A0A087XRS6_POEFO Loading...

Phosphomevalonate kinase

Catalyzes the reversible ATP-dependent phosphorylation of mevalonate 5-phosphate to produce mevalonate diphosphate and ADP, a key step in the mevalonic acid mediated biosynthesis of isopentenyl diphosphate and other polyisoprenoid metabolites.

AlphaFold DB , UniProt , Accession A0A087XRS6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 264 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	42.1	Very low	37.5	Very low	242 Å²	242	147.6 Å²	147.6	100%	1.192	86%	0.856	S	S	*	*				0	87.3	0	-168.3	173.8	-179	0	0	108.4
2	V	34.1	Very low	36.9	Very low	145 Å²	145	145.4 Å²	145.4	88%	0.879	85%	0.845	S	S	*	*			trans	-147.5	121.8	150.9	174.4	0	0	0	0	103.5
3	R	34.2	Very low	36.3	Very low	249 Å²	249	145.3 Å²	145.3	94%	0.94	84%	0.838	S	S	*	*			trans	-110.3	133.7	178.5	-81.8	-176.1	171.3	-173.3	-2.2	108.5
4	S	40.4	Very low	35.9	Very low	115 Å²	115	150.6 Å²	150.6	80%	0.804	84%	0.838	S	S	*	*			trans	-164.6	100.1	149.6	53.6	0	0	0	0	105.1
5	G	32.3	Very low	35.6	Very low	80 Å²	80	149.3 Å²	149.3	83%	0.825	83%	0.834	S	S	*	*				75	122.4	84.2	0	0	0	0	0	108.9
6	S	34.5	Very low	35.4	Very low	109 Å²	109	149.2 Å²	149.2	76%	0.762	83%	0.826	S	S	*	*			cis	-161.7	154.8	5.1	47.3	0	0	0	0	108.1
7	D	42.1	Very low	35.2	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	82%	0.819	S	S	*	*			trans	44.3	97.3	154.2	-65.2	-13.1	0	0	0	120.5
8	D	37.9	Very low	35.6	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	82%	0.821	S	S	*	*				-176.9	119.5	101.6	-97.5	-26.2	0	0	0	109.2	H10	D8-H10 PolarHBondContact O-N 3.33Å
9	G	47.7	Very low	35.8	Very low	77 Å²	77	143.5 Å²	143.5	79%	0.794	80%	0.802	S	S	*	*			trans	-73.9	83.8	-174.3	0	0	0	0	0	113.2
10	H	33.3	Very low	36.2	Very low	173 Å²	173	141 Å²	141	80%	0.801	79%	0.792	S	S	*	*			trans	-136.5	94.4	157.9	-80.2	-62.6	0	0	0	110.7	D8 V12	D8-H10 PolarHBondContact O-N 3.33Å; H10-V12 PolarHBondContact O-N 3.07Å; H10-V12 VanDerWaalsContact O-N 3.13Å
11	V	33.6	Very low	36.6	Very low	132 Å²	132	144.9 Å²	144.9	80%	0.8	80%	0.795	S	S	*	*			trans	-72.7	100.6	163.8	179.4	0	0	0	0	107.4	L13	V11-L13 HydrophobicContact CG1-CD2 4.28Å; V11-L13 HydrophobicContact CG1-CG 4.33Å; V11-L13 PolarHBondContact O-N 3.5Å
12	V	30.9	Very low	36.5	Very low	121 Å²	121	141.4 Å²	141.4	73%	0.733	77%	0.773	S	S	*	*			trans	-76.4	98.6	168	-179.5	0	0	0	0	107.6	H10 R14	H10-V12 PolarHBondContact O-N 3.07Å; H10-V12 VanDerWaalsContact O-N 3.13Å; V12-R14 PolarHBondContact O-N 3.03Å
13	L	29.3	Very low	36.8	Very low	144 Å²	144	140.1 Å²	140.1	75%	0.754	76%	0.757	S	S	*	*			trans	-67.8	101.1	164.4	-69.6	172.3	0	0	0	107.8	V11 V15	V11-L13 HydrophobicContact CG1-CD2 4.28Å; V11-L13 HydrophobicContact CG1-CG 4.33Å; V11-L13 PolarHBondContact O-N 3.5Å; L13-V15 PolarHBondContact O-N 2.97Å
14	R	29.7	Very low	37.1	Very low	220 Å²	220	134.3 Å²	134.3	83%	0.83	74%	0.741	S	S	*	*			trans	-65.5	100.8	162.6	-91.8	-170.7	-178.7	-172.5	2.2	107.7	V12 E16	V12-R14 PolarHBondContact O-N 3.03Å; R14-E16 PolarHBondContact O-N 2.88Å
15	V	31.6	Very low	37.1	Very low	130 Å²	130	136 Å²	136	79%	0.788	74%	0.741	S	S	*	*			trans	-78.5	102	160.7	-176.5	0	0	0	0	105.8	L13	L13-V15 PolarHBondContact O-N 2.97Å
16	E	32.4	Very low	37.4	Very low	148 Å²	148	139.9 Å²	139.9	69%	0.692	74%	0.742	S	S	*	*			trans	-66.8	134	165.5	-64.6	-149.5	157.3	0	0	108.6	R14 V18	R14-E16 PolarHBondContact O-N 2.88Å; E16-V18 PolarHBondContact O-N 2.73Å
17	P	32.4	Very low	37.2	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	75%	0.746	S	S	*	*			trans	-65.3	112.7	176.9	25.4	-30.6	0	0	0	108.8	L19	P17-L19 PolarHBondContact O-N 2.83Å
18	V	42.3	Very low	36.9	Very low	142 Å²	142	141 Å²	141	86%	0.861	74%	0.743	S	S	*	*			trans	-69.1	98.7	165.8	-179.5	0	0	0	0	106.7	E16	E16-V18 PolarHBondContact O-N 2.73Å
19	L	40.2	Very low	36.8	Very low	88 Å²	88	141.9 Å²	141.9	46%	0.461	74%	0.741	S	S	.	*			trans	-63.5	136.4	174.2	-62.8	168.8	0	0	0	109	P17 R21	P17-L19 PolarHBondContact O-N 2.83Å; L19-R21 PolarHBondContact O-N 3.14Å
20	P	42.8	Very low	36	Very low	94 Å²	94	147 Å²	147	61%	0.61	75%	0.749	S	S	*	*			trans	-55.8	138.4	170.2	-21.5	31.6	0	0	0	110	F22 Q23	P20-F22 PolarHBondContact O-N 2.89Å; P20-Q23 PolarHBondContact O-N 2.77Å
21	R	43.8	Very low	36	Very low	222 Å²	222	143.2 Å²	143.2	84%	0.838	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-50.5	-15.4	-175.2	-80.6	-175.9	172.8	-169.4	-1.7	115.6	L19 Q23	L19-R21 PolarHBondContact O-N 3.14Å; R21-Q23 VanDerWaalsContact C-N 3.28Å; R21-Q23 PolarHBondContact O-N 2.85Å
22	F	41.7	Very low	35.9	Very low	170 Å²	170	142.9 Å²	142.9	75%	0.746	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-68.4	-21.2	175.3	-142.9	-97.5	0	0	0	114.2	P20	P20-F22 PolarHBondContact O-N 2.89Å
23	Q	39.5	Very low	36	Very low	117 Å²	117	144.7 Å²	144.7	55%	0.547	75%	0.749	S	S	.	*	G	3₁₀ helix	trans	-94.6	-7.7	-176.7	-71.6	-170.3	-32.8	0	0	115.1	P20 R21	P20-Q23 PolarHBondContact O-N 2.77Å; R21-Q23 VanDerWaalsContact C-N 3.28Å; R21-Q23 PolarHBondContact O-N 2.85Å
24	Q	41.1	Very low	36.3	Very low	128 Å²	128	146.6 Å²	146.6	60%	0.598	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-81.1	-19.5	-179.8	-79.5	172	-13.7	0	0	113.7
25	N	39.1	Very low	36.4	Very low	149 Å²	149	143.5 Å²	143.5	80%	0.797	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-91.6	5.8	-175.5	-77.5	-5.1	0	0	0	115.4
26	L	38.8	Very low	36.4	Very low	163 Å²	163	142.7 Å²	142.7	85%	0.853	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-114.5	15.9	-176.8	-149.7	77.9	0	0	0	114
27	L	31.5	Very low	36.3	Very low	162 Å²	162	144.2 Å²	144.2	85%	0.848	75%	0.752	S	S	*	*	S	Bend	trans	-117	23.7	179.7	-131.1	103.1	0	0	0	114
28	V	36.2	Very low	36.2	Very low	116 Å²	116	145 Å²	145	70%	0.703	76%	0.757	S	S	*	*	S	Bend	trans	-124.9	112.6	170.7	-171.4	0	0	0	0	107
29	H	35.5	Very low	35.7	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.806	75%	0.754	S	S	*	*			trans	107.3	63.7	177.7	-57.5	-14.1	0	0	0	116.7
30	L	31	Very low	35.2	Very low	184 Å²	184	151.7 Å²	151.7	96%	0.963	78%	0.775	S	S	*	*			trans	-136.2	93.6	143.1	-72	175.6	0	0	0	108.9
31	A	32.4	Very low	34.6	Very low	95 Å²	95	156.5 Å²	156.5	79%	0.785	79%	0.787	S	S	*	*			trans	-126.7	128.6	157.7	0	0	0	0	0	106.8
32	P	32.6	Very low	34	Very low	125 Å²	125	157.6 Å²	157.6	81%	0.812	79%	0.791	S	S	*	*			trans	-90	122.4	176.8	32.3	-26.1	0	0	0	109.8
33	E	33.1	Very low	33.4	Very low	158 Å²	158	159 Å²	159	74%	0.738	80%	0.797	S	S	*	*			trans	-100.6	110	156.1	-83.5	-146.4	167.3	0	0	109	K35	E33-K35 IonicContact OE1-NZ 3.94Å; E33-K35 IonicContact OE2-NZ 2.73Å; E33-K35 PolarHBondContact OE2-NZ 2.68Å
34	E	35	Very low	32.9	Very low	185 Å²	185	165.2 Å²	165.2	86%	0.864	82%	0.816	S	S	*	*			trans	-75.1	123.6	162.9	-70.4	-176.2	151.3	0	0	109.7
35	K	32.4	Very low	32.8	Very low	154 Å²	154	164.8 Å²	164.8	67%	0.67	83%	0.827	S	S	*	*			trans	-138.5	112.1	157.7	-69.1	-175.2	-179.6	137.2	0	110.5	E33	E33-K35 IonicContact OE1-NZ 3.94Å; E33-K35 IonicContact OE2-NZ 2.73Å; E33-K35 PolarHBondContact OE2-NZ 2.68Å
36	S	30.7	Very low	32.6	Very low	113 Å²	113	160.4 Å²	160.4	79%	0.79	82%	0.817	S	S	*	*			trans	-72.2	137.7	171.3	61.2	0	0	0	0	111.8
37	F	30.8	Very low	32.4	Very low	180 Å²	180	158.5 Å²	158.5	79%	0.789	81%	0.814	S	S	*	*			trans	-142.4	139.1	156.8	-80.2	-80	0	0	0	110.7
38	P	30.3	Very low	33	Very low	125 Å²	125	162.9 Å²	162.9	81%	0.812	82%	0.82	S	S	*	*			trans	-87.6	132.6	-177.9	34	-30.3	0	0	0	110.6
39	V	31.9	Very low	32.9	Very low	134 Å²	134	163.7 Å²	163.7	81%	0.812	83%	0.825	S	S	*	*			trans	-114.4	118	173	-173.9	0	0	0	0	110
40	R	29.9	Very low	32.9	Very low	237 Å²	237	164.3 Å²	164.3	89%	0.894	83%	0.828	S	S	*	*			trans	-67.6	134.1	173.4	-82.5	174.3	161.9	169	-5.3	110.6	R42	R40-R42 PolarHBondContact O-N 3.08Å
41	F	28.6	Very low	33	Very low	196 Å²	196	161.3 Å²	161.3	86%	0.86	82%	0.823	S	S	*	*			trans	-72.2	123.3	167.8	-77.6	-93.5	0	0	0	110.6
42	R	32.1	Very low	33.2	Very low	244 Å²	244	163.1 Å²	163.1	92%	0.921	82%	0.824	S	S	*	*			trans	-122.4	114.1	160.5	-112	-176	-178.4	176.8	0.3	107.9	R40	R40-R42 PolarHBondContact O-N 3.08Å
43	F	29.4	Very low	33.4	Very low	201 Å²	201	160.8 Å²	160.8	88%	0.882	82%	0.815	S	S	*	*			trans	-70	123.2	169.1	-101	-101.4	0	0	0	109
44	W	29.8	Very low	33.4	Very low	247 Å²	247	158.8 Å²	158.8	94%	0.936	82%	0.816	S	S	*	*			trans	-131.2	119.3	166.7	-162.9	44.6	0	0	0	108.6
45	S	38	Very low	33.4	Very low	119 Å²	119	159 Å²	159	83%	0.832	82%	0.817	S	S	*	*			trans	-96.6	112	178	22.8	0	0	0	0	109.2
46	G	34	Very low	33.8	Very low	57 Å²	57	157.8 Å²	157.8	59%	0.588	82%	0.822	S	S	*	*			trans	-140	159.4	174.9	0	0	0	0	0	111
47	P	35.4	Very low	33.9	Very low	122 Å²	122	159.2 Å²	159.2	79%	0.792	82%	0.821	S	S	*	*			trans	-79.6	154.6	-148.8	32.6	-36.5	0	0	0	114.6	T49	P47-T49 PolarHBondContact O-N 2.57Å
48	R	43.7	Very low	34.5	Very low	255 Å²	255	162 Å²	162	96%	0.962	83%	0.826	S	S	*	*			trans	-58.1	121.1	178.9	-67.3	179.4	-167.7	-158.5	1.6	111.1
49	T	35.3	Very low	34.8	Very low	132 Å²	132	164.2 Å²	164.2	81%	0.81	83%	0.826	S	S	*	*			trans	-112	143.7	160.5	52.6	0	0	0	0	109.2	P47	P47-T49 PolarHBondContact O-N 2.57Å
50	E	35.1	Very low	35.1	Very low	187 Å²	187	166.8 Å²	166.8	87%	0.874	83%	0.831	S	S	*	*			trans	-50.4	142	-170.6	-68.5	164.2	150.1	0	0	114.1	T52	E50-T52 PolarHBondContact O-N 3.46Å; E50-T52 VanDerWaalsContact O-N 3.07Å
51	S	33.1	Very low	35.7	Very low	122 Å²	122	163.8 Å²	163.8	85%	0.853	83%	0.827	S	S	*	*			trans	-70.6	97.1	177	176	0	0	0	0	110.1
52	T	37.2	Very low	36.2	Very low	132 Å²	132	162.3 Å²	162.3	81%	0.81	83%	0.829	S	S	*	*			trans	-87.1	107.1	154	42.9	0	0	0	0	107.5	E50	E50-T52 PolarHBondContact O-N 3.46Å; E50-T52 VanDerWaalsContact O-N 3.07Å
53	A	36.3	Very low	36.7	Very low	77 Å²	77	159 Å²	159	64%	0.636	82%	0.816	S	S	*	*			trans	-55.5	137.9	170.9	0	0	0	0	0	109.2	Q55	A53-Q55 PolarHBondContact O-N 2.94Å
54	P	33.1	Very low	37.9	Very low	116 Å²	116	152.6 Å²	152.6	75%	0.753	80%	0.801	S	S	*	*			trans	-64.9	115.6	177.8	25.6	-29.9	0	0	0	108.1	V56	P54-V56 VanDerWaalsContact C-N 3.25Å; P54-V56 PolarHBondContact O-N 3.39Å
55	Q	34.8	Very low	39.8	Very low	188 Å²	188	144 Å²	144	88%	0.879	78%	0.778	S	S	*	*			trans	-58.6	98.1	160.4	-79.7	173.1	-58.9	0	0	106.2	A53 D57	A53-Q55 PolarHBondContact O-N 2.94Å; Q55-D57 PolarHBondContact O-N 2.99Å
56	V	39.6	Very low	42	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	75%	0.753	S	S	*	*			trans	-60.1	105.4	164.7	-96.3	0	0	0	0	106.3	P54 R58	P54-V56 VanDerWaalsContact C-N 3.25Å; P54-V56 PolarHBondContact O-N 3.39Å; V56-R58 PolarHBondContact O-N 3.21Å
57	D	33.5	Very low	45	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	73%	0.725	S	S	*	*			trans	-45.1	102.7	166.8	-81.6	-38.9	0	0	0	108.2	Q55 Q59	Q55-D57 PolarHBondContact O-N 2.99Å; D57-Q59 PolarHBondContact O-N 3.27Å
58	R	43.8	Very low	47.9	Very low	238 Å²	238	133.6 Å²	133.6	90%	0.898	70%	0.698	S	S	*	*			trans	-69.8	78.9	159.3	-73.4	-174.7	-175.5	-174.8	1.7	105.3	V56 M60	V56-R58 PolarHBondContact O-N 3.21Å; R58-M60 VanDerWaalsContact C-N 3.31Å; R58-M60 PolarHBondContact O-N 3.17Å
59	Q	35.9	Very low	50.5	Low	172 Å²	172	122 Å²	122	80%	0.804	66%	0.655	S	S	*	*			trans	-52.6	108.5	158.1	-76	-175.8	-19.2	0	0	105.5	D57 E61	D57-Q59 PolarHBondContact O-N 3.27Å; Q59-E61 PolarHBondContact O-N 2.68Å
60	M	39.5	Very low	53.5	Low	187 Å²	187	115.7 Å²	115.7	92%	0.921	62%	0.617	S	S	*	*			trans	-63.5	84.9	167.7	-76.3	-177.7	175.7	0	0	106	R58 N62	R58-M60 VanDerWaalsContact C-N 3.31Å; R58-M60 PolarHBondContact O-N 3.17Å; M60-N62 PolarHBondContact O-N 3.29Å; M60-N62 VanDerWaalsContact O-N 3.14Å
61	E	41.3	Very low	56.6	Low	174 Å²	174	106.8 Å²	106.8	81%	0.813	58%	0.575	S	S	*	*			trans	-55.9	118.5	162.1	-141.8	162.4	-155.6	0	0	105.1	Q59 R63	Q59-E61 PolarHBondContact O-N 2.68Å; E61-R63 PolarHBondContact O-N 3.38Å
62	N	39.2	Very low	59.7	Low	166 Å²	166	101.1 Å²	101.1	89%	0.888	54%	0.535	S	S	*	.			trans	-62.3	82.7	-176.6	-155.3	7.1	0	0	0	107.7	M60 A64	M60-N62 PolarHBondContact O-N 3.29Å; M60-N62 VanDerWaalsContact O-N 3.14Å; N62-A64 PolarHBondContact O-N 3.22Å; N62-A64 VanDerWaalsContact O-N 3.08Å
63	R	43.8	Very low	62.6	Low	174 Å²	174	94.9 Å²	94.9	66%	0.657	50%	0.497	S	S	*	.			trans	-64	115.8	-179.7	-74.9	-174.5	176.3	-171.2	-0.4	105.6	E61 S65 E180	E61-R63 PolarHBondContact O-N 3.38Å; R63-S65 PolarHBondContact O-N 3.06Å; R63-E180 IonicContact CZ-OE1 3.43Å; R63-E180 IonicContact NH1-OE1 3.2Å; R63-E180 PolarHBondContact NH1-OE1 3.28Å; R63-E180 IonicContact NH2-OE1 3.92Å; R63-E180 PolarHBondContact NH2-OE1 3.38Å
64	A	54	Low	65.5	Low	67 Å²	67	91.3 Å²	91.3	55%	0.554	47%	0.467	S	S	*	.			trans	-39	132.1	157	0	0	0	0	0	107.5	N62 G66	N62-A64 PolarHBondContact O-N 3.22Å; N62-A64 VanDerWaalsContact O-N 3.08Å; A64-G66 PolarHBondContact O-N 3.14Å
65	S	69.9	Low	68.4	Low	67 Å²	67	86.4 Å²	86.4	47%	0.469	44%	0.438	S	S	.	.			trans	-44.5	119.3	-176.6	36.7	0	0	0	0	108.8	R63	R63-S65 PolarHBondContact O-N 3.06Å
66	G	83.8	Confident	71.2	Confident	29 Å²	29	79.4 Å²	79.4	30%	0.299	40%	0.404	S	S	.	.			trans	-57	171.6	-179.4	0	0	0	0	0	111.3	A64 R184	A64-G66 PolarHBondContact O-N 3.14Å; G66-R184 PolarHBondContact O-NH1 3.17Å
67	P	96.1	Very high	73.6	Confident	1 Å²	1	79 Å²	79	1%	0.006	39%	0.389	C	S	.	.			trans	-57.8	148.2	-177.1	29.8	-36.4	0	0	0	110.1	V70 P161 W163 F181 R184	P67-V70 HydrophobicContact CB-CG2 3.96Å; P67-V70 HydrophobicContact CG-CG2 3.34Å; P67-P161 CarbonylContact C-O 3.6Å; P67-P161 WeakPolarHBondContact CA-O 3.32Å; P67-W163 HydrophobicContact CB-CB 4.49Å; P67-W163 HydrophobicContact CB-CD2 3.66Å; P67-W163 HydrophobicContact CB-CE3 4.13Å; P67-W163 HydrophobicContact CB-CG 3.83Å; P67-W163 HydrophobicContact CB-CZ2 4.3Å; P67-W163 HydrophobicContact CG-CD2 3.65Å; P67-W163 HydrophobicContact CG-CE3 3.57Å; P67-W163 HydrophobicContact CG-CG 4.27Å; P67-W163 HydrophobicContact CG-CH2 4.03Å; P67-W163 HydrophobicContact CG-CZ2 4.09Å; P67-W163 HydrophobicContact CG-CZ3 3.76Å; P67-F181 HydrophobicContact CG-CD1 3.94Å; P67-F181 HydrophobicContact CG-CE1 4.02Å; P67-F181 HydrophobicContact CG-CG 4.26Å; P67-F181 HydrophobicContact CG-CZ 4.39Å; P67-R184 WeakPolarHBondContact O-CD 3.24Å; P67-R184 PolarHBondContact O-NH1 3.4Å
68	E	97.4	Very high	76.5	Confident	48 Å²	48	76.4 Å²	76.4	22%	0.224	37%	0.371	C	S	.	.	S	Bend	trans	-81.5	-24.5	168.8	-68.2	-53.2	133.4	0	0	111.3	P161 R184 A250 A254	E68-P161 PolarHBondContact N-O 3.12Å; E68-R184 VanDerWaalsContact CD-NH2 3.3Å; E68-R184 WeakPolarHBondContact O-CB 3.29Å; E68-R184 IonicContact OE1-CZ 3.39Å; E68-R184 IonicContact OE1-NH1 2.68Å; E68-R184 PolarHBondContact OE1-NH1 2.81Å; E68-R184 IonicContact OE1-NH2 3.19Å; E68-R184 PolarHBondContact OE1-NH2 3.28Å; E68-R184 IonicContact OE2-CZ 2.94Å; E68-R184 IonicContact OE2-NE 2.99Å; E68-R184 IonicContact OE2-NH1 3.5Å; E68-R184 IonicContact OE2-NH2 3.22Å; E68-R184 PolarHBondContact OE2-NH2 3.04Å; E68-A250 HydrophobicContact CB-CB 3.92Å; E68-A254 HydrophobicContact CG-CB 3.91Å
69	L	98.4	Very high	79	Confident	11 Å²	11	65.1 Å²	65.1	6%	0.058	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	133.6	173.1	-179.4	68.5	0	0	0	112	L71 P161 V162 W163 R184 R186 A246 A247 A250	L69-L71 HydrophobicContact CD1-CD2 4.2Å; L69-L71 HydrophobicContact CD2-CD1 4.23Å; L69-L71 HydrophobicContact CD2-CD2 3.95Å; L69-L71 HydrophobicContact CD2-CG 3.96Å; L69-L71 HydrophobicContact CG-CD2 4.12Å; L69-L71 HydrophobicContact CG-CG 4.08Å; L69-P161 PolarHBondContact N-O 2.77Å; L69-P161 VanDerWaalsContact N-O 3.09Å; L69-V162 HydrophobicContact CB-CG2 4.47Å; L69-V162 HydrophobicContact CD2-CG1 4.27Å; L69-V162 WeakPolarHBondContact O-CA 3.42Å; L69-W163 PolarHBondContact O-N 3.09Å; L69-R184 WeakPolarHBondContact CA-O 3.48Å; L69-R184 WeakPolarHBondContact CD1-O 3.24Å; L69-R186 HydrophobicContact CD1-CG 4.1Å; L69-A246 HydrophobicContact CD2-CB 4.34Å; L69-A247 HydrophobicContact CD2-CB 3.93Å; L69-A250 HydrophobicContact CB-CB 3.57Å; L69-A250 HydrophobicContact CD2-CB 4.43Å
70	V	98.6	Very high	81.8	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.8	169.4	-173.1	0	0	0	0	109.2	P67 V72 W163 V165 F177 F181 R184 T185 R186	P67-V70 HydrophobicContact CB-CG2 3.96Å; P67-V70 HydrophobicContact CG-CG2 3.34Å; V70-V72 HydrophobicContact CG1-CG2 3.98Å; V70-W163 CarbonylContact C-O 3.54Å; V70-W163 WeakPolarHBondContact CA-O 3.47Å; V70-W163 HydrophobicContact CG1-CB 4.43Å; V70-W163 HydrophobicContact CG2-CB 4.45Å; V70-W163 HydrophobicContact CG2-CE3 4.25Å; V70-V165 HydrophobicContact CG1-CG2 3.93Å; V70-F177 HydrophobicContact CG1-CD1 3.75Å; V70-F177 HydrophobicContact CG1-CE1 4.21Å; V70-F177 HydrophobicContact CG1-CG 4.32Å; V70-F181 HydrophobicContact CG2-CB 4.16Å; V70-F181 HydrophobicContact CG2-CD2 4Å; V70-F181 HydrophobicContact CG2-CG 4.09Å; V70-R184 PolarHBondContact N-O 3.34Å; V70-T185 CarbonylContact O-C 3.16Å; V70-T185 WeakPolarHBondContact O-CA 3.48Å; V70-R186 PolarHBondContact O-N 3.32Å
71	L	98.7	Very high	84.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	108.8	173.6	-62.2	173.6	0	0	0	109.4	L69 F73 V162 W163 V164 V165 R186 V188 W225 I243	L69-L71 HydrophobicContact CD1-CD2 4.2Å; L69-L71 HydrophobicContact CD2-CD1 4.23Å; L69-L71 HydrophobicContact CD2-CD2 3.95Å; L69-L71 HydrophobicContact CD2-CG 3.96Å; L69-L71 HydrophobicContact CG-CD2 4.12Å; L69-L71 HydrophobicContact CG-CG 4.08Å; L71-F73 HydrophobicContact CB-CD2 4.11Å; L71-F73 HydrophobicContact CB-CE2 3.76Å; L71-F73 HydrophobicContact CD1-CE2 4.31Å; L71-V162 HydrophobicContact CD1-CG1 4.48Å; L71-W163 PolarHBondContact N-O 2.72Å; L71-V164 HydrophobicContact CB-CG2 4.34Å; L71-V164 HydrophobicContact CD1-CG2 4.15Å; L71-V164 CarbonylContact O-C 3.59Å; L71-V164 WeakPolarHBondContact O-CA 3.35Å; L71-V165 PolarHBondContact O-N 3.14Å; L71-R186 CarbonylContact C-O 3.56Å; L71-R186 WeakPolarHBondContact CA-O 3.38Å; L71-R186 HydrophobicContact CD2-CB 4.17Å; L71-V188 HydrophobicContact CD2-CG2 4.36Å; L71-W225 HydrophobicContact CD2-CE3 4.49Å; L71-W225 HydrophobicContact CD2-CZ3 3.79Å; L71-I243 HydrophobicContact CD1-CG2 3.66Å; L71-I243 HydrophobicContact CD2-CG2 4.15Å
72	V	98.5	Very high	87.1	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	101.4	179.5	-175.3	0	0	0	0	109.4	V70 V165 A168 L174 F177 T185 R186 V188	V70-V72 HydrophobicContact CG1-CG2 3.98Å; V72-V165 HydrophobicContact CG2-CB 4.46Å; V72-V165 HydrophobicContact CG2-CG2 4.42Å; V72-A168 HydrophobicContact CG1-CB 3.49Å; V72-A168 VanDerWaalsContact CG1-CB 3.49Å; V72-L174 HydrophobicContact CB-CD1 4.08Å; V72-L174 HydrophobicContact CG1-CD1 4.07Å; V72-L174 HydrophobicContact CG2-CD1 4.34Å; V72-F177 HydrophobicContact CG2-CB 3.92Å; V72-F177 HydrophobicContact CG2-CD2 4.05Å; V72-F177 HydrophobicContact CG2-CG 4Å; V72-T185 HydrophobicContact CG2-CG2 3.83Å; V72-R186 PolarHBondContact N-O 2.94Å; V72-V188 PolarHBondContact O-N 3.44Å
73	F	98.4	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.3	-179.6	-83.4	-100	0	0	0	112	L71 K81 I84 T85 I88 V164 V165 A168 V188 V190 I227	L71-F73 HydrophobicContact CB-CD2 4.11Å; L71-F73 HydrophobicContact CB-CE2 3.76Å; L71-F73 HydrophobicContact CD1-CE2 4.31Å; F73-K81 HydrophobicContact CB-CD 4.42Å; F73-K81 HydrophobicContact CB-CG 4.38Å; F73-I84 HydrophobicContact CE1-CG2 3.83Å; F73-I84 HydrophobicContact CZ-CG2 4.39Å; F73-T85 HydrophobicContact CB-CG2 3.99Å; F73-T85 HydrophobicContact CD1-CG2 3.83Å; F73-T85 HydrophobicContact CD2-CG2 3.91Å; F73-T85 HydrophobicContact CE1-CG2 4.29Å; F73-T85 HydrophobicContact CE2-CG2 4.35Å; F73-T85 HydrophobicContact CG-CG2 3.63Å; F73-I88 HydrophobicContact CE1-CD1 4.18Å; F73-I88 HydrophobicContact CE2-CD1 3.92Å; F73-I88 HydrophobicContact CZ-CD1 3.32Å; F73-V164 HydrophobicContact CD2-CG1 3.86Å; F73-V164 HydrophobicContact CE2-CG1 4.11Å; F73-V165 WeakPolarHBondContact CB-O 3.49Å; F73-V165 PolarHBondContact N-O 3.39Å; F73-A168 PolarHBondContact O-N 3.44Å; F73-V188 WeakPolarHBondContact CA-O 3.34Å; F73-V188 HydrophobicContact CD1-CB 3.84Å; F73-V188 HydrophobicContact CD1-CG1 3.83Å; F73-V188 HydrophobicContact CD2-CB 4.22Å; F73-V188 HydrophobicContact CD2-CG2 4.39Å; F73-V188 HydrophobicContact CE1-CB 3.71Å; F73-V188 HydrophobicContact CE1-CG1 3.35Å; F73-V188 HydrophobicContact CE1-CG2 4.28Å; F73-V188 HydrophobicContact CE2-CB 4.1Å; F73-V188 HydrophobicContact CE2-CG1 4.5Å; F73-V188 HydrophobicContact CE2-CG2 3.95Å; F73-V188 HydrophobicContact CG-CB 4.09Å; F73-V188 HydrophobicContact CZ-CB 3.82Å; F73-V188 HydrophobicContact CZ-CG1 3.72Å; F73-V188 HydrophobicContact CZ-CG2 3.86Å; F73-V190 HydrophobicContact CD1-CG2 4Å; F73-V190 HydrophobicContact CE1-CG2 4.25Å; F73-I227 HydrophobicContact CE1-CD1 4.18Å
74	S	96.9	Very high	92.3	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.014	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	159.5	167.4	77.1	0	0	0	0	111.4	V188 R189 V190 F223	S74-V188 PolarHBondContact N-O 3.27Å; S74-R189 WeakPolarHBondContact OG-CD 3.4Å; S74-R189 PolarHBondContact OG-NH1 3.36Å; S74-V190 PolarHBondContact O-N 2.99Å; S74-F223 WeakPolarHBondContact OG-CE1 3.47Å
75	G	94.9	Very high	94.4	Very high	13 Å²	13	34 Å²	34	13%	0.134	18%	0.175	C	C	.	.			trans	166.1	144.5	179.7	0	0	0	0	0	111	V190	G75-V190 WeakPolarHBondContact CA-O 3.36Å
76	K	92	Very high	95.7	Very high	41 Å²	41	34.4 Å²	34.4	18%	0.178	17%	0.172	C	C	.	.			trans	-66.1	156.9	-179.8	-66.5	-173.1	178.1	-70.7	0	111.7	K78 S79 E214 C215 D218	K76-K78 PolarHBondContact O-N 3.08Å; K76-S79 WeakPolarHBondContact O-CB 3.47Å; K76-S79 PolarHBondContact O-N 3.41Å; K76-S79 PolarHBondContact O-OG 2.92Å; K76-E214 PolarHBondContact NZ-O 2.85Å; K76-C215 PolarHBondContact NZ-SG 3.25Å; K76-D218 WeakPolarHBondContact CE-OD1 3.28Å; K76-D218 WeakPolarHBondContact CE-OD2 3.4Å; K76-D218 IonicContact NZ-OD1 3.4Å; K76-D218 PolarHBondContact NZ-OD1 3.3Å; K76-D218 IonicContact NZ-OD2 2.87Å; K76-D218 PolarHBondContact NZ-OD2 2.9Å
77	R	91.2	Very high	96.3	Very high	120 Å²	120	34.2 Å²	34.2	45%	0.453	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	137.6	173.4	-168.4	-175.5	170.8	-144.8	-0.7	111.4	S79 R197 E214	R77-S79 VanDerWaalsContact C-N 3.26Å; R77-S79 PolarHBondContact O-N 3.22Å; R77-R197 PolarHBondContact O-NE 2.99Å; R77-R197 PolarHBondContact O-NH2 3.25Å; R77-R197 VanDerWaalsContact O-NH2 3.11Å; R77-E214 PolarHBondContact N-OE2 3.2Å
78	K	93.5	Very high	96.4	Very high	90 Å²	90	34.2 Å²	34.2	39%	0.391	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	11.2	-176.7	-57	-60.8	-170.6	176	0	115.9	K76 G80 R197 R200 W202	K76-K78 PolarHBondContact O-N 3.08Å; K78-G80 VanDerWaalsContact C-N 3.26Å; K78-G80 PolarHBondContact O-N 3.05Å; K78-R197 HydrophobicContact CB-CB 4.3Å; K78-R197 HydrophobicContact CB-CG 4.37Å; K78-R200 HydrophobicContact CB-CB 4.37Å; K78-R200 WeakPolarHBondContact O-CD 3.32Å; K78-R200 PolarHBondContact O-NH1 3.23Å; K78-W202 HydrophobicContact CB-CB 4.23Å; K78-W202 HydrophobicContact CG-CB 4Å
79	S	95.9	Very high	96.4	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	17%	0.165	C	C	.	.	S	Bend	trans	-73.8	-13.5	172.2	72.5	0	0	0	0	114.7	K76 R77 V190 C192 R200 N229	K76-S79 WeakPolarHBondContact O-CB 3.47Å; K76-S79 PolarHBondContact O-N 3.41Å; K76-S79 PolarHBondContact O-OG 2.92Å; R77-S79 VanDerWaalsContact C-N 3.26Å; R77-S79 PolarHBondContact O-N 3.22Å; S79-V190 WeakPolarHBondContact O-CG1 3.45Å; S79-C192 VanDerWaalsContact CA-SG 3.59Å; S79-R200 PolarHBondContact O-NH1 3.41Å; S79-N229 WeakPolarHBondContact O-CB 3.48Å; S79-N229 PolarHBondContact O-ND2 2.79Å
80	G	96	Very high	96.3	Very high	22 Å²	22	40.3 Å²	40.3	23%	0.227	20%	0.196	C	C	.	.	S	Bend	trans	90	10	-175.9	0	0	0	0	0	114.3	K78 D82 Y83 I84	K78-G80 VanDerWaalsContact C-N 3.26Å; K78-G80 PolarHBondContact O-N 3.05Å; G80-D82 PolarHBondContact O-N 3.09Å; G80-Y83 WeakPolarHBondContact O-CB 3.33Å; G80-Y83 PolarHBondContact O-N 3.33Å; G80-I84 WeakPolarHBondContact O-CG1 3.35Å; G80-I84 PolarHBondContact O-N 3.4Å; G80-I84 VanDerWaalsContact O-N 3.11Å
81	K	96.2	Very high	96.3	Very high	16 Å²	16	45.3 Å²	45.3	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-50.1	-50.5	177	-178.4	-173.3	62.6	57.8	0	113.6	F73 Y83 I84 T85 S166 V190	F73-K81 HydrophobicContact CB-CD 4.42Å; F73-K81 HydrophobicContact CB-CG 4.38Å; K81-Y83 VanDerWaalsContact C-N 3.34Å; K81-Y83 PolarHBondContact O-N 3.32Å; K81-I84 PolarHBondContact O-N 3.35Å; K81-I84 VanDerWaalsContact O-N 3.14Å; K81-T85 PolarHBondContact O-N 3.12Å; K81-T85 PolarHBondContact O-OG1 3.16Å; K81-S166 VanDerWaalsContact CD-O 3.24Å; K81-S166 WeakPolarHBondContact CD-O 3.37Å; K81-S166 VanDerWaalsContact CE-O 3.24Å; K81-S166 WeakPolarHBondContact CE-O 3.39Å; K81-S166 PolarHBondContact NZ-O 2.9Å; K81-V190 HydrophobicContact CB-CB 4.19Å; K81-V190 HydrophobicContact CB-CG2 4.25Å; K81-V190 HydrophobicContact CG-CG2 4.32Å
82	D	95.3	Very high	96.2	Very high	100 Å²	100	46.5 Å²	46.5	54%	0.535	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-44.6	-176.3	-61.3	-24.3	0	0	0	111	G80 I84 T85 D86	G80-D82 PolarHBondContact O-N 3.09Å; D82-I84 VanDerWaalsContact C-N 3.28Å; D82-I84 PolarHBondContact O-N 3.38Å; D82-T85 PolarHBondContact O-N 3.43Å; D82-T85 PolarHBondContact O-OG1 3.01Å; D82-D86 WeakPolarHBondContact O-CB 3.4Å; D82-D86 PolarHBondContact O-N 3.43Å
83	Y	96.1	Very high	96.2	Very high	146 Å²	146	47.2 Å²	47.2	57%	0.573	23%	0.23	S	C	*	.	H	α-helix	trans	-57.3	-41	175	175.7	-102.3	0	0	0	112.6	G80 K81 M87 L236	G80-Y83 WeakPolarHBondContact O-CB 3.33Å; G80-Y83 PolarHBondContact O-N 3.33Å; K81-Y83 VanDerWaalsContact C-N 3.34Å; K81-Y83 PolarHBondContact O-N 3.32Å; Y83-M87 HydrophobicContact CD1-CE 4.33Å; Y83-M87 HydrophobicContact CE1-CE 3.37Å; Y83-M87 HydrophobicContact CE2-CE 4.36Å; Y83-M87 WeakPolarHBondContact O-CB 3.36Å; Y83-M87 PolarHBondContact O-N 3.02Å; Y83-M87 WeakPolarHBondContact OH-CE 3.44Å; Y83-L236 HydrophobicContact CD1-CD2 4.29Å; Y83-L236 HydrophobicContact CE1-CD2 3.83Å
84	I	97.5	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.7	-44.1	179	-70.4	164	0	0	0	111.5	F73 G80 K81 D82 D86 M87 I88 V190 I227 L236 L240	F73-I84 HydrophobicContact CE1-CG2 3.83Å; F73-I84 HydrophobicContact CZ-CG2 4.39Å; G80-I84 WeakPolarHBondContact O-CG1 3.35Å; G80-I84 PolarHBondContact O-N 3.4Å; G80-I84 VanDerWaalsContact O-N 3.11Å; K81-I84 PolarHBondContact O-N 3.35Å; K81-I84 VanDerWaalsContact O-N 3.14Å; D82-I84 VanDerWaalsContact C-N 3.28Å; D82-I84 PolarHBondContact O-N 3.38Å; I84-D86 VanDerWaalsContact C-N 3.32Å; I84-D86 PolarHBondContact O-N 3.44Å; I84-M87 PolarHBondContact O-N 3.35Å; I84-I88 HydrophobicContact CG2-CD1 4.02Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.39Å; I84-V190 HydrophobicContact CD1-CB 4.36Å; I84-V190 HydrophobicContact CD1-CG1 3.59Å; I84-V190 HydrophobicContact CD1-CG2 3.79Å; I84-I227 HydrophobicContact CD1-CD1 4.36Å; I84-I227 HydrophobicContact CD1-CG2 3.86Å; I84-I227 HydrophobicContact CG2-CD1 3.84Å; I84-L236 HydrophobicContact CD1-CD1 4.08Å; I84-L236 HydrophobicContact CG1-CD1 3.99Å; I84-L236 HydrophobicContact CG1-CD2 4.18Å; I84-L240 HydrophobicContact CG2-CD2 3.86Å
85	T	97.6	Very high	96	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-66	-37.6	179.4	52	0	0	0	0	111.8	F73 K81 D82 I88 Q89 V164	F73-T85 HydrophobicContact CB-CG2 3.99Å; F73-T85 HydrophobicContact CD1-CG2 3.83Å; F73-T85 HydrophobicContact CD2-CG2 3.91Å; F73-T85 HydrophobicContact CE1-CG2 4.29Å; F73-T85 HydrophobicContact CE2-CG2 4.35Å; F73-T85 HydrophobicContact CG-CG2 3.63Å; K81-T85 PolarHBondContact O-N 3.12Å; K81-T85 PolarHBondContact O-OG1 3.16Å; D82-T85 PolarHBondContact O-N 3.43Å; D82-T85 PolarHBondContact O-OG1 3.01Å; T85-I88 PolarHBondContact O-N 2.9Å; T85-Q89 PolarHBondContact O-N 3.16Å; T85-Q89 VanDerWaalsContact O-N 3.13Å; T85-V164 HydrophobicContact CG2-CG1 3.67Å
86	D	96.3	Very high	96.1	Very high	75 Å²	75	59.6 Å²	59.6	40%	0.401	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-45.6	175.4	-65.3	-13.4	0	0	0	110.1	D82 I84 I88 Q89 D90	D82-D86 WeakPolarHBondContact O-CB 3.4Å; D82-D86 PolarHBondContact O-N 3.43Å; I84-D86 VanDerWaalsContact C-N 3.32Å; I84-D86 PolarHBondContact O-N 3.44Å; D86-I88 VanDerWaalsContact C-N 3.31Å; D86-I88 PolarHBondContact O-N 2.74Å; D86-Q89 PolarHBondContact O-N 3.43Å; D86-Q89 VanDerWaalsContact O-N 3.09Å; D86-D90 PolarHBondContact O-N 3.34Å
87	M	96.9	Very high	96.4	Very high	26 Å²	26	57.7 Å²	57.7	13%	0.128	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-38.6	176	-179	-178	-65.8	0	0	113.3	Y83 I84 D90 R91 L236 L240	Y83-M87 HydrophobicContact CD1-CE 4.33Å; Y83-M87 HydrophobicContact CE1-CE 3.37Å; Y83-M87 HydrophobicContact CE2-CE 4.36Å; Y83-M87 WeakPolarHBondContact O-CB 3.36Å; Y83-M87 PolarHBondContact O-N 3.02Å; Y83-M87 WeakPolarHBondContact OH-CE 3.44Å; I84-M87 PolarHBondContact O-N 3.35Å; M87-D90 PolarHBondContact O-N 3.29Å; M87-R91 WeakPolarHBondContact O-CG 3.38Å; M87-R91 PolarHBondContact O-N 2.94Å; M87-R91 VanDerWaalsContact O-N 3.07Å; M87-R91 PolarHBondContact SD-NH2 3.44Å; M87-L236 HydrophobicContact CE-CD2 3.87Å; M87-L236 HydrophobicContact SD-CD2 3.97Å; M87-L240 HydrophobicContact CG-CD1 4.31Å; M87-L240 HydrophobicContact SD-CD1 3.46Å; M87-L240 WeakPolarHBondContact SD-CD1 3.21Å
88	I	97.8	Very high	96.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-43.7	176	-71.2	166.7	0	0	0	110.2	F73 I84 T85 D86 R91 L92 V164 L240 I243 L244	F73-I88 HydrophobicContact CE1-CD1 4.18Å; F73-I88 HydrophobicContact CE2-CD1 3.92Å; F73-I88 HydrophobicContact CZ-CD1 3.32Å; I84-I88 HydrophobicContact CG2-CD1 4.02Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.39Å; T85-I88 PolarHBondContact O-N 2.9Å; D86-I88 VanDerWaalsContact C-N 3.31Å; D86-I88 PolarHBondContact O-N 2.74Å; I88-R91 PolarHBondContact O-N 3.38Å; I88-L92 HydrophobicContact CG2-CD1 3.71Å; I88-L92 WeakPolarHBondContact O-CB 3.48Å; I88-L92 WeakPolarHBondContact O-CG 3.08Å; I88-L92 PolarHBondContact O-N 3.25Å; I88-L92 VanDerWaalsContact O-N 3.11Å; I88-V164 HydrophobicContact CG2-CG2 4.07Å; I88-L240 HydrophobicContact CD1-CD2 4.11Å; I88-L240 HydrophobicContact CG1-CD2 4.25Å; I88-I243 HydrophobicContact CD1-CG2 4.24Å; I88-L244 HydrophobicContact CG1-CD2 4.3Å; I88-L244 HydrophobicContact CG2-CD2 4.37Å
89	Q	97.4	Very high	96.9	Very high	53 Å²	53	49.5 Å²	49.5	25%	0.248	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-43.4	176.2	-174	173.5	48.4	0	0	111.6	T85 D86 R91 L92 G93 C97 V99	T85-Q89 PolarHBondContact O-N 3.16Å; T85-Q89 VanDerWaalsContact O-N 3.13Å; D86-Q89 PolarHBondContact O-N 3.43Å; D86-Q89 VanDerWaalsContact O-N 3.09Å; Q89-R91 VanDerWaalsContact C-N 3.27Å; Q89-R91 PolarHBondContact O-N 2.96Å; Q89-L92 PolarHBondContact O-N 3.24Å; Q89-G93 WeakPolarHBondContact O-CA 3.49Å; Q89-G93 PolarHBondContact O-N 2.94Å; Q89-C97 PolarHBondContact NE2-O 2.94Å; Q89-C97 VanDerWaalsContact NE2-O 3.1Å; Q89-V99 HydrophobicContact CB-CG2 3.78Å; Q89-V99 VanDerWaalsContact CD-CG2 3.49Å; Q89-V99 HydrophobicContact CG-CG2 4.09Å
90	D	97.3	Very high	97	Very high	134 Å²	134	50.1 Å²	50.1	72%	0.717	26%	0.259	S	S	*	.	H	α-helix	trans	-60.1	-37.8	178.4	-71.6	-19.2	0	0	0	112	D86 M87	D86-D90 PolarHBondContact O-N 3.34Å; M87-D90 PolarHBondContact O-N 3.29Å
91	R	97.2	Very high	97	Very high	105 Å²	105	56.4 Å²	56.4	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-75.2	-32.6	179.2	-72.6	-178.8	-168.3	-156.9	-1.2	114	M87 I88 Q89 D237 L244	M87-R91 WeakPolarHBondContact O-CG 3.38Å; M87-R91 PolarHBondContact O-N 2.94Å; M87-R91 VanDerWaalsContact O-N 3.07Å; M87-R91 PolarHBondContact SD-NH2 3.44Å; I88-R91 PolarHBondContact O-N 3.38Å; Q89-R91 VanDerWaalsContact C-N 3.27Å; Q89-R91 PolarHBondContact O-N 2.96Å; R91-D237 IonicContact CZ-OD1 3.54Å; R91-D237 IonicContact NH1-OD1 3.24Å; R91-D237 PolarHBondContact NH1-OD1 2.95Å; R91-D237 IonicContact NH2-OD1 2.89Å; R91-D237 PolarHBondContact NH2-OD1 2.88Å; R91-L244 HydrophobicContact CB-CD2 4.16Å
92	L	97.3	Very high	97	Very high	25 Å²	25	55.9 Å²	55.9	13%	0.131	27%	0.274	C	S	.	.	H	α-helix	trans	-91.5	-28.7	-177.7	-65.6	173	0	0	0	112.4	I88 Q89 V96 C97 V162 L244 A247 Q248	I88-L92 HydrophobicContact CG2-CD1 3.71Å; I88-L92 WeakPolarHBondContact O-CB 3.48Å; I88-L92 WeakPolarHBondContact O-CG 3.08Å; I88-L92 PolarHBondContact O-N 3.25Å; I88-L92 VanDerWaalsContact O-N 3.11Å; Q89-L92 PolarHBondContact O-N 3.24Å; L92-V96 HydrophobicContact CB-CB 4.5Å; L92-V96 HydrophobicContact CB-CG1 4.42Å; L92-V96 WeakPolarHBondContact O-CB 3.35Å; L92-C97 HydrophobicContact CB-CB 3.67Å; L92-C97 HydrophobicContact CD1-CB 3.83Å; L92-C97 HydrophobicContact CG-CB 4.42Å; L92-V162 HydrophobicContact CD1-CG1 4.29Å; L92-L244 HydrophobicContact CG-CD2 4.46Å; L92-A247 HydrophobicContact CD1-CB 3.65Å; L92-A247 HydrophobicContact CD2-CB 4.04Å; L92-Q248 HydrophobicContact CD2-CG 4.04Å
93	G	97.8	Very high	96.9	Very high	20 Å²	20	52.7 Å²	52.7	21%	0.206	26%	0.26	C	S	.	.			trans	85.6	151.7	-173.3	0	0	0	0	0	113.4	Q89 E95 V96 C97	Q89-G93 WeakPolarHBondContact O-CA 3.49Å; Q89-G93 PolarHBondContact O-N 2.94Å; G93-E95 VanDerWaalsContact C-N 3.26Å; G93-E95 PolarHBondContact O-N 3.33Å; G93-V96 PolarHBondContact O-N 2.79Å; G93-V96 VanDerWaalsContact O-N 3.15Å; G93-C97 PolarHBondContact O-N 3.09Å
94	P	96.4	Very high	96.8	Very high	80 Å²	80	46.9 Å²	46.9	52%	0.519	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.5	-174.9	28.5	-36.2	0	0	0	114.3	V96 Q160	P94-V96 VanDerWaalsContact C-N 3.33Å; P94-Q160 WeakPolarHBondContact O-CG 3.45Å; P94-Q160 PolarHBondContact O-NE2 3.13Å
95	E	95.4	Very high	96.8	Very high	162 Å²	162	47.5 Å²	47.5	76%	0.757	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-26.4	174.7	-57.2	-54	146.3	0	0	112.1	G93	G93-E95 VanDerWaalsContact C-N 3.26Å; G93-E95 PolarHBondContact O-N 3.33Å
96	V	97	Very high	96.7	Very high	33 Å²	33	48 Å²	48	20%	0.2	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-35	-178.7	178.1	0	0	0	0	111.6	L92 G93 P94 Q160 P161 V162 A251	L92-V96 HydrophobicContact CB-CB 4.5Å; L92-V96 HydrophobicContact CB-CG1 4.42Å; L92-V96 WeakPolarHBondContact O-CB 3.35Å; G93-V96 PolarHBondContact O-N 2.79Å; G93-V96 VanDerWaalsContact O-N 3.15Å; P94-V96 VanDerWaalsContact C-N 3.33Å; V96-Q160 WeakPolarHBondContact O-CB 3.47Å; V96-P161 HydrophobicContact CG1-CG 4.27Å; V96-P161 WeakPolarHBondContact O-CD 3.46Å; V96-V162 HydrophobicContact CG1-CG2 4.34Å; V96-V162 WeakPolarHBondContact O-CB 3.4Å; V96-V162 PolarHBondContact O-N 3.12Å; V96-V162 VanDerWaalsContact O-N 3.12Å; V96-A251 HydrophobicContact CG1-CB 3.47Å; V96-A251 VanDerWaalsContact CG1-CB 3.47Å
97	C	98.1	Very high	96.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	116.7	-170.8	-176.6	0	0	0	0	112.6	Q89 L92 G93 V162 V164	Q89-C97 PolarHBondContact NE2-O 2.94Å; Q89-C97 VanDerWaalsContact NE2-O 3.1Å; L92-C97 HydrophobicContact CB-CB 3.67Å; L92-C97 HydrophobicContact CD1-CB 3.83Å; L92-C97 HydrophobicContact CG-CB 4.42Å; G93-C97 PolarHBondContact O-N 3.09Å; C97-V162 WeakPolarHBondContact CA-O 3.39Å; C97-V164 VanDerWaalsContact SG-CG2 3.55Å
98	A	97.8	Very high	96.6	Very high	7 Å²	7	49.4 Å²	49.4	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.6	171.5	0	0	0	0	0	111.4	L100 Q160 V162 V164	A98-L100 HydrophobicContact CB-CD2 3.97Å; A98-Q160 HydrophobicContact CB-CB 3.91Å; A98-Q160 HydrophobicContact CB-CG 3.97Å; A98-V162 PolarHBondContact N-O 2.95Å; A98-V164 PolarHBondContact O-N 2.86Å
99	V	97.9	Very high	96.6	Very high	32 Å²	32	51.3 Å²	51.3	19%	0.194	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	111.1	168.7	178.2	0	0	0	0	109.9	Q89 V164	Q89-V99 HydrophobicContact CB-CG2 3.78Å; Q89-V99 VanDerWaalsContact CD-CG2 3.49Å; Q89-V99 HydrophobicContact CG-CG2 4.09Å; V99-V164 CarbonylContact C-O 3.57Å; V99-V164 WeakPolarHBondContact CA-O 3.36Å; V99-V164 HydrophobicContact CG2-CB 4.28Å; V99-V164 HydrophobicContact CG2-CG1 4.47Å
100	L	97.6	Very high	96.6	Very high	14 Å²	14	49 Å²	49	7%	0.073	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133	-178.7	-50.4	-176.2	0	0	0	110.3	A98 T155 A158 W163 V164 V165 S166	A98-L100 HydrophobicContact CB-CD2 3.97Å; L100-T155 HydrophobicContact CD1-CG2 3.82Å; L100-A158 HydrophobicContact CD2-CB 3.96Å; L100-W163 HydrophobicContact CD1-CB 3.9Å; L100-W163 HydrophobicContact CD1-CD2 3.75Å; L100-W163 HydrophobicContact CD1-CE3 3.7Å; L100-W163 HydrophobicContact CD1-CG 3.85Å; L100-W163 HydrophobicContact CG-CB 4.45Å; L100-V164 PolarHBondContact N-O 3.21Å; L100-V165 HydrophobicContact CB-CG2 4.49Å; L100-V165 WeakPolarHBondContact O-CA 3.35Å; L100-S166 PolarHBondContact O-N 3.49Å; L100-S166 PolarHBondContact O-OG 3.05Å
101	R	96.3	Very high	96.5	Very high	155 Å²	155	42.7 Å²	42.7	59%	0.585	22%	0.219	S	C	*	.			trans	-120	113	-179.8	-73.6	-172.5	-89.6	-142.1	-1.5	110.8	S103 G104 P105 S166 D167	R101-S103 PolarHBondContact O-N 3.3Å; R101-G104 PolarHBondContact O-N 3.28Å; R101-G104 VanDerWaalsContact O-N 3.09Å; R101-P105 WeakPolarHBondContact O-CD 3.37Å; R101-S166 WeakPolarHBondContact CG-OG 3.48Å; R101-D167 WeakPolarHBondContact CA-OD1 3.48Å
102	L	96.6	Very high	96.5	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29.3	175.2	-57.1	-176.6	0	0	0	111.8	G104 L106 C151 A154 V165 D167 A168 D173 F177	L102-G104 PolarHBondContact O-N 3.44Å; L102-L106 PolarHBondContact O-N 3.03Å; L102-C151 HydrophobicContact CD2-CB 4.39Å; L102-A154 HydrophobicContact CD2-CB 3.78Å; L102-V165 HydrophobicContact CD1-CG1 4.17Å; L102-V165 HydrophobicContact CD2-CG1 4.21Å; L102-V165 HydrophobicContact CG-CG1 3.97Å; L102-D167 PolarHBondContact N-OD1 2.87Å; L102-A168 HydrophobicContact CD1-CB 4.45Å; L102-D173 HydrophobicContact CD1-CB 3.86Å; L102-F177 HydrophobicContact CD2-CE2 4.24Å; L102-F177 HydrophobicContact CD2-CZ 4.31Å
103	S	93.4	Very high	96.4	Very high	34 Å²	34	47.1 Å²	47.1	24%	0.238	24%	0.243	C	C	.	.	H	α-helix	trans	-70.2	-17.7	174.6	64.3	0	0	0	0	113.9	R101 K107 D167	R101-S103 PolarHBondContact O-N 3.3Å; S103-K107 VanDerWaalsContact O-CG 3.28Å; S103-K107 WeakPolarHBondContact O-CG 3.42Å; S103-K107 PolarHBondContact O-N 3.4Å; S103-K107 VanDerWaalsContact O-N 3.15Å; S103-D167 WeakPolarHBondContact CB-OD2 3.22Å; S103-D167 PolarHBondContact N-OD2 2.79Å; S103-D167 PolarHBondContact OG-OD2 3.36Å
104	G	94	Very high	96.3	Very high	24 Å²	24	51.4 Å²	51.4	25%	0.247	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-63.1	175.9	0	0	0	0	0	111.4	R101 L102 L106 K107 Q108	R101-G104 PolarHBondContact O-N 3.28Å; R101-G104 VanDerWaalsContact O-N 3.09Å; L102-G104 PolarHBondContact O-N 3.44Å; G104-L106 VanDerWaalsContact C-N 3.27Å; G104-L106 PolarHBondContact O-N 3.43Å; G104-K107 PolarHBondContact O-N 2.91Å; G104-K107 VanDerWaalsContact O-N 3.12Å; G104-Q108 PolarHBondContact O-N 3.08Å
105	P	95.8	Very high	96.3	Very high	12 Å²	12	51 Å²	51	8%	0.078	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-36.2	175.1	-29.3	37.3	0	0	0	114.2	R101 K107 Q108 Q109 F150 L153 A154	R101-P105 WeakPolarHBondContact O-CD 3.37Å; P105-K107 PolarHBondContact O-N 3.21Å; P105-Q108 PolarHBondContact O-N 2.66Å; P105-Q109 WeakPolarHBondContact O-CB 3.37Å; P105-Q109 VanDerWaalsContact O-CG 3.31Å; P105-Q109 WeakPolarHBondContact O-CG 3.36Å; P105-Q109 PolarHBondContact O-N 3.45Å; P105-F150 HydrophobicContact CB-CD1 4.09Å; P105-L153 HydrophobicContact CB-CB 3.55Å; P105-L153 HydrophobicContact CB-CD1 3.96Å; P105-L153 HydrophobicContact CB-CG 4.42Å; P105-L153 HydrophobicContact CG-CB 3.74Å; P105-A154 HydrophobicContact CG-CB 3.96Å
106	L	96.1	Very high	96.3	Very high	14 Å²	14	44.9 Å²	44.9	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-53.4	-54.2	172.7	171.9	65.8	0	0	0	111.4	L102 G104 Y110 M135 W138 F150	L102-L106 PolarHBondContact O-N 3.03Å; G104-L106 VanDerWaalsContact C-N 3.27Å; G104-L106 PolarHBondContact O-N 3.43Å; L106-Y110 WeakPolarHBondContact O-CB 3.46Å; L106-Y110 PolarHBondContact O-N 3.1Å; L106-M135 HydrophobicContact CD1-CG 4.16Å; L106-M135 HydrophobicContact CD2-CG 4.41Å; L106-M135 HydrophobicContact CG-CG 4.06Å; L106-M135 HydrophobicContact CG-SD 4.39Å; L106-W138 HydrophobicContact CD1-CE3 3.79Å; L106-W138 HydrophobicContact CD1-CZ3 3.74Å; L106-F150 VanDerWaalsContact CA-CE1 3.45Å; L106-F150 HydrophobicContact CB-CD1 4.17Å; L106-F150 HydrophobicContact CB-CE1 3.99Å; L106-F150 HydrophobicContact CB-CZ 4.34Å; L106-F150 HydrophobicContact CD1-CE1 4.06Å; L106-F150 HydrophobicContact CD1-CE2 4.18Å; L106-F150 HydrophobicContact CD1-CZ 3.64Å
107	K	95.1	Very high	96.1	Very high	30 Å²	30	46.7 Å²	46.7	13%	0.13	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-40.3	-179.4	-69.6	170.4	-175	178.4	0	111.7	S103 G104 P105 A111 L118 L121 L122 M135	S103-K107 VanDerWaalsContact O-CG 3.28Å; S103-K107 WeakPolarHBondContact O-CG 3.42Å; S103-K107 PolarHBondContact O-N 3.4Å; S103-K107 VanDerWaalsContact O-N 3.15Å; G104-K107 PolarHBondContact O-N 2.91Å; G104-K107 VanDerWaalsContact O-N 3.12Å; P105-K107 PolarHBondContact O-N 3.21Å; K107-A111 WeakPolarHBondContact O-CB 3.25Å; K107-A111 PolarHBondContact O-N 3.4Å; K107-L118 HydrophobicContact CB-CD1 4.29Å; K107-L121 HydrophobicContact CB-CD2 3.99Å; K107-L121 HydrophobicContact CB-CG 4.35Å; K107-L121 HydrophobicContact CG-CD2 4.35Å; K107-L121 HydrophobicContact CG-CG 4.33Å; K107-L121 WeakPolarHBondContact O-CD2 3.31Å; K107-L122 HydrophobicContact CB-CD2 4.33Å; K107-L122 HydrophobicContact CD-CD2 3.72Å; K107-M135 HydrophobicContact CB-SD 4.36Å; K107-M135 HydrophobicContact CG-CE 4.1Å; K107-M135 HydrophobicContact CG-SD 3.69Å
108	Q	95.9	Very high	95.9	Very high	100 Å²	100	49.2 Å²	49.2	47%	0.467	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-51.9	-179.7	-174.9	178.6	4.5	0	0	111.7	G104 P105 A111 Q112 L118	G104-Q108 PolarHBondContact O-N 3.08Å; P105-Q108 PolarHBondContact O-N 2.66Å; Q108-A111 PolarHBondContact O-N 3.48Å; Q108-Q112 WeakPolarHBondContact O-CB 3.32Å; Q108-Q112 PolarHBondContact O-N 3.39Å; Q108-L118 HydrophobicContact CB-CD1 4.38Å; Q108-L118 HydrophobicContact CB-CD2 4.38Å; Q108-L118 HydrophobicContact CG-CD2 4.1Å
109	Q	97.6	Very high	95.6	Very high	40 Å²	40	55.1 Å²	55.1	19%	0.187	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-42.2	-179	-66.4	-63.9	-65.3	0	0	111.5	P105 A111 Q112 E113 W138 F149 L153	P105-Q109 WeakPolarHBondContact O-CB 3.37Å; P105-Q109 VanDerWaalsContact O-CG 3.31Å; P105-Q109 WeakPolarHBondContact O-CG 3.36Å; P105-Q109 PolarHBondContact O-N 3.45Å; Q109-A111 PolarHBondContact O-N 2.91Å; Q109-Q112 PolarHBondContact O-N 3.29Å; Q109-E113 PolarHBondContact O-N 3.11Å; Q109-W138 HydrophobicContact CB-CH2 3.51Å; Q109-W138 HydrophobicContact CB-CZ2 4.3Å; Q109-W138 HydrophobicContact CB-CZ3 4.28Å; Q109-F149 HydrophobicContact CG-CE1 4.16Å; Q109-F149 HydrophobicContact CG-CZ 4.29Å; Q109-L153 HydrophobicContact CG-CD1 3.78Å
110	Y	97.2	Very high	95.2	Very high	3 Å²	3	60.3 Å²	60.3	1%	0.012	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-42.8	175.9	179.6	-96.2	0	0	0	112.4	L106 R114 L116 L121 Y131 D134 M135 W138	L106-Y110 WeakPolarHBondContact O-CB 3.46Å; L106-Y110 PolarHBondContact O-N 3.1Å; Y110-R114 VanDerWaalsContact CZ-CD 3.41Å; Y110-R114 PolarHBondContact O-N 2.98Å; Y110-R114 PolarHBondContact OH-NE 2.86Å; Y110-L116 HydrophobicContact CD1-CD1 3.87Å; Y110-L116 HydrophobicContact CE1-CD1 3.41Å; Y110-L116 VanDerWaalsContact CE1-CD1 3.41Å; Y110-L121 HydrophobicContact CD1-CD2 3.92Å; Y110-Y131 HydrophobicContact CE1-CG 4.46Å; Y110-D134 WeakPolarHBondContact CE2-OD2 3.5Å; Y110-D134 PolarHBondContact OH-OD2 2.88Å; Y110-M135 HydrophobicContact CD1-CB 4Å; Y110-M135 HydrophobicContact CD1-CG 3.87Å; Y110-M135 HydrophobicContact CD1-SD 4Å; Y110-M135 HydrophobicContact CD2-CB 4.02Å; Y110-M135 HydrophobicContact CD2-CG 4.02Å; Y110-M135 HydrophobicContact CE1-CB 3.94Å; Y110-M135 HydrophobicContact CE1-CG 4.34Å; Y110-M135 HydrophobicContact CE2-CB 3.95Å; Y110-M135 HydrophobicContact CE2-CG 4.46Å; Y110-M135 HydrophobicContact CG-CB 4.04Å; Y110-M135 HydrophobicContact CG-CG 3.7Å; Y110-M135 HydrophobicContact CG-SD 4.27Å; Y110-W138 HydrophobicContact CD2-CB 4.02Å; Y110-W138 AromaticContact CD2-CD2 3.86Å; Y110-W138 HydrophobicContact CD2-CD2 3.86Å; Y110-W138 AromaticContact CD2-CE3 3.98Å; Y110-W138 HydrophobicContact CD2-CE3 3.98Å; Y110-W138 AromaticContact CD2-CG 3.87Å; Y110-W138 HydrophobicContact CD2-CG 3.87Å; Y110-W138 HydrophobicContact CE2-CB 4.17Å; Y110-W138 HydrophobicContact CE2-CG 4.36Å; Y110-W138 HydrophobicContact CG-CE3 4.47Å
111	A	96.6	Very high	94.8	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-43.8	177	0	0	0	0	0	111.8	K107 Q108 Q109 R114 G115 L116 L118 L121	K107-A111 WeakPolarHBondContact O-CB 3.25Å; K107-A111 PolarHBondContact O-N 3.4Å; Q108-A111 PolarHBondContact O-N 3.48Å; Q109-A111 PolarHBondContact O-N 2.91Å; A111-R114 CarbonylContact O-C 3.59Å; A111-R114 PolarHBondContact O-N 2.81Å; A111-G115 PolarHBondContact O-N 2.96Å; A111-L116 HydrophobicContact CB-CB 4.05Å; A111-L116 PolarHBondContact O-N 3.13Å; A111-L118 HydrophobicContact CB-CB 4.28Å; A111-L118 HydrophobicContact CB-CD1 4.18Å; A111-L121 HydrophobicContact CB-CD2 3.94Å
112	Q	96.6	Very high	94.4	Very high	134 Å²	134	56.1 Å²	56.1	63%	0.626	29%	0.293	S	S	*	.	H	α-helix	trans	-60.2	-48	179.7	-176.2	178.5	-2.2	0	0	112	Q108 Q109 R114 G115	Q108-Q112 WeakPolarHBondContact O-CB 3.32Å; Q108-Q112 PolarHBondContact O-N 3.39Å; Q109-Q112 PolarHBondContact O-N 3.29Å; Q112-R114 PolarHBondContact O-N 3.3Å; Q112-G115 PolarHBondContact O-N 3.22Å
113	E	96.2	Very high	93.8	Very high	89 Å²	89	57.5 Å²	57.5	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-66.5	-19.5	-179	-74	-176.4	-164.5	0	0	113.9	Q109 W138 R142	Q109-E113 PolarHBondContact O-N 3.11Å; E113-W138 WeakPolarHBondContact OE1-CZ2 3.47Å; E113-W138 WeakPolarHBondContact OE2-CZ2 3.34Å; E113-W138 PolarHBondContact OE2-NE1 3.26Å; E113-R142 IonicContact OE1-CZ 2.96Å; E113-R142 IonicContact OE1-NE 2.68Å; E113-R142 IonicContact OE1-NH2 3.62Å; E113-R142 PolarHBondContact OE1-NH2 2.99Å; E113-R142 IonicContact OE2-NH2 2.61Å; E113-R142 PolarHBondContact OE2-NH2 3.31Å; E113-R142 VanDerWaalsContact OE2-NH2 3.08Å
114	R	95.6	Very high	93	Very high	110 Å²	110	61.8 Å²	61.8	42%	0.415	34%	0.339	S	S	.	.	H	α-helix	trans	-113.9	2.1	-175.8	-71.6	-180	173.4	5.3	-2	113.8	Y110 A111 Q112 L116 D134	Y110-R114 VanDerWaalsContact CZ-CD 3.41Å; Y110-R114 PolarHBondContact O-N 2.98Å; Y110-R114 PolarHBondContact OH-NE 2.86Å; A111-R114 CarbonylContact O-C 3.59Å; A111-R114 PolarHBondContact O-N 2.81Å; Q112-R114 PolarHBondContact O-N 3.3Å; R114-L116 VanDerWaalsContact C-N 3.26Å; R114-L116 HydrophobicContact CB-CD1 4Å; R114-L116 HydrophobicContact CB-CD2 4.35Å; R114-L116 HydrophobicContact CB-CG 3.71Å; R114-L116 PolarHBondContact O-N 3.42Å; R114-D134 IonicContact CZ-OD2 3.8Å; R114-D134 IonicContact NE-OD2 2.67Å; R114-D134 PolarHBondContact NE-OD2 3.31Å; R114-D134 IonicContact NH2-OD2 3.62Å; R114-D134 PolarHBondContact NH2-OD2 2.99Å
115	G	95.8	Very high	92.5	Very high	72 Å²	72	62.1 Å²	62.1	74%	0.742	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	37.2	-174.2	0	0	0	0	0	113.1	A111 Q112	A111-G115 PolarHBondContact O-N 2.96Å; Q112-G115 PolarHBondContact O-N 3.22Å
116	L	95.1	Very high	92	Very high	33 Å²	33	67.1 Å²	67.1	17%	0.173	38%	0.375	C	S	.	.			trans	-88.8	156.6	178.5	-55.3	175.7	0	0	0	111.6	Y110 A111 R114 L118 Y131	Y110-L116 HydrophobicContact CD1-CD1 3.87Å; Y110-L116 HydrophobicContact CE1-CD1 3.41Å; Y110-L116 VanDerWaalsContact CE1-CD1 3.41Å; A111-L116 HydrophobicContact CB-CB 4.05Å; A111-L116 PolarHBondContact O-N 3.13Å; R114-L116 VanDerWaalsContact C-N 3.26Å; R114-L116 HydrophobicContact CB-CD1 4Å; R114-L116 HydrophobicContact CB-CD2 4.35Å; R114-L116 HydrophobicContact CB-CG 3.71Å; R114-L116 PolarHBondContact O-N 3.42Å; L116-L118 PolarHBondContact O-N 2.79Å; L116-Y131 HydrophobicContact CD1-CD1 4.44Å; L116-Y131 HydrophobicContact CD1-CD2 4.33Å; L116-Y131 HydrophobicContact CD1-CE2 4.48Å; L116-Y131 HydrophobicContact CD1-CG 4.32Å; L116-Y131 HydrophobicContact CD2-CE1 4.37Å; L116-Y131 HydrophobicContact CD2-CE2 4.32Å
117	D	93.1	Very high	91.5	Very high	70 Å²	70	68.3 Å²	68.3	37%	0.374	38%	0.379	S	S	.	.			trans	-74.1	108	172.6	-177.2	-29.3	0	0	0	110	N119 R120 L121 Y127	D117-N119 PolarHBondContact O-N 3.09Å; D117-N119 WeakPolarHBondContact OD1-CB 3.46Å; D117-N119 PolarHBondContact OD1-N 3.07Å; D117-R120 HydrophobicContact CB-CB 4.14Å; D117-R120 HydrophobicContact CB-CG 4.16Å; D117-R120 PolarHBondContact O-N 2.8Å; D117-R120 PolarHBondContact OD1-N 3.12Å; D117-R120 VanDerWaalsContact OD1-N 3.08Å; D117-R120 WeakPolarHBondContact OD2-CD 3.47Å; D117-R120 WeakPolarHBondContact OD2-CG 3.34Å; D117-L121 WeakPolarHBondContact O-CB 3.22Å; D117-L121 PolarHBondContact O-N 3.4Å; D117-L121 VanDerWaalsContact O-N 3.08Å; D117-Y127 PolarHBondContact N-OH 3.05Å
118	L	92.8	Very high	91.2	Very high	54 Å²	54	69 Å²	69	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-40.8	-179.5	179.4	57.1	0	0	0	112.4	K107 Q108 A111 L116 R120 L121 L122	K107-L118 HydrophobicContact CB-CD1 4.29Å; Q108-L118 HydrophobicContact CB-CD1 4.38Å; Q108-L118 HydrophobicContact CB-CD2 4.38Å; Q108-L118 HydrophobicContact CG-CD2 4.1Å; A111-L118 HydrophobicContact CB-CB 4.28Å; A111-L118 HydrophobicContact CB-CD1 4.18Å; L116-L118 PolarHBondContact O-N 2.79Å; L118-R120 VanDerWaalsContact C-N 3.3Å; L118-R120 PolarHBondContact O-N 2.9Å; L118-L121 PolarHBondContact O-N 3.18Å; L118-L121 VanDerWaalsContact O-N 3.11Å; L118-L122 HydrophobicContact CD1-CD1 4.15Å; L118-L122 HydrophobicContact CD1-CD2 4.38Å; L118-L122 HydrophobicContact CD1-CG 3.95Å; L118-L122 HydrophobicContact CG-CD1 3.93Å; L118-L122 HydrophobicContact CG-CG 4.21Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.39Å; L118-L122 PolarHBondContact O-N 3.2Å
119	N	91.7	Very high	90.7	Very high	131 Å²	131	69.5 Å²	69.5	70%	0.701	38%	0.384	S	S	*	.	H	α-helix	trans	-63.7	-40.8	-177.4	-68.9	-33.7	0	0	0	110.6	D117 L121 L122 G123	D117-N119 PolarHBondContact O-N 3.09Å; D117-N119 WeakPolarHBondContact OD1-CB 3.46Å; D117-N119 PolarHBondContact OD1-N 3.07Å; N119-L121 VanDerWaalsContact C-N 3.35Å; N119-L122 PolarHBondContact O-N 3.34Å; N119-G123 PolarHBondContact O-N 3.28Å
120	R	90.9	Very high	90.4	Very high	140 Å²	140	77 Å²	77	53%	0.528	41%	0.41	S	S	.	.	H	α-helix	trans	-68.9	-33	175	-65.6	-178.9	70	-173.5	4.1	112.8	D117 L118 Y127	D117-R120 HydrophobicContact CB-CB 4.14Å; D117-R120 HydrophobicContact CB-CG 4.16Å; D117-R120 PolarHBondContact O-N 2.8Å; D117-R120 PolarHBondContact OD1-N 3.12Å; D117-R120 VanDerWaalsContact OD1-N 3.08Å; D117-R120 WeakPolarHBondContact OD2-CD 3.47Å; D117-R120 WeakPolarHBondContact OD2-CG 3.34Å; L118-R120 VanDerWaalsContact C-N 3.3Å; L118-R120 PolarHBondContact O-N 2.9Å; R120-Y127 HydrophobicContact CB-CD1 3.45Å; R120-Y127 VanDerWaalsContact CB-CD1 3.45Å; R120-Y127 HydrophobicContact CB-CE1 3.72Å; R120-Y127 HydrophobicContact CB-CG 3.91Å
121	L	89.6	Confident	90.1	Very high	0 Å²	0	79 Å²	79	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-73.8	-29.8	177.3	-167.1	66.4	0	0	0	112.7	K107 Y110 A111 D117 L118 N119 Y127 Y131 M135	K107-L121 HydrophobicContact CB-CD2 3.99Å; K107-L121 HydrophobicContact CB-CG 4.35Å; K107-L121 HydrophobicContact CG-CD2 4.35Å; K107-L121 HydrophobicContact CG-CG 4.33Å; K107-L121 WeakPolarHBondContact O-CD2 3.31Å; Y110-L121 HydrophobicContact CD1-CD2 3.92Å; A111-L121 HydrophobicContact CB-CD2 3.94Å; D117-L121 WeakPolarHBondContact O-CB 3.22Å; D117-L121 PolarHBondContact O-N 3.4Å; D117-L121 VanDerWaalsContact O-N 3.08Å; L118-L121 PolarHBondContact O-N 3.18Å; L118-L121 VanDerWaalsContact O-N 3.11Å; N119-L121 VanDerWaalsContact C-N 3.35Å; L121-Y127 HydrophobicContact CB-CE1 4.47Å; L121-Y131 HydrophobicContact CD1-CD2 4.45Å; L121-M135 HydrophobicContact CD1-SD 4.36Å; L121-M135 HydrophobicContact CD2-SD 4.02Å; L121-M135 HydrophobicContact CG-SD 4.36Å
122	L	86.2	Confident	89.8	Confident	81 Å²	81	81.5 Å²	81.5	42%	0.424	43%	0.427	S	S	.	.	H	α-helix	trans	-71.2	-31.5	174.7	-71.9	171.8	0	0	0	112.5	K107 L118 N119	K107-L122 HydrophobicContact CB-CD2 4.33Å; K107-L122 HydrophobicContact CD-CD2 3.72Å; L118-L122 HydrophobicContact CD1-CD1 4.15Å; L118-L122 HydrophobicContact CD1-CD2 4.38Å; L118-L122 HydrophobicContact CD1-CG 3.95Å; L118-L122 HydrophobicContact CG-CD1 3.93Å; L118-L122 HydrophobicContact CG-CG 4.21Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.39Å; L118-L122 PolarHBondContact O-N 3.2Å; N119-L122 PolarHBondContact O-N 3.34Å
123	G	83.9	Confident	89.4	Confident	34 Å²	34	78.9 Å²	78.9	35%	0.351	43%	0.429	S	S	.	.	S	Bend	trans	-67.3	-174.1	-179.1	0	0	0	0	0	116	N119 K128	N119-G123 PolarHBondContact O-N 3.28Å; G123-K128 WeakPolarHBondContact O-CD 3.32Å
124	S	77.6	Confident	89.3	Confident	123 Å²	123	76.7 Å²	76.7	86%	0.86	42%	0.42	S	S	*	.	S	Bend	trans	-104.1	7.7	-176.1	52.5	0	0	0	0	114.6
125	G	83.9	Confident	89.3	Confident	32 Å²	32	71.8 Å²	71.8	33%	0.33	40%	0.402	S	S	.	.	S	Bend	trans	-87.7	176.7	-171.6	0	0	0	0	0	116.1	Y127 K128	G125-Y127 PolarHBondContact O-N 3.35Å; G125-Y127 VanDerWaalsContact O-N 3.11Å; G125-K128 PolarHBondContact O-N 2.81Å; G125-K128 VanDerWaalsContact O-N 3.11Å
126	P	84.2	Confident	89.1	Confident	116 Å²	116	70.4 Å²	70.4	75%	0.753	38%	0.377	S	S	*	.	H	α-helix	trans	-61.5	-23.3	-178.3	25	-35.1	0	0	0	113.5	K128 E129 R130	P126-K128 VanDerWaalsContact C-N 3.34Å; P126-K128 PolarHBondContact O-N 2.85Å; P126-E129 PolarHBondContact O-N 3.3Å; P126-R130 PolarHBondContact O-N 3.47Å
127	Y	86.6	Confident	89.1	Confident	39 Å²	39	76.3 Å²	76.3	15%	0.153	40%	0.397	C	S	.	.	H	α-helix	trans	-57.9	-46.6	174.6	-173.9	-93	0	0	0	111.8	D117 R120 L121 G125 Y131	D117-Y127 PolarHBondContact N-OH 3.05Å; R120-Y127 HydrophobicContact CB-CD1 3.45Å; R120-Y127 VanDerWaalsContact CB-CD1 3.45Å; R120-Y127 HydrophobicContact CB-CE1 3.72Å; R120-Y127 HydrophobicContact CB-CG 3.91Å; L121-Y127 HydrophobicContact CB-CE1 4.47Å; G125-Y127 PolarHBondContact O-N 3.35Å; G125-Y127 VanDerWaalsContact O-N 3.11Å; Y127-Y131 HydrophobicContact CD1-CD2 4.43Å; Y127-Y131 HydrophobicContact CD1-CE2 4.31Å; Y127-Y131 HydrophobicContact CD2-CE2 4.26Å; Y127-Y131 HydrophobicContact CE1-CD2 4.26Å; Y127-Y131 AromaticContact CE1-CE2 3.97Å; Y127-Y131 HydrophobicContact CE1-CE2 3.97Å; Y127-Y131 AromaticContact CE2-CE2 3.92Å; Y127-Y131 HydrophobicContact CE2-CE2 3.92Å; Y127-Y131 HydrophobicContact CG-CE2 4.46Å; Y127-Y131 AromaticContact CZ-CE2 3.77Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.48Å
128	K	87.5	Confident	89.2	Confident	46 Å²	46	74 Å²	74	20%	0.2	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-43.4	176.3	169	-170.9	153.5	-160.8	0	111	G123 G125 P126 R130 Y131 R132	G123-K128 WeakPolarHBondContact O-CD 3.32Å; G125-K128 PolarHBondContact O-N 2.81Å; G125-K128 VanDerWaalsContact O-N 3.11Å; P126-K128 VanDerWaalsContact C-N 3.34Å; P126-K128 PolarHBondContact O-N 2.85Å; K128-R130 VanDerWaalsContact C-N 3.29Å; K128-R130 PolarHBondContact O-N 3.16Å; K128-Y131 PolarHBondContact O-N 3.45Å; K128-Y131 VanDerWaalsContact O-N 3.12Å; K128-R132 PolarHBondContact O-N 2.95Å; K128-R132 VanDerWaalsContact O-N 3.09Å
129	E	86.9	Confident	89.4	Confident	109 Å²	109	71.4 Å²	71.4	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-64.5	-36.9	-175	-158.3	56.2	-146.5	0	0	111.9	P126 Y131 R132	P126-E129 PolarHBondContact O-N 3.3Å; E129-Y131 PolarHBondContact O-N 3.03Å; E129-Y131 VanDerWaalsContact O-N 3.16Å; E129-R132 WeakPolarHBondContact O-CB 3.49Å; E129-R132 PolarHBondContact O-N 3.3Å; E129-R132 VanDerWaalsContact O-N 3.16Å; E129-R132 WeakPolarHBondContact OE1-CD 3.33Å; E129-R132 WeakPolarHBondContact OE2-CD 3.4Å
130	R	90	Very high	89.5	Confident	197 Å²	197	66.4 Å²	66.4	74%	0.743	34%	0.341	S	S	*	.	H	α-helix	trans	-53	-36.2	173	179.5	179.2	177	178.8	-1.2	113.4	P126 K128	P126-R130 PolarHBondContact O-N 3.47Å; K128-R130 VanDerWaalsContact C-N 3.29Å; K128-R130 PolarHBondContact O-N 3.16Å
131	Y	92.1	Very high	89.7	Confident	46 Å²	46	63.2 Å²	63.2	18%	0.18	34%	0.335	C	S	.	.	H	α-helix	trans	-103	-1.3	-176.2	-59.4	-66.5	0	0	0	113.5	Y110 L116 L121 Y127 K128 E129 A133 D134 M135	Y110-Y131 HydrophobicContact CE1-CG 4.46Å; L116-Y131 HydrophobicContact CD1-CD1 4.44Å; L116-Y131 HydrophobicContact CD1-CD2 4.33Å; L116-Y131 HydrophobicContact CD1-CE2 4.48Å; L116-Y131 HydrophobicContact CD1-CG 4.32Å; L116-Y131 HydrophobicContact CD2-CE1 4.37Å; L116-Y131 HydrophobicContact CD2-CE2 4.32Å; L121-Y131 HydrophobicContact CD1-CD2 4.45Å; Y127-Y131 HydrophobicContact CD1-CD2 4.43Å; Y127-Y131 HydrophobicContact CD1-CE2 4.31Å; Y127-Y131 HydrophobicContact CD2-CE2 4.26Å; Y127-Y131 HydrophobicContact CE1-CD2 4.26Å; Y127-Y131 AromaticContact CE1-CE2 3.97Å; Y127-Y131 HydrophobicContact CE1-CE2 3.97Å; Y127-Y131 AromaticContact CE2-CE2 3.92Å; Y127-Y131 HydrophobicContact CE2-CE2 3.92Å; Y127-Y131 HydrophobicContact CG-CE2 4.46Å; Y127-Y131 AromaticContact CZ-CE2 3.77Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.48Å; K128-Y131 PolarHBondContact O-N 3.45Å; K128-Y131 VanDerWaalsContact O-N 3.12Å; E129-Y131 PolarHBondContact O-N 3.03Å; E129-Y131 VanDerWaalsContact O-N 3.16Å; Y131-A133 PolarHBondContact O-N 3Å; Y131-D134 PolarHBondContact O-N 2.96Å; Y131-M135 WeakPolarHBondContact O-CB 3.26Å; Y131-M135 PolarHBondContact O-N 2.98Å
132	R	89.8	Confident	90.1	Very high	56 Å²	56	66.6 Å²	66.6	21%	0.211	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-47.9	-170.2	-177.1	179.9	172	73.9	0.9	112.1	K128 E129 M135 I136	K128-R132 PolarHBondContact O-N 2.95Å; K128-R132 VanDerWaalsContact O-N 3.09Å; E129-R132 WeakPolarHBondContact O-CB 3.49Å; E129-R132 PolarHBondContact O-N 3.3Å; E129-R132 VanDerWaalsContact O-N 3.16Å; E129-R132 WeakPolarHBondContact OE1-CD 3.33Å; E129-R132 WeakPolarHBondContact OE2-CD 3.4Å; R132-M135 PolarHBondContact O-N 2.77Å; R132-I136 HydrophobicContact CG-CD1 3.94Å; R132-I136 VanDerWaalsContact O-CG1 3.27Å; R132-I136 WeakPolarHBondContact O-CG1 3.37Å; R132-I136 PolarHBondContact O-N 2.89Å
133	A	89.1	Confident	90.5	Very high	79 Å²	79	63.1 Å²	63.1	65%	0.653	33%	0.329	S	S	*	.	H	α-helix	trans	-64.4	-48.7	-178.3	0	0	0	0	0	112.4	Y131 M135 I136 R137	Y131-A133 PolarHBondContact O-N 3Å; A133-M135 VanDerWaalsContact C-N 3.34Å; A133-M135 PolarHBondContact O-N 3.36Å; A133-I136 PolarHBondContact O-N 2.94Å; A133-R137 PolarHBondContact O-N 3.1Å
134	D	93.9	Very high	91	Very high	43 Å²	43	67.7 Å²	67.7	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-39	178.2	-170.2	60.1	0	0	0	111.7	Y110 R114 Y131 I136 R137 W138	Y110-D134 WeakPolarHBondContact CE2-OD2 3.5Å; Y110-D134 PolarHBondContact OH-OD2 2.88Å; R114-D134 IonicContact CZ-OD2 3.8Å; R114-D134 IonicContact NE-OD2 2.67Å; R114-D134 PolarHBondContact NE-OD2 3.31Å; R114-D134 IonicContact NH2-OD2 3.62Å; R114-D134 PolarHBondContact NH2-OD2 2.99Å; Y131-D134 PolarHBondContact O-N 2.96Å; D134-I136 PolarHBondContact O-N 3.38Å; D134-R137 PolarHBondContact O-N 3.2Å; D134-R137 IonicContact OD1-CZ 3.68Å; D134-R137 IonicContact OD1-NE 2.86Å; D134-R137 IonicContact OD1-NH2 2.95Å; D134-R137 PolarHBondContact OD1-NH2 3.24Å; D134-W138 VanDerWaalsContact O-CB 3.3Å; D134-W138 WeakPolarHBondContact O-CB 3.49Å; D134-W138 PolarHBondContact O-N 3Å
135	M	94.8	Very high	91.9	Very high	7 Å²	7	71 Å²	71	3%	0.034	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-39.4	177.3	-177.7	175.3	61.6	0	0	112.3	L106 K107 Y110 L121 Y131 R132 A133 G139	L106-M135 HydrophobicContact CD1-CG 4.16Å; L106-M135 HydrophobicContact CD2-CG 4.41Å; L106-M135 HydrophobicContact CG-CG 4.06Å; L106-M135 HydrophobicContact CG-SD 4.39Å; K107-M135 HydrophobicContact CB-SD 4.36Å; K107-M135 HydrophobicContact CG-CE 4.1Å; K107-M135 HydrophobicContact CG-SD 3.69Å; Y110-M135 HydrophobicContact CD1-CB 4Å; Y110-M135 HydrophobicContact CD1-CG 3.87Å; Y110-M135 HydrophobicContact CD1-SD 4Å; Y110-M135 HydrophobicContact CD2-CB 4.02Å; Y110-M135 HydrophobicContact CD2-CG 4.02Å; Y110-M135 HydrophobicContact CE1-CB 3.94Å; Y110-M135 HydrophobicContact CE1-CG 4.34Å; Y110-M135 HydrophobicContact CE2-CB 3.95Å; Y110-M135 HydrophobicContact CE2-CG 4.46Å; Y110-M135 HydrophobicContact CG-CB 4.04Å; Y110-M135 HydrophobicContact CG-CG 3.7Å; Y110-M135 HydrophobicContact CG-SD 4.27Å; L121-M135 HydrophobicContact CD1-SD 4.36Å; L121-M135 HydrophobicContact CD2-SD 4.02Å; L121-M135 HydrophobicContact CG-SD 4.36Å; Y131-M135 WeakPolarHBondContact O-CB 3.26Å; Y131-M135 PolarHBondContact O-N 2.98Å; R132-M135 PolarHBondContact O-N 2.77Å; A133-M135 VanDerWaalsContact C-N 3.34Å; A133-M135 PolarHBondContact O-N 3.36Å; M135-G139 PolarHBondContact O-N 3.46Å
136	I	91.8	Very high	92.6	Very high	43 Å²	43	72 Å²	72	22%	0.221	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-50.8	174.1	-71.7	167.4	0	0	0	109.6	R132 A133 D134 W138 G139 E140	R132-I136 HydrophobicContact CG-CD1 3.94Å; R132-I136 VanDerWaalsContact O-CG1 3.27Å; R132-I136 WeakPolarHBondContact O-CG1 3.37Å; R132-I136 PolarHBondContact O-N 2.89Å; A133-I136 PolarHBondContact O-N 2.94Å; D134-I136 PolarHBondContact O-N 3.38Å; I136-W138 PolarHBondContact O-N 3.36Å; I136-G139 CarbonylContact O-C 3.54Å; I136-G139 WeakPolarHBondContact O-CA 3.14Å; I136-G139 PolarHBondContact O-N 3.02Å; I136-E140 WeakPolarHBondContact O-CG 3.2Å; I136-E140 PolarHBondContact O-N 2.78Å
137	R	93.9	Very high	93.1	Very high	156 Å²	156	69.4 Å²	69.4	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-57.2	-50.1	179.2	-176.4	-179.1	67.2	170.3	0.2	112	A133 D134 G139 E140 D141	A133-R137 PolarHBondContact O-N 3.1Å; D134-R137 PolarHBondContact O-N 3.2Å; D134-R137 IonicContact OD1-CZ 3.68Å; D134-R137 IonicContact OD1-NE 2.86Å; D134-R137 IonicContact OD1-NH2 2.95Å; D134-R137 PolarHBondContact OD1-NH2 3.24Å; R137-G139 PolarHBondContact O-N 2.97Å; R137-E140 PolarHBondContact O-N 2.83Å; R137-E140 VanDerWaalsContact O-N 3.11Å; R137-D141 PolarHBondContact O-N 3.15Å
138	W	96.6	Very high	93.6	Very high	21 Å²	21	67.6 Å²	67.6	8%	0.08	31%	0.313	C	S	.	.	H	α-helix	trans	-57.4	-40.4	175.6	175	93	0	0	0	111.5	L106 Q109 Y110 E113 D134 I136 D141 R142 F150	L106-W138 HydrophobicContact CD1-CE3 3.79Å; L106-W138 HydrophobicContact CD1-CZ3 3.74Å; Q109-W138 HydrophobicContact CB-CH2 3.51Å; Q109-W138 HydrophobicContact CB-CZ2 4.3Å; Q109-W138 HydrophobicContact CB-CZ3 4.28Å; Y110-W138 HydrophobicContact CD2-CB 4.02Å; Y110-W138 AromaticContact CD2-CD2 3.86Å; Y110-W138 HydrophobicContact CD2-CD2 3.86Å; Y110-W138 AromaticContact CD2-CE3 3.98Å; Y110-W138 HydrophobicContact CD2-CE3 3.98Å; Y110-W138 AromaticContact CD2-CG 3.87Å; Y110-W138 HydrophobicContact CD2-CG 3.87Å; Y110-W138 HydrophobicContact CE2-CB 4.17Å; Y110-W138 HydrophobicContact CE2-CG 4.36Å; Y110-W138 HydrophobicContact CG-CE3 4.47Å; E113-W138 WeakPolarHBondContact OE1-CZ2 3.47Å; E113-W138 WeakPolarHBondContact OE2-CZ2 3.34Å; E113-W138 PolarHBondContact OE2-NE1 3.26Å; D134-W138 VanDerWaalsContact O-CB 3.3Å; D134-W138 WeakPolarHBondContact O-CB 3.49Å; D134-W138 PolarHBondContact O-N 3Å; I136-W138 PolarHBondContact O-N 3.36Å; W138-D141 PolarHBondContact O-N 2.92Å; W138-R142 HydrophobicContact CD2-CG 4.2Å; W138-R142 HydrophobicContact CE3-CG 4.33Å; W138-R142 HydrophobicContact CH2-CG 3.89Å; W138-R142 HydrophobicContact CZ2-CG 3.79Å; W138-R142 VanDerWaalsContact CZ2-NE 3.3Å; W138-R142 HydrophobicContact CZ3-CG 4.19Å; W138-R142 WeakPolarHBondContact O-CG 3.28Å; W138-R142 PolarHBondContact O-N 3.43Å; W138-R142 VanDerWaalsContact O-N 3.1Å; W138-F150 HydrophobicContact CE3-CZ 4.36Å; W138-F150 HydrophobicContact CH2-CE1 4.18Å; W138-F150 HydrophobicContact CH2-CZ 4.14Å; W138-F150 AromaticContact CZ3-CE1 3.83Å; W138-F150 HydrophobicContact CZ3-CE1 3.83Å; W138-F150 AromaticContact CZ3-CZ 3.58Å; W138-F150 HydrophobicContact CZ3-CZ 3.58Å
139	G	95.8	Very high	94.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-42.7	175.1	0	0	0	0	0	112.9	M135 I136 R137 R142 R143	M135-G139 PolarHBondContact O-N 3.46Å; I136-G139 CarbonylContact O-C 3.54Å; I136-G139 WeakPolarHBondContact O-CA 3.14Å; I136-G139 PolarHBondContact O-N 3.02Å; R137-G139 PolarHBondContact O-N 2.97Å; G139-R142 PolarHBondContact O-N 3.44Å; G139-R143 WeakPolarHBondContact O-CG 3.46Å; G139-R143 PolarHBondContact O-N 2.9Å; G139-R143 PolarHBondContact O-NH1 3.35Å
140	E	94.6	Very high	94.6	Very high	26 Å²	26	62.3 Å²	62.3	12%	0.121	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-40.9	175.9	-56.2	-43.7	160.7	0	0	112.1	I136 R137 R142 R143 N144 R170	I136-E140 WeakPolarHBondContact O-CG 3.2Å; I136-E140 PolarHBondContact O-N 2.78Å; R137-E140 PolarHBondContact O-N 2.83Å; R137-E140 VanDerWaalsContact O-N 3.11Å; E140-R142 PolarHBondContact O-N 3.38Å; E140-R143 PolarHBondContact O-N 3.33Å; E140-R143 VanDerWaalsContact O-N 3.11Å; E140-R143 IonicContact OE1-NH1 2.66Å; E140-R143 PolarHBondContact OE1-NH1 3.06Å; E140-R143 IonicContact OE2-CZ 3.08Å; E140-R143 IonicContact OE2-NH1 3.46Å; E140-R143 PolarHBondContact OE2-NH1 2.93Å; E140-N144 WeakPolarHBondContact O-CB 3.3Å; E140-N144 PolarHBondContact O-N 3.45Å; E140-N144 PolarHBondContact O-ND2 2.93Å; E140-R170 IonicContact OE1-CZ 2.74Å; E140-R170 IonicContact OE1-NE 3.2Å; E140-R170 PolarHBondContact OE1-NE 3.49Å; E140-R170 IonicContact OE1-NH2 3.34Å; E140-R170 PolarHBondContact OE1-NH2 3.32Å; E140-R170 IonicContact OE2-NE 3.3Å; E140-R170 PolarHBondContact OE2-NE 3.12Å
141	D	95.9	Very high	95	Very high	74 Å²	74	53 Å²	53	40%	0.396	25%	0.254	S	S	.	.	H	α-helix	trans	-58.4	-37.7	175.1	-70.7	-22.9	0	0	0	111.8	R137 W138 R145	R137-D141 PolarHBondContact O-N 3.15Å; W138-D141 PolarHBondContact O-N 2.92Å; D141-R145 WeakPolarHBondContact O-CG 3.04Å; D141-R145 PolarHBondContact O-N 3.29Å
142	R	96.8	Very high	95.2	Very high	71 Å²	71	55.3 Å²	55.3	27%	0.268	26%	0.262	S	S	.	.	H	α-helix	trans	-67.2	-46.8	173.9	-67.6	-70.4	-178.2	-172.7	-1.6	111.7	E113 W138 G139 E140 R145 D146 F149 F150	E113-R142 IonicContact OE1-CZ 2.96Å; E113-R142 IonicContact OE1-NE 2.68Å; E113-R142 IonicContact OE1-NH2 3.62Å; E113-R142 PolarHBondContact OE1-NH2 2.99Å; E113-R142 IonicContact OE2-NH2 2.61Å; E113-R142 PolarHBondContact OE2-NH2 3.31Å; E113-R142 VanDerWaalsContact OE2-NH2 3.08Å; W138-R142 HydrophobicContact CD2-CG 4.2Å; W138-R142 HydrophobicContact CE3-CG 4.33Å; W138-R142 HydrophobicContact CH2-CG 3.89Å; W138-R142 HydrophobicContact CZ2-CG 3.79Å; W138-R142 VanDerWaalsContact CZ2-NE 3.3Å; W138-R142 HydrophobicContact CZ3-CG 4.19Å; W138-R142 WeakPolarHBondContact O-CG 3.28Å; W138-R142 PolarHBondContact O-N 3.43Å; W138-R142 VanDerWaalsContact O-N 3.1Å; G139-R142 PolarHBondContact O-N 3.44Å; E140-R142 PolarHBondContact O-N 3.38Å; R142-R145 PolarHBondContact O-N 3.09Å; R142-D146 PolarHBondContact O-N 3.11Å; R142-F149 HydrophobicContact CB-CD1 4.35Å; R142-F150 HydrophobicContact CB-CE2 4.05Å; R142-F150 HydrophobicContact CB-CZ 3.95Å; R142-F150 HydrophobicContact CG-CZ 4.34Å
143	R	95.1	Very high	95.6	Very high	8 Å²	8	54.5 Å²	54.5	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-38.4	178.9	-71.2	-173.3	-165.7	82.4	12.9	113	G139 E140 R145 D146 P147 F150 D173	G139-R143 WeakPolarHBondContact O-CG 3.46Å; G139-R143 PolarHBondContact O-N 2.9Å; G139-R143 PolarHBondContact O-NH1 3.35Å; E140-R143 PolarHBondContact O-N 3.33Å; E140-R143 VanDerWaalsContact O-N 3.11Å; E140-R143 IonicContact OE1-NH1 2.66Å; E140-R143 PolarHBondContact OE1-NH1 3.06Å; E140-R143 IonicContact OE2-CZ 3.08Å; E140-R143 IonicContact OE2-NH1 3.46Å; E140-R143 PolarHBondContact OE2-NH1 2.93Å; R143-R145 PolarHBondContact O-N 3.47Å; R143-D146 CarbonylContact O-C 3.56Å; R143-D146 PolarHBondContact O-N 3.01Å; R143-P147 WeakPolarHBondContact O-CA 3.41Å; R143-P147 WeakPolarHBondContact O-CD 3.49Å; R143-F150 HydrophobicContact CG-CD2 3.9Å; R143-F150 HydrophobicContact CG-CE2 3.97Å; R143-D173 IonicContact NE-OD1 3.64Å
144	N	94.3	Very high	96	Very high	129 Å²	129	51.5 Å²	51.5	69%	0.69	24%	0.237	S	C	*	.	H	α-helix	trans	-63.9	-31.8	178.8	-73.2	-22.3	0	0	0	112.2	E140	E140-N144 WeakPolarHBondContact O-CB 3.3Å; E140-N144 PolarHBondContact O-N 3.45Å; E140-N144 PolarHBondContact O-ND2 2.93Å
145	R	96.8	Very high	96.1	Very high	194 Å²	194	50.3 Å²	50.3	73%	0.732	23%	0.231	S	C	*	.	H	α-helix	trans	-82.4	-35.7	174.6	-65.9	172.7	-171.5	172.8	5.1	112.1	D141 R142 R143	D141-R145 WeakPolarHBondContact O-CG 3.04Å; D141-R145 PolarHBondContact O-N 3.29Å; R142-R145 PolarHBondContact O-N 3.09Å; R143-R145 PolarHBondContact O-N 3.47Å
146	D	97.4	Very high	96.1	Very high	51 Å²	51	58.8 Å²	58.8	27%	0.273	26%	0.263	S	S	.	.			trans	-151.2	93.2	-174.5	179.9	-4.2	0	0	0	110.5	R142 R143 G148 F149 R152	R142-D146 PolarHBondContact O-N 3.11Å; R143-D146 CarbonylContact O-C 3.56Å; R143-D146 PolarHBondContact O-N 3.01Å; D146-G148 PolarHBondContact O-N 3.36Å; D146-G148 VanDerWaalsContact O-N 3.08Å; D146-G148 PolarHBondContact OD1-N 3.4Å; D146-F149 HydrophobicContact CB-CB 4.16Å; D146-F149 VanDerWaalsContact O-CB 3.32Å; D146-F149 WeakPolarHBondContact O-CB 3.45Å; D146-F149 PolarHBondContact O-N 2.71Å; D146-F149 PolarHBondContact OD1-N 2.92Å; D146-R152 IonicContact OD1-CZ 2.57Å; D146-R152 IonicContact OD1-NH1 3.66Å; D146-R152 PolarHBondContact OD1-NH1 3.2Å; D146-R152 IonicContact OD1-NH2 3.14Å; D146-R152 PolarHBondContact OD1-NH2 2.77Å; D146-R152 IonicContact OD2-CZ 2.93Å; D146-R152 IonicContact OD2-NH1 3.47Å; D146-R152 IonicContact OD2-NH2 3.91Å; D146-R152 PolarHBondContact OD2-NH2 2.96Å
147	P	95.1	Very high	96	Very high	63 Å²	63	59.1 Å²	59.1	41%	0.409	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.6	-176.9	-32.7	38.6	0	0	0	114.4	R143	R143-P147 WeakPolarHBondContact O-CA 3.41Å; R143-P147 WeakPolarHBondContact O-CD 3.49Å
148	G	96.9	Very high	96.1	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.01	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	1.6	-177.8	0	0	0	0	0	114.9	D146 F150 C151 R152	D146-G148 PolarHBondContact O-N 3.36Å; D146-G148 VanDerWaalsContact O-N 3.08Å; D146-G148 PolarHBondContact OD1-N 3.4Å; G148-F150 PolarHBondContact O-N 2.79Å; G148-C151 PolarHBondContact O-N 2.93Å; G148-R152 VanDerWaalsContact C-NH1 3.31Å; G148-R152 WeakPolarHBondContact O-CG 3.35Å; G148-R152 PolarHBondContact O-N 3.1Å; G148-R152 PolarHBondContact O-NH1 2.61Å
149	F	97.9	Very high	96	Very high	42 Å²	42	59.1 Å²	59.1	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-53.8	-55.5	-172.1	-178.3	-96.6	0	0	0	112.8	Q109 R142 D146 L153	Q109-F149 HydrophobicContact CG-CE1 4.16Å; Q109-F149 HydrophobicContact CG-CZ 4.29Å; R142-F149 HydrophobicContact CB-CD1 4.35Å; D146-F149 HydrophobicContact CB-CB 4.16Å; D146-F149 VanDerWaalsContact O-CB 3.32Å; D146-F149 WeakPolarHBondContact O-CB 3.45Å; D146-F149 PolarHBondContact O-N 2.71Å; D146-F149 PolarHBondContact OD1-N 2.92Å; F149-L153 HydrophobicContact CD1-CD1 4.2Å; F149-L153 HydrophobicContact CE1-CD1 3.72Å; F149-L153 HydrophobicContact CZ-CD1 3.92Å; F149-L153 WeakPolarHBondContact O-CG 3.49Å; F149-L153 PolarHBondContact O-N 3.15Å
150	F	98	Very high	96	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-75.1	-29.7	179.7	-60.6	-61.8	0	0	0	112.7	P105 L106 W138 R142 R143 G148 L153 A154	P105-F150 HydrophobicContact CB-CD1 4.09Å; L106-F150 VanDerWaalsContact CA-CE1 3.45Å; L106-F150 HydrophobicContact CB-CD1 4.17Å; L106-F150 HydrophobicContact CB-CE1 3.99Å; L106-F150 HydrophobicContact CB-CZ 4.34Å; L106-F150 HydrophobicContact CD1-CE1 4.06Å; L106-F150 HydrophobicContact CD1-CE2 4.18Å; L106-F150 HydrophobicContact CD1-CZ 3.64Å; W138-F150 HydrophobicContact CE3-CZ 4.36Å; W138-F150 HydrophobicContact CH2-CE1 4.18Å; W138-F150 HydrophobicContact CH2-CZ 4.14Å; W138-F150 AromaticContact CZ3-CE1 3.83Å; W138-F150 HydrophobicContact CZ3-CE1 3.83Å; W138-F150 AromaticContact CZ3-CZ 3.58Å; W138-F150 HydrophobicContact CZ3-CZ 3.58Å; R142-F150 HydrophobicContact CB-CE2 4.05Å; R142-F150 HydrophobicContact CB-CZ 3.95Å; R142-F150 HydrophobicContact CG-CZ 4.34Å; R143-F150 HydrophobicContact CG-CD2 3.9Å; R143-F150 HydrophobicContact CG-CE2 3.97Å; G148-F150 PolarHBondContact O-N 2.79Å; F150-L153 PolarHBondContact O-N 2.96Å; F150-A154 VanDerWaalsContact O-CB 3.25Å; F150-A154 WeakPolarHBondContact O-CB 3.4Å; F150-A154 PolarHBondContact O-N 3.29Å
151	C	98	Very high	96.2	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.007	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-49	178.8	-53.1	0	0	0	0	110.9	L102 G148 L153 A154 T155 W176 F177	L102-C151 HydrophobicContact CD2-CB 4.39Å; G148-C151 PolarHBondContact O-N 2.93Å; C151-L153 VanDerWaalsContact C-N 3.29Å; C151-L153 PolarHBondContact O-N 3Å; C151-A154 PolarHBondContact O-N 2.84Å; C151-A154 VanDerWaalsContact O-N 3.13Å; C151-T155 VanDerWaalsContact O-CG2 3.32Å; C151-T155 WeakPolarHBondContact O-CG2 3.48Å; C151-T155 PolarHBondContact O-N 2.82Å; C151-T155 PolarHBondContact O-OG1 3.24Å; C151-T155 VanDerWaalsContact O-OG1 3.09Å; C151-W176 HydrophobicContact CB-CD2 3.47Å; C151-W176 VanDerWaalsContact CB-CD2 3.47Å; C151-W176 HydrophobicContact CB-CE3 3.12Å; C151-W176 HydrophobicContact CB-CG 4.22Å; C151-W176 HydrophobicContact CB-CH2 3.9Å; C151-W176 HydrophobicContact CB-CZ2 4.24Å; C151-W176 HydrophobicContact CB-CZ3 3.34Å; C151-F177 HydrophobicContact CB-CE2 4.07Å; C151-F177 HydrophobicContact CB-CZ 4.04Å
152	R	97.6	Very high	96.3	Very high	95 Å²	95	57.9 Å²	57.9	36%	0.358	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-36.6	176.8	-70.5	-173.7	-54.9	-87.6	-6.7	113	D146 G148 T155 R156 W176	D146-R152 IonicContact OD1-CZ 2.57Å; D146-R152 IonicContact OD1-NH1 3.66Å; D146-R152 PolarHBondContact OD1-NH1 3.2Å; D146-R152 IonicContact OD1-NH2 3.14Å; D146-R152 PolarHBondContact OD1-NH2 2.77Å; D146-R152 IonicContact OD2-CZ 2.93Å; D146-R152 IonicContact OD2-NH1 3.47Å; D146-R152 IonicContact OD2-NH2 3.91Å; D146-R152 PolarHBondContact OD2-NH2 2.96Å; G148-R152 VanDerWaalsContact C-NH1 3.31Å; G148-R152 WeakPolarHBondContact O-CG 3.35Å; G148-R152 PolarHBondContact O-N 3.1Å; G148-R152 PolarHBondContact O-NH1 2.61Å; R152-T155 PolarHBondContact O-OG1 2.76Å; R152-R156 PolarHBondContact O-N 2.86Å; R152-W176 HydrophobicContact CG-CH2 4.03Å; R152-W176 HydrophobicContact CG-CZ2 3.37Å
153	L	97.4	Very high	96.4	Very high	38 Å²	38	55.2 Å²	55.2	20%	0.199	27%	0.272	C	S	.	.	H	α-helix	trans	-70.3	-40.1	175.5	-68.9	174.6	0	0	0	111.8	P105 Q109 F149 F150 C151 T155 R156	P105-L153 HydrophobicContact CB-CB 3.55Å; P105-L153 HydrophobicContact CB-CD1 3.96Å; P105-L153 HydrophobicContact CB-CG 4.42Å; P105-L153 HydrophobicContact CG-CB 3.74Å; Q109-L153 HydrophobicContact CG-CD1 3.78Å; F149-L153 HydrophobicContact CD1-CD1 4.2Å; F149-L153 HydrophobicContact CE1-CD1 3.72Å; F149-L153 HydrophobicContact CZ-CD1 3.92Å; F149-L153 WeakPolarHBondContact O-CG 3.49Å; F149-L153 PolarHBondContact O-N 3.15Å; F150-L153 PolarHBondContact O-N 2.96Å; C151-L153 VanDerWaalsContact C-N 3.29Å; C151-L153 PolarHBondContact O-N 3Å; L153-T155 VanDerWaalsContact C-N 3.34Å; L153-R156 WeakPolarHBondContact O-CB 3.46Å; L153-R156 PolarHBondContact O-N 2.9Å
154	A	97	Very high	96.5	Very high	16 Å²	16	54.8 Å²	54.8	13%	0.132	27%	0.27	C	S	.	.	H	α-helix	trans	-69.7	-31.9	-179.1	0	0	0	0	0	112.5	L102 P105 F150 C151	L102-A154 HydrophobicContact CD2-CB 3.78Å; P105-A154 HydrophobicContact CG-CB 3.96Å; F150-A154 VanDerWaalsContact O-CB 3.25Å; F150-A154 WeakPolarHBondContact O-CB 3.4Å; F150-A154 PolarHBondContact O-N 3.29Å; C151-A154 PolarHBondContact O-N 2.84Å; C151-A154 VanDerWaalsContact O-N 3.13Å
155	T	96.5	Very high	96.7	Very high	19 Å²	19	48.7 Å²	48.7	12%	0.117	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.6	178.9	60.3	0	0	0	0	113	L100 C151 R152 L153 G157 A158 W163 W176 F177	L100-T155 HydrophobicContact CD1-CG2 3.82Å; C151-T155 VanDerWaalsContact O-CG2 3.32Å; C151-T155 WeakPolarHBondContact O-CG2 3.48Å; C151-T155 PolarHBondContact O-N 2.82Å; C151-T155 PolarHBondContact O-OG1 3.24Å; C151-T155 VanDerWaalsContact O-OG1 3.09Å; R152-T155 PolarHBondContact O-OG1 2.76Å; L153-T155 VanDerWaalsContact C-N 3.34Å; T155-G157 PolarHBondContact O-N 2.87Å; T155-G157 VanDerWaalsContact O-N 3.17Å; T155-A158 PolarHBondContact O-N 2.81Å; T155-W163 HydrophobicContact CG2-CE3 3.82Å; T155-W163 HydrophobicContact CG2-CH2 4.27Å; T155-W163 HydrophobicContact CG2-CZ3 3.44Å; T155-W163 VanDerWaalsContact CG2-CZ3 3.44Å; T155-W176 HydrophobicContact CG2-CZ3 4.43Å; T155-F177 HydrophobicContact CG2-CE1 3.71Å; T155-F177 HydrophobicContact CG2-CZ 4.1Å
156	R	94.4	Very high	96.8	Very high	184 Å²	184	39.7 Å²	39.7	69%	0.694	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	119.2	-176.3	-175.8	-178.5	-72.5	176	-4.9	110.1	R152 L153 A158	R152-R156 PolarHBondContact O-N 2.86Å; L153-R156 WeakPolarHBondContact O-CB 3.46Å; L153-R156 PolarHBondContact O-N 2.9Å; R156-A158 VanDerWaalsContact C-N 3.32Å
157	G	90.4	Very high	96.6	Very high	50 Å²	50	37.9 Å²	37.9	52%	0.515	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	1.2	177.1	0	0	0	0	0	114.9	T155	T155-G157 PolarHBondContact O-N 2.87Å; T155-G157 VanDerWaalsContact O-N 3.17Å
158	A	95.1	Very high	96.7	Very high	20 Å²	20	35 Å²	35	17%	0.165	18%	0.176	C	C	.	.			trans	-70.7	130.2	167.9	0	0	0	0	0	109.4	L100 T155 R156 W163	L100-A158 HydrophobicContact CD2-CB 3.96Å; T155-A158 PolarHBondContact O-N 2.81Å; R156-A158 VanDerWaalsContact C-N 3.32Å; A158-W163 HydrophobicContact CB-CD2 4.34Å; A158-W163 HydrophobicContact CB-CH2 4.42Å; A158-W163 HydrophobicContact CB-CZ2 3.65Å; A158-W163 WeakPolarHBondContact O-CZ2 3.33Å
159	Q	95	Very high	96.5	Very high	158 Å²	158	38.2 Å²	38.2	74%	0.738	19%	0.188	S	C	*	.			trans	-122.6	-13.2	-176.5	-65.4	-176	-8.9	0	0	112.5
160	Q	96.6	Very high	96.3	Very high	48 Å²	48	37 Å²	37	22%	0.224	18%	0.182	C	C	.	.			trans	-60.3	143.8	179.4	-71.5	84.4	-12.9	0	0	110.9	P94 V96 A98 V162 W163	P94-Q160 WeakPolarHBondContact O-CG 3.45Å; P94-Q160 PolarHBondContact O-NE2 3.13Å; V96-Q160 WeakPolarHBondContact O-CB 3.47Å; A98-Q160 HydrophobicContact CB-CB 3.91Å; A98-Q160 HydrophobicContact CB-CG 3.97Å; Q160-V162 VanDerWaalsContact C-N 3.27Å; Q160-V162 PolarHBondContact O-N 2.89Å; Q160-W163 PolarHBondContact O-NE1 3.3Å
161	P	97.3	Very high	96.2	Very high	26 Å²	26	40.9 Å²	40.9	17%	0.169	20%	0.201	C	C	.	.	S	Bend	trans	-69.8	-24.6	178.4	28.6	-36.2	0	0	0	113.1	P67 E68 L69 V96 A251 A254	P67-P161 CarbonylContact C-O 3.6Å; P67-P161 WeakPolarHBondContact CA-O 3.32Å; E68-P161 PolarHBondContact N-O 3.12Å; L69-P161 PolarHBondContact N-O 2.77Å; L69-P161 VanDerWaalsContact N-O 3.09Å; V96-P161 HydrophobicContact CG1-CG 4.27Å; V96-P161 WeakPolarHBondContact O-CD 3.46Å; P161-A251 HydrophobicContact CG-CB 4.36Å; P161-A254 HydrophobicContact CB-CB 3.47Å; P161-A254 VanDerWaalsContact CB-CB 3.47Å; P161-A254 HydrophobicContact CG-CB 4.2Å
162	V	98.4	Very high	96	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.1	177.6	-176.9	0	0	0	0	110	L69 L71 L92 V96 C97 A98 Q160 A247 A250	L69-V162 HydrophobicContact CB-CG2 4.47Å; L69-V162 HydrophobicContact CD2-CG1 4.27Å; L69-V162 WeakPolarHBondContact O-CA 3.42Å; L71-V162 HydrophobicContact CD1-CG1 4.48Å; L92-V162 HydrophobicContact CD1-CG1 4.29Å; V96-V162 HydrophobicContact CG1-CG2 4.34Å; V96-V162 WeakPolarHBondContact O-CB 3.4Å; V96-V162 PolarHBondContact O-N 3.12Å; V96-V162 VanDerWaalsContact O-N 3.12Å; C97-V162 WeakPolarHBondContact CA-O 3.39Å; A98-V162 PolarHBondContact N-O 2.95Å; Q160-V162 VanDerWaalsContact C-N 3.27Å; Q160-V162 PolarHBondContact O-N 2.89Å; V162-A247 HydrophobicContact CG1-CB 4.05Å; V162-A247 HydrophobicContact CG2-CB 4.16Å; V162-A247 WeakPolarHBondContact CG2-O 3.09Å; V162-A250 HydrophobicContact CG2-CB 4.31Å
163	W	98.6	Very high	95.9	Very high	14 Å²	14	37.7 Å²	37.7	5%	0.053	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130	175.3	-65.7	-1.1	0	0	0	110.7	P67 L69 V70 L71 L100 T155 A158 Q160 F181	P67-W163 HydrophobicContact CB-CB 4.49Å; P67-W163 HydrophobicContact CB-CD2 3.66Å; P67-W163 HydrophobicContact CB-CE3 4.13Å; P67-W163 HydrophobicContact CB-CG 3.83Å; P67-W163 HydrophobicContact CB-CZ2 4.3Å; P67-W163 HydrophobicContact CG-CD2 3.65Å; P67-W163 HydrophobicContact CG-CE3 3.57Å; P67-W163 HydrophobicContact CG-CG 4.27Å; P67-W163 HydrophobicContact CG-CH2 4.03Å; P67-W163 HydrophobicContact CG-CZ2 4.09Å; P67-W163 HydrophobicContact CG-CZ3 3.76Å; L69-W163 PolarHBondContact O-N 3.09Å; V70-W163 CarbonylContact C-O 3.54Å; V70-W163 WeakPolarHBondContact CA-O 3.47Å; V70-W163 HydrophobicContact CG1-CB 4.43Å; V70-W163 HydrophobicContact CG2-CB 4.45Å; V70-W163 HydrophobicContact CG2-CE3 4.25Å; L71-W163 PolarHBondContact N-O 2.72Å; L100-W163 HydrophobicContact CD1-CB 3.9Å; L100-W163 HydrophobicContact CD1-CD2 3.75Å; L100-W163 HydrophobicContact CD1-CE3 3.7Å; L100-W163 HydrophobicContact CD1-CG 3.85Å; L100-W163 HydrophobicContact CG-CB 4.45Å; T155-W163 HydrophobicContact CG2-CE3 3.82Å; T155-W163 HydrophobicContact CG2-CH2 4.27Å; T155-W163 HydrophobicContact CG2-CZ3 3.44Å; T155-W163 VanDerWaalsContact CG2-CZ3 3.44Å; A158-W163 HydrophobicContact CB-CD2 4.34Å; A158-W163 HydrophobicContact CB-CH2 4.42Å; A158-W163 HydrophobicContact CB-CZ2 3.65Å; A158-W163 WeakPolarHBondContact O-CZ2 3.33Å; Q160-W163 PolarHBondContact O-NE1 3.3Å; W163-F181 HydrophobicContact CE3-CE2 4.47Å; W163-F181 HydrophobicContact CH2-CZ 4.07Å; W163-F181 HydrophobicContact CZ3-CE1 4.36Å; W163-F181 AromaticContact CZ3-CE2 3.82Å; W163-F181 HydrophobicContact CZ3-CE2 3.82Å; W163-F181 AromaticContact CZ3-CZ 3.57Å; W163-F181 HydrophobicContact CZ3-CZ 3.57Å
164	V	98.6	Very high	95.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	102	172.5	173.3	0	0	0	0	108.2	L71 F73 T85 I88 C97 A98 V99 L100 S166	L71-V164 HydrophobicContact CB-CG2 4.34Å; L71-V164 HydrophobicContact CD1-CG2 4.15Å; L71-V164 CarbonylContact O-C 3.59Å; L71-V164 WeakPolarHBondContact O-CA 3.35Å; F73-V164 HydrophobicContact CD2-CG1 3.86Å; F73-V164 HydrophobicContact CE2-CG1 4.11Å; T85-V164 HydrophobicContact CG2-CG1 3.67Å; I88-V164 HydrophobicContact CG2-CG2 4.07Å; C97-V164 VanDerWaalsContact SG-CG2 3.55Å; A98-V164 PolarHBondContact O-N 2.86Å; V99-V164 CarbonylContact C-O 3.57Å; V99-V164 WeakPolarHBondContact CA-O 3.36Å; V99-V164 HydrophobicContact CG2-CB 4.28Å; V99-V164 HydrophobicContact CG2-CG1 4.47Å; L100-V164 PolarHBondContact N-O 3.21Å; V164-S166 PolarHBondContact O-N 3.03Å
165	V	98.4	Very high	95.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	100.9	172.5	-175.5	0	0	0	0	107.4	V70 L71 V72 F73 L100 L102 A168 F177	V70-V165 HydrophobicContact CG1-CG2 3.93Å; L71-V165 PolarHBondContact O-N 3.14Å; V72-V165 HydrophobicContact CG2-CB 4.46Å; V72-V165 HydrophobicContact CG2-CG2 4.42Å; F73-V165 WeakPolarHBondContact CB-O 3.49Å; F73-V165 PolarHBondContact N-O 3.39Å; L100-V165 HydrophobicContact CB-CG2 4.49Å; L100-V165 WeakPolarHBondContact O-CA 3.35Å; L102-V165 HydrophobicContact CD1-CG1 4.17Å; L102-V165 HydrophobicContact CD2-CG1 4.21Å; L102-V165 HydrophobicContact CG-CG1 3.97Å; V165-A168 HydrophobicContact CG1-CB 4.45Å; V165-F177 HydrophobicContact CB-CE2 4.36Å; V165-F177 HydrophobicContact CB-CZ 4.36Å; V165-F177 HydrophobicContact CG1-CE2 3.83Å; V165-F177 HydrophobicContact CG1-CZ 4.04Å; V165-F177 HydrophobicContact CG2-CD1 4.27Å; V165-F177 HydrophobicContact CG2-CD2 4.37Å; V165-F177 HydrophobicContact CG2-CE1 3.64Å; V165-F177 HydrophobicContact CG2-CE2 3.81Å; V165-F177 HydrophobicContact CG2-CZ 3.41Å; V165-F177 VanDerWaalsContact CG2-CZ 3.41Å
166	S	97.2	Very high	95.9	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.035	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-20.3	-163.2	61.3	0	0	0	0	114.5	K81 L100 R101 V164	K81-S166 VanDerWaalsContact CD-O 3.24Å; K81-S166 WeakPolarHBondContact CD-O 3.37Å; K81-S166 VanDerWaalsContact CE-O 3.24Å; K81-S166 WeakPolarHBondContact CE-O 3.39Å; K81-S166 PolarHBondContact NZ-O 2.9Å; L100-S166 PolarHBondContact O-N 3.49Å; L100-S166 PolarHBondContact O-OG 3.05Å; R101-S166 WeakPolarHBondContact CG-OG 3.48Å; V164-S166 PolarHBondContact O-N 3.03Å
167	D	94.6	Very high	96.1	Very high	13 Å²	13	31.6 Å²	31.6	7%	0.07	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.8	37.3	-169.5	66.4	-12.4	0	0	0	114.3	R101 L102 S103 R169	R101-D167 WeakPolarHBondContact CA-OD1 3.48Å; L102-D167 PolarHBondContact N-OD1 2.87Å; S103-D167 WeakPolarHBondContact CB-OD2 3.22Å; S103-D167 PolarHBondContact N-OD2 2.79Å; S103-D167 PolarHBondContact OG-OD2 3.36Å; D167-R169 WeakPolarHBondContact O-CG 3.33Å
168	A	96	Very high	96.4	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.025	16%	0.161	C	C	.	.			trans	-64.1	136.7	170.4	0	0	0	0	0	111	V72 F73 L102 V165 D173	V72-A168 HydrophobicContact CG1-CB 3.49Å; V72-A168 VanDerWaalsContact CG1-CB 3.49Å; F73-A168 PolarHBondContact O-N 3.44Å; L102-A168 HydrophobicContact CD1-CB 4.45Å; V165-A168 HydrophobicContact CG1-CB 4.45Å; A168-D173 HydrophobicContact CB-CB 4.21Å
169	R	93.9	Very high	96.4	Very high	69 Å²	69	36.2 Å²	36.2	26%	0.26	18%	0.18	S	C	.	.			trans	-138.4	-24.6	-169.2	-77.4	169.5	-177.9	-84.3	-3.5	113.3	D167 D173 S213 E214 G216	D167-R169 WeakPolarHBondContact O-CG 3.33Å; R169-D173 PolarHBondContact N-OD2 3.46Å; R169-S213 WeakPolarHBondContact CD-O 3.35Å; R169-S213 VanDerWaalsContact CG-O 3.29Å; R169-S213 WeakPolarHBondContact CG-O 3.19Å; R169-S213 PolarHBondContact NH1-O 3.46Å; R169-E214 IonicContact CZ-OE1 3.85Å; R169-E214 IonicContact NH1-OE1 3.74Å; R169-E214 PolarHBondContact NH1-OE1 2.99Å; R169-E214 IonicContact NH2-OE1 2.63Å; R169-G216 CarbonylContact O-C 3.58Å
170	R	94	Very high	96.5	Very high	16 Å²	16	31.7 Å²	31.7	6%	0.06	16%	0.159	C	C	.	.	S	Bend	trans	-111.9	151.6	177.9	-62.8	98.9	-175.2	131.8	11.4	110.9	E140 S172 D173	E140-R170 IonicContact OE1-CZ 2.74Å; E140-R170 IonicContact OE1-NE 3.2Å; E140-R170 PolarHBondContact OE1-NE 3.49Å; E140-R170 IonicContact OE1-NH2 3.34Å; E140-R170 PolarHBondContact OE1-NH2 3.32Å; E140-R170 IonicContact OE2-NE 3.3Å; E140-R170 PolarHBondContact OE2-NE 3.12Å; R170-S172 WeakPolarHBondContact CB-OG 3.43Å; R170-S172 PolarHBondContact O-N 3.28Å; R170-D173 PolarHBondContact N-OD2 2.92Å; R170-D173 WeakPolarHBondContact O-CB 3.12Å; R170-D173 PolarHBondContact O-N 3.08Å
171	Q	94.2	Very high	96.5	Very high	84 Å²	84	30.4 Å²	30.4	39%	0.393	15%	0.153	S	C	.	.	H	α-helix	trans	-57.2	-35.5	171.2	-164.1	-179.5	36.7	0	0	111.7	D173 L174 Q175 L217 G220 V221	Q171-D173 VanDerWaalsContact C-N 3.28Å; Q171-D173 PolarHBondContact O-N 3.41Å; Q171-L174 PolarHBondContact O-N 3.08Å; Q171-Q175 HydrophobicContact CG-CG 4.31Å; Q171-Q175 WeakPolarHBondContact O-CB 3.18Å; Q171-Q175 VanDerWaalsContact O-CG 3.32Å; Q171-Q175 WeakPolarHBondContact O-CG 3.49Å; Q171-Q175 PolarHBondContact O-N 2.86Å; Q171-L217 HydrophobicContact CB-CD2 4.42Å; Q171-G220 PolarHBondContact NE2-O 3.04Å; Q171-G220 VanDerWaalsContact NE2-O 3.1Å; Q171-V221 HydrophobicContact CG-CG2 4.35Å
172	S	95	Very high	96.4	Very high	28 Å²	28	33 Å²	33	20%	0.196	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-34.6	175.9	63.9	0	0	0	0	113.2	R170 W176	R170-S172 WeakPolarHBondContact CB-OG 3.43Å; R170-S172 PolarHBondContact O-N 3.28Å; S172-W176 WeakPolarHBondContact O-CB 3.09Å; S172-W176 PolarHBondContact O-N 3.33Å
173	D	96.1	Very high	96.1	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-50.9	176.4	-56.6	-35.3	0	0	0	108.8	L102 R143 A168 R169 R170 Q171 W176 F177	L102-D173 HydrophobicContact CD1-CB 3.86Å; R143-D173 IonicContact NE-OD1 3.64Å; A168-D173 HydrophobicContact CB-CB 4.21Å; R169-D173 PolarHBondContact N-OD2 3.46Å; R170-D173 PolarHBondContact N-OD2 2.92Å; R170-D173 WeakPolarHBondContact O-CB 3.12Å; R170-D173 PolarHBondContact O-N 3.08Å; Q171-D173 VanDerWaalsContact C-N 3.28Å; Q171-D173 PolarHBondContact O-N 3.41Å; D173-W176 PolarHBondContact O-N 3.46Å; D173-F177 VanDerWaalsContact O-CD2 3.22Å; D173-F177 WeakPolarHBondContact O-CD2 3.32Å; D173-F177 PolarHBondContact O-N 3.48Å
174	L	95.9	Very high	96	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-63.1	-47.4	-179.4	177.8	60.1	0	0	0	112.1	V72 Q171 W176 F177 Q178 V221	V72-L174 HydrophobicContact CB-CD1 4.08Å; V72-L174 HydrophobicContact CG1-CD1 4.07Å; V72-L174 HydrophobicContact CG2-CD1 4.34Å; Q171-L174 PolarHBondContact O-N 3.08Å; L174-W176 VanDerWaalsContact C-N 3.26Å; L174-W176 PolarHBondContact O-N 2.97Å; L174-F177 PolarHBondContact O-N 2.89Å; L174-Q178 HydrophobicContact CD1-CG 4.12Å; L174-Q178 HydrophobicContact CG-CG 4.39Å; L174-Q178 WeakPolarHBondContact O-CG 3.3Å; L174-Q178 PolarHBondContact O-N 2.58Å; L174-V221 HydrophobicContact CD2-CG1 3.51Å
175	Q	96.4	Very high	96	Very high	98 Å²	98	48.1 Å²	48.1	46%	0.458	23%	0.228	S	C	.	.	H	α-helix	trans	-58.1	-40.7	177.9	-74.5	170.1	-12.2	0	0	111.6	Q171 Q178 S179	Q171-Q175 HydrophobicContact CG-CG 4.31Å; Q171-Q175 WeakPolarHBondContact O-CB 3.18Å; Q171-Q175 VanDerWaalsContact O-CG 3.32Å; Q171-Q175 WeakPolarHBondContact O-CG 3.49Å; Q171-Q175 PolarHBondContact O-N 2.86Å; Q175-Q178 PolarHBondContact O-N 3.11Å; Q175-S179 WeakPolarHBondContact O-CB 3.27Å; Q175-S179 PolarHBondContact O-N 3.41Å; Q175-S179 PolarHBondContact O-OG 3.05Å
176	W	97.6	Very high	96	Very high	24 Å²	24	52 Å²	52	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-50.8	177.4	-175.3	81.6	0	0	0	111.5	C151 R152 T155 S172 D173 L174 Q178 S179 E180 F181	C151-W176 HydrophobicContact CB-CD2 3.47Å; C151-W176 VanDerWaalsContact CB-CD2 3.47Å; C151-W176 HydrophobicContact CB-CE3 3.12Å; C151-W176 HydrophobicContact CB-CG 4.22Å; C151-W176 HydrophobicContact CB-CH2 3.9Å; C151-W176 HydrophobicContact CB-CZ2 4.24Å; C151-W176 HydrophobicContact CB-CZ3 3.34Å; R152-W176 HydrophobicContact CG-CH2 4.03Å; R152-W176 HydrophobicContact CG-CZ2 3.37Å; T155-W176 HydrophobicContact CG2-CZ3 4.43Å; S172-W176 WeakPolarHBondContact O-CB 3.09Å; S172-W176 PolarHBondContact O-N 3.33Å; D173-W176 PolarHBondContact O-N 3.46Å; L174-W176 VanDerWaalsContact C-N 3.26Å; L174-W176 PolarHBondContact O-N 2.97Å; W176-Q178 PolarHBondContact O-N 2.91Å; W176-S179 PolarHBondContact O-N 3.05Å; W176-S179 VanDerWaalsContact O-N 3.16Å; W176-S179 PolarHBondContact O-OG 2.91Å; W176-E180 HydrophobicContact CE3-CB 4.48Å; W176-E180 HydrophobicContact CH2-CB 4.17Å; W176-E180 HydrophobicContact CH2-CG 3.86Å; W176-E180 HydrophobicContact CZ2-CB 4.12Å; W176-E180 HydrophobicContact CZ2-CG 3.85Å; W176-E180 HydrophobicContact CZ3-CB 4.33Å; W176-E180 HydrophobicContact CZ3-CG 4.44Å; W176-E180 WeakPolarHBondContact O-CB 3.4Å; W176-E180 PolarHBondContact O-N 2.74Å; W176-F181 HydrophobicContact CH2-CE2 4.26Å; W176-F181 HydrophobicContact CZ3-CE2 4.13Å
177	F	97.9	Very high	96.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-41.3	178.7	-77.7	-75.5	0	0	0	112.4	V70 V72 L102 C151 T155 V165 D173 L174 S179 E180 F181 T185	V70-F177 HydrophobicContact CG1-CD1 3.75Å; V70-F177 HydrophobicContact CG1-CE1 4.21Å; V70-F177 HydrophobicContact CG1-CG 4.32Å; V72-F177 HydrophobicContact CG2-CB 3.92Å; V72-F177 HydrophobicContact CG2-CD2 4.05Å; V72-F177 HydrophobicContact CG2-CG 4Å; L102-F177 HydrophobicContact CD2-CE2 4.24Å; L102-F177 HydrophobicContact CD2-CZ 4.31Å; C151-F177 HydrophobicContact CB-CE2 4.07Å; C151-F177 HydrophobicContact CB-CZ 4.04Å; T155-F177 HydrophobicContact CG2-CE1 3.71Å; T155-F177 HydrophobicContact CG2-CZ 4.1Å; V165-F177 HydrophobicContact CB-CE2 4.36Å; V165-F177 HydrophobicContact CB-CZ 4.36Å; V165-F177 HydrophobicContact CG1-CE2 3.83Å; V165-F177 HydrophobicContact CG1-CZ 4.04Å; V165-F177 HydrophobicContact CG2-CD1 4.27Å; V165-F177 HydrophobicContact CG2-CD2 4.37Å; V165-F177 HydrophobicContact CG2-CE1 3.64Å; V165-F177 HydrophobicContact CG2-CE2 3.81Å; V165-F177 HydrophobicContact CG2-CZ 3.41Å; V165-F177 VanDerWaalsContact CG2-CZ 3.41Å; D173-F177 VanDerWaalsContact O-CD2 3.22Å; D173-F177 WeakPolarHBondContact O-CD2 3.32Å; D173-F177 PolarHBondContact O-N 3.48Å; L174-F177 PolarHBondContact O-N 2.89Å; F177-S179 VanDerWaalsContact C-N 3.28Å; F177-S179 PolarHBondContact O-N 3.09Å; F177-E180 PolarHBondContact O-N 2.68Å; F177-F181 HydrophobicContact CD1-CD2 4.05Å; F177-F181 HydrophobicContact CD1-CE2 4.15Å; F177-F181 HydrophobicContact CE1-CE2 4.5Å; F177-F181 PolarHBondContact O-N 3.36Å; F177-T185 HydrophobicContact CB-CG2 3.95Å; F177-T185 PolarHBondContact O-OG1 3.16Å
178	Q	96.6	Very high	96.2	Very high	85 Å²	85	51.2 Å²	51.2	40%	0.397	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-37.2	175.6	-72.7	172.4	-23.9	0	0	112.4	L174 Q175 W176 P182 T185	L174-Q178 HydrophobicContact CD1-CG 4.12Å; L174-Q178 HydrophobicContact CG-CG 4.39Å; L174-Q178 WeakPolarHBondContact O-CG 3.3Å; L174-Q178 PolarHBondContact O-N 2.58Å; Q175-Q178 PolarHBondContact O-N 3.11Å; W176-Q178 PolarHBondContact O-N 2.91Å; Q178-P182 WeakPolarHBondContact O-CA 3.42Å; Q178-T185 HydrophobicContact CG-CG2 3.92Å
179	S	96.6	Very high	96.3	Very high	83 Å²	83	52.2 Å²	52.2	58%	0.58	24%	0.241	S	C	*	.	H	α-helix	trans	-74.9	-39.9	177.8	72.3	0	0	0	0	113.4	Q175 W176 F177	Q175-S179 WeakPolarHBondContact O-CB 3.27Å; Q175-S179 PolarHBondContact O-N 3.41Å; Q175-S179 PolarHBondContact O-OG 3.05Å; W176-S179 PolarHBondContact O-N 3.05Å; W176-S179 VanDerWaalsContact O-N 3.16Å; W176-S179 PolarHBondContact O-OG 2.91Å; F177-S179 VanDerWaalsContact C-N 3.28Å; F177-S179 PolarHBondContact O-N 3.09Å
180	E	96.8	Very high	96.5	Very high	62 Å²	62	49 Å²	49	29%	0.29	23%	0.229	S	C	.	.	H	α-helix	trans	-78.8	-36.2	-176.3	-169	72.6	-167.5	0	0	111.8	R63 W176 F177 P182	R63-E180 IonicContact CZ-OE1 3.43Å; R63-E180 IonicContact NH1-OE1 3.2Å; R63-E180 PolarHBondContact NH1-OE1 3.28Å; R63-E180 IonicContact NH2-OE1 3.92Å; R63-E180 PolarHBondContact NH2-OE1 3.38Å; W176-E180 HydrophobicContact CE3-CB 4.48Å; W176-E180 HydrophobicContact CH2-CB 4.17Å; W176-E180 HydrophobicContact CH2-CG 3.86Å; W176-E180 HydrophobicContact CZ2-CB 4.12Å; W176-E180 HydrophobicContact CZ2-CG 3.85Å; W176-E180 HydrophobicContact CZ3-CB 4.33Å; W176-E180 HydrophobicContact CZ3-CG 4.44Å; W176-E180 WeakPolarHBondContact O-CB 3.4Å; W176-E180 PolarHBondContact O-N 2.74Å; F177-E180 PolarHBondContact O-N 2.68Å; E180-P182 VanDerWaalsContact C-CD 3.42Å; E180-P182 WeakPolarHBondContact O-CD 3.34Å
181	F	96.3	Very high	96.6	Very high	21 Å²	21	52 Å²	52	9%	0.092	24%	0.244	C	C	.	.	S	Bend	trans	-125.5	66.8	-178.9	-51.3	-72.7	0	0	0	110.4	P67 V70 W163 W176 F177 R184 T185	P67-F181 HydrophobicContact CG-CD1 3.94Å; P67-F181 HydrophobicContact CG-CE1 4.02Å; P67-F181 HydrophobicContact CG-CG 4.26Å; P67-F181 HydrophobicContact CG-CZ 4.39Å; V70-F181 HydrophobicContact CG2-CB 4.16Å; V70-F181 HydrophobicContact CG2-CD2 4Å; V70-F181 HydrophobicContact CG2-CG 4.09Å; W163-F181 HydrophobicContact CE3-CE2 4.47Å; W163-F181 HydrophobicContact CH2-CZ 4.07Å; W163-F181 HydrophobicContact CZ3-CE1 4.36Å; W163-F181 AromaticContact CZ3-CE2 3.82Å; W163-F181 HydrophobicContact CZ3-CE2 3.82Å; W163-F181 AromaticContact CZ3-CZ 3.57Å; W163-F181 HydrophobicContact CZ3-CZ 3.57Å; W176-F181 HydrophobicContact CH2-CE2 4.26Å; W176-F181 HydrophobicContact CZ3-CE2 4.13Å; F177-F181 HydrophobicContact CD1-CD2 4.05Å; F177-F181 HydrophobicContact CD1-CE2 4.15Å; F177-F181 HydrophobicContact CE1-CE2 4.5Å; F177-F181 PolarHBondContact O-N 3.36Å; F181-R184 HydrophobicContact CB-CB 4.3Å; F181-R184 PolarHBondContact O-N 2.66Å; F181-T185 PolarHBondContact O-N 3.09Å; F181-T185 VanDerWaalsContact O-N 3.09Å; F181-T185 PolarHBondContact O-OG1 3.13Å
182	P	94.9	Very high	96.7	Very high	82 Å²	82	49.1 Å²	49.1	53%	0.532	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	143.6	-178.1	27.5	-35.1	0	0	0	110.3	Q178 E180 R184	Q178-P182 WeakPolarHBondContact O-CA 3.42Å; E180-P182 VanDerWaalsContact C-CD 3.42Å; E180-P182 WeakPolarHBondContact O-CD 3.34Å; P182-R184 PolarHBondContact O-N 3.11Å
183	R	92.9	Very high	96.7	Very high	232 Å²	232	49.8 Å²	49.8	88%	0.875	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	-18.2	-176.9	-52.9	178	177.7	179.9	-1.4	115.9	R186	R183-R186 PolarHBondContact O-NH1 2.78Å; R183-R186 PolarHBondContact O-NH2 3.29Å
184	R	96.8	Very high	96.7	Very high	87 Å²	87	55.7 Å²	55.7	33%	0.328	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-15.6	175.7	-58.2	-174.7	179.9	-161.7	-14.6	113.2	G66 P67 E68 L69 V70 F181 P182	G66-R184 PolarHBondContact O-NH1 3.17Å; P67-R184 WeakPolarHBondContact O-CD 3.24Å; P67-R184 PolarHBondContact O-NH1 3.4Å; E68-R184 VanDerWaalsContact CD-NH2 3.3Å; E68-R184 WeakPolarHBondContact O-CB 3.29Å; E68-R184 IonicContact OE1-CZ 3.39Å; E68-R184 IonicContact OE1-NH1 2.68Å; E68-R184 PolarHBondContact OE1-NH1 2.81Å; E68-R184 IonicContact OE1-NH2 3.19Å; E68-R184 PolarHBondContact OE1-NH2 3.28Å; E68-R184 IonicContact OE2-CZ 2.94Å; E68-R184 IonicContact OE2-NE 2.99Å; E68-R184 IonicContact OE2-NH1 3.5Å; E68-R184 IonicContact OE2-NH2 3.22Å; E68-R184 PolarHBondContact OE2-NH2 3.04Å; L69-R184 WeakPolarHBondContact CA-O 3.48Å; L69-R184 WeakPolarHBondContact CD1-O 3.24Å; V70-R184 PolarHBondContact N-O 3.34Å; F181-R184 HydrophobicContact CB-CB 4.3Å; F181-R184 PolarHBondContact O-N 2.66Å; P182-R184 PolarHBondContact O-N 3.11Å
185	T	98.3	Very high	96.7	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	135.2	176.4	-60.3	0	0	0	0	111.4	V70 V72 F177 Q178 F181	V70-T185 CarbonylContact O-C 3.16Å; V70-T185 WeakPolarHBondContact O-CA 3.48Å; V72-T185 HydrophobicContact CG2-CG2 3.83Å; F177-T185 HydrophobicContact CB-CG2 3.95Å; F177-T185 PolarHBondContact O-OG1 3.16Å; Q178-T185 HydrophobicContact CG-CG2 3.92Å; F181-T185 PolarHBondContact O-N 3.09Å; F181-T185 VanDerWaalsContact O-N 3.09Å; F181-T185 PolarHBondContact O-OG1 3.13Å
186	R	98.4	Very high	96.6	Very high	83 Å²	83	58.3 Å²	58.3	31%	0.313	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.2	170.3	-63.8	-70.4	-178.4	-75.5	-8.3	110	L69 V70 L71 V72 R183 D224 W225	L69-R186 HydrophobicContact CD1-CG 4.1Å; V70-R186 PolarHBondContact O-N 3.32Å; L71-R186 CarbonylContact C-O 3.56Å; L71-R186 WeakPolarHBondContact CA-O 3.38Å; L71-R186 HydrophobicContact CD2-CB 4.17Å; V72-R186 PolarHBondContact N-O 2.94Å; R183-R186 PolarHBondContact O-NH1 2.78Å; R183-R186 PolarHBondContact O-NH2 3.29Å; R186-D224 WeakPolarHBondContact CA-OD2 3.43Å; R186-D224 HydrophobicContact CB-CB 4.27Å; R186-D224 VanDerWaalsContact CD-CG 3.46Å; R186-D224 VanDerWaalsContact CD-OD1 3.26Å; R186-D224 WeakPolarHBondContact CD-OD1 3.34Å; R186-D224 IonicContact NE-OD1 2.94Å; R186-W225 HydrophobicContact CB-CE3 3.94Å; R186-W225 HydrophobicContact CB-CH2 3.99Å; R186-W225 HydrophobicContact CB-CZ3 3.25Å; R186-W225 HydrophobicContact CG-CH2 3.71Å; R186-W225 HydrophobicContact CG-CZ3 3.53Å
187	S	98.3	Very high	96.6	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.4	-176.5	59.9	0	0	0	0	110.6	F223 D224 W225	S187-F223 WeakPolarHBondContact OG-CA 3.44Å; S187-D224 PolarHBondContact N-OD2 3.27Å; S187-D224 WeakPolarHBondContact O-CB 3.49Å; S187-D224 PolarHBondContact O-N 3.2Å; S187-D224 VanDerWaalsContact O-N 3.12Å; S187-D224 PolarHBondContact OG-N 2.92Å; S187-D224 VanDerWaalsContact OG-N 3.12Å; S187-D224 PolarHBondContact OG-OD2 3.29Å; S187-W225 PolarHBondContact O-N 2.87Å; S187-W225 VanDerWaalsContact O-N 3.09Å
188	V	98.4	Very high	96.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.6	-179.2	-171	0	0	0	0	109.6	L71 V72 F73 S74 W225 I227 I243	L71-V188 HydrophobicContact CD2-CG2 4.36Å; V72-V188 PolarHBondContact O-N 3.44Å; F73-V188 WeakPolarHBondContact CA-O 3.34Å; F73-V188 HydrophobicContact CD1-CB 3.84Å; F73-V188 HydrophobicContact CD1-CG1 3.83Å; F73-V188 HydrophobicContact CD2-CB 4.22Å; F73-V188 HydrophobicContact CD2-CG2 4.39Å; F73-V188 HydrophobicContact CE1-CB 3.71Å; F73-V188 HydrophobicContact CE1-CG1 3.35Å; F73-V188 HydrophobicContact CE1-CG2 4.28Å; F73-V188 HydrophobicContact CE2-CB 4.1Å; F73-V188 HydrophobicContact CE2-CG1 4.5Å; F73-V188 HydrophobicContact CE2-CG2 3.95Å; F73-V188 HydrophobicContact CG-CB 4.09Å; F73-V188 HydrophobicContact CZ-CB 3.82Å; F73-V188 HydrophobicContact CZ-CG1 3.72Å; F73-V188 HydrophobicContact CZ-CG2 3.86Å; S74-V188 PolarHBondContact N-O 3.27Å; V188-W225 WeakPolarHBondContact CA-O 3.5Å; V188-W225 HydrophobicContact CG1-CB 4.35Å; V188-W225 HydrophobicContact CG2-CB 4.46Å; V188-W225 HydrophobicContact CG2-CE3 3.9Å; V188-I227 HydrophobicContact CG1-CD1 3.86Å; V188-I227 HydrophobicContact CG1-CG1 4.14Å; V188-I243 HydrophobicContact CG1-CD1 3.88Å; V188-I243 HydrophobicContact CG2-CD1 4.19Å
189	R	97.9	Very high	96.4	Very high	24 Å²	24	62 Å²	62	9%	0.091	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.8	174.2	-176.7	63.3	173.9	-164.1	-7.6	110.7	S74 D218 F223 W225 I226 I227	S74-R189 WeakPolarHBondContact OG-CD 3.4Å; S74-R189 PolarHBondContact OG-NH1 3.36Å; R189-D218 IonicContact CZ-OD1 3.99Å; R189-D218 IonicContact NH2-OD1 3.02Å; R189-D218 PolarHBondContact NH2-OD1 2.74Å; R189-F223 HydrophobicContact CB-CB 4.16Å; R189-F223 HydrophobicContact CB-CD1 3.72Å; R189-F223 HydrophobicContact CB-CD2 3.66Å; R189-F223 HydrophobicContact CB-CE1 3.96Å; R189-F223 HydrophobicContact CB-CE2 3.89Å; R189-F223 HydrophobicContact CB-CG 3.56Å; R189-F223 HydrophobicContact CB-CZ 4.04Å; R189-F223 HydrophobicContact CG-CD2 4.14Å; R189-F223 HydrophobicContact CG-CE2 3.99Å; R189-F223 HydrophobicContact CG-CZ 4.22Å; R189-W225 PolarHBondContact N-O 3Å; R189-I226 HydrophobicContact CB-CG1 4.41Å; R189-I226 CarbonylContact O-C 3.58Å; R189-I226 WeakPolarHBondContact O-CA 3.36Å; R189-I227 PolarHBondContact O-N 2.96Å
190	V	97.8	Very high	96.3	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.2	168.1	-176.1	0	0	0	0	108.9	F73 S74 G75 S79 K81 I84 I227	F73-V190 HydrophobicContact CD1-CG2 4Å; F73-V190 HydrophobicContact CE1-CG2 4.25Å; S74-V190 PolarHBondContact O-N 2.99Å; G75-V190 WeakPolarHBondContact CA-O 3.36Å; S79-V190 WeakPolarHBondContact O-CG1 3.45Å; K81-V190 HydrophobicContact CB-CB 4.19Å; K81-V190 HydrophobicContact CB-CG2 4.25Å; K81-V190 HydrophobicContact CG-CG2 4.32Å; I84-V190 HydrophobicContact CD1-CB 4.36Å; I84-V190 HydrophobicContact CD1-CG1 3.59Å; I84-V190 HydrophobicContact CD1-CG2 3.79Å; V190-I227 WeakPolarHBondContact CA-O 3.38Å; V190-I227 HydrophobicContact CG2-CB 4.41Å; V190-I227 HydrophobicContact CG2-CD1 4.41Å
191	Q	96.2	Very high	96.2	Very high	79 Å²	79	62 Å²	62	37%	0.369	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148.3	-178.1	66.5	179.6	14.4	0	0	112.4	I226 I227 R228 N229	Q191-I226 HydrophobicContact CG-CG2 3.72Å; Q191-I227 PolarHBondContact N-O 3.06Å; Q191-R228 HydrophobicContact CG-CG 4.19Å; Q191-R228 WeakPolarHBondContact O-CA 3.2Å; Q191-N229 PolarHBondContact O-N 3.24Å
192	C	96.1	Very high	96.1	Very high	23 Å²	23	62.3 Å²	62.3	16%	0.155	31%	0.308	C	S	.	.			trans	-156.9	167	165.2	65.4	0	0	0	0	108.3	S79 T196 R197 N229 E230	S79-C192 VanDerWaalsContact CA-SG 3.59Å; C192-T196 HydrophobicContact CB-CG2 4.01Å; C192-R197 WeakPolarHBondContact SG-CG 3.36Å; C192-N229 HydrophobicContact CB-CB 4.4Å; C192-N229 WeakPolarHBondContact CB-O 3.24Å; C192-E230 VanDerWaalsContact C-OE1 3.31Å; C192-E230 WeakPolarHBondContact CA-OE1 3.38Å; C192-E230 HydrophobicContact CB-CG 4.44Å
193	S	95.5	Very high	95.9	Very high	42 Å²	42	62.2 Å²	62.2	29%	0.294	31%	0.31	S	S	.	.			trans	-67.7	158.2	-178.3	64.8	0	0	0	0	110.8	E195 T196 R197 E230	S193-E195 PolarHBondContact O-N 3.38Å; S193-T196 PolarHBondContact O-N 2.92Å; S193-T196 WeakPolarHBondContact OG-CB 3.36Å; S193-T196 PolarHBondContact OG-N 3.41Å; S193-T196 PolarHBondContact OG-OG1 3.33Å; S193-T196 VanDerWaalsContact OG-OG1 3.07Å; S193-R197 VanDerWaalsContact O-CG 3.26Å; S193-R197 WeakPolarHBondContact O-CG 3.07Å; S193-R197 PolarHBondContact O-N 3.31Å; S193-E230 VanDerWaalsContact CB-OE1 3.31Å; S193-E230 WeakPolarHBondContact CB-OE1 3.17Å; S193-E230 PolarHBondContact N-OE1 2.88Å; S193-E230 PolarHBondContact OG-OE1 2.9Å; S193-E230 PolarHBondContact OG-OE2 3.02Å
194	E	94.7	Very high	95.8	Very high	126 Å²	126	56.4 Å²	56.4	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-60.9	-33.9	170.4	-71.7	-167.6	165.9	0	0	111.9	R197 G198 W202	E194-R197 PolarHBondContact O-N 3.42Å; E194-G198 PolarHBondContact O-N 3.09Å; E194-W202 HydrophobicContact CB-CE3 4.46Å; E194-W202 HydrophobicContact CB-CH2 4.19Å; E194-W202 HydrophobicContact CB-CZ3 3.67Å; E194-W202 HydrophobicContact CG-CH2 3.81Å; E194-W202 HydrophobicContact CG-CZ3 3.81Å
195	E	95.9	Very high	95.3	Very high	145 Å²	145	54.9 Å²	54.9	68%	0.678	29%	0.292	S	S	*	.	H	α-helix	trans	-60.6	-52.7	174.1	-175.9	-179.6	177.2	0	0	111.4	S193 R197 G198 Q199	S193-E195 PolarHBondContact O-N 3.38Å; E195-R197 VanDerWaalsContact C-N 3.29Å; E195-R197 PolarHBondContact O-N 3.12Å; E195-G198 CarbonylContact O-C 3.58Å; E195-G198 WeakPolarHBondContact O-CA 3.46Å; E195-G198 PolarHBondContact O-N 3.11Å; E195-Q199 WeakPolarHBondContact O-CG 3.45Å; E195-Q199 PolarHBondContact O-N 3.37Å
196	T	96.1	Very high	94.6	Very high	13 Å²	13	59 Å²	59	8%	0.08	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-37.2	177.4	-66.7	0	0	0	0	112	C192 S193 G198 R200 E230	C192-T196 HydrophobicContact CB-CG2 4.01Å; S193-T196 PolarHBondContact O-N 2.92Å; S193-T196 WeakPolarHBondContact OG-CB 3.36Å; S193-T196 PolarHBondContact OG-N 3.41Å; S193-T196 PolarHBondContact OG-OG1 3.33Å; S193-T196 VanDerWaalsContact OG-OG1 3.07Å; T196-G198 VanDerWaalsContact C-N 3.34Å; T196-R200 VanDerWaalsContact CG2-CZ 3.49Å; T196-R200 WeakPolarHBondContact O-CD 3.32Å; T196-R200 WeakPolarHBondContact O-CG 3.33Å; T196-R200 PolarHBondContact O-N 2.87Å; T196-E230 VanDerWaalsContact CB-OE2 3.31Å; T196-E230 WeakPolarHBondContact CB-OE2 3.36Å; T196-E230 PolarHBondContact OG1-OE2 3.39Å
197	R	95.9	Very high	93.9	Very high	8 Å²	8	57.8 Å²	57.8	3%	0.03	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-42.5	171.7	-66.3	167.4	72	-149.7	-0.3	110.4	R77 K78 C192 S193 E194 E195 Q199 R200 G201 W202 D209	R77-R197 PolarHBondContact O-NE 2.99Å; R77-R197 PolarHBondContact O-NH2 3.25Å; R77-R197 VanDerWaalsContact O-NH2 3.11Å; K78-R197 HydrophobicContact CB-CB 4.3Å; K78-R197 HydrophobicContact CB-CG 4.37Å; C192-R197 WeakPolarHBondContact SG-CG 3.36Å; S193-R197 VanDerWaalsContact O-CG 3.26Å; S193-R197 WeakPolarHBondContact O-CG 3.07Å; S193-R197 PolarHBondContact O-N 3.31Å; E194-R197 PolarHBondContact O-N 3.42Å; E195-R197 VanDerWaalsContact C-N 3.29Å; E195-R197 PolarHBondContact O-N 3.12Å; R197-Q199 PolarHBondContact O-N 3.16Å; R197-R200 CarbonylContact O-C 3.43Å; R197-R200 WeakPolarHBondContact O-CA 3.17Å; R197-R200 WeakPolarHBondContact O-CB 3.18Å; R197-R200 PolarHBondContact O-N 3.39Å; R197-G201 PolarHBondContact O-N 3.45Å; R197-W202 VanDerWaalsContact C-CB 3.4Å; R197-W202 HydrophobicContact CB-CB 3.66Å; R197-W202 HydrophobicContact CB-CD2 3.98Å; R197-W202 HydrophobicContact CB-CE3 3.94Å; R197-W202 HydrophobicContact CB-CG 3.89Å; R197-W202 VanDerWaalsContact CZ-CE2 3.5Å; R197-W202 WeakPolarHBondContact O-CB 3.36Å; R197-W202 PolarHBondContact O-N 2.99Å; R197-D209 IonicContact NH2-OD1 3.97Å; R197-D209 PolarHBondContact NH2-OD1 3.31Å
198	G	95.6	Very high	93.1	Very high	33 Å²	33	59.4 Å²	59.4	34%	0.34	34%	0.341	S	S	.	.	H	α-helix	trans	-58.5	-44.8	178.5	0	0	0	0	0	112.5	E194 E195 T196 R200 G201 W202	E194-G198 PolarHBondContact O-N 3.09Å; E195-G198 CarbonylContact O-C 3.58Å; E195-G198 WeakPolarHBondContact O-CA 3.46Å; E195-G198 PolarHBondContact O-N 3.11Å; T196-G198 VanDerWaalsContact C-N 3.34Å; G198-R200 PolarHBondContact O-N 3.46Å; G198-R200 VanDerWaalsContact O-N 3.11Å; G198-G201 PolarHBondContact O-N 2.7Å; G198-W202 WeakPolarHBondContact CA-O 3.35Å
199	Q	95.5	Very high	92.4	Very high	145 Å²	145	59.8 Å²	59.8	68%	0.678	34%	0.344	S	S	*	.	H	α-helix	trans	-58.6	-24	172.7	-66.5	173.3	4.5	0	0	112.8	E195 R197 G201	E195-Q199 WeakPolarHBondContact O-CG 3.45Å; E195-Q199 PolarHBondContact O-N 3.37Å; R197-Q199 PolarHBondContact O-N 3.16Å; Q199-G201 VanDerWaalsContact C-N 3.32Å
200	R	94.8	Very high	91.8	Very high	86 Å²	86	62.8 Å²	62.8	33%	0.325	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	17.7	176.3	-59.5	165.9	-174.3	177.1	0.5	113.1	K78 S79 T196 R197 G198 N229	K78-R200 HydrophobicContact CB-CB 4.37Å; K78-R200 WeakPolarHBondContact O-CD 3.32Å; K78-R200 PolarHBondContact O-NH1 3.23Å; S79-R200 PolarHBondContact O-NH1 3.41Å; T196-R200 VanDerWaalsContact CG2-CZ 3.49Å; T196-R200 WeakPolarHBondContact O-CD 3.32Å; T196-R200 WeakPolarHBondContact O-CG 3.33Å; T196-R200 PolarHBondContact O-N 2.87Å; R197-R200 CarbonylContact O-C 3.43Å; R197-R200 WeakPolarHBondContact O-CA 3.17Å; R197-R200 WeakPolarHBondContact O-CB 3.18Å; R197-R200 PolarHBondContact O-N 3.39Å; G198-R200 PolarHBondContact O-N 3.46Å; G198-R200 VanDerWaalsContact O-N 3.11Å; R200-N229 PolarHBondContact NH1-ND2 3.34Å; R200-N229 VanDerWaalsContact NH2-CG 3.28Å; R200-N229 PolarHBondContact NH2-ND2 3.41Å; R200-N229 PolarHBondContact NH2-O 3.07Å; R200-N229 PolarHBondContact NH2-OD1 3.42Å
201	G	93.9	Very high	91.2	Very high	60 Å²	60	64 Å²	64	62%	0.619	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	26.4	179.9	0	0	0	0	0	113.7	R197 G198 Q199	R197-G201 PolarHBondContact O-N 3.45Å; G198-G201 PolarHBondContact O-N 2.7Å; Q199-G201 VanDerWaalsContact C-N 3.32Å
202	W	94.2	Very high	90.6	Very high	27 Å²	27	65.9 Å²	65.9	10%	0.102	38%	0.381	C	S	.	.			trans	-79.2	138.2	166.3	178.8	71.9	0	0	0	110.2	K78 E194 R197 G198 F204 D209	K78-W202 HydrophobicContact CB-CB 4.23Å; K78-W202 HydrophobicContact CG-CB 4Å; E194-W202 HydrophobicContact CB-CE3 4.46Å; E194-W202 HydrophobicContact CB-CH2 4.19Å; E194-W202 HydrophobicContact CB-CZ3 3.67Å; E194-W202 HydrophobicContact CG-CH2 3.81Å; E194-W202 HydrophobicContact CG-CZ3 3.81Å; R197-W202 VanDerWaalsContact C-CB 3.4Å; R197-W202 HydrophobicContact CB-CB 3.66Å; R197-W202 HydrophobicContact CB-CD2 3.98Å; R197-W202 HydrophobicContact CB-CE3 3.94Å; R197-W202 HydrophobicContact CB-CG 3.89Å; R197-W202 VanDerWaalsContact CZ-CE2 3.5Å; R197-W202 WeakPolarHBondContact O-CB 3.36Å; R197-W202 PolarHBondContact O-N 2.99Å; G198-W202 WeakPolarHBondContact CA-O 3.35Å; W202-F204 HydrophobicContact CH2-CB 4.03Å; W202-F204 HydrophobicContact CH2-CD2 4.49Å; W202-F204 HydrophobicContact CZ2-CB 4Å; W202-F204 HydrophobicContact CZ2-CD2 4.16Å; W202-D209 HydrophobicContact CZ2-CB 4.39Å; W202-D209 VanDerWaalsContact NE1-CG 3.3Å; W202-D209 PolarHBondContact NE1-OD1 3.14Å; W202-D209 PolarHBondContact NE1-OD2 3.11Å
203	S	90.6	Very high	89.9	Confident	81 Å²	81	65.1 Å²	65.1	57%	0.566	38%	0.376	S	S	*	.			trans	-135.7	140.9	164.2	55.8	0	0	0	0	107.6	T205	S203-T205 PolarHBondContact O-N 3.47Å; S203-T205 PolarHBondContact O-OG1 2.91Å
204	F	90.6	Very high	89.5	Confident	110 Å²	110	63.8 Å²	63.8	48%	0.482	37%	0.365	S	S	.	.			trans	-58.9	125.8	179	179.7	-97.8	0	0	0	110.3	W202 P206 D209 D210	W202-F204 HydrophobicContact CH2-CB 4.03Å; W202-F204 HydrophobicContact CH2-CD2 4.49Å; W202-F204 HydrophobicContact CZ2-CB 4Å; W202-F204 HydrophobicContact CZ2-CD2 4.16Å; F204-P206 HydrophobicContact CD1-CG 4.21Å; F204-P206 HydrophobicContact CE1-CB 4.22Å; F204-P206 HydrophobicContact CE1-CG 3.78Å; F204-D209 HydrophobicContact CD2-CB 3.71Å; F204-D209 HydrophobicContact CE2-CB 3.8Å; F204-D210 HydrophobicContact CE2-CB 4.21Å; F204-D210 HydrophobicContact CZ-CB 4.01Å
205	T	86.5	Confident	89.2	Confident	54 Å²	54	59.6 Å²	59.6	33%	0.331	35%	0.349	S	S	.	.			trans	-118.2	110.3	175.8	-54.3	0	0	0	0	109.2	S203 V208 D209	S203-T205 PolarHBondContact O-N 3.47Å; S203-T205 PolarHBondContact O-OG1 2.91Å; T205-V208 HydrophobicContact CG2-CB 4.12Å; T205-V208 HydrophobicContact CG2-CG2 3.81Å; T205-V208 PolarHBondContact O-N 3.49Å; T205-D209 PolarHBondContact N-OD2 3.44Å; T205-D209 PolarHBondContact O-N 2.97Å
206	P	84.6	Confident	88.8	Confident	98 Å²	98	53.7 Å²	53.7	64%	0.636	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	140.4	175.3	-19.6	27.8	0	0	0	111.7	F204 V208	F204-P206 HydrophobicContact CD1-CG 4.21Å; F204-P206 HydrophobicContact CE1-CB 4.22Å; F204-P206 HydrophobicContact CE1-CG 3.78Å; P206-V208 PolarHBondContact O-N 2.92Å
207	G	82.4	Confident	88.6	Confident	57 Å²	57	53.3 Å²	53.3	59%	0.588	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-2.2	-174.3	0	0	0	0	0	114.9	D210	G207-D210 WeakPolarHBondContact CA-OD1 3.46Å; G207-D210 PolarHBondContact N-OD1 3.37Å; G207-D210 PolarHBondContact N-OD2 2.95Å
208	V	82.9	Confident	88.3	Confident	35 Å²	35	56.2 Å²	56.2	21%	0.212	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-59.6	175.7	-179.7	0	0	0	0	110.4	T205 P206 D210 A211 E214	T205-V208 HydrophobicContact CG2-CB 4.12Å; T205-V208 HydrophobicContact CG2-CG2 3.81Å; T205-V208 PolarHBondContact O-N 3.49Å; P206-V208 PolarHBondContact O-N 2.92Å; V208-D210 PolarHBondContact N-OD1 3.33Å; V208-A211 PolarHBondContact O-N 3.24Å; V208-E214 WeakPolarHBondContact O-CG 3.46Å
209	D	83.8	Confident	87.9	Confident	9 Å²	9	65.4 Å²	65.4	5%	0.048	37%	0.365	C	S	.	.	S	Bend	trans	-80.7	-16.7	-173.9	-71.3	-74.5	0	0	0	113.5	R197 W202 F204 T205 C215	R197-D209 IonicContact NH2-OD1 3.97Å; R197-D209 PolarHBondContact NH2-OD1 3.31Å; W202-D209 HydrophobicContact CZ2-CB 4.39Å; W202-D209 VanDerWaalsContact NE1-CG 3.3Å; W202-D209 PolarHBondContact NE1-OD1 3.14Å; W202-D209 PolarHBondContact NE1-OD2 3.11Å; F204-D209 HydrophobicContact CD2-CB 3.71Å; F204-D209 HydrophobicContact CE2-CB 3.8Å; T205-D209 PolarHBondContact N-OD2 3.44Å; T205-D209 PolarHBondContact O-N 2.97Å; D209-C215 PolarHBondContact O-SG 3.04Å
210	D	85.2	Confident	87.5	Confident	86 Å²	86	61.8 Å²	61.8	46%	0.46	37%	0.367	S	S	.	.	S	Bend	trans	-102.4	-4.6	173.6	57.1	-1.2	0	0	0	113	F204 G207 V208	F204-D210 HydrophobicContact CE2-CB 4.21Å; F204-D210 HydrophobicContact CZ-CB 4.01Å; G207-D210 WeakPolarHBondContact CA-OD1 3.46Å; G207-D210 PolarHBondContact N-OD1 3.37Å; G207-D210 PolarHBondContact N-OD2 2.95Å; V208-D210 PolarHBondContact N-OD1 3.33Å
211	A	84.3	Confident	87.4	Confident	28 Å²	28	59.2 Å²	59.2	23%	0.231	36%	0.36	C	S	.	.	S	Bend	trans	-73.2	153.9	177.7	0	0	0	0	0	111.8	V208 S213 E214 C215	V208-A211 PolarHBondContact O-N 3.24Å; A211-S213 PolarHBondContact O-N 3.07Å; A211-E214 PolarHBondContact O-N 3.35Å; A211-C215 PolarHBondContact O-N 3.31Å
212	E	83.9	Confident	87.3	Confident	118 Å²	118	65.2 Å²	65.2	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-52.2	-34.5	176.3	-177.4	175.9	-159.5	0	0	112.5	E214 C215 G216	E212-E214 PolarHBondContact O-N 2.99Å; E212-E214 VanDerWaalsContact O-N 3.09Å; E212-C215 PolarHBondContact O-N 3.41Å; E212-G216 WeakPolarHBondContact O-CA 3.44Å; E212-G216 PolarHBondContact O-N 3Å
213	S	81	Confident	87.5	Confident	7 Å²	7	65.8 Å²	65.8	5%	0.049	38%	0.376	C	S	.	.	H	α-helix	trans	-61.2	-20.1	178.2	74.9	0	0	0	0	114.7	R169 A211	R169-S213 WeakPolarHBondContact CD-O 3.35Å; R169-S213 VanDerWaalsContact CG-O 3.29Å; R169-S213 WeakPolarHBondContact CG-O 3.19Å; R169-S213 PolarHBondContact NH1-O 3.46Å; A211-S213 PolarHBondContact O-N 3.07Å
214	E	87.1	Confident	87.8	Confident	13 Å²	13	65.7 Å²	65.7	6%	0.061	37%	0.369	C	S	.	.	H	α-helix	trans	-111.3	-21.5	175.4	-70.1	-67.1	139.7	0	0	113.1	K76 R77 R169 V208 A211 E212	K76-E214 PolarHBondContact NZ-O 2.85Å; R77-E214 PolarHBondContact N-OE2 3.2Å; R169-E214 IonicContact CZ-OE1 3.85Å; R169-E214 IonicContact NH1-OE1 3.74Å; R169-E214 PolarHBondContact NH1-OE1 2.99Å; R169-E214 IonicContact NH2-OE1 2.63Å; V208-E214 WeakPolarHBondContact O-CG 3.46Å; A211-E214 PolarHBondContact O-N 3.35Å; E212-E214 PolarHBondContact O-N 2.99Å; E212-E214 VanDerWaalsContact O-N 3.09Å
215	C	88.2	Confident	88.2	Confident	38 Å²	38	63.3 Å²	63.3	26%	0.257	36%	0.357	S	S	.	.	H	α-helix	trans	-111.4	-7.7	-174.4	-61.8	0	0	0	0	114.8	K76 D209 A211 E212 L217 D218	K76-C215 PolarHBondContact NZ-SG 3.25Å; D209-C215 PolarHBondContact O-SG 3.04Å; A211-C215 PolarHBondContact O-N 3.31Å; E212-C215 PolarHBondContact O-N 3.41Å; C215-L217 PolarHBondContact O-N 2.97Å; C215-D218 WeakPolarHBondContact CA-OD2 3.5Å; C215-D218 WeakPolarHBondContact O-CB 3.39Å; C215-D218 PolarHBondContact O-N 2.67Å
216	G	87.4	Confident	88.7	Confident	22 Å²	22	64.9 Å²	64.9	23%	0.227	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-3.1	-171.2	0	0	0	0	0	116	R169 E212	R169-G216 CarbonylContact O-C 3.58Å; E212-G216 WeakPolarHBondContact O-CA 3.44Å; E212-G216 PolarHBondContact O-N 3Å
217	L	92	Very high	89.4	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.026	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	19.8	177.3	-68.2	173.1	0	0	0	112.2	Q171 C215 V221 F223	Q171-L217 HydrophobicContact CB-CD2 4.42Å; C215-L217 PolarHBondContact O-N 2.97Å; L217-V221 HydrophobicContact CD2-CG2 3.84Å; L217-F223 HydrophobicContact CB-CZ 4.27Å
218	D	89.4	Confident	90.1	Very high	68 Å²	68	62.1 Å²	62.1	36%	0.364	32%	0.321	S	S	.	.	S	Bend	trans	-81.6	-20	178.7	-70.9	-5.7	0	0	0	113.1	K76 R189 C215	K76-D218 WeakPolarHBondContact CE-OD1 3.28Å; K76-D218 WeakPolarHBondContact CE-OD2 3.4Å; K76-D218 IonicContact NZ-OD1 3.4Å; K76-D218 PolarHBondContact NZ-OD1 3.3Å; K76-D218 IonicContact NZ-OD2 2.87Å; K76-D218 PolarHBondContact NZ-OD2 2.9Å; R189-D218 IonicContact CZ-OD1 3.99Å; R189-D218 IonicContact NH2-OD1 3.02Å; R189-D218 PolarHBondContact NH2-OD1 2.74Å; C215-D218 WeakPolarHBondContact CA-OD2 3.5Å; C215-D218 WeakPolarHBondContact O-CB 3.39Å; C215-D218 PolarHBondContact O-N 2.67Å
219	R	88.5	Confident	90.8	Very high	227 Å²	227	62.5 Å²	62.5	86%	0.857	32%	0.322	S	S	*	.	S	Bend	trans	-141	156	-176.6	-58.7	-176.5	-174.2	-172.2	1.6	110.5	V221	R219-V221 VanDerWaalsContact C-N 3.27Å; R219-V221 PolarHBondContact O-N 2.8Å
220	G	86.8	Confident	91.4	Very high	69 Å²	69	64 Å²	64	71%	0.711	33%	0.329	S	S	*	.	S	Bend	trans	70	21.6	172.9	0	0	0	0	0	114.5	Q171	Q171-G220 PolarHBondContact NE2-O 3.04Å; Q171-G220 VanDerWaalsContact NE2-O 3.1Å
221	V	91.4	Very high	91.7	Very high	31 Å²	31	65 Å²	65	19%	0.188	35%	0.35	C	S	.	.			trans	-134.2	123.6	176.9	-176.9	0	0	0	0	108.8	Q171 L174 L217 R219 F223	Q171-V221 HydrophobicContact CG-CG2 4.35Å; L174-V221 HydrophobicContact CD2-CG1 3.51Å; L217-V221 HydrophobicContact CD2-CG2 3.84Å; R219-V221 VanDerWaalsContact C-N 3.27Å; R219-V221 PolarHBondContact O-N 2.8Å; V221-F223 HydrophobicContact CB-CE2 3.99Å; V221-F223 HydrophobicContact CB-CZ 3.97Å; V221-F223 HydrophobicContact CG1-CD1 4.01Å; V221-F223 HydrophobicContact CG1-CD2 4.19Å; V221-F223 HydrophobicContact CG1-CE1 3.68Å; V221-F223 HydrophobicContact CG1-CE2 3.88Å; V221-F223 HydrophobicContact CG1-CG 4.25Å; V221-F223 HydrophobicContact CG1-CZ 3.61Å
222	E	93.6	Very high	92.1	Very high	187 Å²	187	69.1 Å²	69.1	87%	0.874	37%	0.368	S	S	*	.			trans	-92.2	120.3	165.8	-64.5	-171.4	149.9	0	0	107.7
223	F	97	Very high	92.7	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.171	35%	0.349	C	S	.	.			trans	-91.7	137.2	-179.1	-66.3	-82.4	0	0	0	110.5	S74 S187 R189 L217 V221 W225 I226	S74-F223 WeakPolarHBondContact OG-CE1 3.47Å; S187-F223 WeakPolarHBondContact OG-CA 3.44Å; R189-F223 HydrophobicContact CB-CB 4.16Å; R189-F223 HydrophobicContact CB-CD1 3.72Å; R189-F223 HydrophobicContact CB-CD2 3.66Å; R189-F223 HydrophobicContact CB-CE1 3.96Å; R189-F223 HydrophobicContact CB-CE2 3.89Å; R189-F223 HydrophobicContact CB-CG 3.56Å; R189-F223 HydrophobicContact CB-CZ 4.04Å; R189-F223 HydrophobicContact CG-CD2 4.14Å; R189-F223 HydrophobicContact CG-CE2 3.99Å; R189-F223 HydrophobicContact CG-CZ 4.22Å; L217-F223 HydrophobicContact CB-CZ 4.27Å; V221-F223 HydrophobicContact CB-CE2 3.99Å; V221-F223 HydrophobicContact CB-CZ 3.97Å; V221-F223 HydrophobicContact CG1-CD1 4.01Å; V221-F223 HydrophobicContact CG1-CD2 4.19Å; V221-F223 HydrophobicContact CG1-CE1 3.68Å; V221-F223 HydrophobicContact CG1-CE2 3.88Å; V221-F223 HydrophobicContact CG1-CG 4.25Å; V221-F223 HydrophobicContact CG1-CZ 3.61Å; F223-W225 VanDerWaalsContact C-N 3.27Å; F223-W225 PolarHBondContact O-N 2.85Å; F223-I226 HydrophobicContact CB-CG1 4.08Å
224	D	98.1	Very high	93.4	Very high	78 Å²	78	67.1 Å²	67.1	42%	0.417	37%	0.366	S	S	.	.	S	Bend	trans	-63.3	-38	175.6	-60.1	-90.4	0	0	0	111	R186 S187	R186-D224 WeakPolarHBondContact CA-OD2 3.43Å; R186-D224 HydrophobicContact CB-CB 4.27Å; R186-D224 VanDerWaalsContact CD-CG 3.46Å; R186-D224 VanDerWaalsContact CD-OD1 3.26Å; R186-D224 WeakPolarHBondContact CD-OD1 3.34Å; R186-D224 IonicContact NE-OD1 2.94Å; S187-D224 PolarHBondContact N-OD2 3.27Å; S187-D224 WeakPolarHBondContact O-CB 3.49Å; S187-D224 PolarHBondContact O-N 3.2Å; S187-D224 VanDerWaalsContact O-N 3.12Å; S187-D224 PolarHBondContact OG-N 2.92Å; S187-D224 VanDerWaalsContact OG-N 3.12Å; S187-D224 PolarHBondContact OG-OD2 3.29Å
225	W	98.3	Very high	93.8	Very high	61 Å²	61	69.7 Å²	69.7	23%	0.231	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.4	174.1	-62	-69.9	0	0	0	112.3	L71 R186 S187 V188 R189 F223 I243 A246	L71-W225 HydrophobicContact CD2-CE3 4.49Å; L71-W225 HydrophobicContact CD2-CZ3 3.79Å; R186-W225 HydrophobicContact CB-CE3 3.94Å; R186-W225 HydrophobicContact CB-CH2 3.99Å; R186-W225 HydrophobicContact CB-CZ3 3.25Å; R186-W225 HydrophobicContact CG-CH2 3.71Å; R186-W225 HydrophobicContact CG-CZ3 3.53Å; S187-W225 PolarHBondContact O-N 2.87Å; S187-W225 VanDerWaalsContact O-N 3.09Å; V188-W225 WeakPolarHBondContact CA-O 3.5Å; V188-W225 HydrophobicContact CG1-CB 4.35Å; V188-W225 HydrophobicContact CG2-CB 4.46Å; V188-W225 HydrophobicContact CG2-CE3 3.9Å; R189-W225 PolarHBondContact N-O 3Å; F223-W225 VanDerWaalsContact C-N 3.27Å; F223-W225 PolarHBondContact O-N 2.85Å; W225-I243 HydrophobicContact CB-CD1 4.13Å; W225-I243 HydrophobicContact CB-CG1 4.32Å; W225-I243 HydrophobicContact CD2-CG1 3.85Å; W225-I243 HydrophobicContact CE3-CG1 4.03Å; W225-I243 HydrophobicContact CG-CD1 4.33Å; W225-I243 HydrophobicContact CG-CG1 3.98Å; W225-A246 HydrophobicContact CH2-CB 4.09Å; W225-A246 HydrophobicContact CZ2-CB 4.5Å
226	I	97.9	Very high	94.1	Very high	87 Å²	87	70 Å²	70	45%	0.446	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.7	173.5	-59.2	178.7	0	0	0	108.4	R189 Q191 F223	R189-I226 HydrophobicContact CB-CG1 4.41Å; R189-I226 CarbonylContact O-C 3.58Å; R189-I226 WeakPolarHBondContact O-CA 3.36Å; Q191-I226 HydrophobicContact CG-CG2 3.72Å; F223-I226 HydrophobicContact CB-CG1 4.08Å
227	I	98.3	Very high	94.5	Very high	1 Å²	1	73 Å²	73	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.8	172.7	-57.3	172.3	0	0	0	108.2	F73 I84 V188 R189 V190 Q191 L236 Q239 L240 I243	F73-I227 HydrophobicContact CE1-CD1 4.18Å; I84-I227 HydrophobicContact CD1-CD1 4.36Å; I84-I227 HydrophobicContact CD1-CG2 3.86Å; I84-I227 HydrophobicContact CG2-CD1 3.84Å; V188-I227 HydrophobicContact CG1-CD1 3.86Å; V188-I227 HydrophobicContact CG1-CG1 4.14Å; R189-I227 PolarHBondContact O-N 2.96Å; V190-I227 WeakPolarHBondContact CA-O 3.38Å; V190-I227 HydrophobicContact CG2-CB 4.41Å; V190-I227 HydrophobicContact CG2-CD1 4.41Å; Q191-I227 PolarHBondContact N-O 3.06Å; I227-L236 HydrophobicContact CG2-CD1 3.8Å; I227-Q239 HydrophobicContact CG2-CB 4.44Å; I227-L240 HydrophobicContact CD1-CD2 3.71Å; I227-I243 HydrophobicContact CD1-CD1 3.81Å; I227-I243 HydrophobicContact CG1-CD1 4.21Å
228	R	97.9	Very high	94.8	Very high	96 Å²	96	78.9 Å²	78.9	36%	0.362	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	109.7	172.5	-68.7	-175.7	65.4	-148.7	-8.2	109.1	Q191 E230 D232 A233 Q239	Q191-R228 HydrophobicContact CG-CG 4.19Å; Q191-R228 WeakPolarHBondContact O-CA 3.2Å; R228-E230 PolarHBondContact O-N 3.01Å; R228-D232 IonicContact CZ-OD2 3.61Å; R228-D232 IonicContact NH2-OD1 3.56Å; R228-D232 PolarHBondContact NH2-OD1 3.43Å; R228-D232 IonicContact NH2-OD2 2.78Å; R228-D232 PolarHBondContact NH2-OD2 3.35Å; R228-A233 HydrophobicContact CB-CB 3.76Å; R228-A233 WeakPolarHBondContact O-CB 3.48Å; R228-Q239 PolarHBondContact O-NE2 3.11Å; R228-Q239 PolarHBondContact O-OE1 2.85Å
229	N	96.3	Very high	95.2	Very high	42 Å²	42	77.2 Å²	77.2	23%	0.225	41%	0.412	C	S	.	.			trans	-96.2	67.6	176.4	-172.5	1.9	0	0	0	110.5	S79 Q191 C192 R200	S79-N229 WeakPolarHBondContact O-CB 3.48Å; S79-N229 PolarHBondContact O-ND2 2.79Å; Q191-N229 PolarHBondContact O-N 3.24Å; C192-N229 HydrophobicContact CB-CB 4.4Å; C192-N229 WeakPolarHBondContact CB-O 3.24Å; R200-N229 PolarHBondContact NH1-ND2 3.34Å; R200-N229 VanDerWaalsContact NH2-CG 3.28Å; R200-N229 PolarHBondContact NH2-ND2 3.41Å; R200-N229 PolarHBondContact NH2-O 3.07Å; R200-N229 PolarHBondContact NH2-OD1 3.42Å
230	E	95.9	Very high	95.6	Very high	40 Å²	40	66.4 Å²	66.4	19%	0.187	37%	0.372	C	S	.	.	S	Bend	trans	-123.9	161.6	-177.9	-58.7	-74.8	-165.5	0	0	111	C192 S193 T196 R228 D232 A233	C192-E230 VanDerWaalsContact C-OE1 3.31Å; C192-E230 WeakPolarHBondContact CA-OE1 3.38Å; C192-E230 HydrophobicContact CB-CG 4.44Å; S193-E230 VanDerWaalsContact CB-OE1 3.31Å; S193-E230 WeakPolarHBondContact CB-OE1 3.17Å; S193-E230 PolarHBondContact N-OE1 2.88Å; S193-E230 PolarHBondContact OG-OE1 2.9Å; S193-E230 PolarHBondContact OG-OE2 3.02Å; T196-E230 VanDerWaalsContact CB-OE2 3.31Å; T196-E230 WeakPolarHBondContact CB-OE2 3.36Å; T196-E230 PolarHBondContact OG1-OE2 3.39Å; R228-E230 PolarHBondContact O-N 3.01Å; E230-D232 VanDerWaalsContact C-N 3.32Å; E230-D232 WeakPolarHBondContact CB-OD1 3.35Å; E230-D232 PolarHBondContact O-N 3.29Å; E230-A233 HydrophobicContact CB-CB 4.03Å; E230-A233 PolarHBondContact O-N 3.11Å
231	A	92	Very high	96.1	Very high	109 Å²	109	68 Å²	68	90%	0.901	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-31.2	176	0	0	0	0	0	113.2
232	D	93.7	Very high	96.4	Very high	114 Å²	114	69.2 Å²	69.2	61%	0.61	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.4	179.2	71.9	-47.2	0	0	0	113.4	R228 E230	R228-D232 IonicContact CZ-OD2 3.61Å; R228-D232 IonicContact NH2-OD1 3.56Å; R228-D232 PolarHBondContact NH2-OD1 3.43Å; R228-D232 IonicContact NH2-OD2 2.78Å; R228-D232 PolarHBondContact NH2-OD2 3.35Å; E230-D232 VanDerWaalsContact C-N 3.32Å; E230-D232 WeakPolarHBondContact CB-OD1 3.35Å; E230-D232 PolarHBondContact O-N 3.29Å
233	A	95.6	Very high	96.7	Very high	19 Å²	19	60.4 Å²	60.4	16%	0.157	33%	0.328	C	S	.	.	S	Bend	trans	-77.6	158.8	-178.9	0	0	0	0	0	111.6	R228 E230	R228-A233 HydrophobicContact CB-CB 3.76Å; R228-A233 WeakPolarHBondContact O-CB 3.48Å; E230-A233 HydrophobicContact CB-CB 4.03Å; E230-A233 PolarHBondContact O-N 3.11Å
234	P	95.9	Very high	96.7	Very high	63 Å²	63	59 Å²	59	41%	0.409	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-52.5	155.1	165.6	-23.4	33.8	0	0	0	111.2	Q239	P234-Q239 HydrophobicContact CB-CG 4.12Å; P234-Q239 PolarHBondContact O-NE2 3.1Å
235	S	95.8	Very high	96.7	Very high	67 Å²	67	62.3 Å²	62.3	47%	0.469	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-56	147.4	-179.9	72	0	0	0	0	111.2	D237 Q238 Q239	S235-D237 PolarHBondContact O-N 3.39Å; S235-Q238 WeakPolarHBondContact O-CB 3.48Å; S235-Q238 PolarHBondContact O-N 3.02Å; S235-Q238 WeakPolarHBondContact OG-CB 3.22Å; S235-Q238 PolarHBondContact OG-N 3.4Å; S235-Q239 PolarHBondContact O-N 3.3Å; S235-Q239 VanDerWaalsContact O-N 3.07Å
236	L	94.7	Very high	96.7	Very high	46 Å²	46	60.4 Å²	60.4	24%	0.241	33%	0.326	C	S	.	.	H	α-helix	trans	-57	-38.2	179.3	179.9	60	0	0	0	111.2	Y83 I84 M87 I227 Q238 Q239 L240	Y83-L236 HydrophobicContact CD1-CD2 4.29Å; Y83-L236 HydrophobicContact CE1-CD2 3.83Å; I84-L236 HydrophobicContact CD1-CD1 4.08Å; I84-L236 HydrophobicContact CG1-CD1 3.99Å; I84-L236 HydrophobicContact CG1-CD2 4.18Å; M87-L236 HydrophobicContact CE-CD2 3.87Å; M87-L236 HydrophobicContact SD-CD2 3.97Å; I227-L236 HydrophobicContact CG2-CD1 3.8Å; L236-Q238 PolarHBondContact O-N 2.79Å; L236-Q239 PolarHBondContact O-N 2.82Å; L236-L240 HydrophobicContact CD1-CD1 4.03Å; L236-L240 HydrophobicContact CD1-CD2 4.37Å; L236-L240 HydrophobicContact CD1-CG 3.87Å; L236-L240 HydrophobicContact CD2-CD1 4.32Å; L236-L240 HydrophobicContact CG-CD1 3.8Å; L236-L240 HydrophobicContact CG-CG 4.09Å; L236-L240 WeakPolarHBondContact O-CB 3.43Å; L236-L240 VanDerWaalsContact O-CG 3.28Å; L236-L240 WeakPolarHBondContact O-CG 3.17Å; L236-L240 PolarHBondContact O-N 3.28Å
237	D	95.6	Very high	96.8	Very high	84 Å²	84	56.3 Å²	56.3	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-56.9	-46.6	174.8	-77.1	-41.6	0	0	0	113	R91 S235 Q239 L240 Q241	R91-D237 IonicContact CZ-OD1 3.54Å; R91-D237 IonicContact NH1-OD1 3.24Å; R91-D237 PolarHBondContact NH1-OD1 2.95Å; R91-D237 IonicContact NH2-OD1 2.89Å; R91-D237 PolarHBondContact NH2-OD1 2.88Å; S235-D237 PolarHBondContact O-N 3.39Å; D237-Q239 VanDerWaalsContact C-N 3.3Å; D237-Q239 PolarHBondContact O-N 3.07Å; D237-L240 PolarHBondContact O-N 3.26Å; D237-Q241 WeakPolarHBondContact O-CG 3.46Å; D237-Q241 PolarHBondContact O-N 2.63Å
238	Q	97.3	Very high	96.7	Very high	129 Å²	129	61.6 Å²	61.6	60%	0.603	33%	0.33	S	S	*	.	H	α-helix	trans	-63.5	-39.5	178.3	-176.1	179.9	-7.5	0	0	111.3	S235 L236	S235-Q238 WeakPolarHBondContact O-CB 3.48Å; S235-Q238 PolarHBondContact O-N 3.02Å; S235-Q238 WeakPolarHBondContact OG-CB 3.22Å; S235-Q238 PolarHBondContact OG-N 3.4Å; L236-Q238 PolarHBondContact O-N 2.79Å
239	Q	98	Very high	96.7	Very high	32 Å²	32	62.8 Å²	62.8	15%	0.15	34%	0.339	C	S	.	.	H	α-helix	trans	-70.9	-31.8	177.9	-63.5	-174.2	70.5	0	0	112.6	I227 R228 P234 S235 L236 D237 P242	I227-Q239 HydrophobicContact CG2-CB 4.44Å; R228-Q239 PolarHBondContact O-NE2 3.11Å; R228-Q239 PolarHBondContact O-OE1 2.85Å; P234-Q239 HydrophobicContact CB-CG 4.12Å; P234-Q239 PolarHBondContact O-NE2 3.1Å; S235-Q239 PolarHBondContact O-N 3.3Å; S235-Q239 VanDerWaalsContact O-N 3.07Å; L236-Q239 PolarHBondContact O-N 2.82Å; D237-Q239 VanDerWaalsContact C-N 3.3Å; D237-Q239 PolarHBondContact O-N 3.07Å; Q239-P242 WeakPolarHBondContact O-CD 3.46Å; Q239-P242 WeakPolarHBondContact O-CG 3.34Å
240	L	97.3	Very high	96.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-81.3	-25.7	179.8	-72.4	-179.1	0	0	0	113.9	I84 M87 I88 I227 L236 D237 I243 L244	I84-L240 HydrophobicContact CG2-CD2 3.86Å; M87-L240 HydrophobicContact CG-CD1 4.31Å; M87-L240 HydrophobicContact SD-CD1 3.46Å; M87-L240 WeakPolarHBondContact SD-CD1 3.21Å; I88-L240 HydrophobicContact CD1-CD2 4.11Å; I88-L240 HydrophobicContact CG1-CD2 4.25Å; I227-L240 HydrophobicContact CD1-CD2 3.71Å; L236-L240 HydrophobicContact CD1-CD1 4.03Å; L236-L240 HydrophobicContact CD1-CD2 4.37Å; L236-L240 HydrophobicContact CD1-CG 3.87Å; L236-L240 HydrophobicContact CD2-CD1 4.32Å; L236-L240 HydrophobicContact CG-CD1 3.8Å; L236-L240 HydrophobicContact CG-CG 4.09Å; L236-L240 WeakPolarHBondContact O-CB 3.43Å; L236-L240 VanDerWaalsContact O-CG 3.28Å; L236-L240 WeakPolarHBondContact O-CG 3.17Å; L236-L240 PolarHBondContact O-N 3.28Å; D237-L240 PolarHBondContact O-N 3.26Å; L240-I243 HydrophobicContact CD2-CD1 4.41Å; L240-I243 PolarHBondContact O-N 2.87Å; L240-L244 HydrophobicContact CB-CD1 4.01Å; L240-L244 HydrophobicContact CB-CG 4.34Å; L240-L244 WeakPolarHBondContact O-CG 3.48Å; L240-L244 PolarHBondContact O-N 3.49Å
241	Q	97.9	Very high	96.7	Very high	103 Å²	103	59.9 Å²	59.9	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-44.8	-52.2	179.1	-89	-69.4	-22.5	0	0	114.8	D237 I243 L244 R245	D237-Q241 WeakPolarHBondContact O-CG 3.46Å; D237-Q241 PolarHBondContact O-N 2.63Å; Q241-I243 VanDerWaalsContact C-N 3.32Å; Q241-I243 PolarHBondContact O-N 2.87Å; Q241-L244 PolarHBondContact O-N 2.86Å; Q241-R245 WeakPolarHBondContact O-CB 3.42Å; Q241-R245 PolarHBondContact O-N 3.43Å
242	P	98.1	Very high	96.9	Very high	57 Å²	57	56.7 Å²	56.7	37%	0.37	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-35.5	179.3	23.5	-34.2	0	0	0	113.4	Q239 A246	Q239-P242 WeakPolarHBondContact O-CD 3.46Å; Q239-P242 WeakPolarHBondContact O-CG 3.34Å; P242-A246 PolarHBondContact O-N 3.05Å; P242-A246 VanDerWaalsContact O-N 3.14Å
243	I	98.3	Very high	96.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-71	-45.2	179.4	-60.7	172.4	0	0	0	110.2	L71 I88 V188 W225 I227 L240 Q241 A246 A247	L71-I243 HydrophobicContact CD1-CG2 3.66Å; L71-I243 HydrophobicContact CD2-CG2 4.15Å; I88-I243 HydrophobicContact CD1-CG2 4.24Å; V188-I243 HydrophobicContact CG1-CD1 3.88Å; V188-I243 HydrophobicContact CG2-CD1 4.19Å; W225-I243 HydrophobicContact CB-CD1 4.13Å; W225-I243 HydrophobicContact CB-CG1 4.32Å; W225-I243 HydrophobicContact CD2-CG1 3.85Å; W225-I243 HydrophobicContact CE3-CG1 4.03Å; W225-I243 HydrophobicContact CG-CD1 4.33Å; W225-I243 HydrophobicContact CG-CG1 3.98Å; I227-I243 HydrophobicContact CD1-CD1 3.81Å; I227-I243 HydrophobicContact CG1-CD1 4.21Å; L240-I243 HydrophobicContact CD2-CD1 4.41Å; L240-I243 PolarHBondContact O-N 2.87Å; Q241-I243 VanDerWaalsContact C-N 3.32Å; Q241-I243 PolarHBondContact O-N 2.87Å; I243-A246 PolarHBondContact O-N 3.23Å; I243-A247 PolarHBondContact O-N 3.19Å
244	L	98.3	Very high	96.6	Very high	9 Å²	9	53.5 Å²	53.5	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-40.5	178.4	-69.5	171.9	0	0	0	111.4	I88 R91 L92 L240 Q241 A247 Q248	I88-L244 HydrophobicContact CG1-CD2 4.3Å; I88-L244 HydrophobicContact CG2-CD2 4.37Å; R91-L244 HydrophobicContact CB-CD2 4.16Å; L92-L244 HydrophobicContact CG-CD2 4.46Å; L240-L244 HydrophobicContact CB-CD1 4.01Å; L240-L244 HydrophobicContact CB-CG 4.34Å; L240-L244 WeakPolarHBondContact O-CG 3.48Å; L240-L244 PolarHBondContact O-N 3.49Å; Q241-L244 PolarHBondContact O-N 2.86Å; L244-A247 PolarHBondContact O-N 3.33Å; L244-Q248 WeakPolarHBondContact O-CB 3.37Å; L244-Q248 VanDerWaalsContact O-CG 3.24Å; L244-Q248 WeakPolarHBondContact O-CG 3.21Å; L244-Q248 PolarHBondContact O-N 3.4Å
245	R	98.4	Very high	96.2	Very high	149 Å²	149	56.5 Å²	56.5	56%	0.562	30%	0.3	S	S	*	.	H	α-helix	trans	-59.6	-50.5	174.7	-176.8	-175.6	-63.7	-172.2	-1.6	111.4	Q241 A247 Q248 E249	Q241-R245 WeakPolarHBondContact O-CB 3.42Å; Q241-R245 PolarHBondContact O-N 3.43Å; R245-A247 PolarHBondContact O-N 3.44Å; R245-Q248 PolarHBondContact O-N 3.02Å; R245-Q248 VanDerWaalsContact O-N 3.13Å; R245-E249 WeakPolarHBondContact CD-OE1 3.26Å; R245-E249 HydrophobicContact CG-CG 4.43Å; R245-E249 VanDerWaalsContact CG-OE1 3.32Å; R245-E249 WeakPolarHBondContact CG-OE1 3.44Å; R245-E249 WeakPolarHBondContact O-CG 3.13Å; R245-E249 PolarHBondContact O-N 3.27Å
246	A	98.4	Very high	95.8	Very high	21 Å²	21	59.6 Å²	59.6	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-38.5	178.3	0	0	0	0	0	112.1	L69 W225 P242 I243 A250	L69-A246 HydrophobicContact CD2-CB 4.34Å; W225-A246 HydrophobicContact CH2-CB 4.09Å; W225-A246 HydrophobicContact CZ2-CB 4.5Å; P242-A246 PolarHBondContact O-N 3.05Å; P242-A246 VanDerWaalsContact O-N 3.14Å; I243-A246 PolarHBondContact O-N 3.23Å; A246-A250 WeakPolarHBondContact O-CB 3.42Å; A246-A250 PolarHBondContact O-N 2.77Å
247	A	98.1	Very high	95.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-40.4	175.8	0	0	0	0	0	113	L69 L92 V162 I243 L244 R245 A250 A251	L69-A247 HydrophobicContact CD2-CB 3.93Å; L92-A247 HydrophobicContact CD1-CB 3.65Å; L92-A247 HydrophobicContact CD2-CB 4.04Å; V162-A247 HydrophobicContact CG1-CB 4.05Å; V162-A247 HydrophobicContact CG2-CB 4.16Å; V162-A247 WeakPolarHBondContact CG2-O 3.09Å; I243-A247 PolarHBondContact O-N 3.19Å; L244-A247 PolarHBondContact O-N 3.33Å; R245-A247 PolarHBondContact O-N 3.44Å; A247-A250 PolarHBondContact O-N 3.07Å; A247-A251 WeakPolarHBondContact O-CB 3.35Å; A247-A251 PolarHBondContact O-N 3.17Å
248	Q	97.8	Very high	94.4	Very high	112 Å²	112	58.4 Å²	58.4	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-66.1	-42	176.3	-72.9	167.4	-22.3	0	0	111.8	L92 L244 R245 A251 A252	L92-Q248 HydrophobicContact CD2-CG 4.04Å; L244-Q248 WeakPolarHBondContact O-CB 3.37Å; L244-Q248 VanDerWaalsContact O-CG 3.24Å; L244-Q248 WeakPolarHBondContact O-CG 3.21Å; L244-Q248 PolarHBondContact O-N 3.4Å; R245-Q248 PolarHBondContact O-N 3.02Å; R245-Q248 VanDerWaalsContact O-N 3.13Å; Q248-A251 PolarHBondContact O-N 3Å; Q248-A252 PolarHBondContact O-N 2.95Å
249	E	97.7	Very high	93.5	Very high	121 Å²	121	56.5 Å²	56.5	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-61.8	-44.5	174.9	-72	169.4	-176.8	0	0	111.3	R245 A251 A252 A253	R245-E249 WeakPolarHBondContact CD-OE1 3.26Å; R245-E249 HydrophobicContact CG-CG 4.43Å; R245-E249 VanDerWaalsContact CG-OE1 3.32Å; R245-E249 WeakPolarHBondContact CG-OE1 3.44Å; R245-E249 WeakPolarHBondContact O-CG 3.13Å; R245-E249 PolarHBondContact O-N 3.27Å; E249-A251 VanDerWaalsContact C-N 3.34Å; E249-A251 PolarHBondContact O-N 2.78Å; E249-A252 PolarHBondContact O-N 3.49Å; E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 3.35Å
250	A	96.8	Very high	92.4	Very high	12 Å²	12	60.5 Å²	60.5	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-39	175.8	0	0	0	0	0	112.6	E68 L69 V162 A246 A247 A254	E68-A250 HydrophobicContact CB-CB 3.92Å; L69-A250 HydrophobicContact CB-CB 3.57Å; L69-A250 HydrophobicContact CD2-CB 4.43Å; V162-A250 HydrophobicContact CG2-CB 4.31Å; A246-A250 WeakPolarHBondContact O-CB 3.42Å; A246-A250 PolarHBondContact O-N 2.77Å; A247-A250 PolarHBondContact O-N 3.07Å; A250-A254 PolarHBondContact O-N 3.13Å; A250-A254 VanDerWaalsContact O-N 3.16Å
251	A	95.6	Very high	91.3	Very high	9 Å²	9	67.4 Å²	67.4	7%	0.074	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-43	176.1	0	0	0	0	0	112.2	V96 P161 A247 Q248 E249 A254 Q255	V96-A251 HydrophobicContact CG1-CB 3.47Å; V96-A251 VanDerWaalsContact CG1-CB 3.47Å; P161-A251 HydrophobicContact CG-CB 4.36Å; A247-A251 WeakPolarHBondContact O-CB 3.35Å; A247-A251 PolarHBondContact O-N 3.17Å; Q248-A251 PolarHBondContact O-N 3Å; E249-A251 VanDerWaalsContact C-N 3.34Å; E249-A251 PolarHBondContact O-N 2.78Å; A251-A254 PolarHBondContact O-N 2.97Å; A251-Q255 WeakPolarHBondContact O-CG 3.31Å; A251-Q255 PolarHBondContact O-N 3.44Å
252	A	95.4	Very high	90.1	Very high	42 Å²	42	69.1 Å²	69.1	35%	0.347	37%	0.366	S	S	.	.	H	α-helix	trans	-63.1	-45	176.8	0	0	0	0	0	111.7	Q248 E249 A254 Q255 E256	Q248-A252 PolarHBondContact O-N 2.95Å; E249-A252 PolarHBondContact O-N 3.49Å; A252-A254 VanDerWaalsContact C-N 3.27Å; A252-A254 PolarHBondContact O-N 3.37Å; A252-Q255 WeakPolarHBondContact O-CB 3.36Å; A252-Q255 PolarHBondContact O-N 2.99Å; A252-E256 PolarHBondContact O-N 3.42Å
253	A	92.8	Very high	88.3	Confident	39 Å²	39	72.7 Å²	72.7	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-58.7	-38.5	176.7	0	0	0	0	0	112.4	E249 E256 V257	E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 3.35Å; A253-E256 PolarHBondContact O-N 3Å; A253-V257 WeakPolarHBondContact O-CG2 3.31Å; A253-V257 PolarHBondContact O-N 3.07Å
254	A	91	Very high	86.1	Confident	27 Å²	27	83.6 Å²	83.6	22%	0.223	43%	0.433	C	S	.	.	H	α-helix	trans	-66.4	-36.2	176.1	0	0	0	0	0	112.9	E68 P161 A250 A251 A252 A258	E68-A254 HydrophobicContact CG-CB 3.91Å; P161-A254 HydrophobicContact CB-CB 3.47Å; P161-A254 VanDerWaalsContact CB-CB 3.47Å; P161-A254 HydrophobicContact CG-CB 4.2Å; A250-A254 PolarHBondContact O-N 3.13Å; A250-A254 VanDerWaalsContact O-N 3.16Å; A251-A254 PolarHBondContact O-N 2.97Å; A252-A254 VanDerWaalsContact C-N 3.27Å; A252-A254 PolarHBondContact O-N 3.37Å; A254-A258 PolarHBondContact O-N 3.04Å; A254-A258 VanDerWaalsContact O-N 3.12Å
255	Q	86.6	Confident	85.4	Confident	126 Å²	126	87.3 Å²	87.3	59%	0.589	45%	0.452	S	S	*	.	H	α-helix	trans	-67.8	-42.3	176.9	-71.1	175	-14	0	0	111.7	A251 A252 V257 A258 V259	A251-Q255 WeakPolarHBondContact O-CG 3.31Å; A251-Q255 PolarHBondContact O-N 3.44Å; A252-Q255 WeakPolarHBondContact O-CB 3.36Å; A252-Q255 PolarHBondContact O-N 2.99Å; Q255-V257 VanDerWaalsContact C-N 3.33Å; Q255-V257 PolarHBondContact O-N 3.36Å; Q255-A258 PolarHBondContact O-N 3.38Å; Q255-A258 VanDerWaalsContact O-N 3.16Å; Q255-V259 WeakPolarHBondContact O-CG2 3.07Å; Q255-V259 PolarHBondContact O-N 3.33Å
256	E	87.4	Confident	84.8	Confident	133 Å²	133	84.1 Å²	84.1	62%	0.621	45%	0.447	S	S	*	.	H	α-helix	trans	-59.9	-43.5	176.2	-70.3	177.2	-178.1	0	0	111.8	A252 A253 A258 V259 L260	A252-E256 PolarHBondContact O-N 3.42Å; A253-E256 PolarHBondContact O-N 3Å; E256-A258 VanDerWaalsContact C-N 3.3Å; E256-A258 PolarHBondContact O-N 3.42Å; E256-V259 PolarHBondContact O-N 2.61Å; E256-L260 WeakPolarHBondContact O-CG 3.35Å; E256-L260 PolarHBondContact O-N 3.4Å; E256-L260 VanDerWaalsContact O-N 3.14Å
257	V	81.6	Confident	84	Confident	61 Å²	61	87.6 Å²	87.6	37%	0.37	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-34.5	176.8	174.8	0	0	0	0	111.9	A253 Q255 R261	A253-V257 WeakPolarHBondContact O-CG2 3.31Å; A253-V257 PolarHBondContact O-N 3.07Å; Q255-V257 VanDerWaalsContact C-N 3.33Å; Q255-V257 PolarHBondContact O-N 3.36Å; V257-R261 VanDerWaalsContact O-CG 3.32Å; V257-R261 WeakPolarHBondContact O-CG 3.45Å; V257-R261 PolarHBondContact O-N 2.58Å
258	A	79.6	Confident	83.2	Confident	44 Å²	44	92.7 Å²	92.7	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-68.7	-46.6	177.2	0	0	0	0	0	111.8	A254 Q255 E256 L260 R261 D262	A254-A258 PolarHBondContact O-N 3.04Å; A254-A258 VanDerWaalsContact O-N 3.12Å; Q255-A258 PolarHBondContact O-N 3.38Å; Q255-A258 VanDerWaalsContact O-N 3.16Å; E256-A258 VanDerWaalsContact C-N 3.3Å; E256-A258 PolarHBondContact O-N 3.42Å; A258-L260 VanDerWaalsContact C-N 3.32Å; A258-L260 PolarHBondContact O-N 3.49Å; A258-R261 WeakPolarHBondContact O-CB 3.35Å; A258-R261 PolarHBondContact O-N 2.94Å; A258-D262 PolarHBondContact O-N 2.91Å
259	V	79.1	Confident	82.3	Confident	88 Å²	88	91.5 Å²	91.5	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-58.9	-44.2	178	174.7	0	0	0	0	111.2	Q255 E256 R261 D262 D263	Q255-V259 WeakPolarHBondContact O-CG2 3.07Å; Q255-V259 PolarHBondContact O-N 3.33Å; E256-V259 PolarHBondContact O-N 2.61Å; V259-R261 PolarHBondContact O-N 3.47Å; V259-D262 PolarHBondContact O-N 3.11Å; V259-D263 PolarHBondContact O-N 2.9Å
260	L	74.3	Confident	81.2	Confident	116 Å²	116	89.5 Å²	89.5	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-22.9	178.1	-70.4	171.8	0	0	0	114.2	E256 A258	E256-L260 WeakPolarHBondContact O-CG 3.35Å; E256-L260 PolarHBondContact O-N 3.4Å; E256-L260 VanDerWaalsContact O-N 3.14Å; A258-L260 VanDerWaalsContact C-N 3.32Å; A258-L260 PolarHBondContact O-N 3.49Å
261	R	75.2	Confident	80.1	Confident	145 Å²	145	95.1 Å²	95.1	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-83.7	-31	176.8	-74.8	173.1	177.2	175.4	2.6	112.4	V257 A258 V259 D263	V257-R261 VanDerWaalsContact O-CG 3.32Å; V257-R261 WeakPolarHBondContact O-CG 3.45Å; V257-R261 PolarHBondContact O-N 2.58Å; A258-R261 WeakPolarHBondContact O-CB 3.35Å; A258-R261 PolarHBondContact O-N 2.94Å; V259-R261 PolarHBondContact O-N 3.47Å; R261-D263 VanDerWaalsContact C-N 3.3Å
262	D	71.6	Confident	78.9	Confident	140 Å²	140	101.7 Å²	101.7	75%	0.749	54%	0.542	S	S	*	.	H	α-helix	trans	-77.6	-19	179	-70.3	-16	0	0	0	112.2	A258 V259	A258-D262 PolarHBondContact O-N 2.91Å; V259-D262 PolarHBondContact O-N 3.11Å
263	D	60.7	Low	77.6	Confident	131 Å²	131	106.7 Å²	106.7	70%	0.701	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	3.2	176.5	-74.6	-22.7	0	0	0	114.4	V259 R261	V259-D263 PolarHBondContact O-N 2.9Å; R261-D263 VanDerWaalsContact C-N 3.3Å
264	Q	51.1	Low	76.2	Confident	230 Å²	230	112.8 Å²	112.8	100%	1.075	58%	0.58	S	S	*	*			trans	-112.6	0	177.3	-69.7	-164.3	-3.9	0	0	112.9

Retrieved 264 of 264 residues in 207.5 ms (Link to these results)

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