContact O-N 3.46Å; N69-G347 VanDerWaalsContact CB-O 3.23Å; N69-G347 WeakPolarHBondContact CB-O 2.92Å; N69-G347 PolarHBondContact ND2-O 3.34Å; N69-G347 PolarHBondContact OD1-O 3.21Å
70	R	51	Low	61.3	Low	114 Å²	114	84.2 Å²	84.2	43%	0.43	43%	0.43	S	S	.	.	S	Bend	trans	-70.1	18	-179.4	-73.3	-174.6	-102.4	169	2.2	113.8	H317 K353	R70-H317 PolarHBondContact NH1-CD2 3.43Å; R70-H317 PolarHBondContact NH1-NE2 2.92Å; R70-K353 VanDerWaalsContact NH2-CE 3.25Å
71	I	54.1	Low	63.8	Low	36 Å²	36	87.3 Å²	87.3	19%	0.185	44%	0.442	C	S	.	.			trans	-126.3	94	-170	-60.6	-173.7	0	0	0	107.8	N69 E73 P345 W349	N69-I71 PolarHBondContact O-N 3.46Å; I71-E73 HydrophobicContact CG2-CB 4.01Å; I71-E73 HydrophobicContact CG2-CG 3.23Å; I71-E73 PolarHBondContact O-N 3.34Å; I71-P345 HydrophobicContact CD1-CB 3.72Å; I71-P345 HydrophobicContact CD1-CG 4.35Å; I71-W349 HydrophobicContact CD1-CB 3.52Å; I71-W349 HydrophobicContact CD1-CG 3.84Å; I71-W349 HydrophobicContact CG1-CB 4.42Å
72	D	63.2	Low	66.1	Low	171 Å²	171	84.1 Å²	84.1	91%	0.914	43%	0.433	S	S	*	.			trans	-79.5	59.4	176.6	-83	-31.7	0	0	0	111.1
73	E	71.8	Confident	68.1	Low	40 Å²	40	83.7 Å²	83.7	19%	0.187	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-93.4	144.2	-177.6	-68.6	-69.8	172.4	0	0	112.7	I71 K89 S91 N94	I71-E73 HydrophobicContact CG2-CB 4.01Å; I71-E73 HydrophobicContact CG2-CG 3.23Å; I71-E73 PolarHBondContact O-N 3.34Å; E73-K89 VanDerWaalsContact CB-O 3.29Å; E73-K89 WeakPolarHBondContact CB-O 3.29Å; E73-S91 VanDerWaalsContact CD-CB 3.46Å; E73-S91 WeakPolarHBondContact OE1-CB 3.17Å; E73-N94 PolarHBondContact OE1-ND2 2.89Å
74	P	81.5	Confident	70	Confident	76 Å²	76	82 Å²	82	49%	0.494	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-68	155.9	179.4	29.6	-33.1	0	0	0	111.4	K89	P74-K89 HydrophobicContact CG-CB 4.16Å; P74-K89 HydrophobicContact CG-CD 4.06Å; P74-K89 WeakPolarHBondContact O-CB 3.28Å; P74-K89 PolarHBondContact O-N 2.86Å
75	I	85.1	Confident	71.9	Confident	74 Å²	74	81.4 Å²	81.4	38%	0.379	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-80.5	135.9	178	-64.9	167.7	0	0	0	110.3	L77 S80 P86 I87	I75-L77 PolarHBondContact O-N 3.12Å; I75-S80 WeakPolarHBondContact CG2-OG 3.37Å; I75-P86 HydrophobicContact CD1-CB 4.18Å; I75-I87 CarbonylContact C-O 3.38Å; I75-I87 WeakPolarHBondContact CA-O 3.45Å; I75-I87 WeakPolarHBondContact CG2-O 3.37Å
76	L	85.2	Confident	73.8	Confident	41 Å²	41	83.2 Å²	83.2	22%	0.215	44%	0.438	C	S	.	.			trans	-72.8	92.9	168.9	-69.5	178.2	0	0	0	109.9	P79 S80 I87 K89	L76-P79 HydrophobicContact CB-CB 4.19Å; L76-P79 HydrophobicContact CB-CG 3.9Å; L76-P79 HydrophobicContact CD1-CG 4.41Å; L76-P79 WeakPolarHBondContact O-CD 3.39Å; L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3Å; L76-S80 PolarHBondContact O-OG 3.44Å; L76-I87 HydrophobicContact CB-CG2 4.43Å; L76-I87 HydrophobicContact CD1-CG2 4.14Å; L76-I87 PolarHBondContact N-O 2.8Å; L76-K89 HydrophobicContact CD2-CB 3.92Å; L76-K89 HydrophobicContact CD2-CG 3.95Å; L76-K89 HydrophobicContact CG-CB 3.99Å; L76-K89 HydrophobicContact CG-CG 4.45Å
77	L	86.3	Confident	75.9	Confident	118 Å²	118	78.4 Å²	78.4	62%	0.618	41%	0.413	S	S	*	.	H	α-helix	trans	-58.6	-51	-174.2	-67.2	174.2	0	0	0	113.9	I75 S80 I81	I75-L77 PolarHBondContact O-N 3.12Å; L77-S80 PolarHBondContact O-N 2.92Å; L77-S80 VanDerWaalsContact O-N 3.15Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.29Å; L77-I81 PolarHBondContact O-N 3.3Å
78	P	88.9	Confident	77.7	Confident	100 Å²	100	76 Å²	76	65%	0.649	41%	0.405	S	S	*	.	H	α-helix	trans	-62.5	-47.2	-176.9	-15.1	27.1	0	0	0	113	S80 I81 K82	P78-S80 PolarHBondContact O-N 3.32Å; P78-I81 PolarHBondContact O-N 3.05Å; P78-K82 WeakPolarHBondContact O-CB 3.3Å; P78-K82 PolarHBondContact O-N 2.9Å
79	P	88.1	Confident	79.8	Confident	13 Å²	13	73 Å²	73	8%	0.084	39%	0.385	C	S	.	.	H	α-helix	trans	-56.7	-45.1	168.9	-30.6	39.8	0	0	0	113.4	L76 I81 K82 Y83 I87 D197	L76-P79 HydrophobicContact CB-CB 4.19Å; L76-P79 HydrophobicContact CB-CG 3.9Å; L76-P79 HydrophobicContact CD1-CG 4.41Å; L76-P79 WeakPolarHBondContact O-CD 3.39Å; P79-I81 VanDerWaalsContact C-N 3.29Å; P79-I81 PolarHBondContact O-N 3.3Å; P79-K82 WeakPolarHBondContact O-CB 3.33Å; P79-K82 PolarHBondContact O-N 3.34Å; P79-K82 VanDerWaalsContact O-N 3.12Å; P79-Y83 HydrophobicContact CB-CD2 4.31Å; P79-Y83 HydrophobicContact CB-CE2 4.46Å; P79-Y83 WeakPolarHBondContact O-CD2 3.42Å; P79-Y83 PolarHBondContact O-N 3.38Å; P79-I87 HydrophobicContact CB-CD1 3.7Å; P79-D197 HydrophobicContact CB-CB 4.06Å; P79-D197 WeakPolarHBondContact CB-O 3.41Å; P79-D197 HydrophobicContact CG-CB 4.07Å
80	S	87.4	Confident	81.7	Confident	14 Å²	14	72.4 Å²	72.4	10%	0.098	38%	0.382	C	S	.	.	H	α-helix	trans	-62.3	-38.5	-176.4	-61.1	0	0	0	0	112.3	I75 L76 L77 P78 G84 K85 I87	I75-S80 WeakPolarHBondContact CG2-OG 3.37Å; L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3Å; L76-S80 PolarHBondContact O-OG 3.44Å; L77-S80 PolarHBondContact O-N 2.92Å; L77-S80 VanDerWaalsContact O-N 3.15Å; P78-S80 PolarHBondContact O-N 3.32Å; S80-G84 WeakPolarHBondContact O-CA 3.34Å; S80-G84 PolarHBondContact O-N 3.14Å; S80-K85 WeakPolarHBondContact CA-O 3.4Å; S80-K85 VanDerWaalsContact CB-O 3.28Å; S80-K85 WeakPolarHBondContact CB-O 3.33Å; S80-K85 PolarHBondContact O-N 3.16Å; S80-K85 PolarHBondContact OG-O 3.18Å; S80-I87 PolarHBondContact OG-N 2.75Å
81	I	88.8	Confident	83.5	Confident	136 Å²	136	67.3 Å²	67.3	70%	0.697	36%	0.364	S	S	*	.	H	α-helix	trans	-67.1	-47.6	173.6	-65.9	164.6	0	0	0	110.2	L77 P78 P79 Y83 G84	L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.29Å; L77-I81 PolarHBondContact O-N 3.3Å; P78-I81 PolarHBondContact O-N 3.05Å; P79-I81 VanDerWaalsContact C-N 3.29Å; P79-I81 PolarHBondContact O-N 3.3Å; I81-Y83 VanDerWaalsContact C-N 3.3Å; I81-Y83 PolarHBondContact O-N 2.8Å; I81-G84 PolarHBondContact O-N 3.12Å
82	K	89.8	Confident	85.5	Confident	133 Å²	133	67.3 Å²	67.3	58%	0.578	36%	0.364	S	S	*	.	H	α-helix	trans	-58.4	-39.4	-179.5	178.5	-179.3	172.5	-170.6	0	112.6	P78 P79 D197	P78-K82 WeakPolarHBondContact O-CB 3.3Å; P78-K82 PolarHBondContact O-N 2.9Å; P79-K82 WeakPolarHBondContact O-CB 3.33Å; P79-K82 PolarHBondContact O-N 3.34Å; P79-K82 VanDerWaalsContact O-N 3.12Å; K82-D197 IonicContact NZ-OD2 2.82Å; K82-D197 PolarHBondContact NZ-OD2 3.24Å
83	Y	88	Confident	86.9	Confident	75 Å²	75	65.9 Å²	65.9	29%	0.294	35%	0.352	S	S	.	.	H	α-helix	trans	-103.5	-1.9	-175.3	-61.4	-69.7	0	0	0	114.3	P79 I81 K85 I87 D197 I199	P79-Y83 HydrophobicContact CB-CD2 4.31Å; P79-Y83 HydrophobicContact CB-CE2 4.46Å; P79-Y83 WeakPolarHBondContact O-CD2 3.42Å; P79-Y83 PolarHBondContact O-N 3.38Å; I81-Y83 VanDerWaalsContact C-N 3.3Å; I81-Y83 PolarHBondContact O-N 2.8Å; Y83-K85 VanDerWaalsContact C-N 3.28Å; Y83-K85 PolarHBondContact O-N 2.74Å; Y83-I87 HydrophobicContact CD2-CD1 3.71Å; Y83-I87 HydrophobicContact CG-CD1 4.35Å; Y83-D197 HydrophobicContact CE2-CB 3.71Å; Y83-D197 WeakPolarHBondContact CE2-OD2 3.35Å; Y83-D197 PolarHBondContact OH-OD2 2.92Å; Y83-I199 HydrophobicContact CD1-CD1 3.66Å; Y83-I199 HydrophobicContact CD2-CD1 3.35Å; Y83-I199 HydrophobicContact CD2-CG1 4.2Å; Y83-I199 HydrophobicContact CE1-CD1 3.71Å; Y83-I199 HydrophobicContact CE2-CD1 3.43Å; Y83-I199 VanDerWaalsContact CE2-CD1 3.43Å; Y83-I199 HydrophobicContact CE2-CG1 4Å; Y83-I199 HydrophobicContact CG-CD1 3.48Å; Y83-I199 VanDerWaalsContact CG-CD1 3.48Å
84	G	85.4	Confident	87.9	Confident	66 Å²	66	66.6 Å²	66.6	68%	0.68	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	22.9	175.9	0	0	0	0	0	114.8	S80 I81	S80-G84 WeakPolarHBondContact O-CA 3.34Å; S80-G84 PolarHBondContact O-N 3.14Å; I81-G84 PolarHBondContact O-N 3.12Å
85	K	85.5	Confident	88.6	Confident	150 Å²	150	63.6 Å²	63.6	65%	0.652	34%	0.337	S	S	*	.	S	Bend	trans	-145.3	146.3	178.5	-66.7	-168.6	177.5	-167.5	0	110.4	S80 Y83 I87	S80-K85 WeakPolarHBondContact CA-O 3.4Å; S80-K85 VanDerWaalsContact CB-O 3.28Å; S80-K85 WeakPolarHBondContact CB-O 3.33Å; S80-K85 PolarHBondContact O-N 3.16Å; S80-K85 PolarHBondContact OG-O 3.18Å; Y83-K85 VanDerWaalsContact C-N 3.28Å; Y83-K85 PolarHBondContact O-N 2.74Å; K85-I87 PolarHBondContact O-N 2.64Å
86	P	84	Confident	89.3	Confident	58 Å²	58	60 Å²	60	38%	0.377	32%	0.319	S	S	.	.			trans	-59.6	124	172.4	-22.9	34.2	0	0	0	111.5	I75	I75-P86 HydrophobicContact CD1-CB 4.18Å
87	I	87.4	Confident	89.9	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	32%	0.319	C	S	.	.			trans	-115	118.6	175.7	-64.4	166.4	0	0	0	107.6	I75 L76 P79 S80 Y83 K85 I199	I75-I87 CarbonylContact C-O 3.38Å; I75-I87 WeakPolarHBondContact CA-O 3.45Å; I75-I87 WeakPolarHBondContact CG2-O 3.37Å; L76-I87 HydrophobicContact CB-CG2 4.43Å; L76-I87 HydrophobicContact CD1-CG2 4.14Å; L76-I87 PolarHBondContact N-O 2.8Å; P79-I87 HydrophobicContact CB-CD1 3.7Å; S80-I87 PolarHBondContact OG-N 2.75Å; Y83-I87 HydrophobicContact CD2-CD1 3.71Å; Y83-I87 HydrophobicContact CG-CD1 4.35Å; K85-I87 PolarHBondContact O-N 2.64Å; I87-I199 HydrophobicContact CB-CG2 4.34Å; I87-I199 HydrophobicContact CD1-CD1 4.21Å; I87-I199 HydrophobicContact CD1-CG1 4.33Å; I87-I199 HydrophobicContact CD1-CG2 3.45Å; I87-I199 VanDerWaalsContact CD1-CG2 3.45Å; I87-I199 HydrophobicContact CG1-CG2 3.58Å; I87-I199 HydrophobicContact CG2-CG2 3.79Å
88	P	87.5	Confident	90.5	Very high	7 Å²	7	54.2 Å²	54.2	5%	0.045	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-70.5	144.8	177.2	31	-30	0	0	0	109.9	W67 I90 H287	W67-P88 HydrophobicContact CH2-CG 4.14Å; W67-P88 HydrophobicContact CZ2-CB 4.34Å; W67-P88 HydrophobicContact CZ2-CG 3.8Å; P88-I90 HydrophobicContact CG-CD1 4.45Å; P88-I90 PolarHBondContact O-N 2.93Å; P88-H287 WeakPolarHBondContact CD-CD2 3.24Å; P88-H287 HydrophobicContact CG-CB 4.27Å
89	K	86.8	Confident	90.9	Very high	79 Å²	79	51.1 Å²	51.1	34%	0.343	27%	0.272	S	S	.	.			trans	-68.9	128.7	166.3	-175.2	-178	178.8	-163.2	0	108.1	E73 P74 L76	E73-K89 VanDerWaalsContact CB-O 3.29Å; E73-K89 WeakPolarHBondContact CB-O 3.29Å; P74-K89 HydrophobicContact CG-CB 4.16Å; P74-K89 HydrophobicContact CG-CD 4.06Å; P74-K89 WeakPolarHBondContact O-CB 3.28Å; P74-K89 PolarHBondContact O-N 2.86Å; L76-K89 HydrophobicContact CD2-CB 3.92Å; L76-K89 HydrophobicContact CD2-CG 3.95Å; L76-K89 HydrophobicContact CG-CB 3.99Å; L76-K89 HydrophobicContact CG-CG 4.45Å
90	I	90.3	Very high	91.4	Very high	15 Å²	15	53.2 Å²	53.2	8%	0.077	28%	0.282	C	S	.	.			trans	-88.1	112.4	172.2	-54.6	-51.9	0	0	0	107.3	P88 L121 L195 V344 F346	P88-I90 HydrophobicContact CG-CD1 4.45Å; P88-I90 PolarHBondContact O-N 2.93Å; I90-L121 HydrophobicContact CB-CD1 3.84Å; I90-L121 HydrophobicContact CG2-CD1 4.17Å; I90-L195 HydrophobicContact CG1-CD2 4.06Å; I90-V344 HydrophobicContact CG2-CG1 4.13Å; I90-F346 HydrophobicContact CD1-CD1 3.95Å; I90-F346 HydrophobicContact CG1-CD1 4.2Å
91	S	89.5	Confident	91.9	Very high	7 Å²	7	56 Å²	56	5%	0.049	30%	0.296	C	S	.	.			trans	-90.3	132.6	-178.3	-134.7	0	0	0	0	112	E73 E93 N94	E73-S91 VanDerWaalsContact CD-CB 3.46Å; E73-S91 WeakPolarHBondContact OE1-CB 3.17Å; S91-E93 VanDerWaalsContact C-N 3.3Å; S91-E93 VanDerWaalsContact CB-CD 3.43Å; S91-E93 VanDerWaalsContact CB-OE1 3.28Å; S91-E93 WeakPolarHBondContact CB-OE1 3.45Å; S91-E93 PolarHBondContact O-N 2.77Å; S91-E93 PolarHBondContact OG-OE1 2.79Å; S91-E93 PolarHBondContact OG-OE2 2.69Å; S91-N94 PolarHBondContact O-N 2.92Å
92	L	94.4	Very high	92.2	Very high	35 Å²	35	50.9 Å²	50.9	18%	0.183	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-74.2	-21.8	-174.7	-63.5	-179.5	0	0	0	112.3	N94 V95 F113 Q115 L121 F123	L92-N94 PolarHBondContact O-N 2.81Å; L92-V95 HydrophobicContact CD2-CG2 4.16Å; L92-V95 WeakPolarHBondContact O-CB 3.32Å; L92-V95 PolarHBondContact O-N 2.79Å; L92-V95 VanDerWaalsContact O-N 3.15Å; L92-F113 HydrophobicContact CB-CD2 4.37Å; L92-F113 HydrophobicContact CB-CE2 4.49Å; L92-F113 HydrophobicContact CD2-CD2 4.31Å; L92-Q115 HydrophobicContact CD1-CB 3.92Å; L92-L121 HydrophobicContact CD1-CD2 4.49Å; L92-L121 HydrophobicContact CD2-CD1 4.42Å; L92-L121 HydrophobicContact CD2-CD2 4.34Å; L92-F123 HydrophobicContact CD2-CE1 3.76Å; L92-F123 HydrophobicContact CD2-CZ 4.09Å
93	E	92.6	Very high	92.5	Very high	141 Å²	141	51.7 Å²	51.7	66%	0.659	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-62.6	-22.9	173.1	59.4	-94.2	-159.3	0	0	113.7	S91	S91-E93 VanDerWaalsContact C-N 3.3Å; S91-E93 VanDerWaalsContact CB-CD 3.43Å; S91-E93 VanDerWaalsContact CB-OE1 3.28Å; S91-E93 WeakPolarHBondContact CB-OE1 3.45Å; S91-E93 PolarHBondContact O-N 2.77Å; S91-E93 PolarHBondContact OG-OE1 2.79Å; S91-E93 PolarHBondContact OG-OE2 2.69Å
94	N	92.8	Very high	92.9	Very high	56 Å²	56	54 Å²	54	30%	0.299	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-91.5	-2	179.8	-59.6	-33	0	0	0	112.1	E73 S91 L92 G96 P319 P345	E73-N94 PolarHBondContact OE1-ND2 2.89Å; S91-N94 PolarHBondContact O-N 2.92Å; L92-N94 PolarHBondContact O-N 2.81Å; N94-G96 PolarHBondContact O-N 3Å; N94-P319 VanDerWaalsContact O-CB 3.29Å; N94-P319 WeakPolarHBondContact O-CB 3.28Å; N94-P319 WeakPolarHBondContact O-CG 3.29Å; N94-P345 HydrophobicContact CB-CG 3.83Å
95	V	97.4	Very high	93.4	Very high	12 Å²	12	61.1 Å²	61.1	7%	0.073	30%	0.3	C	S	.	.			trans	-71	124.3	176.3	176.7	0	0	0	0	108.9	L92 F113 F123 V342 V344	L92-V95 HydrophobicContact CD2-CG2 4.16Å; L92-V95 WeakPolarHBondContact O-CB 3.32Å; L92-V95 PolarHBondContact O-N 2.79Å; L92-V95 VanDerWaalsContact O-N 3.15Å; V95-F113 HydrophobicContact CB-CD2 4.19Å; V95-F113 HydrophobicContact CB-CE1 4.39Å; V95-F113 HydrophobicContact CB-CE2 3.95Å; V95-F113 HydrophobicContact CB-CG 4.5Å; V95-F113 HydrophobicContact CB-CZ 4.06Å; V95-F113 HydrophobicContact CG1-CD1 3.77Å; V95-F113 HydrophobicContact CG1-CD2 4.17Å; V95-F113 HydrophobicContact CG1-CE1 3.76Å; V95-F113 HydrophobicContact CG1-CE2 4.14Å; V95-F113 HydrophobicContact CG1-CG 3.98Å; V95-F113 HydrophobicContact CG1-CZ 3.94Å; V95-F113 HydrophobicContact CG2-CD2 4.35Å; V95-F113 HydrophobicContact CG2-CE2 4.5Å; V95-F123 HydrophobicContact CG2-CE1 4.06Å; V95-V342 HydrophobicContact CG1-CG1 3.8Å; V95-V344 HydrophobicContact CG1-CG2 4.25Å; V95-V344 HydrophobicContact CG2-CG1 4.36Å; V95-V344 HydrophobicContact CG2-CG2 4.41Å
96	G	98.2	Very high	94	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	141.4	174.5	0	0	0	0	0	111.3	N94 P319 V342 V343	N94-G96 PolarHBondContact O-N 3Å; G96-P319 WeakPolarHBondContact CA-O 3.12Å; G96-V342 CarbonylContact O-C 3.58Å; G96-V342 WeakPolarHBondContact O-CA 3.23Å; G96-V343 PolarHBondContact N-O 2.72Å; G96-V343 PolarHBondContact O-N 2.93Å
97	C	98.4	Very high	94.7	Very high	31 Å²	31	57.9 Å²	57.9	21%	0.209	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	146.6	174	58.2	0	0	0	0	111.1	F111 F113 H324 A341 V342	C97-F111 HydrophobicContact CB-CD2 4.02Å; C97-F111 HydrophobicContact CB-CE2 3.5Å; C97-F111 VanDerWaalsContact CB-CE2 3.5Å; C97-F111 HydrophobicContact CB-CZ 3.95Å; C97-F111 WeakPolarHBondContact SG-CE2 3.41Å; C97-F113 HydrophobicContact CB-CE1 4.36Å; C97-H324 PolarHBondContact O-CE1 3.36Å; C97-A341 VanDerWaalsContact CA-O 3.29Å; C97-A341 WeakPolarHBondContact CA-O 3.37Å; C97-V342 HydrophobicContact CB-CG2 4.28Å
98	A	98.7	Very high	95.2	Very high	6 Å²	6	59.3 Å²	59.3	5%	0.05	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141	173	0	0	0	0	0	108.8	A323 T327 T340 A341	A98-A323 HydrophobicContact CB-CB 4.04Å; A98-T327 HydrophobicContact CB-CG2 3.93Å; A98-T327 WeakPolarHBondContact CB-OG1 3.14Å; A98-T340 CarbonylContact O-C 3.43Å; A98-T340 VanDerWaalsContact O-CA 3.29Å; A98-T340 WeakPolarHBondContact O-CA 3.49Å; A98-A341 PolarHBondContact N-O 3.19Å; A98-A341 PolarHBondContact O-N 2.83Å
99	S	98.6	Very high	95.8	Very high	34 Å²	34	59.1 Å²	59.1	24%	0.238	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	118	173.7	-177.8	0	0	0	0	108.8	N107 S339 T340	S99-N107 PolarHBondContact OG-ND2 2.88Å; S99-S339 WeakPolarHBondContact CA-O 3.48Å; S99-T340 VanDerWaalsContact CB-OG1 3.28Å; S99-T340 WeakPolarHBondContact CB-OG1 3.21Å; S99-T340 PolarHBondContact OG-OG1 2.65Å
100	L	98.3	Very high	96.3	Very high	58 Å²	58	57.9 Å²	57.9	30%	0.304	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.5	-178.1	-58.4	-179.9	0	0	0	109.5	G102 I331 N338 S339	L100-G102 VanDerWaalsContact C-N 3.27Å; L100-G102 PolarHBondContact O-N 2.69Å; L100-I331 HydrophobicContact CB-CD1 3.68Å; L100-I331 HydrophobicContact CD1-CD1 3.42Å; L100-I331 VanDerWaalsContact CD1-CD1 3.42Å; L100-I331 HydrophobicContact CG-CD1 4.18Å; L100-N338 WeakPolarHBondContact O-CA 3.13Å; L100-S339 PolarHBondContact N-O 3.14Å; L100-S339 PolarHBondContact O-N 3.25Å
101	I	97.8	Very high	96.7	Very high	73 Å²	73	59.8 Å²	59.8	37%	0.374	29%	0.289	S	S	.	.			trans	-68.1	-22.4	-175.7	-170.3	167.8	0	0	0	113.9	R104 N107 N338	I101-R104 HydrophobicContact CG1-CB 4.41Å; I101-R104 PolarHBondContact O-N 2.91Å; I101-N107 HydrophobicContact CB-CB 4.17Å; I101-N107 HydrophobicContact CD1-CB 4.31Å; I101-N107 HydrophobicContact CG1-CB 4.01Å; I101-N338 PolarHBondContact O-ND2 2.66Å
102	G	95.2	Very high	97.2	Very high	27 Å²	27	60.9 Å²	60.9	28%	0.278	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	-136.8	-173.9	0	0	0	0	0	112	L100	L100-G102 VanDerWaalsContact C-N 3.27Å; L100-G102 PolarHBondContact O-N 2.69Å
103	K	95.6	Very high	97.4	Very high	150 Å²	150	62 Å²	62	65%	0.652	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	12.5	176.9	-60.2	-173.3	-167	165.3	0	112.9	E336	K103-E336 HydrophobicContact CB-CB 4.24Å; K103-E336 HydrophobicContact CD-CB 4.39Å; K103-E336 HydrophobicContact CD-CG 4.04Å; K103-E336 PolarHBondContact N-O 3.1Å; K103-E336 IonicContact NZ-OE1 2.83Å; K103-E336 PolarHBondContact NZ-OE1 2.78Å
104	R	96.4	Very high	97.6	Very high	124 Å²	124	56 Å²	56	47%	0.468	27%	0.272	S	S	.	.	S	Bend	trans	-74	160.5	175.3	-61.3	-61	-165.2	146.3	-4.5	110.9	I101 E106 D337 N338	I101-R104 HydrophobicContact CG1-CB 4.41Å; I101-R104 PolarHBondContact O-N 2.91Å; R104-E106 VanDerWaalsContact CB-O 3.31Å; R104-E106 WeakPolarHBondContact CB-O 3.37Å; R104-D337 IonicContact CZ-OD1 3.88Å; R104-D337 VanDerWaalsContact CZ-OD1 3.25Å; R104-D337 IonicContact CZ-OD2 3.78Å; R104-D337 IonicContact NE-OD1 2.98Å; R104-D337 PolarHBondContact NE-OD1 3.47Å; R104-D337 IonicContact NE-OD2 3.22Å; R104-D337 IonicContact NH2-OD1 3.89Å; R104-D337 PolarHBondContact NH2-OD1 3.15Å; R104-D337 VanDerWaalsContact NH2-OD1 3.13Å; R104-D337 IonicContact NH2-OD2 3.61Å; R104-D337 PolarHBondContact NH2-OD2 3.09Å; R104-N338 WeakPolarHBondContact CB-ND2 3.38Å
105	K	96.9	Very high	97.9	Very high	216 Å²	216	58.1 Å²	58.1	94%	0.939	28%	0.28	S	S	*	.	S	Bend	trans	-76.1	-32.2	175.6	-68.3	-178.4	-179.3	175.6	0	112.4
106	E	97.3	Very high	97.9	Very high	101 Å²	101	58.2 Å²	58.2	47%	0.472	28%	0.28	S	S	.	.	S	Bend	trans	-134.1	152.9	-178	-172.9	161.8	-163.8	0	0	108.4	R104 N338	R104-E106 VanDerWaalsContact CB-O 3.31Å; R104-E106 WeakPolarHBondContact CB-O 3.37Å; E106-N338 PolarHBondContact O-ND2 3.22Å; E106-N338 VanDerWaalsContact O-ND2 3.12Å; E106-N338 PolarHBondContact O-OD1 3.05Å
107	N	98.3	Very high	97.7	Very high	39 Å²	39	60.5 Å²	60.5	21%	0.209	29%	0.294	C	S	.	.			trans	-95.7	106.4	169.4	-168.1	-4	0	0	0	107.9	S99 I101 D109 R110 N338	S99-N107 PolarHBondContact OG-ND2 2.88Å; I101-N107 HydrophobicContact CB-CB 4.17Å; I101-N107 HydrophobicContact CD1-CB 4.31Å; I101-N107 HydrophobicContact CG1-CB 4.01Å; N107-D109 WeakPolarHBondContact OD1-CB 3.45Å; N107-D109 PolarHBondContact OD1-N 3.45Å; N107-R110 PolarHBondContact O-NH1 2.96Å; N107-N338 WeakPolarHBondContact OD1-CB 3.4Å; N107-N338 VanDerWaalsContact OD1-CG 3.31Å; N107-N338 PolarHBondContact OD1-OD1 2.83Å
108	E	98.6	Very high	97.4	Very high	34 Å²	34	67 Å²	67	16%	0.159	32%	0.321	C	S	.	.			trans	-90.1	-8.6	-179.7	-59.6	-175.2	115.6	0	0	111.6	G128 G131 P132 A135 N338	E108-G128 WeakPolarHBondContact CB-O 3.37Å; E108-G128 PolarHBondContact O-N 2.83Å; E108-G131 WeakPolarHBondContact OE1-CA 3.35Å; E108-G131 PolarHBondContact OE1-N 2.88Å; E108-P132 HydrophobicContact CG-CB 4.48Å; E108-A135 WeakPolarHBondContact O-CB 3.43Å; E108-N338 PolarHBondContact N-OD1 3.09Å
109	D	98.8	Very high	97.2	Very high	4 Å²	4	71 Å²	71	2%	0.021	34%	0.339	C	S	.	.			trans	-69.9	139.9	174.1	-74.8	-10.3	0	0	0	112	N107 Y126 D127 T297 N338 T340	N107-D109 WeakPolarHBondContact OD1-CB 3.45Å; N107-D109 PolarHBondContact OD1-N 3.45Å; D109-Y126 CarbonylContact C-O 3.49Å; D109-Y126 WeakPolarHBondContact CA-O 3.41Å; D109-D127 WeakPolarHBondContact OD1-CA 3.43Å; D109-T297 PolarHBondContact OD2-OG1 3.21Å; D109-N338 HydrophobicContact CB-CB 4.34Å; D109-N338 WeakPolarHBondContact OD2-CB 3.4Å; D109-T340 WeakPolarHBondContact CB-OG1 3.45Å; D109-T340 VanDerWaalsContact CG-OG1 3.25Å; D109-T340 WeakPolarHBondContact OD2-CB 3.09Å; D109-T340 PolarHBondContact OD2-N 2.95Å; D109-T340 PolarHBondContact OD2-OG1 2.8Å
110	R	98.9	Very high	97.2	Very high	52 Å²	52	69.7 Å²	69.7	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.8	167.6	-58.9	-64.1	179.3	-84.7	-9.3	110	N107 V125 Y126 A135 D136 H139	N107-R110 PolarHBondContact O-NH1 2.96Å; R110-V125 CarbonylContact O-C 3.52Å; R110-V125 WeakPolarHBondContact O-CA 3.35Å; R110-Y126 HydrophobicContact CB-CD2 4.18Å; R110-Y126 PolarHBondContact N-O 3.18Å; R110-Y126 PolarHBondContact O-N 2.73Å; R110-A135 HydrophobicContact CG-CB 4Å; R110-D136 IonicContact CZ-OD1 2.65Å; R110-D136 IonicContact NE-OD1 2.76Å; R110-D136 PolarHBondContact NE-OD1 3.36Å; R110-D136 IonicContact NH2-OD1 3.19Å; R110-D136 PolarHBondContact NH2-OD1 3.41Å; R110-D136 IonicContact NH2-OD2 3.68Å; R110-D136 PolarHBondContact NH2-OD2 2.95Å; R110-H139 HydrophobicContact CB-CB 3.98Å; R110-H139 HydrophobicContact CG-CB 4.26Å
111	F	98.8	Very high	97.2	Very high	56 Å²	56	67.8 Å²	67.8	25%	0.246	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	152.3	173	65	-89.5	0	0	0	109.4	C97 F113 A124 V125 H139 T340 V342	C97-F111 HydrophobicContact CB-CD2 4.02Å; C97-F111 HydrophobicContact CB-CE2 3.5Å; C97-F111 VanDerWaalsContact CB-CE2 3.5Å; C97-F111 HydrophobicContact CB-CZ 3.95Å; C97-F111 WeakPolarHBondContact SG-CE2 3.41Å; F111-F113 HydrophobicContact CE2-CE1 4.48Å; F111-A124 CarbonylContact C-O 3.6Å; F111-A124 WeakPolarHBondContact CA-O 3.23Å; F111-A124 WeakPolarHBondContact CB-O 3.2Å; F111-V125 HydrophobicContact CB-CG1 3.95Å; F111-H139 PolarHBondContact O-CD2 3.26Å; F111-H139 PolarHBondContact O-NE2 3.41Å; F111-T340 HydrophobicContact CB-CG2 4.1Å; F111-T340 HydrophobicContact CD1-CG2 3.65Å; F111-T340 HydrophobicContact CE1-CG2 4.48Å; F111-T340 HydrophobicContact CG-CG2 4.15Å; F111-V342 HydrophobicContact CB-CG2 3.79Å; F111-V342 HydrophobicContact CD2-CG2 3.94Å; F111-V342 HydrophobicContact CG-CG2 4.01Å
112	E	98.4	Very high	97.2	Very high	29 Å²	29	64.3 Å²	64.3	14%	0.136	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149.3	176.1	-166.4	-178	-162.8	0	0	110	Y122 F123 A124 K143	E112-Y122 HydrophobicContact CB-CE1 4.04Å; E112-Y122 HydrophobicContact CG-CE1 4.18Å; E112-F123 CarbonylContact O-C 3.57Å; E112-F123 WeakPolarHBondContact O-CA 3.44Å; E112-A124 PolarHBondContact N-O 2.83Å; E112-A124 PolarHBondContact O-N 3.32Å; E112-K143 IonicContact OE1-NZ 2.97Å; E112-K143 PolarHBondContact OE1-NZ 3.24Å
113	F	98.5	Very high	97.4	Very high	58 Å²	58	63 Å²	63	25%	0.254	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	142.8	165.6	53.8	-91	0	0	0	110.1	L92 V95 C97 F111 Y122 F123 V342	L92-F113 HydrophobicContact CB-CD2 4.37Å; L92-F113 HydrophobicContact CB-CE2 4.49Å; L92-F113 HydrophobicContact CD2-CD2 4.31Å; V95-F113 HydrophobicContact CB-CD2 4.19Å; V95-F113 HydrophobicContact CB-CE1 4.39Å; V95-F113 HydrophobicContact CB-CE2 3.95Å; V95-F113 HydrophobicContact CB-CG 4.5Å; V95-F113 HydrophobicContact CB-CZ 4.06Å; V95-F113 HydrophobicContact CG1-CD1 3.77Å; V95-F113 HydrophobicContact CG1-CD2 4.17Å; V95-F113 HydrophobicContact CG1-CE1 3.76Å; V95-F113 HydrophobicContact CG1-CE2 4.14Å; V95-F113 HydrophobicContact CG1-CG 3.98Å; V95-F113 HydrophobicContact CG1-CZ 3.94Å; V95-F113 HydrophobicContact CG2-CD2 4.35Å; V95-F113 HydrophobicContact CG2-CE2 4.5Å; C97-F113 HydrophobicContact CB-CE1 4.36Å; F111-F113 HydrophobicContact CE2-CE1 4.48Å; F113-Y122 CarbonylContact C-O 3.58Å; F113-Y122 WeakPolarHBondContact CA-O 3.38Å; F113-Y122 WeakPolarHBondContact CB-O 3.12Å; F113-F123 HydrophobicContact CB-CD1 3.48Å; F113-F123 VanDerWaalsContact CB-CD1 3.48Å; F113-F123 HydrophobicContact CB-CE1 4.06Å; F113-F123 HydrophobicContact CB-CG 4.36Å; F113-F123 HydrophobicContact CG-CD1 4.46Å; F113-V342 HydrophobicContact CD1-CG1 4.38Å
114	A	98.2	Very high	97.6	Very high	17 Å²	17	55.9 Å²	55.9	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	157.4	-175.9	0	0	0	0	0	111.1	L116 Y122 K143	A114-L116 HydrophobicContact CB-CD2 4.38Å; A114-Y122 HydrophobicContact CB-CD1 4.39Å; A114-Y122 PolarHBondContact N-O 3.3Å; A114-Y122 PolarHBondContact O-N 2.81Å; A114-K143 HydrophobicContact CB-CD 4Å
115	Q	98	Very high	97.7	Very high	100 Å²	100	50 Å²	50	47%	0.467	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.6	165.1	179.1	168.6	-8.9	0	0	108	L92 T117 L121	L92-Q115 HydrophobicContact CD1-CB 3.92Å; Q115-T117 WeakPolarHBondContact CG-O 3.47Å; Q115-T117 PolarHBondContact NE2-O 3.49Å; Q115-L121 HydrophobicContact CB-CD2 3.73Å; Q115-L121 HydrophobicContact CG-CD2 3.78Å
116	L	97.1	Very high	97.8	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.073	19%	0.191	C	C	.	.			trans	-84.4	-44.8	-177.8	-57.5	-166.5	0	0	0	111.7	A114 V120 Y122 K143 V146 M147 L150 L194	A114-L116 HydrophobicContact CB-CD2 4.38Å; L116-V120 HydrophobicContact CB-CB 4.42Å; L116-V120 HydrophobicContact CB-CG1 4.41Å; L116-V120 HydrophobicContact CD1-CG1 4.25Å; L116-V120 PolarHBondContact N-O 3.02Å; L116-Y122 HydrophobicContact CD1-CG 4.37Å; L116-Y122 HydrophobicContact CD2-CG 4.2Å; L116-Y122 HydrophobicContact CG-CG 4.44Å; L116-K143 HydrophobicContact CD2-CD 3.93Å; L116-K143 HydrophobicContact CD2-CG 3.54Å; L116-V146 HydrophobicContact CD1-CB 4.23Å; L116-V146 HydrophobicContact CD1-CG1 3.59Å; L116-M147 HydrophobicContact CB-CG 4.13Å; L116-M147 HydrophobicContact CD1-CG 4.36Å; L116-M147 HydrophobicContact CD2-CG 4.19Å; L116-M147 HydrophobicContact CD2-SD 4.39Å; L116-M147 HydrophobicContact CG-CG 4.47Å; L116-L150 HydrophobicContact CB-CD1 4.36Å; L116-L150 HydrophobicContact CD1-CD1 4.17Å; L116-L194 HydrophobicContact CD1-CD2 4.09Å
117	T	95.9	Very high	97.9	Very high	47 Å²	47	35.4 Å²	35.4	29%	0.288	17%	0.171	S	C	.	.	S	Bend	trans	-136.7	-179	175.8	74.3	0	0	0	0	109.5	Q115 E119 V120 L150	Q115-T117 WeakPolarHBondContact CG-O 3.47Å; Q115-T117 PolarHBondContact NE2-O 3.49Å; T117-E119 WeakPolarHBondContact CB-OE2 3.48Å; T117-E119 PolarHBondContact O-N 2.88Å; T117-E119 PolarHBondContact OG1-N 2.76Å; T117-E119 PolarHBondContact OG1-OE2 2.89Å; T117-V120 PolarHBondContact N-O 3.09Å; T117-V120 PolarHBondContact OG1-N 2.91Å; T117-L150 HydrophobicContact CG2-CD1 4.12Å
118	E	91.6	Very high	97.9	Very high	167 Å²	167	33.7 Å²	33.7	78%	0.78	16%	0.162	S	C	*	.	S	Bend	trans	-61.6	-27.4	172.9	-66.6	-170.7	178.4	0	0	112.3
119	E	94.2	Very high	97.9	Very high	92 Å²	92	33.7 Å²	33.7	43%	0.43	16%	0.162	S	C	.	.	S	Bend	trans	-100.2	-25.9	-176.1	-49.4	78.6	-172.2	0	0	113.8	T117 R196 D197	T117-E119 WeakPolarHBondContact CB-OE2 3.48Å; T117-E119 PolarHBondContact O-N 2.88Å; T117-E119 PolarHBondContact OG1-N 2.76Å; T117-E119 PolarHBondContact OG1-OE2 2.89Å; E119-R196 HydrophobicContact CB-CG 4.44Å; E119-R196 CarbonylContact O-C 3.51Å; E119-R196 VanDerWaalsContact O-CA 3.25Å; E119-R196 WeakPolarHBondContact O-CA 3.42Å; E119-D197 PolarHBondContact O-N 3.41Å
120	V	98.1	Very high	97.7	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.036	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.2	-168.4	-176.3	0	0	0	0	111.7	L116 T117 L150 L194 L195 R196	L116-V120 HydrophobicContact CB-CB 4.42Å; L116-V120 HydrophobicContact CB-CG1 4.41Å; L116-V120 HydrophobicContact CD1-CG1 4.25Å; L116-V120 PolarHBondContact N-O 3.02Å; T117-V120 PolarHBondContact N-O 3.09Å; T117-V120 PolarHBondContact OG1-N 2.91Å; V120-L150 HydrophobicContact CB-CD1 4.37Å; V120-L150 HydrophobicContact CG1-CD1 4.29Å; V120-L150 HydrophobicContact CG2-CD1 4.35Å; V120-L150 HydrophobicContact CG2-CD2 4.36Å; V120-L194 HydrophobicContact CG1-CB 4.38Å; V120-L194 HydrophobicContact CG1-CD2 4.21Å; V120-L195 WeakPolarHBondContact CA-O 3.44Å; V120-R196 HydrophobicContact CG2-CB 4.24Å; V120-R196 HydrophobicContact CG2-CG 4.16Å
121	L	98.6	Very high	97.6	Very high	18 Å²	18	34.1 Å²	34.1	9%	0.094	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	150.8	165.4	-54.9	179.4	0	0	0	110.5	I90 L92 Q115 F123 L194 L195	I90-L121 HydrophobicContact CB-CD1 3.84Å; I90-L121 HydrophobicContact CG2-CD1 4.17Å; L92-L121 HydrophobicContact CD1-CD2 4.49Å; L92-L121 HydrophobicContact CD2-CD1 4.42Å; L92-L121 HydrophobicContact CD2-CD2 4.34Å; Q115-L121 HydrophobicContact CB-CD2 3.73Å; Q115-L121 HydrophobicContact CG-CD2 3.78Å; L121-F123 HydrophobicContact CB-CE2 3.76Å; L121-F123 HydrophobicContact CB-CZ 3.8Å; L121-F123 HydrophobicContact CD1-CZ 4.09Å; L121-L194 CarbonylContact O-C 3.57Å; L121-L194 WeakPolarHBondContact O-CA 3.49Å; L121-L195 HydrophobicContact CB-CB 4.29Å; L121-L195 HydrophobicContact CD1-CD2 4.4Å; L121-L195 PolarHBondContact N-O 2.93Å; L121-L195 PolarHBondContact O-N 2.83Å
122	Y	98.8	Very high	97.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.9	-178.4	160.2	-89.3	0	0	0	110.2	E112 F113 A114 L116 A124 Y126 M142 V192 A193 L194	E112-Y122 HydrophobicContact CB-CE1 4.04Å; E112-Y122 HydrophobicContact CG-CE1 4.18Å; F113-Y122 CarbonylContact C-O 3.58Å; F113-Y122 WeakPolarHBondContact CA-O 3.38Å; F113-Y122 WeakPolarHBondContact CB-O 3.12Å; A114-Y122 HydrophobicContact CB-CD1 4.39Å; A114-Y122 PolarHBondContact N-O 3.3Å; A114-Y122 PolarHBondContact O-N 2.81Å; L116-Y122 HydrophobicContact CD1-CG 4.37Å; L116-Y122 HydrophobicContact CD2-CG 4.2Å; L116-Y122 HydrophobicContact CG-CG 4.44Å; Y122-A124 HydrophobicContact CE1-CB 4.14Å; Y122-A124 HydrophobicContact CE2-CB 4.03Å; Y122-A124 WeakPolarHBondContact OH-CB 3.46Å; Y122-Y126 PolarHBondContact OH-OH 3.04Å; Y122-M142 HydrophobicContact CE2-CG 4.1Å; Y122-V192 HydrophobicContact CD2-CG1 3.73Å; Y122-V192 HydrophobicContact CE2-CG1 3.48Å; Y122-V192 VanDerWaalsContact CE2-CG1 3.48Å; Y122-A193 WeakPolarHBondContact CA-O 3.37Å; Y122-L194 HydrophobicContact CD2-CD2 3.89Å; Y122-L194 HydrophobicContact CG-CD2 4.43Å
123	F	98.9	Very high	97.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	137	175.7	-46	-87.2	0	0	0	108.6	L92 V95 E112 F113 L121 V192 A193 L195 L295 V344	L92-F123 HydrophobicContact CD2-CE1 3.76Å; L92-F123 HydrophobicContact CD2-CZ 4.09Å; V95-F123 HydrophobicContact CG2-CE1 4.06Å; E112-F123 CarbonylContact O-C 3.57Å; E112-F123 WeakPolarHBondContact O-CA 3.44Å; F113-F123 HydrophobicContact CB-CD1 3.48Å; F113-F123 VanDerWaalsContact CB-CD1 3.48Å; F113-F123 HydrophobicContact CB-CE1 4.06Å; F113-F123 HydrophobicContact CB-CG 4.36Å; F113-F123 HydrophobicContact CG-CD1 4.46Å; L121-F123 HydrophobicContact CB-CE2 3.76Å; L121-F123 HydrophobicContact CB-CZ 3.8Å; L121-F123 HydrophobicContact CD1-CZ 4.09Å; F123-V192 CarbonylContact O-C 3.59Å; F123-V192 WeakPolarHBondContact O-CA 3.36Å; F123-A193 HydrophobicContact CB-CB 4.36Å; F123-A193 HydrophobicContact CD2-CB 4.41Å; F123-A193 PolarHBondContact N-O 2.74Å; F123-A193 PolarHBondContact O-N 2.94Å; F123-L195 HydrophobicContact CE2-CB 4.29Å; F123-L295 HydrophobicContact CB-CD1 3.98Å; F123-V344 HydrophobicContact CD1-CG1 4.4Å; F123-V344 HydrophobicContact CD1-CG2 3.41Å; F123-V344 VanDerWaalsContact CD1-CG2 3.41Å; F123-V344 HydrophobicContact CD2-CG2 4.47Å; F123-V344 HydrophobicContact CE1-CB 4.33Å; F123-V344 HydrophobicContact CE1-CG1 3.74Å; F123-V344 HydrophobicContact CE1-CG2 3.59Å; F123-V344 HydrophobicContact CE2-CG1 4.28Å; F123-V344 HydrophobicContact CG-CG2 3.92Å; F123-V344 HydrophobicContact CZ-CG1 3.67Å; F123-V344 HydrophobicContact CZ-CG2 4.19Å
124	A	98.9	Very high	97.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	150.6	-179	0	0	0	0	0	113	F111 E112 Y122 Y126 T191 V192	F111-A124 CarbonylContact C-O 3.6Å; F111-A124 WeakPolarHBondContact CA-O 3.23Å; F111-A124 WeakPolarHBondContact CB-O 3.2Å; E112-A124 PolarHBondContact N-O 2.83Å; E112-A124 PolarHBondContact O-N 3.32Å; Y122-A124 HydrophobicContact CE1-CB 4.14Å; Y122-A124 HydrophobicContact CE2-CB 4.03Å; Y122-A124 WeakPolarHBondContact OH-CB 3.46Å; A124-Y126 HydrophobicContact CB-CE1 4.44Å; A124-Y126 HydrophobicContact CB-CE2 3.67Å; A124-Y126 WeakPolarHBondContact CB-OH 3.46Å; A124-T191 VanDerWaalsContact CA-O 3.26Å; A124-T191 WeakPolarHBondContact CA-O 3.19Å; A124-V192 HydrophobicContact CB-CG2 3.97Å
125	V	98.9	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.8	163.7	-63.7	0	0	0	0	109.3	R110 F111 T191 L295 T297 T340 V342	R110-V125 CarbonylContact O-C 3.52Å; R110-V125 WeakPolarHBondContact O-CA 3.35Å; F111-V125 HydrophobicContact CB-CG1 3.95Å; V125-T191 PolarHBondContact N-O 3.21Å; V125-T191 PolarHBondContact O-N 3.23Å; V125-L295 HydrophobicContact CG1-CB 3.71Å; V125-L295 HydrophobicContact CG1-CD1 4.23Å; V125-L295 HydrophobicContact CG2-CB 3.96Å; V125-T297 HydrophobicContact CB-CG2 4.36Å; V125-T340 HydrophobicContact CG1-CG2 4.43Å; V125-V342 HydrophobicContact CG1-CG2 3.85Å
126	Y	98.9	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	114.3	179.7	-51.4	-75.6	0	0	0	107.7	D109 R110 Y122 A124 C138 H139 M142 T189 A190 V192	D109-Y126 CarbonylContact C-O 3.49Å; D109-Y126 WeakPolarHBondContact CA-O 3.41Å; R110-Y126 HydrophobicContact CB-CD2 4.18Å; R110-Y126 PolarHBondContact N-O 3.18Å; R110-Y126 PolarHBondContact O-N 2.73Å; Y122-Y126 PolarHBondContact OH-OH 3.04Å; A124-Y126 HydrophobicContact CB-CE1 4.44Å; A124-Y126 HydrophobicContact CB-CE2 3.67Å; A124-Y126 WeakPolarHBondContact CB-OH 3.46Å; Y126-C138 HydrophobicContact CD1-CB 3.54Å; Y126-C138 HydrophobicContact CD2-CB 4.36Å; Y126-C138 HydrophobicContact CE1-CB 3.54Å; Y126-C138 HydrophobicContact CE2-CB 4.35Å; Y126-C138 HydrophobicContact CG-CB 3.97Å; Y126-H139 HydrophobicContact CD2-CB 4.26Å; Y126-H139 HydrophobicContact CE2-CB 4.38Å; Y126-M142 HydrophobicContact CE1-CE 4.41Å; Y126-M142 VanDerWaalsContact OH-CB 3.24Å; Y126-M142 WeakPolarHBondContact OH-CB 3.5Å; Y126-M142 VanDerWaalsContact OH-CG 3.24Å; Y126-M142 WeakPolarHBondContact OH-CG 3.48Å; Y126-T189 WeakPolarHBondContact CA-O 3.49Å; Y126-A190 HydrophobicContact CD1-CB 3.69Å; Y126-A190 HydrophobicContact CE1-CB 3.72Å; Y126-V192 HydrophobicContact CE1-CG2 4.22Å
127	D	98.8	Very high	97.7	Very high	10 Å²	10	27 Å²	27	5%	0.053	16%	0.156	C	C	.	.			trans	-98.3	110.3	178.2	-172.2	-25.8	0	0	0	107.2	D109 T188 T189 T297 D298	D109-D127 WeakPolarHBondContact OD1-CA 3.43Å; D127-T188 VanDerWaalsContact C-OG1 3.23Å; D127-T188 PolarHBondContact N-OG1 3.04Å; D127-T188 CarbonylContact O-C 3.55Å; D127-T188 WeakPolarHBondContact O-CA 3.46Å; D127-T188 WeakPolarHBondContact O-CB 3.38Å; D127-T188 PolarHBondContact O-OG1 2.85Å; D127-T189 HydrophobicContact CB-CG2 3.82Å; D127-T189 WeakPolarHBondContact CB-OG1 3.33Å; D127-T189 PolarHBondContact N-OG1 3.03Å; D127-T189 PolarHBondContact O-N 2.83Å; D127-T297 HydrophobicContact CB-CG2 3.91Å; D127-T297 WeakPolarHBondContact OD2-CB 3.47Å; D127-D298 PolarHBondContact OD2-N 2.78Å
128	G	98.6	Very high	97.9	Very high	3 Å²	3	24.7 Å²	24.7	3%	0.031	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	148.6	-171.5	0	0	0	0	0	112.5	E108	E108-G128 WeakPolarHBondContact CB-O 3.37Å; E108-G128 PolarHBondContact O-N 2.83Å
129	H	98.2	Very high	98.2	Very high	34 Å²	34	19.6 Å²	19.6	16%	0.157	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	152.9	172.8	60.8	-100.5	0	0	0	111.9	G131 S186 G187 L258 D266	H129-G131 VanDerWaalsContact C-N 3.32Å; H129-S186 WeakPolarHBondContact O-CA 3.25Å; H129-G187 VanDerWaalsContact CE1-C 3.45Å; H129-G187 PolarHBondContact N-O 2.86Å; H129-G187 WeakPolarHBondContact NE2-CA 3.5Å; H129-G187 PolarHBondContact O-N 2.89Å; H129-L258 VanDerWaalsContact NE2-CD1 3.34Å; H129-L258 WeakPolarHBondContact NE2-CD1 3.46Å; H129-D266 IonicContact CD2-OD1 3.97Å; H129-D266 IonicContact CE1-OD2 2.74Å; H129-D266 PolarHBondContact CE1-OD2 2.9Å; H129-D266 VanDerWaalsContact CE1-OD2 3.29Å; H129-D266 IonicContact NE2-OD1 3.39Å; H129-D266 PolarHBondContact NE2-OD1 3.1Å; H129-D266 IonicContact NE2-OD2 2.79Å; H129-D266 PolarHBondContact NE2-OD2 2.7Å
130	G	96.4	Very high	98.4	Very high	42 Å²	42	19.3 Å²	19.3	43%	0.433	12%	0.122	S	C	.	.	S	Bend	trans	69.1	32.3	-179.2	0	0	0	0	0	112.7
131	G	96.9	Very high	98.4	Very high	23 Å²	23	22.7 Å²	22.7	24%	0.237	14%	0.138	C	C	.	.	S	Bend	trans	101.9	147.5	-170.6	0	0	0	0	0	111.1	E108 H129 A133 S186	E108-G131 WeakPolarHBondContact OE1-CA 3.35Å; E108-G131 PolarHBondContact OE1-N 2.88Å; H129-G131 VanDerWaalsContact C-N 3.32Å; G131-A133 PolarHBondContact O-N 2.84Å; G131-A133 VanDerWaalsContact O-N 3.14Å; G131-S186 PolarHBondContact O-OG 3.38Å
132	P	97.8	Very high	98.5	Very high	20 Å²	20	21.9 Å²	21.9	13%	0.13	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-3.7	-174.3	32.9	-39.3	0	0	0	113.9	E108 A134 A135 D136	E108-P132 HydrophobicContact CG-CB 4.48Å; P132-A134 PolarHBondContact O-N 3.06Å; P132-A135 PolarHBondContact O-N 3.47Å; P132-A135 VanDerWaalsContact O-N 3.09Å; P132-D136 WeakPolarHBondContact O-CB 3.15Å; P132-D136 PolarHBondContact O-N 3.02Å
133	A	98.3	Very high	98.4	Very high	23 Å²	23	25.2 Å²	25.2	19%	0.19	15%	0.148	C	C	.	.	H	α-helix	trans	-57.2	-42.6	-167.2	0	0	0	0	0	113.7	G131 F137 F171 L183	G131-A133 PolarHBondContact O-N 2.84Å; G131-A133 VanDerWaalsContact O-N 3.14Å; A133-F137 VanDerWaalsContact O-CB 3.23Å; A133-F137 WeakPolarHBondContact O-CB 3.33Å; A133-F137 PolarHBondContact O-N 2.94Å; A133-F171 HydrophobicContact CB-CE2 4.47Å; A133-L183 HydrophobicContact CB-CD1 4.28Å; A133-L183 HydrophobicContact CB-CG 3.98Å
134	A	98.6	Very high	98.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.3	-42	177.5	0	0	0	0	0	112.3	P132 F137 C138 F171 S186 T188	P132-A134 PolarHBondContact O-N 3.06Å; A134-F137 PolarHBondContact O-N 3.2Å; A134-C138 PolarHBondContact O-N 3.04Å; A134-C138 PolarHBondContact O-SG 2.75Å; A134-F171 HydrophobicContact CB-CE1 3.98Å; A134-F171 HydrophobicContact CB-CE2 4.03Å; A134-F171 HydrophobicContact CB-CZ 3.67Å; A134-S186 PolarHBondContact N-OG 3.4Å; A134-T188 HydrophobicContact CB-CG2 3.91Å
135	A	98.8	Very high	98.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-45.2	176.6	0	0	0	0	0	111.5	E108 R110 P132 F137 C138 H139 T188	E108-A135 WeakPolarHBondContact O-CB 3.43Å; R110-A135 HydrophobicContact CG-CB 4Å; P132-A135 PolarHBondContact O-N 3.47Å; P132-A135 VanDerWaalsContact O-N 3.09Å; A135-F137 VanDerWaalsContact C-N 3.33Å; A135-F137 PolarHBondContact O-N 2.78Å; A135-C138 PolarHBondContact O-N 3.06Å; A135-H139 WeakPolarHBondContact O-CB 3.37Å; A135-H139 PolarHBondContact O-N 2.64Å; A135-T188 WeakPolarHBondContact CB-OG1 3.29Å
136	D	98.8	Very high	98.3	Very high	56 Å²	56	31.7 Å²	31.7	30%	0.299	18%	0.178	S	C	.	.	H	α-helix	trans	-59.8	-41.7	174.5	-80.6	-35.9	0	0	0	112	R110 P132 T140	R110-D136 IonicContact CZ-OD1 2.65Å; R110-D136 IonicContact NE-OD1 2.76Å; R110-D136 PolarHBondContact NE-OD1 3.36Å; R110-D136 IonicContact NH2-OD1 3.19Å; R110-D136 PolarHBondContact NH2-OD1 3.41Å; R110-D136 IonicContact NH2-OD2 3.68Å; R110-D136 PolarHBondContact NH2-OD2 2.95Å; P132-D136 WeakPolarHBondContact O-CB 3.15Å; P132-D136 PolarHBondContact O-N 3.02Å; D136-T140 VanDerWaalsContact O-CB 3.31Å; D136-T140 WeakPolarHBondContact O-CB 3.37Å; D136-T140 PolarHBondContact O-N 2.78Å; D136-T140 PolarHBondContact O-OG1 3.26Å
137	F	98.7	Very high	98.2	Very high	25 Å²	25	35.6 Å²	35.6	11%	0.11	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-45.2	177.5	-168.9	-88	0	0	0	111.3	A133 A134 A135 T140 H141 I167 A170 F171 Y174	A133-F137 VanDerWaalsContact O-CB 3.23Å; A133-F137 WeakPolarHBondContact O-CB 3.33Å; A133-F137 PolarHBondContact O-N 2.94Å; A134-F137 PolarHBondContact O-N 3.2Å; A135-F137 VanDerWaalsContact C-N 3.33Å; A135-F137 PolarHBondContact O-N 2.78Å; F137-T140 PolarHBondContact O-N 2.92Å; F137-H141 AromaticContact CD1-CD2 3.85Å; F137-H141 AromaticContact CD2-CD2 3.54Å; F137-H141 AromaticContact CD2-NE2 3.88Å; F137-H141 HydrophobicContact CE1-CB 4.41Å; F137-H141 AromaticContact CE1-CD2 3.79Å; F137-H141 AromaticContact CE2-CD2 3.47Å; F137-H141 VanDerWaalsContact CE2-CD2 3.47Å; F137-H141 WeakPolarHBondContact CE2-CD2 3.37Å; F137-H141 AromaticContact CE2-NE2 3.7Å; F137-H141 AromaticContact CG-CD2 3.73Å; F137-H141 AromaticContact CZ-CD2 3.6Å; F137-H141 WeakPolarHBondContact O-CB 3.46Å; F137-H141 PolarHBondContact O-CD2 3.41Å; F137-H141 VanDerWaalsContact O-CD2 3.23Å; F137-H141 PolarHBondContact O-N 2.9Å; F137-I167 HydrophobicContact CE1-CD1 4.42Å; F137-A170 HydrophobicContact CE1-CB 3.98Å; F137-A170 HydrophobicContact CZ-CB 3.88Å; F137-F171 HydrophobicContact CB-CD2 3.73Å; F137-F171 HydrophobicContact CB-CE2 4.23Å; F137-F171 HydrophobicContact CD1-CB 3.79Å; F137-F171 HydrophobicContact CD1-CD2 4Å; F137-F171 HydrophobicContact CD1-CG 4.36Å; F137-F171 HydrophobicContact CD2-CD2 4.04Å; F137-F171 HydrophobicContact CE1-CB 3.86Å; F137-F171 HydrophobicContact CG-CB 4.31Å; F137-F171 AromaticContact CG-CD2 3.66Å; F137-F171 HydrophobicContact CG-CD2 3.66Å; F137-F171 HydrophobicContact CG-CG 4.45Å; F137-F171 HydrophobicContact CZ-CB 4.44Å; F137-Y174 AromaticContact CD2-CD1 4Å; F137-Y174 HydrophobicContact CD2-CD1 4Å; F137-Y174 HydrophobicContact CD2-CE1 4.44Å; F137-Y174 HydrophobicContact CD2-CG 4.27Å; F137-Y174 HydrophobicContact CE2-CD1 4.17Å; F137-Y174 AromaticContact CE2-CG 3.98Å; F137-Y174 HydrophobicContact CE2-CG 3.98Å
138	C	98.8	Very high	98.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-48.5	176.4	-66.3	0	0	0	0	111.5	Y126 A134 A135 T140 H141 M142	Y126-C138 HydrophobicContact CD1-CB 3.54Å; Y126-C138 HydrophobicContact CD2-CB 4.36Å; Y126-C138 HydrophobicContact CE1-CB 3.54Å; Y126-C138 HydrophobicContact CE2-CB 4.35Å; Y126-C138 HydrophobicContact CG-CB 3.97Å; A134-C138 PolarHBondContact O-N 3.04Å; A134-C138 PolarHBondContact O-SG 2.75Å; A135-C138 PolarHBondContact O-N 3.06Å; C138-T140 PolarHBondContact O-N 3.07Å; C138-H141 PolarHBondContact O-N 2.72Å; C138-M142 WeakPolarHBondContact O-CB 3.23Å; C138-M142 PolarHBondContact O-N 2.69Å
139	H	98.7	Very high	98.2	Very high	60 Å²	60	39 Å²	39	28%	0.278	21%	0.214	S	C	.	.	H	α-helix	trans	-55.8	-39	175.3	175.7	-87.2	0	0	0	112.1	R110 F111 Y126 A135	R110-H139 HydrophobicContact CB-CB 3.98Å; R110-H139 HydrophobicContact CG-CB 4.26Å; F111-H139 PolarHBondContact O-CD2 3.26Å; F111-H139 PolarHBondContact O-NE2 3.41Å; Y126-H139 HydrophobicContact CD2-CB 4.26Å; Y126-H139 HydrophobicContact CE2-CB 4.38Å; A135-H139 WeakPolarHBondContact O-CB 3.37Å; A135-H139 PolarHBondContact O-N 2.64Å
140	T	98.6	Very high	98.1	Very high	85 Å²	85	38.8 Å²	38.8	52%	0.521	21%	0.214	S	C	.	.	H	α-helix	trans	-76.4	-36.1	-178.4	-56.4	0	0	0	0	113.1	D136 F137 C138	D136-T140 VanDerWaalsContact O-CB 3.31Å; D136-T140 WeakPolarHBondContact O-CB 3.37Å; D136-T140 PolarHBondContact O-N 2.78Å; D136-T140 PolarHBondContact O-OG1 3.26Å; F137-T140 PolarHBondContact O-N 2.92Å; C138-T140 PolarHBondContact O-N 3.07Å
141	H	98.6	Very high	98.2	Very high	78 Å²	78	42.1 Å²	42.1	36%	0.361	23%	0.229	S	C	.	.	H	α-helix	trans	-114.8	-22.4	-164.8	-62.2	-59.7	0	0	0	115.3	F137 C138 K143 K144 C145 I167	F137-H141 AromaticContact CD1-CD2 3.85Å; F137-H141 AromaticContact CD2-CD2 3.54Å; F137-H141 AromaticContact CD2-NE2 3.88Å; F137-H141 HydrophobicContact CE1-CB 4.41Å; F137-H141 AromaticContact CE1-CD2 3.79Å; F137-H141 AromaticContact CE2-CD2 3.47Å; F137-H141 VanDerWaalsContact CE2-CD2 3.47Å; F137-H141 WeakPolarHBondContact CE2-CD2 3.37Å; F137-H141 AromaticContact CE2-NE2 3.7Å; F137-H141 AromaticContact CG-CD2 3.73Å; F137-H141 AromaticContact CZ-CD2 3.6Å; F137-H141 WeakPolarHBondContact O-CB 3.46Å; F137-H141 PolarHBondContact O-CD2 3.41Å; F137-H141 VanDerWaalsContact O-CD2 3.23Å; F137-H141 PolarHBondContact O-N 2.9Å; C138-H141 PolarHBondContact O-N 2.72Å; H141-K143 PolarHBondContact O-N 3.46Å; H141-K144 PolarHBondContact O-N 3.17Å; H141-K144 VanDerWaalsContact O-N 3.16Å; H141-C145 PolarHBondContact O-N 2.88Å; H141-I167 HydrophobicContact CB-CD1 3.6Å
142	M	98.6	Very high	98.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-47.2	-173.2	-176.8	66	71.6	0	0	111.7	Y122 Y126 C138 K144 C145 V146 A163 F164 I167 V192 I264	Y122-M142 HydrophobicContact CE2-CG 4.1Å; Y126-M142 HydrophobicContact CE1-CE 4.41Å; Y126-M142 VanDerWaalsContact OH-CB 3.24Å; Y126-M142 WeakPolarHBondContact OH-CB 3.5Å; Y126-M142 VanDerWaalsContact OH-CG 3.24Å; Y126-M142 WeakPolarHBondContact OH-CG 3.48Å; C138-M142 WeakPolarHBondContact O-CB 3.23Å; C138-M142 PolarHBondContact O-N 2.69Å; M142-K144 VanDerWaalsContact C-N 3.29Å; M142-K144 PolarHBondContact O-N 2.73Å; M142-C145 WeakPolarHBondContact O-CB 3.29Å; M142-C145 PolarHBondContact O-N 3.09Å; M142-C145 VanDerWaalsContact O-N 3.13Å; M142-V146 HydrophobicContact CG-CG2 4.37Å; M142-V146 WeakPolarHBondContact O-CG2 3.45Å; M142-V146 PolarHBondContact O-N 3.16Å; M142-V146 HydrophobicContact SD-CG2 4.32Å; M142-A163 HydrophobicContact SD-CB 4.13Å; M142-F164 HydrophobicContact CE-CD2 4.07Å; M142-F164 HydrophobicContact CE-CE2 4.19Å; M142-F164 HydrophobicContact SD-CD2 4.35Å; M142-F164 HydrophobicContact SD-CE2 4.49Å; M142-I167 HydrophobicContact CB-CD1 4.3Å; M142-I167 HydrophobicContact CE-CB 4.14Å; M142-I167 HydrophobicContact CE-CD1 4.48Å; M142-I167 HydrophobicContact CE-CG1 3.87Å; M142-I167 HydrophobicContact CE-CG2 4.07Å; M142-I167 HydrophobicContact SD-CG1 3.92Å; M142-V192 HydrophobicContact CG-CG2 4.29Å; M142-I264 HydrophobicContact CE-CD1 4Å
143	K	97.6	Very high	98.2	Very high	70 Å²	70	52.8 Å²	52.8	30%	0.304	26%	0.262	S	S	.	.	H	α-helix	trans	-51.9	-47.9	177.1	176.8	169.7	68.5	-150.2	0	112.2	E112 A114 L116 H141 V146 M147	E112-K143 IonicContact OE1-NZ 2.97Å; E112-K143 PolarHBondContact OE1-NZ 3.24Å; A114-K143 HydrophobicContact CB-CD 4Å; L116-K143 HydrophobicContact CD2-CD 3.93Å; L116-K143 HydrophobicContact CD2-CG 3.54Å; H141-K143 PolarHBondContact O-N 3.46Å; K143-V146 PolarHBondContact O-N 2.97Å; K143-M147 HydrophobicContact CG-SD 4.12Å; K143-M147 WeakPolarHBondContact O-CB 3.3Å; K143-M147 VanDerWaalsContact O-CG 3.26Å; K143-M147 WeakPolarHBondContact O-CG 3.37Å; K143-M147 PolarHBondContact O-N 3.38Å
144	K	97.9	Very high	98	Very high	120 Å²	120	60 Å²	60	52%	0.522	29%	0.289	S	S	.	.	H	α-helix	trans	-64.8	-44.6	179.8	178.8	174	168.7	44.4	0	111.3	H141 M142 V146 M147 D148	H141-K144 PolarHBondContact O-N 3.17Å; H141-K144 VanDerWaalsContact O-N 3.16Å; M142-K144 VanDerWaalsContact C-N 3.29Å; M142-K144 PolarHBondContact O-N 2.73Å; K144-V146 PolarHBondContact O-N 3.3Å; K144-M147 PolarHBondContact O-N 3.4Å; K144-D148 IonicContact NZ-OD1 2.8Å; K144-D148 IonicContact NZ-OD2 3.12Å; K144-D148 PolarHBondContact NZ-OD2 3.42Å; K144-D148 WeakPolarHBondContact O-CB 3.26Å; K144-D148 VanDerWaalsContact O-CG 3.29Å; K144-D148 PolarHBondContact O-N 3.19Å
145	C	98.1	Very high	98	Very high	16 Å²	16	62.4 Å²	62.4	11%	0.108	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-47	178.5	-178.2	0	0	0	0	111.4	H141 M142 M147 D148 L149 A163 E166 I167	H141-C145 PolarHBondContact O-N 2.88Å; M142-C145 WeakPolarHBondContact O-CB 3.29Å; M142-C145 PolarHBondContact O-N 3.09Å; M142-C145 VanDerWaalsContact O-N 3.13Å; C145-M147 PolarHBondContact O-N 3.09Å; C145-D148 PolarHBondContact O-N 3.17Å; C145-L149 WeakPolarHBondContact O-CG 3.43Å; C145-L149 PolarHBondContact O-N 3.42Å; C145-A163 VanDerWaalsContact SG-CA 3.54Å; C145-E166 PolarHBondContact SG-OE2 2.87Å; C145-I167 HydrophobicContact CB-CD1 4.48Å; C145-I167 HydrophobicContact CB-CG1 4.14Å
146	V	98.3	Very high	98	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-47.3	175	175.6	0	0	0	0	111.2	L116 M142 K143 K144 D148 L149 L150 V159 L160 A163 L194	L116-V146 HydrophobicContact CD1-CB 4.23Å; L116-V146 HydrophobicContact CD1-CG1 3.59Å; M142-V146 HydrophobicContact CG-CG2 4.37Å; M142-V146 WeakPolarHBondContact O-CG2 3.45Å; M142-V146 PolarHBondContact O-N 3.16Å; M142-V146 HydrophobicContact SD-CG2 4.32Å; K143-V146 PolarHBondContact O-N 2.97Å; K144-V146 PolarHBondContact O-N 3.3Å; V146-D148 VanDerWaalsContact C-N 3.3Å; V146-D148 PolarHBondContact O-N 3.32Å; V146-L149 PolarHBondContact O-N 3.25Å; V146-L149 VanDerWaalsContact O-N 3.1Å; V146-L150 HydrophobicContact CG1-CD1 4.23Å; V146-L150 HydrophobicContact CG1-CG 4.16Å; V146-L150 WeakPolarHBondContact O-CG 3.45Å; V146-L150 PolarHBondContact O-N 3.39Å; V146-V159 HydrophobicContact CG1-CG1 4.13Å; V146-L160 HydrophobicContact CG2-CD2 4.24Å; V146-A163 HydrophobicContact CG2-CB 3.92Å; V146-L194 HydrophobicContact CG1-CD1 3.92Å; V146-L194 HydrophobicContact CG1-CD2 4.11Å
147	M	98.1	Very high	98	Very high	82 Å²	82	62.1 Å²	62.1	40%	0.404	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-37.6	178.4	-74.8	179.7	72.5	0	0	113.2	L116 K143 K144 C145 L149 P151	L116-M147 HydrophobicContact CB-CG 4.13Å; L116-M147 HydrophobicContact CD1-CG 4.36Å; L116-M147 HydrophobicContact CD2-CG 4.19Å; L116-M147 HydrophobicContact CD2-SD 4.39Å; L116-M147 HydrophobicContact CG-CG 4.47Å; K143-M147 HydrophobicContact CG-SD 4.12Å; K143-M147 WeakPolarHBondContact O-CB 3.3Å; K143-M147 VanDerWaalsContact O-CG 3.26Å; K143-M147 WeakPolarHBondContact O-CG 3.37Å; K143-M147 PolarHBondContact O-N 3.38Å; K144-M147 PolarHBondContact O-N 3.4Å; C145-M147 PolarHBondContact O-N 3.09Å; M147-L149 VanDerWaalsContact C-N 3.28Å; M147-L149 PolarHBondContact O-N 3.47Å; M147-P151 WeakPolarHBondContact O-CD 3.31Å
148	D	98	Very high	98	Very high	76 Å²	76	63.5 Å²	63.5	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-72.2	-23	179.3	-70.2	-23.6	0	0	0	111.9	K144 C145 V146 R152	K144-D148 IonicContact NZ-OD1 2.8Å; K144-D148 IonicContact NZ-OD2 3.12Å; K144-D148 PolarHBondContact NZ-OD2 3.42Å; K144-D148 WeakPolarHBondContact O-CB 3.26Å; K144-D148 VanDerWaalsContact O-CG 3.29Å; K144-D148 PolarHBondContact O-N 3.19Å; C145-D148 PolarHBondContact O-N 3.17Å; V146-D148 VanDerWaalsContact C-N 3.3Å; V146-D148 PolarHBondContact O-N 3.32Å; D148-R152 PolarHBondContact O-NE 3.48Å
149	L	98.1	Very high	98	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-90.3	-33.2	178.6	-72.6	168.3	0	0	0	114.2	C145 V146 M147 P151 R152 E153 V159 L162 A163	C145-L149 WeakPolarHBondContact O-CG 3.43Å; C145-L149 PolarHBondContact O-N 3.42Å; V146-L149 PolarHBondContact O-N 3.25Å; V146-L149 VanDerWaalsContact O-N 3.1Å; M147-L149 VanDerWaalsContact C-N 3.28Å; M147-L149 PolarHBondContact O-N 3.47Å; L149-P151 VanDerWaalsContact C-CD 3.45Å; L149-P151 VanDerWaalsContact C-N 3.33Å; L149-R152 WeakPolarHBondContact O-CB 3.41Å; L149-R152 PolarHBondContact O-N 2.95Å; L149-E153 PolarHBondContact O-N 3Å; L149-V159 HydrophobicContact CB-CG1 4.02Å; L149-L162 HydrophobicContact CD1-CB 3.96Å; L149-L162 HydrophobicContact CD2-CB 4.43Å; L149-L162 HydrophobicContact CD2-CD1 4.4Å; L149-A163 HydrophobicContact CD1-CB 3.84Å
150	L	97.6	Very high	98	Very high	30 Å²	30	60.7 Å²	60.7	16%	0.157	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-37.6	-178.1	-77.7	172.8	0	0	0	114.9	L116 T117 V120 V146 R152 L156 V159	L116-L150 HydrophobicContact CB-CD1 4.36Å; L116-L150 HydrophobicContact CD1-CD1 4.17Å; T117-L150 HydrophobicContact CG2-CD1 4.12Å; V120-L150 HydrophobicContact CB-CD1 4.37Å; V120-L150 HydrophobicContact CG1-CD1 4.29Å; V120-L150 HydrophobicContact CG2-CD1 4.35Å; V120-L150 HydrophobicContact CG2-CD2 4.36Å; V146-L150 HydrophobicContact CG1-CD1 4.23Å; V146-L150 HydrophobicContact CG1-CG 4.16Å; V146-L150 WeakPolarHBondContact O-CG 3.45Å; V146-L150 PolarHBondContact O-N 3.39Å; L150-R152 VanDerWaalsContact C-N 3.28Å; L150-R152 PolarHBondContact O-N 3.45Å; L150-L156 HydrophobicContact CD2-CD2 3.78Å; L150-V159 HydrophobicContact CD2-CG1 4.39Å
151	P	97.1	Very high	98	Very high	113 Å²	113	58.2 Å²	58.2	73%	0.734	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.1	176.1	-20.8	33.9	0	0	0	114.2	M147 L149	M147-P151 WeakPolarHBondContact O-CD 3.31Å; L149-P151 VanDerWaalsContact C-CD 3.45Å; L149-P151 VanDerWaalsContact C-N 3.33Å
152	R	97.1	Very high	98	Very high	200 Å²	200	57.8 Å²	57.8	76%	0.755	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-32.2	-172.5	-57	-179.8	-171.8	178.1	4	112.4	D148 L149 L150	D148-R152 PolarHBondContact O-NE 3.48Å; L149-R152 WeakPolarHBondContact O-CB 3.41Å; L149-R152 PolarHBondContact O-N 2.95Å; L150-R152 VanDerWaalsContact C-N 3.28Å; L150-R152 PolarHBondContact O-N 3.45Å
153	E	97.5	Very high	98	Very high	67 Å²	67	57.8 Å²	57.8	31%	0.313	28%	0.281	S	S	.	.			trans	-130.1	132.8	-178	-178.5	52.8	-100.7	0	0	110.8	L149 D155 T158 V159	L149-E153 PolarHBondContact O-N 3Å; E153-D155 PolarHBondContact OE1-N 2.93Å; E153-T158 HydrophobicContact CG-CG2 3.88Å; E153-V159 HydrophobicContact CB-CG2 3.73Å; E153-V159 HydrophobicContact CG-CG2 3.84Å; E153-V159 WeakPolarHBondContact O-CG2 3.12Å
154	K	95.8	Very high	98.1	Very high	174 Å²	174	54.5 Å²	54.5	76%	0.757	27%	0.267	S	S	*	.			trans	-93.4	-26.5	-179.5	-68.8	-174.4	178.9	-179.9	0	112.3	L156 R196	K154-L156 PolarHBondContact O-N 3.49Å; K154-R196 PolarHBondContact O-NH1 3.42Å; K154-R196 PolarHBondContact O-NH2 2.91Å
155	D	98.3	Very high	98.1	Very high	51 Å²	51	52.3 Å²	52.3	27%	0.273	26%	0.261	S	S	.	.			trans	-78	114	176.3	177.3	42.6	0	0	0	110.7	E153 E157 T158 V159	E153-D155 PolarHBondContact OE1-N 2.93Å; D155-E157 VanDerWaalsContact C-N 3.27Å; D155-E157 PolarHBondContact O-N 2.85Å; D155-T158 PolarHBondContact O-N 2.87Å; D155-T158 WeakPolarHBondContact OD2-CB 3.25Å; D155-T158 PolarHBondContact OD2-N 2.83Å; D155-T158 PolarHBondContact OD2-OG1 3.01Å; D155-V159 WeakPolarHBondContact O-CG2 3.2Å; D155-V159 PolarHBondContact O-N 3.35Å
156	L	98.5	Very high	98.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.4	-26.3	-174.5	-60.5	179.8	0	0	0	112.5	L150 K154 V159 L160 L194 R196 V202	L150-L156 HydrophobicContact CD2-CD2 3.78Å; K154-L156 PolarHBondContact O-N 3.49Å; L156-V159 PolarHBondContact O-N 3.36Å; L156-L160 WeakPolarHBondContact O-CG 3.24Å; L156-L160 PolarHBondContact O-N 2.96Å; L156-L194 HydrophobicContact CD1-CB 4.35Å; L156-L194 HydrophobicContact CD2-CD1 4.26Å; L156-R196 HydrophobicContact CD1-CB 3.75Å; L156-V202 HydrophobicContact CB-CB 3.96Å; L156-V202 HydrophobicContact CB-CG1 4.13Å; L156-V202 HydrophobicContact CB-CG2 3.85Å; L156-V202 HydrophobicContact CD1-CB 4.43Å; L156-V202 HydrophobicContact CD1-CG2 4.12Å
157	E	98.7	Very high	98.2	Very high	50 Å²	50	56.2 Å²	56.2	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-45.6	174.7	-63.3	-172.8	85.7	0	0	110.1	D155 L160 T161 V202 T280 R282	D155-E157 VanDerWaalsContact C-N 3.27Å; D155-E157 PolarHBondContact O-N 2.85Å; E157-L160 PolarHBondContact O-N 3.16Å; E157-T161 WeakPolarHBondContact O-CB 3.35Å; E157-T161 PolarHBondContact O-N 2.79Å; E157-T161 PolarHBondContact O-OG1 3.26Å; E157-V202 HydrophobicContact CB-CG1 4.48Å; E157-V202 HydrophobicContact CG-CG1 3.64Å; E157-T280 HydrophobicContact CB-CG2 4.19Å; E157-T280 WeakPolarHBondContact OE1-CB 3.33Å; E157-T280 PolarHBondContact OE1-OG1 3.16Å; E157-R282 HydrophobicContact CG-CB 4.24Å; E157-R282 WeakPolarHBondContact OE2-CB 3.23Å
158	T	98.6	Very high	98.2	Very high	54 Å²	54	53.3 Å²	53.3	33%	0.331	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-43.6	172.7	-57.1	0	0	0	0	112	E153 D155 L160 T161 L162	E153-T158 HydrophobicContact CG-CG2 3.88Å; D155-T158 PolarHBondContact O-N 2.87Å; D155-T158 WeakPolarHBondContact OD2-CB 3.25Å; D155-T158 PolarHBondContact OD2-N 2.83Å; D155-T158 PolarHBondContact OD2-OG1 3.01Å; T158-L160 PolarHBondContact O-N 2.69Å; T158-T161 PolarHBondContact O-N 2.74Å; T158-L162 HydrophobicContact CG2-CD1 4.03Å; T158-L162 HydrophobicContact CG2-CG 4.31Å; T158-L162 WeakPolarHBondContact O-CB 3.47Å; T158-L162 WeakPolarHBondContact O-CG 3.4Å; T158-L162 PolarHBondContact O-N 3.33Å
159	V	98.7	Very high	98.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.1	-50.2	175.8	169	0	0	0	0	111	V146 L149 L150 E153 D155 L156 L162 A163	V146-V159 HydrophobicContact CG1-CG1 4.13Å; L149-V159 HydrophobicContact CB-CG1 4.02Å; L150-V159 HydrophobicContact CD2-CG1 4.39Å; E153-V159 HydrophobicContact CB-CG2 3.73Å; E153-V159 HydrophobicContact CG-CG2 3.84Å; E153-V159 WeakPolarHBondContact O-CG2 3.12Å; D155-V159 WeakPolarHBondContact O-CG2 3.2Å; D155-V159 PolarHBondContact O-N 3.35Å; L156-V159 PolarHBondContact O-N 3.36Å; V159-L162 PolarHBondContact O-N 2.98Å; V159-A163 VanDerWaalsContact O-CB 3.3Å; V159-A163 WeakPolarHBondContact O-CB 3.29Å; V159-A163 PolarHBondContact O-N 3.29Å
160	L	98.8	Very high	98.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-39.3	-179	-72.5	174	0	0	0	112.1	V146 L156 E157 T158 L162 A163 F164 V192 L194 V202 A204	V146-L160 HydrophobicContact CG2-CD2 4.24Å; L156-L160 WeakPolarHBondContact O-CG 3.24Å; L156-L160 PolarHBondContact O-N 2.96Å; E157-L160 PolarHBondContact O-N 3.16Å; T158-L160 PolarHBondContact O-N 2.69Å; L160-L162 PolarHBondContact O-N 2.68Å; L160-A163 PolarHBondContact O-N 3.47Å; L160-F164 HydrophobicContact CD2-CE2 4.46Å; L160-F164 WeakPolarHBondContact O-CD2 3.11Å; L160-F164 PolarHBondContact O-N 2.83Å; L160-V192 HydrophobicContact CD2-CB 4.23Å; L160-V192 HydrophobicContact CD2-CG1 3.7Å; L160-L194 HydrophobicContact CD1-CD1 4.14Å; L160-L194 HydrophobicContact CD1-CG 4.12Å; L160-L194 HydrophobicContact CD2-CD1 3.73Å; L160-L194 HydrophobicContact CD2-CG 3.94Å; L160-L194 HydrophobicContact CG-CD1 3.8Å; L160-L194 HydrophobicContact CG-CG 4.22Å; L160-V202 HydrophobicContact CD1-CG1 3.95Å; L160-A204 HydrophobicContact CB-CB 3.53Å; L160-A204 HydrophobicContact CD1-CB 3.56Å; L160-A204 HydrophobicContact CG-CB 4.08Å
161	T	98.8	Very high	98.3	Very high	34 Å²	34	57.2 Å²	57.2	21%	0.209	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-47.2	176.1	-58.2	0	0	0	0	111.3	E157 T158 L165 E277	E157-T161 WeakPolarHBondContact O-CB 3.35Å; E157-T161 PolarHBondContact O-N 2.79Å; E157-T161 PolarHBondContact O-OG1 3.26Å; T158-T161 PolarHBondContact O-N 2.74Å; T161-L165 HydrophobicContact CG2-CD1 4.39Å; T161-L165 WeakPolarHBondContact O-CG 3.44Å; T161-L165 PolarHBondContact O-N 3.15Å; T161-E277 HydrophobicContact CG2-CG 4.37Å
162	L	98.8	Very high	98.3	Very high	69 Å²	69	53.3 Å²	53.3	36%	0.361	26%	0.259	S	S	.	.	H	α-helix	trans	-63.7	-42.9	175.6	-67.9	176.2	0	0	0	111.5	L149 T158 V159 L160 F164 L165 E166	L149-L162 HydrophobicContact CD1-CB 3.96Å; L149-L162 HydrophobicContact CD2-CB 4.43Å; L149-L162 HydrophobicContact CD2-CD1 4.4Å; T158-L162 HydrophobicContact CG2-CD1 4.03Å; T158-L162 HydrophobicContact CG2-CG 4.31Å; T158-L162 WeakPolarHBondContact O-CB 3.47Å; T158-L162 WeakPolarHBondContact O-CG 3.4Å; T158-L162 PolarHBondContact O-N 3.33Å; V159-L162 PolarHBondContact O-N 2.98Å; L160-L162 PolarHBondContact O-N 2.68Å; L162-F164 PolarHBondContact O-N 3.44Å; L162-L165 PolarHBondContact O-N 2.91Å; L162-E166 WeakPolarHBondContact O-CB 3.34Å; L162-E166 WeakPolarHBondContact O-CG 3.35Å; L162-E166 PolarHBondContact O-N 2.8Å
163	A	98.8	Very high	98.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-42.7	-179.3	0	0	0	0	0	112.6	M142 C145 V146 L149 V159 L160 E166 I167	M142-A163 HydrophobicContact SD-CB 4.13Å; C145-A163 VanDerWaalsContact SG-CA 3.54Å; V146-A163 HydrophobicContact CG2-CB 3.92Å; L149-A163 HydrophobicContact CD1-CB 3.84Å; V159-A163 VanDerWaalsContact O-CB 3.3Å; V159-A163 WeakPolarHBondContact O-CB 3.29Å; V159-A163 PolarHBondContact O-N 3.29Å; L160-A163 PolarHBondContact O-N 3.47Å; A163-E166 PolarHBondContact O-N 2.8Å; A163-I167 VanDerWaalsContact O-CB 3.3Å; A163-I167 WeakPolarHBondContact O-CB 3.41Å; A163-I167 WeakPolarHBondContact O-CG1 3.41Å; A163-I167 PolarHBondContact O-N 2.98Å
164	F	98.9	Very high	98.3	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-45.3	177.8	-84.6	-128.4	0	0	0	111.4	M142 L160 L162 I167 D168 A190 V192 A204 V206 I264 P278	M142-F164 HydrophobicContact CE-CD2 4.07Å; M142-F164 HydrophobicContact CE-CE2 4.19Å; M142-F164 HydrophobicContact SD-CD2 4.35Å; M142-F164 HydrophobicContact SD-CE2 4.49Å; L160-F164 HydrophobicContact CD2-CE2 4.46Å; L160-F164 WeakPolarHBondContact O-CD2 3.11Å; L160-F164 PolarHBondContact O-N 2.83Å; L162-F164 PolarHBondContact O-N 3.44Å; F164-I167 PolarHBondContact O-N 3.39Å; F164-D168 WeakPolarHBondContact O-CB 3.48Å; F164-D168 PolarHBondContact O-N 2.86Å; F164-A190 HydrophobicContact CD1-CB 4.42Å; F164-A190 HydrophobicContact CE1-CB 3.65Å; F164-A190 HydrophobicContact CZ-CB 3.92Å; F164-V192 HydrophobicContact CE2-CB 3.96Å; F164-V192 HydrophobicContact CE2-CG2 3.73Å; F164-V192 HydrophobicContact CZ-CB 4.09Å; F164-V192 HydrophobicContact CZ-CG2 3.76Å; F164-A204 HydrophobicContact CE2-CB 3.98Å; F164-A204 HydrophobicContact CZ-CB 4Å; F164-V206 HydrophobicContact CD1-CG1 4.09Å; F164-V206 HydrophobicContact CD1-CG2 4.13Å; F164-V206 HydrophobicContact CE1-CG1 4.32Å; F164-V206 HydrophobicContact CE1-CG2 4.04Å; F164-I264 HydrophobicContact CD1-CD1 4.27Å; F164-P278 HydrophobicContact CB-CG 4.06Å; F164-P278 HydrophobicContact CD1-CB 3.71Å; F164-P278 HydrophobicContact CD1-CG 3.9Å; F164-P278 HydrophobicContact CD2-CG 4.35Å; F164-P278 HydrophobicContact CE1-CB 3.85Å; F164-P278 HydrophobicContact CE1-CG 4.41Å; F164-P278 HydrophobicContact CG-CB 4.18Å; F164-P278 HydrophobicContact CG-CG 3.85Å; F164-P278 HydrophobicContact CZ-CB 4.43Å
165	L	98.8	Very high	98.3	Very high	75 Å²	75	40.9 Å²	40.9	39%	0.393	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-38.3	178.3	-66.2	175.5	0	0	0	112.4	T161 L162 K169 E277	T161-L165 HydrophobicContact CG2-CD1 4.39Å; T161-L165 WeakPolarHBondContact O-CG 3.44Å; T161-L165 PolarHBondContact O-N 3.15Å; L162-L165 PolarHBondContact O-N 2.91Å; L165-K169 WeakPolarHBondContact O-CB 3.46Å; L165-K169 PolarHBondContact O-N 2.96Å; L165-K169 VanDerWaalsContact O-N 3.08Å; L165-E277 HydrophobicContact CD2-CB 4.29Å
166	E	98.6	Very high	98.2	Very high	91 Å²	91	44.4 Å²	44.4	43%	0.425	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-43.5	176.2	-76.7	-175.4	-176.4	0	0	112	C145 L162 A163 K169 A170	C145-E166 PolarHBondContact SG-OE2 2.87Å; L162-E166 WeakPolarHBondContact O-CB 3.34Å; L162-E166 WeakPolarHBondContact O-CG 3.35Å; L162-E166 PolarHBondContact O-N 2.8Å; A163-E166 PolarHBondContact O-N 2.8Å; E166-K169 PolarHBondContact O-N 3.06Å; E166-A170 WeakPolarHBondContact O-CB 3.33Å; E166-A170 PolarHBondContact O-N 3.02Å
167	I	98.6	Very high	98	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-46.9	175	-82	-88.4	0	0	0	111.1	F137 H141 M142 C145 A163 F164 K169 A170 F171 I264	F137-I167 HydrophobicContact CE1-CD1 4.42Å; H141-I167 HydrophobicContact CB-CD1 3.6Å; M142-I167 HydrophobicContact CB-CD1 4.3Å; M142-I167 HydrophobicContact CE-CB 4.14Å; M142-I167 HydrophobicContact CE-CD1 4.48Å; M142-I167 HydrophobicContact CE-CG1 3.87Å; M142-I167 HydrophobicContact CE-CG2 4.07Å; M142-I167 HydrophobicContact SD-CG1 3.92Å; C145-I167 HydrophobicContact CB-CD1 4.48Å; C145-I167 HydrophobicContact CB-CG1 4.14Å; A163-I167 VanDerWaalsContact O-CB 3.3Å; A163-I167 WeakPolarHBondContact O-CB 3.41Å; A163-I167 WeakPolarHBondContact O-CG1 3.41Å; A163-I167 PolarHBondContact O-N 2.98Å; F164-I167 PolarHBondContact O-N 3.39Å; I167-K169 PolarHBondContact O-N 2.87Å; I167-A170 PolarHBondContact O-N 2.91Å; I167-F171 WeakPolarHBondContact O-CB 3.5Å; I167-F171 PolarHBondContact O-N 3.3Å; I167-I264 HydrophobicContact CG2-CD1 3.87Å; I167-I264 HydrophobicContact CG2-CG2 3.88Å
168	D	98.8	Very high	97.7	Very high	21 Å²	21	51.4 Å²	51.4	11%	0.112	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-42.6	-179.9	-175	67.6	0	0	0	111.5	F164 A170 F171 S172 I264 G265 K270 A276	F164-D168 WeakPolarHBondContact O-CB 3.48Å; F164-D168 PolarHBondContact O-N 2.86Å; D168-A170 VanDerWaalsContact C-N 3.34Å; D168-A170 PolarHBondContact O-N 2.89Å; D168-F171 PolarHBondContact O-N 2.96Å; D168-S172 WeakPolarHBondContact O-CB 3.36Å; D168-S172 PolarHBondContact O-N 3.42Å; D168-I264 HydrophobicContact CB-CG2 4.19Å; D168-G265 PolarHBondContact OD1-N 3.47Å; D168-K270 VanDerWaalsContact CG-CE 3.48Å; D168-K270 WeakPolarHBondContact OD1-CE 3.41Å; D168-K270 IonicContact OD1-NZ 3.26Å; D168-K270 WeakPolarHBondContact OD2-CE 3.33Å; D168-A276 HydrophobicContact CB-CB 3.49Å; D168-A276 VanDerWaalsContact CB-CB 3.49Å; D168-A276 VanDerWaalsContact CG-CB 3.41Å
169	K	98.6	Very high	97.4	Very high	152 Å²	152	54.1 Å²	54.1	66%	0.661	30%	0.299	S	S	*	.	H	α-helix	trans	-62.4	-40.7	173.9	-176.9	-179.3	177.1	-177.1	0	112.3	L165 E166 I167 S173	L165-K169 WeakPolarHBondContact O-CB 3.46Å; L165-K169 PolarHBondContact O-N 2.96Å; L165-K169 VanDerWaalsContact O-N 3.08Å; E166-K169 PolarHBondContact O-N 3.06Å; I167-K169 PolarHBondContact O-N 2.87Å; K169-S173 PolarHBondContact O-N 2.8Å; K169-S173 VanDerWaalsContact O-N 3.1Å; K169-S173 PolarHBondContact O-OG 2.81Å
170	A	98.4	Very high	97.1	Very high	44 Å²	44	58 Å²	58	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-66.7	-43.5	177.6	0	0	0	0	0	111.3	F137 E166 I167 D168 S173 Y174	F137-A170 HydrophobicContact CE1-CB 3.98Å; F137-A170 HydrophobicContact CZ-CB 3.88Å; E166-A170 WeakPolarHBondContact O-CB 3.33Å; E166-A170 PolarHBondContact O-N 3.02Å; I167-A170 PolarHBondContact O-N 2.91Å; D168-A170 VanDerWaalsContact C-N 3.34Å; D168-A170 PolarHBondContact O-N 2.89Å; A170-S173 PolarHBondContact O-N 3.46Å; A170-Y174 WeakPolarHBondContact O-CB 3.03Å; A170-Y174 PolarHBondContact O-N 3.29Å
171	F	98.4	Very high	96.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-43.7	175.6	-179.8	-104.9	0	0	0	111.8	A133 A134 F137 I167 D168 S173 Y174 A175	A133-F171 HydrophobicContact CB-CE2 4.47Å; A134-F171 HydrophobicContact CB-CE1 3.98Å; A134-F171 HydrophobicContact CB-CE2 4.03Å; A134-F171 HydrophobicContact CB-CZ 3.67Å; F137-F171 HydrophobicContact CB-CD2 3.73Å; F137-F171 HydrophobicContact CB-CE2 4.23Å; F137-F171 HydrophobicContact CD1-CB 3.79Å; F137-F171 HydrophobicContact CD1-CD2 4Å; F137-F171 HydrophobicContact CD1-CG 4.36Å; F137-F171 HydrophobicContact CD2-CD2 4.04Å; F137-F171 HydrophobicContact CE1-CB 3.86Å; F137-F171 HydrophobicContact CG-CB 4.31Å; F137-F171 AromaticContact CG-CD2 3.66Å; F137-F171 HydrophobicContact CG-CD2 3.66Å; F137-F171 HydrophobicContact CG-CG 4.45Å; F137-F171 HydrophobicContact CZ-CB 4.44Å; I167-F171 WeakPolarHBondContact O-CB 3.5Å; I167-F171 PolarHBondContact O-N 3.3Å; D168-F171 PolarHBondContact O-N 2.96Å; F171-S173 VanDerWaalsContact C-N 3.3Å; F171-S173 PolarHBondContact O-N 2.93Å; F171-Y174 HydrophobicContact CD2-CD1 4.15Å; F171-Y174 HydrophobicContact CE2-CD1 4.21Å; F171-Y174 WeakPolarHBondContact O-CB 3.37Å; F171-Y174 PolarHBondContact O-N 2.86Å; F171-Y174 VanDerWaalsContact O-N 3.14Å; F171-A175 HydrophobicContact CE1-CB 4.48Å; F171-A175 WeakPolarHBondContact O-CB 3.44Å; F171-A175 PolarHBondContact O-N 3.07Å
172	S	98	Very high	96.5	Very high	31 Å²	31	62.2 Å²	62.2	22%	0.217	36%	0.355	C	S	.	.	H	α-helix	trans	-55.8	-45.4	174.5	175.7	0	0	0	0	111.9	D168 A175 H176	D168-S172 WeakPolarHBondContact O-CB 3.36Å; D168-S172 PolarHBondContact O-N 3.42Å; S172-A175 PolarHBondContact O-N 3.45Å; S172-H176 WeakPolarHBondContact O-CB 3.12Å; S172-H176 PolarHBondContact O-CD2 3.2Å; S172-H176 PolarHBondContact O-N 2.99Å
173	S	97.6	Very high	96.3	Very high	62 Å²	62	59.3 Å²	59.3	43%	0.434	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-43	176.9	-55.3	0	0	0	0	111.6	K169 A170 F171 L177	K169-S173 PolarHBondContact O-N 2.8Å; K169-S173 VanDerWaalsContact O-N 3.1Å; K169-S173 PolarHBondContact O-OG 2.81Å; A170-S173 PolarHBondContact O-N 3.46Å; F171-S173 VanDerWaalsContact C-N 3.3Å; F171-S173 PolarHBondContact O-N 2.93Å; S173-L177 VanDerWaalsContact O-CG 3.25Å; S173-L177 WeakPolarHBondContact O-CG 3.41Å; S173-L177 PolarHBondContact O-N 2.99Å
174	Y	96.4	Very high	96.1	Very high	116 Å²	116	62 Å²	62	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-48.3	176.7	169.7	-106.5	0	0	0	112.2	F137 A170 F171 H176 L177 S178 L183	F137-Y174 AromaticContact CD2-CD1 4Å; F137-Y174 HydrophobicContact CD2-CD1 4Å; F137-Y174 HydrophobicContact CD2-CE1 4.44Å; F137-Y174 HydrophobicContact CD2-CG 4.27Å; F137-Y174 HydrophobicContact CE2-CD1 4.17Å; F137-Y174 AromaticContact CE2-CG 3.98Å; F137-Y174 HydrophobicContact CE2-CG 3.98Å; A170-Y174 WeakPolarHBondContact O-CB 3.03Å; A170-Y174 PolarHBondContact O-N 3.29Å; F171-Y174 HydrophobicContact CD2-CD1 4.15Å; F171-Y174 HydrophobicContact CE2-CD1 4.21Å; F171-Y174 WeakPolarHBondContact O-CB 3.37Å; F171-Y174 PolarHBondContact O-N 2.86Å; F171-Y174 VanDerWaalsContact O-N 3.14Å; Y174-H176 PolarHBondContact O-N 3.27Å; Y174-L177 PolarHBondContact O-N 3.05Å; Y174-S178 PolarHBondContact O-N 2.88Å; Y174-S178 VanDerWaalsContact O-N 3.08Å; Y174-L183 HydrophobicContact CD1-CD2 4Å; Y174-L183 HydrophobicContact CE1-CD2 3.45Å; Y174-L183 VanDerWaalsContact CE1-CD2 3.45Å
175	A	96	Very high	96	Very high	2 Å²	2	64.4 Å²	64.4	2%	0.017	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-40.5	179.7	0	0	0	0	0	112.4	F171 S172 L177 S178 L183 L184 L267	F171-A175 HydrophobicContact CE1-CB 4.48Å; F171-A175 WeakPolarHBondContact O-CB 3.44Å; F171-A175 PolarHBondContact O-N 3.07Å; S172-A175 PolarHBondContact O-N 3.45Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 2.97Å; A175-S178 PolarHBondContact O-N 3.44Å; A175-L183 HydrophobicContact CB-CB 3.81Å; A175-L184 HydrophobicContact CB-CD2 4.37Å; A175-L267 HydrophobicContact CB-CD1 3.72Å
176	H	94.4	Very high	96	Very high	125 Å²	125	60.9 Å²	60.9	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-69.5	-25.7	177.1	-78.8	-53.4	0	0	0	114.2	S172 Y174	S172-H176 WeakPolarHBondContact O-CB 3.12Å; S172-H176 PolarHBondContact O-CD2 3.2Å; S172-H176 PolarHBondContact O-N 2.99Å; Y174-H176 PolarHBondContact O-N 3.27Å
177	L	94.8	Very high	96	Very high	156 Å²	156	56.6 Å²	56.6	82%	0.817	33%	0.33	S	S	*	.	H	α-helix	trans	-88	-16	177.2	-68.6	172.5	0	0	0	112.9	S173 Y174 A175	S173-L177 VanDerWaalsContact O-CG 3.25Å; S173-L177 WeakPolarHBondContact O-CG 3.41Å; S173-L177 PolarHBondContact O-N 2.99Å; Y174-L177 PolarHBondContact O-N 3.05Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 2.97Å
178	S	93.3	Very high	96	Very high	41 Å²	41	56.3 Å²	56.3	29%	0.287	33%	0.329	S	S	.	.	S	Bend	trans	-74.1	147.6	177	-172.6	0	0	0	0	111.6	Y174 A175 D180	Y174-S178 PolarHBondContact O-N 2.88Å; Y174-S178 VanDerWaalsContact O-N 3.08Å; A175-S178 PolarHBondContact O-N 3.44Å; S178-D180 PolarHBondContact OG-N 2.73Å
179	A	92	Very high	96	Very high	112 Å²	112	55.3 Å²	55.3	93%	0.926	32%	0.323	S	S	*	.	S	Bend	trans	-75.7	-16.4	170.3	0	0	0	0	0	112.5	A181	A179-A181 PolarHBondContact O-N 3.17Å
180	D	92.3	Very high	96	Very high	80 Å²	80	48 Å²	48	43%	0.428	29%	0.292	S	S	.	.			trans	-85.5	104.2	-179.9	-177.9	2.9	0	0	0	110.7	S178 S182 L183	S178-D180 PolarHBondContact OG-N 2.73Å; D180-S182 PolarHBondContact O-N 2.91Å; D180-S182 VanDerWaalsContact OD1-CB 3.28Å; D180-S182 WeakPolarHBondContact OD1-CB 3.31Å; D180-S182 PolarHBondContact OD1-N 3.36Å; D180-S182 PolarHBondContact OD1-OG 2.82Å; D180-S182 PolarHBondContact OD2-OG 3.18Å; D180-L183 HydrophobicContact CB-CD1 3.76Å; D180-L183 VanDerWaalsContact CG-CD1 3.49Å; D180-L183 PolarHBondContact O-N 2.87Å; D180-L183 VanDerWaalsContact OD2-CD1 3.23Å; D180-L183 WeakPolarHBondContact OD2-CD1 3.25Å
181	A	91.7	Very high	96.1	Very high	70 Å²	70	46 Å²	46	58%	0.579	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.7	-179.7	0	0	0	0	0	113.6	A179 L183 L184	A179-A181 PolarHBondContact O-N 3.17Å; A181-L183 PolarHBondContact O-N 3.06Å; A181-L184 WeakPolarHBondContact O-CB 3.44Å; A181-L184 PolarHBondContact O-N 3.46Å
182	S	93.1	Very high	96.1	Very high	53 Å²	53	46 Å²	46	37%	0.371	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-65	-25.9	178.6	71.5	0	0	0	0	112.6	D180 L184 T185 S186	D180-S182 PolarHBondContact O-N 2.91Å; D180-S182 VanDerWaalsContact OD1-CB 3.28Å; D180-S182 WeakPolarHBondContact OD1-CB 3.31Å; D180-S182 PolarHBondContact OD1-N 3.36Å; D180-S182 PolarHBondContact OD1-OG 2.82Å; D180-S182 PolarHBondContact OD2-OG 3.18Å; S182-L184 PolarHBondContact O-N 3.08Å; S182-T185 CarbonylContact O-C 3.51Å; S182-T185 PolarHBondContact O-N 2.95Å; S182-T185 PolarHBondContact O-OG1 3.4Å; S182-S186 PolarHBondContact O-N 2.68Å; S182-S186 VanDerWaalsContact O-N 3.09Å
183	L	95.1	Very high	96.1	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-62.4	-26.9	176.3	-83.2	61.9	0	0	0	112.8	A133 Y174 A175 D180 A181 T185 S186	A133-L183 HydrophobicContact CB-CD1 4.28Å; A133-L183 HydrophobicContact CB-CG 3.98Å; Y174-L183 HydrophobicContact CD1-CD2 4Å; Y174-L183 HydrophobicContact CE1-CD2 3.45Å; Y174-L183 VanDerWaalsContact CE1-CD2 3.45Å; A175-L183 HydrophobicContact CB-CB 3.81Å; D180-L183 HydrophobicContact CB-CD1 3.76Å; D180-L183 VanDerWaalsContact CG-CD1 3.49Å; D180-L183 PolarHBondContact O-N 2.87Å; D180-L183 VanDerWaalsContact OD2-CD1 3.23Å; D180-L183 WeakPolarHBondContact OD2-CD1 3.25Å; A181-L183 PolarHBondContact O-N 3.06Å; L183-T185 PolarHBondContact O-N 3.4Å; L183-S186 PolarHBondContact O-N 3.09Å
184	L	95.2	Very high	96.2	Very high	57 Å²	57	41.5 Å²	41.5	30%	0.298	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.8	-25.2	176.4	-59.2	179.4	0	0	0	111.9	A175 A181 S182 L267	A175-L184 HydrophobicContact CB-CD2 4.37Å; A181-L184 WeakPolarHBondContact O-CB 3.44Å; A181-L184 PolarHBondContact O-N 3.46Å; S182-L184 PolarHBondContact O-N 3.08Å; L184-L267 HydrophobicContact CD2-CD1 3.89Å; L184-L267 PolarHBondContact O-N 2.93Å; L184-L267 VanDerWaalsContact O-N 3.1Å
185	T	96.7	Very high	96.3	Very high	51 Å²	51	36 Å²	36	31%	0.313	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-108	-0.2	180	61.1	0	0	0	0	113.1	S182 L183 R257	S182-T185 CarbonylContact O-C 3.51Å; S182-T185 PolarHBondContact O-N 2.95Å; S182-T185 PolarHBondContact O-OG1 3.4Å; L183-T185 PolarHBondContact O-N 3.4Å; T185-R257 PolarHBondContact O-NH2 2.8Å
186	S	98.3	Very high	96.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	23%	0.231	C	C	.	.			trans	-78.6	136.6	173.3	178.1	0	0	0	0	108.8	H129 G131 A134 S182 L183 D266	H129-S186 WeakPolarHBondContact O-CA 3.25Å; G131-S186 PolarHBondContact O-OG 3.38Å; A134-S186 PolarHBondContact N-OG 3.4Å; S182-S186 PolarHBondContact O-N 2.68Å; S182-S186 VanDerWaalsContact O-N 3.09Å; L183-S186 PolarHBondContact O-N 3.09Å; S186-D266 PolarHBondContact O-N 3.19Å
187	G	98.7	Very high	96.5	Very high	0 Å²	0	33 Å²	33	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	168.8	176.8	0	0	0	0	0	110.8	H129 I264	H129-G187 VanDerWaalsContact CE1-C 3.45Å; H129-G187 PolarHBondContact N-O 2.86Å; H129-G187 WeakPolarHBondContact NE2-CA 3.5Å; H129-G187 PolarHBondContact O-N 2.89Å; G187-I264 CarbonylContact C-O 3.54Å; G187-I264 VanDerWaalsContact CA-O 3.25Å; G187-I264 WeakPolarHBondContact CA-O 3.47Å
188	T	98.9	Very high	96.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	149.5	175.5	-168.4	0	0	0	0	111.2	D127 A134 A135 I264	D127-T188 VanDerWaalsContact C-OG1 3.23Å; D127-T188 PolarHBondContact N-OG1 3.04Å; D127-T188 CarbonylContact O-C 3.55Å; D127-T188 WeakPolarHBondContact O-CA 3.46Å; D127-T188 WeakPolarHBondContact O-CB 3.38Å; D127-T188 PolarHBondContact O-OG1 2.85Å; A134-T188 HydrophobicContact CB-CG2 3.91Å; A135-T188 WeakPolarHBondContact CB-OG1 3.29Å; T188-I264 HydrophobicContact CG2-CB 4.07Å; T188-I264 PolarHBondContact N-O 2.99Å; T188-I264 PolarHBondContact O-N 2.99Å
189	T	98.8	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.158	C	C	.	.			trans	-67.5	161.4	158.5	77.3	0	0	0	0	109.6	Y126 D127 V206 D208 S209 M260	Y126-T189 WeakPolarHBondContact CA-O 3.49Å; D127-T189 HydrophobicContact CB-CG2 3.82Å; D127-T189 WeakPolarHBondContact CB-OG1 3.33Å; D127-T189 PolarHBondContact N-OG1 3.03Å; D127-T189 PolarHBondContact O-N 2.83Å; T189-V206 WeakPolarHBondContact CA-O 3.39Å; T189-V206 WeakPolarHBondContact CB-O 3.26Å; T189-D208 WeakPolarHBondContact CG2-OD1 3.4Å; T189-S209 WeakPolarHBondContact OG1-CB 3.25Å; T189-S209 PolarHBondContact OG1-OG 3.01Å; T189-M260 HydrophobicContact CG2-CE 3.52Å; T189-M260 HydrophobicContact CG2-SD 3.73Å
190	A	98.9	Very high	96.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	122.4	166.9	0	0	0	0	0	108.1	Y126 F164 S205 V206 I264	Y126-A190 HydrophobicContact CD1-CB 3.69Å; Y126-A190 HydrophobicContact CE1-CB 3.72Å; F164-A190 HydrophobicContact CD1-CB 4.42Å; F164-A190 HydrophobicContact CE1-CB 3.65Å; F164-A190 HydrophobicContact CZ-CB 3.92Å; A190-S205 CarbonylContact O-C 3.55Å; A190-S205 WeakPolarHBondContact O-CA 3.23Å; A190-V206 HydrophobicContact CB-CG2 4.13Å; A190-V206 PolarHBondContact N-O 3.19Å; A190-V206 PolarHBondContact O-N 3.27Å; A190-I264 HydrophobicContact CB-CD1 3.69Å; A190-I264 HydrophobicContact CB-CG1 4.42Å
191	T	98.9	Very high	97.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	110.4	169.8	-63.5	0	0	0	0	108.1	A124 V125 V203 S209 A211 T223 L295	A124-T191 VanDerWaalsContact CA-O 3.26Å; A124-T191 WeakPolarHBondContact CA-O 3.19Å; V125-T191 PolarHBondContact N-O 3.21Å; V125-T191 PolarHBondContact O-N 3.23Å; T191-V203 HydrophobicContact CG2-CG1 4.11Å; T191-S209 WeakPolarHBondContact OG1-CB 3.29Å; T191-S209 PolarHBondContact OG1-O 3.25Å; T191-A211 HydrophobicContact CG2-CB 3.91Å; T191-T223 HydrophobicContact CG2-CG2 4.1Å; T191-L295 HydrophobicContact CG2-CD2 4.17Å
192	V	98.9	Very high	97.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.4	-173.8	-179.2	0	0	0	0	109.5	Y122 F123 A124 Y126 M142 L160 F164 V203 A204	Y122-V192 HydrophobicContact CD2-CG1 3.73Å; Y122-V192 HydrophobicContact CE2-CG1 3.48Å; Y122-V192 VanDerWaalsContact CE2-CG1 3.48Å; F123-V192 CarbonylContact O-C 3.59Å; F123-V192 WeakPolarHBondContact O-CA 3.36Å; A124-V192 HydrophobicContact CB-CG2 3.97Å; Y126-V192 HydrophobicContact CE1-CG2 4.22Å; M142-V192 HydrophobicContact CG-CG2 4.29Å; L160-V192 HydrophobicContact CD2-CB 4.23Å; L160-V192 HydrophobicContact CD2-CG1 3.7Å; F164-V192 HydrophobicContact CE2-CB 3.96Å; F164-V192 HydrophobicContact CE2-CG2 3.73Å; F164-V192 HydrophobicContact CZ-CB 4.09Å; F164-V192 HydrophobicContact CZ-CG2 3.76Å; V192-V203 CarbonylContact O-C 3.52Å; V192-V203 WeakPolarHBondContact O-CA 3.42Å; V192-A204 PolarHBondContact N-O 2.69Å; V192-A204 PolarHBondContact O-N 3.11Å
193	A	98.9	Very high	97.8	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.9	176.2	0	0	0	0	0	110.6	Y122 F123 L201 V202 V203 L293	Y122-A193 WeakPolarHBondContact CA-O 3.37Å; F123-A193 HydrophobicContact CB-CB 4.36Å; F123-A193 HydrophobicContact CD2-CB 4.41Å; F123-A193 PolarHBondContact N-O 2.74Å; F123-A193 PolarHBondContact O-N 2.94Å; A193-L201 HydrophobicContact CB-CD1 4.02Å; A193-V202 CarbonylContact C-O 3.57Å; A193-V202 WeakPolarHBondContact CA-O 3.31Å; A193-V203 HydrophobicContact CB-CG2 3.97Å; A193-L293 HydrophobicContact CB-CD2 3.87Å
194	L	98.9	Very high	98	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.4	169.5	-60.6	-178.3	0	0	0	109.5	L116 V120 L121 Y122 V146 L156 L160 L201 V202	L116-L194 HydrophobicContact CD1-CD2 4.09Å; V120-L194 HydrophobicContact CG1-CB 4.38Å; V120-L194 HydrophobicContact CG1-CD2 4.21Å; L121-L194 CarbonylContact O-C 3.57Å; L121-L194 WeakPolarHBondContact O-CA 3.49Å; Y122-L194 HydrophobicContact CD2-CD2 3.89Å; Y122-L194 HydrophobicContact CG-CD2 4.43Å; V146-L194 HydrophobicContact CG1-CD1 3.92Å; V146-L194 HydrophobicContact CG1-CD2 4.11Å; L156-L194 HydrophobicContact CD1-CB 4.35Å; L156-L194 HydrophobicContact CD2-CD1 4.26Å; L160-L194 HydrophobicContact CD1-CD1 4.14Å; L160-L194 HydrophobicContact CD1-CG 4.12Å; L160-L194 HydrophobicContact CD2-CD1 3.73Å; L160-L194 HydrophobicContact CD2-CG 3.94Å; L160-L194 HydrophobicContact CG-CD1 3.8Å; L160-L194 HydrophobicContact CG-CG 4.22Å; L194-L201 WeakPolarHBondContact O-CA 3.41Å; L194-V202 PolarHBondContact N-O 3.05Å; L194-V202 PolarHBondContact O-N 2.63Å
195	L	98.7	Very high	98.2	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108.4	173.1	179.2	61.5	0	0	0	109.3	I90 V120 L121 F123 E200 L201 L285 F346	I90-L195 HydrophobicContact CG1-CD2 4.06Å; V120-L195 WeakPolarHBondContact CA-O 3.44Å; L121-L195 HydrophobicContact CB-CB 4.29Å; L121-L195 HydrophobicContact CD1-CD2 4.4Å; L121-L195 PolarHBondContact N-O 2.93Å; L121-L195 PolarHBondContact O-N 2.83Å; F123-L195 HydrophobicContact CE2-CB 4.29Å; L195-E200 CarbonylContact C-O 3.58Å; L195-E200 WeakPolarHBondContact CA-O 3.37Å; L195-L201 HydrophobicContact CD1-CB 4.1Å; L195-L285 HydrophobicContact CD1-CD1 3.6Å; L195-L285 HydrophobicContact CD1-CG 4.26Å; L195-L285 HydrophobicContact CD2-CD1 4.14Å; L195-F346 HydrophobicContact CD2-CE1 3.9Å
196	R	98.1	Very high	98.3	Very high	51 Å²	51	4.7 Å²	4.7	19%	0.192	2%	0.022	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.7	177.5	-178.6	170.3	65.2	-167.3	-2.3	112.1	E119 V120 K154 L156 G198 I199 E200	E119-R196 HydrophobicContact CB-CG 4.44Å; E119-R196 CarbonylContact O-C 3.51Å; E119-R196 VanDerWaalsContact O-CA 3.25Å; E119-R196 WeakPolarHBondContact O-CA 3.42Å; V120-R196 HydrophobicContact CG2-CB 4.24Å; V120-R196 HydrophobicContact CG2-CG 4.16Å; K154-R196 PolarHBondContact O-NH1 3.42Å; K154-R196 PolarHBondContact O-NH2 2.91Å; L156-R196 HydrophobicContact CD1-CB 3.75Å; R196-G198 PolarHBondContact O-N 3.47Å; R196-I199 PolarHBondContact O-N 3.4Å; R196-E200 HydrophobicContact CB-CB 4.33Å; R196-E200 IonicContact CZ-OE1 3.48Å; R196-E200 IonicContact CZ-OE2 3.97Å; R196-E200 PolarHBondContact N-O 3.35Å; R196-E200 IonicContact NE-OE2 3.36Å; R196-E200 PolarHBondContact NE-OE2 3.19Å; R196-E200 IonicContact NH2-OE1 3.36Å; R196-E200 PolarHBondContact NH2-OE1 2.96Å; R196-E200 IonicContact NH2-OE2 3.84Å; R196-E200 PolarHBondContact NH2-OE2 3.39Å; R196-E200 PolarHBondContact O-N 3.15Å
197	D	95.9	Very high	98.3	Very high	11 Å²	11	4.7 Å²	4.7	6%	0.059	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	21	179.7	-63.8	-27.6	0	0	0	113.3	P79 K82 Y83 E119 I199	P79-D197 HydrophobicContact CB-CB 4.06Å; P79-D197 WeakPolarHBondContact CB-O 3.41Å; P79-D197 HydrophobicContact CG-CB 4.07Å; K82-D197 IonicContact NZ-OD2 2.82Å; K82-D197 PolarHBondContact NZ-OD2 3.24Å; Y83-D197 HydrophobicContact CE2-CB 3.71Å; Y83-D197 WeakPolarHBondContact CE2-OD2 3.35Å; Y83-D197 PolarHBondContact OH-OD2 2.92Å; E119-D197 PolarHBondContact O-N 3.41Å; D197-I199 HydrophobicContact CB-CG1 4.27Å; D197-I199 PolarHBondContact O-N 3.41Å
198	G	94.9	Very high	98.2	Very high	5 Å²	5	5.1 Å²	5.1	5%	0.052	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	-3.6	-173.4	0	0	0	0	0	115.6	R196 H287	R196-G198 PolarHBondContact O-N 3.47Å; G198-H287 PolarHBondContact O-CE1 3.13Å; G198-H287 PolarHBondContact O-NE2 3.1Å
199	I	95.9	Very high	98.2	Very high	10 Å²	10	5.2 Å²	5.2	5%	0.051	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-22	-171.4	59.4	160.8	0	0	0	116	Y83 I87 R196 D197 K284 L285	Y83-I199 HydrophobicContact CD1-CD1 3.66Å; Y83-I199 HydrophobicContact CD2-CD1 3.35Å; Y83-I199 HydrophobicContact CD2-CG1 4.2Å; Y83-I199 HydrophobicContact CE1-CD1 3.71Å; Y83-I199 HydrophobicContact CE2-CD1 3.43Å; Y83-I199 VanDerWaalsContact CE2-CD1 3.43Å; Y83-I199 HydrophobicContact CE2-CG1 4Å; Y83-I199 HydrophobicContact CG-CD1 3.48Å; Y83-I199 VanDerWaalsContact CG-CD1 3.48Å; I87-I199 HydrophobicContact CB-CG2 4.34Å; I87-I199 HydrophobicContact CD1-CD1 4.21Å; I87-I199 HydrophobicContact CD1-CG1 4.33Å; I87-I199 HydrophobicContact CD1-CG2 3.45Å; I87-I199 VanDerWaalsContact CD1-CG2 3.45Å; I87-I199 HydrophobicContact CG1-CG2 3.58Å; I87-I199 HydrophobicContact CG2-CG2 3.79Å; R196-I199 PolarHBondContact O-N 3.4Å; D197-I199 HydrophobicContact CB-CG1 4.27Å; D197-I199 PolarHBondContact O-N 3.41Å; I199-K284 CarbonylContact O-C 3.53Å; I199-K284 WeakPolarHBondContact O-CA 3.17Å; I199-L285 PolarHBondContact O-N 3.32Å
200	E	97.9	Very high	98.2	Very high	15 Å²	15	6.9 Å²	6.9	7%	0.07	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	103.1	-178.4	178.5	-179.3	-164.3	0	0	108.8	L195 R196 V202 R282	L195-E200 CarbonylContact C-O 3.58Å; L195-E200 WeakPolarHBondContact CA-O 3.37Å; R196-E200 HydrophobicContact CB-CB 4.33Å; R196-E200 IonicContact CZ-OE1 3.48Å; R196-E200 IonicContact CZ-OE2 3.97Å; R196-E200 PolarHBondContact N-O 3.35Å; R196-E200 IonicContact NE-OE2 3.36Å; R196-E200 PolarHBondContact NE-OE2 3.19Å; R196-E200 IonicContact NH2-OE1 3.36Å; R196-E200 PolarHBondContact NH2-OE1 2.96Å; R196-E200 IonicContact NH2-OE2 3.84Å; R196-E200 PolarHBondContact NH2-OE2 3.39Å; R196-E200 PolarHBondContact O-N 3.15Å; E200-V202 HydrophobicContact CG-CG2 4.39Å; E200-R282 IonicContact OE1-CZ 2.64Å; E200-R282 IonicContact OE1-NE 2.69Å; E200-R282 PolarHBondContact OE1-NE 2.76Å; E200-R282 IonicContact OE1-NH2 3.13Å; E200-R282 PolarHBondContact OE1-NH2 3.3Å
201	L	98.8	Very high	98.2	Very high	1 Å²	1	6.9 Å²	6.9	1%	0.005	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120.9	179.9	174.3	61.2	0	0	0	109.2	A193 L194 L195 V203 L222 I283 L285 L293	A193-L201 HydrophobicContact CB-CD1 4.02Å; L194-L201 WeakPolarHBondContact O-CA 3.41Å; L195-L201 HydrophobicContact CD1-CB 4.1Å; L201-V203 HydrophobicContact CD1-CG2 4.22Å; L201-V203 HydrophobicContact CG-CG2 4.29Å; L201-L222 HydrophobicContact CD2-CD1 3.96Å; L201-I283 HydrophobicContact CB-CG1 4.03Å; L201-I283 HydrophobicContact CD2-CD1 3.91Å; L201-I283 HydrophobicContact CD2-CG1 4.21Å; L201-I283 HydrophobicContact CG-CD1 4.44Å; L201-I283 HydrophobicContact CG-CG1 4.19Å; L201-I283 PolarHBondContact N-O 2.93Å; L201-I283 PolarHBondContact O-N 3.43Å; L201-I283 VanDerWaalsContact O-O 3.09Å; L201-L285 HydrophobicContact CB-CD2 4.15Å; L201-L285 HydrophobicContact CB-CG 4.2Å; L201-L285 HydrophobicContact CD2-CD2 3.93Å; L201-L293 HydrophobicContact CD1-CD2 4.2Å; L201-L293 HydrophobicContact CD2-CD1 4.42Å; L201-L293 HydrophobicContact CD2-CD2 4.45Å
202	V	98.9	Very high	98.2	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127	174	177.9	0	0	0	0	108.8	L156 E157 L160 A193 L194 E200 T281 R282	L156-V202 HydrophobicContact CB-CB 3.96Å; L156-V202 HydrophobicContact CB-CG1 4.13Å; L156-V202 HydrophobicContact CB-CG2 3.85Å; L156-V202 HydrophobicContact CD1-CB 4.43Å; L156-V202 HydrophobicContact CD1-CG2 4.12Å; E157-V202 HydrophobicContact CB-CG1 4.48Å; E157-V202 HydrophobicContact CG-CG1 3.64Å; L160-V202 HydrophobicContact CD1-CG1 3.95Å; A193-V202 CarbonylContact C-O 3.57Å; A193-V202 WeakPolarHBondContact CA-O 3.31Å; L194-V202 PolarHBondContact N-O 3.05Å; L194-V202 PolarHBondContact O-N 2.63Å; E200-V202 HydrophobicContact CG-CG2 4.39Å; V202-T281 WeakPolarHBondContact CA-O 3.45Å; V202-R282 HydrophobicContact CG2-CB 3.93Å; V202-R282 HydrophobicContact CG2-CG 3.74Å
203	V	98.9	Very high	98.2	Very high	1 Å²	1	7 Å²	7	1%	0.006	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.7	177.9	-176.9	0	0	0	0	108.8	T191 V192 A193 L201 A211 L222 T223 T280 T281	T191-V203 HydrophobicContact CG2-CG1 4.11Å; V192-V203 CarbonylContact O-C 3.52Å; V192-V203 WeakPolarHBondContact O-CA 3.42Å; A193-V203 HydrophobicContact CB-CG2 3.97Å; L201-V203 HydrophobicContact CD1-CG2 4.22Å; L201-V203 HydrophobicContact CG-CG2 4.29Å; V203-A211 HydrophobicContact CG1-CB 3.83Å; V203-A211 HydrophobicContact CG2-CB 4.44Å; V203-L222 HydrophobicContact CB-CB 4.41Å; V203-L222 HydrophobicContact CG2-CB 4.18Å; V203-L222 HydrophobicContact CG2-CD1 3.74Å; V203-T223 HydrophobicContact CG1-CG2 3.79Å; V203-T280 CarbonylContact O-C 3.58Å; V203-T280 VanDerWaalsContact O-CA 3.24Å; V203-T280 WeakPolarHBondContact O-CA 3.36Å; V203-T281 PolarHBondContact N-O 2.96Å; V203-T281 PolarHBondContact O-N 3.37Å
204	A	98.9	Very high	98.1	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.7	170.3	0	0	0	0	0	109.3	L160 F164 V192 P278 E279 T280	L160-A204 HydrophobicContact CB-CB 3.53Å; L160-A204 HydrophobicContact CD1-CB 3.56Å; L160-A204 HydrophobicContact CG-CB 4.08Å; F164-A204 HydrophobicContact CE2-CB 3.98Å; F164-A204 HydrophobicContact CZ-CB 4Å; V192-A204 PolarHBondContact N-O 2.69Å; V192-A204 PolarHBondContact O-N 3.11Å; A204-P278 HydrophobicContact CB-CB 3.93Å; A204-P278 HydrophobicContact CB-CG 4.13Å; A204-E279 WeakPolarHBondContact CA-O 3.39Å; A204-T280 HydrophobicContact CB-CG2 3.94Å
205	S	98.9	Very high	97.9	Very high	2 Å²	2	9.5 Å²	9.5	1%	0.014	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	148.2	178	65.3	0	0	0	0	115.1	A190 T223 H226 P278 E279	A190-S205 CarbonylContact O-C 3.55Å; A190-S205 WeakPolarHBondContact O-CA 3.23Å; S205-T223 VanDerWaalsContact OG-CG2 3.23Å; S205-T223 WeakPolarHBondContact OG-CG2 3.36Å; S205-H226 PolarHBondContact O-CE1 3.26Å; S205-P278 VanDerWaalsContact O-CA 3.26Å; S205-P278 WeakPolarHBondContact O-CA 3.41Å; S205-P278 WeakPolarHBondContact O-CB 3.26Å; S205-E279 PolarHBondContact N-O 2.89Å; S205-E279 PolarHBondContact O-N 3.49Å
206	V	98.9	Very high	97.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.8	160.2	-64.7	0	0	0	0	108.9	F164 T189 A190 R262 I264 P278	F164-V206 HydrophobicContact CD1-CG1 4.09Å; F164-V206 HydrophobicContact CD1-CG2 4.13Å; F164-V206 HydrophobicContact CE1-CG1 4.32Å; F164-V206 HydrophobicContact CE1-CG2 4.04Å; T189-V206 WeakPolarHBondContact CA-O 3.39Å; T189-V206 WeakPolarHBondContact CB-O 3.26Å; A190-V206 HydrophobicContact CB-CG2 4.13Å; A190-V206 PolarHBondContact N-O 3.19Å; A190-V206 PolarHBondContact O-N 3.27Å; V206-R262 HydrophobicContact CB-CB 3.76Å; V206-R262 HydrophobicContact CG1-CB 3.92Å; V206-I264 HydrophobicContact CG2-CG1 4.11Å; V206-P278 HydrophobicContact CG1-CB 4.1Å
207	G	98.5	Very high	97.1	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.01	6%	0.058	C	C	.	.	S	Bend	trans	90.8	-150	-174.6	0	0	0	0	0	113	H226 R262	G207-H226 PolarHBondContact N-ND1 2.92Å; G207-H226 PolarHBondContact O-N 2.8Å; G207-H226 PolarHBondContact O-ND1 2.83Å; G207-R262 WeakPolarHBondContact CA-O 3.45Å; G207-R262 PolarHBondContact N-O 2.81Å; G207-R262 VanDerWaalsContact N-O 3.12Å
208	D	97.8	Very high	97.1	Very high	10 Å²	10	19.1 Å²	19.1	5%	0.053	9%	0.086	C	C	.	.	S	Bend	trans	-128.6	9.2	-171.5	53.1	3.4	0	0	0	114	T189 D225 M260 N301	T189-D208 WeakPolarHBondContact CG2-OD1 3.4Å; D208-D225 HydrophobicContact CB-CB 4.01Å; D208-M260 WeakPolarHBondContact OD1-CE 3.27Å; D208-N301 PolarHBondContact O-ND2 2.98Å
209	S	98.6	Very high	97.2	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.007	10%	0.095	C	C	.	.			trans	-62.2	143.1	156.5	-80.8	0	0	0	0	110.4	T189 T191 T296	T189-S209 WeakPolarHBondContact OG1-CB 3.25Å; T189-S209 PolarHBondContact OG1-OG 3.01Å; T191-S209 WeakPolarHBondContact OG1-CB 3.29Å; T191-S209 PolarHBondContact OG1-O 3.25Å; S209-T296 CarbonylContact C-O 3.54Å; S209-T296 WeakPolarHBondContact CA-O 3.46Å
210	R	98.6	Very high	97.3	Very high	36 Å²	36	23.4 Å²	23.4	14%	0.136	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149	-168.5	-68.1	-177.5	-173.9	148.3	4.3	113.1	T223 D225 L295 T296 N301	R210-T223 WeakPolarHBondContact CA-OG1 3.43Å; R210-D225 WeakPolarHBondContact CG-OD1 3.38Å; R210-D225 IonicContact CZ-OD1 3.65Å; R210-D225 IonicContact CZ-OD2 3.61Å; R210-D225 IonicContact NE-OD1 3.13Å; R210-D225 PolarHBondContact NE-OD1 3.46Å; R210-D225 IonicContact NE-OD2 3.25Å; R210-D225 PolarHBondContact NE-OD2 3.25Å; R210-D225 IonicContact NH2-OD1 3.41Å; R210-D225 IonicContact NH2-OD2 2.69Å; R210-D225 PolarHBondContact NH2-OD2 2.83Å; R210-L295 CarbonylContact O-C 3.58Å; R210-L295 VanDerWaalsContact O-CA 3.26Å; R210-L295 WeakPolarHBondContact O-CA 3.14Å; R210-T296 PolarHBondContact N-O 3.22Å; R210-T296 PolarHBondContact O-N 3.45Å; R210-N301 VanDerWaalsContact NH1-CB 3.33Å; R210-N301 PolarHBondContact NH1-O 3.46Å
211	A	98.8	Very high	97.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.9	164.5	0	0	0	0	0	110.5	T191 V203 L222 T223 L293 V294 L295	T191-A211 HydrophobicContact CG2-CB 3.91Å; V203-A211 HydrophobicContact CG1-CB 3.83Å; V203-A211 HydrophobicContact CG2-CB 4.44Å; A211-L222 HydrophobicContact CB-CB 4.1Å; A211-L222 HydrophobicContact CB-CD1 4.45Å; A211-L222 WeakPolarHBondContact O-CB 3.35Å; A211-L222 PolarHBondContact O-N 3.06Å; A211-T223 HydrophobicContact CB-CG2 3.96Å; A211-T223 PolarHBondContact N-OG1 2.78Å; A211-T223 VanDerWaalsContact N-OG1 3.15Å; A211-L293 HydrophobicContact CB-CD1 4.25Å; A211-V294 WeakPolarHBondContact CA-O 3.45Å; A211-L295 HydrophobicContact CB-CD2 3.43Å; A211-L295 VanDerWaalsContact CB-CD2 3.43Å
212	L	98.5	Very high	97.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.8	179	-50.7	171.5	0	0	0	110.1	M220 K221 L293 V294 I309	L212-M220 WeakPolarHBondContact CA-O 3.44Å; L212-K221 HydrophobicContact CD2-CB 4.22Å; L212-K221 HydrophobicContact CD2-CG 3.75Å; L212-L293 CarbonylContact O-C 3.55Å; L212-L293 WeakPolarHBondContact O-CA 3.26Å; L212-V294 HydrophobicContact CB-CG1 3.72Å; L212-V294 HydrophobicContact CD1-CG1 4.2Å; L212-V294 HydrophobicContact CG-CG1 4.34Å; L212-V294 PolarHBondContact N-O 2.97Å; L212-V294 PolarHBondContact O-N 3.15Å; L212-I309 HydrophobicContact CD1-CB 4.42Å; L212-I309 HydrophobicContact CD1-CD1 3.97Å; L212-I309 HydrophobicContact CD1-CG2 4.41Å
213	L	98.5	Very high	97.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.4	167.5	174.5	67.8	0	0	0	109.4	M220 L222 I283 L285 D290 F292 F346	L213-M220 HydrophobicContact CB-CB 4.31Å; L213-M220 HydrophobicContact CD2-SD 4.37Å; L213-M220 PolarHBondContact N-O 2.93Å; L213-M220 WeakPolarHBondContact O-CB 3.11Å; L213-M220 PolarHBondContact O-N 3.48Å; L213-L222 HydrophobicContact CB-CD1 4.12Å; L213-L222 HydrophobicContact CB-CD2 4.24Å; L213-L222 HydrophobicContact CB-CG 4.31Å; L213-I283 HydrophobicContact CB-CD1 4.47Å; L213-I283 HydrophobicContact CD2-CD1 3.38Å; L213-I283 HydrophobicContact CG-CD1 4.49Å; L213-L285 HydrophobicContact CD1-CD2 4.09Å; L213-L285 HydrophobicContact CD2-CD2 4.23Å; L213-D290 HydrophobicContact CD1-CB 4.16Å; L213-F292 WeakPolarHBondContact CD1-O 3.49Å; L213-F346 HydrophobicContact CD1-CD2 3.89Å; L213-F346 HydrophobicContact CD1-CE2 3.71Å
214	C	97.3	Very high	97.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	111.8	169.6	-177.6	0	0	0	0	110.2	K218 S291 F292	C214-K218 WeakPolarHBondContact CA-O 3.37Å; C214-S291 PolarHBondContact O-N 3.01Å; C214-F292 HydrophobicContact CB-CD1 3.91Å; C214-F292 HydrophobicContact CB-CD2 3.68Å; C214-F292 HydrophobicContact CB-CE1 3.51Å; C214-F292 HydrophobicContact CB-CE2 3.27Å; C214-F292 HydrophobicContact CB-CG 3.98Å; C214-F292 HydrophobicContact CB-CZ 3.17Å; C214-F292 PolarHBondContact N-O 2.87Å; C214-F292 VanDerWaalsContact SG-CZ 3.5Å
215	R	95.1	Very high	97.2	Very high	53 Å²	53	35.8 Å²	35.8	20%	0.2	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.1	177.3	-179.4	170	-70.4	171.1	1.2	109.1	G217 K218 K284 D289 D290	R215-G217 PolarHBondContact O-N 2.79Å; R215-K218 PolarHBondContact N-O 2.81Å; R215-K218 PolarHBondContact O-N 2.91Å; R215-K284 PolarHBondContact NH2-O 3.38Å; R215-K284 VanDerWaalsContact NH2-O 3.16Å; R215-D289 HydrophobicContact CG-CB 4.23Å; R215-D290 WeakPolarHBondContact CB-OD1 3.43Å; R215-D290 WeakPolarHBondContact CG-OD1 3.42Å; R215-D290 IonicContact CZ-OD1 3.62Å; R215-D290 IonicContact CZ-OD2 3.59Å; R215-D290 IonicContact NE-OD1 3.67Å; R215-D290 PolarHBondContact NE-OD1 3.15Å; R215-D290 IonicContact NE-OD2 3.18Å; R215-D290 IonicContact NH2-OD1 2.74Å; R215-D290 PolarHBondContact NH2-OD1 3.49Å; R215-D290 IonicContact NH2-OD2 3.33Å; R215-D290 PolarHBondContact NH2-OD2 2.96Å
216	K	91.6	Very high	97.2	Very high	114 Å²	114	35.7 Å²	35.7	50%	0.496	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	41.6	-177.5	-55.9	-176.9	178.9	179.9	0	112.9	K218 D289 Y352	K216-K218 PolarHBondContact O-N 3.49Å; K216-D289 WeakPolarHBondContact CE-OD1 3.28Å; K216-D289 WeakPolarHBondContact CE-OD2 3.32Å; K216-D289 HydrophobicContact CG-CB 4.08Å; K216-D289 PolarHBondContact N-O 3.16Å; K216-D289 IonicContact NZ-OD1 3.04Å; K216-D289 IonicContact NZ-OD2 3.83Å; K216-D289 PolarHBondContact NZ-OD2 2.93Å; K216-Y352 HydrophobicContact CB-CE1 4.26Å; K216-Y352 HydrophobicContact CG-CE1 4.42Å
217	G	88.9	Confident	97.1	Very high	5 Å²	5	37.4 Å²	37.4	5%	0.052	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	5	-179.1	0	0	0	0	0	115.5	R215	R215-G217 PolarHBondContact O-N 2.79Å
218	K	94.5	Very high	97	Very high	147 Å²	147	37.4 Å²	37.4	64%	0.639	18%	0.181	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.9	-179.2	-64.5	-175.1	-179.8	-177.7	0	111.9	C214 R215 K216	C214-K218 WeakPolarHBondContact CA-O 3.37Å; R215-K218 PolarHBondContact N-O 2.81Å; R215-K218 PolarHBondContact O-N 2.91Å; K216-K218 PolarHBondContact O-N 3.49Å
219	P	96.8	Very high	96.9	Very high	37 Å²	37	43.1 Å²	43.1	24%	0.24	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.8	175.8	28.7	-33.9	0	0	0	111.5	Q307 C310	P219-Q307 HydrophobicContact CG-CB 4.25Å; P219-C310 VanDerWaalsContact CB-SG 3.58Å
220	M	98	Very high	96.8	Very high	68 Å²	68	45 Å²	45	34%	0.335	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115.3	164.1	178.9	179.4	-63.8	0	0	108	L212 L213 L222	L212-M220 WeakPolarHBondContact CA-O 3.44Å; L213-M220 HydrophobicContact CB-CB 4.31Å; L213-M220 HydrophobicContact CD2-SD 4.37Å; L213-M220 PolarHBondContact N-O 2.93Å; L213-M220 WeakPolarHBondContact O-CB 3.11Å; L213-M220 PolarHBondContact O-N 3.48Å; M220-L222 HydrophobicContact CG-CD2 4.29Å; M220-L222 PolarHBondContact O-N 2.89Å; M220-L222 HydrophobicContact SD-CD2 4.48Å
221	K	98.1	Very high	96.8	Very high	140 Å²	140	51.3 Å²	51.3	61%	0.609	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	127.6	177.8	-62.1	-175.9	178	-173.1	0	109.9	L212 S306	L212-K221 HydrophobicContact CD2-CB 4.22Å; L212-K221 HydrophobicContact CD2-CG 3.75Å; K221-S306 WeakPolarHBondContact CE-OG 3.14Å
222	L	98.6	Very high	96.7	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.026	26%	0.261	C	S	.	.			trans	-102.1	-14.9	176.5	-53.6	-178.4	0	0	0	112.4	L201 V203 A211 L213 M220 T281 I283 L293	L201-L222 HydrophobicContact CD2-CD1 3.96Å; V203-L222 HydrophobicContact CB-CB 4.41Å; V203-L222 HydrophobicContact CG2-CB 4.18Å; V203-L222 HydrophobicContact CG2-CD1 3.74Å; A211-L222 HydrophobicContact CB-CB 4.1Å; A211-L222 HydrophobicContact CB-CD1 4.45Å; A211-L222 WeakPolarHBondContact O-CB 3.35Å; A211-L222 PolarHBondContact O-N 3.06Å; L213-L222 HydrophobicContact CB-CD1 4.12Å; L213-L222 HydrophobicContact CB-CD2 4.24Å; L213-L222 HydrophobicContact CB-CG 4.31Å; M220-L222 HydrophobicContact CG-CD2 4.29Å; M220-L222 PolarHBondContact O-N 2.89Å; M220-L222 HydrophobicContact SD-CD2 4.48Å; L222-T281 HydrophobicContact CD2-CG2 4.39Å; L222-T281 VanDerWaalsContact O-CB 3.25Å; L222-T281 WeakPolarHBondContact O-CB 3.3Å; L222-T281 PolarHBondContact O-OG1 2.84Å; L222-I283 HydrophobicContact CD1-CD1 4.24Å; L222-I283 HydrophobicContact CD2-CD1 3.61Å; L222-I283 HydrophobicContact CD2-CG1 4.24Å; L222-I283 HydrophobicContact CD2-CG2 4.46Å; L222-L293 HydrophobicContact CD1-CD1 3.81Å
223	T	98.6	Very high	96.7	Very high	9 Å²	9	54.7 Å²	54.7	6%	0.055	26%	0.261	C	S	.	.			trans	-125.4	157.7	175.9	61.2	0	0	0	0	110.8	T191 V203 S205 R210 A211	T191-T223 HydrophobicContact CG2-CG2 4.1Å; V203-T223 HydrophobicContact CG1-CG2 3.79Å; S205-T223 VanDerWaalsContact OG-CG2 3.23Å; S205-T223 WeakPolarHBondContact OG-CG2 3.36Å; R210-T223 WeakPolarHBondContact CA-OG1 3.43Å; A211-T223 HydrophobicContact CB-CG2 3.96Å; A211-T223 PolarHBondContact N-OG1 2.78Å; A211-T223 VanDerWaalsContact N-OG1 3.15Å
224	T	98	Very high	96.7	Very high	83 Å²	83	57.9 Å²	57.9	51%	0.509	28%	0.275	S	S	.	.			trans	-125.4	124.3	172.1	-59.1	0	0	0	0	108.2	H226	T224-H226 PolarHBondContact O-N 3.33Å
225	D	98.2	Very high	96.7	Very high	39 Å²	39	64.3 Å²	64.3	21%	0.209	31%	0.305	C	S	.	.			trans	-56.2	133.2	-176.2	-51.1	-0.3	0	0	0	111.7	D208 R210 T227	D208-D225 HydrophobicContact CB-CB 4.01Å; R210-D225 WeakPolarHBondContact CG-OD1 3.38Å; R210-D225 IonicContact CZ-OD1 3.65Å; R210-D225 IonicContact CZ-OD2 3.61Å; R210-D225 IonicContact NE-OD1 3.13Å; R210-D225 PolarHBondContact NE-OD1 3.46Å; R210-D225 IonicContact NE-OD2 3.25Å; R210-D225 PolarHBondContact NE-OD2 3.25Å; R210-D225 IonicContact NH2-OD1 3.41Å; R210-D225 IonicContact NH2-OD2 2.69Å; R210-D225 PolarHBondContact NH2-OD2 2.83Å; D225-T227 HydrophobicContact CB-CG2 3.83Å; D225-T227 PolarHBondContact O-N 3.31Å
226	H	98.4	Very high	96.9	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.303	C	S	.	.			trans	-88.8	79.2	177	-60.5	101.5	0	0	0	110.1	S205 G207 T224 R230 E233 M260 T261 R262 E279	S205-H226 PolarHBondContact O-CE1 3.26Å; G207-H226 PolarHBondContact N-ND1 2.92Å; G207-H226 PolarHBondContact O-N 2.8Å; G207-H226 PolarHBondContact O-ND1 2.83Å; T224-H226 PolarHBondContact O-N 3.33Å; H226-R230 PolarHBondContact CD2-NH1 3.48Å; H226-E233 IonicContact CD2-OE2 3.09Å; H226-M260 CarbonylContact O-C 3.43Å; H226-M260 VanDerWaalsContact O-CA 3.23Å; H226-M260 WeakPolarHBondContact O-CA 3.44Å; H226-M260 WeakPolarHBondContact O-CB 3.42Å; H226-T261 PolarHBondContact O-N 2.6Å; H226-T261 PolarHBondContact O-OG1 3.33Å; H226-T261 VanDerWaalsContact O-OG1 3.05Å; H226-R262 HydrophobicContact CB-CB 4.1Å; H226-R262 HydrophobicContact CB-CG 4.02Å; H226-R262 VanDerWaalsContact CD2-CD 3.41Å; H226-R262 WeakPolarHBondContact CD2-CD 3.19Å; H226-R262 PolarHBondContact CD2-NE 2.94Å; H226-E279 WeakPolarHBondContact NE2-CG 3.45Å; H226-E279 IonicContact NE2-OE2 2.85Å; H226-E279 PolarHBondContact NE2-OE2 3.29Å
227	T	96.9	Very high	97.2	Very high	36 Å²	36	58.4 Å²	58.4	22%	0.221	28%	0.279	C	S	.	.			trans	-109.8	155.8	-177.7	73.1	0	0	0	0	112.2	D225 E229 R230	D225-T227 HydrophobicContact CB-CG2 3.83Å; D225-T227 PolarHBondContact O-N 3.31Å; T227-E229 PolarHBondContact O-N 3.42Å; T227-R230 WeakPolarHBondContact O-CB 3.16Å; T227-R230 PolarHBondContact O-N 3.23Å
228	P	97	Very high	97.6	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.013	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.3	176.3	-23.9	33.5	0	0	0	115.1	V244 P252 V254 A259 T261	P228-V244 HydrophobicContact CB-CG1 3.79Å; P228-V244 HydrophobicContact CB-CG2 3.94Å; P228-P252 HydrophobicContact CB-CB 4Å; P228-P252 HydrophobicContact CB-CG 4.26Å; P228-P252 HydrophobicContact CG-CB 4.44Å; P228-V254 HydrophobicContact CG-CG2 3.93Å; P228-A259 WeakPolarHBondContact CD-O 3.42Å; P228-T261 HydrophobicContact CB-CG2 4.21Å; P228-T261 HydrophobicContact CG-CG2 3.86Å
229	E	94.9	Very high	97.8	Very high	129 Å²	129	66.3 Å²	66.3	60%	0.603	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-26.3	174.2	-60.5	-163.6	140.4	0	0	112.4	T227 K231 P252	T227-E229 PolarHBondContact O-N 3.42Å; E229-K231 PolarHBondContact O-N 2.94Å; E229-P252 HydrophobicContact CG-CG 3.64Å
230	R	97.4	Very high	97.9	Very high	41 Å²	41	67.4 Å²	67.4	16%	0.155	32%	0.32	C	S	.	.	S	Bend	trans	-66.7	128.6	177.8	-137.3	176.1	75.1	174.8	6.5	109.5	H226 T227 D232 E233 K234 R262 E279	H226-R230 PolarHBondContact CD2-NH1 3.48Å; T227-R230 WeakPolarHBondContact O-CB 3.16Å; T227-R230 PolarHBondContact O-N 3.23Å; R230-D232 VanDerWaalsContact CG-OD1 3.26Å; R230-D232 WeakPolarHBondContact CG-OD1 3.32Å; R230-D232 IonicContact CZ-OD1 3.59Å; R230-D232 IonicContact CZ-OD2 3.27Å; R230-D232 IonicContact NE-OD1 2.7Å; R230-D232 PolarHBondContact NE-OD1 3.46Å; R230-D232 IonicContact NE-OD2 2.84Å; R230-D232 PolarHBondContact NE-OD2 3.34Å; R230-D232 IonicContact NH2-OD1 3.61Å; R230-D232 IonicContact NH2-OD2 3.71Å; R230-D232 PolarHBondContact NH2-OD2 3.29Å; R230-D232 PolarHBondContact O-N 2.9Å; R230-E233 HydrophobicContact CB-CB 4.04Å; R230-E233 HydrophobicContact CB-CG 3.73Å; R230-E233 HydrophobicContact CG-CG 4.41Å; R230-E233 IonicContact CZ-OE1 3.86Å; R230-E233 VanDerWaalsContact NE-CG 3.26Å; R230-E233 IonicContact NH2-OE1 2.68Å; R230-E233 PolarHBondContact NH2-OE1 2.92Å; R230-E233 PolarHBondContact O-N 2.86Å; R230-K234 VanDerWaalsContact O-CB 3.31Å; R230-K234 WeakPolarHBondContact O-CB 3.16Å; R230-K234 PolarHBondContact O-N 3.47Å; R230-R262 VanDerWaalsContact NH2-NH2 3.13Å; R230-E279 IonicContact CZ-OE1 3.96Å; R230-E279 IonicContact CZ-OE2 2.81Å; R230-E279 IonicContact NH1-OE1 2.91Å; R230-E279 PolarHBondContact NH1-OE1 3.44Å; R230-E279 IonicContact NH1-OE2 3.74Å; R230-E279 PolarHBondContact NH1-OE2 3.04Å; R230-E279 IonicContact NH2-OE1 2.78Å; R230-E279 PolarHBondContact NH2-OE1 2.93Å; R230-E279 IonicContact NH2-OE2 3Å
231	K	97.9	Very high	97.8	Very high	168 Å²	168	67.2 Å²	67.2	73%	0.73	34%	0.336	S	S	*	.	H	α-helix	trans	-64.2	-46.4	-167.5	-69.1	-174.8	179.3	177.7	0	112.6	E229 K234 E235	E229-K231 PolarHBondContact O-N 2.94Å; K231-K234 PolarHBondContact O-N 3.49Å; K231-E235 WeakPolarHBondContact O-CB 3.45Å; K231-E235 VanDerWaalsContact O-CG 3.29Å; K231-E235 WeakPolarHBondContact O-CG 3.4Å; K231-E235 PolarHBondContact O-N 3.49Å
232	D	98.1	Very high	97.8	Very high	72 Å²	72	60.9 Å²	60.9	39%	0.385	31%	0.31	S	S	.	.	H	α-helix	trans	-61	-44.4	176.5	59.7	-34.8	0	0	0	112.1	R230 E235 R236	R230-D232 VanDerWaalsContact CG-OD1 3.26Å; R230-D232 WeakPolarHBondContact CG-OD1 3.32Å; R230-D232 IonicContact CZ-OD1 3.59Å; R230-D232 IonicContact CZ-OD2 3.27Å; R230-D232 IonicContact NE-OD1 2.7Å; R230-D232 PolarHBondContact NE-OD1 3.46Å; R230-D232 IonicContact NE-OD2 2.84Å; R230-D232 PolarHBondContact NE-OD2 3.34Å; R230-D232 IonicContact NH2-OD1 3.61Å; R230-D232 IonicContact NH2-OD2 3.71Å; R230-D232 PolarHBondContact NH2-OD2 3.29Å; R230-D232 PolarHBondContact O-N 2.9Å; D232-E235 PolarHBondContact O-N 3.1Å; D232-R236 PolarHBondContact O-N 3.2Å
233	E	98.4	Very high	97.7	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-47.1	176.9	-59.5	-67.7	103.1	0	0	110.9	H226 R230 E235 R236 I237 T261 R262	H226-E233 IonicContact CD2-OE2 3.09Å; R230-E233 HydrophobicContact CB-CB 4.04Å; R230-E233 HydrophobicContact CB-CG 3.73Å; R230-E233 HydrophobicContact CG-CG 4.41Å; R230-E233 IonicContact CZ-OE1 3.86Å; R230-E233 VanDerWaalsContact NE-CG 3.26Å; R230-E233 IonicContact NH2-OE1 2.68Å; R230-E233 PolarHBondContact NH2-OE1 2.92Å; R230-E233 PolarHBondContact O-N 2.86Å; E233-E235 VanDerWaalsContact C-N 3.31Å; E233-E235 PolarHBondContact O-N 3.42Å; E233-R236 WeakPolarHBondContact O-CB 3.39Å; E233-R236 PolarHBondContact O-N 2.87Å; E233-R236 IonicContact OE1-CZ 3.21Å; E233-R236 IonicContact OE1-NH1 3.11Å; E233-R236 PolarHBondContact OE1-NH1 3.48Å; E233-R236 IonicContact OE1-NH2 2.94Å; E233-R236 IonicContact OE2-CZ 3.46Å; E233-R236 IonicContact OE2-NH1 3.69Å; E233-R236 PolarHBondContact OE2-NH1 3.37Å; E233-R236 IonicContact OE2-NH2 3.46Å; E233-R236 PolarHBondContact OE2-NH2 3.28Å; E233-I237 WeakPolarHBondContact O-CG1 3.26Å; E233-I237 PolarHBondContact O-N 3.17Å; E233-T261 HydrophobicContact CB-CG2 3.99Å; E233-T261 WeakPolarHBondContact CB-OG1 3.4Å; E233-T261 WeakPolarHBondContact CG-OG1 3.45Å; E233-T261 WeakPolarHBondContact OE2-CB 3.45Å; E233-T261 PolarHBondContact OE2-OG1 3.31Å; E233-R262 IonicContact OE1-CZ 3.42Å; E233-R262 IonicContact OE1-NE 3.89Å; E233-R262 PolarHBondContact OE1-NE 3.27Å; E233-R262 VanDerWaalsContact OE1-NE 3.16Å; E233-R262 IonicContact OE1-NH2 2.69Å; E233-R262 PolarHBondContact OE1-NH2 3.45Å; E233-R262 WeakPolarHBondContact OE2-CG 3.48Å; E233-R262 IonicContact OE2-NE 2.76Å; E233-R262 PolarHBondContact OE2-NE 3.21Å; E233-R262 VanDerWaalsContact OE2-NE 3.11Å
234	K	97.6	Very high	97.7	Very high	67 Å²	67	67.3 Å²	67.3	29%	0.291	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-38.8	177.2	-173.7	174.8	-173.3	168.2	0	112.6	R230 K231 K238 V244	R230-K234 VanDerWaalsContact O-CB 3.31Å; R230-K234 WeakPolarHBondContact O-CB 3.16Å; R230-K234 PolarHBondContact O-N 3.47Å; K231-K234 PolarHBondContact O-N 3.49Å; K234-K238 WeakPolarHBondContact O-CG 3.43Å; K234-K238 PolarHBondContact O-N 3.47Å; K234-K238 VanDerWaalsContact O-N 3.15Å; K234-V244 HydrophobicContact CG-CG2 4.42Å
235	E	98.1	Very high	97.6	Very high	134 Å²	134	64.8 Å²	64.8	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-64.7	-43.7	175.1	-78	173	-162.2	0	0	111.4	K231 D232 E233 K238 K239	K231-E235 WeakPolarHBondContact O-CB 3.45Å; K231-E235 VanDerWaalsContact O-CG 3.29Å; K231-E235 WeakPolarHBondContact O-CG 3.4Å; K231-E235 PolarHBondContact O-N 3.49Å; D232-E235 PolarHBondContact O-N 3.1Å; E233-E235 VanDerWaalsContact C-N 3.31Å; E233-E235 PolarHBondContact O-N 3.42Å; E235-K238 PolarHBondContact O-N 3.5Å; E235-K239 VanDerWaalsContact O-CB 3.31Å; E235-K239 WeakPolarHBondContact O-CB 3.33Å; E235-K239 PolarHBondContact O-N 3.33Å
236	R	98.6	Very high	97.5	Very high	43 Å²	43	70 Å²	70	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-59.6	-49.8	174.5	-175.8	-176.6	65.2	-106.9	-0.6	111.7	D232 E233 K238 K239 C240 T261 G273	D232-R236 PolarHBondContact O-N 3.2Å; E233-R236 WeakPolarHBondContact O-CB 3.39Å; E233-R236 PolarHBondContact O-N 2.87Å; E233-R236 IonicContact OE1-CZ 3.21Å; E233-R236 IonicContact OE1-NH1 3.11Å; E233-R236 PolarHBondContact OE1-NH1 3.48Å; E233-R236 IonicContact OE1-NH2 2.94Å; E233-R236 IonicContact OE2-CZ 3.46Å; E233-R236 IonicContact OE2-NH1 3.69Å; E233-R236 PolarHBondContact OE2-NH1 3.37Å; E233-R236 IonicContact OE2-NH2 3.46Å; E233-R236 PolarHBondContact OE2-NH2 3.28Å; R236-K238 VanDerWaalsContact C-N 3.32Å; R236-K238 PolarHBondContact O-N 3.18Å; R236-K239 PolarHBondContact O-N 3.12Å; R236-K239 VanDerWaalsContact O-N 3.13Å; R236-C240 PolarHBondContact O-N 3.43Å; R236-C240 PolarHBondContact O-SG 2.99Å; R236-T261 PolarHBondContact NH2-O 3.5Å; R236-G273 PolarHBondContact NE-O 3.08Å; R236-G273 PolarHBondContact NH2-O 3.32Å
237	I	98.6	Very high	97.2	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-54.6	-49.2	179.3	-66.4	-57.6	0	0	0	110.7	E233 K239 C240 G241 G242 V244 V254 T261 S272 V274	E233-I237 WeakPolarHBondContact O-CG1 3.26Å; E233-I237 PolarHBondContact O-N 3.17Å; I237-K239 PolarHBondContact O-N 3.22Å; I237-C240 PolarHBondContact O-N 3.43Å; I237-G241 PolarHBondContact O-N 2.91Å; I237-G242 WeakPolarHBondContact O-CA 3.05Å; I237-G242 PolarHBondContact O-N 3.47Å; I237-V244 HydrophobicContact CG2-CG2 4.46Å; I237-V254 HydrophobicContact CD1-CG1 3.96Å; I237-V254 HydrophobicContact CD1-CG2 4.13Å; I237-V254 HydrophobicContact CG1-CG1 4.49Å; I237-V254 HydrophobicContact CG1-CG2 4.22Å; I237-V254 HydrophobicContact CG2-CG1 4.04Å; I237-T261 HydrophobicContact CD1-CG2 4.38Å; I237-T261 HydrophobicContact CG1-CG2 4.01Å; I237-S272 WeakPolarHBondContact CD1-O 3.48Å; I237-V274 HydrophobicContact CD1-CG2 4.11Å
238	K	97.8	Very high	96.9	Very high	131 Å²	131	77.1 Å²	77.1	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-62.9	-42.1	177.9	-71.9	176.4	177.7	-173.7	0	112.8	K234 E235 R236 C240 G241	K234-K238 WeakPolarHBondContact O-CG 3.43Å; K234-K238 PolarHBondContact O-N 3.47Å; K234-K238 VanDerWaalsContact O-N 3.15Å; E235-K238 PolarHBondContact O-N 3.5Å; R236-K238 VanDerWaalsContact C-N 3.32Å; R236-K238 PolarHBondContact O-N 3.18Å; K238-C240 VanDerWaalsContact C-N 3.26Å; K238-C240 PolarHBondContact O-N 2.96Å; K238-G241 PolarHBondContact O-N 2.94Å; K238-G241 VanDerWaalsContact O-N 3.1Å
239	K	98.3	Very high	96.5	Very high	188 Å²	188	82.7 Å²	82.7	82%	0.817	42%	0.42	S	S	*	.	H	α-helix	trans	-63.6	-33.8	179.7	-175.7	-179.3	176.4	-175.1	0	112	E235 R236 I237 G241	E235-K239 VanDerWaalsContact O-CB 3.31Å; E235-K239 WeakPolarHBondContact O-CB 3.33Å; E235-K239 PolarHBondContact O-N 3.33Å; R236-K239 PolarHBondContact O-N 3.12Å; R236-K239 VanDerWaalsContact O-N 3.13Å; I237-K239 PolarHBondContact O-N 3.22Å; K239-G241 VanDerWaalsContact C-N 3.27Å; K239-G241 PolarHBondContact O-N 3.15Å
240	C	98	Very high	96.3	Very high	60 Å²	60	78.5 Å²	78.5	41%	0.405	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	6.3	176	-66.6	0	0	0	0	113.5	R236 I237 K238 G242 A271	R236-C240 PolarHBondContact O-N 3.43Å; R236-C240 PolarHBondContact O-SG 2.99Å; I237-C240 PolarHBondContact O-N 3.43Å; K238-C240 VanDerWaalsContact C-N 3.26Å; K238-C240 PolarHBondContact O-N 2.96Å; C240-G242 VanDerWaalsContact C-N 3.33Å; C240-G242 PolarHBondContact O-N 2.91Å; C240-A271 VanDerWaalsContact O-O 3.13Å
241	G	97.4	Very high	96	Very high	64 Å²	64	81 Å²	81	66%	0.66	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	4	177.5	0	0	0	0	0	115.1	I237 K238 K239	I237-G241 PolarHBondContact O-N 2.91Å; K238-G241 PolarHBondContact O-N 2.94Å; K238-G241 VanDerWaalsContact O-N 3.1Å; K239-G241 VanDerWaalsContact C-N 3.27Å; K239-G241 PolarHBondContact O-N 3.15Å
242	G	97.7	Very high	95.9	Very high	7 Å²	7	73.8 Å²	73.8	7%	0.072	40%	0.395	C	S	.	.			trans	-76.4	167.7	168.6	0	0	0	0	0	112.3	I237 C240 N255	I237-G242 WeakPolarHBondContact O-CA 3.05Å; I237-G242 PolarHBondContact O-N 3.47Å; C240-G242 VanDerWaalsContact C-N 3.33Å; C240-G242 PolarHBondContact O-N 2.91Å; G242-N255 WeakPolarHBondContact CA-OD1 3.46Å
243	F	96.8	Very high	95.8	Very high	120 Å²	120	72 Å²	72	53%	0.526	38%	0.384	S	S	.	.			trans	-134	163.8	175.3	64.2	-86.4	0	0	0	111.3	A245 V254 N255	F243-A245 HydrophobicContact CD2-CB 4.23Å; F243-A245 HydrophobicContact CE2-CB 3.99Å; F243-V254 WeakPolarHBondContact O-CA 3.45Å; F243-N255 HydrophobicContact CE1-CB 4.02Å; F243-N255 HydrophobicContact CZ-CB 4.13Å; F243-N255 PolarHBondContact N-OD1 3.35Å; F243-N255 PolarHBondContact O-N 2.82Å; F243-N255 PolarHBondContact O-OD1 3.3Å
244	V	97.6	Very high	95.8	Very high	28 Å²	28	72 Å²	72	17%	0.17	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.6	174.7	-179.5	0	0	0	0	108	P228 K234 I237 P252 H253	P228-V244 HydrophobicContact CB-CG1 3.79Å; P228-V244 HydrophobicContact CB-CG2 3.94Å; K234-V244 HydrophobicContact CG-CG2 4.42Å; I237-V244 HydrophobicContact CG2-CG2 4.46Å; V244-P252 HydrophobicContact CG1-CB 3.63Å; V244-H253 WeakPolarHBondContact CA-O 3.44Å
245	A	96.2	Very high	95.8	Very high	31 Å²	31	70.8 Å²	70.8	26%	0.256	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	154.6	173.3	0	0	0	0	0	110.3	F243 P252 H253	F243-A245 HydrophobicContact CD2-CB 4.23Å; F243-A245 HydrophobicContact CE2-CB 3.99Å; A245-P252 CarbonylContact O-C 3.57Å; A245-P252 WeakPolarHBondContact O-CA 3.33Å; A245-H253 PolarHBondContact N-O 3.22Å; A245-H253 PolarHBondContact O-N 3.17Å
246	W	95.2	Very high	95.6	Very high	149 Å²	149	66.8 Å²	66.8	56%	0.564	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.2	-179.4	-63.6	73.5	0	0	0	108.3	G250 P252	W246-G250 WeakPolarHBondContact CZ3-O 3.4Å; W246-P252 HydrophobicContact CD2-CB 4.23Å; W246-P252 HydrophobicContact CE3-CB 4.28Å; W246-P252 HydrophobicContact CH2-CB 4.14Å; W246-P252 HydrophobicContact CH2-CG 4.31Å; W246-P252 HydrophobicContact CZ2-CB 4.1Å; W246-P252 HydrophobicContact CZ3-CB 4.24Å; W246-P252 HydrophobicContact CZ3-CG 4.34Å
247	N	92.1	Very high	95.5	Very high	57 Å²	57	68.8 Å²	68.8	31%	0.305	38%	0.383	S	S	.	.			trans	-75	177.1	173.9	72.6	7.1	0	0	0	110.9	L249 G250 Q251 H253	N247-L249 PolarHBondContact O-N 3.4Å; N247-L249 VanDerWaalsContact O-N 3.16Å; N247-L249 WeakPolarHBondContact OD1-CA 3.28Å; N247-L249 WeakPolarHBondContact OD1-CB 3.17Å; N247-L249 PolarHBondContact OD1-N 3.45Å; N247-G250 PolarHBondContact O-N 3.05Å; N247-G250 PolarHBondContact OD1-N 3.38Å; N247-G250 VanDerWaalsContact OD1-N 3.09Å; N247-Q251 PolarHBondContact N-O 3.42Å; N247-Q251 VanDerWaalsContact N-O 3.11Å; N247-Q251 PolarHBondContact ND2-OE1 3.41Å; N247-Q251 PolarHBondContact OD1-N 2.78Å; N247-H253 PolarHBondContact ND2-CE1 3.2Å
248	S	91.4	Very high	95.4	Very high	127 Å²	127	69.2 Å²	69.2	89%	0.888	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21	178.3	48.9	0	0	0	0	114	G250	S248-G250 VanDerWaalsContact C-N 3.33Å
249	L	88	Confident	95.4	Very high	120 Å²	120	65 Å²	65	63%	0.628	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	1.1	177.5	-56.5	178.3	0	0	0	112.7	N247 Q251	N247-L249 PolarHBondContact O-N 3.4Å; N247-L249 VanDerWaalsContact O-N 3.16Å; N247-L249 WeakPolarHBondContact OD1-CA 3.28Å; N247-L249 WeakPolarHBondContact OD1-CB 3.17Å; N247-L249 PolarHBondContact OD1-N 3.45Å; L249-Q251 VanDerWaalsContact C-N 3.34Å; L249-Q251 HydrophobicContact CB-CG 4.45Å
250	G	90.9	Very high	95.3	Very high	41 Å²	41	56.5 Å²	56.5	42%	0.423	34%	0.338	S	S	.	.	S	Bend	trans	71.5	27.5	-177.9	0	0	0	0	0	113.4	W246 N247 S248	W246-G250 WeakPolarHBondContact CZ3-O 3.4Å; N247-G250 PolarHBondContact O-N 3.05Å; N247-G250 PolarHBondContact OD1-N 3.38Å; N247-G250 VanDerWaalsContact OD1-N 3.09Å; S248-G250 VanDerWaalsContact C-N 3.33Å
251	Q	90.6	Very high	95.4	Very high	94 Å²	94	53.6 Å²	53.6	44%	0.439	32%	0.319	S	S	.	.			trans	-96.5	130.4	173.1	-62.6	166.8	-48.7	0	0	110.2	N247 L249 H253	N247-Q251 PolarHBondContact N-O 3.42Å; N247-Q251 VanDerWaalsContact N-O 3.11Å; N247-Q251 PolarHBondContact ND2-OE1 3.41Å; N247-Q251 PolarHBondContact OD1-N 2.78Å; L249-Q251 VanDerWaalsContact C-N 3.34Å; L249-Q251 HydrophobicContact CB-CG 4.45Å; Q251-H253 PolarHBondContact O-ND1 3.25Å
252	P	95.9	Very high	95.4	Very high	16 Å²	16	51.5 Å²	51.5	10%	0.104	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.4	-177.3	33.9	-34.9	0	0	0	111.5	P228 E229 V244 A245 W246	P228-P252 HydrophobicContact CB-CB 4Å; P228-P252 HydrophobicContact CB-CG 4.26Å; P228-P252 HydrophobicContact CG-CB 4.44Å; E229-P252 HydrophobicContact CG-CG 3.64Å; V244-P252 HydrophobicContact CG1-CB 3.63Å; A245-P252 CarbonylContact O-C 3.57Å; A245-P252 WeakPolarHBondContact O-CA 3.33Å; W246-P252 HydrophobicContact CD2-CB 4.23Å; W246-P252 HydrophobicContact CE3-CB 4.28Å; W246-P252 HydrophobicContact CH2-CB 4.14Å; W246-P252 HydrophobicContact CH2-CG 4.31Å; W246-P252 HydrophobicContact CZ2-CB 4.1Å; W246-P252 HydrophobicContact CZ3-CB 4.24Å; W246-P252 HydrophobicContact CZ3-CG 4.34Å
253	H	97.3	Very high	95.5	Very high	34 Å²	34	51.1 Å²	51.1	16%	0.157	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134	-179	-68.7	69.8	0	0	0	110.8	V244 A245 N247 Q251 N255 G256 L258	V244-H253 WeakPolarHBondContact CA-O 3.44Å; A245-H253 PolarHBondContact N-O 3.22Å; A245-H253 PolarHBondContact O-N 3.17Å; N247-H253 PolarHBondContact ND2-CE1 3.2Å; Q251-H253 PolarHBondContact O-ND1 3.25Å; H253-N255 PolarHBondContact O-N 3.1Å; H253-G256 PolarHBondContact O-N 2.93Å; H253-L258 CarbonylContact C-O 3.52Å; H253-L258 VanDerWaalsContact CA-O 3.22Å; H253-L258 WeakPolarHBondContact CA-O 3.29Å
254	V	97.6	Very high	95.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	125.7	171.3	-176.4	0	0	0	0	109.1	P228 I237 F243 G256 R257 L258 M260 T261 V274	P228-V254 HydrophobicContact CG-CG2 3.93Å; I237-V254 HydrophobicContact CD1-CG1 3.96Å; I237-V254 HydrophobicContact CD1-CG2 4.13Å; I237-V254 HydrophobicContact CG1-CG1 4.49Å; I237-V254 HydrophobicContact CG1-CG2 4.22Å; I237-V254 HydrophobicContact CG2-CG1 4.04Å; F243-V254 WeakPolarHBondContact O-CA 3.45Å; V254-G256 PolarHBondContact O-N 2.98Å; V254-R257 PolarHBondContact O-N 3.33Å; V254-L258 HydrophobicContact CB-CB 4.48Å; V254-L258 PolarHBondContact N-O 3.09Å; V254-L258 PolarHBondContact O-N 2.93Å; V254-L258 VanDerWaalsContact O-N 3.15Å; V254-M260 WeakPolarHBondContact CG2-O 3.41Å; V254-T261 HydrophobicContact CG2-CG2 3.8Å; V254-V274 HydrophobicContact CB-CG2 4.45Å; V254-V274 HydrophobicContact CG1-CG2 3.92Å
255	N	96.9	Very high	95.6	Very high	43 Å²	43	44.1 Å²	44.1	23%	0.23	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	27.4	-174.9	-63.8	5	0	0	0	113.6	G242 F243 H253 R257 L269 S272	G242-N255 WeakPolarHBondContact CA-OD1 3.46Å; F243-N255 HydrophobicContact CE1-CB 4.02Å; F243-N255 HydrophobicContact CZ-CB 4.13Å; F243-N255 PolarHBondContact N-OD1 3.35Å; F243-N255 PolarHBondContact O-N 2.82Å; F243-N255 PolarHBondContact O-OD1 3.3Å; H253-N255 PolarHBondContact O-N 3.1Å; N255-R257 PolarHBondContact O-N 2.93Å; N255-L269 HydrophobicContact CB-CD2 3.91Å; N255-S272 PolarHBondContact ND2-OG 2.88Å
256	G	95.3	Very high	95.7	Very high	49 Å²	49	42.6 Å²	42.6	51%	0.505	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	13.5	-176.7	0	0	0	0	0	115.2	H253 V254	H253-G256 PolarHBondContact O-N 2.93Å; V254-G256 PolarHBondContact O-N 2.98Å
257	R	95.8	Very high	95.8	Very high	86 Å²	86	36.8 Å²	36.8	33%	0.325	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-51.6	-172.6	-175.5	-171	134	141	11.4	113.8	T185 V254 N255 D266 D268	T185-R257 PolarHBondContact O-NH2 2.8Å; V254-R257 PolarHBondContact O-N 3.33Å; N255-R257 PolarHBondContact O-N 2.93Å; R257-D266 IonicContact NH2-OD1 2.68Å; R257-D266 PolarHBondContact NH2-OD1 3.11Å; R257-D266 VanDerWaalsContact NH2-OD1 3.09Å; R257-D268 IonicContact CZ-OD1 3.61Å; R257-D268 IonicContact CZ-OD2 3.49Å; R257-D268 IonicContact NE-OD2 3.47Å; R257-D268 VanDerWaalsContact NH1-CG 3.28Å; R257-D268 IonicContact NH1-OD1 2.8Å; R257-D268 PolarHBondContact NH1-OD1 2.83Å; R257-D268 VanDerWaalsContact NH1-OD1 3.12Å; R257-D268 IonicContact NH1-OD2 3.29Å; R257-D268 PolarHBondContact NH1-OD2 3.41Å; R257-D268 IonicContact NH2-OD1 3.56Å
258	L	96.9	Very high	96	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.042	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-109.2	128.5	-168	-172.7	65.3	0	0	0	111.8	H129 H253 V254 M260 D266 L269 V274	H129-L258 VanDerWaalsContact NE2-CD1 3.34Å; H129-L258 WeakPolarHBondContact NE2-CD1 3.46Å; H253-L258 CarbonylContact C-O 3.52Å; H253-L258 VanDerWaalsContact CA-O 3.22Å; H253-L258 WeakPolarHBondContact CA-O 3.29Å; V254-L258 HydrophobicContact CB-CB 4.48Å; V254-L258 PolarHBondContact N-O 3.09Å; V254-L258 PolarHBondContact O-N 2.93Å; V254-L258 VanDerWaalsContact O-N 3.15Å; L258-M260 VanDerWaalsContact C-N 3.26Å; L258-M260 HydrophobicContact CD1-CG 3.96Å; L258-M260 HydrophobicContact CD2-CG 3.89Å; L258-M260 WeakPolarHBondContact CD2-O 3.48Å; L258-M260 HydrophobicContact CG-CG 3.77Å; L258-M260 WeakPolarHBondContact CG-O 3.33Å; L258-M260 PolarHBondContact O-N 2.9Å; L258-D266 HydrophobicContact CD2-CB 4.47Å; L258-L269 HydrophobicContact CB-CD1 3.58Å; L258-L269 HydrophobicContact CD2-CD1 3.9Å; L258-L269 HydrophobicContact CG-CD1 4.35Å; L258-V274 HydrophobicContact CD2-CG1 3.77Å; L258-V274 HydrophobicContact CD2-CG2 4.21Å
259	A	96.8	Very high	96.4	Very high	42 Å²	42	31.9 Å²	31.9	35%	0.347	19%	0.185	S	C	.	.	S	Bend	trans	-76.6	-10.9	-178.3	0	0	0	0	0	114.1	P228	P228-A259 WeakPolarHBondContact CD-O 3.42Å
260	M	97.8	Very high	96.8	Very high	10 Å²	10	28.3 Å²	28.3	5%	0.049	17%	0.165	C	C	.	.			trans	-119.3	162.9	179.8	65.5	-172.3	72.6	0	0	112.3	T189 D208 H226 V254 L258	T189-M260 HydrophobicContact CG2-CE 3.52Å; T189-M260 HydrophobicContact CG2-SD 3.73Å; D208-M260 WeakPolarHBondContact OD1-CE 3.27Å; H226-M260 CarbonylContact O-C 3.43Å; H226-M260 VanDerWaalsContact O-CA 3.23Å; H226-M260 WeakPolarHBondContact O-CA 3.44Å; H226-M260 WeakPolarHBondContact O-CB 3.42Å; V254-M260 WeakPolarHBondContact CG2-O 3.41Å; L258-M260 VanDerWaalsContact C-N 3.26Å; L258-M260 HydrophobicContact CD1-CG 3.96Å; L258-M260 HydrophobicContact CD2-CG 3.89Å; L258-M260 WeakPolarHBondContact CD2-O 3.48Å; L258-M260 HydrophobicContact CG-CG 3.77Å; L258-M260 WeakPolarHBondContact CG-O 3.33Å; L258-M260 PolarHBondContact O-N 2.9Å
261	T	98.6	Very high	97.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-111.7	-4.2	-174.3	50.9	0	0	0	0	114.1	H226 P228 E233 R236 I237 V254 V274	H226-T261 PolarHBondContact O-N 2.6Å; H226-T261 PolarHBondContact O-OG1 3.33Å; H226-T261 VanDerWaalsContact O-OG1 3.05Å; P228-T261 HydrophobicContact CB-CG2 4.21Å; P228-T261 HydrophobicContact CG-CG2 3.86Å; E233-T261 HydrophobicContact CB-CG2 3.99Å; E233-T261 WeakPolarHBondContact CB-OG1 3.4Å; E233-T261 WeakPolarHBondContact CG-OG1 3.45Å; E233-T261 WeakPolarHBondContact OE2-CB 3.45Å; E233-T261 PolarHBondContact OE2-OG1 3.31Å; R236-T261 PolarHBondContact NH2-O 3.5Å; I237-T261 HydrophobicContact CD1-CG2 4.38Å; I237-T261 HydrophobicContact CG1-CG2 4.01Å; V254-T261 HydrophobicContact CG2-CG2 3.8Å; T261-V274 WeakPolarHBondContact O-CA 3.37Å
262	R	98.8	Very high	97.5	Very high	19 Å²	19	26.8 Å²	26.8	7%	0.072	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-139.2	140.3	171.5	-55.3	-167	-163.4	-178.4	16.1	109.1	V206 G207 H226 R230 E233 I275 E277 E279	V206-R262 HydrophobicContact CB-CB 3.76Å; V206-R262 HydrophobicContact CG1-CB 3.92Å; G207-R262 WeakPolarHBondContact CA-O 3.45Å; G207-R262 PolarHBondContact N-O 2.81Å; G207-R262 VanDerWaalsContact N-O 3.12Å; H226-R262 HydrophobicContact CB-CB 4.1Å; H226-R262 HydrophobicContact CB-CG 4.02Å; H226-R262 VanDerWaalsContact CD2-CD 3.41Å; H226-R262 WeakPolarHBondContact CD2-CD 3.19Å; H226-R262 PolarHBondContact CD2-NE 2.94Å; R230-R262 VanDerWaalsContact NH2-NH2 3.13Å; E233-R262 IonicContact OE1-CZ 3.42Å; E233-R262 IonicContact OE1-NE 3.89Å; E233-R262 PolarHBondContact OE1-NE 3.27Å; E233-R262 VanDerWaalsContact OE1-NE 3.16Å; E233-R262 IonicContact OE1-NH2 2.69Å; E233-R262 PolarHBondContact OE1-NH2 3.45Å; E233-R262 WeakPolarHBondContact OE2-CG 3.48Å; E233-R262 IonicContact OE2-NE 2.76Å; E233-R262 PolarHBondContact OE2-NE 3.21Å; E233-R262 VanDerWaalsContact OE2-NE 3.11Å; R262-I275 CarbonylContact C-O 3.55Å; R262-I275 WeakPolarHBondContact CA-O 3.3Å; R262-I275 VanDerWaalsContact CB-O 3.27Å; R262-I275 WeakPolarHBondContact CB-O 3.39Å; R262-I275 HydrophobicContact CG-CG1 3.86Å; R262-E277 WeakPolarHBondContact CD-O 3.43Å; R262-E277 PolarHBondContact NH1-O 3.12Å; R262-E279 IonicContact CZ-OE1 3.94Å; R262-E279 VanDerWaalsContact NH1-CG 3.33Å; R262-E279 IonicContact NH1-OE1 3.29Å; R262-E279 IonicContact NH2-OE1 2.7Å; R262-E279 PolarHBondContact NH2-OE1 3.13Å
263	S	98.8	Very high	97.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.159	C	C	.	.			trans	-163.8	160.3	179	64.4	0	0	0	0	110.5	D266 K270 V274 I275 A276	S263-D266 VanDerWaalsContact CB-OD2 3.3Å; S263-D266 WeakPolarHBondContact CB-OD2 3.47Å; S263-D266 PolarHBondContact OG-OD2 3.28Å; S263-K270 PolarHBondContact O-NZ 3.04Å; S263-V274 WeakPolarHBondContact OG-CG1 3.5Å; S263-I275 PolarHBondContact N-O 3.08Å; S263-I275 VanDerWaalsContact N-O 3.09Å; S263-A276 WeakPolarHBondContact O-CA 3.15Å
264	I	98.9	Very high	97.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.2	161.6	-60.1	179	0	0	0	107.4	M142 F164 I167 D168 G187 T188 A190 V206	M142-I264 HydrophobicContact CE-CD1 4Å; F164-I264 HydrophobicContact CD1-CD1 4.27Å; I167-I264 HydrophobicContact CG2-CD1 3.87Å; I167-I264 HydrophobicContact CG2-CG2 3.88Å; D168-I264 HydrophobicContact CB-CG2 4.19Å; G187-I264 CarbonylContact C-O 3.54Å; G187-I264 VanDerWaalsContact CA-O 3.25Å; G187-I264 WeakPolarHBondContact CA-O 3.47Å; T188-I264 HydrophobicContact CG2-CB 4.07Å; T188-I264 PolarHBondContact N-O 2.99Å; T188-I264 PolarHBondContact O-N 2.99Å; A190-I264 HydrophobicContact CB-CD1 3.69Å; A190-I264 HydrophobicContact CB-CG1 4.42Å; V206-I264 HydrophobicContact CG2-CG1 4.11Å
265	G	98.5	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.2	-140.2	-173.1	0	0	0	0	0	112.9	D168 L267 K270	D168-G265 PolarHBondContact OD1-N 3.47Å; G265-L267 VanDerWaalsContact C-N 3.33Å; G265-L267 PolarHBondContact O-N 3.22Å; G265-K270 WeakPolarHBondContact O-CE 3.39Å; G265-K270 PolarHBondContact O-NZ 2.99Å
266	D	98.3	Very high	97.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.153	C	C	.	.			trans	45.9	54.1	-175.4	-64.7	-67.5	0	0	0	112.8	H129 S186 R257 L258 S263 D268 L269 K270	H129-D266 IonicContact CD2-OD1 3.97Å; H129-D266 IonicContact CE1-OD2 2.74Å; H129-D266 PolarHBondContact CE1-OD2 2.9Å; H129-D266 VanDerWaalsContact CE1-OD2 3.29Å; H129-D266 IonicContact NE2-OD1 3.39Å; H129-D266 PolarHBondContact NE2-OD1 3.1Å; H129-D266 IonicContact NE2-OD2 2.79Å; H129-D266 PolarHBondContact NE2-OD2 2.7Å; S186-D266 PolarHBondContact O-N 3.19Å; R257-D266 IonicContact NH2-OD1 2.68Å; R257-D266 PolarHBondContact NH2-OD1 3.11Å; R257-D266 VanDerWaalsContact NH2-OD1 3.09Å; L258-D266 HydrophobicContact CD2-CB 4.47Å; S263-D266 VanDerWaalsContact CB-OD2 3.3Å; S263-D266 WeakPolarHBondContact CB-OD2 3.47Å; S263-D266 PolarHBondContact OG-OD2 3.28Å; D266-D268 PolarHBondContact O-N 3.39Å; D266-D268 VanDerWaalsContact O-N 3.16Å; D266-L269 HydrophobicContact CB-CB 4.3Å; D266-L269 HydrophobicContact CB-CD1 4.46Å; D266-L269 PolarHBondContact O-N 3.09Å; D266-K270 PolarHBondContact O-N 2.83Å
267	L	97.6	Very high	98	Very high	27 Å²	27	27.3 Å²	27.3	14%	0.141	15%	0.152	C	C	.	.	H	α-helix	trans	-61.7	-30.8	-168	-58.3	-178.2	0	0	0	112.4	A175 L184 G265 L269	A175-L267 HydrophobicContact CB-CD1 3.72Å; L184-L267 HydrophobicContact CD2-CD1 3.89Å; L184-L267 PolarHBondContact O-N 2.93Å; L184-L267 VanDerWaalsContact O-N 3.1Å; G265-L267 VanDerWaalsContact C-N 3.33Å; G265-L267 PolarHBondContact O-N 3.22Å; L267-L269 PolarHBondContact O-N 3.01Å
268	D	96.3	Very high	98.1	Very high	76 Å²	76	23.6 Å²	23.6	41%	0.406	14%	0.139	S	C	.	.	H	α-helix	trans	-66.1	-23.7	175	63	-52.7	0	0	0	113.4	R257 D266	R257-D268 IonicContact CZ-OD1 3.61Å; R257-D268 IonicContact CZ-OD2 3.49Å; R257-D268 IonicContact NE-OD2 3.47Å; R257-D268 VanDerWaalsContact NH1-CG 3.28Å; R257-D268 IonicContact NH1-OD1 2.8Å; R257-D268 PolarHBondContact NH1-OD1 2.83Å; R257-D268 VanDerWaalsContact NH1-OD1 3.12Å; R257-D268 IonicContact NH1-OD2 3.29Å; R257-D268 PolarHBondContact NH1-OD2 3.41Å; R257-D268 IonicContact NH2-OD1 3.56Å; D266-D268 PolarHBondContact O-N 3.39Å; D266-D268 VanDerWaalsContact O-N 3.16Å
269	L	98.1	Very high	98.2	Very high	4 Å²	4	26 Å²	26	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-103.6	-10.9	-177.2	-60.3	178.3	0	0	0	114	N255 L258 D266 L267 A271 S272 G273 V274	N255-L269 HydrophobicContact CB-CD2 3.91Å; L258-L269 HydrophobicContact CB-CD1 3.58Å; L258-L269 HydrophobicContact CD2-CD1 3.9Å; L258-L269 HydrophobicContact CG-CD1 4.35Å; D266-L269 HydrophobicContact CB-CB 4.3Å; D266-L269 HydrophobicContact CB-CD1 4.46Å; D266-L269 PolarHBondContact O-N 3.09Å; L267-L269 PolarHBondContact O-N 3.01Å; L269-A271 VanDerWaalsContact C-N 3.29Å; L269-A271 PolarHBondContact O-N 3.01Å; L269-S272 CarbonylContact O-C 3.48Å; L269-S272 WeakPolarHBondContact O-CA 3.18Å; L269-S272 WeakPolarHBondContact O-CB 3.35Å; L269-S272 PolarHBondContact O-N 2.97Å; L269-G273 PolarHBondContact O-N 2.69Å; L269-V274 HydrophobicContact CB-CB 3.96Å; L269-V274 HydrophobicContact CB-CG2 3.7Å; L269-V274 HydrophobicContact CD1-CG2 4.46Å; L269-V274 PolarHBondContact O-N 3.45Å
270	K	98.1	Very high	98.3	Very high	45 Å²	45	26 Å²	26	20%	0.196	15%	0.146	C	C	.	.	H	α-helix	trans	-54.9	-43.5	177.3	-72.9	-86.8	167.7	-67.4	0	112.1	D168 S263 G265 D266 S272 G273 V274	D168-K270 VanDerWaalsContact CG-CE 3.48Å; D168-K270 WeakPolarHBondContact OD1-CE 3.41Å; D168-K270 IonicContact OD1-NZ 3.26Å; D168-K270 WeakPolarHBondContact OD2-CE 3.33Å; S263-K270 PolarHBondContact O-NZ 3.04Å; G265-K270 WeakPolarHBondContact O-CE 3.39Å; G265-K270 PolarHBondContact O-NZ 2.99Å; D266-K270 PolarHBondContact O-N 2.83Å; K270-S272 VanDerWaalsContact C-N 3.26Å; K270-S272 PolarHBondContact O-N 2.79Å; K270-G273 PolarHBondContact O-N 2.98Å; K270-V274 VanDerWaalsContact CD-O 3.23Å; K270-V274 WeakPolarHBondContact CD-O 3.23Å; K270-V274 PolarHBondContact NZ-O 3.43Å
271	A	97.4	Very high	98.3	Very high	85 Å²	85	27.9 Å²	27.9	70%	0.702	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.1	175.8	0	0	0	0	0	113.6	C240 L269 G273	C240-A271 VanDerWaalsContact O-O 3.13Å; L269-A271 VanDerWaalsContact C-N 3.29Å; L269-A271 PolarHBondContact O-N 3.01Å; A271-G273 VanDerWaalsContact C-N 3.27Å; A271-G273 PolarHBondContact O-N 2.79Å
272	S	98	Very high	98.3	Very high	18 Å²	18	34.2 Å²	34.2	13%	0.126	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7	178.3	-60.6	0	0	0	0	113.3	I237 N255 L269 K270	I237-S272 WeakPolarHBondContact CD1-O 3.48Å; N255-S272 PolarHBondContact ND2-OG 2.88Å; L269-S272 CarbonylContact O-C 3.48Å; L269-S272 WeakPolarHBondContact O-CA 3.18Å; L269-S272 WeakPolarHBondContact O-CB 3.35Å; L269-S272 PolarHBondContact O-N 2.97Å; K270-S272 VanDerWaalsContact C-N 3.26Å; K270-S272 PolarHBondContact O-N 2.79Å
273	G	97.9	Very high	98.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.01	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	8.5	176	0	0	0	0	0	115.3	R236 L269 K270 A271 I275	R236-G273 PolarHBondContact NE-O 3.08Å; R236-G273 PolarHBondContact NH2-O 3.32Å; L269-G273 PolarHBondContact O-N 2.69Å; K270-G273 PolarHBondContact O-N 2.98Å; A271-G273 VanDerWaalsContact C-N 3.27Å; A271-G273 PolarHBondContact O-N 2.79Å; G273-I275 PolarHBondContact O-N 2.91Å
274	V	98.6	Very high	98.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.			trans	-81.4	90	171.5	-177.3	0	0	0	0	109.7	I237 V254 L258 T261 S263 L269 K270	I237-V274 HydrophobicContact CD1-CG2 4.11Å; V254-V274 HydrophobicContact CB-CG2 4.45Å; V254-V274 HydrophobicContact CG1-CG2 3.92Å; L258-V274 HydrophobicContact CD2-CG1 3.77Å; L258-V274 HydrophobicContact CD2-CG2 4.21Å; T261-V274 WeakPolarHBondContact O-CA 3.37Å; S263-V274 WeakPolarHBondContact OG-CG1 3.5Å; L269-V274 HydrophobicContact CB-CB 3.96Å; L269-V274 HydrophobicContact CB-CG2 3.7Å; L269-V274 HydrophobicContact CD1-CG2 4.46Å; L269-V274 PolarHBondContact O-N 3.45Å; K270-V274 VanDerWaalsContact CD-O 3.23Å; K270-V274 WeakPolarHBondContact CD-O 3.23Å; K270-V274 PolarHBondContact NZ-O 3.43Å
275	I	98.8	Very high	98.1	Very high	46 Å²	46	40.2 Å²	40.2	24%	0.236	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-89.4	157.6	-172.3	63.5	179	0	0	0	112.7	R262 S263 G273 E277	R262-I275 CarbonylContact C-O 3.55Å; R262-I275 WeakPolarHBondContact CA-O 3.3Å; R262-I275 VanDerWaalsContact CB-O 3.27Å; R262-I275 WeakPolarHBondContact CB-O 3.39Å; R262-I275 HydrophobicContact CG-CG1 3.86Å; S263-I275 PolarHBondContact N-O 3.08Å; S263-I275 VanDerWaalsContact N-O 3.09Å; G273-I275 PolarHBondContact O-N 2.91Å; I275-E277 HydrophobicContact CD1-CB 4.04Å; I275-E277 HydrophobicContact CG1-CB 4.43Å
276	A	98.8	Very high	97.8	Very high	4 Å²	4	46 Å²	46	3%	0.033	23%	0.232	C	C	.	.			trans	-97	1.9	173.4	0	0	0	0	0	113.6	D168 S263 P278	D168-A276 HydrophobicContact CB-CB 3.49Å; D168-A276 VanDerWaalsContact CB-CB 3.49Å; D168-A276 VanDerWaalsContact CG-CB 3.41Å; S263-A276 WeakPolarHBondContact O-CA 3.15Å; A276-P278 WeakPolarHBondContact O-CD 3.21Å
277	E	98.8	Very high	97.4	Very high	102 Å²	102	46.4 Å²	46.4	48%	0.477	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-71	117.7	176.8	-171.9	-177.3	153	0	0	110.4	T161 L165 R262 I275	T161-E277 HydrophobicContact CG2-CG 4.37Å; L165-E277 HydrophobicContact CD2-CB 4.29Å; R262-E277 WeakPolarHBondContact CD-O 3.43Å; R262-E277 PolarHBondContact NH1-O 3.12Å; I275-E277 HydrophobicContact CD1-CB 4.04Å; I275-E277 HydrophobicContact CG1-CB 4.43Å
278	P	98.8	Very high	96.9	Very high	8 Å²	8	47.6 Å²	47.6	5%	0.052	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-77.2	158.4	-176.6	31.7	-34.5	0	0	0	112.6	F164 A204 S205 V206 A276	F164-P278 HydrophobicContact CB-CG 4.06Å; F164-P278 HydrophobicContact CD1-CB 3.71Å; F164-P278 HydrophobicContact CD1-CG 3.9Å; F164-P278 HydrophobicContact CD2-CG 4.35Å; F164-P278 HydrophobicContact CE1-CB 3.85Å; F164-P278 HydrophobicContact CE1-CG 4.41Å; F164-P278 HydrophobicContact CG-CB 4.18Å; F164-P278 HydrophobicContact CG-CG 3.85Å; F164-P278 HydrophobicContact CZ-CB 4.43Å; A204-P278 HydrophobicContact CB-CB 3.93Å; A204-P278 HydrophobicContact CB-CG 4.13Å; S205-P278 VanDerWaalsContact O-CA 3.26Å; S205-P278 WeakPolarHBondContact O-CA 3.41Å; S205-P278 WeakPolarHBondContact O-CB 3.26Å; V206-P278 HydrophobicContact CG1-CB 4.1Å; A276-P278 WeakPolarHBondContact O-CD 3.21Å
279	E	98.8	Very high	96.7	Very high	59 Å²	59	46 Å²	46	28%	0.276	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	137.4	155.9	-66	-172.9	156.2	0	0	109.4	A204 S205 H226 R230 R262	A204-E279 WeakPolarHBondContact CA-O 3.39Å; S205-E279 PolarHBondContact N-O 2.89Å; S205-E279 PolarHBondContact O-N 3.49Å; H226-E279 WeakPolarHBondContact NE2-CG 3.45Å; H226-E279 IonicContact NE2-OE2 2.85Å; H226-E279 PolarHBondContact NE2-OE2 3.29Å; R230-E279 IonicContact CZ-OE1 3.96Å; R230-E279 IonicContact CZ-OE2 2.81Å; R230-E279 IonicContact NH1-OE1 2.91Å; R230-E279 PolarHBondContact NH1-OE1 3.44Å; R230-E279 IonicContact NH1-OE2 3.74Å; R230-E279 PolarHBondContact NH1-OE2 3.04Å; R230-E279 IonicContact NH2-OE1 2.78Å; R230-E279 PolarHBondContact NH2-OE1 2.93Å; R230-E279 IonicContact NH2-OE2 3Å; R262-E279 IonicContact CZ-OE1 3.94Å; R262-E279 VanDerWaalsContact NH1-CG 3.33Å; R262-E279 IonicContact NH1-OE1 3.29Å; R262-E279 IonicContact NH2-OE1 2.7Å; R262-E279 PolarHBondContact NH2-OE1 3.13Å
280	T	98.7	Very high	96.5	Very high	43 Å²	43	45.9 Å²	45.9	26%	0.264	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.6	-179.2	62.1	0	0	0	0	111.8	E157 V203 A204	E157-T280 HydrophobicContact CB-CG2 4.19Å; E157-T280 WeakPolarHBondContact OE1-CB 3.33Å; E157-T280 PolarHBondContact OE1-OG1 3.16Å; V203-T280 CarbonylContact O-C 3.58Å; V203-T280 VanDerWaalsContact O-CA 3.24Å; V203-T280 WeakPolarHBondContact O-CA 3.36Å; A204-T280 HydrophobicContact CB-CG2 3.94Å
281	T	98.7	Very high	96.2	Very high	48 Å²	48	43.7 Å²	43.7	29%	0.294	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.9	172.8	-62.4	0	0	0	0	108.6	V202 V203 L222 I283	V202-T281 WeakPolarHBondContact CA-O 3.45Å; V203-T281 PolarHBondContact N-O 2.96Å; V203-T281 PolarHBondContact O-N 3.37Å; L222-T281 HydrophobicContact CD2-CG2 4.39Å; L222-T281 VanDerWaalsContact O-CB 3.25Å; L222-T281 WeakPolarHBondContact O-CB 3.3Å; L222-T281 PolarHBondContact O-OG1 2.84Å; T281-I283 HydrophobicContact CG2-CG2 4.17Å
282	R	98.6	Very high	96.2	Very high	134 Å²	134	39.7 Å²	39.7	51%	0.506	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127	175.5	176.9	168.3	-176	-131.1	3.9	111.3	E157 E200 V202	E157-R282 HydrophobicContact CG-CB 4.24Å; E157-R282 WeakPolarHBondContact OE2-CB 3.23Å; E200-R282 IonicContact OE1-CZ 2.64Å; E200-R282 IonicContact OE1-NE 2.69Å; E200-R282 PolarHBondContact OE1-NE 2.76Å; E200-R282 IonicContact OE1-NH2 3.13Å; E200-R282 PolarHBondContact OE1-NH2 3.3Å; V202-R282 HydrophobicContact CG2-CB 3.93Å; V202-R282 HydrophobicContact CG2-CG 3.74Å
283	I	98.2	Very high	96.2	Very high	31 Å²	31	38.8 Å²	38.8	16%	0.159	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.8	177.3	56	155.7	0	0	0	111.8	L201 L213 L222 T281 L285	L201-I283 HydrophobicContact CB-CG1 4.03Å; L201-I283 HydrophobicContact CD2-CD1 3.91Å; L201-I283 HydrophobicContact CD2-CG1 4.21Å; L201-I283 HydrophobicContact CG-CD1 4.44Å; L201-I283 HydrophobicContact CG-CG1 4.19Å; L201-I283 PolarHBondContact N-O 2.93Å; L201-I283 PolarHBondContact O-N 3.43Å; L201-I283 VanDerWaalsContact O-O 3.09Å; L213-I283 HydrophobicContact CB-CD1 4.47Å; L213-I283 HydrophobicContact CD2-CD1 3.38Å; L213-I283 HydrophobicContact CG-CD1 4.49Å; L222-I283 HydrophobicContact CD1-CD1 4.24Å; L222-I283 HydrophobicContact CD2-CD1 3.61Å; L222-I283 HydrophobicContact CD2-CG1 4.24Å; L222-I283 HydrophobicContact CD2-CG2 4.46Å; T281-I283 HydrophobicContact CG2-CG2 4.17Å; I283-L285 HydrophobicContact CD1-CD2 4.46Å
284	K	97.3	Very high	96.3	Very high	109 Å²	109	38.8 Å²	38.8	47%	0.474	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.9	169.6	-171.5	174.5	-179.1	171.8	0	109.5	I199 R215	I199-K284 CarbonylContact O-C 3.53Å; I199-K284 WeakPolarHBondContact O-CA 3.17Å; R215-K284 PolarHBondContact NH2-O 3.38Å; R215-K284 VanDerWaalsContact NH2-O 3.16Å
285	L	95.7	Very high	96.3	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	19%	0.189	C	C	.	.			trans	-76.3	139.6	172.2	-62.1	-173.7	0	0	0	110.7	L195 I199 L201 L213 I283 D290 F346	L195-L285 HydrophobicContact CD1-CD1 3.6Å; L195-L285 HydrophobicContact CD1-CG 4.26Å; L195-L285 HydrophobicContact CD2-CD1 4.14Å; I199-L285 PolarHBondContact O-N 3.32Å; L201-L285 HydrophobicContact CB-CD2 4.15Å; L201-L285 HydrophobicContact CB-CG 4.2Å; L201-L285 HydrophobicContact CD2-CD2 3.93Å; L213-L285 HydrophobicContact CD1-CD2 4.09Å; L213-L285 HydrophobicContact CD2-CD2 4.23Å; I283-L285 HydrophobicContact CD1-CD2 4.46Å; L285-D290 VanDerWaalsContact CA-OD2 3.29Å; L285-D290 WeakPolarHBondContact CA-OD2 3.38Å; L285-F346 HydrophobicContact CD1-CD1 3.99Å; L285-F346 HydrophobicContact CD1-CD2 4.12Å; L285-F346 HydrophobicContact CD1-CE1 3.76Å; L285-F346 HydrophobicContact CD1-CE2 3.87Å; L285-F346 HydrophobicContact CD1-CG 4.18Å; L285-F346 HydrophobicContact CD1-CZ 3.7Å; L285-F346 HydrophobicContact CD2-CD2 4.25Å; L285-F346 HydrophobicContact CD2-CE2 3.9Å; L285-F346 HydrophobicContact CD2-CZ 4.39Å
286	Y	93.3	Very high	96.3	Very high	120 Å²	120	36.6 Å²	36.6	47%	0.471	18%	0.178	S	C	.	.			trans	-118.8	85	169	-58	-77.5	0	0	0	107.1	A288 D289 D290	Y286-A288 PolarHBondContact O-N 3.37Å; Y286-D289 CarbonylContact O-C 3.54Å; Y286-D289 WeakPolarHBondContact O-CA 3.09Å; Y286-D289 PolarHBondContact O-N 2.94Å; Y286-D290 PolarHBondContact N-OD2 3.09Å; Y286-D290 WeakPolarHBondContact O-CB 3.41Å; Y286-D290 PolarHBondContact O-N 2.85Å
287	H	89.1	Confident	96.3	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.046	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-24	-173.8	-68.2	-67.3	0	0	0	114.7	W67 P88 G198 D289 G347 A348	W67-H287 HydrophobicContact CE3-CB 4.46Å; W67-H287 HydrophobicContact CH2-CB 3.1Å; W67-H287 HydrophobicContact CZ2-CB 4.16Å; W67-H287 HydrophobicContact CZ3-CB 3.27Å; W67-H287 WeakPolarHBondContact CZ3-O 3.24Å; P88-H287 WeakPolarHBondContact CD-CD2 3.24Å; P88-H287 HydrophobicContact CG-CB 4.27Å; G198-H287 PolarHBondContact O-CE1 3.13Å; G198-H287 PolarHBondContact O-NE2 3.1Å; H287-D289 PolarHBondContact O-N 2.99Å; H287-G347 CarbonylContact O-C 3.57Å; H287-A348 WeakPolarHBondContact O-CB 3.45Å; H287-A348 PolarHBondContact O-N 3.36Å
288	A	87.6	Confident	96.1	Very high	52 Å²	52	32.5 Å²	32.5	43%	0.43	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.2	173.9	0	0	0	0	0	114.1	Y286 K351 Y352	Y286-A288 PolarHBondContact O-N 3.37Å; A288-K351 PolarHBondContact O-NZ 3.33Å; A288-K351 VanDerWaalsContact O-NZ 3.14Å; A288-Y352 PolarHBondContact O-OH 3.22Å
289	D	90.9	Very high	95.9	Very high	43 Å²	43	32.1 Å²	32.1	23%	0.23	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-31.2	-174.3	-69.8	-19.1	0	0	0	112.8	R215 K216 Y286 H287 Y352	R215-D289 HydrophobicContact CG-CB 4.23Å; K216-D289 WeakPolarHBondContact CE-OD1 3.28Å; K216-D289 WeakPolarHBondContact CE-OD2 3.32Å; K216-D289 HydrophobicContact CG-CB 4.08Å; K216-D289 PolarHBondContact N-O 3.16Å; K216-D289 IonicContact NZ-OD1 3.04Å; K216-D289 IonicContact NZ-OD2 3.83Å; K216-D289 PolarHBondContact NZ-OD2 2.93Å; Y286-D289 CarbonylContact O-C 3.54Å; Y286-D289 WeakPolarHBondContact O-CA 3.09Å; Y286-D289 PolarHBondContact O-N 2.94Å; H287-D289 PolarHBondContact O-N 2.99Å; D289-Y352 WeakPolarHBondContact O-CE2 3.35Å
290	D	94.4	Very high	95.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.2	-176.3	-71	-24.5	0	0	0	111.5	L213 R215 L285 Y286 F346 A348	L213-D290 HydrophobicContact CD1-CB 4.16Å; R215-D290 WeakPolarHBondContact CB-OD1 3.43Å; R215-D290 WeakPolarHBondContact CG-OD1 3.42Å; R215-D290 IonicContact CZ-OD1 3.62Å; R215-D290 IonicContact CZ-OD2 3.59Å; R215-D290 IonicContact NE-OD1 3.67Å; R215-D290 PolarHBondContact NE-OD1 3.15Å; R215-D290 IonicContact NE-OD2 3.18Å; R215-D290 IonicContact NH2-OD1 2.74Å; R215-D290 PolarHBondContact NH2-OD1 3.49Å; R215-D290 IonicContact NH2-OD2 3.33Å; R215-D290 PolarHBondContact NH2-OD2 2.96Å; L285-D290 VanDerWaalsContact CA-OD2 3.29Å; L285-D290 WeakPolarHBondContact CA-OD2 3.38Å; Y286-D290 PolarHBondContact N-OD2 3.09Å; Y286-D290 WeakPolarHBondContact O-CB 3.41Å; Y286-D290 PolarHBondContact O-N 2.85Å; D290-F346 HydrophobicContact CB-CD2 4.35Å; D290-F346 WeakPolarHBondContact O-CB 3.49Å; D290-A348 WeakPolarHBondContact O-CB 3.47Å; D290-A348 PolarHBondContact O-N 3.05Å
291	S	92.4	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-43	-173.7	-64.1	0	0	0	0	113.1	C214 F346 A348 Y352	C214-S291 PolarHBondContact O-N 3.01Å; S291-F346 PolarHBondContact O-N 3.04Å; S291-A348 WeakPolarHBondContact CB-O 3.47Å; S291-A348 PolarHBondContact OG-O 2.81Å; S291-Y352 VanDerWaalsContact OG-CD2 3.3Å; S291-Y352 WeakPolarHBondContact OG-CD2 3.42Å
292	F	96.8	Very high	95.1	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	155.3	-179.4	51.1	-93.9	0	0	0	112.8	L213 C214 V294 C310 V313 N314 V343 V344 W349	L213-F292 WeakPolarHBondContact CD1-O 3.49Å; C214-F292 HydrophobicContact CB-CD1 3.91Å; C214-F292 HydrophobicContact CB-CD2 3.68Å; C214-F292 HydrophobicContact CB-CE1 3.51Å; C214-F292 HydrophobicContact CB-CE2 3.27Å; C214-F292 HydrophobicContact CB-CG 3.98Å; C214-F292 HydrophobicContact CB-CZ 3.17Å; C214-F292 PolarHBondContact N-O 2.87Å; C214-F292 VanDerWaalsContact SG-CZ 3.5Å; F292-V294 HydrophobicContact CD2-CB 4.36Å; F292-V294 HydrophobicContact CD2-CG1 4.44Å; F292-V294 HydrophobicContact CE2-CG1 4.34Å; F292-C310 HydrophobicContact CZ-CB 4.32Å; F292-V313 HydrophobicContact CD1-CG1 3.6Å; F292-V313 HydrophobicContact CD2-CB 4.48Å; F292-V313 HydrophobicContact CD2-CG1 3.83Å; F292-V313 HydrophobicContact CE1-CB 3.9Å; F292-V313 HydrophobicContact CE1-CG1 3.37Å; F292-V313 HydrophobicContact CE2-CB 3.79Å; F292-V313 HydrophobicContact CE2-CG1 3.6Å; F292-V313 HydrophobicContact CE2-CG2 4.13Å; F292-V313 HydrophobicContact CG-CG1 3.83Å; F292-V313 HydrophobicContact CZ-CB 3.46Å; F292-V313 VanDerWaalsContact CZ-CB 3.46Å; F292-V313 HydrophobicContact CZ-CG1 3.37Å; F292-V313 HydrophobicContact CZ-CG2 4.28Å; F292-N314 WeakPolarHBondContact CE1-OD1 3.45Å; F292-V343 HydrophobicContact CB-CG1 4.32Å; F292-V344 CarbonylContact C-O 3.51Å; F292-V344 WeakPolarHBondContact CA-O 3.31Å; F292-V344 WeakPolarHBondContact CB-O 3.3Å; F292-W349 HydrophobicContact CB-CE3 3.89Å; F292-W349 HydrophobicContact CB-CZ3 3.82Å; F292-W349 AromaticContact CD1-CE3 3.76Å; F292-W349 HydrophobicContact CD1-CE3 3.76Å; F292-W349 AromaticContact CD1-CZ3 3.58Å; F292-W349 HydrophobicContact CD1-CZ3 3.58Å; F292-W349 HydrophobicContact CE1-CZ3 4.39Å; F292-W349 HydrophobicContact CG-CE3 4.21Å; F292-W349 AromaticContact CG-CZ3 3.89Å; F292-W349 HydrophobicContact CG-CZ3 3.89Å
293	L	98.6	Very high	94.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	139	159.4	167.6	70.1	0	0	0	108.4	A193 L201 A211 L212 L222 L295 V344 F346	A193-L293 HydrophobicContact CB-CD2 3.87Å; L201-L293 HydrophobicContact CD1-CD2 4.2Å; L201-L293 HydrophobicContact CD2-CD1 4.42Å; L201-L293 HydrophobicContact CD2-CD2 4.45Å; A211-L293 HydrophobicContact CB-CD1 4.25Å; L212-L293 CarbonylContact O-C 3.55Å; L212-L293 WeakPolarHBondContact O-CA 3.26Å; L222-L293 HydrophobicContact CD1-CD1 3.81Å; L293-L295 HydrophobicContact CD1-CD2 4.1Å; L293-L295 HydrophobicContact CD2-CD2 4.4Å; L293-L295 HydrophobicContact CG-CD2 4.26Å; L293-V344 HydrophobicContact CB-CB 4.21Å; L293-V344 PolarHBondContact N-O 3.12Å; L293-V344 PolarHBondContact O-N 3.5Å; L293-F346 HydrophobicContact CB-CE2 3.59Å; L293-F346 HydrophobicContact CB-CZ 3.63Å
294	V	98.6	Very high	94.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.3	170.5	61.5	0	0	0	0	110.5	A211 L212 F292 T296 I309 V342 V343	A211-V294 WeakPolarHBondContact CA-O 3.45Å; L212-V294 HydrophobicContact CB-CG1 3.72Å; L212-V294 HydrophobicContact CD1-CG1 4.2Å; L212-V294 HydrophobicContact CG-CG1 4.34Å; L212-V294 PolarHBondContact N-O 2.97Å; L212-V294 PolarHBondContact O-N 3.15Å; F292-V294 HydrophobicContact CD2-CB 4.36Å; F292-V294 HydrophobicContact CD2-CG1 4.44Å; F292-V294 HydrophobicContact CE2-CG1 4.34Å; V294-T296 HydrophobicContact CG2-CG2 3.98Å; V294-I309 HydrophobicContact CG1-CG2 3.86Å; V294-I309 HydrophobicContact CG2-CG2 4.17Å; V294-V342 CarbonylContact C-O 3.57Å; V294-V342 VanDerWaalsContact CA-O 3.25Å; V294-V342 WeakPolarHBondContact CA-O 3.26Å; V294-V343 HydrophobicContact CG2-CG2 3.96Å
295	L	98.9	Very high	94.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.8	172.3	-51.4	-177.3	0	0	0	109.1	F123 V125 T191 R210 A211 L293 A341 V342	F123-L295 HydrophobicContact CB-CD1 3.98Å; V125-L295 HydrophobicContact CG1-CB 3.71Å; V125-L295 HydrophobicContact CG1-CD1 4.23Å; V125-L295 HydrophobicContact CG2-CB 3.96Å; T191-L295 HydrophobicContact CG2-CD2 4.17Å; R210-L295 CarbonylContact O-C 3.58Å; R210-L295 VanDerWaalsContact O-CA 3.26Å; R210-L295 WeakPolarHBondContact O-CA 3.14Å; A211-L295 HydrophobicContact CB-CD2 3.43Å; A211-L295 VanDerWaalsContact CB-CD2 3.43Å; L293-L295 HydrophobicContact CD1-CD2 4.1Å; L293-L295 HydrophobicContact CD2-CD2 4.4Å; L293-L295 HydrophobicContact CG-CD2 4.26Å; L295-A341 CarbonylContact O-C 3.57Å; L295-A341 VanDerWaalsContact O-CA 3.28Å; L295-A341 WeakPolarHBondContact O-CA 3.44Å; L295-V342 HydrophobicContact CB-CB 4.29Å; L295-V342 PolarHBondContact N-O 3.27Å; L295-V342 PolarHBondContact O-N 2.89Å
296	T	98.8	Very high	94.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141	-178.3	53.2	0	0	0	0	113.5	S209 R210 V294 I300 N301 I309 T340 A341	S209-T296 CarbonylContact C-O 3.54Å; S209-T296 WeakPolarHBondContact CA-O 3.46Å; R210-T296 PolarHBondContact N-O 3.22Å; R210-T296 PolarHBondContact O-N 3.45Å; V294-T296 HydrophobicContact CG2-CG2 3.98Å; T296-I300 HydrophobicContact CG2-CD1 3.89Å; T296-I300 HydrophobicContact CG2-CG2 4.23Å; T296-N301 PolarHBondContact O-ND2 2.89Å; T296-N301 PolarHBondContact OG1-OD1 3.28Å; T296-I309 HydrophobicContact CG2-CD1 4.21Å; T296-T340 WeakPolarHBondContact CA-O 3.46Å; T296-A341 HydrophobicContact CG2-CB 4.26Å
297	T	98.6	Very high	94.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.			trans	-85	170.6	171.8	58	0	0	0	0	112.4	D109 V125 D127 G299 I300 N301 T340	D109-T297 PolarHBondContact OD2-OG1 3.21Å; V125-T297 HydrophobicContact CB-CG2 4.36Å; D127-T297 HydrophobicContact CB-CG2 3.91Å; D127-T297 WeakPolarHBondContact OD2-CB 3.47Å; T297-G299 VanDerWaalsContact C-N 3.29Å; T297-G299 PolarHBondContact O-N 3.47Å; T297-I300 PolarHBondContact O-N 2.98Å; T297-N301 VanDerWaalsContact O-CG 3.24Å; T297-N301 PolarHBondContact O-N 2.74Å; T297-N301 PolarHBondContact O-ND2 2.98Å; T297-N301 VanDerWaalsContact O-ND2 3.1Å; T297-T340 PolarHBondContact N-O 3.27Å; T297-T340 VanDerWaalsContact N-O 3.09Å; T297-T340 PolarHBondContact OG1-N 3.11Å
298	D	95.6	Very high	94.8	Very high	20 Å²	20	22.2 Å²	22.2	11%	0.107	12%	0.117	C	C	.	.	H	α-helix	trans	-66	-30	-166.7	78.5	-11.1	0	0	0	113.6	D127 I300 N301 F302	D127-D298 PolarHBondContact OD2-N 2.78Å; D298-I300 PolarHBondContact O-N 2.7Å; D298-I300 VanDerWaalsContact O-N 3.12Å; D298-N301 PolarHBondContact O-N 3.31Å; D298-F302 HydrophobicContact CB-CD2 4.43Å; D298-F302 HydrophobicContact CB-CE2 3.81Å; D298-F302 HydrophobicContact CB-CZ 3.84Å; D298-F302 VanDerWaalsContact O-CD2 3.26Å; D298-F302 WeakPolarHBondContact O-CD2 3.49Å; D298-F302 WeakPolarHBondContact O-CG 3.36Å; D298-F302 PolarHBondContact O-N 3.01Å; D298-F302 WeakPolarHBondContact OD2-CE2 3.45Å; D298-F302 WeakPolarHBondContact OD2-CZ 3.41Å
299	G	94.4	Very high	95.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58.9	-27.7	176.9	0	0	0	0	0	113.7	T297 T335 N338	T297-G299 VanDerWaalsContact C-N 3.29Å; T297-G299 PolarHBondContact O-N 3.47Å; G299-T335 VanDerWaalsContact O-CB 3.23Å; G299-T335 WeakPolarHBondContact O-CB 3.48Å; G299-T335 PolarHBondContact O-OG1 3.19Å; G299-N338 WeakPolarHBondContact CA-O 3.41Å
300	I	97.1	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-83.2	-47.1	169.9	-58.9	173.4	0	0	0	110.1	T296 T297 D298 F302 M303 V304 I309 V326 T327 A330 T340 A341	T296-I300 HydrophobicContact CG2-CD1 3.89Å; T296-I300 HydrophobicContact CG2-CG2 4.23Å; T297-I300 PolarHBondContact O-N 2.98Å; D298-I300 PolarHBondContact O-N 2.7Å; D298-I300 VanDerWaalsContact O-N 3.12Å; I300-F302 PolarHBondContact O-N 2.75Å; I300-M303 PolarHBondContact O-N 2.9Å; I300-M303 VanDerWaalsContact O-N 3.08Å; I300-V304 HydrophobicContact CG2-CB 4.16Å; I300-V304 HydrophobicContact CG2-CG2 4.38Å; I300-V304 PolarHBondContact O-N 3.4Å; I300-I309 HydrophobicContact CG2-CD1 4.17Å; I300-I309 HydrophobicContact CG2-CG1 4.41Å; I300-V326 HydrophobicContact CD1-CG1 4.16Å; I300-V326 HydrophobicContact CG2-CG1 3.7Å; I300-T327 HydrophobicContact CD1-CG2 3.83Å; I300-A330 HydrophobicContact CB-CB 4.42Å; I300-A330 HydrophobicContact CG1-CB 4.19Å; I300-T340 WeakPolarHBondContact CD1-O 3.48Å; I300-A341 HydrophobicContact CD1-CB 3.79Å
301	N	93.2	Very high	95.4	Very high	11 Å²	11	19.4 Å²	19.4	6%	0.059	10%	0.095	C	C	.	.	H	α-helix	trans	-62.1	-25.8	-170.7	-67.4	-29.3	0	0	0	114.2	D208 R210 T296 T297 D298	D208-N301 PolarHBondContact O-ND2 2.98Å; R210-N301 VanDerWaalsContact NH1-CB 3.33Å; R210-N301 PolarHBondContact NH1-O 3.46Å; T296-N301 PolarHBondContact O-ND2 2.89Å; T296-N301 PolarHBondContact OG1-OD1 3.28Å; T297-N301 VanDerWaalsContact O-CG 3.24Å; T297-N301 PolarHBondContact O-N 2.74Å; T297-N301 PolarHBondContact O-ND2 2.98Å; T297-N301 VanDerWaalsContact O-ND2 3.1Å; D298-N301 PolarHBondContact O-N 3.31Å
302	F	89.4	Confident	95.4	Very high	115 Å²	115	20.6 Å²	20.6	50%	0.504	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-32.3	176	-66	-37.4	0	0	0	113.5	D298 I300	D298-F302 HydrophobicContact CB-CD2 4.43Å; D298-F302 HydrophobicContact CB-CE2 3.81Å; D298-F302 HydrophobicContact CB-CZ 3.84Å; D298-F302 VanDerWaalsContact O-CD2 3.26Å; D298-F302 WeakPolarHBondContact O-CD2 3.49Å; D298-F302 WeakPolarHBondContact O-CG 3.36Å; D298-F302 PolarHBondContact O-N 3.01Å; D298-F302 WeakPolarHBondContact OD2-CE2 3.45Å; D298-F302 WeakPolarHBondContact OD2-CZ 3.41Å; I300-F302 PolarHBondContact O-N 2.75Å
303	M	92.6	Very high	95.2	Very high	58 Å²	58	20.7 Å²	20.7	29%	0.286	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-40.4	-176.3	-62.3	-54.2	142.3	0	0	112.4	I300 Y333	I300-M303 PolarHBondContact O-N 2.9Å; I300-M303 VanDerWaalsContact O-N 3.08Å; M303-Y333 HydrophobicContact CB-CD2 4.26Å
304	V	92.6	Very high	94.9	Very high	1 Å²	1	21 Å²	21	1%	0.006	10%	0.102	C	C	.	.	S	Bend	trans	-113.3	124	-170.9	-168	0	0	0	0	109.6	I300 E308 I309 F312 A330 Y333	I300-V304 HydrophobicContact CG2-CB 4.16Å; I300-V304 HydrophobicContact CG2-CG2 4.38Å; I300-V304 PolarHBondContact O-N 3.4Å; V304-E308 HydrophobicContact CG1-CB 3.48Å; V304-E308 VanDerWaalsContact CG1-CB 3.48Å; V304-I309 HydrophobicContact CB-CG1 4.25Å; V304-I309 HydrophobicContact CG1-CG1 3.71Å; V304-F312 HydrophobicContact CG1-CD2 4.11Å; V304-F312 HydrophobicContact CG1-CE2 3.74Å; V304-A330 HydrophobicContact CG2-CB 4.18Å; V304-Y333 HydrophobicContact CG2-CD2 4.05Å; V304-Y333 HydrophobicContact CG2-CE2 4.27Å
305	N	95	Very high	94.4	Very high	59 Å²	59	25.3 Å²	25.3	32%	0.316	12%	0.123	S	C	.	.			trans	-82	165.3	178.3	78.5	67	0	0	0	112.2	Q307 E308 I309 R363	N305-Q307 VanDerWaalsContact C-N 3.26Å; N305-Q307 PolarHBondContact O-N 3.42Å; N305-Q307 VanDerWaalsContact O-N 3.16Å; N305-Q307 WeakPolarHBondContact OD1-CA 3.39Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.26Å; N305-Q307 PolarHBondContact OD1-N 2.91Å; N305-E308 VanDerWaalsContact CG-OE2 3.29Å; N305-E308 PolarHBondContact N-OE2 2.84Å; N305-E308 WeakPolarHBondContact ND2-CG 3.44Å; N305-E308 PolarHBondContact ND2-OE1 3.29Å; N305-E308 PolarHBondContact ND2-OE2 2.84Å; N305-E308 PolarHBondContact O-N 2.99Å; N305-E308 VanDerWaalsContact O-N 3.09Å; N305-E308 PolarHBondContact OD1-N 2.59Å; N305-E308 VanDerWaalsContact OD1-N 3.17Å; N305-I309 WeakPolarHBondContact O-CG1 3.23Å; N305-I309 PolarHBondContact O-N 3.15Å; N305-R363 PolarHBondContact ND2-NH2 3.44Å
306	S	96.2	Very high	94	Very high	10 Å²	10	25.9 Å²	25.9	7%	0.07	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-32.3	-175.7	-51.2	0	0	0	0	115	K221 C310	K221-S306 WeakPolarHBondContact CE-OG 3.14Å; S306-C310 PolarHBondContact O-N 3.3Å; S306-C310 PolarHBondContact O-SG 2.78Å; S306-C310 VanDerWaalsContact O-SG 3.42Å
307	Q	95.1	Very high	93.4	Very high	68 Å²	68	31 Å²	31	32%	0.318	15%	0.15	S	C	.	.	H	α-helix	trans	-73.2	-45.2	176.6	-176.1	63.2	61.6	0	0	110.5	P219 N305 I309 C310 D311	P219-Q307 HydrophobicContact CG-CB 4.25Å; N305-Q307 VanDerWaalsContact C-N 3.26Å; N305-Q307 PolarHBondContact O-N 3.42Å; N305-Q307 VanDerWaalsContact O-N 3.16Å; N305-Q307 WeakPolarHBondContact OD1-CA 3.39Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.26Å; N305-Q307 PolarHBondContact OD1-N 2.91Å; Q307-I309 VanDerWaalsContact C-N 3.3Å; Q307-I309 PolarHBondContact O-N 2.72Å; Q307-C310 WeakPolarHBondContact O-CB 3.19Å; Q307-C310 PolarHBondContact O-N 2.89Å; Q307-C310 VanDerWaalsContact O-N 3.09Å; Q307-D311 PolarHBondContact NE2-OD1 3.41Å; Q307-D311 PolarHBondContact O-N 2.88Å
308	E	94.7	Very high	93	Very high	30 Å²	30	34 Å²	34	14%	0.14	17%	0.166	C	C	.	.	H	α-helix	trans	-58.9	-41.1	175.6	-73	162.2	171.7	0	0	111.3	V304 N305 C310 D311 F312 R363	V304-E308 HydrophobicContact CG1-CB 3.48Å; V304-E308 VanDerWaalsContact CG1-CB 3.48Å; N305-E308 VanDerWaalsContact CG-OE2 3.29Å; N305-E308 PolarHBondContact N-OE2 2.84Å; N305-E308 WeakPolarHBondContact ND2-CG 3.44Å; N305-E308 PolarHBondContact ND2-OE1 3.29Å; N305-E308 PolarHBondContact ND2-OE2 2.84Å; N305-E308 PolarHBondContact O-N 2.99Å; N305-E308 VanDerWaalsContact O-N 3.09Å; N305-E308 PolarHBondContact OD1-N 2.59Å; N305-E308 VanDerWaalsContact OD1-N 3.17Å; E308-C310 PolarHBondContact O-N 2.85Å; E308-D311 PolarHBondContact O-N 2.9Å; E308-F312 HydrophobicContact CB-CE2 4.29Å; E308-F312 WeakPolarHBondContact O-CD2 3.35Å; E308-F312 WeakPolarHBondContact O-CG 3.3Å; E308-F312 PolarHBondContact O-N 2.91Å; E308-R363 IonicContact OE1-CZ 2.69Å; E308-R363 IonicContact OE1-NE 3.16Å; E308-R363 IonicContact OE1-NH2 3.75Å; E308-R363 PolarHBondContact OE1-NH2 3.24Å; E308-R363 IonicContact OE2-CZ 3.1Å; E308-R363 IonicContact OE2-NH1 2.96Å; E308-R363 IonicContact OE2-NH2 2.75Å; E308-R363 PolarHBondContact OE2-NH2 3.22Å
309	I	96.1	Very high	93	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-49	173.5	-64.7	169.6	0	0	0	110.5	L212 V294 T296 I300 V304 N305 Q307 D311 F312 V313 V326	L212-I309 HydrophobicContact CD1-CB 4.42Å; L212-I309 HydrophobicContact CD1-CD1 3.97Å; L212-I309 HydrophobicContact CD1-CG2 4.41Å; V294-I309 HydrophobicContact CG1-CG2 3.86Å; V294-I309 HydrophobicContact CG2-CG2 4.17Å; T296-I309 HydrophobicContact CG2-CD1 4.21Å; I300-I309 HydrophobicContact CG2-CD1 4.17Å; I300-I309 HydrophobicContact CG2-CG1 4.41Å; V304-I309 HydrophobicContact CB-CG1 4.25Å; V304-I309 HydrophobicContact CG1-CG1 3.71Å; N305-I309 WeakPolarHBondContact O-CG1 3.23Å; N305-I309 PolarHBondContact O-N 3.15Å; Q307-I309 VanDerWaalsContact C-N 3.3Å; Q307-I309 PolarHBondContact O-N 2.72Å; I309-D311 VanDerWaalsContact C-N 3.29Å; I309-D311 PolarHBondContact O-N 3.35Å; I309-F312 PolarHBondContact O-N 3.37Å; I309-V313 HydrophobicContact CG2-CG2 4.47Å; I309-V313 VanDerWaalsContact O-CG2 3.25Å; I309-V313 WeakPolarHBondContact O-CG2 3.22Å; I309-V313 PolarHBondContact O-N 2.88Å; I309-V313 VanDerWaalsContact O-N 3.09Å; I309-V326 HydrophobicContact CG1-CG1 4.34Å; I309-V326 HydrophobicContact CG2-CG1 4.45Å; I309-V326 HydrophobicContact CG2-CG2 4.45Å
310	C	94.9	Very high	93.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-37.9	178.3	-71.1	0	0	0	0	112.1	P219 F292 S306 Q307 E308 V313 N314	P219-C310 VanDerWaalsContact CB-SG 3.58Å; F292-C310 HydrophobicContact CZ-CB 4.32Å; S306-C310 PolarHBondContact O-N 3.3Å; S306-C310 PolarHBondContact O-SG 2.78Å; S306-C310 VanDerWaalsContact O-SG 3.42Å; Q307-C310 WeakPolarHBondContact O-CB 3.19Å; Q307-C310 PolarHBondContact O-N 2.89Å; Q307-C310 VanDerWaalsContact O-N 3.09Å; E308-C310 PolarHBondContact O-N 2.85Å; C310-V313 PolarHBondContact O-N 2.78Å; C310-N314 VanDerWaalsContact O-CB 3.3Å; C310-N314 WeakPolarHBondContact O-CB 3.45Å; C310-N314 VanDerWaalsContact O-CG 3.27Å; C310-N314 PolarHBondContact O-N 3.43Å; C310-N314 PolarHBondContact O-ND2 2.61Å
311	D	92.8	Very high	93	Very high	36 Å²	36	41.5 Å²	41.5	19%	0.193	20%	0.204	C	C	.	.	H	α-helix	trans	-66.3	-42.7	180	-64	-25	0	0	0	111.6	Q307 E308 I309 Q315 N354	Q307-D311 PolarHBondContact NE2-OD1 3.41Å; Q307-D311 PolarHBondContact O-N 2.88Å; E308-D311 PolarHBondContact O-N 2.9Å; I309-D311 VanDerWaalsContact C-N 3.29Å; I309-D311 PolarHBondContact O-N 3.35Å; D311-Q315 VanDerWaalsContact O-CG 3.23Å; D311-Q315 WeakPolarHBondContact O-CG 3.45Å; D311-Q315 PolarHBondContact O-N 3.19Å; D311-Q315 PolarHBondContact O-NE2 3.3Å; D311-N354 PolarHBondContact OD1-ND2 2.99Å
312	F	92.7	Very high	93.2	Very high	25 Å²	25	41 Å²	41	11%	0.11	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-48.4	174.7	-68.7	-47.2	0	0	0	111.4	V304 E308 I309 N314 Q315 C316 V326 Q329	V304-F312 HydrophobicContact CG1-CD2 4.11Å; V304-F312 HydrophobicContact CG1-CE2 3.74Å; E308-F312 HydrophobicContact CB-CE2 4.29Å; E308-F312 WeakPolarHBondContact O-CD2 3.35Å; E308-F312 WeakPolarHBondContact O-CG 3.3Å; E308-F312 PolarHBondContact O-N 2.91Å; I309-F312 PolarHBondContact O-N 3.37Å; F312-N314 VanDerWaalsContact C-N 3.34Å; F312-N314 PolarHBondContact O-N 3.16Å; F312-Q315 PolarHBondContact O-N 2.93Å; F312-Q315 VanDerWaalsContact O-N 3.17Å; F312-C316 PolarHBondContact O-N 3.44Å; F312-C316 PolarHBondContact O-SG 2.89Å; F312-C316 VanDerWaalsContact O-SG 3.38Å; F312-V326 HydrophobicContact CB-CG2 3.81Å; F312-V326 HydrophobicContact CD2-CG2 4.39Å; F312-Q329 HydrophobicContact CD1-CG 4.26Å; F312-Q329 HydrophobicContact CD2-CG 4.48Å; F312-Q329 HydrophobicContact CE1-CG 3.79Å; F312-Q329 HydrophobicContact CE2-CB 3.91Å; F312-Q329 HydrophobicContact CE2-CG 4.01Å; F312-Q329 HydrophobicContact CZ-CB 3.94Å; F312-Q329 HydrophobicContact CZ-CG 3.65Å
313	V	94.1	Very high	93.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-39.9	-178.8	178.8	0	0	0	0	111.8	F292 I309 C310 Q315 C316 A322 V326 V343 W349	F292-V313 HydrophobicContact CD1-CG1 3.6Å; F292-V313 HydrophobicContact CD2-CB 4.48Å; F292-V313 HydrophobicContact CD2-CG1 3.83Å; F292-V313 HydrophobicContact CE1-CB 3.9Å; F292-V313 HydrophobicContact CE1-CG1 3.37Å; F292-V313 HydrophobicContact CE2-CB 3.79Å; F292-V313 HydrophobicContact CE2-CG1 3.6Å; F292-V313 HydrophobicContact CE2-CG2 4.13Å; F292-V313 HydrophobicContact CG-CG1 3.83Å; F292-V313 HydrophobicContact CZ-CB 3.46Å; F292-V313 VanDerWaalsContact CZ-CB 3.46Å; F292-V313 HydrophobicContact CZ-CG1 3.37Å; F292-V313 HydrophobicContact CZ-CG2 4.28Å; I309-V313 HydrophobicContact CG2-CG2 4.47Å; I309-V313 VanDerWaalsContact O-CG2 3.25Å; I309-V313 WeakPolarHBondContact O-CG2 3.22Å; I309-V313 PolarHBondContact O-N 2.88Å; I309-V313 VanDerWaalsContact O-N 3.09Å; C310-V313 PolarHBondContact O-N 2.78Å; V313-Q315 VanDerWaalsContact C-N 3.25Å; V313-Q315 PolarHBondContact O-N 2.88Å; V313-C316 PolarHBondContact O-N 2.67Å; V313-A322 HydrophobicContact CB-CB 4.18Å; V313-A322 HydrophobicContact CG1-CB 3.93Å; V313-A322 HydrophobicContact CG2-CB 4.12Å; V313-V326 HydrophobicContact CG2-CG2 3.98Å; V313-V343 HydrophobicContact CG1-CG1 3.77Å; V313-V343 HydrophobicContact CG2-CG2 4.26Å; V313-W349 HydrophobicContact CG1-CH2 3.45Å; V313-W349 VanDerWaalsContact CG1-CH2 3.45Å; V313-W349 HydrophobicContact CG1-CZ3 3.46Å; V313-W349 VanDerWaalsContact CG1-CZ3 3.46Å
314	N	91.1	Very high	93.8	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.032	18%	0.182	C	C	.	.	H	α-helix	trans	-68.3	-19.7	178.4	-79.5	-41.6	0	0	0	114.2	F292 C310 F312 Y352	F292-N314 WeakPolarHBondContact CE1-OD1 3.45Å; C310-N314 VanDerWaalsContact O-CB 3.3Å; C310-N314 WeakPolarHBondContact O-CB 3.45Å; C310-N314 VanDerWaalsContact O-CG 3.27Å; C310-N314 PolarHBondContact O-N 3.43Å; C310-N314 PolarHBondContact O-ND2 2.61Å; F312-N314 VanDerWaalsContact C-N 3.34Å; F312-N314 PolarHBondContact O-N 3.16Å; N314-Y352 WeakPolarHBondContact CB-O 3.04Å; N314-Y352 VanDerWaalsContact CG-O 3.24Å; N314-Y352 PolarHBondContact OD1-O 2.79Å
315	Q	88.3	Confident	94	Very high	92 Å²	92	38.1 Å²	38.1	43%	0.43	19%	0.193	S	C	.	.	H	α-helix	trans	-86.8	-27.5	-180	-74.2	169.1	53.7	0	0	112.8	D311 F312 V313	D311-Q315 VanDerWaalsContact O-CG 3.23Å; D311-Q315 WeakPolarHBondContact O-CG 3.45Å; D311-Q315 PolarHBondContact O-N 3.19Å; D311-Q315 PolarHBondContact O-NE2 3.3Å; F312-Q315 PolarHBondContact O-N 2.93Å; F312-Q315 VanDerWaalsContact O-N 3.17Å; V313-Q315 VanDerWaalsContact C-N 3.25Å; V313-Q315 PolarHBondContact O-N 2.88Å
316	C	90.3	Very high	94.1	Very high	11 Å²	11	35.3 Å²	35.3	7%	0.074	18%	0.178	C	C	.	.	S	Bend	trans	-73.6	158.4	-178	-66.5	0	0	0	0	112.7	F312 V313 E321 A322	F312-C316 PolarHBondContact O-N 3.44Å; F312-C316 PolarHBondContact O-SG 2.89Å; F312-C316 VanDerWaalsContact O-SG 3.38Å; V313-C316 PolarHBondContact O-N 2.67Å; C316-E321 HydrophobicContact CB-CB 4.22Å; C316-E321 HydrophobicContact CB-CG 4.1Å; C316-A322 HydrophobicContact CB-CB 3.8Å
317	H	87.6	Confident	94.2	Very high	108 Å²	108	34.8 Å²	34.8	50%	0.5	17%	0.174	S	C	.	.	S	Bend	trans	-74	-49.1	179.5	178	-89.3	0	0	0	111.5	R70 E321 W349	R70-H317 PolarHBondContact NH1-CD2 3.43Å; R70-H317 PolarHBondContact NH1-NE2 2.92Å; H317-E321 VanDerWaalsContact CB-OE2 3.29Å; H317-E321 WeakPolarHBondContact CB-OE2 3.2Å; H317-E321 PolarHBondContact N-OE2 3.3Å; H317-W349 PolarHBondContact O-NE1 3.31Å
318	D	89.9	Confident	94.2	Very high	62 Å²	62	36.7 Å²	36.7	33%	0.332	18%	0.183	S	C	.	.	S	Bend	trans	-130.3	161.5	-177.4	60.2	68.7	0	0	0	112.1	N320 E321 A322 W349	D318-N320 PolarHBondContact O-N 3.47Å; D318-N320 WeakPolarHBondContact OD1-CB 3.35Å; D318-N320 PolarHBondContact OD1-N 3.29Å; D318-N320 VanDerWaalsContact OD1-N 3.11Å; D318-E321 PolarHBondContact O-N 3.39Å; D318-E321 PolarHBondContact OD1-N 3.39Å; D318-A322 PolarHBondContact O-N 3.27Å; D318-W349 VanDerWaalsContact C-CZ2 3.46Å
319	P	95.2	Very high	94.3	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-28.2	-178.4	-29.1	39.5	0	0	0	114	N94 G96 A322 A323 V343 P345 W349	N94-P319 VanDerWaalsContact O-CB 3.29Å; N94-P319 WeakPolarHBondContact O-CB 3.28Å; N94-P319 WeakPolarHBondContact O-CG 3.29Å; G96-P319 WeakPolarHBondContact CA-O 3.12Å; P319-A322 WeakPolarHBondContact O-CB 3.4Å; P319-A322 PolarHBondContact O-N 3.28Å; P319-A323 PolarHBondContact O-N 3.29Å; P319-V343 HydrophobicContact CB-CB 4.05Å; P319-V343 HydrophobicContact CB-CG1 3.87Å; P319-P345 HydrophobicContact CG-CB 3.8Å; P319-P345 HydrophobicContact CG-CG 3.81Å; P319-W349 HydrophobicContact CB-CH2 4.04Å; P319-W349 HydrophobicContact CB-CZ2 4.38Å; P319-W349 HydrophobicContact CB-CZ3 4.41Å; P319-W349 HydrophobicContact CG-CD2 4.21Å; P319-W349 HydrophobicContact CG-CE3 4.21Å; P319-W349 HydrophobicContact CG-CH2 3.68Å; P319-W349 HydrophobicContact CG-CZ2 3.69Å; P319-W349 HydrophobicContact CG-CZ3 3.94Å
320	N	95.8	Very high	94.3	Very high	79 Å²	79	37.3 Å²	37.3	42%	0.422	19%	0.186	S	C	.	.	H	α-helix	trans	-72.2	-46.6	-178.9	-172.8	54.2	0	0	0	111.1	D318 A322 A323 H324	D318-N320 PolarHBondContact O-N 3.47Å; D318-N320 WeakPolarHBondContact OD1-CB 3.35Å; D318-N320 PolarHBondContact OD1-N 3.29Å; D318-N320 VanDerWaalsContact OD1-N 3.11Å; N320-A322 VanDerWaalsContact C-N 3.26Å; N320-A322 PolarHBondContact O-N 2.92Å; N320-A323 PolarHBondContact O-N 3.23Å; N320-H324 PolarHBondContact O-N 2.7Å; N320-H324 VanDerWaalsContact O-N 3.17Å; N320-H324 PolarHBondContact O-ND1 2.86Å; N320-H324 PolarHBondContact OD1-CE1 3.2Å
321	E	95.8	Very high	94.2	Very high	92 Å²	92	40.5 Å²	40.5	43%	0.43	20%	0.202	S	C	.	.	H	α-helix	trans	-55.9	-44.2	168.9	-174.5	-168.5	176.5	0	0	110.7	C316 H317 D318 A323 H324 A325	C316-E321 HydrophobicContact CB-CB 4.22Å; C316-E321 HydrophobicContact CB-CG 4.1Å; H317-E321 VanDerWaalsContact CB-OE2 3.29Å; H317-E321 WeakPolarHBondContact CB-OE2 3.2Å; H317-E321 PolarHBondContact N-OE2 3.3Å; D318-E321 PolarHBondContact O-N 3.39Å; D318-E321 PolarHBondContact OD1-N 3.39Å; E321-A323 PolarHBondContact O-N 3Å; E321-H324 PolarHBondContact O-N 2.85Å; E321-A325 WeakPolarHBondContact O-CB 3.44Å; E321-A325 PolarHBondContact O-N 2.82Å
322	A	96.2	Very high	94.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-45.2	178.8	0	0	0	0	0	113.1	V313 C316 D318 P319 N320 A325 V326 V343 W349	V313-A322 HydrophobicContact CB-CB 4.18Å; V313-A322 HydrophobicContact CG1-CB 3.93Å; V313-A322 HydrophobicContact CG2-CB 4.12Å; C316-A322 HydrophobicContact CB-CB 3.8Å; D318-A322 PolarHBondContact O-N 3.27Å; P319-A322 WeakPolarHBondContact O-CB 3.4Å; P319-A322 PolarHBondContact O-N 3.28Å; N320-A322 VanDerWaalsContact C-N 3.26Å; N320-A322 PolarHBondContact O-N 2.92Å; A322-A325 PolarHBondContact O-N 2.87Å; A322-V326 VanDerWaalsContact O-CG2 3.31Å; A322-V326 WeakPolarHBondContact O-CG2 3.44Å; A322-V326 PolarHBondContact O-N 2.9Å; A322-V343 HydrophobicContact CB-CG2 4.39Å; A322-W349 HydrophobicContact CB-CH2 4.17Å
323	A	98.1	Very high	94.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-43.2	178.2	0	0	0	0	0	111.9	A98 P319 N320 E321 T327 A341 V343	A98-A323 HydrophobicContact CB-CB 4.04Å; P319-A323 PolarHBondContact O-N 3.29Å; N320-A323 PolarHBondContact O-N 3.23Å; E321-A323 PolarHBondContact O-N 3Å; A323-T327 WeakPolarHBondContact O-CG2 3.34Å; A323-T327 PolarHBondContact O-N 3.13Å; A323-T327 VanDerWaalsContact O-N 3.15Å; A323-T327 PolarHBondContact O-OG1 2.96Å; A323-A341 HydrophobicContact CB-CB 4.43Å; A323-V343 HydrophobicContact CB-CG2 4.04Å
324	H	97.9	Very high	94.4	Very high	86 Å²	86	49.4 Å²	49.4	40%	0.398	25%	0.251	S	S	.	.	H	α-helix	trans	-64.8	-43.2	175.4	-72.6	79.2	0	0	0	111.8	C97 N320 E321 V326 T327 E328	C97-H324 PolarHBondContact O-CE1 3.36Å; N320-H324 PolarHBondContact O-N 2.7Å; N320-H324 VanDerWaalsContact O-N 3.17Å; N320-H324 PolarHBondContact O-ND1 2.86Å; N320-H324 PolarHBondContact OD1-CE1 3.2Å; E321-H324 PolarHBondContact O-N 2.85Å; H324-V326 PolarHBondContact O-N 3.47Å; H324-T327 WeakPolarHBondContact CA-OG1 3.48Å; H324-T327 PolarHBondContact O-N 2.76Å; H324-T327 PolarHBondContact O-OG1 2.91Å; H324-E328 VanDerWaalsContact O-CB 3.26Å; H324-E328 WeakPolarHBondContact O-CB 3.36Å; H324-E328 PolarHBondContact O-N 3.47Å
325	A	96.5	Very high	94.6	Very high	27 Å²	27	49.4 Å²	49.4	22%	0.223	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-47.2	178.1	0	0	0	0	0	111.5	E321 A322 T327 E328 Q329	E321-A325 WeakPolarHBondContact O-CB 3.44Å; E321-A325 PolarHBondContact O-N 2.82Å; A322-A325 PolarHBondContact O-N 2.87Å; A325-T327 PolarHBondContact O-N 3.45Å; A325-E328 PolarHBondContact O-N 3.18Å; A325-Q329 WeakPolarHBondContact O-CB 3.39Å; A325-Q329 WeakPolarHBondContact O-CG 3.44Å; A325-Q329 PolarHBondContact O-N 3.1Å
326	V	97.1	Very high	94.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-45.8	-180	174.8	0	0	0	0	111.4	I300 I309 F312 V313 A322 H324 A330	I300-V326 HydrophobicContact CD1-CG1 4.16Å; I300-V326 HydrophobicContact CG2-CG1 3.7Å; I309-V326 HydrophobicContact CG1-CG1 4.34Å; I309-V326 HydrophobicContact CG2-CG1 4.45Å; I309-V326 HydrophobicContact CG2-CG2 4.45Å; F312-V326 HydrophobicContact CB-CG2 3.81Å; F312-V326 HydrophobicContact CD2-CG2 4.39Å; V313-V326 HydrophobicContact CG2-CG2 3.98Å; A322-V326 VanDerWaalsContact O-CG2 3.31Å; A322-V326 WeakPolarHBondContact O-CG2 3.44Å; A322-V326 PolarHBondContact O-N 2.9Å; H324-V326 PolarHBondContact O-N 3.47Å; V326-A330 PolarHBondContact O-N 2.87Å; V326-A330 VanDerWaalsContact O-N 3.17Å
327	T	97.8	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-43	179.1	48.4	0	0	0	0	112.3	A98 I300 A323 H324 A325 A330 I331 S339 A341	A98-T327 HydrophobicContact CB-CG2 3.93Å; A98-T327 WeakPolarHBondContact CB-OG1 3.14Å; I300-T327 HydrophobicContact CD1-CG2 3.83Å; A323-T327 WeakPolarHBondContact O-CG2 3.34Å; A323-T327 PolarHBondContact O-N 3.13Å; A323-T327 VanDerWaalsContact O-N 3.15Å; A323-T327 PolarHBondContact O-OG1 2.96Å; H324-T327 WeakPolarHBondContact CA-OG1 3.48Å; H324-T327 PolarHBondContact O-N 2.76Å; H324-T327 PolarHBondContact O-OG1 2.91Å; A325-T327 PolarHBondContact O-N 3.45Å; T327-A330 PolarHBondContact O-N 3.31Å; T327-I331 PolarHBondContact O-N 2.9Å; T327-S339 WeakPolarHBondContact CG2-O 3.49Å; T327-A341 HydrophobicContact CG2-CB 3.92Å
328	E	96.1	Very high	95.6	Very high	108 Å²	108	45.6 Å²	45.6	51%	0.505	23%	0.234	S	C	.	.	H	α-helix	trans	-67.8	-38.1	178.4	-174.3	164.3	-160.9	0	0	112.1	H324 A325 A330 I331 Q332	H324-E328 VanDerWaalsContact O-CB 3.26Å; H324-E328 WeakPolarHBondContact O-CB 3.36Å; H324-E328 PolarHBondContact O-N 3.47Å; A325-E328 PolarHBondContact O-N 3.18Å; E328-A330 VanDerWaalsContact C-N 3.32Å; E328-A330 PolarHBondContact O-N 3.36Å; E328-I331 PolarHBondContact O-N 3.46Å; E328-Q332 HydrophobicContact CG-CG 4.49Å; E328-Q332 WeakPolarHBondContact O-CG 3.4Å; E328-Q332 PolarHBondContact O-N 3.48Å
329	Q	95.6	Very high	96	Very high	43 Å²	43	42.7 Å²	42.7	20%	0.201	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-39	174.3	-73.5	-58.6	-57.9	0	0	112.1	F312 A325 I331 Q332 Y333	F312-Q329 HydrophobicContact CD1-CG 4.26Å; F312-Q329 HydrophobicContact CD2-CG 4.48Å; F312-Q329 HydrophobicContact CE1-CG 3.79Å; F312-Q329 HydrophobicContact CE2-CB 3.91Å; F312-Q329 HydrophobicContact CE2-CG 4.01Å; F312-Q329 HydrophobicContact CZ-CB 3.94Å; F312-Q329 HydrophobicContact CZ-CG 3.65Å; A325-Q329 WeakPolarHBondContact O-CB 3.39Å; A325-Q329 WeakPolarHBondContact O-CG 3.44Å; A325-Q329 PolarHBondContact O-N 3.1Å; Q329-I331 VanDerWaalsContact C-N 3.33Å; Q329-I331 PolarHBondContact O-N 2.82Å; Q329-Q332 PolarHBondContact O-N 3.12Å; Q329-Y333 PolarHBondContact O-N 2.94Å
330	A	96	Very high	96.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-41.5	175	0	0	0	0	0	112.1	I300 V304 V326 T327 E328 Y333 G334 T335	I300-A330 HydrophobicContact CB-CB 4.42Å; I300-A330 HydrophobicContact CG1-CB 4.19Å; V304-A330 HydrophobicContact CG2-CB 4.18Å; V326-A330 PolarHBondContact O-N 2.87Å; V326-A330 VanDerWaalsContact O-N 3.17Å; T327-A330 PolarHBondContact O-N 3.31Å; E328-A330 VanDerWaalsContact C-N 3.32Å; E328-A330 PolarHBondContact O-N 3.36Å; A330-Y333 PolarHBondContact O-N 3.09Å; A330-G334 PolarHBondContact O-N 3.12Å; A330-T335 HydrophobicContact CB-CG2 3.99Å; A330-T335 WeakPolarHBondContact O-CB 3.36Å; A330-T335 WeakPolarHBondContact O-CG2 3.47Å; A330-T335 PolarHBondContact O-N 2.76Å
331	I	94.4	Very high	96.3	Very high	66 Å²	66	38.5 Å²	38.5	34%	0.338	20%	0.195	S	C	.	.	H	α-helix	trans	-65.5	-42.5	174.8	-64.7	178.7	0	0	0	111.3	L100 T327 E328 Q329 Y333 G334 T335	L100-I331 HydrophobicContact CB-CD1 3.68Å; L100-I331 HydrophobicContact CD1-CD1 3.42Å; L100-I331 VanDerWaalsContact CD1-CD1 3.42Å; L100-I331 HydrophobicContact CG-CD1 4.18Å; T327-I331 PolarHBondContact O-N 2.9Å; E328-I331 PolarHBondContact O-N 3.46Å; Q329-I331 VanDerWaalsContact C-N 3.33Å; Q329-I331 PolarHBondContact O-N 2.82Å; I331-Y333 VanDerWaalsContact C-N 3.26Å; I331-Y333 PolarHBondContact O-N 2.68Å; I331-G334 WeakPolarHBondContact O-CA 3.25Å; I331-G334 PolarHBondContact O-N 2.8Å; I331-T335 HydrophobicContact CG1-CG2 4.08Å
332	Q	94.9	Very high	96.5	Very high	118 Å²	118	34.1 Å²	34.1	55%	0.551	18%	0.175	S	C	*	.	H	α-helix	trans	-63.5	-32.2	176.8	-71.8	-179.4	3.1	0	0	112.5	E328 Q329 G334	E328-Q332 HydrophobicContact CG-CG 4.49Å; E328-Q332 WeakPolarHBondContact O-CG 3.4Å; E328-Q332 PolarHBondContact O-N 3.48Å; Q329-Q332 PolarHBondContact O-N 3.12Å; Q332-G334 PolarHBondContact O-N 2.96Å
333	Y	94.3	Very high	96.6	Very high	89 Å²	89	34.1 Å²	34.1	35%	0.349	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.4	172.3	-68.7	-7	0	0	0	113.8	M303 V304 Q329 A330 I331	M303-Y333 HydrophobicContact CB-CD2 4.26Å; V304-Y333 HydrophobicContact CG2-CD2 4.05Å; V304-Y333 HydrophobicContact CG2-CE2 4.27Å; Q329-Y333 PolarHBondContact O-N 2.94Å; A330-Y333 PolarHBondContact O-N 3.09Å; I331-Y333 VanDerWaalsContact C-N 3.26Å; I331-Y333 PolarHBondContact O-N 2.68Å
334	G	93.4	Very high	96.6	Very high	42 Å²	42	34.1 Å²	34.1	43%	0.433	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	23.6	172	0	0	0	0	0	114.1	A330 I331 Q332 E336	A330-G334 PolarHBondContact O-N 3.12Å; I331-G334 WeakPolarHBondContact O-CA 3.25Å; I331-G334 PolarHBondContact O-N 2.8Å; Q332-G334 PolarHBondContact O-N 2.96Å; G334-E336 PolarHBondContact O-N 2.89Å
335	T	94.6	Very high	96.5	Very high	7 Å²	7	30.3 Å²	30.3	4%	0.043	16%	0.158	C	C	.	.			trans	-61.4	138.5	167.5	-157	0	0	0	0	110.1	G299 A330 I331 S339	G299-T335 VanDerWaalsContact O-CB 3.23Å; G299-T335 WeakPolarHBondContact O-CB 3.48Å; G299-T335 PolarHBondContact O-OG1 3.19Å; A330-T335 HydrophobicContact CB-CG2 3.99Å; A330-T335 WeakPolarHBondContact O-CB 3.36Å; A330-T335 WeakPolarHBondContact O-CG2 3.47Å; A330-T335 PolarHBondContact O-N 2.76Å; I331-T335 HydrophobicContact CG1-CG2 4.08Å; T335-S339 VanDerWaalsContact CG2-OG 3.3Å; T335-S339 WeakPolarHBondContact CG2-OG 3.08Å
336	E	94	Very high	96.3	Very high	106 Å²	106	29.2 Å²	29.2	50%	0.495	15%	0.148	S	C	.	.			trans	-104.3	-12	177.2	-55.9	-159.2	140.7	0	0	111.8	K103 G334	K103-E336 HydrophobicContact CB-CB 4.24Å; K103-E336 HydrophobicContact CD-CB 4.39Å; K103-E336 HydrophobicContact CD-CG 4.04Å; K103-E336 PolarHBondContact N-O 3.1Å; K103-E336 IonicContact NZ-OE1 2.83Å; K103-E336 PolarHBondContact NZ-OE1 2.78Å; G334-E336 PolarHBondContact O-N 2.89Å
337	D	96.4	Very high	95.7	Very high	24 Å²	24	29.5 Å²	29.5	13%	0.128	15%	0.151	C	C	.	.	S	Bend	trans	-83.7	170.5	-174.8	-136	-21.9	0	0	0	114	R104 S339	R104-D337 IonicContact CZ-OD1 3.88Å; R104-D337 VanDerWaalsContact CZ-OD1 3.25Å; R104-D337 IonicContact CZ-OD2 3.78Å; R104-D337 IonicContact NE-OD1 2.98Å; R104-D337 PolarHBondContact NE-OD1 3.47Å; R104-D337 IonicContact NE-OD2 3.22Å; R104-D337 IonicContact NH2-OD1 3.89Å; R104-D337 PolarHBondContact NH2-OD1 3.15Å; R104-D337 VanDerWaalsContact NH2-OD1 3.13Å; R104-D337 IonicContact NH2-OD2 3.61Å; R104-D337 PolarHBondContact NH2-OD2 3.09Å; D337-S339 PolarHBondContact O-OG 2.97Å
338	N	98.1	Very high	95.2	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.151	C	C	.	.			trans	-58.6	138.5	164.1	-56.8	153.3	0	0	0	109.4	L100 I101 R104 E106 N107 E108 D109 G299	L100-N338 WeakPolarHBondContact O-CA 3.13Å; I101-N338 PolarHBondContact O-ND2 2.66Å; R104-N338 WeakPolarHBondContact CB-ND2 3.38Å; E106-N338 PolarHBondContact O-ND2 3.22Å; E106-N338 VanDerWaalsContact O-ND2 3.12Å; E106-N338 PolarHBondContact O-OD1 3.05Å; N107-N338 WeakPolarHBondContact OD1-CB 3.4Å; N107-N338 VanDerWaalsContact OD1-CG 3.31Å; N107-N338 PolarHBondContact OD1-OD1 2.83Å; E108-N338 PolarHBondContact N-OD1 3.09Å; D109-N338 HydrophobicContact CB-CB 4.34Å; D109-N338 WeakPolarHBondContact OD2-CB 3.4Å; G299-N338 WeakPolarHBondContact CA-O 3.41Å
339	S	98.3	Very high	94.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	108.3	-174.5	-66.9	0	0	0	0	109.5	S99 L100 T327 T335 D337	S99-S339 WeakPolarHBondContact CA-O 3.48Å; L100-S339 PolarHBondContact N-O 3.14Å; L100-S339 PolarHBondContact O-N 3.25Å; T327-S339 WeakPolarHBondContact CG2-O 3.49Å; T335-S339 VanDerWaalsContact CG2-OG 3.3Å; T335-S339 WeakPolarHBondContact CG2-OG 3.08Å; D337-S339 PolarHBondContact O-OG 2.97Å
340	T	98.8	Very high	94.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.2	-176.1	-61.9	0	0	0	0	111.5	A98 S99 D109 F111 V125 T296 T297 I300	A98-T340 CarbonylContact O-C 3.43Å; A98-T340 VanDerWaalsContact O-CA 3.29Å; A98-T340 WeakPolarHBondContact O-CA 3.49Å; S99-T340 VanDerWaalsContact CB-OG1 3.28Å; S99-T340 WeakPolarHBondContact CB-OG1 3.21Å; S99-T340 PolarHBondContact OG-OG1 2.65Å; D109-T340 WeakPolarHBondContact CB-OG1 3.45Å; D109-T340 VanDerWaalsContact CG-OG1 3.25Å; D109-T340 WeakPolarHBondContact OD2-CB 3.09Å; D109-T340 PolarHBondContact OD2-N 2.95Å; D109-T340 PolarHBondContact OD2-OG1 2.8Å; F111-T340 HydrophobicContact CB-CG2 4.1Å; F111-T340 HydrophobicContact CD1-CG2 3.65Å; F111-T340 HydrophobicContact CE1-CG2 4.48Å; F111-T340 HydrophobicContact CG-CG2 4.15Å; V125-T340 HydrophobicContact CG1-CG2 4.43Å; T296-T340 WeakPolarHBondContact CA-O 3.46Å; T297-T340 PolarHBondContact N-O 3.27Å; T297-T340 VanDerWaalsContact N-O 3.09Å; T297-T340 PolarHBondContact OG1-N 3.11Å; I300-T340 WeakPolarHBondContact CD1-O 3.48Å
341	A	98.8	Very high	93.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.6	174.6	0	0	0	0	0	111.2	C97 A98 L295 T296 I300 A323 T327	C97-A341 VanDerWaalsContact CA-O 3.29Å; C97-A341 WeakPolarHBondContact CA-O 3.37Å; A98-A341 PolarHBondContact N-O 3.19Å; A98-A341 PolarHBondContact O-N 2.83Å; L295-A341 CarbonylContact O-C 3.57Å; L295-A341 VanDerWaalsContact O-CA 3.28Å; L295-A341 WeakPolarHBondContact O-CA 3.44Å; T296-A341 HydrophobicContact CG2-CB 4.26Å; I300-A341 HydrophobicContact CD1-CB 3.79Å; A323-A341 HydrophobicContact CB-CB 4.43Å; T327-A341 HydrophobicContact CG2-CB 3.92Å
342	V	98.8	Very high	92.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.8	169.1	-179	0	0	0	0	108.5	V95 G96 C97 F111 F113 V125 V294 L295 V344	V95-V342 HydrophobicContact CG1-CG1 3.8Å; G96-V342 CarbonylContact O-C 3.58Å; G96-V342 WeakPolarHBondContact O-CA 3.23Å; C97-V342 HydrophobicContact CB-CG2 4.28Å; F111-V342 HydrophobicContact CB-CG2 3.79Å; F111-V342 HydrophobicContact CD2-CG2 3.94Å; F111-V342 HydrophobicContact CG-CG2 4.01Å; F113-V342 HydrophobicContact CD1-CG1 4.38Å; V125-V342 HydrophobicContact CG1-CG2 3.85Å; V294-V342 CarbonylContact C-O 3.57Å; V294-V342 VanDerWaalsContact CA-O 3.25Å; V294-V342 WeakPolarHBondContact CA-O 3.26Å; L295-V342 HydrophobicContact CB-CB 4.29Å; L295-V342 PolarHBondContact N-O 3.27Å; L295-V342 PolarHBondContact O-N 2.89Å; V342-V344 HydrophobicContact CG1-CG2 4.29Å
343	V	98.6	Very high	91.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	116.4	-178.1	-175.7	0	0	0	0	109.3	G96 F292 V294 V313 P319 A322 A323 W349	G96-V343 PolarHBondContact N-O 2.72Å; G96-V343 PolarHBondContact O-N 2.93Å; F292-V343 HydrophobicContact CB-CG1 4.32Å; V294-V343 HydrophobicContact CG2-CG2 3.96Å; V313-V343 HydrophobicContact CG1-CG1 3.77Å; V313-V343 HydrophobicContact CG2-CG2 4.26Å; P319-V343 HydrophobicContact CB-CB 4.05Å; P319-V343 HydrophobicContact CB-CG1 3.87Å; A322-V343 HydrophobicContact CB-CG2 4.39Å; A323-V343 HydrophobicContact CB-CG2 4.04Å; V343-W349 HydrophobicContact CG1-CH2 4.01Å; V343-W349 HydrophobicContact CG1-CZ3 3.73Å
344	V	98.1	Very high	89.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112.7	-178.6	-176.6	0	0	0	0	108.8	I90 V95 F123 F292 L293 V342 F346	I90-V344 HydrophobicContact CG2-CG1 4.13Å; V95-V344 HydrophobicContact CG1-CG2 4.25Å; V95-V344 HydrophobicContact CG2-CG1 4.36Å; V95-V344 HydrophobicContact CG2-CG2 4.41Å; F123-V344 HydrophobicContact CD1-CG1 4.4Å; F123-V344 HydrophobicContact CD1-CG2 3.41Å; F123-V344 VanDerWaalsContact CD1-CG2 3.41Å; F123-V344 HydrophobicContact CD2-CG2 4.47Å; F123-V344 HydrophobicContact CE1-CB 4.33Å; F123-V344 HydrophobicContact CE1-CG1 3.74Å; F123-V344 HydrophobicContact CE1-CG2 3.59Å; F123-V344 HydrophobicContact CE2-CG1 4.28Å; F123-V344 HydrophobicContact CG-CG2 3.92Å; F123-V344 HydrophobicContact CZ-CG1 3.67Å; F123-V344 HydrophobicContact CZ-CG2 4.19Å; F292-V344 CarbonylContact C-O 3.51Å; F292-V344 WeakPolarHBondContact CA-O 3.31Å; F292-V344 WeakPolarHBondContact CB-O 3.3Å; L293-V344 HydrophobicContact CB-CB 4.21Å; L293-V344 PolarHBondContact N-O 3.12Å; L293-V344 PolarHBondContact O-N 3.5Å; V342-V344 HydrophobicContact CG1-CG2 4.29Å; V344-F346 HydrophobicContact CG1-CE1 3.91Å; V344-F346 HydrophobicContact CG1-CZ 4.39Å
345	P	95.3	Very high	87.8	Confident	6 Å²	6	30.9 Å²	30.9	4%	0.039	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.5	-179.8	31.1	-35.5	0	0	0	111.5	I71 N94 P319 W349	I71-P345 HydrophobicContact CD1-CB 3.72Å; I71-P345 HydrophobicContact CD1-CG 4.35Å; N94-P345 HydrophobicContact CB-CG 3.83Å; P319-P345 HydrophobicContact CG-CB 3.8Å; P319-P345 HydrophobicContact CG-CG 3.81Å; P345-W349 HydrophobicContact CB-CB 4.24Å; P345-W349 HydrophobicContact CB-CD2 4.07Å; P345-W349 HydrophobicContact CB-CE3 3.93Å; P345-W349 HydrophobicContact CB-CG 4.2Å
346	F	92.8	Very high	85.5	Confident	3 Å²	3	38.1 Å²	38.1	1%	0.013	20%	0.196	C	C	.	.			trans	-118.5	-178.9	169.2	-63.2	-38	0	0	0	110.4	I90 L195 L213 L285 D290 S291 L293 V344 A348 W349	I90-F346 HydrophobicContact CD1-CD1 3.95Å; I90-F346 HydrophobicContact CG1-CD1 4.2Å; L195-F346 HydrophobicContact CD2-CE1 3.9Å; L213-F346 HydrophobicContact CD1-CD2 3.89Å; L213-F346 HydrophobicContact CD1-CE2 3.71Å; L285-F346 HydrophobicContact CD1-CD1 3.99Å; L285-F346 HydrophobicContact CD1-CD2 4.12Å; L285-F346 HydrophobicContact CD1-CE1 3.76Å; L285-F346 HydrophobicContact CD1-CE2 3.87Å; L285-F346 HydrophobicContact CD1-CG 4.18Å; L285-F346 HydrophobicContact CD1-CZ 3.7Å; L285-F346 HydrophobicContact CD2-CD2 4.25Å; L285-F346 HydrophobicContact CD2-CE2 3.9Å; L285-F346 HydrophobicContact CD2-CZ 4.39Å; D290-F346 HydrophobicContact CB-CD2 4.35Å; D290-F346 WeakPolarHBondContact O-CB 3.49Å; S291-F346 PolarHBondContact O-N 3.04Å; L293-F346 HydrophobicContact CB-CE2 3.59Å; L293-F346 HydrophobicContact CB-CZ 3.63Å; V344-F346 HydrophobicContact CG1-CE1 3.91Å; V344-F346 HydrophobicContact CG1-CZ 4.39Å; F346-A348 VanDerWaalsContact C-N 3.33Å; F346-A348 PolarHBondContact O-N 3.48Å; F346-W349 WeakPolarHBondContact O-CB 3.25Å; F346-W349 PolarHBondContact O-N 2.94Å
347	G	85.6	Confident	83.3	Confident	6 Å²	6	37.2 Å²	37.2	6%	0.062	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47	-50.1	-173.2	0	0	0	0	0	113.7	N69 H287 W349	N69-G347 VanDerWaalsContact CB-O 3.23Å; N69-G347 WeakPolarHBondContact CB-O 2.92Å; N69-G347 PolarHBondContact ND2-O 3.34Å; N69-G347 PolarHBondContact OD1-O 3.21Å; H287-G347 CarbonylContact O-C 3.57Å; G347-W349 PolarHBondContact O-N 3.35Å; G347-W349 VanDerWaalsContact O-N 3.09Å
348	A	86.8	Confident	80.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	22.9	-175.9	0	0	0	0	0	114.3	H287 D290 S291 F346 G350 K351 Y352	H287-A348 WeakPolarHBondContact O-CB 3.45Å; H287-A348 PolarHBondContact O-N 3.36Å; D290-A348 WeakPolarHBondContact O-CB 3.47Å; D290-A348 PolarHBondContact O-N 3.05Å; S291-A348 WeakPolarHBondContact CB-O 3.47Å; S291-A348 PolarHBondContact OG-O 2.81Å; F346-A348 VanDerWaalsContact C-N 3.33Å; F346-A348 PolarHBondContact O-N 3.48Å; A348-G350 PolarHBondContact O-N 3.14Å; A348-K351 HydrophobicContact CB-CB 4.26Å; A348-K351 HydrophobicContact CB-CD 4.22Å; A348-K351 WeakPolarHBondContact O-CB 3.31Å; A348-K351 PolarHBondContact O-N 2.76Å; A348-Y352 HydrophobicContact CB-CE2 3.93Å
349	W	88.4	Confident	78.3	Confident	9 Å²	9	49.2 Å²	49.2	3%	0.034	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	126.4	175.9	178.2	-92.5	0	0	0	111.2	I71 F292 V313 H317 D318 P319 A322 V343 P345 F346 G347 K351	I71-W349 HydrophobicContact CD1-CB 3.52Å; I71-W349 HydrophobicContact CD1-CG 3.84Å; I71-W349 HydrophobicContact CG1-CB 4.42Å; F292-W349 HydrophobicContact CB-CE3 3.89Å; F292-W349 HydrophobicContact CB-CZ3 3.82Å; F292-W349 AromaticContact CD1-CE3 3.76Å; F292-W349 HydrophobicContact CD1-CE3 3.76Å; F292-W349 AromaticContact CD1-CZ3 3.58Å; F292-W349 HydrophobicContact CD1-CZ3 3.58Å; F292-W349 HydrophobicContact CE1-CZ3 4.39Å; F292-W349 HydrophobicContact CG-CE3 4.21Å; F292-W349 AromaticContact CG-CZ3 3.89Å; F292-W349 HydrophobicContact CG-CZ3 3.89Å; V313-W349 HydrophobicContact CG1-CH2 3.45Å; V313-W349 VanDerWaalsContact CG1-CH2 3.45Å; V313-W349 HydrophobicContact CG1-CZ3 3.46Å; V313-W349 VanDerWaalsContact CG1-CZ3 3.46Å; H317-W349 PolarHBondContact O-NE1 3.31Å; D318-W349 VanDerWaalsContact C-CZ2 3.46Å; P319-W349 HydrophobicContact CB-CH2 4.04Å; P319-W349 HydrophobicContact CB-CZ2 4.38Å; P319-W349 HydrophobicContact CB-CZ3 4.41Å; P319-W349 HydrophobicContact CG-CD2 4.21Å; P319-W349 HydrophobicContact CG-CE3 4.21Å; P319-W349 HydrophobicContact CG-CH2 3.68Å; P319-W349 HydrophobicContact CG-CZ2 3.69Å; P319-W349 HydrophobicContact CG-CZ3 3.94Å; A322-W349 HydrophobicContact CB-CH2 4.17Å; V343-W349 HydrophobicContact CG1-CH2 4.01Å; V343-W349 HydrophobicContact CG1-CZ3 3.73Å; P345-W349 HydrophobicContact CB-CB 4.24Å; P345-W349 HydrophobicContact CB-CD2 4.07Å; P345-W349 HydrophobicContact CB-CE3 3.93Å; P345-W349 HydrophobicContact CB-CG 4.2Å; F346-W349 WeakPolarHBondContact O-CB 3.25Å; F346-W349 PolarHBondContact O-N 2.94Å; G347-W349 PolarHBondContact O-N 3.35Å; G347-W349 VanDerWaalsContact O-N 3.09Å; W349-K351 VanDerWaalsContact C-N 3.29Å; W349-K351 PolarHBondContact O-N 2.79Å
350	G	81.9	Confident	75.7	Confident	21 Å²	21	52.2 Å²	52.2	22%	0.216	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-1.6	178.2	0	0	0	0	0	115.7	A348	A348-G350 PolarHBondContact O-N 3.14Å
351	K	82.4	Confident	73.2	Confident	88 Å²	88	60.7 Å²	60.7	38%	0.383	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-37.6	177.7	-175.5	171.8	178.4	174	0	113.1	A288 A348 W349	A288-K351 PolarHBondContact O-NZ 3.33Å; A288-K351 VanDerWaalsContact O-NZ 3.14Å; A348-K351 HydrophobicContact CB-CB 4.26Å; A348-K351 HydrophobicContact CB-CD 4.22Å; A348-K351 WeakPolarHBondContact O-CB 3.31Å; A348-K351 PolarHBondContact O-N 2.76Å; W349-K351 VanDerWaalsContact C-N 3.29Å; W349-K351 PolarHBondContact O-N 2.79Å
352	Y	78.3	Confident	70.5	Confident	52 Å²	52	64.8 Å²	64.8	20%	0.204	34%	0.34	C	S	.	.			trans	-105.7	84.1	-176.2	-53.2	-74.4	0	0	0	110.1	K216 A288 D289 S291 N314 A348	K216-Y352 HydrophobicContact CB-CE1 4.26Å; K216-Y352 HydrophobicContact CG-CE1 4.42Å; A288-Y352 PolarHBondContact O-OH 3.22Å; D289-Y352 WeakPolarHBondContact O-CE2 3.35Å; S291-Y352 VanDerWaalsContact OG-CD2 3.3Å; S291-Y352 WeakPolarHBondContact OG-CD2 3.42Å; N314-Y352 WeakPolarHBondContact CB-O 3.04Å; N314-Y352 VanDerWaalsContact CG-O 3.24Å; N314-Y352 PolarHBondContact OD1-O 2.79Å; A348-Y352 HydrophobicContact CB-CE2 3.93Å
353	K	70.3	Confident	68.2	Low	136 Å²	136	70 Å²	70	59%	0.591	36%	0.36	S	S	*	.			trans	-84.3	123.9	167.4	-67	-175.2	178.9	-177.1	0	108.8	R70 S355	R70-K353 VanDerWaalsContact NH2-CE 3.25Å; K353-S355 PolarHBondContact O-N 3.22Å
354	N	59.5	Low	65.4	Low	70 Å²	70	74.4 Å²	74.4	37%	0.374	39%	0.39	S	S	.	.			trans	-72.7	125.1	170.6	-93.4	-11.3	0	0	0	109.4	D311	D311-N354 PolarHBondContact OD1-ND2 2.99Å
355	S	47.9	Very low	62.6	Low	119 Å²	119	82.9 Å²	82.9	83%	0.832	43%	0.427	S	S	*	.	S	Bend	trans	-86.8	-8.1	179.3	52	0	0	0	0	113.9	K353	K353-S355 PolarHBondContact O-N 3.22Å
356	E	46.4	Very low	59.9	Low	160 Å²	160	86 Å²	86	75%	0.748	45%	0.453	S	S	*	.			trans	-132.9	120.1	-174.8	-66.4	-175.7	172.4	0	0	110.4
357	I	47.8	Very low	57.4	Low	86 Å²	86	89 Å²	89	44%	0.441	48%	0.475	S	S	.	.			trans	-101.5	115	174.6	-48.9	170.5	0	0	0	108.5	F359	I357-F359 HydrophobicContact CB-CD2 3.97Å; I357-F359 HydrophobicContact CB-CE2 3.84Å; I357-F359 HydrophobicContact CB-CZ 4.46Å; I357-F359 HydrophobicContact CD1-CE2 3.64Å; I357-F359 HydrophobicContact CD1-CZ 3.86Å; I357-F359 HydrophobicContact CG1-CE2 4.33Å; I357-F359 HydrophobicContact CG2-CB 4.47Å; I357-F359 HydrophobicContact CG2-CD1 3.92Å; I357-F359 HydrophobicContact CG2-CD2 3.3Å; I357-F359 HydrophobicContact CG2-CE1 3.92Å; I357-F359 HydrophobicContact CG2-CE2 3.31Å; I357-F359 HydrophobicContact CG2-CG 3.63Å; I357-F359 HydrophobicContact CG2-CZ 3.63Å; I357-F359 PolarHBondContact O-N 3.31Å
358	N	41.9	Very low	55.2	Low	159 Å²	159	92.3 Å²	92.3	85%	0.85	50%	0.497	S	S	*	.			trans	-91.9	84.4	159.9	-79.7	-33.6	0	0	0	108.2	S360	N358-S360 PolarHBondContact O-N 3.21Å
359	F	47.1	Very low	52.7	Low	118 Å²	118	95.5 Å²	95.5	52%	0.518	53%	0.53	S	S	.	.			trans	-63.6	109.8	168.6	-75.4	-73.4	0	0	0	108.3	I357 F361	I357-F359 HydrophobicContact CB-CD2 3.97Å; I357-F359 HydrophobicContact CB-CE2 3.84Å; I357-F359 HydrophobicContact CB-CZ 4.46Å; I357-F359 HydrophobicContact CD1-CE2 3.64Å; I357-F359 HydrophobicContact CD1-CZ 3.86Å; I357-F359 HydrophobicContact CG1-CE2 4.33Å; I357-F359 HydrophobicContact CG2-CB 4.47Å; I357-F359 HydrophobicContact CG2-CD1 3.92Å; I357-F359 HydrophobicContact CG2-CD2 3.3Å; I357-F359 HydrophobicContact CG2-CE1 3.92Å; I357-F359 HydrophobicContact CG2-CE2 3.31Å; I357-F359 HydrophobicContact CG2-CG 3.63Å; I357-F359 HydrophobicContact CG2-CZ 3.63Å; I357-F359 PolarHBondContact O-N 3.31Å; F359-F361 HydrophobicContact CB-CD2 3.91Å; F359-F361 HydrophobicContact CB-CE2 4.1Å; F359-F361 PolarHBondContact O-N 3.37Å
360	S	45.2	Very low	50.6	Low	64 Å²	64	104.7 Å²	104.7	45%	0.448	57%	0.565	S	S	.	*			trans	-76.7	79	173	-169.1	0	0	0	0	109.7	N358 S362	N358-S360 PolarHBondContact O-N 3.21Å; S360-S362 PolarHBondContact O-N 3.47Å; S360-S362 PolarHBondContact OG-OG 3.37Å
361	F	44.7	Very low	48.8	Very low	178 Å²	178	113.6 Å²	113.6	78%	0.781	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-8.9	176.1	-101.4	-85	0	0	0	113.7	F359 R363	F359-F361 HydrophobicContact CB-CD2 3.91Å; F359-F361 HydrophobicContact CB-CE2 4.1Å; F359-F361 PolarHBondContact O-N 3.37Å; F361-R363 VanDerWaalsContact C-N 3.35Å; F361-R363 PolarHBondContact O-N 3.08Å
362	S	43.6	Very low	46.4	Very low	86 Å²	86	117.8 Å²	117.8	60%	0.601	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-8.4	-174.2	39.5	0	0	0	0	114.8	S360	S360-S362 PolarHBondContact O-N 3.47Å; S360-S362 PolarHBondContact OG-OG 3.37Å
363	R	50.5	Low	44.8	Very low	110 Å²	110	121.1 Å²	121.1	42%	0.415	67%	0.665	S	S	.	*	H	α-helix	trans	-75.9	-24.7	180	-61.2	-167.1	-165.3	-156.7	9.4	114.3	N305 E308 F361 F365 A366 S367	N305-R363 PolarHBondContact ND2-NH2 3.44Å; E308-R363 IonicContact OE1-CZ 2.69Å; E308-R363 IonicContact OE1-NE 3.16Å; E308-R363 IonicContact OE1-NH2 3.75Å; E308-R363 PolarHBondContact OE1-NH2 3.24Å; E308-R363 IonicContact OE2-CZ 3.1Å; E308-R363 IonicContact OE2-NH1 2.96Å; E308-R363 IonicContact OE2-NH2 2.75Å; E308-R363 PolarHBondContact OE2-NH2 3.22Å; F361-R363 VanDerWaalsContact C-N 3.35Å; F361-R363 PolarHBondContact O-N 3.08Å; R363-F365 PolarHBondContact O-N 3.02Å; R363-A366 PolarHBondContact O-N 2.67Å; R363-S367 PolarHBondContact O-N 2.96Å
364	S	39.9	Very low	43.5	Very low	91 Å²	91	120.3 Å²	120.3	64%	0.636	67%	0.669	S	S	*	*	H	α-helix	trans	-65.3	-23.5	-179.3	-155.7	0	0	0	0	113	S368	S364-S368 WeakPolarHBondContact O-CB 3.28Å; S364-S368 PolarHBondContact O-OG 3.25Å
365	F	37.8	Very low	42.6	Very low	179 Å²	179	123.1 Å²	123.1	79%	0.785	69%	0.685	S	S	*	*	H	α-helix	trans	-91.3	-22.5	177.6	-89.6	-82.7	0	0	0	114.9	R363 S368	R363-F365 PolarHBondContact O-N 3.02Å; F365-S368 WeakPolarHBondContact CA-OG 3.23Å
366	A	39.6	Very low	42.3	Very low	70 Å²	70	123.4 Å²	123.4	58%	0.579	68%	0.677	S	S	*	*	H	α-helix	trans	-82.6	-21.6	176.8	0	0	0	0	0	112.9	R363	R363-A366 PolarHBondContact O-N 2.67Å
367	S	40.3	Very low	42	Very low	68 Å²	68	121.1 Å²	121.1	48%	0.476	67%	0.672	S	S	.	*	H	α-helix	trans	-86.9	-36.5	175.1	167.4	0	0	0	0	112.6	R363 G369 R370	R363-S367 PolarHBondContact O-N 2.96Å; S367-G369 VanDerWaalsContact C-N 3.33Å; S367-G369 PolarHBondContact O-N 3.38Å; S367-R370 PolarHBondContact O-N 3.2Å
368	S	38.8	Very low	41.6	Very low	74 Å²	74	123.4 Å²	123.4	52%	0.517	69%	0.688	S	S	.	*	H	α-helix	trans	-75.4	-16.5	178.4	51.3	0	0	0	0	114.5	S364 F365 R370	S364-S368 WeakPolarHBondContact O-CB 3.28Å; S364-S368 PolarHBondContact O-OG 3.25Å; F365-S368 WeakPolarHBondContact CA-OG 3.23Å; S368-R370 VanDerWaalsContact C-N 3.3Å
369	G	33.9	Very low	41.6	Very low	68 Å²	68	120.9 Å²	120.9	70%	0.701	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-1	171.2	0	0	0	0	0	114.8	S367	S367-G369 VanDerWaalsContact C-N 3.33Å; S367-G369 PolarHBondContact O-N 3.38Å
370	R	45.2	Very low	41.2	Very low	202 Å²	202	121.1 Å²	121.1	76%	0.762	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	8.8	-178.4	-71	-173.2	-178.4	-140.5	0.1	114.3	S367 S368	S367-R370 PolarHBondContact O-N 3.2Å; S368-R370 VanDerWaalsContact C-N 3.3Å
371	W	44.1	Very low	40.9	Very low	207 Å²	207	125.8 Å²	125.8	78%	0.784	71%	0.708	S	S	*	*			trans	-137.3	79.3	178.6	-58.5	98.1	0	0	0	110.8
372	A	32.1	Very low	40.5	Very low	177 Å²	177	121.1 Å²	121.1	100%	1.463	70%	0.702	S	S	*	*			trans	-143.3	0	154.3	0	0	0	0	0	108.5

Retrieved 372 of 372 residues in 148.4 ms (Link to these results)

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