A0A087XX58_POEFO Loading...

Lipoyl synthase, mitochondrial

Catalyzes the radical-mediated insertion of two sulfur atoms into the C-6 and C-8 positions of the octanoyl moiety bound to the lipoyl domains of lipoate-dependent enzymes, thereby converting the octanoylated domains into lipoylated derivatives.

AlphaFold DB , UniProt , Accession A0A087XX58, Species POEFO (Poecilia formosa, Amazon molly), Gene LIAS, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	31.6	Very low	241 Å²	241	148.3 Å²	148.3	100%	1.187	84%	0.84	S	S	*	*				0	79.9	0	-72.3	-177.6	163.9	0	0	106.9
2	A	30.6	Very low	31.3	Very low	94 Å²	94	142.8 Å²	142.8	78%	0.777	84%	0.841	S	S	*	*				69.3	136.5	62.6	0	0	0	0	0	114.2
3	L	31.8	Very low	31.2	Very low	165 Å²	165	149 Å²	149	86%	0.864	84%	0.841	S	S	*	*			trans	95.9	98.4	178.1	-55.6	169.8	0	0	0	113.7
4	L	30.6	Very low	31	Very low	142 Å²	142	152 Å²	152	74%	0.743	84%	0.841	S	S	*	*			cis	66.7	106	30.7	-117.2	165.1	0	0	0	113.8
5	K	32.1	Very low	30.8	Very low	211 Å²	211	148.7 Å²	148.7	92%	0.917	83%	0.833	S	S	*	*			trans	-148	106.5	150.2	-97.8	-174.5	-178.3	-179.6	0	111.4
6	Q	32.6	Very low	30.8	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.804	82%	0.824	S	S	*	*			trans	-50.3	168.8	145.9	-81	167.3	-14.4	0	0	111.1
7	S	30	Very low	30.8	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	83%	0.828	S	S	*	*			cis	-179.5	151.4	-4.3	170.7	0	0	0	0	104.2
8	C	28.2	Very low	30.8	Very low	126 Å²	126	148.6 Å²	148.6	85%	0.851	82%	0.824	S	S	*	*				-170.9	132.5	128.2	-142.2	0	0	0	0	112.4
9	C	28.4	Very low	30.7	Very low	104 Å²	104	149.9 Å²	149.9	70%	0.703	83%	0.829	S	S	*	*			trans	-90.4	141.9	173.7	-158.6	0	0	0	0	109
10	V	31.4	Very low	30.7	Very low	141 Å²	141	153.4 Å²	153.4	86%	0.855	83%	0.829	S	S	*	*			trans	-142.7	120.6	153.8	-178.4	0	0	0	0	109.6
11	T	30.4	Very low	30.7	Very low	128 Å²	128	154 Å²	154	79%	0.785	83%	0.831	S	S	*	*			trans	-78.1	145.6	171.9	44.3	0	0	0	0	112.4
12	G	28.2	Very low	30.3	Very low	83 Å²	83	147.9 Å²	147.9	86%	0.856	81%	0.812	S	S	*	*			trans	-146.4	114.7	163.8	0	0	0	0	0	111.4
13	R	29.6	Very low	30.9	Very low	223 Å²	223	148.9 Å²	148.9	84%	0.842	81%	0.81	S	S	*	*			trans	-102.3	168.9	174.6	-91.6	-175.4	177.1	-168.4	0.1	110.7
14	F	28.7	Very low	30.8	Very low	191 Å²	191	152.8 Å²	152.8	84%	0.838	81%	0.813	S	S	*	*			trans	87.2	138.4	165.8	-61.5	-82.3	0	0	0	114.9
15	S	28.6	Very low	30.7	Very low	103 Å²	103	151 Å²	151	72%	0.72	81%	0.813	S	S	*	*			cis	-154.1	151.3	22	-174	0	0	0	0	112.1
16	T	30.2	Very low	30.6	Very low	113 Å²	113	147.9 Å²	147.9	69%	0.693	80%	0.804	S	S	*	*			trans	-60	151.3	164.3	44.3	0	0	0	0	113.3
17	N	31.1	Very low	30.3	Very low	167 Å²	167	146.9 Å²	146.9	89%	0.893	80%	0.804	S	S	*	*			trans	-152.5	124.4	137.4	-100.6	-18.6	0	0	0	112.3
18	H	30	Very low	30.2	Very low	164 Å²	164	149 Å²	149	76%	0.759	80%	0.802	S	S	*	*			trans	-69	151.3	167.2	-86.3	-78.5	0	0	0	111.1
19	L	30.6	Very low	30.2	Very low	174 Å²	174	149.9 Å²	149.9	91%	0.911	80%	0.803	S	S	*	*			trans	-159.2	117.6	134.3	-102.4	154.5	0	0	0	109.7
20	R	29.8	Very low	30.1	Very low	219 Å²	219	153.8 Å²	153.8	83%	0.826	80%	0.804	S	S	*	*			trans	-81	155.6	165.6	-72.3	178.5	175.7	-168.7	-1.1	108.9
21	L	30.5	Very low	29.9	Very low	166 Å²	166	153 Å²	153	87%	0.869	80%	0.8	S	S	*	*			trans	-175.7	100.9	131.2	-95.3	162.4	0	0	0	111.1
22	S	32.3	Very low	29.6	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	80%	0.795	S	S	*	*				41.1	149.5	123.2	-177.6	0	0	0	0	123.3
23	P	44.9	Very low	29.5	Very low	115 Å²	115	152.8 Å²	152.8	75%	0.747	79%	0.789	S	S	*	*			trans	-108.7	172.6	-155.1	40.4	-27.5	0	0	0	114.9
24	R	29.4	Very low	29.3	Very low	246 Å²	246	149.2 Å²	149.2	93%	0.928	79%	0.786	S	S	*	*			trans	-134	122.2	157.9	-84.2	-172.1	173.5	-177.1	-1.9	111.9
25	S	27.8	Very low	29.1	Very low	104 Å²	104	148 Å²	148	73%	0.727	79%	0.789	S	S	*	*			trans	-69.5	161.6	163.2	34.2	0	0	0	0	112.1
26	I	30.6	Very low	29	Very low	146 Å²	146	148.6 Å²	148.6	75%	0.749	79%	0.788	S	S	*	*				164.5	132.7	120	-88.5	166	0	0	0	114.4
27	L	26.6	Very low	28.8	Very low	151 Å²	151	148.6 Å²	148.6	79%	0.791	79%	0.793	S	S	*	*			trans	59.3	123.9	154.7	-90.2	70	0	0	0	119.7
28	H	27.7	Very low	29.2	Very low	152 Å²	152	145.7 Å²	145.7	70%	0.704	78%	0.783	S	S	*	*			cis	72.2	101.5	40.3	-133.3	67	0	0	0	114.8	Y30	H28-Y30 AromaticContact NE2-CE2 3.93Å
29	V	28.3	Very low	29	Very low	145 Å²	145	147.5 Å²	147.5	88%	0.879	79%	0.788	S	S	*	*			trans	-150.5	130.4	148.4	-179.1	0	0	0	0	110.7
30	Y	25.2	Very low	28.8	Very low	185 Å²	185	144 Å²	144	73%	0.725	78%	0.778	S	S	*	*			trans	-87.7	157	175.1	-102.7	-104	0	0	0	112.8	H28	H28-Y30 AromaticContact NE2-CE2 3.93Å
31	T	26.8	Very low	28.9	Very low	126 Å²	126	138.9 Å²	138.9	77%	0.773	78%	0.776	S	S	*	*			trans	168.7	117.9	138.1	24	0	0	0	0	108.2
32	S	25.2	Very low	28.8	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	77%	0.771	S	S	*	*				56.6	125.4	60.1	88.6	0	0	0	0	112.2
33	C	24.9	Very low	28.9	Very low	110 Å²	110	137.5 Å²	137.5	74%	0.743	77%	0.773	S	S	*	*			cis	-168.8	151.9	37.7	-93.5	0	0	0	0	112.6
34	L	25.5	Very low	28.3	Very low	148 Å²	148	143.5 Å²	143.5	78%	0.775	78%	0.781	S	S	*	*			trans	22	136.6	136.7	-62.3	155.4	0	0	0	122.6
35	N	25.6	Very low	28.4	Very low	166 Å²	166	140.3 Å²	140.3	89%	0.888	78%	0.777	S	S	*	*				-164.7	155.2	121.3	-102.2	-14.1	0	0	0	113.7
36	T	26.9	Very low	28.5	Very low	115 Å²	115	140.6 Å²	140.6	71%	0.706	77%	0.77	S	S	*	*			trans	-105.7	141.9	-157.9	46.3	0	0	0	0	116.3
37	S	25.7	Very low	28.5	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	78%	0.775	S	S	*	*			trans	36.8	170.9	138	-42.1	0	0	0	0	123.1
38	P	39.1	Very low	28.7	Very low	105 Å²	105	146 Å²	146	68%	0.682	78%	0.776	S	S	*	*			cis	-144	-179.9	-0.3	43	-23.3	0	0	0	118.7
39	K	26	Very low	28.8	Very low	202 Å²	202	146.3 Å²	146.3	88%	0.878	78%	0.775	S	S	*	*			trans	79	141.2	159.2	-60.1	-175.9	-174.4	179.7	0	117.3
40	S	25.9	Very low	28.7	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	77%	0.768	S	S	*	*			cis	-165.5	149.6	16.1	48.7	0	0	0	0	112.5
41	S	31.8	Very low	29.2	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	77%	0.767	S	S	*	*			trans	45	98.7	144.6	64.5	0	0	0	0	121.4
42	A	29	Very low	29.6	Very low	92 Å²	92	146 Å²	146	76%	0.76	77%	0.77	S	S	*	*			trans	-166.4	51.5	147.5	0	0	0	0	0	112	R44	A42-R44 PolarHBondContact O-N 3.21Å
43	D	34.7	Very low	30.2	Very low	158 Å²	158	146 Å²	146	85%	0.845	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	96.8	176.9	-106	-35.6	0	0	0	110.7
44	R	32.5	Very low	30.9	Very low	242 Å²	242	149.6 Å²	149.6	91%	0.913	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.8	-12.5	150.7	-109.9	169.4	177.8	-169.2	-1.2	116.4	A42	A42-R44 PolarHBondContact O-N 3.21Å
45	E	30.6	Very low	32.2	Very low	179 Å²	179	151.2 Å²	151.2	84%	0.836	79%	0.785	S	S	*	*	S	Bend	trans	-103.4	-18.1	-179.6	-76	-174.5	150.4	0	0	115	R47	E45-R47 PolarHBondContact O-N 3.04Å
46	D	30.1	Very low	33.2	Very low	109 Å²	109	146 Å²	146	58%	0.583	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-80.2	-17.1	-175.1	-99.2	-27	0	0	0	115.2	K48 K49	D46-K48 PolarHBondContact O-N 2.94Å; D46-K48 VanDerWaalsContact O-N 3.09Å; D46-K49 PolarHBondContact O-N 3.16Å; D46-K49 VanDerWaalsContact O-N 3.13Å
47	R	31.3	Very low	33.8	Very low	223 Å²	223	144.1 Å²	144.1	84%	0.842	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-70.4	-9.4	-178.7	-152.5	178.3	-92.7	-128.1	0.4	113.7	E45	E45-R47 PolarHBondContact O-N 3.04Å
48	K	30.6	Very low	34.5	Very low	188 Å²	188	140.2 Å²	140.2	82%	0.817	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-90.8	-18.9	174.2	-104.9	-178.9	178.2	178.5	0	113.7	D46	D46-K48 PolarHBondContact O-N 2.94Å; D46-K48 VanDerWaalsContact O-N 3.09Å
49	K	28.6	Very low	34.8	Very low	159 Å²	159	137 Å²	137	69%	0.691	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-25	-176	-81.8	179.9	177.5	172.8	0	113.9	D46 V51 Q52	D46-K49 PolarHBondContact O-N 3.16Å; D46-K49 VanDerWaalsContact O-N 3.13Å; K49-V51 PolarHBondContact O-N 3.17Å; K49-Q52 PolarHBondContact O-N 3.26Å
50	E	26.3	Very low	35.9	Very low	157 Å²	157	132.5 Å²	132.5	73%	0.734	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-71.8	-7	175.8	-74.7	-175.9	148.7	0	0	114.4	Q52	E50-Q52 VanDerWaalsContact C-N 3.31Å; E50-Q52 PolarHBondContact O-N 2.7Å
51	V	36	Very low	36.9	Very low	116 Å²	116	132.2 Å²	132.2	70%	0.703	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-82	-8.6	179.3	-176.3	0	0	0	0	112.6	K49	K49-V51 PolarHBondContact O-N 3.17Å
52	Q	36.1	Very low	37.4	Very low	177 Å²	177	132 Å²	132	83%	0.827	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-104.5	2.7	-174.2	-85.8	-178	-18.7	0	0	115.8	K49 E50	K49-Q52 PolarHBondContact O-N 3.26Å; E50-Q52 VanDerWaalsContact C-N 3.31Å; E50-Q52 PolarHBondContact O-N 2.7Å
53	S	37.9	Very low	38.4	Very low	94 Å²	94	130.7 Å²	130.7	66%	0.657	65%	0.652	S	S	*	*			trans	-129.3	76.8	179.5	67.6	0	0	0	0	112.5
54	Q	38.9	Very low	38.9	Very low	186 Å²	186	125.4 Å²	125.4	87%	0.869	63%	0.628	S	S	*	*	S	Bend	trans	-139.7	124.9	154.5	-72.3	-163	-11.8	0	0	109.1	G56	Q54-G56 PolarHBondContact O-N 3.39Å
55	D	52.9	Low	39.4	Very low	183 Å²	183	117 Å²	117	98%	0.979	62%	0.616	S	S	*	*	S	Bend	trans	-54.8	111.8	-166.4	-66.3	-55.3	0	0	0	113.9
56	G	47.1	Very low	39.9	Very low	57 Å²	57	116.3 Å²	116.3	59%	0.588	61%	0.613	S	S	*	*	S	Bend	trans	179.1	146.9	169.1	0	0	0	0	0	110.3	Q54 G58	Q54-G56 PolarHBondContact O-N 3.39Å; G56-G58 PolarHBondContact O-N 3.02Å
57	P	37.9	Very low	40.5	Very low	74 Å²	74	114.9 Å²	114.9	48%	0.481	61%	0.605	S	S	.	*			trans	-58.8	129.3	180	20.4	-29.5	0	0	0	110.9	D61 F62	P57-D61 WeakPolarHBondContact CA-OD2 3.1Å; P57-D61 HydrophobicContact CB-CB 3.84Å; P57-F62 HydrophobicContact CB-CD2 4.36Å; P57-F62 HydrophobicContact CB-CE2 3.97Å; P57-F62 HydrophobicContact CG-CE2 3.76Å; P57-F62 HydrophobicContact CG-CZ 4.37Å
58	G	41	Very low	41	Very low	31 Å²	31	108.8 Å²	108.8	32%	0.32	60%	0.597	S	S	.	*			trans	-72.7	168.6	176.8	0	0	0	0	0	112	G56 Q60 D61 F62	G56-G58 PolarHBondContact O-N 3.02Å; G58-Q60 PolarHBondContact O-N 3.05Å; G58-Q60 VanDerWaalsContact O-N 3.17Å; G58-D61 PolarHBondContact N-OD2 2.82Å; G58-D61 WeakPolarHBondContact O-CB 3.47Å; G58-D61 PolarHBondContact O-N 3.3Å; G58-F62 PolarHBondContact O-N 3.45Å
59	L	46.5	Very low	41.7	Very low	37 Å²	37	102.6 Å²	102.6	19%	0.194	57%	0.571	C	S	.	*	H	α-helix	trans	-51.9	-38.2	172.8	175.4	67.2	0	0	0	111.5	D61 F62 I63 Y356 A369	L59-D61 VanDerWaalsContact C-N 3.3Å; L59-D61 PolarHBondContact O-N 2.72Å; L59-F62 PolarHBondContact O-N 3.38Å; L59-I63 HydrophobicContact CD1-CD1 3.77Å; L59-I63 HydrophobicContact CD1-CG1 4.16Å; L59-I63 HydrophobicContact CD2-CD1 4.24Å; L59-I63 HydrophobicContact CG-CD1 3.71Å; L59-I63 HydrophobicContact CG-CG1 4.36Å; L59-I63 WeakPolarHBondContact O-CG1 3.07Å; L59-I63 PolarHBondContact O-N 3.38Å; L59-Y356 HydrophobicContact CD2-CE2 4.2Å; L59-A369 HydrophobicContact CD1-CB 3.72Å
60	Q	48.3	Very low	42.6	Very low	108 Å²	108	102.7 Å²	102.7	51%	0.505	57%	0.571	S	S	.	*	H	α-helix	trans	-62.7	-38	177.8	-79.7	57.2	36.4	0	0	110.6	G58 F62 I63 S64	G58-Q60 PolarHBondContact O-N 3.05Å; G58-Q60 VanDerWaalsContact O-N 3.17Å; Q60-F62 VanDerWaalsContact C-N 3.28Å; Q60-F62 PolarHBondContact O-N 2.63Å; Q60-I63 PolarHBondContact O-N 3.45Å; Q60-S64 WeakPolarHBondContact O-CA 3.34Å; Q60-S64 WeakPolarHBondContact O-CB 3.29Å; Q60-S64 PolarHBondContact O-N 2.91Å; Q60-S64 PolarHBondContact O-OG 3.09Å
61	D	45.8	Very low	43.6	Very low	96 Å²	96	99.6 Å²	99.6	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-69.6	-26.3	179.1	-56.9	-38.3	0	0	0	112.4	P57 G58 L59 S64	P57-D61 WeakPolarHBondContact CA-OD2 3.1Å; P57-D61 HydrophobicContact CB-CB 3.84Å; G58-D61 PolarHBondContact N-OD2 2.82Å; G58-D61 WeakPolarHBondContact O-CB 3.47Å; G58-D61 PolarHBondContact O-N 3.3Å; L59-D61 VanDerWaalsContact C-N 3.3Å; L59-D61 PolarHBondContact O-N 2.72Å; D61-S64 WeakPolarHBondContact CA-OG 3.39Å
62	F	43.8	Very low	44.5	Very low	106 Å²	106	99.8 Å²	99.8	47%	0.465	56%	0.558	S	S	.	*	H	α-helix	trans	-84	-41	174.3	-83.5	-85.9	0	0	0	113.6	P57 G58 L59 Q60 S64	P57-F62 HydrophobicContact CB-CD2 4.36Å; P57-F62 HydrophobicContact CB-CE2 3.97Å; P57-F62 HydrophobicContact CG-CE2 3.76Å; P57-F62 HydrophobicContact CG-CZ 4.37Å; G58-F62 PolarHBondContact O-N 3.45Å; L59-F62 PolarHBondContact O-N 3.38Å; Q60-F62 VanDerWaalsContact C-N 3.28Å; Q60-F62 PolarHBondContact O-N 2.63Å; F62-S64 VanDerWaalsContact C-N 3.28Å
63	I	49.5	Very low	45.8	Very low	64 Å²	64	95 Å²	95	33%	0.328	53%	0.532	S	S	.	.	H	α-helix	trans	-71.6	-28.7	175.1	-64	176.2	0	0	0	110.7	L59 Q60	L59-I63 HydrophobicContact CD1-CD1 3.77Å; L59-I63 HydrophobicContact CD1-CG1 4.16Å; L59-I63 HydrophobicContact CD2-CD1 4.24Å; L59-I63 HydrophobicContact CG-CD1 3.71Å; L59-I63 HydrophobicContact CG-CG1 4.36Å; L59-I63 WeakPolarHBondContact O-CG1 3.07Å; L59-I63 PolarHBondContact O-N 3.38Å; Q60-I63 PolarHBondContact O-N 3.45Å
64	S	45.9	Very low	47	Very low	48 Å²	48	95 Å²	95	34%	0.336	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	6.1	-176.9	72.5	0	0	0	0	115.1	Q60 D61 F62 E66 L67	Q60-S64 WeakPolarHBondContact O-CA 3.34Å; Q60-S64 WeakPolarHBondContact O-CB 3.29Å; Q60-S64 PolarHBondContact O-N 2.91Å; Q60-S64 PolarHBondContact O-OG 3.09Å; D61-S64 WeakPolarHBondContact CA-OG 3.39Å; F62-S64 VanDerWaalsContact C-N 3.28Å; S64-E66 WeakPolarHBondContact O-CA 3.29Å; S64-E66 PolarHBondContact O-N 2.72Å; S64-L67 PolarHBondContact O-N 3.39Å
65	G	41.8	Very low	48.3	Very low	65 Å²	65	93.5 Å²	93.5	67%	0.67	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	38.3	171.5	0	0	0	0	0	114.8
66	E	41.3	Very low	49.5	Very low	164 Å²	164	88 Å²	88	77%	0.766	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.7	56.5	134.7	-90.1	-172.7	170.4	0	0	107.6	S64 S68	S64-E66 WeakPolarHBondContact O-CA 3.29Å; S64-E66 PolarHBondContact O-N 2.72Å; E66-S68 PolarHBondContact O-N 2.85Å
67	L	42.8	Very low	50.8	Low	79 Å²	79	96.9 Å²	96.9	41%	0.414	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-82.4	24	164.1	-73.7	175.6	0	0	0	111.8	S64 E69 K70	S64-L67 PolarHBondContact O-N 3.39Å; L67-E69 PolarHBondContact O-N 3.16Å; L67-E69 VanDerWaalsContact O-N 3.11Å; L67-K70 PolarHBondContact O-N 3.06Å
68	S	41.3	Very low	52.8	Low	96 Å²	96	94.8 Å²	94.8	67%	0.671	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-66.4	-5.2	172.6	62.5	0	0	0	0	112.7	E66	E66-S68 PolarHBondContact O-N 2.85Å
69	E	46.7	Very low	54.9	Low	58 Å²	58	97.8 Å²	97.8	27%	0.271	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-116.4	29.3	-178.8	-59.1	-137.9	140.2	0	0	113.8	L67 S71 K72 W73	L67-E69 PolarHBondContact O-N 3.16Å; L67-E69 VanDerWaalsContact O-N 3.11Å; E69-S71 PolarHBondContact O-N 2.91Å; E69-K72 HydrophobicContact CB-CB 4.21Å; E69-K72 HydrophobicContact CB-CD 4.45Å; E69-K72 VanDerWaalsContact CD-NZ 3.28Å; E69-K72 HydrophobicContact CG-CD 4.34Å; E69-K72 PolarHBondContact O-N 3.43Å; E69-K72 VanDerWaalsContact OE1-CD 3.31Å; E69-K72 WeakPolarHBondContact OE1-CD 3.49Å; E69-K72 WeakPolarHBondContact OE1-CE 3.41Å; E69-K72 IonicContact OE1-NZ 3.99Å; E69-K72 PolarHBondContact OE1-NZ 3.43Å; E69-K72 WeakPolarHBondContact OE2-CD 3.37Å; E69-K72 IonicContact OE2-NZ 3.72Å; E69-K72 PolarHBondContact OE2-NZ 2.81Å; E69-W73 HydrophobicContact CB-CZ2 3.85Å; E69-W73 PolarHBondContact O-NE1 3.07Å
70	K	47.3	Very low	57	Low	161 Å²	161	98 Å²	98	70%	0.7	51%	0.514	S	S	*	.	H	α-helix	trans	-49.7	-28.3	169.7	-82.4	-175.2	178.6	178.1	0	112.7	L67	L67-K70 PolarHBondContact O-N 3.06Å
71	S	47.1	Very low	59	Low	91 Å²	91	99.2 Å²	99.2	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-73.9	-26.9	176.4	52.2	0	0	0	0	114.9	E69	E69-S71 PolarHBondContact O-N 2.91Å
72	K	54.3	Low	61.2	Low	121 Å²	121	97.5 Å²	97.5	53%	0.526	50%	0.504	S	S	.	.	H	α-helix	trans	-87.4	-19.6	-175.1	-98.7	169.4	172.2	178.9	0	114.4	E69	E69-K72 HydrophobicContact CB-CB 4.21Å; E69-K72 HydrophobicContact CB-CD 4.45Å; E69-K72 VanDerWaalsContact CD-NZ 3.28Å; E69-K72 HydrophobicContact CG-CD 4.34Å; E69-K72 PolarHBondContact O-N 3.43Å; E69-K72 VanDerWaalsContact OE1-CD 3.31Å; E69-K72 WeakPolarHBondContact OE1-CD 3.49Å; E69-K72 WeakPolarHBondContact OE1-CE 3.41Å; E69-K72 IonicContact OE1-NZ 3.99Å; E69-K72 PolarHBondContact OE1-NZ 3.43Å; E69-K72 WeakPolarHBondContact OE2-CD 3.37Å; E69-K72 IonicContact OE2-NZ 3.72Å; E69-K72 PolarHBondContact OE2-NZ 2.81Å
73	W	63.4	Low	63.2	Low	75 Å²	75	97.7 Å²	97.7	28%	0.284	51%	0.506	S	S	.	.	H	α-helix	trans	-93.7	-29	-174.5	-45	132	0	0	0	113.8	E69 E75 Y76 P92 W93	E69-W73 HydrophobicContact CB-CZ2 3.85Å; E69-W73 PolarHBondContact O-NE1 3.07Å; W73-E75 PolarHBondContact O-N 2.94Å; W73-E75 VanDerWaalsContact O-N 3.15Å; W73-Y76 WeakPolarHBondContact O-CB 3.1Å; W73-Y76 PolarHBondContact O-N 3.24Å; W73-Y76 VanDerWaalsContact O-N 3.1Å; W73-P92 HydrophobicContact CD2-CB 4.46Å; W73-P92 HydrophobicContact CE3-CB 3.47Å; W73-P92 VanDerWaalsContact CE3-CB 3.47Å; W73-P92 HydrophobicContact CE3-CG 4Å; W73-P92 HydrophobicContact CH2-CB 3.81Å; W73-P92 HydrophobicContact CZ3-CB 3.1Å; W73-P92 HydrophobicContact CZ3-CG 3.85Å; W73-W93 HydrophobicContact CB-CE3 4.48Å
74	A	62.5	Low	64.7	Low	94 Å²	94	105 Å²	105	78%	0.777	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.9	177.6	0	0	0	0	0	113
75	E	67.9	Low	66.1	Low	156 Å²	156	106.1 Å²	106.1	73%	0.729	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	0.5	180	-60.3	-174	172.9	0	0	113.8	W73 R77	W73-E75 PolarHBondContact O-N 2.94Å; W73-E75 VanDerWaalsContact O-N 3.15Å; E75-R77 WeakPolarHBondContact O-CG 3.32Å; E75-R77 PolarHBondContact O-N 2.71Å
76	Y	76.3	Confident	68	Low	67 Å²	67	107.4 Å²	107.4	26%	0.263	54%	0.544	S	S	.	.			trans	-64.5	107.7	-179.6	-178.5	-101	0	0	0	111.1	W73 G78 L80 P91 P92 W93	W73-Y76 WeakPolarHBondContact O-CB 3.1Å; W73-Y76 PolarHBondContact O-N 3.24Å; W73-Y76 VanDerWaalsContact O-N 3.1Å; Y76-G78 VanDerWaalsContact CE1-CA 3.44Å; Y76-G78 WeakPolarHBondContact CE1-O 3.49Å; Y76-L80 HydrophobicContact CD1-CD2 3.94Å; Y76-L80 HydrophobicContact CE1-CD2 3.59Å; Y76-L80 HydrophobicContact CE1-CG 4.47Å; Y76-P91 HydrophobicContact CE1-CB 4.07Å; Y76-P92 HydrophobicContact CD2-CG 4Å; Y76-P92 HydrophobicContact CE2-CG 4.32Å; Y76-W93 HydrophobicContact CD1-CH2 4.01Å; Y76-W93 AromaticContact CD1-CZ3 3.96Å; Y76-W93 HydrophobicContact CD1-CZ3 3.96Å; Y76-W93 HydrophobicContact CE1-CH2 4.48Å; Y76-W93 HydrophobicContact CG-CZ3 4.09Å
77	R	75.5	Confident	69.7	Low	244 Å²	244	106.3 Å²	106.3	92%	0.921	53%	0.533	S	S	*	.			trans	-93.8	13.7	179.9	-58.4	-154	-174.4	-117.4	3.7	114.7	E75	E75-R77 WeakPolarHBondContact O-CG 3.32Å; E75-R77 PolarHBondContact O-N 2.71Å
78	G	79	Confident	71.8	Confident	29 Å²	29	103.8 Å²	103.8	30%	0.299	52%	0.52	S	S	.	.	S	Bend	trans	-75.8	151.5	177.7	0	0	0	0	0	112.1	Y76 L80	Y76-G78 VanDerWaalsContact CE1-CA 3.44Å; Y76-G78 WeakPolarHBondContact CE1-O 3.49Å; G78-L80 PolarHBondContact O-N 3.13Å
79	N	85.3	Confident	73.9	Confident	94 Å²	94	109.1 Å²	109.1	50%	0.503	53%	0.525	S	S	.	.			trans	-61.5	124.9	173.6	-69.6	-22	0	0	0	110	L88	N79-L88 HydrophobicContact CB-CD2 4.36Å; N79-L88 WeakPolarHBondContact O-CD2 3.47Å
80	L	90.2	Very high	75.9	Confident	43 Å²	43	109.5 Å²	109.5	23%	0.225	53%	0.529	C	S	.	.			trans	-95.7	-25.4	176.2	-62.9	179.9	0	0	0	112.7	Y76 G78 L88 W93 E335 Y336	Y76-L80 HydrophobicContact CD1-CD2 3.94Å; Y76-L80 HydrophobicContact CE1-CD2 3.59Å; Y76-L80 HydrophobicContact CE1-CG 4.47Å; G78-L80 PolarHBondContact O-N 3.13Å; L80-L88 VanDerWaalsContact O-CD1 3.3Å; L80-L88 WeakPolarHBondContact O-CD1 3.46Å; L80-W93 HydrophobicContact CD1-CH2 4.22Å; L80-W93 HydrophobicContact CD2-CH2 3.58Å; L80-W93 HydrophobicContact CD2-CZ2 3.87Å; L80-E335 CarbonylContact O-C 3.52Å; L80-E335 VanDerWaalsContact O-CA 3.24Å; L80-E335 WeakPolarHBondContact O-CA 3.39Å; L80-Y336 PolarHBondContact O-N 3.21Å
81	K	91.1	Very high	77.9	Confident	132 Å²	132	101.9 Å²	101.9	57%	0.574	50%	0.495	S	S	*	.	B	Isolated β-bridge	trans	-103.2	134	178	-71.5	-175.3	174.2	-175.3	0	111.2	E334 E335	K81-E334 WeakPolarHBondContact CA-O 3.41Å; K81-E335 WeakPolarHBondContact CE-OE1 3.49Å; K81-E335 WeakPolarHBondContact CE-OE2 3.37Å; K81-E335 HydrophobicContact CG-CB 4.23Å; K81-E335 HydrophobicContact CG-CG 3.74Å; K81-E335 IonicContact NZ-OE1 3.51Å; K81-E335 IonicContact NZ-OE2 3.73Å
82	R	91.4	Very high	79.9	Confident	60 Å²	60	99 Å²	99	23%	0.226	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-73.1	128.9	-175.2	-167.6	-174.9	72.9	-133.9	5.4	110.5	L88 K332 V333 E334	R82-L88 HydrophobicContact CB-CD1 3.86Å; R82-L88 HydrophobicContact CB-CD2 4.39Å; R82-L88 HydrophobicContact CB-CG 3.9Å; R82-L88 HydrophobicContact CG-CG 4.24Å; R82-K332 PolarHBondContact NH1-O 2.74Å; R82-V333 WeakPolarHBondContact CD-O 3.47Å; R82-V333 PolarHBondContact NH1-O 3.1Å; R82-E334 WeakPolarHBondContact CB-O 3.4Å; R82-E334 IonicContact CZ-OE1 3.95Å; R82-E334 IonicContact CZ-OE2 3.85Å; R82-E334 PolarHBondContact N-O 2.87Å; R82-E334 IonicContact NE-OE2 3.68Å; R82-E334 IonicContact NH1-OE1 3.32Å; R82-E334 PolarHBondContact NH1-OE1 2.93Å; R82-E334 IonicContact NH1-OE2 2.65Å; R82-E334 PolarHBondContact NH1-OE2 3.49Å; R82-E334 VanDerWaalsContact NH1-OE2 3.11Å; R82-E334 IonicContact NH2-OE1 2.85Å; R82-E334 PolarHBondContact NH2-OE1 2.71Å; R82-E334 IonicContact NH2-OE2 2.86Å; R82-E334 PolarHBondContact NH2-OE2 2.93Å
83	Q	87.6	Confident	81.5	Confident	110 Å²	110	94.7 Å²	94.7	51%	0.514	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-91.1	151.8	166.4	-59.8	-170.9	8.1	0	0	111	G85 E86	Q83-G85 PolarHBondContact O-N 3.04Å; Q83-E86 HydrophobicContact CB-CG 4.38Å; Q83-E86 PolarHBondContact O-N 3.07Å
84	K	80.3	Confident	82.6	Confident	217 Å²	217	91.2 Å²	91.2	94%	0.943	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	123	-177.3	-171.9	178.8	-179.7	-178.8	0	110
85	G	75.6	Confident	83.7	Confident	73 Å²	73	93.3 Å²	93.3	75%	0.753	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-12.8	-178.9	0	0	0	0	0	114.6	Q83	Q83-G85 PolarHBondContact O-N 3.04Å
86	E	80.8	Confident	84.2	Confident	92 Å²	92	88.8 Å²	88.8	43%	0.43	42%	0.417	S	S	.	.			trans	-100.7	158.7	-176.6	-61.1	-168.3	163	0	0	113.4	Q83	Q83-E86 HydrophobicContact CB-CG 4.38Å; Q83-E86 PolarHBondContact O-N 3.07Å
87	R	77.8	Confident	84.1	Confident	140 Å²	140	94 Å²	94	53%	0.528	44%	0.444	S	S	.	.			trans	-108.1	129.1	167.6	-86.8	-170	159.3	129.3	11.2	109.5	K328	R87-K328 VanDerWaalsContact NH2-CB 3.29Å
88	L	86.3	Confident	84	Confident	26 Å²	26	89 Å²	89	14%	0.136	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-69.2	133.7	172.3	-66.2	176.9	0	0	0	110.7	N79 L80 R82 V333 Y336	N79-L88 HydrophobicContact CB-CD2 4.36Å; N79-L88 WeakPolarHBondContact O-CD2 3.47Å; L80-L88 VanDerWaalsContact O-CD1 3.3Å; L80-L88 WeakPolarHBondContact O-CD1 3.46Å; R82-L88 HydrophobicContact CB-CD1 3.86Å; R82-L88 HydrophobicContact CB-CD2 4.39Å; R82-L88 HydrophobicContact CB-CG 3.9Å; R82-L88 HydrophobicContact CG-CG 4.24Å; L88-V333 HydrophobicContact CD1-CG1 4.36Å; L88-Y336 HydrophobicContact CB-CD2 3.89Å; L88-Y336 HydrophobicContact CB-CE2 3.42Å; L88-Y336 VanDerWaalsContact CB-CE2 3.42Å; L88-Y336 HydrophobicContact CD1-CD2 4.01Å; L88-Y336 HydrophobicContact CD1-CE2 4.2Å; L88-Y336 HydrophobicContact CG-CE2 4.45Å
89	R	86.3	Confident	83.4	Confident	209 Å²	209	89.7 Å²	89.7	79%	0.789	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-76	139.4	169.9	-70.3	-172.3	178.4	-158.2	0.7	109.3	P91 Y336	R89-P91 WeakPolarHBondContact O-CD 3.44Å; R89-Y336 WeakPolarHBondContact O-CE2 3.31Å
90	L	88.1	Confident	82.5	Confident	66 Å²	66	92.7 Å²	92.7	35%	0.346	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-64.9	119.7	179.2	-168.5	70.7	0	0	0	109.8	L94 K95 M324 Y336	L90-L94 HydrophobicContact CD1-CB 3.71Å; L90-L94 HydrophobicContact CD1-CD1 3.95Å; L90-L94 HydrophobicContact CD1-CG 4.5Å; L90-L94 HydrophobicContact CD2-CB 4.46Å; L90-L94 HydrophobicContact CG-CB 3.99Å; L90-K95 HydrophobicContact CD2-CG 4.24Å; L90-M324 HydrophobicContact CD1-CE 3.5Å; L90-M324 HydrophobicContact CD1-SD 4.26Å; L90-M324 HydrophobicContact CD2-CE 4.4Å; L90-Y336 HydrophobicContact CD1-CE1 3.87Å
91	P	89.8	Confident	81.5	Confident	0 Å²	0	92 Å²	92	0%	0	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-69.5	160.3	178.8	30	-37.7	0	0	0	111.2	Y76 R89 W93 L94 Y336	Y76-P91 HydrophobicContact CE1-CB 4.07Å; R89-P91 WeakPolarHBondContact O-CD 3.44Å; P91-W93 HydrophobicContact CB-CD2 3.87Å; P91-W93 HydrophobicContact CB-CE3 3.81Å; P91-W93 HydrophobicContact CB-CH2 3.55Å; P91-W93 HydrophobicContact CB-CZ2 3.57Å; P91-W93 HydrophobicContact CB-CZ3 3.65Å; P91-W93 HydrophobicContact CG-CD2 4.09Å; P91-W93 HydrophobicContact CG-CH2 4.11Å; P91-W93 HydrophobicContact CG-CZ2 3.58Å; P91-W93 PolarHBondContact O-N 2.98Å; P91-L94 HydrophobicContact CG-CB 4.4Å; P91-L94 HydrophobicContact CG-CD1 3.66Å; P91-L94 HydrophobicContact CG-CG 4.13Å; P91-L94 PolarHBondContact O-N 3.05Å; P91-Y336 HydrophobicContact CG-CD1 4.32Å; P91-Y336 HydrophobicContact CG-CD2 4.08Å; P91-Y336 HydrophobicContact CG-CG 3.85Å
92	P	88.2	Confident	80.6	Confident	31 Å²	31	94.9 Å²	94.9	20%	0.201	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-59.9	-38.7	-173.3	-25.7	35.2	0	0	0	115.2	W73 Y76 L94 K95	W73-P92 HydrophobicContact CD2-CB 4.46Å; W73-P92 HydrophobicContact CE3-CB 3.47Å; W73-P92 VanDerWaalsContact CE3-CB 3.47Å; W73-P92 HydrophobicContact CE3-CG 4Å; W73-P92 HydrophobicContact CH2-CB 3.81Å; W73-P92 HydrophobicContact CZ3-CB 3.1Å; W73-P92 HydrophobicContact CZ3-CG 3.85Å; Y76-P92 HydrophobicContact CD2-CG 4Å; Y76-P92 HydrophobicContact CE2-CG 4.32Å; P92-L94 PolarHBondContact O-N 2.96Å; P92-L94 VanDerWaalsContact O-N 3.12Å; P92-K95 WeakPolarHBondContact O-CB 3.41Å; P92-K95 PolarHBondContact O-N 3.04Å
93	W	88.6	Confident	79.5	Confident	30 Å²	30	95.1 Å²	95.1	11%	0.114	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-70.3	-5.8	-178.1	62.7	87.2	0	0	0	114.5	W73 Y76 L80 P91 I337 P338 P339	W73-W93 HydrophobicContact CB-CE3 4.48Å; Y76-W93 HydrophobicContact CD1-CH2 4.01Å; Y76-W93 AromaticContact CD1-CZ3 3.96Å; Y76-W93 HydrophobicContact CD1-CZ3 3.96Å; Y76-W93 HydrophobicContact CE1-CH2 4.48Å; Y76-W93 HydrophobicContact CG-CZ3 4.09Å; L80-W93 HydrophobicContact CD1-CH2 4.22Å; L80-W93 HydrophobicContact CD2-CH2 3.58Å; L80-W93 HydrophobicContact CD2-CZ2 3.87Å; P91-W93 HydrophobicContact CB-CD2 3.87Å; P91-W93 HydrophobicContact CB-CE3 3.81Å; P91-W93 HydrophobicContact CB-CH2 3.55Å; P91-W93 HydrophobicContact CB-CZ2 3.57Å; P91-W93 HydrophobicContact CB-CZ3 3.65Å; P91-W93 HydrophobicContact CG-CD2 4.09Å; P91-W93 HydrophobicContact CG-CH2 4.11Å; P91-W93 HydrophobicContact CG-CZ2 3.58Å; P91-W93 PolarHBondContact O-N 2.98Å; W93-I337 PolarHBondContact NE1-O 3.5Å; W93-P338 HydrophobicContact CZ2-CB 4.4Å; W93-P339 HydrophobicContact CB-CG 4.11Å; W93-P339 HydrophobicContact CD2-CG 4.18Å; W93-P339 HydrophobicContact CG-CG 3.84Å
94	L	86.2	Confident	78.9	Confident	2 Å²	2	91.3 Å²	91.3	1%	0.01	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-104.9	-0.8	173.5	-70	173.4	0	0	0	112.7	L90 P91 P92 Q322 M324 Y336 P361 L362	L90-L94 HydrophobicContact CD1-CB 3.71Å; L90-L94 HydrophobicContact CD1-CD1 3.95Å; L90-L94 HydrophobicContact CD1-CG 4.5Å; L90-L94 HydrophobicContact CD2-CB 4.46Å; L90-L94 HydrophobicContact CG-CB 3.99Å; P91-L94 HydrophobicContact CG-CB 4.4Å; P91-L94 HydrophobicContact CG-CD1 3.66Å; P91-L94 HydrophobicContact CG-CG 4.13Å; P91-L94 PolarHBondContact O-N 3.05Å; P92-L94 PolarHBondContact O-N 2.96Å; P92-L94 VanDerWaalsContact O-N 3.12Å; L94-Q322 HydrophobicContact CD1-CG 3.79Å; L94-Q322 HydrophobicContact CD2-CB 3.93Å; L94-Q322 HydrophobicContact CD2-CG 3.92Å; L94-M324 HydrophobicContact CB-CE 4.27Å; L94-M324 HydrophobicContact CB-SD 4.47Å; L94-M324 HydrophobicContact CD1-SD 3.92Å; L94-M324 HydrophobicContact CD2-SD 4Å; L94-M324 HydrophobicContact CG-SD 4.37Å; L94-Y336 HydrophobicContact CD1-CD1 3.3Å; L94-Y336 HydrophobicContact CD1-CE1 3.69Å; L94-Y336 HydrophobicContact CD1-CG 4.1Å; L94-P361 HydrophobicContact CD2-CB 3.47Å; L94-P361 VanDerWaalsContact CD2-CB 3.47Å; L94-P361 HydrophobicContact CG-CB 4.41Å; L94-L362 HydrophobicContact CD2-CD2 4.17Å
95	K	84.8	Confident	78.8	Confident	138 Å²	138	84.9 Å²	84.9	60%	0.6	43%	0.426	S	S	*	.			trans	-78.7	130.5	175.2	-64.5	-179.8	-177.9	176.6	0	108.4	L90 P92	L90-K95 HydrophobicContact CD2-CG 4.24Å; P92-K95 WeakPolarHBondContact O-CB 3.41Å; P92-K95 PolarHBondContact O-N 3.04Å
96	T	78.5	Confident	78.9	Confident	62 Å²	62	88.7 Å²	88.7	38%	0.38	42%	0.418	S	S	.	.			trans	-116.4	153.8	173.7	54.3	0	0	0	0	110	P126 L362	T96-P126 HydrophobicContact CG2-CB 4.07Å; T96-P126 PolarHBondContact OG1-O 3.41Å; T96-L362 HydrophobicContact CG2-CD1 3.56Å; T96-L362 HydrophobicContact CG2-CD2 3.99Å; T96-L362 HydrophobicContact CG2-CG 4.44Å
97	E	75.3	Confident	78.6	Confident	177 Å²	177	86 Å²	86	83%	0.827	41%	0.407	S	S	*	.			trans	-70.9	152.4	173.4	-61.3	-165.2	154.6	0	0	111.1
98	I	73.1	Confident	78.7	Confident	137 Å²	137	81.6 Å²	81.6	70%	0.703	39%	0.391	S	S	*	.			trans	-72.3	129.3	176.5	-62.3	174.5	0	0	0	107.8	I100	I98-I100 HydrophobicContact CG2-CG1 4.47Å; I98-I100 PolarHBondContact O-N 3.38Å; I98-I100 VanDerWaalsContact O-N 3.08Å
99	P	67.2	Low	78.5	Confident	44 Å²	44	84.3 Å²	84.3	29%	0.286	41%	0.406	S	S	.	.			trans	-63.1	113.4	-179.2	25.6	-35.1	0	0	0	110.8	Y104 I128	P99-Y104 HydrophobicContact CB-CD2 4.29Å; P99-Y104 HydrophobicContact CB-CE2 4.35Å; P99-Y104 HydrophobicContact CB-CG 4.45Å; P99-I128 HydrophobicContact CB-CG2 4.24Å; P99-I128 HydrophobicContact CG-CG2 3.94Å
100	I	65.4	Low	78.1	Confident	157 Å²	157	76.4 Å²	76.4	81%	0.805	38%	0.381	S	S	*	.			trans	-130	128	176	-59.3	165.5	0	0	0	107.8	I98	I98-I100 HydrophobicContact CG2-CG1 4.47Å; I98-I100 PolarHBondContact O-N 3.38Å; I98-I100 VanDerWaalsContact O-N 3.08Å
101	G	69.4	Low	77.8	Confident	30 Å²	30	73.6 Å²	73.6	31%	0.309	37%	0.366	S	S	.	.	S	Bend	trans	162	157.1	174.7	0	0	0	0	0	115.7	N105	G101-N105 PolarHBondContact O-N 3.13Å; G101-N105 PolarHBondContact O-ND2 3.41Å
102	K	71.6	Confident	77.4	Confident	192 Å²	192	81 Å²	81	84%	0.835	39%	0.394	S	S	*	.	H	α-helix	trans	-63.4	-40.3	178.8	-68.4	-177.4	-179.8	177.9	0	112.4	N105 R106	K102-N105 PolarHBondContact O-N 3.47Å; K102-R106 WeakPolarHBondContact O-CB 3.24Å; K102-R106 PolarHBondContact O-N 3.39Å
103	N	69.2	Low	77.1	Confident	64 Å²	64	86.1 Å²	86.1	34%	0.342	42%	0.42	S	S	.	.	H	α-helix	trans	-65.3	-45	179.2	-80.2	-11.7	0	0	0	112.5	N105 R106 L107 G134	N103-N105 PolarHBondContact O-N 2.91Å; N103-R106 PolarHBondContact O-N 3.3Å; N103-L107 PolarHBondContact O-N 3.14Å; N103-G134 PolarHBondContact ND2-O 3.25Å
104	Y	74.8	Confident	76.5	Confident	30 Å²	30	88.3 Å²	88.3	12%	0.118	43%	0.433	C	S	.	.	H	α-helix	trans	-56.7	-49.8	174.2	171.6	-99.7	0	0	0	111.5	P99 R106 L107 K108 I128 W132	P99-Y104 HydrophobicContact CB-CD2 4.29Å; P99-Y104 HydrophobicContact CB-CE2 4.35Å; P99-Y104 HydrophobicContact CB-CG 4.45Å; Y104-R106 VanDerWaalsContact C-N 3.34Å; Y104-R106 PolarHBondContact O-N 3.14Å; Y104-L107 PolarHBondContact O-N 2.9Å; Y104-K108 HydrophobicContact CE1-CD 4.04Å; Y104-K108 VanDerWaalsContact O-CB 3.27Å; Y104-K108 WeakPolarHBondContact O-CB 3.36Å; Y104-K108 PolarHBondContact O-N 3.47Å; Y104-K108 PolarHBondContact OH-NZ 2.9Å; Y104-I128 HydrophobicContact CD2-CG1 4.42Å; Y104-I128 HydrophobicContact CE2-CD1 3.81Å; Y104-I128 HydrophobicContact CE2-CG1 3.89Å; Y104-I128 HydrophobicContact CE2-CG2 4.36Å; Y104-W132 HydrophobicContact CD2-CB 4.29Å; Y104-W132 HydrophobicContact CD2-CD2 4.3Å; Y104-W132 AromaticContact CD2-CE3 3.6Å; Y104-W132 HydrophobicContact CD2-CE3 3.6Å; Y104-W132 HydrophobicContact CD2-CZ3 4.3Å; Y104-W132 AromaticContact CE2-CE3 3.72Å; Y104-W132 HydrophobicContact CE2-CE3 3.72Å; Y104-W132 HydrophobicContact CE2-CZ3 4.01Å
105	N	78.2	Confident	76.3	Confident	83 Å²	83	93.9 Å²	93.9	44%	0.444	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-37.6	178.8	-73.7	-32.1	0	0	0	112.8	G101 K102 N103 N109	G101-N105 PolarHBondContact O-N 3.13Å; G101-N105 PolarHBondContact O-ND2 3.41Å; K102-N105 PolarHBondContact O-N 3.47Å; N103-N105 PolarHBondContact O-N 2.91Å; N105-N109 WeakPolarHBondContact O-CB 3.32Å; N105-N109 VanDerWaalsContact O-CG 3.22Å; N105-N109 PolarHBondContact O-N 3.15Å; N105-N109 PolarHBondContact O-ND2 3.1Å
106	R	76.8	Confident	76.2	Confident	153 Å²	153	87.9 Å²	87.9	58%	0.577	44%	0.437	S	S	*	.	H	α-helix	trans	-61.3	-54.2	175.3	-177.1	-177.6	67.5	136.9	0.2	111.1	K102 N103 Y104 K108 N109 T110	K102-R106 WeakPolarHBondContact O-CB 3.24Å; K102-R106 PolarHBondContact O-N 3.39Å; N103-R106 PolarHBondContact O-N 3.3Å; Y104-R106 VanDerWaalsContact C-N 3.34Å; Y104-R106 PolarHBondContact O-N 3.14Å; R106-K108 VanDerWaalsContact C-N 3.3Å; R106-K108 PolarHBondContact O-N 3.16Å; R106-N109 PolarHBondContact O-N 2.92Å; R106-T110 PolarHBondContact O-N 3.12Å; R106-T110 PolarHBondContact O-OG1 3.15Å; R106-T110 VanDerWaalsContact O-OG1 3.07Å
107	L	76	Confident	76.6	Confident	36 Å²	36	86.9 Å²	86.9	19%	0.188	43%	0.428	C	S	.	.	H	α-helix	trans	-59.2	-43.9	179.5	-96.7	66.1	0	0	0	111.1	N103 Y104 N109 T110 L111 W132	N103-L107 PolarHBondContact O-N 3.14Å; Y104-L107 PolarHBondContact O-N 2.9Å; L107-N109 PolarHBondContact O-N 2.94Å; L107-T110 PolarHBondContact O-N 2.98Å; L107-L111 WeakPolarHBondContact O-CB 3.18Å; L107-L111 VanDerWaalsContact O-CG 3.29Å; L107-L111 WeakPolarHBondContact O-CG 3.24Å; L107-L111 PolarHBondContact O-N 3.45Å; L107-W132 HydrophobicContact CB-CD2 4.29Å; L107-W132 HydrophobicContact CB-CE3 3.81Å; L107-W132 HydrophobicContact CB-CZ3 4.29Å; L107-W132 HydrophobicContact CD2-CB 3.89Å; L107-W132 HydrophobicContact CD2-CD2 4.15Å; L107-W132 HydrophobicContact CD2-CG 3.88Å
108	K	79.1	Confident	77.1	Confident	46 Å²	46	78.5 Å²	78.5	20%	0.2	39%	0.389	C	S	.	.	H	α-helix	trans	-57.2	-45.8	176.5	-174.1	173.7	-170.3	167.6	0	113.1	Y104 R106 R112 W132	Y104-K108 HydrophobicContact CE1-CD 4.04Å; Y104-K108 VanDerWaalsContact O-CB 3.27Å; Y104-K108 WeakPolarHBondContact O-CB 3.36Å; Y104-K108 PolarHBondContact O-N 3.47Å; Y104-K108 PolarHBondContact OH-NZ 2.9Å; R106-K108 VanDerWaalsContact C-N 3.3Å; R106-K108 PolarHBondContact O-N 3.16Å; K108-R112 VanDerWaalsContact CE-NH2 3.34Å; K108-R112 WeakPolarHBondContact O-CG 3.39Å; K108-R112 PolarHBondContact O-N 3.37Å; K108-W132 HydrophobicContact CB-CZ3 4.05Å
109	N	82.1	Confident	77.7	Confident	84 Å²	84	73.8 Å²	73.8	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-43.9	179	-69.9	-15.1	0	0	0	110.9	N105 R106 L107 L111 R112 D113	N105-N109 WeakPolarHBondContact O-CB 3.32Å; N105-N109 VanDerWaalsContact O-CG 3.22Å; N105-N109 PolarHBondContact O-N 3.15Å; N105-N109 PolarHBondContact O-ND2 3.1Å; R106-N109 PolarHBondContact O-N 2.92Å; L107-N109 PolarHBondContact O-N 2.94Å; N109-L111 VanDerWaalsContact C-N 3.34Å; N109-L111 PolarHBondContact O-N 3.24Å; N109-R112 PolarHBondContact O-N 3.48Å; N109-R112 VanDerWaalsContact O-N 3.16Å; N109-D113 PolarHBondContact O-N 3.35Å
110	T	78.3	Confident	78.4	Confident	43 Å²	43	72 Å²	72	26%	0.264	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-42.2	177.3	-59.1	0	0	0	0	112.5	R106 L107 R112 D113 L114 W184	R106-T110 PolarHBondContact O-N 3.12Å; R106-T110 PolarHBondContact O-OG1 3.15Å; R106-T110 VanDerWaalsContact O-OG1 3.07Å; L107-T110 PolarHBondContact O-N 2.98Å; T110-R112 VanDerWaalsContact C-N 3.34Å; T110-R112 PolarHBondContact O-N 2.9Å; T110-D113 PolarHBondContact O-N 3.46Å; T110-L114 HydrophobicContact CG2-CD1 3.77Å; T110-L114 WeakPolarHBondContact O-CB 3.34Å; T110-L114 WeakPolarHBondContact O-CD1 3.36Å; T110-L114 VanDerWaalsContact O-CG 3.24Å; T110-L114 WeakPolarHBondContact O-CG 3.34Å; T110-L114 PolarHBondContact O-N 3.01Å; T110-W184 HydrophobicContact CG2-CZ2 4.22Å
111	L	81.6	Confident	79.2	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-41.7	176.2	-72.9	163.7	0	0	0	111.9	L107 N109 L114 N115 L116 T118 W132 I144 W184	L107-L111 WeakPolarHBondContact O-CB 3.18Å; L107-L111 VanDerWaalsContact O-CG 3.29Å; L107-L111 WeakPolarHBondContact O-CG 3.24Å; L107-L111 PolarHBondContact O-N 3.45Å; N109-L111 VanDerWaalsContact C-N 3.34Å; N109-L111 PolarHBondContact O-N 3.24Å; L111-L114 PolarHBondContact O-N 3.46Å; L111-N115 PolarHBondContact O-N 3.09Å; L111-N115 VanDerWaalsContact O-N 3.17Å; L111-L116 HydrophobicContact CD2-CB 3.89Å; L111-L116 HydrophobicContact CD2-CD1 4.36Å; L111-L116 PolarHBondContact O-N 3.41Å; L111-T118 HydrophobicContact CD1-CG2 3.48Å; L111-T118 VanDerWaalsContact CD1-CG2 3.48Å; L111-T118 HydrophobicContact CD2-CG2 3.64Å; L111-T118 HydrophobicContact CG-CG2 4.16Å; L111-W132 HydrophobicContact CD1-CH2 3.15Å; L111-W132 HydrophobicContact CD1-CZ2 3.58Å; L111-W132 HydrophobicContact CD1-CZ3 3.79Å; L111-I144 HydrophobicContact CD2-CD1 3.92Å; L111-W184 HydrophobicContact CD2-CH2 3.53Å; L111-W184 HydrophobicContact CD2-CZ2 3.94Å; L111-W184 HydrophobicContact CG-CH2 4.47Å
112	R	81.6	Confident	79.9	Confident	157 Å²	157	67.4 Å²	67.4	59%	0.592	32%	0.322	S	S	*	.	H	α-helix	trans	-66	-44.8	176.9	-73.6	173.8	175.2	-166.7	-8.7	112.9	K108 N109 T110 L114 N115	K108-R112 VanDerWaalsContact CE-NH2 3.34Å; K108-R112 WeakPolarHBondContact O-CG 3.39Å; K108-R112 PolarHBondContact O-N 3.37Å; N109-R112 PolarHBondContact O-N 3.48Å; N109-R112 VanDerWaalsContact O-N 3.16Å; T110-R112 VanDerWaalsContact C-N 3.34Å; T110-R112 PolarHBondContact O-N 2.9Å; R112-L114 PolarHBondContact O-N 3.25Å; R112-N115 PolarHBondContact O-N 3.45Å
113	D	80.4	Confident	80.2	Confident	138 Å²	138	60 Å²	60	74%	0.738	30%	0.296	S	S	*	.	H	α-helix	trans	-62.9	-28.6	-179.6	-66	-20.4	0	0	0	111.8	N109 T110	N109-D113 PolarHBondContact O-N 3.35Å; T110-D113 PolarHBondContact O-N 3.46Å
114	L	77.1	Confident	80.7	Confident	76 Å²	76	64.8 Å²	64.8	40%	0.398	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	2.9	178.9	-63.4	169.8	0	0	0	113.4	T110 L111 R112 L116 A180 W184	T110-L114 HydrophobicContact CG2-CD1 3.77Å; T110-L114 WeakPolarHBondContact O-CB 3.34Å; T110-L114 WeakPolarHBondContact O-CD1 3.36Å; T110-L114 VanDerWaalsContact O-CG 3.24Å; T110-L114 WeakPolarHBondContact O-CG 3.34Å; T110-L114 PolarHBondContact O-N 3.01Å; L111-L114 PolarHBondContact O-N 3.46Å; R112-L114 PolarHBondContact O-N 3.25Å; L114-L116 HydrophobicContact CB-CD1 3.97Å; L114-L116 HydrophobicContact CB-CG 3.83Å; L114-L116 HydrophobicContact CD1-CD1 4.2Å; L114-L116 PolarHBondContact O-N 3.49Å; L114-A180 HydrophobicContact CD1-CB 3.51Å; L114-W184 HydrophobicContact CD1-CZ2 4.39Å
115	N	81	Confident	81.1	Confident	118 Å²	118	64.6 Å²	64.6	63%	0.631	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	38	-175.4	-162.9	47.3	0	0	0	113.1	L111 R112	L111-N115 PolarHBondContact O-N 3.09Å; L111-N115 VanDerWaalsContact O-N 3.17Å; R112-N115 PolarHBondContact O-N 3.45Å
116	L	84.3	Confident	81.2	Confident	13 Å²	13	62.3 Å²	62.3	7%	0.068	30%	0.302	C	S	.	.			trans	-97.3	136.4	179.1	-64.2	179.1	0	0	0	110.7	L111 L114 T177 A180 W184	L111-L116 HydrophobicContact CD2-CB 3.89Å; L111-L116 HydrophobicContact CD2-CD1 4.36Å; L111-L116 PolarHBondContact O-N 3.41Å; L114-L116 HydrophobicContact CB-CD1 3.97Å; L114-L116 HydrophobicContact CB-CG 3.83Å; L114-L116 HydrophobicContact CD1-CD1 4.2Å; L114-L116 PolarHBondContact O-N 3.49Å; L116-T177 HydrophobicContact CD2-CG2 4.35Å; L116-T177 WeakPolarHBondContact CD2-OG1 3.35Å; L116-A180 HydrophobicContact CD1-CB 3.76Å; L116-W184 HydrophobicContact CD1-CH2 4.1Å; L116-W184 HydrophobicContact CD1-CZ2 4.27Å
117	H	86.5	Confident	81.3	Confident	41 Å²	41	55.2 Å²	55.2	19%	0.19	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	149.7	174.5	-62.9	-82.2	0	0	0	111.1	E122 M145 D149	H117-E122 IonicContact ND1-OE1 4Å; H117-M145 HydrophobicContact CB-CB 4.37Å; H117-M145 HydrophobicContact CB-CE 4.4Å; H117-M145 PolarHBondContact O-N 3.26Å; H117-D149 IonicContact CE1-OD2 2.73Å
118	T	86.2	Confident	81.3	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.1	173.7	68.5	0	0	0	0	110.4	L111 C120 E121 E122 W132 T143 I144	L111-T118 HydrophobicContact CD1-CG2 3.48Å; L111-T118 VanDerWaalsContact CD1-CG2 3.48Å; L111-T118 HydrophobicContact CD2-CG2 3.64Å; L111-T118 HydrophobicContact CG-CG2 4.16Å; T118-C120 PolarHBondContact O-N 3.43Å; T118-E121 PolarHBondContact O-N 3.19Å; T118-E121 PolarHBondContact OG1-N 3.06Å; T118-E122 WeakPolarHBondContact O-CG 3.36Å; T118-E122 PolarHBondContact O-N 3.23Å; T118-W132 HydrophobicContact CG2-CH2 4.44Å; T118-W132 HydrophobicContact CG2-CZ2 3.98Å; T118-W132 WeakPolarHBondContact OG1-CZ2 3.43Å; T118-T143 WeakPolarHBondContact CA-O 3.37Å; T118-T143 WeakPolarHBondContact CB-O 3.37Å; T118-I144 HydrophobicContact CG2-CD1 3.85Å
119	V	84.5	Confident	81.1	Confident	37 Å²	37	53 Å²	53	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-26.4	172.5	73.7	0	0	0	0	110.9	E121 A123 T143 T192	V119-E121 VanDerWaalsContact C-N 3.32Å; V119-E121 PolarHBondContact O-N 2.66Å; V119-A123 HydrophobicContact CG2-CB 3.73Å; V119-A123 WeakPolarHBondContact O-CA 3.37Å; V119-A123 WeakPolarHBondContact O-CB 3.33Å; V119-A123 PolarHBondContact O-N 2.91Å; V119-T143 HydrophobicContact CB-CG2 4.37Å; V119-T143 HydrophobicContact CG1-CG2 3.32Å; V119-T192 HydrophobicContact CB-CG2 4.15Å; V119-T192 HydrophobicContact CG1-CG2 4.48Å
120	C	81.5	Confident	80.7	Confident	7 Å²	7	53.1 Å²	53.1	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-58.7	-44.1	177.5	-55.8	0	0	0	0	111.7	T118 C125 I128 W132	T118-C120 PolarHBondContact O-N 3.43Å; C120-C125 HydrophobicContact CB-CB 4.42Å; C120-C125 WeakPolarHBondContact O-CB 3.38Å; C120-C125 PolarHBondContact O-N 3.46Å; C120-I128 HydrophobicContact CB-CB 4.39Å; C120-I128 HydrophobicContact CB-CD1 3.74Å; C120-I128 HydrophobicContact CB-CG1 3.84Å; C120-W132 HydrophobicContact CB-CZ2 3.91Å
121	E	83.1	Confident	80.5	Confident	49 Å²	49	51.6 Å²	51.6	23%	0.229	26%	0.26	C	S	.	.	H	α-helix	trans	-80.3	-51	177.4	-69.6	-176	119.8	0	0	111.7	T118 V119 A123 R124 I128 W132	T118-E121 PolarHBondContact O-N 3.19Å; T118-E121 PolarHBondContact OG1-N 3.06Å; V119-E121 VanDerWaalsContact C-N 3.32Å; V119-E121 PolarHBondContact O-N 2.66Å; E121-A123 PolarHBondContact O-N 3.17Å; E121-R124 PolarHBondContact O-N 3.29Å; E121-R124 VanDerWaalsContact O-N 3.14Å; E121-I128 HydrophobicContact CG-CD1 3.74Å; E121-W132 HydrophobicContact CG-CH2 3.76Å; E121-W132 HydrophobicContact CG-CZ2 4.36Å
122	E	85.1	Confident	80.1	Confident	42 Å²	42	51.7 Å²	51.7	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-69.1	-34.9	-172.2	-62.1	-54.9	152.8	0	0	112.8	H117 T118 R124 M145 D149 S159	H117-E122 IonicContact ND1-OE1 4Å; T118-E122 WeakPolarHBondContact O-CG 3.36Å; T118-E122 PolarHBondContact O-N 3.23Å; E122-R124 VanDerWaalsContact C-N 3.33Å; E122-M145 HydrophobicContact CB-CE 3.4Å; E122-M145 HydrophobicContact CG-CE 3.31Å; E122-D149 HydrophobicContact CG-CB 4.1Å; E122-S159 PolarHBondContact O-OG 3.39Å
123	A	77.4	Confident	79	Confident	35 Å²	35	46 Å²	46	29%	0.289	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	4.1	176.4	0	0	0	0	0	113.7	V119 E121 C125 S159	V119-A123 HydrophobicContact CG2-CB 3.73Å; V119-A123 WeakPolarHBondContact O-CA 3.37Å; V119-A123 WeakPolarHBondContact O-CB 3.33Å; V119-A123 PolarHBondContact O-N 2.91Å; E121-A123 PolarHBondContact O-N 3.17Å; A123-C125 PolarHBondContact O-N 2.89Å; A123-S159 WeakPolarHBondContact CA-OG 3.23Å
124	R	79.5	Confident	77.8	Confident	166 Å²	166	40.2 Å²	40.2	63%	0.626	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	49.9	-180	-53	177.7	179.7	-155.3	-7	112.7	E121 E122	E121-R124 PolarHBondContact O-N 3.29Å; E121-R124 VanDerWaalsContact O-N 3.14Å; E122-R124 VanDerWaalsContact C-N 3.33Å
125	C	82.8	Confident	76.4	Confident	25 Å²	25	39 Å²	39	17%	0.169	23%	0.229	C	C	.	.			trans	-62.9	126.3	-174.3	-176.2	0	0	0	0	111.2	C120 A123 N127 I128	C120-C125 HydrophobicContact CB-CB 4.42Å; C120-C125 WeakPolarHBondContact O-CB 3.38Å; C120-C125 PolarHBondContact O-N 3.46Å; A123-C125 PolarHBondContact O-N 2.89Å; C125-N127 PolarHBondContact O-N 3.06Å; C125-N127 PolarHBondContact SG-N 3.22Å; C125-N127 VanDerWaalsContact SG-N 3.45Å; C125-I128 PolarHBondContact O-N 2.94Å
126	P	79.8	Confident	74.7	Confident	36 Å²	36	42.4 Å²	42.4	23%	0.234	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.1	178	28.3	-34.5	0	0	0	113	T96 L362	T96-P126 HydrophobicContact CG2-CB 4.07Å; T96-P126 PolarHBondContact OG1-O 3.41Å; P126-L362 HydrophobicContact CG-CD2 4.4Å
127	N	79.1	Confident	72.7	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	4.4	-176.1	-50.4	-16.7	0	0	0	112.8	C125 G129 E130 C131 L362 Y367	C125-N127 PolarHBondContact O-N 3.06Å; C125-N127 PolarHBondContact SG-N 3.22Å; C125-N127 VanDerWaalsContact SG-N 3.45Å; N127-G129 VanDerWaalsContact C-N 3.25Å; N127-G129 PolarHBondContact O-N 3.01Å; N127-E130 PolarHBondContact O-N 2.92Å; N127-E130 VanDerWaalsContact O-N 3.17Å; N127-C131 WeakPolarHBondContact O-CB 3.35Å; N127-C131 PolarHBondContact O-N 3.38Å; N127-C131 PolarHBondContact O-SG 3.23Å; N127-L362 PolarHBondContact ND2-O 3.41Å; N127-Y367 HydrophobicContact CB-CD2 4.4Å; N127-Y367 HydrophobicContact CB-CE2 4.33Å; N127-Y367 WeakPolarHBondContact ND2-CD2 3.3Å
128	I	77.4	Confident	71	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.072	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-36.9	-172.8	-168	170.9	0	0	0	112.8	P99 Y104 C120 E121 C125 W132	P99-I128 HydrophobicContact CB-CG2 4.24Å; P99-I128 HydrophobicContact CG-CG2 3.94Å; Y104-I128 HydrophobicContact CD2-CG1 4.42Å; Y104-I128 HydrophobicContact CE2-CD1 3.81Å; Y104-I128 HydrophobicContact CE2-CG1 3.89Å; Y104-I128 HydrophobicContact CE2-CG2 4.36Å; C120-I128 HydrophobicContact CB-CB 4.39Å; C120-I128 HydrophobicContact CB-CD1 3.74Å; C120-I128 HydrophobicContact CB-CG1 3.84Å; E121-I128 HydrophobicContact CG-CD1 3.74Å; C125-I128 PolarHBondContact O-N 2.94Å; I128-W132 HydrophobicContact CD1-CD2 4.26Å; I128-W132 HydrophobicContact CD1-CE3 4.31Å; I128-W132 HydrophobicContact CD1-CH2 3.98Å; I128-W132 HydrophobicContact CD1-CZ2 3.93Å; I128-W132 HydrophobicContact CD1-CZ3 4.17Å; I128-W132 HydrophobicContact CG1-CD2 3.82Å; I128-W132 HydrophobicContact CG1-CE3 4.23Å; I128-W132 HydrophobicContact CG1-CG 4.14Å; I128-W132 HydrophobicContact CG1-CZ2 4.21Å; I128-W132 VanDerWaalsContact O-CB 3.32Å; I128-W132 WeakPolarHBondContact O-CB 3.24Å; I128-W132 PolarHBondContact O-N 3.05Å
129	G	74.3	Confident	69.4	Low	20 Å²	20	54.3 Å²	54.3	21%	0.206	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-46.8	177.3	0	0	0	0	0	112.4	N127 G133	N127-G129 VanDerWaalsContact C-N 3.25Å; N127-G129 PolarHBondContact O-N 3.01Å; G129-G133 VanDerWaalsContact O-CA 3.22Å; G129-G133 WeakPolarHBondContact O-CA 3.44Å; G129-G133 PolarHBondContact O-N 2.78Å
130	E	73.9	Confident	68.3	Low	87 Å²	87	54.3 Å²	54.3	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-48.1	175.5	-170.4	-163.4	148.4	0	0	110.5	N127 Y367 K368	N127-E130 PolarHBondContact O-N 2.92Å; N127-E130 VanDerWaalsContact O-N 3.17Å; E130-Y367 PolarHBondContact OE1-OH 3.49Å; E130-Y367 PolarHBondContact OE2-OH 3.41Å; E130-K368 PolarHBondContact O-NZ 3.02Å
131	C	74.1	Confident	67.7	Low	12 Å²	12	54.5 Å²	54.5	8%	0.081	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-49.3	-177.2	-71.3	0	0	0	0	112.4	N127 K368	N127-C131 WeakPolarHBondContact O-CB 3.35Å; N127-C131 PolarHBondContact O-N 3.38Å; N127-C131 PolarHBondContact O-SG 3.23Å; C131-K368 WeakPolarHBondContact O-CE 3.42Å; C131-K368 PolarHBondContact O-NZ 2.8Å
132	W	72.9	Confident	67.4	Low	8 Å²	8	52.5 Å²	52.5	3%	0.03	30%	0.295	C	S	.	.	H	α-helix	trans	-88.5	-17.5	-174.6	-65.6	12.5	0	0	0	113.7	Y104 L107 K108 L111 T118 C120 E121 I128 G134	Y104-W132 HydrophobicContact CD2-CB 4.29Å; Y104-W132 HydrophobicContact CD2-CD2 4.3Å; Y104-W132 AromaticContact CD2-CE3 3.6Å; Y104-W132 HydrophobicContact CD2-CE3 3.6Å; Y104-W132 HydrophobicContact CD2-CZ3 4.3Å; Y104-W132 AromaticContact CE2-CE3 3.72Å; Y104-W132 HydrophobicContact CE2-CE3 3.72Å; Y104-W132 HydrophobicContact CE2-CZ3 4.01Å; L107-W132 HydrophobicContact CB-CD2 4.29Å; L107-W132 HydrophobicContact CB-CE3 3.81Å; L107-W132 HydrophobicContact CB-CZ3 4.29Å; L107-W132 HydrophobicContact CD2-CB 3.89Å; L107-W132 HydrophobicContact CD2-CD2 4.15Å; L107-W132 HydrophobicContact CD2-CG 3.88Å; K108-W132 HydrophobicContact CB-CZ3 4.05Å; L111-W132 HydrophobicContact CD1-CH2 3.15Å; L111-W132 HydrophobicContact CD1-CZ2 3.58Å; L111-W132 HydrophobicContact CD1-CZ3 3.79Å; T118-W132 HydrophobicContact CG2-CH2 4.44Å; T118-W132 HydrophobicContact CG2-CZ2 3.98Å; T118-W132 WeakPolarHBondContact OG1-CZ2 3.43Å; C120-W132 HydrophobicContact CB-CZ2 3.91Å; E121-W132 HydrophobicContact CG-CH2 3.76Å; E121-W132 HydrophobicContact CG-CZ2 4.36Å; I128-W132 HydrophobicContact CD1-CD2 4.26Å; I128-W132 HydrophobicContact CD1-CE3 4.31Å; I128-W132 HydrophobicContact CD1-CH2 3.98Å; I128-W132 HydrophobicContact CD1-CZ2 3.93Å; I128-W132 HydrophobicContact CD1-CZ3 4.17Å; I128-W132 HydrophobicContact CG1-CD2 3.82Å; I128-W132 HydrophobicContact CG1-CE3 4.23Å; I128-W132 HydrophobicContact CG1-CG 4.14Å; I128-W132 HydrophobicContact CG1-CZ2 4.21Å; I128-W132 VanDerWaalsContact O-CB 3.32Å; I128-W132 WeakPolarHBondContact O-CB 3.24Å; I128-W132 PolarHBondContact O-N 3.05Å; W132-G134 VanDerWaalsContact C-N 3.34Å; W132-G134 PolarHBondContact O-N 2.83Å
133	G	58.8	Low	67.6	Low	38 Å²	38	50.8 Å²	50.8	39%	0.392	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	6.3	-175.9	0	0	0	0	0	115.3	G129 G135	G129-G133 VanDerWaalsContact O-CA 3.22Å; G129-G133 WeakPolarHBondContact O-CA 3.44Å; G129-G133 PolarHBondContact O-N 2.78Å; G133-G135 PolarHBondContact O-N 2.99Å
134	G	53.7	Low	68.2	Low	15 Å²	15	49.1 Å²	49.1	16%	0.155	27%	0.274	C	S	.	.			trans	-44.4	127.9	-175.2	0	0	0	0	0	113.5	N103 W132	N103-G134 PolarHBondContact ND2-O 3.25Å; W132-G134 VanDerWaalsContact C-N 3.34Å; W132-G134 PolarHBondContact O-N 2.83Å
135	G	49.5	Very low	68.9	Low	52 Å²	52	41.5 Å²	41.5	54%	0.536	25%	0.245	S	C	.	.			trans	-71.6	-177.2	173.2	0	0	0	0	0	112.7	G133 Y137 A138	G133-G135 PolarHBondContact O-N 2.99Å; G135-Y137 PolarHBondContact O-N 3.19Å; G135-A138 PolarHBondContact O-N 3.45Å
136	E	43.3	Very low	69.6	Low	189 Å²	189	40.3 Å²	40.3	88%	0.883	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-17.5	-175.1	-82.3	178.1	154	0	0	115.5
137	Y	43.1	Very low	70.3	Confident	221 Å²	221	38.8 Å²	38.8	87%	0.867	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.4	2.6	-178.9	-57.5	-76.1	0	0	0	114.4	G135	G135-Y137 PolarHBondContact O-N 3.19Å
138	A	50.2	Low	71	Confident	40 Å²	40	39.6 Å²	39.6	33%	0.331	24%	0.236	S	C	.	.	S	Bend	trans	-95.8	128.6	-179.2	0	0	0	0	0	110.6	G135 A140	G135-A138 PolarHBondContact O-N 3.45Å; A138-A140 PolarHBondContact O-N 3.18Å
139	T	53	Low	71.7	Confident	43 Å²	43	40.2 Å²	40.2	26%	0.264	24%	0.24	S	C	.	.			trans	-61.5	110.5	168.7	-55.8	0	0	0	0	107.5	T141 D187 K375	T139-T141 PolarHBondContact O-N 3.46Å; T139-D187 HydrophobicContact CG2-CB 4.17Å; T139-K375 PolarHBondContact OG1-NZ 3.24Å
140	A	61.9	Low	72.8	Confident	38 Å²	38	40.2 Å²	40.2	31%	0.314	24%	0.236	S	C	.	.			trans	-67.4	128.7	170.4	0	0	0	0	0	107.5	A138 L186	A138-A140 PolarHBondContact O-N 3.18Å; A140-L186 HydrophobicContact CB-CD2 3.84Å; A140-L186 WeakPolarHBondContact O-CD2 3.11Å
141	T	68.6	Low	73.9	Confident	11 Å²	11	36.6 Å²	36.6	7%	0.067	22%	0.22	C	C	.	.			trans	-121.6	136.1	170.9	-45.4	0	0	0	0	109	T139 Y188 E371	T139-T141 PolarHBondContact O-N 3.46Å; T141-Y188 HydrophobicContact CG2-CD1 4.14Å; T141-E371 WeakPolarHBondContact CB-OE2 3.41Å; T141-E371 WeakPolarHBondContact CG2-OE1 3.48Å; T141-E371 WeakPolarHBondContact CG2-OE2 3.23Å; T141-E371 PolarHBondContact OG1-OE2 2.79Å
142	A	76.9	Confident	75	Confident	7 Å²	7	36.8 Å²	36.8	6%	0.058	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.5	171	0	0	0	0	0	109.2	I144 W184 L186 V189 V190	A142-I144 HydrophobicContact CB-CD1 3.97Å; A142-I144 HydrophobicContact CB-CG1 4.45Å; A142-W184 HydrophobicContact CB-CE3 4.43Å; A142-W184 HydrophobicContact CB-CZ3 4Å; A142-L186 HydrophobicContact CB-CD1 3.9Å; A142-V189 WeakPolarHBondContact O-CG2 3.49Å; A142-V190 PolarHBondContact O-N 2.87Å; A142-V190 VanDerWaalsContact O-N 3.13Å
143	T	88.8	Confident	76.2	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.1	166.2	-50.9	0	0	0	0	108.7	T118 V119 V190 T192 S366	T118-T143 WeakPolarHBondContact CA-O 3.37Å; T118-T143 WeakPolarHBondContact CB-O 3.37Å; V119-T143 HydrophobicContact CB-CG2 4.37Å; V119-T143 HydrophobicContact CG1-CG2 3.32Å; T143-V190 CarbonylContact C-O 3.59Å; T143-V190 VanDerWaalsContact CA-O 3.25Å; T143-V190 WeakPolarHBondContact CA-O 3.42Å; T143-V190 HydrophobicContact CG2-CB 3.82Å; T143-V190 HydrophobicContact CG2-CG1 3.74Å; T143-T192 HydrophobicContact CG2-CG2 4Å; T143-S366 WeakPolarHBondContact OG1-CB 3.45Å; T143-S366 PolarHBondContact OG1-OG 2.86Å
144	I	91.4	Very high	78	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.7	-178.2	-54.5	-51.8	0	0	0	109	L111 T118 A142 L146 T177 I181 W184 V189 V190 L191 T192	L111-I144 HydrophobicContact CD2-CD1 3.92Å; T118-I144 HydrophobicContact CG2-CD1 3.85Å; A142-I144 HydrophobicContact CB-CD1 3.97Å; A142-I144 HydrophobicContact CB-CG1 4.45Å; I144-L146 HydrophobicContact CG2-CD2 4.24Å; I144-T177 HydrophobicContact CG2-CG2 3.88Å; I144-I181 HydrophobicContact CG1-CD1 4.07Å; I144-I181 HydrophobicContact CG1-CG1 4.27Å; I144-W184 HydrophobicContact CD1-CH2 3.76Å; I144-W184 HydrophobicContact CD1-CZ3 3.74Å; I144-W184 HydrophobicContact CG1-CH2 4.48Å; I144-W184 HydrophobicContact CG1-CZ3 4.18Å; I144-V189 HydrophobicContact CG1-CG2 4.36Å; I144-V190 PolarHBondContact N-O 3.49Å; I144-L191 HydrophobicContact CB-CD2 3.99Å; I144-T192 PolarHBondContact O-N 2.78Å
145	M	94.4	Very high	80.1	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112.2	177.2	-176.1	159.4	49.5	0	0	108.8	H117 E122 V160 T192 V194	H117-M145 HydrophobicContact CB-CB 4.37Å; H117-M145 HydrophobicContact CB-CE 4.4Å; H117-M145 PolarHBondContact O-N 3.26Å; E122-M145 HydrophobicContact CB-CE 3.4Å; E122-M145 HydrophobicContact CG-CE 3.31Å; M145-V160 HydrophobicContact SD-CG2 4.38Å; M145-T192 CarbonylContact C-O 3.59Å; M145-T192 WeakPolarHBondContact CA-O 3.24Å; M145-T192 HydrophobicContact CB-CG2 3.95Å; M145-T192 HydrophobicContact CG-CG2 4.16Å; M145-V194 HydrophobicContact CG-CG1 4.48Å; M145-V194 HydrophobicContact SD-CG1 4Å
146	L	96.1	Very high	82.4	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	161.6	177.7	-52.9	177.7	0	0	0	110.5	I144 G148 E173 T177 L191 T192 S193 F207 T210	I144-L146 HydrophobicContact CG2-CD2 4.24Å; L146-G148 VanDerWaalsContact C-N 3.28Å; L146-G148 PolarHBondContact O-N 2.84Å; L146-E173 WeakPolarHBondContact CA-OE1 3.12Å; L146-T177 HydrophobicContact CD2-CG2 3.88Å; L146-L191 HydrophobicContact CD1-CB 4.44Å; L146-T192 PolarHBondContact N-O 3.43Å; L146-S193 WeakPolarHBondContact O-CA 3.21Å; L146-S193 WeakPolarHBondContact O-CB 3.41Å; L146-F207 HydrophobicContact CD1-CD1 4.16Å; L146-F207 HydrophobicContact CD1-CD2 4.1Å; L146-F207 HydrophobicContact CD1-CE1 4.33Å; L146-F207 HydrophobicContact CD1-CE2 4.31Å; L146-F207 HydrophobicContact CD1-CG 4.04Å; L146-F207 HydrophobicContact CD1-CZ 4.43Å; L146-T210 HydrophobicContact CD1-CG2 4.08Å; L146-T210 HydrophobicContact CD2-CG2 3.98Å
147	M	95.7	Very high	85	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.025	18%	0.179	C	C	.	.	S	Bend	trans	69.2	26.1	171.8	-51.4	-166.1	-85.1	0	0	113.7	L169 E173 S193 V194 R196 G203 H206 F207	M147-L169 HydrophobicContact CB-CD2 3.44Å; M147-L169 VanDerWaalsContact CB-CD2 3.44Å; M147-L169 HydrophobicContact CG-CD2 3.44Å; M147-L169 VanDerWaalsContact CG-CD2 3.44Å; M147-L169 HydrophobicContact SD-CD1 4.19Å; M147-L169 HydrophobicContact SD-CD2 3.85Å; M147-E173 WeakPolarHBondContact CA-OE2 3.4Å; M147-E173 VanDerWaalsContact N-CD 3.33Å; M147-E173 PolarHBondContact N-OE1 2.99Å; M147-E173 PolarHBondContact N-OE2 3.17Å; M147-S193 WeakPolarHBondContact CE-OG 3.36Å; M147-V194 HydrophobicContact CB-CG2 4.19Å; M147-V194 WeakPolarHBondContact O-CG2 3.17Å; M147-R196 HydrophobicContact CB-CG 4.05Å; M147-R196 HydrophobicContact CE-CG 4.21Å; M147-R196 HydrophobicContact SD-CG 3.8Å; M147-G203 VanDerWaalsContact SD-CA 3.54Å; M147-H206 HydrophobicContact SD-CB 4.25Å; M147-F207 HydrophobicContact CE-CD2 4.42Å
148	G	92.8	Very high	87.5	Confident	21 Å²	21	23.9 Å²	23.9	22%	0.216	15%	0.152	C	C	.	.			trans	84.1	-161.8	177	0	0	0	0	0	114.9	L146	L146-G148 VanDerWaalsContact C-N 3.28Å; L146-G148 PolarHBondContact O-N 2.84Å
149	D	93.3	Very high	89.6	Confident	27 Å²	27	23.1 Å²	23.1	14%	0.144	14%	0.144	C	C	.	.	S	Bend	trans	-113.6	7.8	-173.8	68.9	-3	0	0	0	113.9	H117 E122 V160 K161	H117-D149 IonicContact CE1-OD2 2.73Å; E122-D149 HydrophobicContact CG-CB 4.1Å; D149-V160 WeakPolarHBondContact O-CG1 3.45Å; D149-K161 WeakPolarHBondContact O-CB 3.5Å; D149-K161 PolarHBondContact O-N 2.88Å; D149-K161 IonicContact OD2-NZ 3.24Å; D149-K161 PolarHBondContact OD2-NZ 3.03Å
150	T	95.9	Very high	91.5	Very high	20 Å²	20	21.9 Å²	21.9	12%	0.123	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	115	-170.1	-60.5	0	0	0	0	110.8	K161 A163 P166	T150-K161 CarbonylContact C-O 3.59Å; T150-K161 WeakPolarHBondContact CA-O 3.35Å; T150-K161 HydrophobicContact CG2-CB 4.36Å; T150-A163 HydrophobicContact CG2-CB 3.43Å; T150-A163 VanDerWaalsContact CG2-CB 3.43Å; T150-P166 HydrophobicContact CG2-CB 4.1Å
151	C	97.6	Very high	93.1	Very high	11 Å²	11	25.5 Å²	25.5	7%	0.074	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	146.8	-172.8	-171.7	0	0	0	0	112.8	R153 V160 K161 T162 A163 V194 D195	C151-R153 PolarHBondContact O-N 3.31Å; C151-R153 PolarHBondContact SG-N 2.92Å; C151-V160 HydrophobicContact CB-CG1 4.04Å; C151-K161 PolarHBondContact N-O 2.61Å; C151-T162 VanDerWaalsContact O-CA 3.23Å; C151-T162 WeakPolarHBondContact O-CA 3.47Å; C151-A163 PolarHBondContact O-N 3.3Å; C151-V194 HydrophobicContact CB-CB 3.86Å; C151-V194 HydrophobicContact CB-CG1 4.14Å; C151-D195 VanDerWaalsContact SG-CB 3.59Å; C151-D195 PolarHBondContact SG-N 3.32Å
152	T	98.3	Very high	94.4	Very high	15 Å²	15	29.3 Å²	29.3	9%	0.092	17%	0.168	C	C	.	.	S	Bend	trans	-77.8	-5.5	171.4	60.6	0	0	0	0	113.5	A163 P166 D195 D197 D198 R266	T152-A163 WeakPolarHBondContact CA-O 3.39Å; T152-P166 HydrophobicContact CG2-CG 3.99Å; T152-D195 PolarHBondContact N-O 3.14Å; T152-D195 PolarHBondContact OG1-O 3.13Å; T152-D195 VanDerWaalsContact OG1-O 3.07Å; T152-D197 WeakPolarHBondContact OG1-CB 3.44Å; T152-D197 VanDerWaalsContact OG1-CG 3.26Å; T152-D197 PolarHBondContact OG1-N 2.89Å; T152-D197 PolarHBondContact OG1-OD2 3.17Å; T152-D198 HydrophobicContact CG2-CB 4.29Å; T152-D198 WeakPolarHBondContact CG2-OD1 3.33Å; T152-R266 PolarHBondContact O-NH1 3.48Å; T152-R266 VanDerWaalsContact O-NH1 3.13Å; T152-R266 PolarHBondContact O-NH2 3.42Å
153	R	97.9	Very high	95.3	Very high	8 Å²	8	30.7 Å²	30.7	3%	0.03	18%	0.18	C	C	.	.			trans	-118.1	148	-176.5	-62.4	-162.2	-170.3	173.7	8.1	113.4	C151 T162 D195 D197 D229 D264	C151-R153 PolarHBondContact O-N 3.31Å; C151-R153 PolarHBondContact SG-N 2.92Å; R153-T162 WeakPolarHBondContact O-CG2 3.27Å; R153-D195 HydrophobicContact CB-CB 4.19Å; R153-D195 VanDerWaalsContact CD-CG 3.42Å; R153-D195 WeakPolarHBondContact CD-OD2 3.49Å; R153-D195 HydrophobicContact CG-CB 3.65Å; R153-D195 IonicContact CZ-OD1 2.66Å; R153-D195 IonicContact NE-OD1 3.43Å; R153-D195 IonicContact NH1-OD1 2.78Å; R153-D195 IonicContact NH2-OD1 3.54Å; R153-D197 VanDerWaalsContact CG-OD2 3.24Å; R153-D197 WeakPolarHBondContact CG-OD2 3.35Å; R153-D197 IonicContact CZ-OD1 2.65Å; R153-D197 IonicContact NE-OD1 3.25Å; R153-D197 PolarHBondContact NE-OD1 3.36Å; R153-D197 IonicContact NE-OD2 2.75Å; R153-D197 PolarHBondContact NE-OD2 2.79Å; R153-D197 IonicContact NH2-OD1 3.66Å; R153-D197 PolarHBondContact NH2-OD1 3.36Å; R153-D229 IonicContact CZ-OD1 3.24Å; R153-D229 VanDerWaalsContact CZ-OD1 3.22Å; R153-D229 IonicContact CZ-OD2 2.94Å; R153-D229 IonicContact NH1-OD1 3.51Å; R153-D229 PolarHBondContact NH1-OD1 2.77Å; R153-D229 IonicContact NH1-OD2 3.63Å; R153-D229 PolarHBondContact NH1-OD2 2.99Å; R153-D229 IonicContact NH2-OD1 3.94Å; R153-D229 PolarHBondContact NH2-OD1 2.98Å; R153-D264 WeakPolarHBondContact CA-OD2 2.87Å; R153-D264 HydrophobicContact CB-CB 3.87Å; R153-D264 HydrophobicContact CG-CB 4.34Å
154	G	96.5	Very high	95.6	Very high	38 Å²	38	41.3 Å²	41.3	39%	0.392	22%	0.219	S	C	.	.			trans	-114.1	57.6	-175	0	0	0	0	0	113.5	R156 D264	G154-R156 PolarHBondContact O-N 2.78Å; G154-D264 PolarHBondContact N-OD2 2.84Å
155	C	98	Very high	95.7	Very high	24 Å²	24	49.1 Å²	49.1	16%	0.162	26%	0.256	C	S	.	.			trans	-58.8	128.2	173.7	-69.4	0	0	0	0	110.7	F157 C158 D264	C155-F157 HydrophobicContact CB-CD1 3.88Å; C155-F157 HydrophobicContact CB-CE1 3.58Å; C155-F157 HydrophobicContact CB-CZ 4.23Å; C155-F157 PolarHBondContact O-N 2.87Å; C155-C158 HydrophobicContact CB-CB 3.87Å; C155-C158 PolarHBondContact O-N 3.45Å; C155-C158 VanDerWaalsContact O-N 3.1Å; C155-D264 PolarHBondContact SG-N 2.86Å; C155-D264 VanDerWaalsContact SG-N 3.36Å
156	R	97.5	Very high	95.8	Very high	111 Å²	111	49.5 Å²	49.5	42%	0.419	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.4	-168.3	-63	176.7	62.3	-152.4	8.4	114	G154 Y261 V262 H330 L331	G154-R156 PolarHBondContact O-N 2.78Å; R156-Y261 VanDerWaalsContact CD-O 3.29Å; R156-Y261 WeakPolarHBondContact CD-O 3.3Å; R156-Y261 PolarHBondContact NH1-O 2.85Å; R156-V262 PolarHBondContact N-O 2.73Å; R156-H330 WeakPolarHBondContact O-CA 3.49Å; R156-H330 WeakPolarHBondContact O-CB 3.18Å; R156-L331 HydrophobicContact CB-CD1 3.89Å; R156-L331 HydrophobicContact CB-CD2 4Å; R156-L331 HydrophobicContact CB-CG 3.65Å; R156-L331 VanDerWaalsContact CZ-CD2 3.41Å; R156-L331 PolarHBondContact O-N 3.43Å
157	F	96.5	Very high	95.7	Very high	29 Å²	29	53.8 Å²	53.8	13%	0.127	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-21.3	172.5	73.9	-92.5	0	0	0	113.3	C155 E253 V262 R263 M293 Y323 P326	C155-F157 HydrophobicContact CB-CD1 3.88Å; C155-F157 HydrophobicContact CB-CE1 3.58Å; C155-F157 HydrophobicContact CB-CZ 4.23Å; C155-F157 PolarHBondContact O-N 2.87Å; F157-E253 HydrophobicContact CE1-CB 4.41Å; F157-E253 HydrophobicContact CE1-CG 4.1Å; F157-E253 HydrophobicContact CZ-CB 4.46Å; F157-E253 HydrophobicContact CZ-CG 3.84Å; F157-V262 HydrophobicContact CB-CG1 4.41Å; F157-V262 HydrophobicContact CD1-CG1 3.65Å; F157-V262 HydrophobicContact CE1-CG1 4.34Å; F157-V262 HydrophobicContact CG-CG1 4.37Å; F157-R263 HydrophobicContact CE1-CG 4.13Å; F157-M293 HydrophobicContact CB-CE 4.18Å; F157-M293 HydrophobicContact CD1-CE 3.89Å; F157-M293 HydrophobicContact CD2-CE 3.38Å; F157-M293 HydrophobicContact CD2-SD 3.79Å; F157-M293 HydrophobicContact CE1-CE 4.05Å; F157-M293 HydrophobicContact CE2-CE 3.56Å; F157-M293 HydrophobicContact CE2-SD 4.2Å; F157-M293 HydrophobicContact CG-CE 3.55Å; F157-M293 HydrophobicContact CG-SD 4.3Å; F157-M293 HydrophobicContact CZ-CE 3.89Å; F157-Y323 HydrophobicContact CB-CD2 4.2Å; F157-Y323 HydrophobicContact CB-CE2 3.62Å; F157-P326 WeakPolarHBondContact O-CG 3.11Å
158	C	95.8	Very high	95.6	Very high	42 Å²	42	59.1 Å²	59.1	28%	0.284	32%	0.322	S	S	.	.			trans	-92.1	138.8	-167.4	-173.3	0	0	0	0	111.3	C155 V160 H330	C155-C158 HydrophobicContact CB-CB 3.87Å; C155-C158 PolarHBondContact O-N 3.45Å; C155-C158 VanDerWaalsContact O-N 3.1Å; C158-V160 VanDerWaalsContact SG-CG2 3.59Å; C158-H330 PolarHBondContact O-CD2 3.17Å; C158-H330 PolarHBondContact O-NE2 3.04Å
159	S	93.9	Very high	95.7	Very high	24 Å²	24	60.1 Å²	60.1	17%	0.168	32%	0.322	C	S	.	.			trans	-100.8	-0.6	-178	59.8	0	0	0	0	115.7	E122 A123	E122-S159 PolarHBondContact O-OG 3.39Å; A123-S159 WeakPolarHBondContact CA-OG 3.23Å
160	V	94.3	Very high	95.7	Very high	17 Å²	17	62.3 Å²	62.3	10%	0.103	33%	0.333	C	S	.	.	S	Bend	trans	-57.8	143.9	172	176.3	0	0	0	0	109.6	M145 D149 C151 C158 V194	M145-V160 HydrophobicContact SD-CG2 4.38Å; D149-V160 WeakPolarHBondContact O-CG1 3.45Å; C151-V160 HydrophobicContact CB-CG1 4.04Å; C158-V160 VanDerWaalsContact SG-CG2 3.59Å; V160-V194 HydrophobicContact CG1-CG1 3.69Å
161	K	94.8	Very high	95.7	Very high	114 Å²	114	66.7 Å²	66.7	50%	0.496	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	155.8	-179	-61.4	169.4	-169.4	160.5	0	109.7	D149 T150 C151	D149-K161 WeakPolarHBondContact O-CB 3.5Å; D149-K161 PolarHBondContact O-N 2.88Å; D149-K161 IonicContact OD2-NZ 3.24Å; D149-K161 PolarHBondContact OD2-NZ 3.03Å; T150-K161 CarbonylContact C-O 3.59Å; T150-K161 WeakPolarHBondContact CA-O 3.35Å; T150-K161 HydrophobicContact CG2-CB 4.36Å; C151-K161 PolarHBondContact N-O 2.61Å
162	T	96.4	Very high	95.5	Very high	91 Å²	91	71 Å²	71	56%	0.558	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.6	179.3	59.8	0	0	0	0	111.3	C151 R153	C151-T162 VanDerWaalsContact O-CA 3.23Å; C151-T162 WeakPolarHBondContact O-CA 3.47Å; R153-T162 WeakPolarHBondContact O-CG2 3.27Å
163	A	96.7	Very high	95.4	Very high	37 Å²	37	71.1 Å²	71.1	31%	0.306	38%	0.384	S	S	.	.			trans	-149.6	144.6	172.2	0	0	0	0	0	109.4	T150 C151 T152 Q165	T150-A163 HydrophobicContact CG2-CB 3.43Å; T150-A163 VanDerWaalsContact CG2-CB 3.43Å; C151-A163 PolarHBondContact O-N 3.3Å; T152-A163 WeakPolarHBondContact CA-O 3.39Å; A163-Q165 PolarHBondContact O-N 3.2Å
164	R	93.4	Very high	95.3	Very high	227 Å²	227	71.1 Å²	71.1	86%	0.857	39%	0.385	S	S	*	.	S	Bend	trans	-66.5	-31.4	175.2	-174.2	174.9	178.9	166.4	-0	112.2
165	Q	94.1	Very high	95.3	Very high	165 Å²	165	75.2 Å²	75.2	77%	0.771	39%	0.39	S	S	*	.	S	Bend	trans	-130.6	87.1	178.2	-67.3	177.8	11.3	0	0	107.3	A163	A163-Q165 PolarHBondContact O-N 3.2Å
166	P	95.7	Very high	95	Very high	14 Å²	14	77.3 Å²	77.3	9%	0.091	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-66.1	167.2	172.1	29.1	-34.4	0	0	0	110.9	T150 T152	T150-P166 HydrophobicContact CG2-CB 4.1Å; T152-P166 HydrophobicContact CG2-CG 3.99Å
167	P	94.2	Very high	94.8	Very high	89 Å²	89	72 Å²	72	58%	0.578	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-53.4	152.5	172.5	-26.2	35.8	0	0	0	112.8	R196	P167-R196 PolarHBondContact O-NH1 3.05Å; P167-R196 PolarHBondContact O-NH2 3.16Å
168	P	94.4	Very high	94.7	Very high	118 Å²	118	70.6 Å²	70.6	77%	0.766	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-59.2	150.4	174.8	27.4	-34.6	0	0	0	110.5
169	L	94.4	Very high	94.5	Very high	42 Å²	42	74.2 Å²	74.2	22%	0.22	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-61.2	138.9	172.1	-67.5	179.4	0	0	0	110.1	M147 P171 I199 H206	M147-L169 HydrophobicContact CB-CD2 3.44Å; M147-L169 VanDerWaalsContact CB-CD2 3.44Å; M147-L169 HydrophobicContact CG-CD2 3.44Å; M147-L169 VanDerWaalsContact CG-CD2 3.44Å; M147-L169 HydrophobicContact SD-CD1 4.19Å; M147-L169 HydrophobicContact SD-CD2 3.85Å; L169-P171 VanDerWaalsContact O-CD 3.29Å; L169-P171 WeakPolarHBondContact O-CD 3.36Å; L169-I199 HydrophobicContact CD1-CD1 3.34Å; L169-I199 HydrophobicContact CD2-CD1 4.41Å; L169-I199 HydrophobicContact CG-CD1 3.55Å; L169-H206 HydrophobicContact CD1-CB 4.18Å
170	D	94.3	Very high	94.2	Very high	72 Å²	72	73.4 Å²	73.4	39%	0.385	38%	0.379	S	S	.	.			trans	-74.9	114.8	166.4	175.3	5.9	0	0	0	108.6	D172 E173 H206	D170-D172 PolarHBondContact O-N 3Å; D170-D172 VanDerWaalsContact O-N 3.16Å; D170-D172 PolarHBondContact OD1-N 3.32Å; D170-E173 HydrophobicContact CB-CB 3.98Å; D170-E173 WeakPolarHBondContact O-CB 3.26Å; D170-E173 PolarHBondContact O-N 2.78Å; D170-H206 PolarHBondContact O-CE1 2.88Å; D170-H206 VanDerWaalsContact O-CE1 3.26Å
171	P	94.7	Very high	93.9	Very high	112 Å²	112	72.6 Å²	72.6	73%	0.727	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.2	179.3	-22.4	34.5	0	0	0	113.9	L169 P174	L169-P171 VanDerWaalsContact O-CD 3.29Å; L169-P171 WeakPolarHBondContact O-CD 3.36Å; P171-P174 WeakPolarHBondContact O-CD 3.41Å
172	D	94.5	Very high	93.6	Very high	102 Å²	102	68.6 Å²	68.6	55%	0.545	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-9.6	-178.2	-65.8	-38.5	0	0	0	113	D170 P174 Y175 N176	D170-D172 PolarHBondContact O-N 3Å; D170-D172 VanDerWaalsContact O-N 3.16Å; D170-D172 PolarHBondContact OD1-N 3.32Å; D172-P174 VanDerWaalsContact C-CD 3.45Å; D172-Y175 PolarHBondContact O-N 3.29Å; D172-Y175 VanDerWaalsContact O-N 3.16Å; D172-N176 WeakPolarHBondContact O-CB 3.49Å; D172-N176 PolarHBondContact O-N 2.93Å; D172-N176 PolarHBondContact O-ND2 3.16Å
173	E	95.7	Very high	93	Very high	18 Å²	18	68.3 Å²	68.3	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-51.8	-44	178.5	172.5	179.2	-147.7	0	0	112.7	L146 M147 D170 Y175 N176 T177 H206	L146-E173 WeakPolarHBondContact CA-OE1 3.12Å; M147-E173 WeakPolarHBondContact CA-OE2 3.4Å; M147-E173 VanDerWaalsContact N-CD 3.33Å; M147-E173 PolarHBondContact N-OE1 2.99Å; M147-E173 PolarHBondContact N-OE2 3.17Å; D170-E173 HydrophobicContact CB-CB 3.98Å; D170-E173 WeakPolarHBondContact O-CB 3.26Å; D170-E173 PolarHBondContact O-N 2.78Å; E173-Y175 PolarHBondContact O-N 2.85Å; E173-N176 PolarHBondContact O-N 3.02Å; E173-T177 WeakPolarHBondContact O-CB 3.37Å; E173-T177 PolarHBondContact O-N 2.93Å; E173-T177 PolarHBondContact O-OG1 3.25Å; E173-H206 WeakPolarHBondContact CG-NE2 3.3Å; E173-H206 IonicContact OE2-CD2 2.81Å; E173-H206 IonicContact OE2-CE1 3.67Å; E173-H206 PolarHBondContact OE2-CE1 2.69Å; E173-H206 VanDerWaalsContact OE2-CE1 3.24Å; E173-H206 IonicContact OE2-NE2 3.92Å; E173-H206 PolarHBondContact OE2-NE2 2.72Å
174	P	96.4	Very high	92.2	Very high	8 Å²	8	69.8 Å²	69.8	5%	0.052	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-44.9	179	-26.5	37	0	0	0	113.1	P171 D172 A178 H206 K209 T210	P171-P174 WeakPolarHBondContact O-CD 3.41Å; D172-P174 VanDerWaalsContact C-CD 3.45Å; P174-A178 VanDerWaalsContact O-CB 3.24Å; P174-A178 WeakPolarHBondContact O-CB 3.35Å; P174-A178 PolarHBondContact O-N 2.98Å; P174-H206 VanDerWaalsContact CD-CE1 3.44Å; P174-H206 WeakPolarHBondContact CD-CE1 3.38Å; P174-H206 WeakPolarHBondContact CD-NE2 3.37Å; P174-H206 WeakPolarHBondContact CG-NE2 3.42Å; P174-K209 HydrophobicContact CB-CB 3.93Å; P174-K209 HydrophobicContact CG-CB 4.26Å; P174-T210 WeakPolarHBondContact CA-OG1 3.49Å; P174-T210 WeakPolarHBondContact CB-OG1 3.4Å
175	Y	95	Very high	91.3	Very high	124 Å²	124	61.9 Å²	61.9	49%	0.486	36%	0.356	S	S	.	.	H	α-helix	trans	-70.7	-46	-178.5	177	-87.9	0	0	0	111.3	D172 E173 A178 K179 R217	D172-Y175 PolarHBondContact O-N 3.29Å; D172-Y175 VanDerWaalsContact O-N 3.16Å; E173-Y175 PolarHBondContact O-N 2.85Å; Y175-A178 PolarHBondContact O-N 3.23Å; Y175-K179 HydrophobicContact CE1-CD 4.32Å; Y175-K179 VanDerWaalsContact O-CB 3.32Å; Y175-K179 WeakPolarHBondContact O-CB 3.31Å; Y175-K179 PolarHBondContact O-N 3.06Å; Y175-R217 PolarHBondContact OH-NH2 2.92Å
176	N	92.9	Very high	90.5	Very high	67 Å²	67	54.8 Å²	54.8	36%	0.358	32%	0.323	S	S	.	.	H	α-helix	trans	-66.2	-42	-178.9	-73.1	-29.2	0	0	0	111.3	D172 E173 K179 A180	D172-N176 WeakPolarHBondContact O-CB 3.49Å; D172-N176 PolarHBondContact O-N 2.93Å; D172-N176 PolarHBondContact O-ND2 3.16Å; E173-N176 PolarHBondContact O-N 3.02Å; N176-K179 PolarHBondContact O-N 2.89Å; N176-A180 WeakPolarHBondContact O-CB 3.47Å; N176-A180 PolarHBondContact O-N 3.46Å
177	T	93.5	Very high	89.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-48.6	174.6	-60.1	0	0	0	0	111.2	L116 I144 L146 E173 K179 A180 I181 T210	L116-T177 HydrophobicContact CD2-CG2 4.35Å; L116-T177 WeakPolarHBondContact CD2-OG1 3.35Å; I144-T177 HydrophobicContact CG2-CG2 3.88Å; L146-T177 HydrophobicContact CD2-CG2 3.88Å; E173-T177 WeakPolarHBondContact O-CB 3.37Å; E173-T177 PolarHBondContact O-N 2.93Å; E173-T177 PolarHBondContact O-OG1 3.25Å; T177-K179 VanDerWaalsContact C-N 3.34Å; T177-K179 PolarHBondContact O-N 3.2Å; T177-A180 WeakPolarHBondContact O-CB 3.37Å; T177-A180 PolarHBondContact O-N 3.49Å; T177-I181 HydrophobicContact CG2-CD1 3.55Å; T177-I181 HydrophobicContact CG2-CG1 4.35Å; T177-I181 WeakPolarHBondContact O-CG1 3.46Å; T177-I181 PolarHBondContact O-N 3.39Å; T177-T210 HydrophobicContact CG2-CG2 3.98Å
178	A	93.9	Very high	89.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-42.1	177.4	0	0	0	0	0	112.5	P174 Y175 A182 L214	P174-A178 VanDerWaalsContact O-CB 3.24Å; P174-A178 WeakPolarHBondContact O-CB 3.35Å; P174-A178 PolarHBondContact O-N 2.98Å; Y175-A178 PolarHBondContact O-N 3.23Å; A178-A182 VanDerWaalsContact O-CB 3.3Å; A178-A182 WeakPolarHBondContact O-CB 3.36Å; A178-A182 PolarHBondContact O-N 3.3Å; A178-L214 HydrophobicContact CB-CB 3.96Å
179	K	91.3	Very high	89	Confident	117 Å²	117	48 Å²	48	51%	0.509	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-44.2	175.5	-178.4	-177.2	175	-175	0	111.5	Y175 N176 T177 A183	Y175-K179 HydrophobicContact CE1-CD 4.32Å; Y175-K179 VanDerWaalsContact O-CB 3.32Å; Y175-K179 WeakPolarHBondContact O-CB 3.31Å; Y175-K179 PolarHBondContact O-N 3.06Å; N176-K179 PolarHBondContact O-N 2.89Å; T177-K179 VanDerWaalsContact C-N 3.34Å; T177-K179 PolarHBondContact O-N 3.2Å; K179-A183 PolarHBondContact O-N 2.91Å
180	A	88.8	Confident	89	Confident	7 Å²	7	46 Å²	46	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-52.1	178.9	0	0	0	0	0	112.3	L114 L116 N176 T177 A182 A183 W184	L114-A180 HydrophobicContact CD1-CB 3.51Å; L116-A180 HydrophobicContact CD1-CB 3.76Å; N176-A180 WeakPolarHBondContact O-CB 3.47Å; N176-A180 PolarHBondContact O-N 3.46Å; T177-A180 WeakPolarHBondContact O-CB 3.37Å; T177-A180 PolarHBondContact O-N 3.49Å; A180-A182 VanDerWaalsContact C-N 3.32Å; A180-A182 PolarHBondContact O-N 2.86Å; A180-A183 WeakPolarHBondContact O-CB 3.26Å; A180-A183 PolarHBondContact O-N 3.12Å; A180-A183 VanDerWaalsContact O-N 3.11Å; A180-W184 HydrophobicContact CB-CZ2 4.26Å; A180-W184 PolarHBondContact O-N 3.44Å
181	I	87.9	Confident	89.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-42.4	-178.7	-66.1	163	0	0	0	110.7	I144 T177 A183 W184 V189 L191 L214 I221	I144-I181 HydrophobicContact CG1-CD1 4.07Å; I144-I181 HydrophobicContact CG1-CG1 4.27Å; T177-I181 HydrophobicContact CG2-CD1 3.55Å; T177-I181 HydrophobicContact CG2-CG1 4.35Å; T177-I181 WeakPolarHBondContact O-CG1 3.46Å; T177-I181 PolarHBondContact O-N 3.39Å; I181-A183 VanDerWaalsContact C-N 3.26Å; I181-A183 PolarHBondContact O-N 3.29Å; I181-W184 HydrophobicContact CB-CE3 4.43Å; I181-W184 HydrophobicContact CG1-CE3 4.14Å; I181-W184 HydrophobicContact CG1-CH2 4.48Å; I181-W184 HydrophobicContact CG1-CZ3 3.82Å; I181-W184 PolarHBondContact O-N 3.33Å; I181-W184 VanDerWaalsContact O-N 3.12Å; I181-V189 HydrophobicContact CD1-CG2 4.02Å; I181-V189 HydrophobicContact CG1-CG2 4.41Å; I181-V189 HydrophobicContact CG2-CB 4.19Å; I181-V189 HydrophobicContact CG2-CG1 4.22Å; I181-V189 HydrophobicContact CG2-CG2 4.14Å; I181-L191 HydrophobicContact CD1-CD2 3.83Å; I181-L214 HydrophobicContact CB-CD1 3.98Å; I181-L214 HydrophobicContact CD1-CD2 4.34Å; I181-L214 HydrophobicContact CG2-CD1 3.76Å; I181-L214 HydrophobicContact CG2-CD2 4.04Å; I181-I221 HydrophobicContact CG2-CD1 3.62Å
182	A	87.6	Confident	89.2	Confident	31 Å²	31	38 Å²	38	26%	0.256	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-35.6	177.5	0	0	0	0	0	112.3	A178 A180 W184 L214 R217	A178-A182 VanDerWaalsContact O-CB 3.3Å; A178-A182 WeakPolarHBondContact O-CB 3.36Å; A178-A182 PolarHBondContact O-N 3.3Å; A180-A182 VanDerWaalsContact C-N 3.32Å; A180-A182 PolarHBondContact O-N 2.86Å; A182-W184 VanDerWaalsContact C-N 3.29Å; A182-W184 PolarHBondContact O-N 3.11Å; A182-L214 HydrophobicContact CB-CD1 4.46Å; A182-R217 HydrophobicContact CB-CB 3.99Å
183	A	84.3	Confident	89.3	Confident	84 Å²	84	33.8 Å²	33.8	69%	0.694	19%	0.194	S	C	*	.	H	α-helix	trans	-72.4	-20.1	177.9	0	0	0	0	0	113.7	K179 A180 I181 G185	K179-A183 PolarHBondContact O-N 2.91Å; A180-A183 WeakPolarHBondContact O-CB 3.26Å; A180-A183 PolarHBondContact O-N 3.12Å; A180-A183 VanDerWaalsContact O-N 3.11Å; I181-A183 VanDerWaalsContact C-N 3.26Å; I181-A183 PolarHBondContact O-N 3.29Å; A183-G185 VanDerWaalsContact C-N 3.31Å
184	W	79.5	Confident	89.4	Confident	68 Å²	68	33.2 Å²	33.2	26%	0.258	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-13	179.3	-63	-17.7	0	0	0	113.8	T110 L111 L114 L116 A142 I144 A180 I181 A182 L186	T110-W184 HydrophobicContact CG2-CZ2 4.22Å; L111-W184 HydrophobicContact CD2-CH2 3.53Å; L111-W184 HydrophobicContact CD2-CZ2 3.94Å; L111-W184 HydrophobicContact CG-CH2 4.47Å; L114-W184 HydrophobicContact CD1-CZ2 4.39Å; L116-W184 HydrophobicContact CD1-CH2 4.1Å; L116-W184 HydrophobicContact CD1-CZ2 4.27Å; A142-W184 HydrophobicContact CB-CE3 4.43Å; A142-W184 HydrophobicContact CB-CZ3 4Å; I144-W184 HydrophobicContact CD1-CH2 3.76Å; I144-W184 HydrophobicContact CD1-CZ3 3.74Å; I144-W184 HydrophobicContact CG1-CH2 4.48Å; I144-W184 HydrophobicContact CG1-CZ3 4.18Å; A180-W184 HydrophobicContact CB-CZ2 4.26Å; A180-W184 PolarHBondContact O-N 3.44Å; I181-W184 HydrophobicContact CB-CE3 4.43Å; I181-W184 HydrophobicContact CG1-CE3 4.14Å; I181-W184 HydrophobicContact CG1-CH2 4.48Å; I181-W184 HydrophobicContact CG1-CZ3 3.82Å; I181-W184 PolarHBondContact O-N 3.33Å; I181-W184 VanDerWaalsContact O-N 3.12Å; A182-W184 VanDerWaalsContact C-N 3.29Å; A182-W184 PolarHBondContact O-N 3.11Å; W184-L186 VanDerWaalsContact C-N 3.29Å; W184-L186 HydrophobicContact CB-CD1 4.48Å; W184-L186 HydrophobicContact CB-CD2 4.05Å; W184-L186 HydrophobicContact CB-CG 3.85Å; W184-L186 HydrophobicContact CE3-CD1 3.82Å; W184-L186 HydrophobicContact CE3-CG 4.41Å; W184-L186 PolarHBondContact O-N 3.4Å
185	G	75.3	Confident	89.4	Confident	61 Å²	61	34 Å²	34	63%	0.629	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	31.6	179.9	0	0	0	0	0	113.4	A183	A183-G185 VanDerWaalsContact C-N 3.31Å
186	L	77.4	Confident	89.6	Confident	17 Å²	17	28.5 Å²	28.5	9%	0.089	17%	0.174	C	C	.	.			trans	-75.4	142.5	177.7	-51.9	-173.7	0	0	0	110.8	A140 A142 W184 I221	A140-L186 HydrophobicContact CB-CD2 3.84Å; A140-L186 WeakPolarHBondContact O-CD2 3.11Å; A142-L186 HydrophobicContact CB-CD1 3.9Å; W184-L186 VanDerWaalsContact C-N 3.29Å; W184-L186 HydrophobicContact CB-CD1 4.48Å; W184-L186 HydrophobicContact CB-CD2 4.05Å; W184-L186 HydrophobicContact CB-CG 3.85Å; W184-L186 HydrophobicContact CE3-CD1 3.82Å; W184-L186 HydrophobicContact CE3-CG 4.41Å; W184-L186 PolarHBondContact O-N 3.4Å; L186-I221 HydrophobicContact CB-CD1 4.29Å; L186-I221 WeakPolarHBondContact O-CD1 3.5Å; L186-I221 WeakPolarHBondContact O-CG1 3.29Å
187	D	78.4	Confident	89.8	Confident	77 Å²	77	26.8 Å²	26.8	41%	0.412	17%	0.165	S	C	.	.	S	Bend	trans	-84	-23	171.2	-71.7	-49.7	0	0	0	112.8	T139 L222 K375	T139-D187 HydrophobicContact CG2-CB 4.17Å; D187-L222 PolarHBondContact O-N 3.23Å; D187-K375 HydrophobicContact CB-CD 4.33Å; D187-K375 VanDerWaalsContact CB-NZ 3.3Å; D187-K375 VanDerWaalsContact CG-NZ 3.25Å; D187-K375 IonicContact OD2-NZ 2.78Å; D187-K375 PolarHBondContact OD2-NZ 3.37Å
188	Y	84.6	Confident	89.9	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	135.3	-174.3	-160.5	-79.2	0	0	0	109.8	T141 V190 L222 E224 E371 L374 K375	T141-Y188 HydrophobicContact CG2-CD1 4.14Å; Y188-V190 HydrophobicContact CD1-CG2 4.38Å; Y188-V190 HydrophobicContact CE1-CG2 3.91Å; Y188-L222 WeakPolarHBondContact CA-O 3.37Å; Y188-L222 HydrophobicContact CD2-CB 3.44Å; Y188-L222 VanDerWaalsContact CD2-CB 3.44Å; Y188-L222 HydrophobicContact CD2-CD1 3.88Å; Y188-L222 HydrophobicContact CD2-CG 4.3Å; Y188-L222 HydrophobicContact CE2-CB 3.83Å; Y188-L222 HydrophobicContact CE2-CD1 4.24Å; Y188-L222 HydrophobicContact CG-CB 4.22Å; Y188-E224 HydrophobicContact CE1-CB 3.83Å; Y188-E224 WeakPolarHBondContact OH-CB 3.2Å; Y188-E224 PolarHBondContact OH-OE2 3.29Å; Y188-E371 HydrophobicContact CD1-CB 3.97Å; Y188-E371 HydrophobicContact CD1-CG 3.91Å; Y188-E371 HydrophobicContact CE1-CB 4.03Å; Y188-E371 HydrophobicContact CE1-CG 3.69Å; Y188-E371 HydrophobicContact CG-CB 4.22Å; Y188-L374 HydrophobicContact CE2-CB 4.33Å; Y188-K375 HydrophobicContact CD2-CB 4.46Å
189	V	89.3	Confident	90	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.6	173.6	69.2	0	0	0	0	110.4	A142 I144 I181 L191 L214 I221 L222 V223 E224	A142-V189 WeakPolarHBondContact O-CG2 3.49Å; I144-V189 HydrophobicContact CG1-CG2 4.36Å; I181-V189 HydrophobicContact CD1-CG2 4.02Å; I181-V189 HydrophobicContact CG1-CG2 4.41Å; I181-V189 HydrophobicContact CG2-CB 4.19Å; I181-V189 HydrophobicContact CG2-CG1 4.22Å; I181-V189 HydrophobicContact CG2-CG2 4.14Å; V189-L191 HydrophobicContact CG2-CD2 4.24Å; V189-L214 HydrophobicContact CG1-CD2 3.65Å; V189-I221 HydrophobicContact CB-CD1 4.2Å; V189-I221 HydrophobicContact CG1-CD1 3.92Å; V189-I221 HydrophobicContact CG1-CG1 4.4Å; V189-L222 PolarHBondContact N-O 2.83Å; V189-V223 HydrophobicContact CG1-CG1 4.38Å; V189-V223 HydrophobicContact CG1-CG2 4.07Å; V189-E224 PolarHBondContact O-N 3.39Å
190	V	93.5	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.7	168.5	-175.9	0	0	0	0	107.7	A142 T143 I144 Y188 E224 L226 E371	A142-V190 PolarHBondContact O-N 2.87Å; A142-V190 VanDerWaalsContact O-N 3.13Å; T143-V190 CarbonylContact C-O 3.59Å; T143-V190 VanDerWaalsContact CA-O 3.25Å; T143-V190 WeakPolarHBondContact CA-O 3.42Å; T143-V190 HydrophobicContact CG2-CB 3.82Å; T143-V190 HydrophobicContact CG2-CG1 3.74Å; I144-V190 PolarHBondContact N-O 3.49Å; Y188-V190 HydrophobicContact CD1-CG2 4.38Å; Y188-V190 HydrophobicContact CE1-CG2 3.91Å; V190-E224 CarbonylContact C-O 3.57Å; V190-E224 WeakPolarHBondContact CA-O 3.46Å; V190-E224 HydrophobicContact CG1-CB 4.49Å; V190-E224 HydrophobicContact CG1-CG 4.31Å; V190-E224 HydrophobicContact CG2-CB 4.14Å; V190-E224 HydrophobicContact CG2-CG 4.44Å; V190-L226 HydrophobicContact CG1-CB 4.31Å; V190-E371 WeakPolarHBondContact CG2-OE1 3.39Å
191	L	96.2	Very high	90.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.7	167.6	-59.5	-179.1	0	0	0	107.7	I144 L146 I181 V189 F207 T210 V211 V223 E224 C225 L226	I144-L191 HydrophobicContact CB-CD2 3.99Å; L146-L191 HydrophobicContact CD1-CB 4.44Å; I181-L191 HydrophobicContact CD1-CD2 3.83Å; V189-L191 HydrophobicContact CG2-CD2 4.24Å; L191-F207 HydrophobicContact CB-CE1 3.64Å; L191-F207 HydrophobicContact CB-CZ 3.93Å; L191-F207 WeakPolarHBondContact O-CZ 3.18Å; L191-T210 HydrophobicContact CD1-CG2 3.87Å; L191-V211 HydrophobicContact CD1-CG2 3.9Å; L191-V223 HydrophobicContact CD1-CG1 4Å; L191-V223 HydrophobicContact CG-CG1 4.29Å; L191-E224 PolarHBondContact N-O 3.13Å; L191-C225 CarbonylContact O-C 3.55Å; L191-C225 WeakPolarHBondContact O-CA 3.07Å; L191-L226 PolarHBondContact O-N 3.28Å
192	T	97	Very high	90.9	Very high	14 Å²	14	34.1 Å²	34.1	9%	0.086	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	174.9	171.9	-168.8	0	0	0	0	109.3	V119 T143 I144 M145 L146 L226	V119-T192 HydrophobicContact CB-CG2 4.15Å; V119-T192 HydrophobicContact CG1-CG2 4.48Å; T143-T192 HydrophobicContact CG2-CG2 4Å; I144-T192 PolarHBondContact O-N 2.78Å; M145-T192 CarbonylContact C-O 3.59Å; M145-T192 WeakPolarHBondContact CA-O 3.24Å; M145-T192 HydrophobicContact CB-CG2 3.95Å; M145-T192 HydrophobicContact CG-CG2 4.16Å; L146-T192 PolarHBondContact N-O 3.43Å; T192-L226 WeakPolarHBondContact CA-O 3.27Å; T192-L226 PolarHBondContact OG1-O 3.35Å
193	S	97.2	Very high	91.4	Very high	15 Å²	15	32.7 Å²	32.7	11%	0.105	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	166.2	172.9	72.8	0	0	0	0	111.9	L146 M147 P228	L146-S193 WeakPolarHBondContact O-CA 3.21Å; L146-S193 WeakPolarHBondContact O-CB 3.41Å; M147-S193 WeakPolarHBondContact CE-OG 3.36Å; S193-P228 WeakPolarHBondContact OG-CD 3.42Å; S193-P228 VanDerWaalsContact OG-CG 3.3Å; S193-P228 WeakPolarHBondContact OG-CG 3.42Å
194	V	96.9	Very high	92.1	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.03	18%	0.181	C	C	.	.			trans	-71.2	162.9	159.5	-59.9	0	0	0	0	110.7	M145 M147 C151 V160 R196	M145-V194 HydrophobicContact CG-CG1 4.48Å; M145-V194 HydrophobicContact SD-CG1 4Å; M147-V194 HydrophobicContact CB-CG2 4.19Å; M147-V194 WeakPolarHBondContact O-CG2 3.17Å; C151-V194 HydrophobicContact CB-CB 3.86Å; C151-V194 HydrophobicContact CB-CG1 4.14Å; V160-V194 HydrophobicContact CG1-CG1 3.69Å; V194-R196 HydrophobicContact CG2-CG 4.17Å
195	D	98.1	Very high	92.9	Very high	26 Å²	26	28.9 Å²	28.9	14%	0.139	19%	0.185	C	C	.	.			trans	-73.5	134.5	166.2	-62.8	-82.2	0	0	0	109.7	C151 T152 R153 P228	C151-D195 VanDerWaalsContact SG-CB 3.59Å; C151-D195 PolarHBondContact SG-N 3.32Å; T152-D195 PolarHBondContact N-O 3.14Å; T152-D195 PolarHBondContact OG1-O 3.13Å; T152-D195 VanDerWaalsContact OG1-O 3.07Å; R153-D195 HydrophobicContact CB-CB 4.19Å; R153-D195 VanDerWaalsContact CD-CG 3.42Å; R153-D195 WeakPolarHBondContact CD-OD2 3.49Å; R153-D195 HydrophobicContact CG-CB 3.65Å; R153-D195 IonicContact CZ-OD1 2.66Å; R153-D195 IonicContact NE-OD1 3.43Å; R153-D195 IonicContact NH1-OD1 2.78Å; R153-D195 IonicContact NH2-OD1 3.54Å; D195-P228 WeakPolarHBondContact OD1-CB 3.37Å
196	R	97.7	Very high	94	Very high	7 Å²	7	26.8 Å²	26.8	3%	0.026	16%	0.159	C	C	.	.			trans	-121.8	60.4	178.9	-68	-59.5	-58.2	-105.9	3.7	111.5	M147 P167 V194 D198 I199	M147-R196 HydrophobicContact CB-CG 4.05Å; M147-R196 HydrophobicContact CE-CG 4.21Å; M147-R196 HydrophobicContact SD-CG 3.8Å; P167-R196 PolarHBondContact O-NH1 3.05Å; P167-R196 PolarHBondContact O-NH2 3.16Å; V194-R196 HydrophobicContact CG2-CG 4.17Å; R196-D198 WeakPolarHBondContact CA-OD1 3.29Å; R196-D198 IonicContact CZ-OD1 3.52Å; R196-D198 IonicContact CZ-OD2 2.81Å; R196-D198 IonicContact NE-OD1 2.72Å; R196-D198 PolarHBondContact NE-OD1 3.15Å; R196-D198 IonicContact NE-OD2 3.1Å; R196-D198 PolarHBondContact NE-OD2 2.7Å; R196-D198 IonicContact NH2-OD1 2.7Å; R196-D198 IonicContact NH2-OD2 2.89Å; R196-D198 PolarHBondContact NH2-OD2 3.16Å; R196-D198 PolarHBondContact O-N 2.81Å; R196-I199 HydrophobicContact CB-CD1 4.36Å; R196-I199 PolarHBondContact O-N 3.45Å
197	D	96.9	Very high	95	Very high	32 Å²	32	26 Å²	26	17%	0.171	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-7.6	179	-56.7	-51.2	0	0	0	113.1	T152 R153 I199 R231 R266	T152-D197 WeakPolarHBondContact OG1-CB 3.44Å; T152-D197 VanDerWaalsContact OG1-CG 3.26Å; T152-D197 PolarHBondContact OG1-N 2.89Å; T152-D197 PolarHBondContact OG1-OD2 3.17Å; R153-D197 VanDerWaalsContact CG-OD2 3.24Å; R153-D197 WeakPolarHBondContact CG-OD2 3.35Å; R153-D197 IonicContact CZ-OD1 2.65Å; R153-D197 IonicContact NE-OD1 3.25Å; R153-D197 PolarHBondContact NE-OD1 3.36Å; R153-D197 IonicContact NE-OD2 2.75Å; R153-D197 PolarHBondContact NE-OD2 2.79Å; R153-D197 IonicContact NH2-OD1 3.66Å; R153-D197 PolarHBondContact NH2-OD1 3.36Å; D197-I199 VanDerWaalsContact C-N 3.32Å; D197-R231 WeakPolarHBondContact OD1-CD 3.41Å; D197-R231 WeakPolarHBondContact OD1-CG 3.46Å; D197-R266 IonicContact OD2-CZ 2.76Å; D197-R266 IonicContact OD2-NE 3.54Å; D197-R266 IonicContact OD2-NH1 2.94Å; D197-R266 PolarHBondContact OD2-NH1 3.43Å
198	D	96.2	Very high	96	Very high	71 Å²	71	22.7 Å²	22.7	38%	0.38	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-13	173.5	63.3	-60.8	0	0	0	113.6	T152 R196	T152-D198 HydrophobicContact CG2-CB 4.29Å; T152-D198 WeakPolarHBondContact CG2-OD1 3.33Å; R196-D198 WeakPolarHBondContact CA-OD1 3.29Å; R196-D198 IonicContact CZ-OD1 3.52Å; R196-D198 IonicContact CZ-OD2 2.81Å; R196-D198 IonicContact NE-OD1 2.72Å; R196-D198 PolarHBondContact NE-OD1 3.15Å; R196-D198 IonicContact NE-OD2 3.1Å; R196-D198 PolarHBondContact NE-OD2 2.7Å; R196-D198 IonicContact NH2-OD1 2.7Å; R196-D198 IonicContact NH2-OD2 2.89Å; R196-D198 PolarHBondContact NH2-OD2 3.16Å; R196-D198 PolarHBondContact O-N 2.81Å
199	I	95.4	Very high	96.6	Very high	50 Å²	50	27.7 Å²	27.7	26%	0.256	16%	0.16	S	C	.	.	S	Bend	trans	-113.5	143.4	-179.7	-55.5	177.3	0	0	0	109.5	L169 R196 D197 D201 G202	L169-I199 HydrophobicContact CD1-CD1 3.34Å; L169-I199 HydrophobicContact CD2-CD1 4.41Å; L169-I199 HydrophobicContact CG-CD1 3.55Å; R196-I199 HydrophobicContact CB-CD1 4.36Å; R196-I199 PolarHBondContact O-N 3.45Å; D197-I199 VanDerWaalsContact C-N 3.32Å; I199-D201 PolarHBondContact O-N 2.88Å; I199-G202 PolarHBondContact O-N 3.27Å; I199-G202 VanDerWaalsContact O-N 3.09Å
200	A	95.1	Very high	97.1	Very high	109 Å²	109	27.7 Å²	27.7	90%	0.901	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-41.6	-171	0	0	0	0	0	114.2
201	D	96.3	Very high	97.3	Very high	38 Å²	38	27.7 Å²	27.7	20%	0.203	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	11.5	-179.5	75.8	-23	0	0	0	113.1	I199 G203 A204 E205 K239	I199-D201 PolarHBondContact O-N 2.88Å; D201-G203 PolarHBondContact O-N 3.08Å; D201-G203 PolarHBondContact OD1-N 2.84Å; D201-A204 WeakPolarHBondContact O-CB 3.49Å; D201-A204 PolarHBondContact O-N 3.42Å; D201-A204 VanDerWaalsContact O-N 3.1Å; D201-A204 PolarHBondContact OD2-N 3.23Å; D201-E205 WeakPolarHBondContact OD2-CB 3.47Å; D201-E205 PolarHBondContact OD2-N 2.83Å; D201-K239 IonicContact OD2-NZ 3.7Å
202	G	96.8	Very high	97.4	Very high	10 Å²	10	30.3 Å²	30.3	10%	0.103	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	14.5	-176.6	0	0	0	0	0	114.8	I199	I199-G202 PolarHBondContact O-N 3.27Å; I199-G202 VanDerWaalsContact O-N 3.09Å
203	G	97.6	Very high	97.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.01	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	10.3	-176.7	0	0	0	0	0	115.3	M147 D201 E205 H206 F207	M147-G203 VanDerWaalsContact SD-CA 3.54Å; D201-G203 PolarHBondContact O-N 3.08Å; D201-G203 PolarHBondContact OD1-N 2.84Å; G203-E205 VanDerWaalsContact C-N 3.35Å; G203-E205 PolarHBondContact O-N 3.18Å; G203-H206 WeakPolarHBondContact O-CB 3.32Å; G203-H206 PolarHBondContact O-N 3.18Å; G203-H206 VanDerWaalsContact O-N 3.13Å; G203-F207 PolarHBondContact O-N 3.1Å
204	A	98.3	Very high	97.3	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.6	-177.2	0	0	0	0	0	113.9	D201 H206 F207 A208 F230 A236 K239 I240	D201-A204 WeakPolarHBondContact O-CB 3.49Å; D201-A204 PolarHBondContact O-N 3.42Å; D201-A204 VanDerWaalsContact O-N 3.1Å; D201-A204 PolarHBondContact OD2-N 3.23Å; A204-H206 VanDerWaalsContact C-N 3.32Å; A204-H206 PolarHBondContact O-N 2.89Å; A204-F207 PolarHBondContact O-N 3.2Å; A204-A208 WeakPolarHBondContact O-CB 3.39Å; A204-A208 PolarHBondContact O-N 3.37Å; A204-F230 HydrophobicContact CB-CD1 4.4Å; A204-F230 HydrophobicContact CB-CE1 4.15Å; A204-A236 HydrophobicContact CB-CB 3.54Å; A204-K239 HydrophobicContact CB-CD 4.46Å; A204-I240 HydrophobicContact CB-CD1 4.02Å; A204-I240 HydrophobicContact CB-CG1 4.21Å
205	E	98.1	Very high	97.3	Very high	72 Å²	72	31.2 Å²	31.2	34%	0.336	18%	0.179	S	C	.	.	H	α-helix	trans	-59.5	-43.5	173.1	-176.6	68	-158.6	0	0	111.8	D201 G203 F207 A208 K209 K239	D201-E205 WeakPolarHBondContact OD2-CB 3.47Å; D201-E205 PolarHBondContact OD2-N 2.83Å; G203-E205 VanDerWaalsContact C-N 3.35Å; G203-E205 PolarHBondContact O-N 3.18Å; E205-F207 VanDerWaalsContact C-N 3.34Å; E205-F207 PolarHBondContact O-N 2.78Å; E205-A208 PolarHBondContact O-N 2.77Å; E205-K209 HydrophobicContact CG-CD 4.2Å; E205-K209 WeakPolarHBondContact O-CB 3.47Å; E205-K209 WeakPolarHBondContact O-CG 3.49Å; E205-K209 PolarHBondContact O-N 2.9Å; E205-K209 WeakPolarHBondContact OE1-CE 3.18Å; E205-K209 IonicContact OE1-NZ 3.44Å; E205-K239 HydrophobicContact CB-CD 4.28Å; E205-K239 VanDerWaalsContact OE2-CD 3.29Å; E205-K239 WeakPolarHBondContact OE2-CD 3.4Å; E205-K239 WeakPolarHBondContact OE2-CE 3.41Å; E205-K239 IonicContact OE2-NZ 3.39Å; E205-K239 PolarHBondContact OE2-NZ 2.84Å
206	H	98.3	Very high	97.2	Very high	16 Å²	16	37.1 Å²	37.1	7%	0.074	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-43.5	-179.3	-167.5	109.5	0	0	0	111	M147 L169 D170 E173 P174 G203 A204 T210	M147-H206 HydrophobicContact SD-CB 4.25Å; L169-H206 HydrophobicContact CD1-CB 4.18Å; D170-H206 PolarHBondContact O-CE1 2.88Å; D170-H206 VanDerWaalsContact O-CE1 3.26Å; E173-H206 WeakPolarHBondContact CG-NE2 3.3Å; E173-H206 IonicContact OE2-CD2 2.81Å; E173-H206 IonicContact OE2-CE1 3.67Å; E173-H206 PolarHBondContact OE2-CE1 2.69Å; E173-H206 VanDerWaalsContact OE2-CE1 3.24Å; E173-H206 IonicContact OE2-NE2 3.92Å; E173-H206 PolarHBondContact OE2-NE2 2.72Å; P174-H206 VanDerWaalsContact CD-CE1 3.44Å; P174-H206 WeakPolarHBondContact CD-CE1 3.38Å; P174-H206 WeakPolarHBondContact CD-NE2 3.37Å; P174-H206 WeakPolarHBondContact CG-NE2 3.42Å; G203-H206 WeakPolarHBondContact O-CB 3.32Å; G203-H206 PolarHBondContact O-N 3.18Å; G203-H206 VanDerWaalsContact O-N 3.13Å; A204-H206 VanDerWaalsContact C-N 3.32Å; A204-H206 PolarHBondContact O-N 2.89Å; H206-T210 PolarHBondContact O-N 2.84Å; H206-T210 VanDerWaalsContact O-N 3.14Å; H206-T210 PolarHBondContact O-OG1 3.37Å
207	F	97.8	Very high	97.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.4	-51	175.5	-142.1	-64.1	0	0	0	111.5	L146 M147 L191 G203 A204 E205 K209 T210 V211 C225 I240	L146-F207 HydrophobicContact CD1-CD1 4.16Å; L146-F207 HydrophobicContact CD1-CD2 4.1Å; L146-F207 HydrophobicContact CD1-CE1 4.33Å; L146-F207 HydrophobicContact CD1-CE2 4.31Å; L146-F207 HydrophobicContact CD1-CG 4.04Å; L146-F207 HydrophobicContact CD1-CZ 4.43Å; M147-F207 HydrophobicContact CE-CD2 4.42Å; L191-F207 HydrophobicContact CB-CE1 3.64Å; L191-F207 HydrophobicContact CB-CZ 3.93Å; L191-F207 WeakPolarHBondContact O-CZ 3.18Å; G203-F207 PolarHBondContact O-N 3.1Å; A204-F207 PolarHBondContact O-N 3.2Å; E205-F207 VanDerWaalsContact C-N 3.34Å; E205-F207 PolarHBondContact O-N 2.78Å; F207-K209 PolarHBondContact O-N 3.15Å; F207-T210 WeakPolarHBondContact O-CB 3.48Å; F207-T210 PolarHBondContact O-N 3.21Å; F207-T210 VanDerWaalsContact O-N 3.14Å; F207-V211 HydrophobicContact CD1-CG2 4.41Å; F207-V211 PolarHBondContact O-N 2.86Å; F207-V211 VanDerWaalsContact O-N 3.14Å; F207-C225 HydrophobicContact CD1-CB 4.33Å; F207-C225 HydrophobicContact CE1-CB 3.54Å; F207-C225 HydrophobicContact CZ-CB 4.15Å; F207-I240 HydrophobicContact CB-CD1 3.99Å; F207-I240 HydrophobicContact CB-CG1 4.18Å; F207-I240 HydrophobicContact CG-CD1 4.22Å
208	A	98.4	Very high	96.8	Very high	8 Å²	8	41.4 Å²	41.4	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-44.6	-179.6	0	0	0	0	0	112.1	A204 E205 T210 V211 T212 K239	A204-A208 WeakPolarHBondContact O-CB 3.39Å; A204-A208 PolarHBondContact O-N 3.37Å; E205-A208 PolarHBondContact O-N 2.77Å; A208-T210 VanDerWaalsContact C-N 3.25Å; A208-T210 PolarHBondContact O-N 2.87Å; A208-V211 PolarHBondContact O-N 3.14Å; A208-V211 VanDerWaalsContact O-N 3.16Å; A208-T212 PolarHBondContact O-N 2.89Å; A208-T212 PolarHBondContact O-OG1 3.44Å; A208-K239 HydrophobicContact CB-CD 4.38Å; A208-K239 HydrophobicContact CB-CG 3.96Å
209	K	98.4	Very high	96.6	Very high	107 Å²	107	42 Å²	42	47%	0.465	23%	0.23	S	C	.	.	H	α-helix	trans	-57.9	-37.6	174.7	-80.2	177.5	171.8	162.3	0	112.7	P174 E205 F207 S213	P174-K209 HydrophobicContact CB-CB 3.93Å; P174-K209 HydrophobicContact CG-CB 4.26Å; E205-K209 HydrophobicContact CG-CD 4.2Å; E205-K209 WeakPolarHBondContact O-CB 3.47Å; E205-K209 WeakPolarHBondContact O-CG 3.49Å; E205-K209 PolarHBondContact O-N 2.9Å; E205-K209 WeakPolarHBondContact OE1-CE 3.18Å; E205-K209 IonicContact OE1-NZ 3.44Å; F207-K209 PolarHBondContact O-N 3.15Å; K209-S213 WeakPolarHBondContact O-CB 3.48Å; K209-S213 PolarHBondContact O-N 2.74Å; K209-S213 PolarHBondContact O-OG 3.47Å
210	T	98.3	Very high	96.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-45.4	178	-54.1	0	0	0	0	110.5	L146 P174 T177 L191 H206 F207 A208 L214	L146-T210 HydrophobicContact CD1-CG2 4.08Å; L146-T210 HydrophobicContact CD2-CG2 3.98Å; P174-T210 WeakPolarHBondContact CA-OG1 3.49Å; P174-T210 WeakPolarHBondContact CB-OG1 3.4Å; T177-T210 HydrophobicContact CG2-CG2 3.98Å; L191-T210 HydrophobicContact CD1-CG2 3.87Å; H206-T210 PolarHBondContact O-N 2.84Å; H206-T210 VanDerWaalsContact O-N 3.14Å; H206-T210 PolarHBondContact O-OG1 3.37Å; F207-T210 WeakPolarHBondContact O-CB 3.48Å; F207-T210 PolarHBondContact O-N 3.21Å; F207-T210 VanDerWaalsContact O-N 3.14Å; A208-T210 VanDerWaalsContact C-N 3.25Å; A208-T210 PolarHBondContact O-N 2.87Å; T210-L214 VanDerWaalsContact O-CB 3.27Å; T210-L214 WeakPolarHBondContact O-CB 3.46Å; T210-L214 PolarHBondContact O-N 3.44Å
211	V	98.2	Very high	95.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-50.5	177.2	179	0	0	0	0	111	L191 F207 A208 L214 K215 V223 C225 S243 L245	L191-V211 HydrophobicContact CD1-CG2 3.9Å; F207-V211 HydrophobicContact CD1-CG2 4.41Å; F207-V211 PolarHBondContact O-N 2.86Å; F207-V211 VanDerWaalsContact O-N 3.14Å; A208-V211 PolarHBondContact O-N 3.14Å; A208-V211 VanDerWaalsContact O-N 3.16Å; V211-L214 PolarHBondContact O-N 3.34Å; V211-K215 HydrophobicContact CG1-CG 4.3Å; V211-K215 WeakPolarHBondContact O-CG 3.43Å; V211-K215 PolarHBondContact O-N 3.28Å; V211-V223 HydrophobicContact CG1-CG1 4.21Å; V211-V223 HydrophobicContact CG2-CG1 4.12Å; V211-C225 WeakPolarHBondContact CG2-SG 3.43Å; V211-S243 WeakPolarHBondContact CG1-OG 3.16Å; V211-L245 HydrophobicContact CG1-CB 4.22Å
212	T	98.2	Very high	95.6	Very high	56 Å²	56	41 Å²	41	34%	0.344	20%	0.204	S	C	.	.	H	α-helix	trans	-61.4	-47.7	-179.3	-56.2	0	0	0	0	111.2	A208 L214 K215 E216 S243	A208-T212 PolarHBondContact O-N 2.89Å; A208-T212 PolarHBondContact O-OG1 3.44Å; T212-L214 PolarHBondContact O-N 3.04Å; T212-K215 PolarHBondContact O-N 3.44Å; T212-K215 VanDerWaalsContact O-N 3.13Å; T212-E216 WeakPolarHBondContact O-CG 3.49Å; T212-E216 PolarHBondContact O-N 2.99Å; T212-S243 PolarHBondContact OG1-O 3.39Å; T212-S243 VanDerWaalsContact OG1-O 3.12Å
213	S	97.6	Very high	95.5	Very high	22 Å²	22	40.5 Å²	40.5	15%	0.154	20%	0.199	C	C	.	.	H	α-helix	trans	-59.2	-35.8	176.7	-59.7	0	0	0	0	112.3	K209 R217	K209-S213 WeakPolarHBondContact O-CB 3.48Å; K209-S213 PolarHBondContact O-N 2.74Å; K209-S213 PolarHBondContact O-OG 3.47Å; S213-R217 WeakPolarHBondContact O-CD 3.49Å; S213-R217 VanDerWaalsContact O-CG 3.26Å; S213-R217 WeakPolarHBondContact O-CG 3.26Å; S213-R217 PolarHBondContact O-N 2.95Å
214	L	95.8	Very high	95.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-71.2	-43.9	176.9	176.9	59.1	0	0	0	111.5	A178 I181 A182 V189 T210 V211 T212 E216 R217 N218 I221 V223	A178-L214 HydrophobicContact CB-CB 3.96Å; I181-L214 HydrophobicContact CB-CD1 3.98Å; I181-L214 HydrophobicContact CD1-CD2 4.34Å; I181-L214 HydrophobicContact CG2-CD1 3.76Å; I181-L214 HydrophobicContact CG2-CD2 4.04Å; A182-L214 HydrophobicContact CB-CD1 4.46Å; V189-L214 HydrophobicContact CG1-CD2 3.65Å; T210-L214 VanDerWaalsContact O-CB 3.27Å; T210-L214 WeakPolarHBondContact O-CB 3.46Å; T210-L214 PolarHBondContact O-N 3.44Å; V211-L214 PolarHBondContact O-N 3.34Å; T212-L214 PolarHBondContact O-N 3.04Å; L214-E216 VanDerWaalsContact C-N 3.34Å; L214-E216 PolarHBondContact O-N 3.38Å; L214-R217 PolarHBondContact O-N 3.08Å; L214-N218 PolarHBondContact O-N 2.86Å; L214-I221 HydrophobicContact CD1-CD1 4.34Å; L214-I221 HydrophobicContact CD1-CG2 4.22Å; L214-I221 HydrophobicContact CD2-CD1 4.29Å; L214-I221 HydrophobicContact CD2-CG2 4.17Å; L214-I221 HydrophobicContact CG-CG2 3.88Å; L214-V223 HydrophobicContact CD2-CG2 3.75Å; L214-V223 HydrophobicContact CG-CG2 4.46Å
215	K	95.6	Very high	95.5	Very high	31 Å²	31	40.5 Å²	40.5	14%	0.135	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-34.4	178.7	-71.6	-67.2	-172.6	169.7	0	112.9	V211 T212 R217 N218 P219 I221 V223 G244 D246	V211-K215 HydrophobicContact CG1-CG 4.3Å; V211-K215 WeakPolarHBondContact O-CG 3.43Å; V211-K215 PolarHBondContact O-N 3.28Å; T212-K215 PolarHBondContact O-N 3.44Å; T212-K215 VanDerWaalsContact O-N 3.13Å; K215-R217 VanDerWaalsContact C-N 3.29Å; K215-R217 PolarHBondContact O-N 3.31Å; K215-N218 CarbonylContact O-C 3.33Å; K215-P219 VanDerWaalsContact O-CA 3.31Å; K215-P219 WeakPolarHBondContact O-CA 3.41Å; K215-P219 WeakPolarHBondContact O-CD 3.4Å; K215-P219 WeakPolarHBondContact O-CG 3.47Å; K215-P219 VanDerWaalsContact O-N 3.14Å; K215-I221 PolarHBondContact NZ-O 3.43Å; K215-V223 HydrophobicContact CD-CG2 4.39Å; K215-G244 WeakPolarHBondContact CE-O 3.48Å; K215-D246 IonicContact NZ-OD1 2.77Å; K215-D246 IonicContact NZ-OD2 3.68Å; K215-D246 PolarHBondContact NZ-OD2 3.06Å
216	E	96.4	Very high	95.4	Very high	149 Å²	149	38 Å²	38	70%	0.696	19%	0.188	S	C	*	.	H	α-helix	trans	-62.1	-37.3	172.4	-74.3	172.9	179.4	0	0	112.2	T212 L214	T212-E216 WeakPolarHBondContact O-CG 3.49Å; T212-E216 PolarHBondContact O-N 2.99Å; L214-E216 VanDerWaalsContact C-N 3.34Å; L214-E216 PolarHBondContact O-N 3.38Å
217	R	94.9	Very high	95.4	Very high	95 Å²	95	37.6 Å²	37.6	36%	0.358	19%	0.187	S	C	.	.	H	α-helix	trans	-82.2	-36.2	-179.1	-68	169.9	176.4	-75.7	1.4	113.1	Y175 A182 S213 L214 K215	Y175-R217 PolarHBondContact OH-NH2 2.92Å; A182-R217 HydrophobicContact CB-CB 3.99Å; S213-R217 WeakPolarHBondContact O-CD 3.49Å; S213-R217 VanDerWaalsContact O-CG 3.26Å; S213-R217 WeakPolarHBondContact O-CG 3.26Å; S213-R217 PolarHBondContact O-N 2.95Å; L214-R217 PolarHBondContact O-N 3.08Å; K215-R217 VanDerWaalsContact C-N 3.29Å; K215-R217 PolarHBondContact O-N 3.31Å
218	N	92.1	Very high	95.4	Very high	34 Å²	34	38.2 Å²	38.2	18%	0.182	19%	0.19	C	C	.	.			trans	-141.5	90.7	180	-174.4	-12.3	0	0	0	109.3	L214 K215 H220 I221	L214-N218 PolarHBondContact O-N 2.86Å; K215-N218 CarbonylContact O-C 3.33Å; N218-H220 PolarHBondContact O-N 3Å; N218-H220 VanDerWaalsContact O-N 3.16Å; N218-H220 PolarHBondContact OD1-N 3.39Å; N218-H220 VanDerWaalsContact OD1-N 3.15Å; N218-I221 HydrophobicContact CB-CB 4.31Å; N218-I221 HydrophobicContact CB-CG2 4.09Å; N218-I221 WeakPolarHBondContact O-CG2 3.36Å; N218-I221 PolarHBondContact O-N 2.89Å; N218-I221 PolarHBondContact OD1-N 3.45Å; N218-I221 VanDerWaalsContact OD1-N 3.13Å
219	P	92.3	Very high	95.4	Very high	85 Å²	85	37.9 Å²	37.9	55%	0.552	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-19.6	179.9	-24.7	34.6	0	0	0	114.1	K215	K215-P219 VanDerWaalsContact O-CA 3.31Å; K215-P219 WeakPolarHBondContact O-CA 3.41Å; K215-P219 WeakPolarHBondContact O-CD 3.4Å; K215-P219 WeakPolarHBondContact O-CG 3.47Å; K215-P219 VanDerWaalsContact O-N 3.14Å
220	H	88.3	Confident	95.4	Very high	166 Å²	166	33.3 Å²	33.3	77%	0.769	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-20.4	-174.2	-59.9	-53.2	0	0	0	114	N218 L222	N218-H220 PolarHBondContact O-N 3Å; N218-H220 VanDerWaalsContact O-N 3.16Å; N218-H220 PolarHBondContact OD1-N 3.39Å; N218-H220 VanDerWaalsContact OD1-N 3.15Å; H220-L222 PolarHBondContact O-N 2.94Å
221	I	87	Confident	95.3	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-61.1	136.5	177.2	-165.7	168.3	0	0	0	110	I181 L186 V189 L214 K215 N218 V223	I181-I221 HydrophobicContact CG2-CD1 3.62Å; L186-I221 HydrophobicContact CB-CD1 4.29Å; L186-I221 WeakPolarHBondContact O-CD1 3.5Å; L186-I221 WeakPolarHBondContact O-CG1 3.29Å; V189-I221 HydrophobicContact CB-CD1 4.2Å; V189-I221 HydrophobicContact CG1-CD1 3.92Å; V189-I221 HydrophobicContact CG1-CG1 4.4Å; L214-I221 HydrophobicContact CD1-CD1 4.34Å; L214-I221 HydrophobicContact CD1-CG2 4.22Å; L214-I221 HydrophobicContact CD2-CD1 4.29Å; L214-I221 HydrophobicContact CD2-CG2 4.17Å; L214-I221 HydrophobicContact CG-CG2 3.88Å; K215-I221 PolarHBondContact NZ-O 3.43Å; N218-I221 HydrophobicContact CB-CB 4.31Å; N218-I221 HydrophobicContact CB-CG2 4.09Å; N218-I221 WeakPolarHBondContact O-CG2 3.36Å; N218-I221 PolarHBondContact O-N 2.89Å; N218-I221 PolarHBondContact OD1-N 3.45Å; N218-I221 VanDerWaalsContact OD1-N 3.13Å; I221-V223 HydrophobicContact CG2-CG2 4.01Å
222	L	90.6	Very high	95.1	Very high	8 Å²	8	42.5 Å²	42.5	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	133.7	172.2	-61.4	178.7	0	0	0	109.8	D187 Y188 V189 H220 D246 K375 L378	D187-L222 PolarHBondContact O-N 3.23Å; Y188-L222 WeakPolarHBondContact CA-O 3.37Å; Y188-L222 HydrophobicContact CD2-CB 3.44Å; Y188-L222 VanDerWaalsContact CD2-CB 3.44Å; Y188-L222 HydrophobicContact CD2-CD1 3.88Å; Y188-L222 HydrophobicContact CD2-CG 4.3Å; Y188-L222 HydrophobicContact CE2-CB 3.83Å; Y188-L222 HydrophobicContact CE2-CD1 4.24Å; Y188-L222 HydrophobicContact CG-CB 4.22Å; V189-L222 PolarHBondContact N-O 2.83Å; H220-L222 PolarHBondContact O-N 2.94Å; L222-D246 VanDerWaalsContact CA-OD2 3.32Å; L222-D246 WeakPolarHBondContact CA-OD2 3.47Å; L222-D246 HydrophobicContact CD2-CB 4.3Å; L222-D246 WeakPolarHBondContact CD2-OD1 3.33Å; L222-K375 HydrophobicContact CD1-CB 3.82Å; L222-K375 HydrophobicContact CD1-CG 3.81Å; L222-L378 HydrophobicContact CD1-CB 4.37Å; L222-L378 HydrophobicContact CD1-CD1 4.12Å; L222-L378 HydrophobicContact CD2-CB 4.45Å; L222-L378 HydrophobicContact CD2-CD1 4.24Å
223	V	94.4	Very high	95	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.6	-175.9	-175.7	0	0	0	0	109.9	V189 L191 V211 L214 K215 I221 D246 V247	V189-V223 HydrophobicContact CG1-CG1 4.38Å; V189-V223 HydrophobicContact CG1-CG2 4.07Å; L191-V223 HydrophobicContact CD1-CG1 4Å; L191-V223 HydrophobicContact CG-CG1 4.29Å; V211-V223 HydrophobicContact CG1-CG1 4.21Å; V211-V223 HydrophobicContact CG2-CG1 4.12Å; L214-V223 HydrophobicContact CD2-CG2 3.75Å; L214-V223 HydrophobicContact CG-CG2 4.46Å; K215-V223 HydrophobicContact CD-CG2 4.39Å; I221-V223 HydrophobicContact CG2-CG2 4.01Å; V223-D246 PolarHBondContact N-OD2 3.4Å; V223-D246 PolarHBondContact O-N 3.07Å; V223-V247 PolarHBondContact O-N 2.99Å
224	E	96.4	Very high	95.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.9	166.9	177.3	172.4	133.9	0	0	109.5	Y188 V189 V190 L191 V247 A249 K289	Y188-E224 HydrophobicContact CE1-CB 3.83Å; Y188-E224 WeakPolarHBondContact OH-CB 3.2Å; Y188-E224 PolarHBondContact OH-OE2 3.29Å; V189-E224 PolarHBondContact O-N 3.39Å; V190-E224 CarbonylContact C-O 3.57Å; V190-E224 WeakPolarHBondContact CA-O 3.46Å; V190-E224 HydrophobicContact CG1-CB 4.49Å; V190-E224 HydrophobicContact CG1-CG 4.31Å; V190-E224 HydrophobicContact CG2-CB 4.14Å; V190-E224 HydrophobicContact CG2-CG 4.44Å; L191-E224 PolarHBondContact N-O 3.13Å; E224-V247 CarbonylContact C-O 3.57Å; E224-V247 WeakPolarHBondContact CA-O 3.35Å; E224-V247 HydrophobicContact CB-CB 3.95Å; E224-V247 HydrophobicContact CG-CB 3.92Å; E224-V247 HydrophobicContact CG-CG1 3.95Å; E224-A249 HydrophobicContact CG-CB 4.09Å; E224-K289 IonicContact OE1-NZ 2.62Å; E224-K289 PolarHBondContact OE1-NZ 2.97Å; E224-K289 WeakPolarHBondContact OE2-CD 3.28Å; E224-K289 IonicContact OE2-NZ 3.9Å; E224-K289 PolarHBondContact OE2-NZ 3.11Å
225	C	97.7	Very high	95.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.9	174.8	-61.1	0	0	0	0	109.1	L191 F207 V211 T227 I240 L245 V247 A249	L191-C225 CarbonylContact O-C 3.55Å; L191-C225 WeakPolarHBondContact O-CA 3.07Å; F207-C225 HydrophobicContact CD1-CB 4.33Å; F207-C225 HydrophobicContact CE1-CB 3.54Å; F207-C225 HydrophobicContact CZ-CB 4.15Å; V211-C225 WeakPolarHBondContact CG2-SG 3.43Å; C225-T227 HydrophobicContact CB-CG2 4.02Å; C225-T227 PolarHBondContact O-N 3.14Å; C225-I240 HydrophobicContact CB-CG2 4.16Å; C225-L245 HydrophobicContact CB-CD2 3.84Å; C225-V247 PolarHBondContact N-O 3.25Å; C225-A249 WeakPolarHBondContact O-CA 3.48Å; C225-A249 PolarHBondContact O-N 2.85Å; C225-A249 VanDerWaalsContact O-O 3.06Å
226	L	97.8	Very high	95.3	Very high	20 Å²	20	46.4 Å²	46.4	11%	0.105	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	100.5	168.5	175.8	57.8	0	0	0	108.9	V190 L191 T192 A249	V190-L226 HydrophobicContact CG1-CB 4.31Å; L191-L226 PolarHBondContact O-N 3.28Å; T192-L226 WeakPolarHBondContact CA-O 3.27Å; T192-L226 PolarHBondContact OG1-O 3.35Å; L226-A249 WeakPolarHBondContact CA-O 3.48Å; L226-A249 HydrophobicContact CB-CB 4.22Å; L226-A249 HydrophobicContact CD1-CB 3.99Å
227	T	98	Very high	95.4	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.043	20%	0.203	C	C	.	.			trans	-97.8	150.8	-167.9	59.9	0	0	0	0	113	C225 F230 I240 Y248 A249 H250	C225-T227 HydrophobicContact CB-CG2 4.02Å; C225-T227 PolarHBondContact O-N 3.14Å; T227-F230 HydrophobicContact CG2-CE2 4.36Å; T227-F230 HydrophobicContact CG2-CZ 4.39Å; T227-I240 HydrophobicContact CG2-CD1 3.97Å; T227-I240 HydrophobicContact CG2-CG2 3.95Å; T227-Y248 HydrophobicContact CG2-CE1 4.12Å; T227-Y248 HydrophobicContact CG2-CE2 4.32Å; T227-Y248 WeakPolarHBondContact OG1-CE1 3.43Å; T227-Y248 PolarHBondContact OG1-OH 3.43Å; T227-A249 PolarHBondContact N-O 2.71Å; T227-A249 PolarHBondContact OG1-O 3Å; T227-A249 VanDerWaalsContact OG1-O 3.08Å; T227-H250 PolarHBondContact O-ND1 2.8Å
228	P	98	Very high	95.6	Very high	12 Å²	12	39 Å²	39	8%	0.078	21%	0.206	C	C	.	.			trans	-54.5	174	156.2	-27.8	37.7	0	0	0	113.2	S193 D195 F230 H250	S193-P228 WeakPolarHBondContact OG-CD 3.42Å; S193-P228 VanDerWaalsContact OG-CG 3.3Å; S193-P228 WeakPolarHBondContact OG-CG 3.42Å; D195-P228 WeakPolarHBondContact OD1-CB 3.37Å; P228-F230 HydrophobicContact CB-CD1 4.28Å; P228-F230 HydrophobicContact CB-CE1 4.05Å; P228-F230 HydrophobicContact CB-CZ 4.21Å; P228-F230 HydrophobicContact CG-CE1 4.14Å; P228-F230 HydrophobicContact CG-CZ 4.29Å; P228-F230 WeakPolarHBondContact O-CE2 3.35Å; P228-H250 PolarHBondContact O-ND1 2.88Å
229	D	97.9	Very high	95.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.011	21%	0.212	C	C	.	.			trans	-87.9	-4.6	172.8	63.2	24.6	0	0	0	114.1	R153 R231 G232 A267 Q271 V275	R153-D229 IonicContact CZ-OD1 3.24Å; R153-D229 VanDerWaalsContact CZ-OD1 3.22Å; R153-D229 IonicContact CZ-OD2 2.94Å; R153-D229 IonicContact NH1-OD1 3.51Å; R153-D229 PolarHBondContact NH1-OD1 2.77Å; R153-D229 IonicContact NH1-OD2 3.63Å; R153-D229 PolarHBondContact NH1-OD2 2.99Å; R153-D229 IonicContact NH2-OD1 3.94Å; R153-D229 PolarHBondContact NH2-OD1 2.98Å; D229-R231 PolarHBondContact O-N 3.21Å; D229-R231 PolarHBondContact OD1-N 3.03Å; D229-G232 PolarHBondContact O-N 3.2Å; D229-A267 WeakPolarHBondContact OD2-CB 3.34Å; D229-Q271 HydrophobicContact CB-CG 4.2Å; D229-Q271 PolarHBondContact OD1-NE2 3.41Å; D229-Q271 PolarHBondContact OD2-NE2 3.44Å; D229-V275 HydrophobicContact CB-CG2 4.32Å
230	F	97.8	Very high	96.2	Very high	11 Å²	11	36.8 Å²	36.8	5%	0.048	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	48.9	28.7	-176.6	-50.9	-71.9	0	0	0	114.2	A204 T227 P228 G232 D233 A236 V237 I240	A204-F230 HydrophobicContact CB-CD1 4.4Å; A204-F230 HydrophobicContact CB-CE1 4.15Å; T227-F230 HydrophobicContact CG2-CE2 4.36Å; T227-F230 HydrophobicContact CG2-CZ 4.39Å; P228-F230 HydrophobicContact CB-CD1 4.28Å; P228-F230 HydrophobicContact CB-CE1 4.05Å; P228-F230 HydrophobicContact CB-CZ 4.21Å; P228-F230 HydrophobicContact CG-CE1 4.14Å; P228-F230 HydrophobicContact CG-CZ 4.29Å; P228-F230 WeakPolarHBondContact O-CE2 3.35Å; F230-G232 PolarHBondContact O-N 3.29Å; F230-G232 VanDerWaalsContact O-N 3.15Å; F230-D233 HydrophobicContact CB-CB 4.2Å; F230-D233 VanDerWaalsContact O-CB 3.3Å; F230-D233 WeakPolarHBondContact O-CB 3.11Å; F230-D233 PolarHBondContact O-N 2.94Å; F230-A236 HydrophobicContact CB-CB 3.75Å; F230-A236 HydrophobicContact CD1-CB 4.04Å; F230-A236 HydrophobicContact CD2-CB 4.05Å; F230-A236 HydrophobicContact CG-CB 3.66Å; F230-V237 HydrophobicContact CD2-CG2 4.01Å; F230-I240 HydrophobicContact CE1-CD1 4.06Å; F230-I240 HydrophobicContact CE2-CD1 3.6Å; F230-I240 HydrophobicContact CZ-CD1 3.18Å
231	R	95.6	Very high	96.7	Very high	161 Å²	161	28.9 Å²	28.9	61%	0.608	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	55.6	28.3	-174.4	-54.5	173	60.1	-175.2	-5	113	D197 D229	D197-R231 WeakPolarHBondContact OD1-CD 3.41Å; D197-R231 WeakPolarHBondContact OD1-CG 3.46Å; D229-R231 PolarHBondContact O-N 3.21Å; D229-R231 PolarHBondContact OD1-N 3.03Å
232	G	94.3	Very high	97.2	Very high	32 Å²	32	33.5 Å²	33.5	33%	0.33	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	79.7	11.6	-177	0	0	0	0	0	114.8	D229 F230 L234	D229-G232 PolarHBondContact O-N 3.2Å; F230-G232 PolarHBondContact O-N 3.29Å; F230-G232 VanDerWaalsContact O-N 3.15Å; G232-L234 PolarHBondContact O-N 3.42Å; G232-L234 VanDerWaalsContact O-N 3.09Å
233	D	97.8	Very high	97.5	Very high	56 Å²	56	33.6 Å²	33.6	30%	0.299	18%	0.175	S	C	.	.			trans	-68.9	104.5	172.8	-174.8	-8.2	0	0	0	110.6	F230 S235 A236 V237	F230-D233 HydrophobicContact CB-CB 4.2Å; F230-D233 VanDerWaalsContact O-CB 3.3Å; F230-D233 WeakPolarHBondContact O-CB 3.11Å; F230-D233 PolarHBondContact O-N 2.94Å; D233-S235 VanDerWaalsContact C-N 3.3Å; D233-S235 PolarHBondContact O-N 3.22Å; D233-S235 WeakPolarHBondContact OD1-CB 3.49Å; D233-S235 PolarHBondContact OD1-N 2.95Å; D233-S235 PolarHBondContact OD1-OG 2.8Å; D233-S235 PolarHBondContact OD2-OG 2.88Å; D233-A236 HydrophobicContact CB-CB 4.12Å; D233-A236 WeakPolarHBondContact O-CB 3.33Å; D233-A236 PolarHBondContact O-N 3.18Å; D233-A236 PolarHBondContact OD1-N 2.81Å; D233-V237 PolarHBondContact O-N 3.1Å
234	L	98.2	Very high	97.6	Very high	64 Å²	64	35.1 Å²	35.1	34%	0.335	19%	0.19	S	C	.	.	H	α-helix	trans	-70.4	-25.9	-179.3	-65.3	-172.1	0	0	0	113.1	G232 A236 V237 E238 T274 H278	G232-L234 PolarHBondContact O-N 3.42Å; G232-L234 VanDerWaalsContact O-N 3.09Å; L234-A236 VanDerWaalsContact C-N 3.31Å; L234-A236 PolarHBondContact O-N 2.97Å; L234-V237 WeakPolarHBondContact O-CB 3.25Å; L234-V237 PolarHBondContact O-N 2.91Å; L234-E238 WeakPolarHBondContact O-CB 3.43Å; L234-E238 PolarHBondContact O-N 2.98Å; L234-T274 HydrophobicContact CD2-CG2 4.01Å; L234-H278 HydrophobicContact CD2-CB 3.8Å; L234-H278 PolarHBondContact O-CD2 3.13Å; L234-H278 PolarHBondContact O-NE2 2.94Å
235	S	98.4	Very high	97.6	Very high	70 Å²	70	35.1 Å²	35.1	49%	0.49	19%	0.19	S	C	.	.	H	α-helix	trans	-68.4	-34.5	176.6	74.5	0	0	0	0	111.6	D233 K239	D233-S235 VanDerWaalsContact C-N 3.3Å; D233-S235 PolarHBondContact O-N 3.22Å; D233-S235 WeakPolarHBondContact OD1-CB 3.49Å; D233-S235 PolarHBondContact OD1-N 2.95Å; D233-S235 PolarHBondContact OD1-OG 2.8Å; D233-S235 PolarHBondContact OD2-OG 2.88Å; S235-K239 WeakPolarHBondContact O-CB 3.43Å; S235-K239 PolarHBondContact O-N 3.27Å
236	A	98.4	Very high	97.5	Very high	1 Å²	1	36 Å²	36	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-43.8	171.5	0	0	0	0	0	111.7	A204 F230 D233 L234 K239 I240	A204-A236 HydrophobicContact CB-CB 3.54Å; F230-A236 HydrophobicContact CB-CB 3.75Å; F230-A236 HydrophobicContact CD1-CB 4.04Å; F230-A236 HydrophobicContact CD2-CB 4.05Å; F230-A236 HydrophobicContact CG-CB 3.66Å; D233-A236 HydrophobicContact CB-CB 4.12Å; D233-A236 WeakPolarHBondContact O-CB 3.33Å; D233-A236 PolarHBondContact O-N 3.18Å; D233-A236 PolarHBondContact OD1-N 2.81Å; L234-A236 VanDerWaalsContact C-N 3.31Å; L234-A236 PolarHBondContact O-N 2.97Å; A236-K239 PolarHBondContact O-N 2.83Å; A236-I240 PolarHBondContact O-N 2.86Å
237	V	98.4	Very high	97.4	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-48.1	175.5	175.1	0	0	0	0	111.2	F230 D233 L234 K239 I240 A241 Y248 V275 H278 A279	F230-V237 HydrophobicContact CD2-CG2 4.01Å; D233-V237 PolarHBondContact O-N 3.1Å; L234-V237 WeakPolarHBondContact O-CB 3.25Å; L234-V237 PolarHBondContact O-N 2.91Å; V237-K239 PolarHBondContact O-N 3.19Å; V237-I240 PolarHBondContact O-N 3.21Å; V237-A241 WeakPolarHBondContact O-CB 3.1Å; V237-A241 PolarHBondContact O-N 3.46Å; V237-Y248 HydrophobicContact CG1-CE2 4.22Å; V237-V275 HydrophobicContact CG1-CG1 4.42Å; V237-V275 HydrophobicContact CG2-CB 4.32Å; V237-V275 HydrophobicContact CG2-CG1 3.96Å; V237-V275 HydrophobicContact CG2-CG2 4Å; V237-H278 HydrophobicContact CG1-CB 4.26Å; V237-A279 HydrophobicContact CG1-CB 4.08Å
238	E	98.5	Very high	97.4	Very high	88 Å²	88	34.7 Å²	34.7	41%	0.411	19%	0.188	S	C	.	.	H	α-helix	trans	-56.4	-49.4	177.7	169.5	168.1	-170.9	0	0	111.3	L234 I240 A241 L242 V282	L234-E238 WeakPolarHBondContact O-CB 3.43Å; L234-E238 PolarHBondContact O-N 2.98Å; E238-I240 VanDerWaalsContact C-N 3.3Å; E238-I240 PolarHBondContact O-N 2.97Å; E238-A241 PolarHBondContact O-N 2.98Å; E238-L242 HydrophobicContact CG-CD1 3.82Å; E238-L242 HydrophobicContact CG-CG 4.46Å; E238-L242 WeakPolarHBondContact O-CG 3.19Å; E238-L242 PolarHBondContact O-N 3.1Å; E238-V282 HydrophobicContact CB-CG1 4.21Å; E238-V282 HydrophobicContact CB-CG2 3.97Å; E238-V282 HydrophobicContact CG-CG1 3.76Å; E238-V282 HydrophobicContact CG-CG2 4.11Å
239	K	98.6	Very high	97.4	Very high	72 Å²	72	34.2 Å²	34.2	31%	0.313	19%	0.185	S	C	.	.	H	α-helix	trans	-54.9	-45.7	-180	-174.4	-178.8	-63.7	-169.4	0	112.2	D201 A204 E205 A208 S235 A236 V237 S243	D201-K239 IonicContact OD2-NZ 3.7Å; A204-K239 HydrophobicContact CB-CD 4.46Å; E205-K239 HydrophobicContact CB-CD 4.28Å; E205-K239 VanDerWaalsContact OE2-CD 3.29Å; E205-K239 WeakPolarHBondContact OE2-CD 3.4Å; E205-K239 WeakPolarHBondContact OE2-CE 3.41Å; E205-K239 IonicContact OE2-NZ 3.39Å; E205-K239 PolarHBondContact OE2-NZ 2.84Å; A208-K239 HydrophobicContact CB-CD 4.38Å; A208-K239 HydrophobicContact CB-CG 3.96Å; S235-K239 WeakPolarHBondContact O-CB 3.43Å; S235-K239 PolarHBondContact O-N 3.27Å; A236-K239 PolarHBondContact O-N 2.83Å; V237-K239 PolarHBondContact O-N 3.19Å; K239-S243 PolarHBondContact O-N 3.3Å
240	I	98.1	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-43.2	179.3	-64.6	169.7	0	0	0	110.7	A204 F207 C225 T227 F230 A236 V237 E238 L242 S243 L245 Y248	A204-I240 HydrophobicContact CB-CD1 4.02Å; A204-I240 HydrophobicContact CB-CG1 4.21Å; F207-I240 HydrophobicContact CB-CD1 3.99Å; F207-I240 HydrophobicContact CB-CG1 4.18Å; F207-I240 HydrophobicContact CG-CD1 4.22Å; C225-I240 HydrophobicContact CB-CG2 4.16Å; T227-I240 HydrophobicContact CG2-CD1 3.97Å; T227-I240 HydrophobicContact CG2-CG2 3.95Å; F230-I240 HydrophobicContact CE1-CD1 4.06Å; F230-I240 HydrophobicContact CE2-CD1 3.6Å; F230-I240 HydrophobicContact CZ-CD1 3.18Å; A236-I240 PolarHBondContact O-N 2.86Å; V237-I240 PolarHBondContact O-N 3.21Å; E238-I240 VanDerWaalsContact C-N 3.3Å; E238-I240 PolarHBondContact O-N 2.97Å; I240-L242 PolarHBondContact O-N 3.2Å; I240-S243 VanDerWaalsContact O-CB 3.26Å; I240-S243 WeakPolarHBondContact O-CB 3.37Å; I240-S243 PolarHBondContact O-N 3.36Å; I240-S243 PolarHBondContact O-OG 3.46Å; I240-L245 HydrophobicContact CG2-CD2 3.57Å; I240-L245 WeakPolarHBondContact O-CD2 3.39Å; I240-Y248 HydrophobicContact CB-CE2 4.07Å; I240-Y248 HydrophobicContact CG2-CD2 4.41Å; I240-Y248 HydrophobicContact CG2-CE2 3.88Å
241	A	98.1	Very high	97.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.3	-38.3	178.1	0	0	0	0	0	112.1	V237 E238 Y248 A279 V282 K283	V237-A241 WeakPolarHBondContact O-CB 3.1Å; V237-A241 PolarHBondContact O-N 3.46Å; E238-A241 PolarHBondContact O-N 2.98Å; A241-Y248 HydrophobicContact CB-CD2 4.07Å; A241-Y248 HydrophobicContact CB-CE2 4.2Å; A241-A279 HydrophobicContact CB-CB 4.41Å; A241-V282 HydrophobicContact CB-CG1 4.18Å; A241-K283 HydrophobicContact CB-CB 4.47Å; A241-K283 WeakPolarHBondContact O-CD 3.29Å
242	L	98.2	Very high	97.6	Very high	98 Å²	98	26.6 Å²	26.6	51%	0.513	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.9	179.9	-62.5	177.7	0	0	0	114.8	E238 I240 G244 V282	E238-L242 HydrophobicContact CG-CD1 3.82Å; E238-L242 HydrophobicContact CG-CG 4.46Å; E238-L242 WeakPolarHBondContact O-CG 3.19Å; E238-L242 PolarHBondContact O-N 3.1Å; I240-L242 PolarHBondContact O-N 3.2Å; L242-G244 PolarHBondContact O-N 2.84Å; L242-V282 HydrophobicContact CD1-CG1 3.99Å; L242-V282 HydrophobicContact CD2-CG1 3.74Å; L242-V282 HydrophobicContact CG-CG1 3.66Å
243	S	97.9	Very high	97.8	Very high	11 Å²	11	26.5 Å²	26.5	8%	0.077	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-10.3	-175.6	66.6	0	0	0	0	116	V211 T212 K239 I240	V211-S243 WeakPolarHBondContact CG1-OG 3.16Å; T212-S243 PolarHBondContact OG1-O 3.39Å; T212-S243 VanDerWaalsContact OG1-O 3.12Å; K239-S243 PolarHBondContact O-N 3.3Å; I240-S243 VanDerWaalsContact O-CB 3.26Å; I240-S243 WeakPolarHBondContact O-CB 3.37Å; I240-S243 PolarHBondContact O-N 3.36Å; I240-S243 PolarHBondContact O-OG 3.46Å
244	G	95.8	Very high	97.9	Very high	31 Å²	31	23.8 Å²	23.8	32%	0.32	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.9	3	-176.5	0	0	0	0	0	114.7	K215 L242	K215-G244 WeakPolarHBondContact CE-O 3.48Å; L242-G244 PolarHBondContact O-N 2.84Å
245	L	96.7	Very high	97.9	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	12%	0.117	C	C	.	.			trans	-57.4	157.3	175	67.2	82.3	0	0	0	113.2	V211 C225 I240 Y248 K283 V286	V211-L245 HydrophobicContact CG1-CB 4.22Å; C225-L245 HydrophobicContact CB-CD2 3.84Å; I240-L245 HydrophobicContact CG2-CD2 3.57Å; I240-L245 WeakPolarHBondContact O-CD2 3.39Å; L245-Y248 HydrophobicContact CD2-CD2 3.9Å; L245-K283 PolarHBondContact O-NZ 2.86Å; L245-V286 HydrophobicContact CD1-CG2 3.57Å
246	D	95.2	Very high	97.9	Very high	18 Å²	18	21.3 Å²	21.3	10%	0.096	11%	0.108	C	C	.	.	S	Bend	trans	-100.8	-31.8	177.2	-53.5	-97.7	0	0	0	112.3	K215 L222 V223 L378 K382	K215-D246 IonicContact NZ-OD1 2.77Å; K215-D246 IonicContact NZ-OD2 3.68Å; K215-D246 PolarHBondContact NZ-OD2 3.06Å; L222-D246 VanDerWaalsContact CA-OD2 3.32Å; L222-D246 WeakPolarHBondContact CA-OD2 3.47Å; L222-D246 HydrophobicContact CD2-CB 4.3Å; L222-D246 WeakPolarHBondContact CD2-OD1 3.33Å; V223-D246 PolarHBondContact N-OD2 3.4Å; V223-D246 PolarHBondContact O-N 3.07Å; D246-L378 HydrophobicContact CB-CD1 3.82Å; D246-K382 IonicContact OD1-NZ 2.77Å; D246-K382 PolarHBondContact OD1-NZ 3.12Å; D246-K382 VanDerWaalsContact OD1-NZ 3.1Å
247	V	96.5	Very high	97.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.9	178.8	-174.7	0	0	0	0	110.8	V223 E224 C225 L287 K289 L374 L378	V223-V247 PolarHBondContact O-N 2.99Å; E224-V247 CarbonylContact C-O 3.57Å; E224-V247 WeakPolarHBondContact CA-O 3.35Å; E224-V247 HydrophobicContact CB-CB 3.95Å; E224-V247 HydrophobicContact CG-CB 3.92Å; E224-V247 HydrophobicContact CG-CG1 3.95Å; C225-V247 PolarHBondContact N-O 3.25Å; V247-L287 CarbonylContact C-O 3.51Å; V247-L287 WeakPolarHBondContact CA-O 3.32Å; V247-L287 HydrophobicContact CG1-CB 4.34Å; V247-L287 HydrophobicContact CG2-CB 4.22Å; V247-L287 HydrophobicContact CG2-CD1 4.49Å; V247-K289 HydrophobicContact CG1-CB 4Å; V247-K289 HydrophobicContact CG1-CD 4.4Å; V247-L374 HydrophobicContact CG2-CD1 4.4Å; V247-L374 HydrophobicContact CG2-CD2 4.38Å; V247-L378 HydrophobicContact CG2-CD1 4.04Å
248	Y	98.1	Very high	97.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.1	174.1	-163	-68.1	0	0	0	109.2	T227 V237 I240 A241 L245 V275 A279 L287 T288 K289	T227-Y248 HydrophobicContact CG2-CE1 4.12Å; T227-Y248 HydrophobicContact CG2-CE2 4.32Å; T227-Y248 WeakPolarHBondContact OG1-CE1 3.43Å; T227-Y248 PolarHBondContact OG1-OH 3.43Å; V237-Y248 HydrophobicContact CG1-CE2 4.22Å; I240-Y248 HydrophobicContact CB-CE2 4.07Å; I240-Y248 HydrophobicContact CG2-CD2 4.41Å; I240-Y248 HydrophobicContact CG2-CE2 3.88Å; A241-Y248 HydrophobicContact CB-CD2 4.07Å; A241-Y248 HydrophobicContact CB-CE2 4.2Å; L245-Y248 HydrophobicContact CD2-CD2 3.9Å; Y248-V275 HydrophobicContact CE1-CG1 3.78Å; Y248-A279 HydrophobicContact CD1-CB 3.78Å; Y248-A279 HydrophobicContact CD2-CB 3.63Å; Y248-A279 HydrophobicContact CE1-CB 4.11Å; Y248-A279 HydrophobicContact CE2-CB 3.95Å; Y248-A279 HydrophobicContact CG-CB 3.56Å; Y248-L287 PolarHBondContact N-O 3.48Å; Y248-T288 CarbonylContact O-C 3.53Å; Y248-T288 WeakPolarHBondContact O-CA 3.29Å; Y248-K289 PolarHBondContact O-N 2.9Å
249	A	97.9	Very high	97.8	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.008	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140	179.1	0	0	0	0	0	111.5	E224 C225 L226 T227 K289	E224-A249 HydrophobicContact CG-CB 4.09Å; C225-A249 WeakPolarHBondContact O-CA 3.48Å; C225-A249 PolarHBondContact O-N 2.85Å; C225-A249 VanDerWaalsContact O-O 3.06Å; L226-A249 WeakPolarHBondContact CA-O 3.48Å; L226-A249 HydrophobicContact CB-CB 4.22Å; L226-A249 HydrophobicContact CD1-CB 3.99Å; T227-A249 PolarHBondContact N-O 2.71Å; T227-A249 PolarHBondContact OG1-O 3Å; T227-A249 VanDerWaalsContact OG1-O 3.08Å; A249-K289 VanDerWaalsContact CA-O 3.26Å; A249-K289 WeakPolarHBondContact CA-O 3.5Å; A249-K289 HydrophobicContact CB-CB 4.05Å
250	H	98.4	Very high	97.7	Very high	5 Å²	5	30.5 Å²	30.5	2%	0.023	14%	0.144	C	C	.	.			trans	-151.2	125.8	167.4	-179.7	73.1	0	0	0	108.6	T227 P228 S272 V275 L276 K289 T290	T227-H250 PolarHBondContact O-ND1 2.8Å; P228-H250 PolarHBondContact O-ND1 2.88Å; H250-S272 VanDerWaalsContact CD2-CB 3.49Å; H250-S272 WeakPolarHBondContact CD2-CB 3.47Å; H250-S272 WeakPolarHBondContact NE2-CA 3.26Å; H250-S272 VanDerWaalsContact NE2-CB 3.26Å; H250-S272 WeakPolarHBondContact NE2-CB 3.31Å; H250-S272 PolarHBondContact NE2-OG 3.46Å; H250-V275 HydrophobicContact CB-CG1 3.99Å; H250-L276 HydrophobicContact CB-CD2 3.77Å; H250-L276 HydrophobicContact CB-CG 4.09Å; H250-K289 PolarHBondContact N-O 2.74Å; H250-T290 WeakPolarHBondContact O-CA 3.41Å; H250-T290 VanDerWaalsContact O-CB 3.31Å; H250-T290 WeakPolarHBondContact O-CB 3.08Å; H250-T290 PolarHBondContact O-OG1 2.99Å
251	N	98.4	Very high	97.7	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.048	16%	0.162	C	C	.	.			trans	-89.6	128.6	-174.7	-67.6	-14.3	0	0	0	111.5	E253 R263 T290 S291	N251-E253 VanDerWaalsContact C-N 3.25Å; N251-E253 HydrophobicContact CB-CG 3.93Å; N251-E253 WeakPolarHBondContact CB-OE1 3.44Å; N251-E253 PolarHBondContact ND2-OE1 3.07Å; N251-R263 PolarHBondContact O-NH2 3.29Å; N251-T290 WeakPolarHBondContact CA-OG1 3.45Å; N251-S291 WeakPolarHBondContact OD1-CB 3.16Å; N251-S291 PolarHBondContact OD1-N 3.45Å
252	V	98.4	Very high	97.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.162	C	C	.	.			trans	-75.6	-19.6	166.9	-62.2	0	0	0	0	112.1	T254 Q259 F269 T290 I292 L310	V252-T254 PolarHBondContact O-N 3.13Å; V252-Q259 PolarHBondContact O-NE2 2.97Å; V252-F269 HydrophobicContact CB-CD2 4.1Å; V252-F269 HydrophobicContact CB-CE2 3.9Å; V252-F269 HydrophobicContact CG1-CD2 4.3Å; V252-F269 HydrophobicContact CG1-CE2 4.01Å; V252-F269 HydrophobicContact CG2-CE2 4.15Å; V252-T290 PolarHBondContact N-OG1 3.04Å; V252-T290 VanDerWaalsContact N-OG1 3.12Å; V252-I292 HydrophobicContact CG2-CD1 4.42Å; V252-I292 HydrophobicContact CG2-CG1 3.8Å; V252-L310 HydrophobicContact CG1-CD2 3.92Å; V252-L310 HydrophobicContact CG2-CD1 4.35Å; V252-L310 HydrophobicContact CG2-CD2 4.4Å
253	E	98.4	Very high	97.7	Very high	30 Å²	30	31.2 Å²	31.2	14%	0.14	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	65.9	-39.2	175.3	-52.5	-63.6	-174.3	0	0	116	F157 N251 R263 S291 M293	F157-E253 HydrophobicContact CE1-CB 4.41Å; F157-E253 HydrophobicContact CE1-CG 4.1Å; F157-E253 HydrophobicContact CZ-CB 4.46Å; F157-E253 HydrophobicContact CZ-CG 3.84Å; N251-E253 VanDerWaalsContact C-N 3.25Å; N251-E253 HydrophobicContact CB-CG 3.93Å; N251-E253 WeakPolarHBondContact CB-OE1 3.44Å; N251-E253 PolarHBondContact ND2-OE1 3.07Å; E253-R263 HydrophobicContact CB-CG 4.31Å; E253-R263 HydrophobicContact CG-CG 4.45Å; E253-S291 WeakPolarHBondContact CA-O 3.26Å; E253-S291 PolarHBondContact N-O 3.49Å; E253-M293 HydrophobicContact CB-CE 3.8Å; E253-M293 HydrophobicContact CG-CE 4.38Å; E253-M293 PolarHBondContact O-N 3.42Å
254	T	98.6	Very high	97.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-156.6	176.2	-177.9	-165.8	0	0	0	0	111.1	V252 L258 Q259 V262	V252-T254 PolarHBondContact O-N 3.13Å; T254-L258 HydrophobicContact CG2-CB 3.79Å; T254-Q259 PolarHBondContact O-NE2 3.1Å; T254-V262 HydrophobicContact CG2-CB 3.82Å; T254-V262 HydrophobicContact CG2-CG1 4.07Å; T254-V262 HydrophobicContact CG2-CG2 3.96Å
255	V	98.7	Very high	97.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.156	C	C	.	.			trans	-67.3	158.1	177.3	-56.3	0	0	0	0	112	E257 L258 Q259 E298 Q302 I303 T306	V255-E257 WeakPolarHBondContact CG2-OE2 3.35Å; V255-E257 PolarHBondContact O-N 2.87Å; V255-E257 VanDerWaalsContact O-N 3.14Å; V255-L258 HydrophobicContact CG2-CB 4.1Å; V255-L258 HydrophobicContact CG2-CD1 4.04Å; V255-L258 HydrophobicContact CG2-CG 3.8Å; V255-L258 PolarHBondContact O-N 2.76Å; V255-Q259 PolarHBondContact O-N 3.11Å; V255-E298 HydrophobicContact CB-CB 4.49Å; V255-E298 HydrophobicContact CG1-CB 3.81Å; V255-E298 HydrophobicContact CG1-CG 4.35Å; V255-E298 HydrophobicContact CG2-CB 3.79Å; V255-Q302 HydrophobicContact CB-CB 4.03Å; V255-Q302 HydrophobicContact CG1-CB 3.85Å; V255-Q302 HydrophobicContact CG2-CB 4.13Å; V255-I303 HydrophobicContact CG1-CD1 3.64Å; V255-I303 HydrophobicContact CG1-CG1 4.24Å; V255-T306 WeakPolarHBondContact CG1-OG1 3.38Å
256	R	97.9	Very high	97.8	Very high	82 Å²	82	39.3 Å²	39.3	31%	0.309	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-49.9	-41.5	-176.5	-177.7	176.1	-71.2	-78.5	5.5	113.3	L258 Q259 F269 D270 E309	R256-L258 VanDerWaalsContact C-N 3.29Å; R256-L258 PolarHBondContact O-N 2.92Å; R256-Q259 WeakPolarHBondContact O-CG 3.49Å; R256-Q259 PolarHBondContact O-N 3.29Å; R256-F269 HydrophobicContact CB-CG 4.46Å; R256-F269 HydrophobicContact CG-CB 4.48Å; R256-D270 IonicContact CZ-OD1 2.97Å; R256-D270 VanDerWaalsContact CZ-OD1 3.25Å; R256-D270 IonicContact CZ-OD2 3.91Å; R256-D270 IonicContact NH1-OD1 3.02Å; R256-D270 PolarHBondContact NH1-OD1 3.07Å; R256-D270 IonicContact NH1-OD2 3.56Å; R256-D270 PolarHBondContact NH1-OD2 3.2Å; R256-D270 IonicContact NH2-OD1 3.11Å; R256-D270 PolarHBondContact NH2-OD1 3.37Å; R256-E309 IonicContact CZ-OE2 2.86Å; R256-E309 IonicContact NE-OE1 3.46Å; R256-E309 IonicContact NE-OE2 3.68Å; R256-E309 IonicContact NH2-OE1 3.22Å; R256-E309 IonicContact NH2-OE2 2.64Å; R256-E309 PolarHBondContact NH2-OE2 3.3Å
257	E	98.2	Very high	97.9	Very high	104 Å²	104	38.7 Å²	38.7	49%	0.486	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-69.9	-25.6	-175.6	-60.3	88.3	159	0	0	113.3	V255 Q302	V255-E257 WeakPolarHBondContact CG2-OE2 3.35Å; V255-E257 PolarHBondContact O-N 2.87Å; V255-E257 VanDerWaalsContact O-N 3.14Å; E257-Q302 WeakPolarHBondContact OE1-CG 3.31Å; E257-Q302 PolarHBondContact OE1-NE2 2.75Å
258	L	98.4	Very high	97.9	Very high	30 Å²	30	41.6 Å²	41.6	16%	0.157	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-98.8	-6.9	-177.3	-64.5	-174.4	0	0	0	113.3	T254 V255 R256 R260 Y261 V262 L296 E298	T254-L258 HydrophobicContact CG2-CB 3.79Å; V255-L258 HydrophobicContact CG2-CB 4.1Å; V255-L258 HydrophobicContact CG2-CD1 4.04Å; V255-L258 HydrophobicContact CG2-CG 3.8Å; V255-L258 PolarHBondContact O-N 2.76Å; R256-L258 VanDerWaalsContact C-N 3.29Å; R256-L258 PolarHBondContact O-N 2.92Å; L258-R260 PolarHBondContact O-N 3.33Å; L258-Y261 CarbonylContact O-C 3.59Å; L258-Y261 WeakPolarHBondContact O-CA 3.2Å; L258-Y261 WeakPolarHBondContact O-CB 3.45Å; L258-Y261 PolarHBondContact O-N 3.31Å; L258-V262 HydrophobicContact CB-CG2 3.96Å; L258-V262 WeakPolarHBondContact O-CB 3.39Å; L258-V262 WeakPolarHBondContact O-CG2 3.47Å; L258-V262 PolarHBondContact O-N 3.49Å; L258-L296 HydrophobicContact CD1-CB 4.17Å; L258-E298 HydrophobicContact CD1-CB 4.02Å
259	Q	98.1	Very high	97.9	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-48.3	-57	-176	-70.9	-71.5	-41.3	0	0	113.1	V252 T254 V255 R256 Y261 V262 R263 F269	V252-Q259 PolarHBondContact O-NE2 2.97Å; T254-Q259 PolarHBondContact O-NE2 3.1Å; V255-Q259 PolarHBondContact O-N 3.11Å; R256-Q259 WeakPolarHBondContact O-CG 3.49Å; R256-Q259 PolarHBondContact O-N 3.29Å; Q259-Y261 PolarHBondContact O-N 2.96Å; Q259-V262 PolarHBondContact O-N 2.65Å; Q259-R263 PolarHBondContact O-N 2.82Å; Q259-F269 HydrophobicContact CG-CB 3.91Å
260	R	96.4	Very high	98	Very high	212 Å²	212	45.5 Å²	45.5	80%	0.8	21%	0.207	S	C	*	.	H	α-helix	trans	-66.9	-24.1	-178.3	-170.9	175.7	-177.6	-172.9	2.1	113.2	L258	L258-R260 PolarHBondContact O-N 3.33Å
261	Y	97.1	Very high	97.9	Very high	97 Å²	97	46.9 Å²	46.9	38%	0.38	21%	0.214	S	C	.	.	H	α-helix	trans	-83.1	-30.7	177.2	-177.6	-102.7	0	0	0	112	R156 L258 Q259 L331	R156-Y261 VanDerWaalsContact CD-O 3.29Å; R156-Y261 WeakPolarHBondContact CD-O 3.3Å; R156-Y261 PolarHBondContact NH1-O 2.85Å; L258-Y261 CarbonylContact O-C 3.59Å; L258-Y261 WeakPolarHBondContact O-CA 3.2Å; L258-Y261 WeakPolarHBondContact O-CB 3.45Å; L258-Y261 PolarHBondContact O-N 3.31Å; Q259-Y261 PolarHBondContact O-N 2.96Å; Y261-L331 HydrophobicContact CD1-CD1 4.34Å; Y261-L331 HydrophobicContact CD1-CD2 4.22Å; Y261-L331 HydrophobicContact CE1-CD1 4.21Å; Y261-L331 HydrophobicContact CE1-CD2 3.53Å; Y261-L331 HydrophobicContact CE1-CG 4.46Å; Y261-L331 HydrophobicContact CE2-CD2 4.43Å
262	V	98.2	Very high	97.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-97.7	-48.3	-172.1	174.4	0	0	0	0	112.7	R156 F157 T254 L258 Q259 L296 L331	R156-V262 PolarHBondContact N-O 2.73Å; F157-V262 HydrophobicContact CB-CG1 4.41Å; F157-V262 HydrophobicContact CD1-CG1 3.65Å; F157-V262 HydrophobicContact CE1-CG1 4.34Å; F157-V262 HydrophobicContact CG-CG1 4.37Å; T254-V262 HydrophobicContact CG2-CB 3.82Å; T254-V262 HydrophobicContact CG2-CG1 4.07Å; T254-V262 HydrophobicContact CG2-CG2 3.96Å; L258-V262 HydrophobicContact CB-CG2 3.96Å; L258-V262 WeakPolarHBondContact O-CB 3.39Å; L258-V262 WeakPolarHBondContact O-CG2 3.47Å; L258-V262 PolarHBondContact O-N 3.49Å; Q259-V262 PolarHBondContact O-N 2.65Å; V262-L296 HydrophobicContact CG1-CD1 3.87Å; V262-L296 HydrophobicContact CG2-CB 4.45Å; V262-L296 HydrophobicContact CG2-CD1 3.99Å; V262-L296 HydrophobicContact CG2-CD2 4.39Å; V262-L331 HydrophobicContact CB-CD1 4.24Å; V262-L331 HydrophobicContact CG1-CD1 4.34Å; V262-L331 HydrophobicContact CG2-CD1 3.93Å
263	R	98.5	Very high	97.9	Very high	15 Å²	15	46.9 Å²	46.9	6%	0.057	21%	0.214	C	C	.	.	S	Bend	trans	-98.8	167.2	-174.2	-58.7	172.8	79	-166.4	5.4	110.8	F157 N251 E253 Q259 A267 S272	F157-R263 HydrophobicContact CE1-CG 4.13Å; N251-R263 PolarHBondContact O-NH2 3.29Å; E253-R263 HydrophobicContact CB-CG 4.31Å; E253-R263 HydrophobicContact CG-CG 4.45Å; Q259-R263 PolarHBondContact O-N 2.82Å; R263-A267 HydrophobicContact CB-CB 4.16Å; R263-S272 PolarHBondContact NH1-OG 2.88Å; R263-S272 PolarHBondContact NH2-OG 2.97Å
264	D	98.1	Very high	97.9	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.064	23%	0.227	C	C	.	.			trans	-56.6	140.6	170.6	-173.3	-75.2	0	0	0	110.1	R153 G154 C155 R266 A267	R153-D264 WeakPolarHBondContact CA-OD2 2.87Å; R153-D264 HydrophobicContact CB-CB 3.87Å; R153-D264 HydrophobicContact CG-CB 4.34Å; G154-D264 PolarHBondContact N-OD2 2.84Å; C155-D264 PolarHBondContact SG-N 2.86Å; C155-D264 VanDerWaalsContact SG-N 3.36Å; D264-R266 PolarHBondContact O-N 3.14Å; D264-R266 WeakPolarHBondContact OD1-CB 3.33Å; D264-R266 IonicContact OD1-CZ 3.04Å; D264-R266 PolarHBondContact OD1-N 3.33Å; D264-R266 IonicContact OD1-NE 3.52Å; D264-R266 PolarHBondContact OD1-NE 3.2Å; D264-R266 IonicContact OD1-NH2 3.86Å; D264-R266 PolarHBondContact OD1-NH2 3.27Å; D264-R266 IonicContact OD2-CZ 2.71Å; D264-R266 IonicContact OD2-NE 2.82Å; D264-R266 IonicContact OD2-NH2 3.44Å; D264-R266 PolarHBondContact OD2-NH2 2.94Å; D264-A267 PolarHBondContact O-N 3.41Å
265	P	96.8	Very high	97.9	Very high	102 Å²	102	48.6 Å²	48.6	66%	0.662	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.7	-178	-26.8	35.2	0	0	0	115.7	A267	P265-A267 VanDerWaalsContact C-N 3.31Å
266	R	96.9	Very high	97.9	Very high	100 Å²	100	48.6 Å²	48.6	38%	0.377	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-16.1	174.4	-69.8	166.2	-79	-173	-11.3	113.4	T152 D197 D264 Q271	T152-R266 PolarHBondContact O-NH1 3.48Å; T152-R266 VanDerWaalsContact O-NH1 3.13Å; T152-R266 PolarHBondContact O-NH2 3.42Å; D197-R266 IonicContact OD2-CZ 2.76Å; D197-R266 IonicContact OD2-NE 3.54Å; D197-R266 IonicContact OD2-NH1 2.94Å; D197-R266 PolarHBondContact OD2-NH1 3.43Å; D264-R266 PolarHBondContact O-N 3.14Å; D264-R266 WeakPolarHBondContact OD1-CB 3.33Å; D264-R266 IonicContact OD1-CZ 3.04Å; D264-R266 PolarHBondContact OD1-N 3.33Å; D264-R266 IonicContact OD1-NE 3.52Å; D264-R266 PolarHBondContact OD1-NE 3.2Å; D264-R266 IonicContact OD1-NH2 3.86Å; D264-R266 PolarHBondContact OD1-NH2 3.27Å; D264-R266 IonicContact OD2-CZ 2.71Å; D264-R266 IonicContact OD2-NE 2.82Å; D264-R266 IonicContact OD2-NH2 3.44Å; D264-R266 PolarHBondContact OD2-NH2 2.94Å; R266-Q271 PolarHBondContact O-NE2 3.21Å; R266-Q271 VanDerWaalsContact O-NE2 3.16Å
267	A	97.6	Very high	97.9	Very high	6 Å²	6	48.7 Å²	48.7	5%	0.05	23%	0.229	C	C	.	.			trans	-98.2	142.2	175.9	0	0	0	0	0	110.8	D229 R263 D264 P265	D229-A267 WeakPolarHBondContact OD2-CB 3.34Å; R263-A267 HydrophobicContact CB-CB 4.16Å; D264-A267 PolarHBondContact O-N 3.41Å; P265-A267 VanDerWaalsContact C-N 3.31Å
268	N	97.2	Very high	98	Very high	61 Å²	61	45.1 Å²	45.1	33%	0.326	21%	0.213	S	C	.	.			trans	-149.5	166.2	174.4	69.5	78.1	0	0	0	111.3	D270 Q271 S272	N268-D270 PolarHBondContact OD1-N 3.31Å; N268-D270 VanDerWaalsContact OD1-N 3.15Å; N268-Q271 WeakPolarHBondContact ND2-CB 2.87Å; N268-Q271 WeakPolarHBondContact OD1-CB 3.41Å; N268-Q271 PolarHBondContact OD1-N 3.48Å; N268-S272 WeakPolarHBondContact O-CB 2.92Å; N268-S272 PolarHBondContact O-N 2.96Å; N268-S272 VanDerWaalsContact O-N 3.1Å; N268-S272 PolarHBondContact O-OG 3.49Å
269	F	98.3	Very high	97.9	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-46.8	-174.7	-166.9	-92.3	0	0	0	112.6	V252 R256 Q259 Q271 S272 L273 T306 E309	V252-F269 HydrophobicContact CB-CD2 4.1Å; V252-F269 HydrophobicContact CB-CE2 3.9Å; V252-F269 HydrophobicContact CG1-CD2 4.3Å; V252-F269 HydrophobicContact CG1-CE2 4.01Å; V252-F269 HydrophobicContact CG2-CE2 4.15Å; R256-F269 HydrophobicContact CB-CG 4.46Å; R256-F269 HydrophobicContact CG-CB 4.48Å; Q259-F269 HydrophobicContact CG-CB 3.91Å; F269-Q271 PolarHBondContact O-N 2.94Å; F269-S272 WeakPolarHBondContact O-CB 3.31Å; F269-S272 PolarHBondContact O-N 2.99Å; F269-S272 VanDerWaalsContact O-N 3.14Å; F269-L273 HydrophobicContact CE1-CD2 4.37Å; F269-L273 WeakPolarHBondContact O-CB 3.42Å; F269-L273 PolarHBondContact O-N 3.37Å; F269-T306 HydrophobicContact CE2-CG2 3.65Å; F269-T306 HydrophobicContact CZ-CG2 3.85Å; F269-E309 HydrophobicContact CE1-CB 4.1Å; F269-E309 HydrophobicContact CZ-CB 4.36Å
270	D	98.3	Very high	97.8	Very high	80 Å²	80	45.7 Å²	45.7	43%	0.428	21%	0.214	S	C	.	.	H	α-helix	trans	-65.8	-39.9	-176.1	-62.7	-43.4	0	0	0	112.2	R256 N268 S272 L273 T274	R256-D270 IonicContact CZ-OD1 2.97Å; R256-D270 VanDerWaalsContact CZ-OD1 3.25Å; R256-D270 IonicContact CZ-OD2 3.91Å; R256-D270 IonicContact NH1-OD1 3.02Å; R256-D270 PolarHBondContact NH1-OD1 3.07Å; R256-D270 IonicContact NH1-OD2 3.56Å; R256-D270 PolarHBondContact NH1-OD2 3.2Å; R256-D270 IonicContact NH2-OD1 3.11Å; R256-D270 PolarHBondContact NH2-OD1 3.37Å; N268-D270 PolarHBondContact OD1-N 3.31Å; N268-D270 VanDerWaalsContact OD1-N 3.15Å; D270-S272 VanDerWaalsContact C-N 3.34Å; D270-L273 PolarHBondContact O-N 3.2Å; D270-T274 VanDerWaalsContact O-CB 3.29Å; D270-T274 WeakPolarHBondContact O-CB 3.42Å; D270-T274 PolarHBondContact O-N 2.59Å; D270-T274 PolarHBondContact O-OG1 3.22Å
271	Q	98.3	Very high	97.9	Very high	34 Å²	34	42.1 Å²	42.1	16%	0.159	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-45.2	172.6	-178.8	171.3	-77.7	0	0	111.1	D229 R266 N268 F269 L273 T274 V275	D229-Q271 HydrophobicContact CB-CG 4.2Å; D229-Q271 PolarHBondContact OD1-NE2 3.41Å; D229-Q271 PolarHBondContact OD2-NE2 3.44Å; R266-Q271 PolarHBondContact O-NE2 3.21Å; R266-Q271 VanDerWaalsContact O-NE2 3.16Å; N268-Q271 WeakPolarHBondContact ND2-CB 2.87Å; N268-Q271 WeakPolarHBondContact OD1-CB 3.41Å; N268-Q271 PolarHBondContact OD1-N 3.48Å; F269-Q271 PolarHBondContact O-N 2.94Å; Q271-L273 VanDerWaalsContact C-N 3.33Å; Q271-L273 PolarHBondContact O-N 2.65Å; Q271-T274 WeakPolarHBondContact O-CB 3.45Å; Q271-T274 PolarHBondContact O-N 2.62Å; Q271-V275 WeakPolarHBondContact O-CG2 3.35Å; Q271-V275 PolarHBondContact O-N 3.45Å
272	S	98.5	Very high	97.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-39.8	179.1	-54	0	0	0	0	111.7	H250 R263 N268 F269 D270 L276	H250-S272 VanDerWaalsContact CD2-CB 3.49Å; H250-S272 WeakPolarHBondContact CD2-CB 3.47Å; H250-S272 WeakPolarHBondContact NE2-CA 3.26Å; H250-S272 VanDerWaalsContact NE2-CB 3.26Å; H250-S272 WeakPolarHBondContact NE2-CB 3.31Å; H250-S272 PolarHBondContact NE2-OG 3.46Å; R263-S272 PolarHBondContact NH1-OG 2.88Å; R263-S272 PolarHBondContact NH2-OG 2.97Å; N268-S272 WeakPolarHBondContact O-CB 2.92Å; N268-S272 PolarHBondContact O-N 2.96Å; N268-S272 VanDerWaalsContact O-N 3.1Å; N268-S272 PolarHBondContact O-OG 3.49Å; F269-S272 WeakPolarHBondContact O-CB 3.31Å; F269-S272 PolarHBondContact O-N 2.99Å; F269-S272 VanDerWaalsContact O-N 3.14Å; D270-S272 VanDerWaalsContact C-N 3.34Å; S272-L276 PolarHBondContact O-N 3.06Å
273	L	98.3	Very high	97.8	Very high	10 Å²	10	42 Å²	42	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-67	-39.4	175.9	-160.7	66.8	0	0	0	111.5	F269 D270 Q271 L276 K277 L310 A313	F269-L273 HydrophobicContact CE1-CD2 4.37Å; F269-L273 WeakPolarHBondContact O-CB 3.42Å; F269-L273 PolarHBondContact O-N 3.37Å; D270-L273 PolarHBondContact O-N 3.2Å; Q271-L273 VanDerWaalsContact C-N 3.33Å; Q271-L273 PolarHBondContact O-N 2.65Å; L273-L276 PolarHBondContact O-N 3.47Å; L273-K277 HydrophobicContact CG-CD 4.49Å; L273-K277 WeakPolarHBondContact O-CB 3.32Å; L273-K277 WeakPolarHBondContact O-CG 3.18Å; L273-K277 PolarHBondContact O-N 2.83Å; L273-L310 HydrophobicContact CD1-CD2 3.9Å; L273-A313 HydrophobicContact CD1-CB 3.26Å; L273-A313 HydrophobicContact CD2-CB 4.08Å; L273-A313 HydrophobicContact CG-CB 3.6Å
274	T	98.6	Very high	97.6	Very high	66 Å²	66	46.7 Å²	46.7	41%	0.405	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-40.4	178.7	-62.4	0	0	0	0	111.6	L234 D270 Q271 L276 K277 H278	L234-T274 HydrophobicContact CD2-CG2 4.01Å; D270-T274 VanDerWaalsContact O-CB 3.29Å; D270-T274 WeakPolarHBondContact O-CB 3.42Å; D270-T274 PolarHBondContact O-N 2.59Å; D270-T274 PolarHBondContact O-OG1 3.22Å; Q271-T274 WeakPolarHBondContact O-CB 3.45Å; Q271-T274 PolarHBondContact O-N 2.62Å; T274-L276 PolarHBondContact O-N 2.82Å; T274-K277 PolarHBondContact O-N 2.83Å; T274-H278 VanDerWaalsContact O-CB 3.24Å; T274-H278 WeakPolarHBondContact O-CB 3.29Å; T274-H278 PolarHBondContact O-N 3.38Å
275	V	98.5	Very high	97.3	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.7	-50.6	173.2	167.3	0	0	0	0	111.1	D229 V237 Y248 H250 Q271 H278 A279	D229-V275 HydrophobicContact CB-CG2 4.32Å; V237-V275 HydrophobicContact CG1-CG1 4.42Å; V237-V275 HydrophobicContact CG2-CB 4.32Å; V237-V275 HydrophobicContact CG2-CG1 3.96Å; V237-V275 HydrophobicContact CG2-CG2 4Å; Y248-V275 HydrophobicContact CE1-CG1 3.78Å; H250-V275 HydrophobicContact CB-CG1 3.99Å; Q271-V275 WeakPolarHBondContact O-CG2 3.35Å; Q271-V275 PolarHBondContact O-N 3.45Å; V275-H278 PolarHBondContact O-N 3Å; V275-A279 PolarHBondContact O-N 2.69Å
276	L	98.3	Very high	97.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-43.5	-179.3	-67.2	168.5	0	0	0	112.2	H250 S272 L273 T274 K280 V315	H250-L276 HydrophobicContact CB-CD2 3.77Å; H250-L276 HydrophobicContact CB-CG 4.09Å; S272-L276 PolarHBondContact O-N 3.06Å; L273-L276 PolarHBondContact O-N 3.47Å; T274-L276 PolarHBondContact O-N 2.82Å; L276-K280 PolarHBondContact O-N 2.97Å; L276-V315 HydrophobicContact CB-CG2 4.07Å; L276-V315 HydrophobicContact CD1-CG1 4.49Å; L276-V315 HydrophobicContact CD1-CG2 3.7Å; L276-V315 HydrophobicContact CG-CG2 4.44Å
277	K	98.2	Very high	97.1	Very high	84 Å²	84	39.8 Å²	39.8	37%	0.365	22%	0.222	S	C	.	.	H	α-helix	trans	-59.4	-47	175.4	-76.3	176.6	175.6	176.2	0	111.1	L273 T274 K280 Q281 A313	L273-K277 HydrophobicContact CG-CD 4.49Å; L273-K277 WeakPolarHBondContact O-CB 3.32Å; L273-K277 WeakPolarHBondContact O-CG 3.18Å; L273-K277 PolarHBondContact O-N 2.83Å; T274-K277 PolarHBondContact O-N 2.83Å; K277-K280 WeakPolarHBondContact O-CB 2.99Å; K277-K280 PolarHBondContact O-N 2.77Å; K277-Q281 WeakPolarHBondContact O-CG 3.3Å; K277-Q281 PolarHBondContact O-N 2.91Å; K277-A313 HydrophobicContact CD-CB 4.14Å; K277-A313 HydrophobicContact CG-CB 3.79Å
278	H	98.4	Very high	97.1	Very high	29 Å²	29	39.5 Å²	39.5	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-67.8	-40.7	-175.2	-169.5	66.3	0	0	0	112.2	L234 V237 T274 V275 K280 Q281 V282	L234-H278 HydrophobicContact CD2-CB 3.8Å; L234-H278 PolarHBondContact O-CD2 3.13Å; L234-H278 PolarHBondContact O-NE2 2.94Å; V237-H278 HydrophobicContact CG1-CB 4.26Å; T274-H278 VanDerWaalsContact O-CB 3.24Å; T274-H278 WeakPolarHBondContact O-CB 3.29Å; T274-H278 PolarHBondContact O-N 3.38Å; V275-H278 PolarHBondContact O-N 3Å; H278-K280 PolarHBondContact O-N 3.43Å; H278-Q281 WeakPolarHBondContact O-CB 3.12Å; H278-Q281 PolarHBondContact O-N 2.73Å; H278-V282 WeakPolarHBondContact NE2-CG2 3.15Å; H278-V282 WeakPolarHBondContact O-CG2 3.12Å; H278-V282 PolarHBondContact O-N 3.07Å
279	A	97.9	Very high	97.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.7	-40.4	174.5	0	0	0	0	0	112.4	V237 A241 Y248 V275 K283	V237-A279 HydrophobicContact CG1-CB 4.08Å; A241-A279 HydrophobicContact CB-CB 4.41Å; Y248-A279 HydrophobicContact CD1-CB 3.78Å; Y248-A279 HydrophobicContact CD2-CB 3.63Å; Y248-A279 HydrophobicContact CE1-CB 4.11Å; Y248-A279 HydrophobicContact CE2-CB 3.95Å; Y248-A279 HydrophobicContact CG-CB 3.56Å; V275-A279 PolarHBondContact O-N 2.69Å; A279-K283 PolarHBondContact O-N 3.41Å
280	K	95.6	Very high	97.1	Very high	50 Å²	50	36.5 Å²	36.5	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-69.3	-39.1	174.5	-94.7	174.4	-179.1	-103.7	0	114.3	L276 K277 H278 K283 P284 V286 T288 G314 D316	L276-K280 PolarHBondContact O-N 2.97Å; K277-K280 WeakPolarHBondContact O-CB 2.99Å; K277-K280 PolarHBondContact O-N 2.77Å; H278-K280 PolarHBondContact O-N 3.43Å; K280-K283 CarbonylContact O-C 3.57Å; K280-K283 VanDerWaalsContact O-C 3.26Å; K280-P284 WeakPolarHBondContact O-CA 3.35Å; K280-V286 HydrophobicContact CG-CG1 4.19Å; K280-T288 HydrophobicContact CD-CG2 3.93Å; K280-T288 WeakPolarHBondContact CE-OG1 3.38Å; K280-T288 HydrophobicContact CG-CG2 3.7Å; K280-G314 WeakPolarHBondContact CE-O 2.99Å; K280-G314 PolarHBondContact NZ-O 2.87Å; K280-D316 WeakPolarHBondContact CE-OD2 3.14Å; K280-D316 IonicContact NZ-OD1 3.92Å; K280-D316 PolarHBondContact NZ-OD1 2.94Å; K280-D316 IonicContact NZ-OD2 3.19Å; K280-D316 PolarHBondContact NZ-OD2 3.11Å
281	Q	97.3	Very high	97.1	Very high	136 Å²	136	33 Å²	33	64%	0.636	19%	0.186	S	C	*	.	H	α-helix	trans	-63.9	-44.9	178.1	-72.1	169.1	-13.3	0	0	110.8	K277 H278	K277-Q281 WeakPolarHBondContact O-CG 3.3Å; K277-Q281 PolarHBondContact O-N 2.91Å; H278-Q281 WeakPolarHBondContact O-CB 3.12Å; H278-Q281 PolarHBondContact O-N 2.73Å
282	V	97.4	Very high	97.1	Very high	35 Å²	35	31.4 Å²	31.4	21%	0.212	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-44.4	179	168.3	0	0	0	0	111.7	E238 A241 L242 H278 P284	E238-V282 HydrophobicContact CB-CG1 4.21Å; E238-V282 HydrophobicContact CB-CG2 3.97Å; E238-V282 HydrophobicContact CG-CG1 3.76Å; E238-V282 HydrophobicContact CG-CG2 4.11Å; A241-V282 HydrophobicContact CB-CG1 4.18Å; L242-V282 HydrophobicContact CD1-CG1 3.99Å; L242-V282 HydrophobicContact CD2-CG1 3.74Å; L242-V282 HydrophobicContact CG-CG1 3.66Å; H278-V282 WeakPolarHBondContact NE2-CG2 3.15Å; H278-V282 WeakPolarHBondContact O-CG2 3.12Å; H278-V282 PolarHBondContact O-N 3.07Å; V282-P284 WeakPolarHBondContact O-CD 3.32Å
283	K	96.8	Very high	97.1	Very high	60 Å²	60	32.7 Å²	32.7	26%	0.261	18%	0.184	S	C	.	.	S	Bend	trans	-122.8	84.4	180	-171.7	173.1	178.3	-179.4	0	110.6	A241 L245 A279 K280 G285 V286	A241-K283 HydrophobicContact CB-CB 4.47Å; A241-K283 WeakPolarHBondContact O-CD 3.29Å; L245-K283 PolarHBondContact O-NZ 2.86Å; A279-K283 PolarHBondContact O-N 3.41Å; K280-K283 CarbonylContact O-C 3.57Å; K280-K283 VanDerWaalsContact O-C 3.26Å; K283-G285 PolarHBondContact O-N 3.37Å; K283-V286 HydrophobicContact CB-CB 4.18Å; K283-V286 HydrophobicContact CB-CG1 4.26Å; K283-V286 HydrophobicContact CD-CB 4.15Å; K283-V286 HydrophobicContact CD-CG2 4.33Å; K283-V286 HydrophobicContact CG-CB 4.05Å; K283-V286 WeakPolarHBondContact O-CB 3.44Å; K283-V286 WeakPolarHBondContact O-CG1 3.08Å; K283-V286 PolarHBondContact O-N 3.48Å; K283-V286 VanDerWaalsContact O-N 3.08Å
284	P	95.3	Very high	97.1	Very high	113 Å²	113	32.2 Å²	32.2	73%	0.734	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	132.3	174.7	-27.6	35.7	0	0	0	111.4	K280 V282	K280-P284 WeakPolarHBondContact O-CA 3.35Å; V282-P284 WeakPolarHBondContact O-CD 3.32Å
285	G	90.8	Very high	97.1	Very high	61 Å²	61	29.1 Å²	29.1	63%	0.629	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	-8.5	-179.3	0	0	0	0	0	115.7	K283 L287	K283-G285 PolarHBondContact O-N 3.37Å; G285-L287 PolarHBondContact O-N 2.85Å
286	V	94.8	Very high	97	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.036	16%	0.164	C	C	.	.			trans	-60.6	135	169.1	75.9	0	0	0	0	109.9	L245 K280 K283 T288	L245-V286 HydrophobicContact CD1-CG2 3.57Å; K280-V286 HydrophobicContact CG-CG1 4.19Å; K283-V286 HydrophobicContact CB-CB 4.18Å; K283-V286 HydrophobicContact CB-CG1 4.26Å; K283-V286 HydrophobicContact CD-CB 4.15Å; K283-V286 HydrophobicContact CD-CG2 4.33Å; K283-V286 HydrophobicContact CG-CB 4.05Å; K283-V286 WeakPolarHBondContact O-CB 3.44Å; K283-V286 WeakPolarHBondContact O-CG1 3.08Å; K283-V286 PolarHBondContact O-N 3.48Å; K283-V286 VanDerWaalsContact O-N 3.08Å; V286-T288 HydrophobicContact CG1-CG2 4.5Å
287	L	95.9	Very high	96.9	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133.2	172.6	-70.9	177.7	0	0	0	109.1	V247 Y248 G285 D316 L374 L377 L378	V247-L287 CarbonylContact C-O 3.51Å; V247-L287 WeakPolarHBondContact CA-O 3.32Å; V247-L287 HydrophobicContact CG1-CB 4.34Å; V247-L287 HydrophobicContact CG2-CB 4.22Å; V247-L287 HydrophobicContact CG2-CD1 4.49Å; Y248-L287 PolarHBondContact N-O 3.48Å; G285-L287 PolarHBondContact O-N 2.85Å; L287-D316 WeakPolarHBondContact CA-OD2 3.3Å; L287-D316 HydrophobicContact CD2-CB 3.97Å; L287-L374 HydrophobicContact CD1-CD2 3.66Å; L287-L377 HydrophobicContact CD1-CD2 3.84Å; L287-L377 HydrophobicContact CD2-CD2 4.33Å; L287-L378 HydrophobicContact CD1-CD1 4.4Å; L287-L378 HydrophobicContact CD1-CD2 3.7Å; L287-L378 HydrophobicContact CD1-CG 3.92Å; L287-L378 HydrophobicContact CG-CD2 4.36Å
288	T	97.4	Very high	96.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	141.6	174.5	51.8	0	0	0	0	110.9	Y248 K280 V286 V315 D316 C317	Y248-T288 CarbonylContact O-C 3.53Å; Y248-T288 WeakPolarHBondContact O-CA 3.29Å; K280-T288 HydrophobicContact CD-CG2 3.93Å; K280-T288 WeakPolarHBondContact CE-OG1 3.38Å; K280-T288 HydrophobicContact CG-CG2 3.7Å; V286-T288 HydrophobicContact CG1-CG2 4.5Å; T288-V315 WeakPolarHBondContact OG1-CA 3.15Å; T288-D316 PolarHBondContact N-OD2 3.05Å; T288-D316 WeakPolarHBondContact O-CB 3.38Å; T288-D316 PolarHBondContact O-N 3.38Å; T288-D316 VanDerWaalsContact O-N 3.11Å; T288-D316 PolarHBondContact OG1-N 3.14Å; T288-D316 VanDerWaalsContact OG1-N 3.13Å; T288-D316 PolarHBondContact OG1-OD2 2.95Å; T288-C317 PolarHBondContact O-N 2.7Å
289	K	97.4	Very high	96.9	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.6	-175.3	-176.9	179	173.1	-164.2	0	111.3	E224 V247 Y248 A249 H250 C317 S365 L374	E224-K289 IonicContact OE1-NZ 2.62Å; E224-K289 PolarHBondContact OE1-NZ 2.97Å; E224-K289 WeakPolarHBondContact OE2-CD 3.28Å; E224-K289 IonicContact OE2-NZ 3.9Å; E224-K289 PolarHBondContact OE2-NZ 3.11Å; V247-K289 HydrophobicContact CG1-CB 4Å; V247-K289 HydrophobicContact CG1-CD 4.4Å; Y248-K289 PolarHBondContact O-N 2.9Å; A249-K289 VanDerWaalsContact CA-O 3.26Å; A249-K289 WeakPolarHBondContact CA-O 3.5Å; A249-K289 HydrophobicContact CB-CB 4.05Å; H250-K289 PolarHBondContact N-O 2.74Å; K289-C317 WeakPolarHBondContact CA-O 3.39Å; K289-C317 HydrophobicContact CB-CB 3.9Å; K289-C317 HydrophobicContact CD-CB 4.39Å; K289-C317 HydrophobicContact CG-CB 3.8Å; K289-S365 WeakPolarHBondContact CE-O 3.47Å; K289-S365 PolarHBondContact NZ-O 2.89Å; K289-L374 HydrophobicContact CD-CD1 4.13Å
290	T	98.1	Very high	97	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	169.8	174.5	-157.1	0	0	0	0	112.2	H250 N251 V252 L310 V315 C317 L318 T319	H250-T290 WeakPolarHBondContact O-CA 3.41Å; H250-T290 VanDerWaalsContact O-CB 3.31Å; H250-T290 WeakPolarHBondContact O-CB 3.08Å; H250-T290 PolarHBondContact O-OG1 2.99Å; N251-T290 WeakPolarHBondContact CA-OG1 3.45Å; V252-T290 PolarHBondContact N-OG1 3.04Å; V252-T290 VanDerWaalsContact N-OG1 3.12Å; T290-L310 HydrophobicContact CG2-CD1 3.72Å; T290-L310 HydrophobicContact CG2-CD2 3.88Å; T290-L310 HydrophobicContact CG2-CG 4.4Å; T290-V315 HydrophobicContact CG2-CG1 3.97Å; T290-C317 PolarHBondContact N-O 3.43Å; T290-L318 HydrophobicContact CG2-CD1 3.95Å; T290-T319 PolarHBondContact O-N 3.27Å; T290-T319 PolarHBondContact O-OG1 2.83Å; T290-T319 VanDerWaalsContact O-OG1 3.07Å
291	S	97.4	Very high	97.1	Very high	7 Å²	7	36.2 Å²	36.2	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.2	177.8	-156.9	0	0	0	0	111.6	N251 E253 T319	N251-S291 WeakPolarHBondContact OD1-CB 3.16Å; N251-S291 PolarHBondContact OD1-N 3.45Å; E253-S291 WeakPolarHBondContact CA-O 3.26Å; E253-S291 PolarHBondContact N-O 3.49Å; S291-T319 CarbonylContact C-O 3.47Å; S291-T319 VanDerWaalsContact CA-O 3.29Å; S291-T319 WeakPolarHBondContact CA-O 3.49Å; S291-T319 VanDerWaalsContact CA-OG1 3.3Å; S291-T319 WeakPolarHBondContact CA-OG1 3.37Å; S291-T319 WeakPolarHBondContact CB-OG1 3.22Å; S291-T319 PolarHBondContact OG-O 3.03Å; S291-T319 PolarHBondContact OG-OG1 3.37Å
292	I	98.4	Very high	97.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.3	171.9	-58.2	173.7	0	0	0	108.1	V252 L294 I303 T306 L307 L310 L318 T319 L320 G321	V252-I292 HydrophobicContact CG2-CD1 4.42Å; V252-I292 HydrophobicContact CG2-CG1 3.8Å; I292-L294 HydrophobicContact CG2-CD2 3.98Å; I292-I303 HydrophobicContact CG2-CD1 3.91Å; I292-T306 HydrophobicContact CD1-CG2 3.63Å; I292-L307 HydrophobicContact CD1-CD2 3.72Å; I292-L310 HydrophobicContact CD1-CD1 4.03Å; I292-L318 HydrophobicContact CD1-CD1 4.16Å; I292-L318 HydrophobicContact CG1-CD1 4.37Å; I292-T319 PolarHBondContact N-O 3.47Å; I292-L320 HydrophobicContact CB-CD2 3.96Å; I292-L320 HydrophobicContact CD1-CD2 4.4Å; I292-L320 HydrophobicContact CG2-CD2 4.34Å; I292-L320 WeakPolarHBondContact O-CA 3.43Å; I292-G321 PolarHBondContact O-N 3.27Å; I292-G321 VanDerWaalsContact O-N 3.1Å
293	M	98.2	Very high	97.2	Very high	26 Å²	26	30.1 Å²	30.1	13%	0.128	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	129.3	168.8	-61.5	176.6	-78.9	0	0	109.9	F157 E253 L296 G321 Y323	F157-M293 HydrophobicContact CB-CE 4.18Å; F157-M293 HydrophobicContact CD1-CE 3.89Å; F157-M293 HydrophobicContact CD2-CE 3.38Å; F157-M293 HydrophobicContact CD2-SD 3.79Å; F157-M293 HydrophobicContact CE1-CE 4.05Å; F157-M293 HydrophobicContact CE2-CE 3.56Å; F157-M293 HydrophobicContact CE2-SD 4.2Å; F157-M293 HydrophobicContact CG-CE 3.55Å; F157-M293 HydrophobicContact CG-SD 4.3Å; F157-M293 HydrophobicContact CZ-CE 3.89Å; E253-M293 HydrophobicContact CB-CE 3.8Å; E253-M293 HydrophobicContact CG-CE 4.38Å; E253-M293 PolarHBondContact O-N 3.42Å; M293-L296 HydrophobicContact CB-CD1 4.12Å; M293-L296 HydrophobicContact CE-CD1 4.39Å; M293-G321 CarbonylContact C-O 3.51Å; M293-G321 WeakPolarHBondContact CA-O 3.32Å; M293-Y323 HydrophobicContact SD-CD2 3.97Å
294	L	98.5	Very high	97.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	156.2	176.4	-53.7	-176.2	0	0	0	111.6	I292 E298 I303 L320 G321 Q322 Y323 I337 F342	I292-L294 HydrophobicContact CG2-CD2 3.98Å; L294-E298 WeakPolarHBondContact CA-OE1 3.23Å; L294-E298 WeakPolarHBondContact CB-OE1 3.28Å; L294-E298 HydrophobicContact CD2-CG 4.34Å; L294-I303 HydrophobicContact CD2-CD1 3.45Å; L294-I303 VanDerWaalsContact CD2-CD1 3.45Å; L294-I303 HydrophobicContact CD2-CG1 4.08Å; L294-L320 HydrophobicContact CD1-CD2 4.28Å; L294-L320 HydrophobicContact CD2-CD2 4.01Å; L294-L320 HydrophobicContact CG-CD2 4.28Å; L294-G321 PolarHBondContact N-O 3.35Å; L294-Q322 PolarHBondContact O-NE2 3.49Å; L294-Y323 WeakPolarHBondContact O-CB 3.33Å; L294-Y323 PolarHBondContact O-N 3.48Å; L294-I337 HydrophobicContact CB-CG1 3.76Å; L294-I337 HydrophobicContact CD1-CG2 4.48Å; L294-F342 HydrophobicContact CB-CE1 4.49Å; L294-F342 HydrophobicContact CD1-CD1 4.12Å; L294-F342 HydrophobicContact CD1-CE1 3.69Å; L294-F342 HydrophobicContact CD1-CZ 4.29Å; L294-F342 HydrophobicContact CG-CE1 4.29Å
295	G	97.5	Very high	97.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	92.2	18.5	-179.4	0	0	0	0	0	114.4	E298 E334 E335	G295-E298 PolarHBondContact N-OE1 2.94Å; G295-E298 PolarHBondContact N-OE2 3.21Å; G295-E334 PolarHBondContact O-N 3.01Å; G295-E335 WeakPolarHBondContact CA-O 3.12Å; G295-E335 PolarHBondContact O-N 2.98Å
296	L	97.6	Very high	97.9	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	14%	0.144	C	C	.	.	S	Bend	trans	-97	-2.8	176.5	-74.4	167.1	0	0	0	113	L258 V262 M293 E298 Y323 L331 E334	L258-L296 HydrophobicContact CD1-CB 4.17Å; V262-L296 HydrophobicContact CG1-CD1 3.87Å; V262-L296 HydrophobicContact CG2-CB 4.45Å; V262-L296 HydrophobicContact CG2-CD1 3.99Å; V262-L296 HydrophobicContact CG2-CD2 4.39Å; M293-L296 HydrophobicContact CB-CD1 4.12Å; M293-L296 HydrophobicContact CE-CD1 4.39Å; L296-E298 WeakPolarHBondContact CA-OE2 3.26Å; L296-E298 PolarHBondContact N-OE2 3.34Å; L296-Y323 HydrophobicContact CD1-CG 4.41Å; L296-Y323 HydrophobicContact CD2-CD1 3.32Å; L296-Y323 HydrophobicContact CD2-CD2 4.18Å; L296-Y323 HydrophobicContact CD2-CE1 3.64Å; L296-Y323 HydrophobicContact CD2-CE2 4.48Å; L296-Y323 HydrophobicContact CD2-CG 3.62Å; L296-Y323 HydrophobicContact CG-CD1 3.95Å; L296-Y323 HydrophobicContact CG-CG 3.89Å; L296-L331 HydrophobicContact CD2-CB 4.33Å; L296-L331 HydrophobicContact CD2-CD1 3.97Å; L296-E334 VanDerWaalsContact O-CG 3.26Å; L296-E334 WeakPolarHBondContact O-CG 3.25Å
297	G	96.9	Very high	98	Very high	46 Å²	46	24.5 Å²	24.5	47%	0.474	14%	0.142	S	C	.	.	S	Bend	trans	113.2	7.2	176.7	0	0	0	0	0	113.7
298	E	98.3	Very high	98.2	Very high	15 Å²	15	26.9 Å²	26.9	7%	0.07	16%	0.157	C	C	.	.			trans	-67.9	145.1	175	71.6	-60.3	156.4	0	0	112.2	V255 L258 L294 G295 L296 I303	V255-E298 HydrophobicContact CB-CB 4.49Å; V255-E298 HydrophobicContact CG1-CB 3.81Å; V255-E298 HydrophobicContact CG1-CG 4.35Å; V255-E298 HydrophobicContact CG2-CB 3.79Å; L258-E298 HydrophobicContact CD1-CB 4.02Å; L294-E298 WeakPolarHBondContact CA-OE1 3.23Å; L294-E298 WeakPolarHBondContact CB-OE1 3.28Å; L294-E298 HydrophobicContact CD2-CG 4.34Å; G295-E298 PolarHBondContact N-OE1 2.94Å; G295-E298 PolarHBondContact N-OE2 3.21Å; L296-E298 WeakPolarHBondContact CA-OE2 3.26Å; L296-E298 PolarHBondContact N-OE2 3.34Å; E298-I303 HydrophobicContact CB-CD1 4.47Å; E298-I303 HydrophobicContact CG-CD1 3.69Å; E298-I303 HydrophobicContact CG-CG1 3.8Å
299	S	98.4	Very high	98.2	Very high	53 Å²	53	29 Å²	29	37%	0.371	17%	0.166	S	C	.	.			trans	-93.4	160.3	172.3	65.4	0	0	0	0	111.7	Q301 Q302 I303	S299-Q301 VanDerWaalsContact C-N 3.27Å; S299-Q301 PolarHBondContact O-N 3Å; S299-Q302 WeakPolarHBondContact O-CB 3.32Å; S299-Q302 PolarHBondContact O-N 2.78Å; S299-Q302 VanDerWaalsContact OG-CD 3.27Å; S299-Q302 WeakPolarHBondContact OG-CG 3.35Å; S299-Q302 PolarHBondContact OG-N 3Å; S299-Q302 PolarHBondContact OG-OE1 3.38Å; S299-I303 PolarHBondContact O-N 3.48Å
300	D	98.3	Very high	98.3	Very high	73 Å²	73	28.9 Å²	28.9	39%	0.39	17%	0.166	S	C	.	.	H	α-helix	trans	-60.8	-37.8	-179.9	-63.9	-5.1	0	0	0	111.7	Q302 I303 V304 K341 W345	D300-Q302 VanDerWaalsContact C-N 3.33Å; D300-Q302 PolarHBondContact O-N 3.35Å; D300-I303 PolarHBondContact O-N 3.39Å; D300-V304 WeakPolarHBondContact O-CG2 3.48Å; D300-V304 PolarHBondContact O-N 2.99Å; D300-K341 WeakPolarHBondContact OD1-CE 3.35Å; D300-K341 IonicContact OD1-NZ 3.17Å; D300-K341 PolarHBondContact OD1-NZ 3.07Å; D300-K341 IonicContact OD2-NZ 2.69Å; D300-K341 PolarHBondContact OD2-NZ 3.43Å; D300-W345 HydrophobicContact CB-CH2 3.96Å; D300-W345 HydrophobicContact CB-CZ2 3.93Å; D300-W345 WeakPolarHBondContact O-CH2 3.36Å
301	Q	98.6	Very high	98.3	Very high	121 Å²	121	32 Å²	32	57%	0.565	18%	0.178	S	C	*	.	H	α-helix	trans	-63.2	-39.4	175.7	-172.4	61.1	57.8	0	0	112.2	S299 I303 V304 N305	S299-Q301 VanDerWaalsContact C-N 3.27Å; S299-Q301 PolarHBondContact O-N 3Å; Q301-I303 VanDerWaalsContact C-N 3.33Å; Q301-V304 PolarHBondContact O-N 2.76Å; Q301-N305 PolarHBondContact NE2-OD1 2.61Å; Q301-N305 WeakPolarHBondContact O-CB 3.46Å; Q301-N305 PolarHBondContact O-N 3.01Å; Q301-N305 PolarHBondContact O-OD1 3.29Å
302	Q	98.8	Very high	98.3	Very high	43 Å²	43	38.8 Å²	38.8	20%	0.201	21%	0.209	C	C	.	.	H	α-helix	trans	-68.3	-35.6	177.9	-69.3	169.3	-45.5	0	0	111.7	V255 E257 S299 D300 T306	V255-Q302 HydrophobicContact CB-CB 4.03Å; V255-Q302 HydrophobicContact CG1-CB 3.85Å; V255-Q302 HydrophobicContact CG2-CB 4.13Å; E257-Q302 WeakPolarHBondContact OE1-CG 3.31Å; E257-Q302 PolarHBondContact OE1-NE2 2.75Å; S299-Q302 WeakPolarHBondContact O-CB 3.32Å; S299-Q302 PolarHBondContact O-N 2.78Å; S299-Q302 VanDerWaalsContact OG-CD 3.27Å; S299-Q302 WeakPolarHBondContact OG-CG 3.35Å; S299-Q302 PolarHBondContact OG-N 3Å; S299-Q302 PolarHBondContact OG-OE1 3.38Å; D300-Q302 VanDerWaalsContact C-N 3.33Å; D300-Q302 PolarHBondContact O-N 3.35Å; Q302-T306 VanDerWaalsContact O-CB 3.31Å; Q302-T306 WeakPolarHBondContact O-CB 3.45Å; Q302-T306 PolarHBondContact O-N 2.68Å; Q302-T306 PolarHBondContact O-OG1 3Å
303	I	98.6	Very high	98.2	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-51.9	171.3	-67.1	-66.4	0	0	0	110.1	V255 I292 L294 E298 S299 D300 Q301 N305 T306 L307 W345	V255-I303 HydrophobicContact CG1-CD1 3.64Å; V255-I303 HydrophobicContact CG1-CG1 4.24Å; I292-I303 HydrophobicContact CG2-CD1 3.91Å; L294-I303 HydrophobicContact CD2-CD1 3.45Å; L294-I303 VanDerWaalsContact CD2-CD1 3.45Å; L294-I303 HydrophobicContact CD2-CG1 4.08Å; E298-I303 HydrophobicContact CB-CD1 4.47Å; E298-I303 HydrophobicContact CG-CD1 3.69Å; E298-I303 HydrophobicContact CG-CG1 3.8Å; S299-I303 PolarHBondContact O-N 3.48Å; D300-I303 PolarHBondContact O-N 3.39Å; Q301-I303 VanDerWaalsContact C-N 3.33Å; I303-N305 VanDerWaalsContact C-N 3.3Å; I303-N305 PolarHBondContact O-N 3.37Å; I303-T306 CarbonylContact O-C 3.59Å; I303-T306 WeakPolarHBondContact O-CA 3.4Å; I303-T306 WeakPolarHBondContact O-CB 3.46Å; I303-T306 PolarHBondContact O-N 2.99Å; I303-L307 HydrophobicContact CG2-CD1 4.16Å; I303-L307 HydrophobicContact CG2-CG 4.08Å; I303-L307 WeakPolarHBondContact O-CG 3.45Å; I303-L307 PolarHBondContact O-N 3.36Å; I303-W345 HydrophobicContact CB-CH2 3.63Å; I303-W345 HydrophobicContact CB-CZ2 3.81Å; I303-W345 HydrophobicContact CB-CZ3 4.11Å; I303-W345 HydrophobicContact CG1-CZ2 4.23Å; I303-W345 HydrophobicContact CG2-CD2 3.97Å; I303-W345 HydrophobicContact CG2-CE3 3.69Å; I303-W345 HydrophobicContact CG2-CH2 3.44Å; I303-W345 VanDerWaalsContact CG2-CH2 3.44Å; I303-W345 HydrophobicContact CG2-CZ2 3.69Å; I303-W345 HydrophobicContact CG2-CZ3 3.43Å; I303-W345 VanDerWaalsContact CG2-CZ3 3.43Å
304	V	98.7	Very high	98.1	Very high	49 Å²	49	39.2 Å²	39.2	30%	0.297	22%	0.219	S	C	.	.	H	α-helix	trans	-54.4	-47.5	178.4	171.2	0	0	0	0	111.2	D300 Q301 T306 L307 T308 W345	D300-V304 WeakPolarHBondContact O-CG2 3.48Å; D300-V304 PolarHBondContact O-N 2.99Å; Q301-V304 PolarHBondContact O-N 2.76Å; V304-T306 VanDerWaalsContact C-N 3.34Å; V304-T306 PolarHBondContact O-N 3.34Å; V304-L307 PolarHBondContact O-N 2.86Å; V304-T308 PolarHBondContact O-N 3.08Å; V304-T308 PolarHBondContact O-OG1 3.31Å; V304-T308 VanDerWaalsContact O-OG1 3.07Å; V304-W345 HydrophobicContact CG2-CH2 3.98Å; V304-W345 HydrophobicContact CG2-CZ3 3.81Å
305	N	98.7	Very high	98.1	Very high	70 Å²	70	39.2 Å²	39.2	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-58.4	-46.9	176.7	-66.4	-5.5	0	0	0	111.3	Q301 I303 L307 T308 E309	Q301-N305 PolarHBondContact NE2-OD1 2.61Å; Q301-N305 WeakPolarHBondContact O-CB 3.46Å; Q301-N305 PolarHBondContact O-N 3.01Å; Q301-N305 PolarHBondContact O-OD1 3.29Å; I303-N305 VanDerWaalsContact C-N 3.3Å; I303-N305 PolarHBondContact O-N 3.37Å; N305-L307 VanDerWaalsContact C-N 3.34Å; N305-L307 PolarHBondContact O-N 3.08Å; N305-T308 WeakPolarHBondContact O-CB 3.31Å; N305-T308 PolarHBondContact O-N 3.31Å; N305-E309 WeakPolarHBondContact O-CG 3.22Å; N305-E309 PolarHBondContact O-N 2.91Å
306	T	98.8	Very high	98.1	Very high	2 Å²	2	40 Å²	40	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-59	-44.5	177.3	-63.3	0	0	0	0	111.6	V255 F269 I292 Q302 I303 V304 T308 E309 L310	V255-T306 WeakPolarHBondContact CG1-OG1 3.38Å; F269-T306 HydrophobicContact CE2-CG2 3.65Å; F269-T306 HydrophobicContact CZ-CG2 3.85Å; I292-T306 HydrophobicContact CD1-CG2 3.63Å; Q302-T306 VanDerWaalsContact O-CB 3.31Å; Q302-T306 WeakPolarHBondContact O-CB 3.45Å; Q302-T306 PolarHBondContact O-N 2.68Å; Q302-T306 PolarHBondContact O-OG1 3Å; I303-T306 CarbonylContact O-C 3.59Å; I303-T306 WeakPolarHBondContact O-CA 3.4Å; I303-T306 WeakPolarHBondContact O-CB 3.46Å; I303-T306 PolarHBondContact O-N 2.99Å; V304-T306 VanDerWaalsContact C-N 3.34Å; V304-T306 PolarHBondContact O-N 3.34Å; T306-T308 VanDerWaalsContact C-N 3.33Å; T306-T308 PolarHBondContact O-N 3.19Å; T306-E309 PolarHBondContact O-N 3.48Å; T306-L310 HydrophobicContact CG2-CD1 4.03Å; T306-L310 HydrophobicContact CG2-CG 4.47Å; T306-L310 WeakPolarHBondContact O-CB 3.36Å; T306-L310 VanDerWaalsContact O-CG 3.22Å; T306-L310 WeakPolarHBondContact O-CG 3.27Å; T306-L310 PolarHBondContact O-N 3.43Å
307	L	98.6	Very high	98	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-39.6	178	-62.1	-166.6	0	0	0	111.5	I292 I303 V304 N305 L310 R311 L318 W345 V348 M352 F354	I292-L307 HydrophobicContact CD1-CD2 3.72Å; I303-L307 HydrophobicContact CG2-CD1 4.16Å; I303-L307 HydrophobicContact CG2-CG 4.08Å; I303-L307 WeakPolarHBondContact O-CG 3.45Å; I303-L307 PolarHBondContact O-N 3.36Å; V304-L307 PolarHBondContact O-N 2.86Å; N305-L307 VanDerWaalsContact C-N 3.34Å; N305-L307 PolarHBondContact O-N 3.08Å; L307-L310 HydrophobicContact CD2-CD1 4.23Å; L307-L310 PolarHBondContact O-N 2.83Å; L307-R311 WeakPolarHBondContact O-CG 3.31Å; L307-R311 PolarHBondContact O-N 3.19Å; L307-L318 HydrophobicContact CD1-CD2 4.15Å; L307-L318 HydrophobicContact CD2-CD1 4.02Å; L307-L318 HydrophobicContact CD2-CD2 3.44Å; L307-L318 VanDerWaalsContact CD2-CD2 3.44Å; L307-L318 HydrophobicContact CD2-CG 4.39Å; L307-L318 HydrophobicContact CG-CD2 4.39Å; L307-W345 HydrophobicContact CD1-CE3 4.26Å; L307-V348 HydrophobicContact CD1-CG1 4.17Å; L307-M352 HydrophobicContact CB-CE 3.79Å; L307-M352 HydrophobicContact CB-SD 3.68Å; L307-M352 HydrophobicContact CD1-SD 4.17Å; L307-F354 HydrophobicContact CB-CE2 4.33Å; L307-F354 HydrophobicContact CD2-CE2 4.49Å
308	T	98.7	Very high	97.9	Very high	52 Å²	52	37.6 Å²	37.6	32%	0.319	20%	0.2	S	C	.	.	H	α-helix	trans	-60.5	-50.2	175.9	-60.9	0	0	0	0	110.6	V304 N305 T306 L310 R311 E312 M352	V304-T308 PolarHBondContact O-N 3.08Å; V304-T308 PolarHBondContact O-OG1 3.31Å; V304-T308 VanDerWaalsContact O-OG1 3.07Å; N305-T308 WeakPolarHBondContact O-CB 3.31Å; N305-T308 PolarHBondContact O-N 3.31Å; T306-T308 VanDerWaalsContact C-N 3.33Å; T306-T308 PolarHBondContact O-N 3.19Å; T308-L310 VanDerWaalsContact C-N 3.31Å; T308-L310 PolarHBondContact O-N 3.17Å; T308-R311 PolarHBondContact O-N 3.21Å; T308-R311 VanDerWaalsContact O-N 3.08Å; T308-E312 HydrophobicContact CG2-CG 4.4Å; T308-E312 WeakPolarHBondContact O-CG 3.47Å; T308-E312 PolarHBondContact O-N 2.85Å; T308-M352 VanDerWaalsContact N-CE 3.33Å; T308-M352 VanDerWaalsContact OG1-CE 3.27Å; T308-M352 WeakPolarHBondContact OG1-CE 3.24Å
309	E	98.6	Very high	97.8	Very high	44 Å²	44	37 Å²	37	21%	0.206	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-38	179.4	-66.9	-174	-114.2	0	0	112.4	R256 F269 N305 T306 E312 A313	R256-E309 IonicContact CZ-OE2 2.86Å; R256-E309 IonicContact NE-OE1 3.46Å; R256-E309 IonicContact NE-OE2 3.68Å; R256-E309 IonicContact NH2-OE1 3.22Å; R256-E309 IonicContact NH2-OE2 2.64Å; R256-E309 PolarHBondContact NH2-OE2 3.3Å; F269-E309 HydrophobicContact CE1-CB 4.1Å; F269-E309 HydrophobicContact CZ-CB 4.36Å; N305-E309 WeakPolarHBondContact O-CG 3.22Å; N305-E309 PolarHBondContact O-N 2.91Å; T306-E309 PolarHBondContact O-N 3.48Å; E309-E312 PolarHBondContact O-N 3.01Å; E309-A313 VanDerWaalsContact O-CB 3.31Å; E309-A313 WeakPolarHBondContact O-CB 3.46Å; E309-A313 PolarHBondContact O-N 3.48Å
310	L	98.5	Very high	97.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-40.2	174	-72.5	171.1	0	0	0	111.9	V252 L273 T290 I292 T306 L307 T308 A313 G314 V315 L318 F354	V252-L310 HydrophobicContact CG1-CD2 3.92Å; V252-L310 HydrophobicContact CG2-CD1 4.35Å; V252-L310 HydrophobicContact CG2-CD2 4.4Å; L273-L310 HydrophobicContact CD1-CD2 3.9Å; T290-L310 HydrophobicContact CG2-CD1 3.72Å; T290-L310 HydrophobicContact CG2-CD2 3.88Å; T290-L310 HydrophobicContact CG2-CG 4.4Å; I292-L310 HydrophobicContact CD1-CD1 4.03Å; T306-L310 HydrophobicContact CG2-CD1 4.03Å; T306-L310 HydrophobicContact CG2-CG 4.47Å; T306-L310 WeakPolarHBondContact O-CB 3.36Å; T306-L310 VanDerWaalsContact O-CG 3.22Å; T306-L310 WeakPolarHBondContact O-CG 3.27Å; T306-L310 PolarHBondContact O-N 3.43Å; L307-L310 HydrophobicContact CD2-CD1 4.23Å; L307-L310 PolarHBondContact O-N 2.83Å; T308-L310 VanDerWaalsContact C-N 3.31Å; T308-L310 PolarHBondContact O-N 3.17Å; L310-A313 WeakPolarHBondContact O-CB 3.48Å; L310-A313 PolarHBondContact O-N 3.31Å; L310-G314 PolarHBondContact O-N 2.64Å; L310-V315 HydrophobicContact CB-CB 4.39Å; L310-V315 HydrophobicContact CB-CG2 4.46Å; L310-V315 HydrophobicContact CD2-CG2 4.08Å; L310-V315 VanDerWaalsContact O-CB 3.29Å; L310-V315 WeakPolarHBondContact O-CB 3.19Å; L310-V315 WeakPolarHBondContact O-CG2 3.5Å; L310-V315 PolarHBondContact O-N 3.2Å; L310-L318 HydrophobicContact CD1-CD1 4.3Å; L310-F354 HydrophobicContact CB-CE1 4.3Å; L310-F354 HydrophobicContact CB-CZ 3.94Å
311	R	97.8	Very high	97.7	Very high	65 Å²	65	31.2 Å²	31.2	25%	0.245	16%	0.163	C	C	.	.	H	α-helix	trans	-70	-42.1	176	-70.7	-53.5	-57.9	134.2	-0.5	112.6	L307 T308 A313 G314 V315 M352 G353 F354	L307-R311 WeakPolarHBondContact O-CG 3.31Å; L307-R311 PolarHBondContact O-N 3.19Å; T308-R311 PolarHBondContact O-N 3.21Å; T308-R311 VanDerWaalsContact O-N 3.08Å; R311-A313 PolarHBondContact O-N 3.47Å; R311-G314 WeakPolarHBondContact O-CA 3.29Å; R311-G314 PolarHBondContact O-N 2.75Å; R311-V315 PolarHBondContact NH1-O 3.48Å; R311-M352 HydrophobicContact CG-CB 4.13Å; R311-M352 PolarHBondContact NE-O 2.8Å; R311-M352 VanDerWaalsContact NE-O 3.13Å; R311-G353 VanDerWaalsContact CZ-O 3.24Å; R311-G353 PolarHBondContact NE-O 3.05Å; R311-G353 PolarHBondContact NH2-O 2.69Å; R311-F354 VanDerWaalsContact CD-CD1 3.43Å; R311-F354 VanDerWaalsContact CD-CD2 3.46Å; R311-F354 VanDerWaalsContact CD-CG 3.5Å; R311-F354 HydrophobicContact CG-CD2 4.1Å; R311-F354 HydrophobicContact CG-CE1 4.12Å; R311-F354 HydrophobicContact CG-CE2 3.55Å; R311-F354 HydrophobicContact CG-CZ 3.57Å
312	E	97.7	Very high	97.7	Very high	150 Å²	150	25.5 Å²	25.5	70%	0.701	14%	0.136	S	C	*	.	H	α-helix	trans	-60.7	-30	173.2	-71.8	175.7	174.1	0	0	111.9	T308 E309 G314	T308-E312 HydrophobicContact CG2-CG 4.4Å; T308-E312 WeakPolarHBondContact O-CG 3.47Å; T308-E312 PolarHBondContact O-N 2.85Å; E309-E312 PolarHBondContact O-N 3.01Å; E312-G314 PolarHBondContact O-N 3.29Å
313	A	96.9	Very high	97.5	Very high	9 Å²	9	23.6 Å²	23.6	7%	0.074	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.1	170.9	0	0	0	0	0	114.9	L273 K277 E309 L310 R311 V315	L273-A313 HydrophobicContact CD1-CB 3.26Å; L273-A313 HydrophobicContact CD2-CB 4.08Å; L273-A313 HydrophobicContact CG-CB 3.6Å; K277-A313 HydrophobicContact CD-CB 4.14Å; K277-A313 HydrophobicContact CG-CB 3.79Å; E309-A313 VanDerWaalsContact O-CB 3.31Å; E309-A313 WeakPolarHBondContact O-CB 3.46Å; E309-A313 PolarHBondContact O-N 3.48Å; L310-A313 WeakPolarHBondContact O-CB 3.48Å; L310-A313 PolarHBondContact O-N 3.31Å; R311-A313 PolarHBondContact O-N 3.47Å; A313-V315 VanDerWaalsContact C-N 3.35Å; A313-V315 HydrophobicContact CB-CG2 4.2Å
314	G	96.4	Very high	97.2	Very high	26 Å²	26	25.7 Å²	25.7	27%	0.268	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	15.2	179.4	0	0	0	0	0	114.5	K280 L310 R311 E312 D316	K280-G314 WeakPolarHBondContact CE-O 2.99Å; K280-G314 PolarHBondContact NZ-O 2.87Å; L310-G314 PolarHBondContact O-N 2.64Å; R311-G314 WeakPolarHBondContact O-CA 3.29Å; R311-G314 PolarHBondContact O-N 2.75Å; E312-G314 PolarHBondContact O-N 3.29Å; G314-D316 PolarHBondContact O-N 2.86Å
315	V	97.9	Very high	96.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.			trans	-64.8	119.6	-176.8	178.1	0	0	0	0	111.2	L276 T288 T290 L310 R311 A313 F354	L276-V315 HydrophobicContact CB-CG2 4.07Å; L276-V315 HydrophobicContact CD1-CG1 4.49Å; L276-V315 HydrophobicContact CD1-CG2 3.7Å; L276-V315 HydrophobicContact CG-CG2 4.44Å; T288-V315 WeakPolarHBondContact OG1-CA 3.15Å; T290-V315 HydrophobicContact CG2-CG1 3.97Å; L310-V315 HydrophobicContact CB-CB 4.39Å; L310-V315 HydrophobicContact CB-CG2 4.46Å; L310-V315 HydrophobicContact CD2-CG2 4.08Å; L310-V315 VanDerWaalsContact O-CB 3.29Å; L310-V315 WeakPolarHBondContact O-CB 3.19Å; L310-V315 WeakPolarHBondContact O-CG2 3.5Å; L310-V315 PolarHBondContact O-N 3.2Å; R311-V315 PolarHBondContact NH1-O 3.48Å; A313-V315 VanDerWaalsContact C-N 3.35Å; A313-V315 HydrophobicContact CB-CG2 4.2Å; V315-F354 HydrophobicContact CB-CE1 4.35Å; V315-F354 HydrophobicContact CG1-CE1 4.36Å; V315-F354 WeakPolarHBondContact O-CD1 3.34Å; V315-F354 VanDerWaalsContact O-CE1 3.27Å; V315-F354 WeakPolarHBondContact O-CE1 3.42Å
316	D	96.6	Very high	96.5	Very high	17 Å²	17	24.2 Å²	24.2	9%	0.091	13%	0.127	C	C	.	.			trans	-77.3	-39.9	-168.6	-52.7	-75.9	0	0	0	113.7	K280 L287 T288 G314 F354 V355	K280-D316 WeakPolarHBondContact CE-OD2 3.14Å; K280-D316 IonicContact NZ-OD1 3.92Å; K280-D316 PolarHBondContact NZ-OD1 2.94Å; K280-D316 IonicContact NZ-OD2 3.19Å; K280-D316 PolarHBondContact NZ-OD2 3.11Å; L287-D316 WeakPolarHBondContact CA-OD2 3.3Å; L287-D316 HydrophobicContact CD2-CB 3.97Å; T288-D316 PolarHBondContact N-OD2 3.05Å; T288-D316 WeakPolarHBondContact O-CB 3.38Å; T288-D316 PolarHBondContact O-N 3.38Å; T288-D316 VanDerWaalsContact O-N 3.11Å; T288-D316 PolarHBondContact OG1-N 3.14Å; T288-D316 VanDerWaalsContact OG1-N 3.13Å; T288-D316 PolarHBondContact OG1-OD2 2.95Å; G314-D316 PolarHBondContact O-N 2.86Å; D316-F354 CarbonylContact O-C 3.26Å; D316-V355 HydrophobicContact CB-CB 4.29Å; D316-V355 HydrophobicContact CB-CG2 3.96Å; D316-V355 PolarHBondContact O-N 2.64Å
317	C	95.7	Very high	96.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.5	-168.2	-58.4	0	0	0	0	111.7	T288 K289 T290 Y356	T288-C317 PolarHBondContact O-N 2.7Å; K289-C317 WeakPolarHBondContact CA-O 3.39Å; K289-C317 HydrophobicContact CB-CB 3.9Å; K289-C317 HydrophobicContact CD-CB 4.39Å; K289-C317 HydrophobicContact CG-CB 3.8Å; T290-C317 PolarHBondContact N-O 3.43Å; C317-Y356 WeakPolarHBondContact CA-O 3.42Å; C317-Y356 HydrophobicContact CB-CD1 4.46Å
318	L	96.1	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.7	-177.3	177.2	65.4	0	0	0	110.4	T290 I292 L307 L310 L320 F354 Y356 T357 A358	T290-L318 HydrophobicContact CG2-CD1 3.95Å; I292-L318 HydrophobicContact CD1-CD1 4.16Å; I292-L318 HydrophobicContact CG1-CD1 4.37Å; L307-L318 HydrophobicContact CD1-CD2 4.15Å; L307-L318 HydrophobicContact CD2-CD1 4.02Å; L307-L318 HydrophobicContact CD2-CD2 3.44Å; L307-L318 VanDerWaalsContact CD2-CD2 3.44Å; L307-L318 HydrophobicContact CD2-CG 4.39Å; L307-L318 HydrophobicContact CG-CD2 4.39Å; L310-L318 HydrophobicContact CD1-CD1 4.3Å; L318-L320 HydrophobicContact CD1-CG 4.45Å; L318-L320 HydrophobicContact CD2-CD1 3.69Å; L318-L320 HydrophobicContact CD2-CG 4.24Å; L318-L320 HydrophobicContact CG-CD1 4.05Å; L318-L320 HydrophobicContact CG-CG 4.18Å; L318-F354 HydrophobicContact CB-CD1 3.86Å; L318-F354 HydrophobicContact CB-CD2 4.22Å; L318-F354 HydrophobicContact CB-CE1 3.98Å; L318-F354 HydrophobicContact CB-CE2 4.36Å; L318-F354 HydrophobicContact CB-CG 4.01Å; L318-F354 HydrophobicContact CB-CZ 4.24Å; L318-F354 HydrophobicContact CD2-CD2 3.99Å; L318-F354 HydrophobicContact CD2-CE2 3.72Å; L318-F354 HydrophobicContact CD2-CZ 4.07Å; L318-Y356 PolarHBondContact N-O 3.22Å; L318-T357 HydrophobicContact CB-CG2 4.34Å; L318-T357 HydrophobicContact CD2-CG2 4Å; L318-T357 HydrophobicContact CG-CG2 4.31Å; L318-T357 CarbonylContact O-C 3.57Å; L318-T357 WeakPolarHBondContact O-CA 3.43Å; L318-A358 PolarHBondContact O-N 3.41Å
319	T	96.5	Very high	95.3	Very high	2 Å²	2	43 Å²	43	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.6	168.1	58.3	0	0	0	0	110.4	T290 S291 I292 A358 V363	T290-T319 PolarHBondContact O-N 3.27Å; T290-T319 PolarHBondContact O-OG1 2.83Å; T290-T319 VanDerWaalsContact O-OG1 3.07Å; S291-T319 CarbonylContact C-O 3.47Å; S291-T319 VanDerWaalsContact CA-O 3.29Å; S291-T319 WeakPolarHBondContact CA-O 3.49Å; S291-T319 VanDerWaalsContact CA-OG1 3.3Å; S291-T319 WeakPolarHBondContact CA-OG1 3.37Å; S291-T319 WeakPolarHBondContact CB-OG1 3.22Å; S291-T319 PolarHBondContact OG-O 3.03Å; S291-T319 PolarHBondContact OG-OG1 3.37Å; I292-T319 PolarHBondContact N-O 3.47Å; T319-A358 CarbonylContact C-O 3.56Å; T319-A358 VanDerWaalsContact CA-O 3.25Å; T319-A358 WeakPolarHBondContact CA-O 3.11Å; T319-A358 HydrophobicContact CG2-CB 3.98Å; T319-V363 HydrophobicContact CG2-CG1 4.46Å
320	L	97.6	Very high	95.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	116.8	-180	-71.2	143.2	0	0	0	108.6	I292 L294 L318 W345 T357 A358 S359 G360 V363	I292-L320 HydrophobicContact CB-CD2 3.96Å; I292-L320 HydrophobicContact CD1-CD2 4.4Å; I292-L320 HydrophobicContact CG2-CD2 4.34Å; I292-L320 WeakPolarHBondContact O-CA 3.43Å; L294-L320 HydrophobicContact CD1-CD2 4.28Å; L294-L320 HydrophobicContact CD2-CD2 4.01Å; L294-L320 HydrophobicContact CG-CD2 4.28Å; L318-L320 HydrophobicContact CD1-CG 4.45Å; L318-L320 HydrophobicContact CD2-CD1 3.69Å; L318-L320 HydrophobicContact CD2-CG 4.24Å; L318-L320 HydrophobicContact CG-CD1 4.05Å; L318-L320 HydrophobicContact CG-CG 4.18Å; L320-W345 HydrophobicContact CD1-CB 3.73Å; L320-T357 HydrophobicContact CD1-CG2 4.1Å; L320-A358 PolarHBondContact N-O 3.46Å; L320-S359 WeakPolarHBondContact O-CA 3.41Å; L320-G360 PolarHBondContact O-N 3.03Å; L320-V363 WeakPolarHBondContact O-CB 3.23Å
321	G	96.5	Very high	94.9	Very high	4 Å²	4	43.1 Å²	43.1	4%	0.041	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.4	-175.6	0	0	0	0	0	112.7	I292 M293 L294 Y323 G360 V363	I292-G321 PolarHBondContact O-N 3.27Å; I292-G321 VanDerWaalsContact O-N 3.1Å; M293-G321 CarbonylContact C-O 3.51Å; M293-G321 WeakPolarHBondContact CA-O 3.32Å; L294-G321 PolarHBondContact N-O 3.35Å; G321-Y323 PolarHBondContact O-N 3.26Å; G321-G360 WeakPolarHBondContact CA-O 3.23Å; G321-V363 WeakPolarHBondContact CA-O 3.47Å
322	Q	97.2	Very high	94.8	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.1	171.3	175.6	65.4	56.8	0	0	110.3	L94 L294 M324 E335 Y336 F342 P361 R364	L94-Q322 HydrophobicContact CD1-CG 3.79Å; L94-Q322 HydrophobicContact CD2-CB 3.93Å; L94-Q322 HydrophobicContact CD2-CG 3.92Å; L294-Q322 PolarHBondContact O-NE2 3.49Å; Q322-M324 HydrophobicContact CG-CG 4.48Å; Q322-M324 HydrophobicContact CG-SD 3.85Å; Q322-M324 PolarHBondContact O-N 3.15Å; Q322-E335 PolarHBondContact NE2-O 2.87Å; Q322-Y336 HydrophobicContact CG-CD1 4.3Å; Q322-F342 HydrophobicContact CB-CZ 3.94Å; Q322-P361 WeakPolarHBondContact CB-O 3.42Å; Q322-P361 PolarHBondContact N-O 2.79Å; Q322-P361 VanDerWaalsContact N-O 3.15Å; Q322-R364 PolarHBondContact O-NH1 3.22Å
323	Y	96.4	Very high	94.7	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.012	18%	0.178	C	C	.	.			trans	-63.2	122	164.1	171.9	-119.9	0	0	0	110	F157 M293 L294 L296 G321 Q325 L331 V333	F157-Y323 HydrophobicContact CB-CD2 4.2Å; F157-Y323 HydrophobicContact CB-CE2 3.62Å; M293-Y323 HydrophobicContact SD-CD2 3.97Å; L294-Y323 WeakPolarHBondContact O-CB 3.33Å; L294-Y323 PolarHBondContact O-N 3.48Å; L296-Y323 HydrophobicContact CD1-CG 4.41Å; L296-Y323 HydrophobicContact CD2-CD1 3.32Å; L296-Y323 HydrophobicContact CD2-CD2 4.18Å; L296-Y323 HydrophobicContact CD2-CE1 3.64Å; L296-Y323 HydrophobicContact CD2-CE2 4.48Å; L296-Y323 HydrophobicContact CD2-CG 3.62Å; L296-Y323 HydrophobicContact CG-CD1 3.95Å; L296-Y323 HydrophobicContact CG-CG 3.89Å; G321-Y323 PolarHBondContact O-N 3.26Å; Y323-Q325 HydrophobicContact CE1-CB 4.38Å; Y323-L331 HydrophobicContact CE1-CB 4.04Å; Y323-L331 VanDerWaalsContact CE1-O 3.29Å; Y323-L331 WeakPolarHBondContact CE1-O 3.26Å; Y323-L331 PolarHBondContact OH-N 2.81Å; Y323-L331 PolarHBondContact OH-O 3.33Å; Y323-V333 HydrophobicContact CD1-CG2 3.99Å; Y323-V333 HydrophobicContact CE1-CG2 4.13Å
324	M	91.9	Very high	94.6	Very high	45 Å²	45	39.3 Å²	39.3	22%	0.222	19%	0.185	C	C	.	.			trans	-111.9	117.3	177	-64.6	-63.6	-73.8	0	0	109	L90 L94 Q322 P326 R364	L90-M324 HydrophobicContact CD1-CE 3.5Å; L90-M324 HydrophobicContact CD1-SD 4.26Å; L90-M324 HydrophobicContact CD2-CE 4.4Å; L94-M324 HydrophobicContact CB-CE 4.27Å; L94-M324 HydrophobicContact CB-SD 4.47Å; L94-M324 HydrophobicContact CD1-SD 3.92Å; L94-M324 HydrophobicContact CD2-SD 4Å; L94-M324 HydrophobicContact CG-SD 4.37Å; Q322-M324 HydrophobicContact CG-CG 4.48Å; Q322-M324 HydrophobicContact CG-SD 3.85Å; Q322-M324 PolarHBondContact O-N 3.15Å; M324-P326 WeakPolarHBondContact O-CD 3.45Å; M324-R364 VanDerWaalsContact CG-NH2 3.25Å
325	Q	92.3	Very high	94.6	Very high	56 Å²	56	39.7 Å²	39.7	26%	0.262	18%	0.179	S	C	.	.			trans	-63.7	115.2	179.5	179.1	176.3	42.6	0	0	110.6	Y323 T327 H330 L331 V333	Y323-Q325 HydrophobicContact CE1-CB 4.38Å; Q325-T327 WeakPolarHBondContact CG-O 3.39Å; Q325-T327 PolarHBondContact NE2-O 3.06Å; Q325-H330 HydrophobicContact CG-CB 4.34Å; Q325-H330 PolarHBondContact NE2-O 2.99Å; Q325-L331 VanDerWaalsContact CG-O 3.3Å; Q325-L331 WeakPolarHBondContact CG-O 3.42Å; Q325-L331 PolarHBondContact NE2-O 2.79Å; Q325-V333 HydrophobicContact CB-CG2 4.06Å
326	P	90.2	Very high	94.5	Very high	31 Å²	31	40.6 Å²	40.6	20%	0.201	18%	0.183	C	C	.	.			trans	-71.5	-39.5	-174.9	-21	33.1	0	0	0	113.5	F157 M324	F157-P326 WeakPolarHBondContact O-CG 3.11Å; M324-P326 WeakPolarHBondContact O-CD 3.45Å
327	T	89.9	Confident	94.4	Very high	42 Å²	42	39.9 Å²	39.9	26%	0.258	18%	0.179	S	C	.	.	S	Bend	trans	-147.1	166.7	176.8	84.1	0	0	0	0	110.6	Q325 R329 H330	Q325-T327 WeakPolarHBondContact CG-O 3.39Å; Q325-T327 PolarHBondContact NE2-O 3.06Å; T327-R329 PolarHBondContact O-N 3.15Å; T327-R329 PolarHBondContact OG1-N 3.33Å; T327-H330 PolarHBondContact N-ND1 3.46Å; T327-H330 PolarHBondContact O-N 2.98Å; T327-H330 VanDerWaalsContact O-N 3.07Å; T327-H330 PolarHBondContact OG1-CE1 3.33Å; T327-H330 VanDerWaalsContact OG1-CE1 3.25Å; T327-H330 PolarHBondContact OG1-ND1 3.44Å
328	K	89.6	Confident	94.3	Very high	165 Å²	165	40.8 Å²	40.8	72%	0.717	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-15.9	178.4	-61.7	-172.6	174.7	172	0	114.8	R87	R87-K328 VanDerWaalsContact NH2-CB 3.29Å
329	R	90.3	Very high	94.2	Very high	242 Å²	242	42.8 Å²	42.8	91%	0.913	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-20	-179.7	-62.9	-177.6	-178.9	175.9	-0.1	113.5	T327	T327-R329 PolarHBondContact O-N 3.15Å; T327-R329 PolarHBondContact OG1-N 3.33Å
330	H	94.9	Very high	94	Very high	40 Å²	40	48.8 Å²	48.8	19%	0.185	23%	0.226	C	C	.	.	S	Bend	trans	-81.4	173.1	180	-61.7	91	0	0	0	111.2	R156 C158 Q325 T327 K332	R156-H330 WeakPolarHBondContact O-CA 3.49Å; R156-H330 WeakPolarHBondContact O-CB 3.18Å; C158-H330 PolarHBondContact O-CD2 3.17Å; C158-H330 PolarHBondContact O-NE2 3.04Å; Q325-H330 HydrophobicContact CG-CB 4.34Å; Q325-H330 PolarHBondContact NE2-O 2.99Å; T327-H330 PolarHBondContact N-ND1 3.46Å; T327-H330 PolarHBondContact O-N 2.98Å; T327-H330 VanDerWaalsContact O-N 3.07Å; T327-H330 PolarHBondContact OG1-CE1 3.33Å; T327-H330 VanDerWaalsContact OG1-CE1 3.25Å; T327-H330 PolarHBondContact OG1-ND1 3.44Å; H330-K332 PolarHBondContact O-N 3.07Å
331	L	95.2	Very high	94	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.031	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-49	137	175	-67	177.7	0	0	0	111.3	R156 Y261 V262 L296 Y323 Q325	R156-L331 HydrophobicContact CB-CD1 3.89Å; R156-L331 HydrophobicContact CB-CD2 4Å; R156-L331 HydrophobicContact CB-CG 3.65Å; R156-L331 VanDerWaalsContact CZ-CD2 3.41Å; R156-L331 PolarHBondContact O-N 3.43Å; Y261-L331 HydrophobicContact CD1-CD1 4.34Å; Y261-L331 HydrophobicContact CD1-CD2 4.22Å; Y261-L331 HydrophobicContact CE1-CD1 4.21Å; Y261-L331 HydrophobicContact CE1-CD2 3.53Å; Y261-L331 HydrophobicContact CE1-CG 4.46Å; Y261-L331 HydrophobicContact CE2-CD2 4.43Å; V262-L331 HydrophobicContact CB-CD1 4.24Å; V262-L331 HydrophobicContact CG1-CD1 4.34Å; V262-L331 HydrophobicContact CG2-CD1 3.93Å; L296-L331 HydrophobicContact CD2-CB 4.33Å; L296-L331 HydrophobicContact CD2-CD1 3.97Å; Y323-L331 HydrophobicContact CE1-CB 4.04Å; Y323-L331 VanDerWaalsContact CE1-O 3.29Å; Y323-L331 WeakPolarHBondContact CE1-O 3.26Å; Y323-L331 PolarHBondContact OH-N 2.81Å; Y323-L331 PolarHBondContact OH-O 3.33Å; Q325-L331 VanDerWaalsContact CG-O 3.3Å; Q325-L331 WeakPolarHBondContact CG-O 3.42Å; Q325-L331 PolarHBondContact NE2-O 2.79Å
332	K	94.6	Very high	94	Very high	93 Å²	93	50.6 Å²	50.6	40%	0.404	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-75.3	142.4	172.7	-68.6	179.2	-175.2	-178.6	0	107.9	R82 H330 E334	R82-K332 PolarHBondContact NH1-O 2.74Å; H330-K332 PolarHBondContact O-N 3.07Å; K332-E334 PolarHBondContact O-N 2.8Å
333	V	95.1	Very high	93.9	Very high	6 Å²	6	53.1 Å²	53.1	4%	0.036	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-62	129.7	168.8	-175.5	0	0	0	0	108.2	R82 L88 Y323 Q325 E335 Y336	R82-V333 WeakPolarHBondContact CD-O 3.47Å; R82-V333 PolarHBondContact NH1-O 3.1Å; L88-V333 HydrophobicContact CD1-CG1 4.36Å; Y323-V333 HydrophobicContact CD1-CG2 3.99Å; Y323-V333 HydrophobicContact CE1-CG2 4.13Å; Q325-V333 HydrophobicContact CB-CG2 4.06Å; V333-E335 VanDerWaalsContact CG1-O 3.23Å; V333-E335 WeakPolarHBondContact CG1-O 3.21Å; V333-Y336 HydrophobicContact CB-CE1 4.33Å; V333-Y336 HydrophobicContact CG1-CD1 3.9Å; V333-Y336 HydrophobicContact CG1-CE1 3.82Å; V333-Y336 HydrophobicContact CG1-CG 4.37Å; V333-Y336 HydrophobicContact CG2-CE1 4.08Å
334	E	95.9	Very high	93.9	Very high	46 Å²	46	57.6 Å²	57.6	22%	0.215	27%	0.274	C	S	.	.	S	Bend	trans	-85.6	-39.7	172.8	-63.1	-58.3	150.2	0	0	110.6	K81 R82 G295 L296 K332	K81-E334 WeakPolarHBondContact CA-O 3.41Å; R82-E334 WeakPolarHBondContact CB-O 3.4Å; R82-E334 IonicContact CZ-OE1 3.95Å; R82-E334 IonicContact CZ-OE2 3.85Å; R82-E334 PolarHBondContact N-O 2.87Å; R82-E334 IonicContact NE-OE2 3.68Å; R82-E334 IonicContact NH1-OE1 3.32Å; R82-E334 PolarHBondContact NH1-OE1 2.93Å; R82-E334 IonicContact NH1-OE2 2.65Å; R82-E334 PolarHBondContact NH1-OE2 3.49Å; R82-E334 VanDerWaalsContact NH1-OE2 3.11Å; R82-E334 IonicContact NH2-OE1 2.85Å; R82-E334 PolarHBondContact NH2-OE1 2.71Å; R82-E334 IonicContact NH2-OE2 2.86Å; R82-E334 PolarHBondContact NH2-OE2 2.93Å; G295-E334 PolarHBondContact O-N 3.01Å; L296-E334 VanDerWaalsContact O-CG 3.26Å; L296-E334 WeakPolarHBondContact O-CG 3.25Å; K332-E334 PolarHBondContact O-N 2.8Å
335	E	95.6	Very high	94.2	Very high	33 Å²	33	55.5 Å²	55.5	15%	0.154	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-145.5	137.3	-179.4	-172.4	172.1	-174.2	0	0	111.6	L80 K81 G295 Q322 V333 I337	L80-E335 CarbonylContact O-C 3.52Å; L80-E335 VanDerWaalsContact O-CA 3.24Å; L80-E335 WeakPolarHBondContact O-CA 3.39Å; K81-E335 WeakPolarHBondContact CE-OE1 3.49Å; K81-E335 WeakPolarHBondContact CE-OE2 3.37Å; K81-E335 HydrophobicContact CG-CB 4.23Å; K81-E335 HydrophobicContact CG-CG 3.74Å; K81-E335 IonicContact NZ-OE1 3.51Å; K81-E335 IonicContact NZ-OE2 3.73Å; G295-E335 WeakPolarHBondContact CA-O 3.12Å; G295-E335 PolarHBondContact O-N 2.98Å; Q322-E335 PolarHBondContact NE2-O 2.87Å; V333-E335 VanDerWaalsContact CG1-O 3.23Å; V333-E335 WeakPolarHBondContact CG1-O 3.21Å; E335-I337 HydrophobicContact CB-CD1 4.2Å; E335-I337 HydrophobicContact CG-CD1 3.84Å
336	Y	96.1	Very high	94.4	Very high	20 Å²	20	54.3 Å²	54.3	8%	0.078	26%	0.258	C	S	.	.			trans	-90	109.8	162.1	-71.2	-57.2	0	0	0	109.4	L80 L88 R89 L90 P91 L94 Q322 V333	L80-Y336 PolarHBondContact O-N 3.21Å; L88-Y336 HydrophobicContact CB-CD2 3.89Å; L88-Y336 HydrophobicContact CB-CE2 3.42Å; L88-Y336 VanDerWaalsContact CB-CE2 3.42Å; L88-Y336 HydrophobicContact CD1-CD2 4.01Å; L88-Y336 HydrophobicContact CD1-CE2 4.2Å; L88-Y336 HydrophobicContact CG-CE2 4.45Å; R89-Y336 WeakPolarHBondContact O-CE2 3.31Å; L90-Y336 HydrophobicContact CD1-CE1 3.87Å; P91-Y336 HydrophobicContact CG-CD1 4.32Å; P91-Y336 HydrophobicContact CG-CD2 4.08Å; P91-Y336 HydrophobicContact CG-CG 3.85Å; L94-Y336 HydrophobicContact CD1-CD1 3.3Å; L94-Y336 HydrophobicContact CD1-CE1 3.69Å; L94-Y336 HydrophobicContact CD1-CG 4.1Å; Q322-Y336 HydrophobicContact CG-CD1 4.3Å; V333-Y336 HydrophobicContact CB-CE1 4.33Å; V333-Y336 HydrophobicContact CG1-CD1 3.9Å; V333-Y336 HydrophobicContact CG1-CE1 3.82Å; V333-Y336 HydrophobicContact CG1-CG 4.37Å; V333-Y336 HydrophobicContact CG2-CE1 4.08Å
337	I	95.6	Very high	94.7	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.275	C	S	.	.			trans	-73.2	129.5	-176.8	-55.7	-59.4	0	0	0	109	W93 L294 E335 K341 F342	W93-I337 PolarHBondContact NE1-O 3.5Å; L294-I337 HydrophobicContact CB-CG1 3.76Å; L294-I337 HydrophobicContact CD1-CG2 4.48Å; E335-I337 HydrophobicContact CB-CD1 4.2Å; E335-I337 HydrophobicContact CG-CD1 3.84Å; I337-K341 HydrophobicContact CG2-CB 3.73Å; I337-K341 HydrophobicContact CG2-CD 3.98Å; I337-K341 HydrophobicContact CG2-CG 3.81Å; I337-F342 HydrophobicContact CB-CD2 4.27Å; I337-F342 HydrophobicContact CB-CE2 3.51Å; I337-F342 HydrophobicContact CB-CZ 3.8Å; I337-F342 HydrophobicContact CG1-CZ 4.46Å; I337-F342 HydrophobicContact CG2-CD2 3.77Å; I337-F342 HydrophobicContact CG2-CE2 3.5Å; I337-F342 VanDerWaalsContact CG2-CE2 3.5Å; I337-F342 HydrophobicContact CG2-CG 4.41Å; I337-F342 HydrophobicContact CG2-CZ 3.91Å
338	P	93.4	Very high	95.1	Very high	20 Å²	20	57.7 Å²	57.7	13%	0.13	27%	0.268	C	S	.	.			trans	-77.9	152.3	-179.4	35.8	-38.6	0	0	0	110.9	W93 E340 K341 F342	W93-P338 HydrophobicContact CZ2-CB 4.4Å; P338-E340 VanDerWaalsContact C-N 3.28Å; P338-E340 VanDerWaalsContact CB-OE1 3.22Å; P338-E340 WeakPolarHBondContact CB-OE1 3.48Å; P338-E340 WeakPolarHBondContact CB-OE2 3.45Å; P338-E340 HydrophobicContact CG-CG 4.41Å; P338-E340 WeakPolarHBondContact CG-OE1 3.4Å; P338-E340 PolarHBondContact O-N 2.98Å; P338-K341 HydrophobicContact CG-CB 4.06Å; P338-K341 WeakPolarHBondContact O-CB 3.21Å; P338-K341 PolarHBondContact O-N 3.28Å; P338-F342 PolarHBondContact O-N 3.05Å
339	P	92.9	Very high	95.4	Very high	41 Å²	41	49.9 Å²	49.9	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-54.7	-36.6	-173.8	-27.9	36.3	0	0	0	114.9	W93 K341 F342 A343 P361	W93-P339 HydrophobicContact CB-CG 4.11Å; W93-P339 HydrophobicContact CD2-CG 4.18Å; W93-P339 HydrophobicContact CG-CG 3.84Å; P339-K341 PolarHBondContact O-N 2.92Å; P339-F342 WeakPolarHBondContact O-CB 3.32Å; P339-F342 PolarHBondContact O-N 2.96Å; P339-F342 VanDerWaalsContact O-N 3.11Å; P339-A343 PolarHBondContact O-N 3.31Å; P339-P361 HydrophobicContact CB-CG 4.44Å; P339-P361 HydrophobicContact CG-CG 4.22Å
340	E	93.7	Very high	95.7	Very high	129 Å²	129	41.9 Å²	41.9	60%	0.603	21%	0.21	S	C	*	.	H	α-helix	trans	-62	-31.4	177.7	63.5	-83.6	-167.6	0	0	112.9	P338 A343 H344	P338-E340 VanDerWaalsContact C-N 3.28Å; P338-E340 VanDerWaalsContact CB-OE1 3.22Å; P338-E340 WeakPolarHBondContact CB-OE1 3.48Å; P338-E340 WeakPolarHBondContact CB-OE2 3.45Å; P338-E340 HydrophobicContact CG-CG 4.41Å; P338-E340 WeakPolarHBondContact CG-OE1 3.4Å; P338-E340 PolarHBondContact O-N 2.98Å; E340-A343 PolarHBondContact O-N 2.83Å; E340-H344 PolarHBondContact O-N 2.89Å
341	K	95.7	Very high	95.8	Very high	41 Å²	41	46.5 Å²	46.5	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-73.9	-32.9	176.4	-174.7	162.4	179.2	178.3	0	111.2	D300 I337 P338 P339 H344 W345	D300-K341 WeakPolarHBondContact OD1-CE 3.35Å; D300-K341 IonicContact OD1-NZ 3.17Å; D300-K341 PolarHBondContact OD1-NZ 3.07Å; D300-K341 IonicContact OD2-NZ 2.69Å; D300-K341 PolarHBondContact OD2-NZ 3.43Å; I337-K341 HydrophobicContact CG2-CB 3.73Å; I337-K341 HydrophobicContact CG2-CD 3.98Å; I337-K341 HydrophobicContact CG2-CG 3.81Å; P338-K341 HydrophobicContact CG-CB 4.06Å; P338-K341 WeakPolarHBondContact O-CB 3.21Å; P338-K341 PolarHBondContact O-N 3.28Å; P339-K341 PolarHBondContact O-N 2.92Å; K341-H344 WeakPolarHBondContact O-CB 3.47Å; K341-H344 PolarHBondContact O-N 3.46Å; K341-W345 PolarHBondContact O-N 3.07Å; K341-W345 VanDerWaalsContact O-N 3.08Å
342	F	96.8	Very high	95.9	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-43.3	169.1	-74.1	-78.2	0	0	0	111.9	L294 Q322 I337 P338 P339 H344 W345 E346 S359 P361	L294-F342 HydrophobicContact CB-CE1 4.49Å; L294-F342 HydrophobicContact CD1-CD1 4.12Å; L294-F342 HydrophobicContact CD1-CE1 3.69Å; L294-F342 HydrophobicContact CD1-CZ 4.29Å; L294-F342 HydrophobicContact CG-CE1 4.29Å; Q322-F342 HydrophobicContact CB-CZ 3.94Å; I337-F342 HydrophobicContact CB-CD2 4.27Å; I337-F342 HydrophobicContact CB-CE2 3.51Å; I337-F342 HydrophobicContact CB-CZ 3.8Å; I337-F342 HydrophobicContact CG1-CZ 4.46Å; I337-F342 HydrophobicContact CG2-CD2 3.77Å; I337-F342 HydrophobicContact CG2-CE2 3.5Å; I337-F342 VanDerWaalsContact CG2-CE2 3.5Å; I337-F342 HydrophobicContact CG2-CG 4.41Å; I337-F342 HydrophobicContact CG2-CZ 3.91Å; P338-F342 PolarHBondContact O-N 3.05Å; P339-F342 WeakPolarHBondContact O-CB 3.32Å; P339-F342 PolarHBondContact O-N 2.96Å; P339-F342 VanDerWaalsContact O-N 3.11Å; F342-H344 VanDerWaalsContact C-N 3.27Å; F342-H344 PolarHBondContact O-N 3.43Å; F342-W345 PolarHBondContact O-N 3.36Å; F342-W345 VanDerWaalsContact O-N 3.08Å; F342-E346 PolarHBondContact O-N 2.91Å; F342-S359 WeakPolarHBondContact CA-OG 3.37Å; F342-S359 WeakPolarHBondContact CD1-OG 3.49Å; F342-S359 VanDerWaalsContact O-CB 3.23Å; F342-S359 WeakPolarHBondContact O-CB 3.47Å; F342-S359 PolarHBondContact O-OG 2.92Å; F342-P361 HydrophobicContact CD2-CB 4.41Å; F342-P361 HydrophobicContact CD2-CG 3.75Å; F342-P361 HydrophobicContact CE2-CB 4.03Å; F342-P361 HydrophobicContact CE2-CG 3.86Å
343	A	95.1	Very high	96	Very high	55 Å²	55	46.2 Å²	46.2	46%	0.455	24%	0.242	S	C	.	.	H	α-helix	trans	-60.8	-37.4	175.5	0	0	0	0	0	112.1	P339 E340 E346 K347	P339-A343 PolarHBondContact O-N 3.31Å; E340-A343 PolarHBondContact O-N 2.83Å; A343-E346 WeakPolarHBondContact O-CB 3.27Å; A343-E346 PolarHBondContact O-N 2.93Å; A343-K347 PolarHBondContact O-N 3.19Å; A343-K347 VanDerWaalsContact O-N 3.17Å
344	H	97.3	Very high	96	Very high	96 Å²	96	46.3 Å²	46.3	44%	0.444	24%	0.242	S	C	.	.	H	α-helix	trans	-58.7	-49.3	170.5	172.2	69.1	0	0	0	111.8	E340 K341 F342 E346 K347 V348	E340-H344 PolarHBondContact O-N 2.89Å; K341-H344 WeakPolarHBondContact O-CB 3.47Å; K341-H344 PolarHBondContact O-N 3.46Å; F342-H344 VanDerWaalsContact C-N 3.27Å; F342-H344 PolarHBondContact O-N 3.43Å; H344-E346 VanDerWaalsContact C-N 3.31Å; H344-E346 PolarHBondContact O-N 3.23Å; H344-K347 WeakPolarHBondContact O-CB 3.21Å; H344-K347 PolarHBondContact O-N 2.87Å; H344-V348 WeakPolarHBondContact O-CG2 3.3Å; H344-V348 PolarHBondContact O-N 3.26Å
345	W	98.1	Very high	95.8	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-31.4	179.2	-68.1	125.5	0	0	0	114	D300 I303 V304 L307 L320 K341 F342 V348 G349	D300-W345 HydrophobicContact CB-CH2 3.96Å; D300-W345 HydrophobicContact CB-CZ2 3.93Å; D300-W345 WeakPolarHBondContact O-CH2 3.36Å; I303-W345 HydrophobicContact CB-CH2 3.63Å; I303-W345 HydrophobicContact CB-CZ2 3.81Å; I303-W345 HydrophobicContact CB-CZ3 4.11Å; I303-W345 HydrophobicContact CG1-CZ2 4.23Å; I303-W345 HydrophobicContact CG2-CD2 3.97Å; I303-W345 HydrophobicContact CG2-CE3 3.69Å; I303-W345 HydrophobicContact CG2-CH2 3.44Å; I303-W345 VanDerWaalsContact CG2-CH2 3.44Å; I303-W345 HydrophobicContact CG2-CZ2 3.69Å; I303-W345 HydrophobicContact CG2-CZ3 3.43Å; I303-W345 VanDerWaalsContact CG2-CZ3 3.43Å; V304-W345 HydrophobicContact CG2-CH2 3.98Å; V304-W345 HydrophobicContact CG2-CZ3 3.81Å; L307-W345 HydrophobicContact CD1-CE3 4.26Å; L320-W345 HydrophobicContact CD1-CB 3.73Å; K341-W345 PolarHBondContact O-N 3.07Å; K341-W345 VanDerWaalsContact O-N 3.08Å; F342-W345 PolarHBondContact O-N 3.36Å; F342-W345 VanDerWaalsContact O-N 3.08Å; W345-V348 HydrophobicContact CE3-CB 4.22Å; W345-V348 HydrophobicContact CE3-CG1 4.27Å; W345-V348 HydrophobicContact CE3-CG2 4.39Å; W345-V348 HydrophobicContact CZ3-CG1 4.34Å; W345-V348 PolarHBondContact O-N 3.04Å; W345-G349 PolarHBondContact O-N 3.24Å
346	E	95.8	Very high	95.3	Very high	30 Å²	30	45.2 Å²	45.2	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-58.8	-49.8	171.5	-162	-178.2	173.1	0	0	110.7	F342 A343 H344 G349 N350	F342-E346 PolarHBondContact O-N 2.91Å; A343-E346 WeakPolarHBondContact O-CB 3.27Å; A343-E346 PolarHBondContact O-N 2.93Å; H344-E346 VanDerWaalsContact C-N 3.31Å; H344-E346 PolarHBondContact O-N 3.23Å; E346-G349 PolarHBondContact O-N 3.41Å; E346-N350 WeakPolarHBondContact O-CB 3.42Å; E346-N350 PolarHBondContact O-N 2.97Å; E346-N350 PolarHBondContact O-ND2 3.45Å
347	K	97.1	Very high	95.2	Very high	124 Å²	124	44.3 Å²	44.3	54%	0.539	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-48.4	178	-179.9	179.8	170.7	-177.6	0	111.2	A343 H344 G349 N350 E351	A343-K347 PolarHBondContact O-N 3.19Å; A343-K347 VanDerWaalsContact O-N 3.17Å; H344-K347 WeakPolarHBondContact O-CB 3.21Å; H344-K347 PolarHBondContact O-N 2.87Å; K347-G349 PolarHBondContact O-N 2.94Å; K347-N350 PolarHBondContact O-N 3.15Å; K347-E351 WeakPolarHBondContact CE-OE1 3.1Å; K347-E351 HydrophobicContact CG-CG 4.38Å; K347-E351 IonicContact NZ-OE1 2.61Å; K347-E351 WeakPolarHBondContact O-CB 3.48Å; K347-E351 WeakPolarHBondContact O-CG 3.3Å; K347-E351 PolarHBondContact O-N 2.77Å
348	V	98	Very high	95	Very high	21 Å²	21	44.4 Å²	44.4	13%	0.127	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-49	178.5	171.6	0	0	0	0	110.9	L307 H344 W345 N350 E351 M352	L307-V348 HydrophobicContact CD1-CG1 4.17Å; H344-V348 WeakPolarHBondContact O-CG2 3.3Å; H344-V348 PolarHBondContact O-N 3.26Å; W345-V348 HydrophobicContact CE3-CB 4.22Å; W345-V348 HydrophobicContact CE3-CG1 4.27Å; W345-V348 HydrophobicContact CE3-CG2 4.39Å; W345-V348 HydrophobicContact CZ3-CG1 4.34Å; W345-V348 PolarHBondContact O-N 3.04Å; V348-N350 VanDerWaalsContact C-N 3.33Å; V348-N350 PolarHBondContact O-N 3.48Å; V348-E351 PolarHBondContact O-N 2.9Å; V348-M352 HydrophobicContact CG1-CG 4.33Å; V348-M352 HydrophobicContact CG1-SD 3.75Å; V348-M352 VanDerWaalsContact O-CG 3.23Å; V348-M352 WeakPolarHBondContact O-CG 3.48Å; V348-M352 PolarHBondContact O-N 3.07Å
349	G	97.3	Very high	95.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-43	178.7	0	0	0	0	0	112.6	W345 E346 K347 M352 G353 F354 T357	W345-G349 PolarHBondContact O-N 3.24Å; E346-G349 PolarHBondContact O-N 3.41Å; K347-G349 PolarHBondContact O-N 2.94Å; G349-M352 PolarHBondContact O-N 3.13Å; G349-G353 PolarHBondContact O-N 3.02Å; G349-F354 VanDerWaalsContact O-CD2 3.3Å; G349-F354 WeakPolarHBondContact O-CD2 3.21Å; G349-F354 PolarHBondContact O-N 2.65Å; G349-T357 VanDerWaalsContact C-OG1 3.28Å; G349-T357 WeakPolarHBondContact CA-OG1 3.05Å
350	N	94.8	Very high	95.1	Very high	75 Å²	75	42.2 Å²	42.2	40%	0.401	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-40.4	177	-66.6	-21.2	0	0	0	112.2	E346 K347 V348 M352 G353 T357	E346-N350 WeakPolarHBondContact O-CB 3.42Å; E346-N350 PolarHBondContact O-N 2.97Å; E346-N350 PolarHBondContact O-ND2 3.45Å; K347-N350 PolarHBondContact O-N 3.15Å; V348-N350 VanDerWaalsContact C-N 3.33Å; V348-N350 PolarHBondContact O-N 3.48Å; N350-M352 VanDerWaalsContact C-N 3.33Å; N350-M352 PolarHBondContact O-N 3.06Å; N350-G353 PolarHBondContact O-N 3.21Å; N350-G353 VanDerWaalsContact O-N 3.09Å; N350-T357 PolarHBondContact N-OG1 3.39Å; N350-T357 VanDerWaalsContact OD1-CB 3.27Å; N350-T357 WeakPolarHBondContact OD1-CB 3.32Å; N350-T357 PolarHBondContact OD1-OG1 3.41Å; N350-T357 VanDerWaalsContact OD1-OG1 3.05Å
351	E	97.5	Very high	95.1	Very high	136 Å²	136	37.1 Å²	37.1	64%	0.636	20%	0.203	S	C	*	.	H	α-helix	trans	-66.2	-33.3	176	-74	175	165.8	0	0	112.6	K347 V348 G353	K347-E351 WeakPolarHBondContact CE-OE1 3.1Å; K347-E351 HydrophobicContact CG-CG 4.38Å; K347-E351 IonicContact NZ-OE1 2.61Å; K347-E351 WeakPolarHBondContact O-CB 3.48Å; K347-E351 WeakPolarHBondContact O-CG 3.3Å; K347-E351 PolarHBondContact O-N 2.77Å; V348-E351 PolarHBondContact O-N 2.9Å; E351-G353 PolarHBondContact O-N 2.87Å
352	M	97.8	Very high	94.8	Very high	55 Å²	55	37 Å²	37	27%	0.271	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-1.6	173.2	-64.9	178	81.8	0	0	113.3	L307 T308 R311 V348 G349 N350	L307-M352 HydrophobicContact CB-CE 3.79Å; L307-M352 HydrophobicContact CB-SD 3.68Å; L307-M352 HydrophobicContact CD1-SD 4.17Å; T308-M352 VanDerWaalsContact N-CE 3.33Å; T308-M352 VanDerWaalsContact OG1-CE 3.27Å; T308-M352 WeakPolarHBondContact OG1-CE 3.24Å; R311-M352 HydrophobicContact CG-CB 4.13Å; R311-M352 PolarHBondContact NE-O 2.8Å; R311-M352 VanDerWaalsContact NE-O 3.13Å; V348-M352 HydrophobicContact CG1-CG 4.33Å; V348-M352 HydrophobicContact CG1-SD 3.75Å; V348-M352 VanDerWaalsContact O-CG 3.23Å; V348-M352 WeakPolarHBondContact O-CG 3.48Å; V348-M352 PolarHBondContact O-N 3.07Å; G349-M352 PolarHBondContact O-N 3.13Å; N350-M352 VanDerWaalsContact C-N 3.33Å; N350-M352 PolarHBondContact O-N 3.06Å
353	G	96.1	Very high	94.6	Very high	38 Å²	38	37.4 Å²	37.4	39%	0.392	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	23.8	172.8	0	0	0	0	0	114.6	R311 G349 N350 E351 V355	R311-G353 VanDerWaalsContact CZ-O 3.24Å; R311-G353 PolarHBondContact NE-O 3.05Å; R311-G353 PolarHBondContact NH2-O 2.69Å; G349-G353 PolarHBondContact O-N 3.02Å; N350-G353 PolarHBondContact O-N 3.21Å; N350-G353 VanDerWaalsContact O-N 3.09Å; E351-G353 PolarHBondContact O-N 2.87Å; G353-V355 PolarHBondContact O-N 3.39Å
354	F	96.2	Very high	94.3	Very high	9 Å²	9	37.2 Å²	37.2	4%	0.039	20%	0.195	C	C	.	.			trans	-57.8	136.8	160	-73.4	-78	0	0	0	108.2	L307 L310 R311 V315 D316 L318 G349 Y356	L307-F354 HydrophobicContact CB-CE2 4.33Å; L307-F354 HydrophobicContact CD2-CE2 4.49Å; L310-F354 HydrophobicContact CB-CE1 4.3Å; L310-F354 HydrophobicContact CB-CZ 3.94Å; R311-F354 VanDerWaalsContact CD-CD1 3.43Å; R311-F354 VanDerWaalsContact CD-CD2 3.46Å; R311-F354 VanDerWaalsContact CD-CG 3.5Å; R311-F354 HydrophobicContact CG-CD2 4.1Å; R311-F354 HydrophobicContact CG-CE1 4.12Å; R311-F354 HydrophobicContact CG-CE2 3.55Å; R311-F354 HydrophobicContact CG-CZ 3.57Å; V315-F354 HydrophobicContact CB-CE1 4.35Å; V315-F354 HydrophobicContact CG1-CE1 4.36Å; V315-F354 WeakPolarHBondContact O-CD1 3.34Å; V315-F354 VanDerWaalsContact O-CE1 3.27Å; V315-F354 WeakPolarHBondContact O-CE1 3.42Å; D316-F354 CarbonylContact O-C 3.26Å; L318-F354 HydrophobicContact CB-CD1 3.86Å; L318-F354 HydrophobicContact CB-CD2 4.22Å; L318-F354 HydrophobicContact CB-CE1 3.98Å; L318-F354 HydrophobicContact CB-CE2 4.36Å; L318-F354 HydrophobicContact CB-CG 4.01Å; L318-F354 HydrophobicContact CB-CZ 4.24Å; L318-F354 HydrophobicContact CD2-CD2 3.99Å; L318-F354 HydrophobicContact CD2-CE2 3.72Å; L318-F354 HydrophobicContact CD2-CZ 4.07Å; G349-F354 VanDerWaalsContact O-CD2 3.3Å; G349-F354 WeakPolarHBondContact O-CD2 3.21Å; G349-F354 PolarHBondContact O-N 2.65Å; F354-Y356 PolarHBondContact O-N 3.01Å
355	V	91.3	Very high	93.6	Very high	49 Å²	49	33.6 Å²	33.6	30%	0.297	18%	0.18	S	C	.	.	S	Bend	trans	-61.8	-31.2	176	179.4	0	0	0	0	110.3	D316 G353 F373 L377	D316-V355 HydrophobicContact CB-CB 4.29Å; D316-V355 HydrophobicContact CB-CG2 3.96Å; D316-V355 PolarHBondContact O-N 2.64Å; G353-V355 PolarHBondContact O-N 3.39Å; V355-F373 HydrophobicContact CG1-CE1 4.38Å; V355-F373 WeakPolarHBondContact O-CE1 3.48Å; V355-F373 WeakPolarHBondContact O-CZ 3.44Å; V355-L377 HydrophobicContact CG1-CD1 4.37Å; V355-L377 HydrophobicContact CG1-CD2 3.44Å; V355-L377 VanDerWaalsContact CG1-CD2 3.44Å
356	Y	85.2	Confident	92.8	Very high	6 Å²	6	34.3 Å²	34.3	2%	0.024	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	131.4	177.2	175.5	-110.2	0	0	0	110.8	L59 C317 L318 F354 A358 A369 G370 F373	L59-Y356 HydrophobicContact CD2-CE2 4.2Å; C317-Y356 WeakPolarHBondContact CA-O 3.42Å; C317-Y356 HydrophobicContact CB-CD1 4.46Å; L318-Y356 PolarHBondContact N-O 3.22Å; F354-Y356 PolarHBondContact O-N 3.01Å; Y356-A358 HydrophobicContact CE1-CB 3.62Å; Y356-A358 WeakPolarHBondContact OH-CB 3.44Å; Y356-A369 VanDerWaalsContact OH-C 3.3Å; Y356-A369 PolarHBondContact OH-O 3.32Å; Y356-G370 WeakPolarHBondContact OH-CA 3.27Å; Y356-G370 PolarHBondContact OH-N 3.28Å; Y356-G370 VanDerWaalsContact OH-N 3.15Å; Y356-F373 HydrophobicContact CD2-CB 3.88Å; Y356-F373 AromaticContact CD2-CD1 3.42Å; Y356-F373 HydrophobicContact CD2-CD1 3.42Å; Y356-F373 VanDerWaalsContact CD2-CD1 3.42Å; Y356-F373 HydrophobicContact CD2-CD2 4.1Å; Y356-F373 AromaticContact CD2-CE1 3.94Å; Y356-F373 HydrophobicContact CD2-CE1 3.94Å; Y356-F373 AromaticContact CD2-CG 3.51Å; Y356-F373 HydrophobicContact CD2-CG 3.51Å; Y356-F373 HydrophobicContact CD2-CZ 4.45Å; Y356-F373 HydrophobicContact CE2-CB 3.87Å; Y356-F373 HydrophobicContact CE2-CD1 4.29Å; Y356-F373 AromaticContact CE2-CG 3.97Å; Y356-F373 HydrophobicContact CE2-CG 3.97Å; Y356-F373 AromaticContact CG-CD1 3.64Å; Y356-F373 HydrophobicContact CG-CD1 3.64Å; Y356-F373 HydrophobicContact CG-CE1 4.09Å; Y356-F373 HydrophobicContact CG-CG 4.17Å
357	T	93.6	Very high	91.5	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.1	169	-50.1	0	0	0	0	109.6	L318 L320 G349 N350	L318-T357 HydrophobicContact CB-CG2 4.34Å; L318-T357 HydrophobicContact CD2-CG2 4Å; L318-T357 HydrophobicContact CG-CG2 4.31Å; L318-T357 CarbonylContact O-C 3.57Å; L318-T357 WeakPolarHBondContact O-CA 3.43Å; L320-T357 HydrophobicContact CD1-CG2 4.1Å; G349-T357 VanDerWaalsContact C-OG1 3.28Å; G349-T357 WeakPolarHBondContact CA-OG1 3.05Å; N350-T357 PolarHBondContact N-OG1 3.39Å; N350-T357 VanDerWaalsContact OD1-CB 3.27Å; N350-T357 WeakPolarHBondContact OD1-CB 3.32Å; N350-T357 PolarHBondContact OD1-OG1 3.41Å; N350-T357 VanDerWaalsContact OD1-OG1 3.05Å
358	A	92.3	Very high	90	Very high	3 Å²	3	30 Å²	30	3%	0.025	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.1	164.5	0	0	0	0	0	108.9	L318 T319 L320 Y356 V363	L318-A358 PolarHBondContact O-N 3.41Å; T319-A358 CarbonylContact C-O 3.56Å; T319-A358 VanDerWaalsContact CA-O 3.25Å; T319-A358 WeakPolarHBondContact CA-O 3.11Å; T319-A358 HydrophobicContact CG2-CB 3.98Å; L320-A358 PolarHBondContact N-O 3.46Å; Y356-A358 HydrophobicContact CE1-CB 3.62Å; Y356-A358 WeakPolarHBondContact OH-CB 3.44Å; A358-V363 HydrophobicContact CB-CG1 3.81Å; A358-V363 HydrophobicContact CB-CG2 4.46Å
359	S	94.8	Very high	87.8	Confident	7 Å²	7	29.5 Å²	29.5	5%	0.049	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	120.8	177.1	-175.1	0	0	0	0	110.2	L320 F342	L320-S359 WeakPolarHBondContact O-CA 3.41Å; F342-S359 WeakPolarHBondContact CA-OG 3.37Å; F342-S359 WeakPolarHBondContact CD1-OG 3.49Å; F342-S359 VanDerWaalsContact O-CB 3.23Å; F342-S359 WeakPolarHBondContact O-CB 3.47Å; F342-S359 PolarHBondContact O-OG 2.92Å
360	G	93.8	Very high	86	Confident	9 Å²	9	29.6 Å²	29.6	9%	0.093	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	158.8	-179.1	0	0	0	0	0	113	L320 G321 L362 V363	L320-G360 PolarHBondContact O-N 3.03Å; G321-G360 WeakPolarHBondContact CA-O 3.23Å; G360-L362 VanDerWaalsContact C-N 3.29Å; G360-L362 PolarHBondContact O-N 3.05Å; G360-V363 WeakPolarHBondContact O-CB 3.04Å; G360-V363 PolarHBondContact O-N 3.47Å
361	P	92.6	Very high	84.6	Confident	22 Å²	22	26.2 Å²	26.2	14%	0.143	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-41.8	-174.7	-22.9	31.4	0	0	0	113.2	L94 Q322 P339 F342 R364	L94-P361 HydrophobicContact CD2-CB 3.47Å; L94-P361 VanDerWaalsContact CD2-CB 3.47Å; L94-P361 HydrophobicContact CG-CB 4.41Å; Q322-P361 WeakPolarHBondContact CB-O 3.42Å; Q322-P361 PolarHBondContact N-O 2.79Å; Q322-P361 VanDerWaalsContact N-O 3.15Å; P339-P361 HydrophobicContact CB-CG 4.44Å; P339-P361 HydrophobicContact CG-CG 4.22Å; F342-P361 HydrophobicContact CD2-CB 4.41Å; F342-P361 HydrophobicContact CD2-CG 3.75Å; F342-P361 HydrophobicContact CE2-CB 4.03Å; F342-P361 HydrophobicContact CE2-CG 3.86Å; P361-R364 PolarHBondContact O-NH1 3.38Å
362	L	90.3	Very high	82.9	Confident	38 Å²	38	23.3 Å²	23.3	20%	0.199	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	1	-179.4	-62.1	179.3	0	0	0	113.6	L94 T96 P126 N127 G360 R364	L94-L362 HydrophobicContact CD2-CD2 4.17Å; T96-L362 HydrophobicContact CG2-CD1 3.56Å; T96-L362 HydrophobicContact CG2-CD2 3.99Å; T96-L362 HydrophobicContact CG2-CG 4.44Å; P126-L362 HydrophobicContact CG-CD2 4.4Å; N127-L362 PolarHBondContact ND2-O 3.41Å; G360-L362 VanDerWaalsContact C-N 3.29Å; G360-L362 PolarHBondContact O-N 3.05Å; L362-R364 PolarHBondContact O-N 3.3Å
363	V	90.8	Very high	81.4	Confident	10 Å²	10	24.2 Å²	24.2	6%	0.061	13%	0.134	C	C	.	.			trans	-60.7	140.2	177.5	170.6	0	0	0	0	110.1	T319 L320 G321 A358 G360 Y367	T319-V363 HydrophobicContact CG2-CG1 4.46Å; L320-V363 WeakPolarHBondContact O-CB 3.23Å; G321-V363 WeakPolarHBondContact CA-O 3.47Å; A358-V363 HydrophobicContact CB-CG1 3.81Å; A358-V363 HydrophobicContact CB-CG2 4.46Å; G360-V363 WeakPolarHBondContact O-CB 3.04Å; G360-V363 PolarHBondContact O-N 3.47Å; V363-Y367 HydrophobicContact CG2-CD1 4.23Å
364	R	89.4	Confident	80.2	Confident	51 Å²	51	22.4 Å²	22.4	19%	0.192	12%	0.115	C	C	.	.			trans	-131.6	162.3	174.9	-62.2	-63.9	179.4	-97.3	3.2	108.5	Q322 M324 P361 L362 S366 Y367	Q322-R364 PolarHBondContact O-NH1 3.22Å; M324-R364 VanDerWaalsContact CG-NH2 3.25Å; P361-R364 PolarHBondContact O-NH1 3.38Å; L362-R364 PolarHBondContact O-N 3.3Å; R364-S366 PolarHBondContact O-N 3.09Å; R364-Y367 WeakPolarHBondContact O-CB 3.48Å; R364-Y367 PolarHBondContact O-N 2.93Å
365	S	83.8	Confident	78.9	Confident	19 Å²	19	22.7 Å²	22.7	13%	0.133	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-42	175.8	51.9	0	0	0	0	111.6	K289	K289-S365 WeakPolarHBondContact CE-O 3.47Å; K289-S365 PolarHBondContact NZ-O 2.89Å
366	S	79.5	Confident	78.1	Confident	17 Å²	17	23 Å²	23	12%	0.119	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	29.1	176.7	61.4	0	0	0	0	114.7	T143 R364	T143-S366 WeakPolarHBondContact OG1-CB 3.45Å; T143-S366 PolarHBondContact OG1-OG 2.86Å; R364-S366 PolarHBondContact O-N 3.09Å
367	Y	69.4	Low	77.9	Confident	29 Å²	29	24.3 Å²	24.3	11%	0.114	12%	0.124	C	C	.	.			trans	-78.5	135.4	178.7	-172.7	-116.9	0	0	0	112.1	N127 E130 V363 R364 A369 G370	N127-Y367 HydrophobicContact CB-CD2 4.4Å; N127-Y367 HydrophobicContact CB-CE2 4.33Å; N127-Y367 WeakPolarHBondContact ND2-CD2 3.3Å; E130-Y367 PolarHBondContact OE1-OH 3.49Å; E130-Y367 PolarHBondContact OE2-OH 3.41Å; V363-Y367 HydrophobicContact CG2-CD1 4.23Å; R364-Y367 WeakPolarHBondContact O-CB 3.48Å; R364-Y367 PolarHBondContact O-N 2.93Å; Y367-A369 HydrophobicContact CD1-CB 3.97Å; Y367-A369 HydrophobicContact CE1-CB 4.06Å; Y367-A369 PolarHBondContact O-N 3.28Å; Y367-G370 PolarHBondContact O-N 3.23Å
368	K	65.8	Low	77.1	Confident	35 Å²	35	25 Å²	25	15%	0.152	13%	0.128	C	C	.	.	H	α-helix	trans	-42.5	-39.5	-171.7	-71.8	178.6	139.5	178.1	0	115.9	E130 C131 G370 E371 F372	E130-K368 PolarHBondContact O-NZ 3.02Å; C131-K368 WeakPolarHBondContact O-CE 3.42Å; C131-K368 PolarHBondContact O-NZ 2.8Å; K368-G370 VanDerWaalsContact C-N 3.27Å; K368-G370 PolarHBondContact O-N 3.34Å; K368-E371 PolarHBondContact O-N 3.12Å; K368-F372 PolarHBondContact O-N 3.48Å; K368-F372 VanDerWaalsContact O-N 3.07Å
369	A	52	Low	76.4	Confident	10 Å²	10	30 Å²	30	8%	0.083	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-37.4	-177.8	0	0	0	0	0	112.7	L59 Y356 Y367 F373	L59-A369 HydrophobicContact CD1-CB 3.72Å; Y356-A369 VanDerWaalsContact OH-C 3.3Å; Y356-A369 PolarHBondContact OH-O 3.32Å; Y367-A369 HydrophobicContact CD1-CB 3.97Å; Y367-A369 HydrophobicContact CE1-CB 4.06Å; Y367-A369 PolarHBondContact O-N 3.28Å; A369-F373 PolarHBondContact O-N 3.33Å
370	G	59.2	Low	75.6	Confident	2 Å²	2	35.8 Å²	35.8	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-72.7	-34.9	176.9	0	0	0	0	0	113.2	Y356 Y367 K368 F373 L374	Y356-G370 WeakPolarHBondContact OH-CA 3.27Å; Y356-G370 PolarHBondContact OH-N 3.28Å; Y356-G370 VanDerWaalsContact OH-N 3.15Å; Y367-G370 PolarHBondContact O-N 3.23Å; K368-G370 VanDerWaalsContact C-N 3.27Å; K368-G370 PolarHBondContact O-N 3.34Å; G370-F373 PolarHBondContact O-N 3.37Å; G370-L374 VanDerWaalsContact O-CB 3.28Å; G370-L374 WeakPolarHBondContact O-CB 3.48Å; G370-L374 WeakPolarHBondContact O-CD1 3.39Å; G370-L374 WeakPolarHBondContact O-CG 2.93Å; G370-L374 PolarHBondContact O-N 3.44Å
371	E	64.7	Low	75.1	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.019	18%	0.183	C	C	.	.	H	α-helix	trans	-72.1	-38.2	-177.4	-58.5	171	158.3	0	0	111.4	T141 Y188 V190 K368 L374 K375	T141-E371 WeakPolarHBondContact CB-OE2 3.41Å; T141-E371 WeakPolarHBondContact CG2-OE1 3.48Å; T141-E371 WeakPolarHBondContact CG2-OE2 3.23Å; T141-E371 PolarHBondContact OG1-OE2 2.79Å; Y188-E371 HydrophobicContact CD1-CB 3.97Å; Y188-E371 HydrophobicContact CD1-CG 3.91Å; Y188-E371 HydrophobicContact CE1-CB 4.03Å; Y188-E371 HydrophobicContact CE1-CG 3.69Å; Y188-E371 HydrophobicContact CG-CB 4.22Å; V190-E371 WeakPolarHBondContact CG2-OE1 3.39Å; K368-E371 PolarHBondContact O-N 3.12Å; E371-L374 PolarHBondContact O-N 3.25Å; E371-K375 WeakPolarHBondContact O-CB 3.45Å; E371-K375 PolarHBondContact O-N 2.69Å
372	F	63.2	Low	74.3	Confident	75 Å²	75	42.5 Å²	42.5	33%	0.329	20%	0.195	S	C	.	.	H	α-helix	trans	-63.4	-45.5	174.6	-174.1	-101.6	0	0	0	111.9	K368 K375 N376	K368-F372 PolarHBondContact O-N 3.48Å; K368-F372 VanDerWaalsContact O-N 3.07Å; F372-K375 PolarHBondContact O-N 2.94Å; F372-N376 WeakPolarHBondContact CD1-ND2 3.37Å; F372-N376 WeakPolarHBondContact CE1-ND2 3.36Å; F372-N376 VanDerWaalsContact CZ-ND2 3.32Å; F372-N376 WeakPolarHBondContact CZ-ND2 3.38Å; F372-N376 PolarHBondContact O-N 3.38Å; F372-N376 PolarHBondContact O-ND2 3.22Å
373	F	65.9	Low	73.6	Confident	74 Å²	74	45.3 Å²	45.3	33%	0.325	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-48.1	176.6	-176.9	-89.2	0	0	0	111.4	V355 Y356 A369 G370 K375 N376 L377	V355-F373 HydrophobicContact CG1-CE1 4.38Å; V355-F373 WeakPolarHBondContact O-CE1 3.48Å; V355-F373 WeakPolarHBondContact O-CZ 3.44Å; Y356-F373 HydrophobicContact CD2-CB 3.88Å; Y356-F373 AromaticContact CD2-CD1 3.42Å; Y356-F373 HydrophobicContact CD2-CD1 3.42Å; Y356-F373 VanDerWaalsContact CD2-CD1 3.42Å; Y356-F373 HydrophobicContact CD2-CD2 4.1Å; Y356-F373 AromaticContact CD2-CE1 3.94Å; Y356-F373 HydrophobicContact CD2-CE1 3.94Å; Y356-F373 AromaticContact CD2-CG 3.51Å; Y356-F373 HydrophobicContact CD2-CG 3.51Å; Y356-F373 HydrophobicContact CD2-CZ 4.45Å; Y356-F373 HydrophobicContact CE2-CB 3.87Å; Y356-F373 HydrophobicContact CE2-CD1 4.29Å; Y356-F373 AromaticContact CE2-CG 3.97Å; Y356-F373 HydrophobicContact CE2-CG 3.97Å; Y356-F373 AromaticContact CG-CD1 3.64Å; Y356-F373 HydrophobicContact CG-CD1 3.64Å; Y356-F373 HydrophobicContact CG-CE1 4.09Å; Y356-F373 HydrophobicContact CG-CG 4.17Å; A369-F373 PolarHBondContact O-N 3.33Å; G370-F373 PolarHBondContact O-N 3.37Å; F373-K375 VanDerWaalsContact C-N 3.32Å; F373-K375 PolarHBondContact O-N 2.78Å; F373-N376 PolarHBondContact O-N 3.02Å; F373-L377 HydrophobicContact CE1-CB 4.42Å; F373-L377 HydrophobicContact CE1-CD2 4.27Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 PolarHBondContact O-N 3.46Å
374	L	69.6	Low	72.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-42.2	178	-75.1	167.3	0	0	0	111.8	Y188 V247 L287 K289 G370 E371 N376 L377 L378	Y188-L374 HydrophobicContact CE2-CB 4.33Å; V247-L374 HydrophobicContact CG2-CD1 4.4Å; V247-L374 HydrophobicContact CG2-CD2 4.38Å; L287-L374 HydrophobicContact CD1-CD2 3.66Å; K289-L374 HydrophobicContact CD-CD1 4.13Å; G370-L374 VanDerWaalsContact O-CB 3.28Å; G370-L374 WeakPolarHBondContact O-CB 3.48Å; G370-L374 WeakPolarHBondContact O-CD1 3.39Å; G370-L374 WeakPolarHBondContact O-CG 2.93Å; G370-L374 PolarHBondContact O-N 3.44Å; E371-L374 PolarHBondContact O-N 3.25Å; L374-N376 PolarHBondContact O-N 2.93Å; L374-L377 PolarHBondContact O-N 2.55Å; L374-L378 VanDerWaalsContact O-CB 3.28Å; L374-L378 WeakPolarHBondContact O-CB 3.43Å; L374-L378 WeakPolarHBondContact O-CD1 3.45Å; L374-L378 VanDerWaalsContact O-CG 3.23Å; L374-L378 WeakPolarHBondContact O-CG 3.44Å; L374-L378 PolarHBondContact O-N 3.17Å
375	K	70.1	Confident	72.1	Confident	15 Å²	15	52.7 Å²	52.7	7%	0.065	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-48.3	175	177	180	-180	-176.2	0	111.5	T139 D187 Y188 L222 E371 F372 F373 K379	T139-K375 PolarHBondContact OG1-NZ 3.24Å; D187-K375 HydrophobicContact CB-CD 4.33Å; D187-K375 VanDerWaalsContact CB-NZ 3.3Å; D187-K375 VanDerWaalsContact CG-NZ 3.25Å; D187-K375 IonicContact OD2-NZ 2.78Å; D187-K375 PolarHBondContact OD2-NZ 3.37Å; Y188-K375 HydrophobicContact CD2-CB 4.46Å; L222-K375 HydrophobicContact CD1-CB 3.82Å; L222-K375 HydrophobicContact CD1-CG 3.81Å; E371-K375 WeakPolarHBondContact O-CB 3.45Å; E371-K375 PolarHBondContact O-N 2.69Å; F372-K375 PolarHBondContact O-N 2.94Å; F373-K375 VanDerWaalsContact C-N 3.32Å; F373-K375 PolarHBondContact O-N 2.78Å; K375-K379 HydrophobicContact CG-CD 4.31Å; K375-K379 WeakPolarHBondContact O-CB 3.02Å; K375-K379 VanDerWaalsContact O-CG 3.26Å; K375-K379 WeakPolarHBondContact O-CG 3.45Å; K375-K379 PolarHBondContact O-N 3.31Å
376	N	74.9	Confident	71.5	Confident	56 Å²	56	55 Å²	55	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-40.4	179.9	-69	-23.3	0	0	0	112	F372 F373 L374 K379 K380	F372-N376 WeakPolarHBondContact CD1-ND2 3.37Å; F372-N376 WeakPolarHBondContact CE1-ND2 3.36Å; F372-N376 VanDerWaalsContact CZ-ND2 3.32Å; F372-N376 WeakPolarHBondContact CZ-ND2 3.38Å; F372-N376 PolarHBondContact O-N 3.38Å; F372-N376 PolarHBondContact O-ND2 3.22Å; F373-N376 PolarHBondContact O-N 3.02Å; L374-N376 PolarHBondContact O-N 2.93Å; N376-K379 PolarHBondContact O-N 3.08Å; N376-K380 VanDerWaalsContact O-CG 3.31Å; N376-K380 WeakPolarHBondContact O-CG 3.35Å; N376-K380 PolarHBondContact O-N 3.11Å
377	L	79.4	Confident	70.9	Confident	34 Å²	34	61.6 Å²	61.6	18%	0.178	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-47.8	175.8	-179.2	71.7	0	0	0	111.8	L287 V355 F373 L374 K380 R381	L287-L377 HydrophobicContact CD1-CD2 3.84Å; L287-L377 HydrophobicContact CD2-CD2 4.33Å; V355-L377 HydrophobicContact CG1-CD1 4.37Å; V355-L377 HydrophobicContact CG1-CD2 3.44Å; V355-L377 VanDerWaalsContact CG1-CD2 3.44Å; F373-L377 HydrophobicContact CE1-CB 4.42Å; F373-L377 HydrophobicContact CE1-CD2 4.27Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 PolarHBondContact O-N 3.46Å; L374-L377 PolarHBondContact O-N 2.55Å; L377-K380 PolarHBondContact O-N 2.99Å; L377-R381 WeakPolarHBondContact O-CG 3.34Å; L377-R381 PolarHBondContact O-N 2.91Å
378	L	77.6	Confident	70.7	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-38.3	179.9	-73.2	167.3	0	0	0	111.7	L222 D246 V247 L287 L374 R381 K382	L222-L378 HydrophobicContact CD1-CB 4.37Å; L222-L378 HydrophobicContact CD1-CD1 4.12Å; L222-L378 HydrophobicContact CD2-CB 4.45Å; L222-L378 HydrophobicContact CD2-CD1 4.24Å; D246-L378 HydrophobicContact CB-CD1 3.82Å; V247-L378 HydrophobicContact CG2-CD1 4.04Å; L287-L378 HydrophobicContact CD1-CD1 4.4Å; L287-L378 HydrophobicContact CD1-CD2 3.7Å; L287-L378 HydrophobicContact CD1-CG 3.92Å; L287-L378 HydrophobicContact CG-CD2 4.36Å; L374-L378 VanDerWaalsContact O-CB 3.28Å; L374-L378 WeakPolarHBondContact O-CB 3.43Å; L374-L378 WeakPolarHBondContact O-CD1 3.45Å; L374-L378 VanDerWaalsContact O-CG 3.23Å; L374-L378 WeakPolarHBondContact O-CG 3.44Å; L374-L378 PolarHBondContact O-N 3.17Å; L378-R381 PolarHBondContact O-N 3.08Å; L378-K382 WeakPolarHBondContact O-CG 3.46Å; L378-K382 PolarHBondContact O-N 3.17Å
379	K	78.3	Confident	70.9	Confident	106 Å²	106	68.2 Å²	68.2	46%	0.461	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-48.2	172.7	-77.7	-178.2	178.3	-166	0	111.3	K375 N376 R381 K382 T383	K375-K379 HydrophobicContact CG-CD 4.31Å; K375-K379 WeakPolarHBondContact O-CB 3.02Å; K375-K379 VanDerWaalsContact O-CG 3.26Å; K375-K379 WeakPolarHBondContact O-CG 3.45Å; K375-K379 PolarHBondContact O-N 3.31Å; N376-K379 PolarHBondContact O-N 3.08Å; K379-R381 PolarHBondContact O-N 3.37Å; K379-K382 PolarHBondContact O-N 2.95Å; K379-T383 PolarHBondContact O-N 3.42Å; K379-T383 PolarHBondContact O-OG1 3.31Å; K379-T383 VanDerWaalsContact O-OG1 3.07Å
380	K	78.1	Confident	71.2	Confident	130 Å²	130	74.1 Å²	74.1	57%	0.565	35%	0.352	S	S	*	.	H	α-helix	trans	-57.8	-48.2	176.9	-74.4	178	-179.7	-173.4	0	111.9	N376 L377 K382 T383 E384	N376-K380 VanDerWaalsContact O-CG 3.31Å; N376-K380 WeakPolarHBondContact O-CG 3.35Å; N376-K380 PolarHBondContact O-N 3.11Å; L377-K380 PolarHBondContact O-N 2.99Å; K380-K382 PolarHBondContact O-N 3.49Å; K380-T383 PolarHBondContact O-N 2.95Å; K380-E384 WeakPolarHBondContact O-CG 3.4Å; K380-E384 PolarHBondContact O-N 3.18Å
381	R	81.4	Confident	71.3	Confident	81 Å²	81	80.4 Å²	80.4	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-59.7	-43.2	177.2	-74	-175.8	177.9	-174	1.4	112.7	L377 L378 K379 E384 I385	L377-R381 WeakPolarHBondContact O-CG 3.34Å; L377-R381 PolarHBondContact O-N 2.91Å; L378-R381 PolarHBondContact O-N 3.08Å; K379-R381 PolarHBondContact O-N 3.37Å; R381-E384 PolarHBondContact O-N 3.32Å; R381-I385 VanDerWaalsContact O-CG1 3.31Å; R381-I385 WeakPolarHBondContact O-CG1 2.78Å; R381-I385 PolarHBondContact O-N 3.19Å
382	K	77.3	Confident	70.9	Confident	91 Å²	91	84.3 Å²	84.3	40%	0.396	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-44.6	176.4	-75.8	178.7	-177.1	175.3	0	111	D246 L378 K379 K380 E384 I385 T386	D246-K382 IonicContact OD1-NZ 2.77Å; D246-K382 PolarHBondContact OD1-NZ 3.12Å; D246-K382 VanDerWaalsContact OD1-NZ 3.1Å; L378-K382 WeakPolarHBondContact O-CG 3.46Å; L378-K382 PolarHBondContact O-N 3.17Å; K379-K382 PolarHBondContact O-N 2.95Å; K380-K382 PolarHBondContact O-N 3.49Å; K382-E384 PolarHBondContact O-N 3.47Å; K382-I385 PolarHBondContact O-N 3.21Å; K382-T386 PolarHBondContact O-N 3.09Å; K382-T386 VanDerWaalsContact O-N 3.07Å; K382-T386 PolarHBondContact O-OG1 3.49Å
383	T	74.9	Confident	70.2	Confident	96 Å²	96	88.2 Å²	88.2	59%	0.589	45%	0.45	S	S	*	.	H	α-helix	trans	-63	-40.8	177.2	-54.8	0	0	0	0	112.6	K379 K380 R387	K379-T383 PolarHBondContact O-N 3.42Å; K379-T383 PolarHBondContact O-OG1 3.31Å; K379-T383 VanDerWaalsContact O-OG1 3.07Å; K380-T383 PolarHBondContact O-N 2.95Å; T383-R387 WeakPolarHBondContact O-CB 2.87Å; T383-R387 PolarHBondContact O-N 3.26Å
384	E	74.8	Confident	70.5	Confident	121 Å²	121	88.9 Å²	88.9	57%	0.565	46%	0.457	S	S	*	.	H	α-helix	trans	-64.6	-43.8	177.4	-73.6	169.6	-177.9	0	0	112.2	K380 R381 K382 R387 T388	K380-E384 WeakPolarHBondContact O-CG 3.4Å; K380-E384 PolarHBondContact O-N 3.18Å; R381-E384 PolarHBondContact O-N 3.32Å; K382-E384 PolarHBondContact O-N 3.47Å; E384-R387 PolarHBondContact O-N 3.1Å; E384-T388 PolarHBondContact O-N 3.15Å; E384-T388 PolarHBondContact O-OG1 3.27Å
385	I	74.8	Confident	70.5	Confident	96 Å²	96	93.6 Å²	93.6	49%	0.492	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-51.3	176.2	-68.2	165.6	0	0	0	110.2	R381 K382 R387 T388 E389	R381-I385 VanDerWaalsContact O-CG1 3.31Å; R381-I385 WeakPolarHBondContact O-CG1 2.78Å; R381-I385 PolarHBondContact O-N 3.19Å; K382-I385 PolarHBondContact O-N 3.21Å; I385-R387 VanDerWaalsContact C-N 3.27Å; I385-R387 PolarHBondContact O-N 3.3Å; I385-T388 PolarHBondContact O-N 2.97Å; I385-T388 VanDerWaalsContact O-N 3.11Å; I385-E389 HydrophobicContact CG2-CG 4.41Å; I385-E389 WeakPolarHBondContact O-CG 3.44Å; I385-E389 PolarHBondContact O-N 3.13Å
386	T	71.6	Confident	70.5	Confident	67 Å²	67	97.9 Å²	97.9	41%	0.411	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-37.8	179.7	-54.5	0	0	0	0	112.1	K382 Q390	K382-T386 PolarHBondContact O-N 3.09Å; K382-T386 VanDerWaalsContact O-N 3.07Å; K382-T386 PolarHBondContact O-OG1 3.49Å; T386-Q390 WeakPolarHBondContact O-CB 3.49Å; T386-Q390 VanDerWaalsContact O-CG 3.26Å; T386-Q390 WeakPolarHBondContact O-CG 3.42Å; T386-Q390 PolarHBondContact O-N 2.61Å; T386-Q390 VanDerWaalsContact O-N 3.1Å
387	R	65.7	Low	70.3	Confident	155 Å²	155	100.4 Å²	100.4	59%	0.585	52%	0.516	S	S	*	.	H	α-helix	trans	-67.3	-40.5	177.1	-159.5	179.9	83.7	-171.8	-2.2	111.9	T383 E384 I385 Q390 E391	T383-R387 WeakPolarHBondContact O-CB 2.87Å; T383-R387 PolarHBondContact O-N 3.26Å; E384-R387 PolarHBondContact O-N 3.1Å; I385-R387 VanDerWaalsContact C-N 3.27Å; I385-R387 PolarHBondContact O-N 3.3Å; R387-Q390 PolarHBondContact O-N 2.98Å; R387-E391 IonicContact NE-OE1 2.7Å; R387-E391 PolarHBondContact NE-OE1 3.5Å; R387-E391 WeakPolarHBondContact O-CB 3.41Å; R387-E391 WeakPolarHBondContact O-CG 3.31Å; R387-E391 PolarHBondContact O-N 2.93Å
388	T	66.1	Low	69.7	Low	86 Å²	86	104.6 Å²	104.6	53%	0.528	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-38	179.1	-43.5	0	0	0	0	111.4	E384 I385 E391 A392	E384-T388 PolarHBondContact O-N 3.15Å; E384-T388 PolarHBondContact O-OG1 3.27Å; I385-T388 PolarHBondContact O-N 2.97Å; I385-T388 VanDerWaalsContact O-N 3.11Å; T388-E391 PolarHBondContact O-N 2.99Å; T388-A392 VanDerWaalsContact O-CB 3.31Å; T388-A392 WeakPolarHBondContact O-CB 3.36Å; T388-A392 PolarHBondContact O-N 3.28Å; T388-A392 VanDerWaalsContact O-N 3.14Å
389	E	68.5	Low	69.2	Low	118 Å²	118	110.5 Å²	110.5	55%	0.551	57%	0.567	S	S	*	*	H	α-helix	trans	-67.7	-34.8	175.5	-70.6	172.2	164.1	0	0	112.6	I385 S393	I385-E389 HydrophobicContact CG2-CG 4.41Å; I385-E389 WeakPolarHBondContact O-CG 3.44Å; I385-E389 PolarHBondContact O-N 3.13Å; E389-S393 PolarHBondContact O-N 3.17Å; E389-S393 PolarHBondContact O-OG 3.11Å
390	Q	58.9	Low	68.5	Low	134 Å²	134	110.8 Å²	110.8	63%	0.626	58%	0.575	S	S	*	*	H	α-helix	trans	-75.1	-32.2	175.8	-74.3	174.8	-12.2	0	0	113.4	T386 R387 A392	T386-Q390 WeakPolarHBondContact O-CB 3.49Å; T386-Q390 VanDerWaalsContact O-CG 3.26Å; T386-Q390 WeakPolarHBondContact O-CG 3.42Å; T386-Q390 PolarHBondContact O-N 2.61Å; T386-Q390 VanDerWaalsContact O-N 3.1Å; R387-Q390 PolarHBondContact O-N 2.98Å; Q390-A392 VanDerWaalsContact C-N 3.3Å
391	E	62.4	Low	67.8	Low	133 Å²	133	109.3 Å²	109.3	62%	0.621	58%	0.575	S	S	*	*	H	α-helix	trans	-76.5	-20	174.6	-72.8	170.1	-171.6	0	0	112.3	R387 T388	R387-E391 IonicContact NE-OE1 2.7Å; R387-E391 PolarHBondContact NE-OE1 3.5Å; R387-E391 WeakPolarHBondContact O-CB 3.41Å; R387-E391 WeakPolarHBondContact O-CG 3.31Å; R387-E391 PolarHBondContact O-N 2.93Å; T388-E391 PolarHBondContact O-N 2.99Å
392	A	56	Low	66.6	Low	87 Å²	87	111.7 Å²	111.7	72%	0.719	60%	0.598	S	S	*	*			trans	-93.5	-9.2	178.2	0	0	0	0	0	114.4	T388 Q390	T388-A392 VanDerWaalsContact O-CB 3.31Å; T388-A392 WeakPolarHBondContact O-CB 3.36Å; T388-A392 PolarHBondContact O-N 3.28Å; T388-A392 VanDerWaalsContact O-N 3.14Å; Q390-A392 VanDerWaalsContact C-N 3.3Å
393	S	48.7	Very low	65.7	Low	156 Å²	156	113.5 Å²	113.5	100%	1.091	62%	0.616	S	S	*	*			trans	-101.7	0	175.2	-58	0	0	0	0	110.6	E389	E389-S393 PolarHBondContact O-N 3.17Å; E389-S393 PolarHBondContact O-OG 3.11Å

Retrieved 393 of 393 residues in 1741.3 ms (Link to these results)

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