A0A061I4I9_CRIGR Loading...

Serine/threonine-protein phosphatase PGAM5, mitochondrial

Mitochondrial serine/threonine phosphatase that dephosphorylates various substrates and thus plays a role in different biological processes including cellular senescence or mitophagy. Modulates cellular senescence by regulating mitochondrial dynamics. Mechanistically, participates in mitochondrial fission through dephosphorylating DNM1L/DRP1. Additionally, dephosphorylates MFN2 in a stress-sensitive manner and consequently protects it from ubiquitination and degradation to promote mitochondrial network formation. Regulates mitophagy independent of PARKIN by interacting with and dephosphorylating FUNDC1, which interacts with LC3. Regulates anti-oxidative response by forming a tertiary complex with KEAP1 and NRF2. Regulates necroptosis by acting as a RIPK3 target and recruiting the RIPK1-RIPK3-MLKL necrosis 'attack' complex to mitochondria.

AlphaFold DB , UniProt , Accession A0A061I4I9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Pgam5, Length 288 aa.

Structure Viewer

Loading PAE data...

(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	34.7	Very low	32.5	Very low	239 Å²	239	149.5 Å²	149.5	100%	1.177	81%	0.811	S	S	*	*				0	82.7	0	-64.6	-157.6	-85.2	0	0	106.8
2	A	32.8	Very low	32.3	Very low	87 Å²	87	148.7 Å²	148.7	72%	0.719	82%	0.823	S	S	*	*				68.4	105	76.7	0	0	0	0	0	112.8
3	F	32.8	Very low	31.9	Very low	202 Å²	202	142.5 Å²	142.5	89%	0.886	81%	0.813	S	S	*	*			trans	-171.9	98.2	140.8	-100	-76.6	0	0	0	105.4
4	R	34.6	Very low	31.8	Very low	226 Å²	226	145.5 Å²	145.5	85%	0.853	82%	0.824	S	S	*	*				52.7	124.9	80.5	-65.4	-170.6	170.6	-171.1	-1.5	111.2
5	Q	35.1	Very low	31.7	Very low	182 Å²	182	142.4 Å²	142.4	85%	0.85	82%	0.824	S	S	*	*				-164.6	138.8	58.1	-78.7	170.8	-43.9	0	0	108.6
6	A	34.8	Very low	31.3	Very low	86 Å²	86	138.8 Å²	138.8	71%	0.711	83%	0.827	S	S	*	*				57.5	132.6	82.5	0	0	0	0	0	113.1
7	L	32.3	Very low	31.1	Very low	139 Å²	139	135.2 Å²	135.2	73%	0.728	83%	0.826	S	S	*	*			cis	-179.1	148.5	42	-149.8	93.8	0	0	0	109.6
8	Q	30.1	Very low	31.1	Very low	156 Å²	156	135.1 Å²	135.1	73%	0.729	83%	0.832	S	S	*	*			trans	59.2	155.3	139	-82.7	-177.8	-1.5	0	0	122
9	L	30.1	Very low	31.3	Very low	142 Å²	142	133.1 Å²	133.1	74%	0.743	83%	0.83	S	S	*	*			cis	-176.2	162	-13.3	-123.3	165.8	0	0	0	106.6
10	A	30.1	Very low	31.3	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	83%	0.83	S	S	*	*			trans	68.7	116.3	151.2	0	0	0	0	0	118.9
11	A	29.8	Very low	31.2	Very low	98 Å²	98	130.7 Å²	130.7	81%	0.81	82%	0.824	S	S	*	*				98.7	111.1	66	0	0	0	0	0	112.6
12	C	30.3	Very low	30.9	Very low	140 Å²	140	127.1 Å²	127.1	95%	0.946	81%	0.809	S	S	*	*			trans	-169.7	126.4	154.3	-90.2	0	0	0	0	104.2
13	G	27.3	Very low	30.7	Very low	68 Å²	68	132 Å²	132	70%	0.701	81%	0.814	S	S	*	*			cis	122	98.8	19.6	0	0	0	0	0	109.2
14	L	30.1	Very low	30.5	Very low	185 Å²	185	127.8 Å²	127.8	97%	0.969	81%	0.81	S	S	*	*			trans	62.9	146.3	157.6	-60.7	158	0	0	0	117
15	A	30.6	Very low	30.4	Very low	99 Å²	99	121.9 Å²	121.9	82%	0.818	81%	0.809	S	S	*	*			cis	-152.6	151.7	16.3	0	0	0	0	0	106.7
16	G	26.2	Very low	30.1	Very low	84 Å²	84	119.7 Å²	119.7	87%	0.866	81%	0.808	S	S	*	*				122	109.7	63	0	0	0	0	0	107.4
17	G	27.6	Very low	30	Very low	79 Å²	79	120.5 Å²	120.5	81%	0.814	81%	0.814	S	S	*	*			trans	-167.1	88.8	-178	0	0	0	0	0	111.2
18	S	30.8	Very low	29.9	Very low	133 Å²	133	120.3 Å²	120.3	93%	0.93	82%	0.819	S	S	*	*			trans	-67.5	133.5	-177.6	-51.7	0	0	0	0	112.4
19	A	34.2	Very low	29.9	Very low	97 Å²	97	116.6 Å²	116.6	80%	0.802	82%	0.822	S	S	*	*			trans	-116.9	122.4	162.7	0	0	0	0	0	109.1
20	A	31.6	Very low	30	Very low	100 Å²	100	119.6 Å²	119.6	83%	0.826	83%	0.829	S	S	*	*			trans	-69.5	132.8	-172	0	0	0	0	0	112.6
21	V	30.4	Very low	30.7	Very low	116 Å²	116	120.7 Å²	120.7	70%	0.703	83%	0.829	S	S	*	*			trans	-94.3	113.8	167.7	179	0	0	0	0	107.3	F23	V21-F23 HydrophobicContact CG1-CD2 3.65Å; V21-F23 HydrophobicContact CG1-CE2 3.63Å
22	L	28.4	Very low	30.7	Very low	164 Å²	164	128.3 Å²	128.3	86%	0.859	84%	0.837	S	S	*	*			trans	-89.2	102.6	172.3	-81	163.8	0	0	0	109.3
23	F	27	Very low	30.6	Very low	189 Å²	189	125.4 Å²	125.4	83%	0.829	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-89.7	121.3	159	-85.6	-85	0	0	0	108.3	V21	V21-F23 HydrophobicContact CG1-CD2 3.65Å; V21-F23 HydrophobicContact CG1-CE2 3.63Å
24	S	29.3	Very low	30.6	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-100.2	121.4	166.8	-65.6	0	0	0	0	109.7
25	A	33.4	Very low	30.5	Very low	102 Å²	102	121 Å²	121	84%	0.843	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.2	145.9	-177.8	0	0	0	0	0	112.5
26	V	27.6	Very low	30.6	Very low	136 Å²	136	124.5 Å²	124.5	82%	0.824	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-89.7	119.7	169.6	173.5	0	0	0	0	108.4
27	A	32.8	Very low	31.4	Very low	102 Å²	102	125.3 Å²	125.3	84%	0.843	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-95.6	123.9	170.7	0	0	0	0	0	110.2
28	V	31.3	Very low	31.6	Very low	136 Å²	136	129 Å²	129	82%	0.824	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-90.1	124.7	175.7	169.9	0	0	0	0	109.2
29	G	29.2	Very low	31.9	Very low	77 Å²	77	129.5 Å²	129.5	79%	0.794	83%	0.832	S	S	*	*			trans	-126.9	128.9	169.8	0	0	0	0	0	111.2
30	K	32.5	Very low	31.8	Very low	205 Å²	205	136.1 Å²	136.1	89%	0.891	84%	0.836	S	S	*	*			trans	-94.6	170.9	-179.6	-106.6	-160.8	177	175.2	0	112.2
31	P	44.2	Very low	31.9	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	83%	0.832	S	S	*	*			trans	-108.6	167	-137.6	41.7	-36.8	0	0	0	115.5
32	R	30.1	Very low	32.1	Very low	258 Å²	258	136.3 Å²	136.3	97%	0.974	84%	0.836	S	S	*	*			trans	-178.9	136.9	156.2	-97	160.5	-179.6	-178.3	0.3	105.3
33	G	27.9	Very low	32.3	Very low	80 Å²	80	137.7 Å²	137.7	83%	0.825	84%	0.839	S	S	*	*			cis	159	131.9	4.6	0	0	0	0	0	106.1
34	G	27.2	Very low	32.5	Very low	87 Å²	87	139.8 Å²	139.8	90%	0.897	84%	0.841	S	S	*	*			trans	98.6	128.6	161	0	0	0	0	0	117.9
35	G	29.3	Very low	32.5	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	84%	0.838	S	S	*	*			trans	108.2	102.1	137.8	0	0	0	0	0	117.9
36	D	31.8	Very low	32.8	Very low	174 Å²	174	140.6 Å²	140.6	93%	0.93	84%	0.835	S	S	*	*			trans	81.9	132.4	143.7	-60.8	-21.4	0	0	0	122.1
37	A	42	Very low	33.3	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	83%	0.834	S	S	*	*			trans	-73	128.1	-174.4	0	0	0	0	0	111.3
38	D	33.7	Very low	33.6	Very low	156 Å²	156	145.8 Å²	145.8	83%	0.834	83%	0.833	S	S	*	*			trans	-146.8	103.4	152.8	-139.5	-6.4	0	0	0	108.1	R40	D38-R40 PolarHBondContact O-N 3.36Å
39	T	35.4	Very low	33.6	Very low	145 Å²	145	142.6 Å²	142.6	89%	0.89	83%	0.828	S	S	*	*			trans	-70.6	80.5	175.6	36.4	0	0	0	0	109.2	A41	T39-A41 PolarHBondContact O-N 2.92Å; T39-A41 VanDerWaalsContact O-N 3.15Å
40	R	32	Very low	34.1	Very low	235 Å²	235	146.2 Å²	146.2	89%	0.887	83%	0.828	S	S	*	*			trans	-69.8	106	167.3	-146.6	172.7	-170.9	173.6	2.5	107.5	D38 T42	D38-R40 PolarHBondContact O-N 3.36Å; R40-T42 PolarHBondContact O-N 3.25Å
41	A	35.3	Very low	34.5	Very low	89 Å²	89	141.5 Å²	141.5	74%	0.736	82%	0.82	S	S	*	*			trans	-47.8	116.2	173.7	0	0	0	0	0	109.3	T39 E43	T39-A41 PolarHBondContact O-N 2.92Å; T39-A41 VanDerWaalsContact O-N 3.15Å; A41-E43 PolarHBondContact O-N 3.13Å; A41-E43 VanDerWaalsContact O-N 3.1Å
42	T	33.4	Very low	34.7	Very low	131 Å²	131	147.3 Å²	147.3	80%	0.804	83%	0.828	S	S	*	*			trans	-67.3	109.1	172.6	-21.3	0	0	0	0	106.3	R40 R44	R40-T42 PolarHBondContact O-N 3.25Å; T42-R44 PolarHBondContact O-N 3.31Å
43	E	32.1	Very low	35.7	Very low	194 Å²	194	140.7 Å²	140.7	91%	0.907	82%	0.818	S	S	*	*			trans	-53.6	109	168.3	-78.8	-178.3	156.5	0	0	107.9	A41 S45	A41-E43 PolarHBondContact O-N 3.13Å; A41-E43 VanDerWaalsContact O-N 3.1Å; E43-S45 PolarHBondContact O-N 2.74Å
44	R	32	Very low	37	Very low	232 Å²	232	139.3 Å²	139.3	88%	0.875	81%	0.805	S	S	*	*			trans	-65.7	116	170	-82.5	179	172	176.3	-2.5	107.1	T42 T46	T42-R44 PolarHBondContact O-N 3.31Å; R44-T46 PolarHBondContact O-N 3.25Å; R44-T46 VanDerWaalsContact O-N 3.08Å
45	S	30.2	Very low	38.5	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	80%	0.803	S	S	*	*			trans	-45	114.7	165	177.2	0	0	0	0	110	E43 W47	E43-S45 PolarHBondContact O-N 2.74Å; S45-W47 PolarHBondContact O-N 2.81Å; S45-W47 VanDerWaalsContact O-N 3.13Å
46	T	38.3	Very low	40.7	Very low	127 Å²	127	142.6 Å²	142.6	78%	0.779	80%	0.799	S	S	*	*			trans	-84.2	45.7	-177.5	35	0	0	0	0	112.1	R44	R44-T46 PolarHBondContact O-N 3.25Å; R44-T46 VanDerWaalsContact O-N 3.08Å
47	W	39.2	Very low	43.5	Very low	214 Å²	214	140.8 Å²	140.8	81%	0.811	79%	0.794	S	S	*	*	S	Bend	trans	-139.3	121.4	171.4	-74.9	90.4	0	0	0	110.7	S45	S45-W47 PolarHBondContact O-N 2.81Å; S45-W47 VanDerWaalsContact O-N 3.13Å
48	T	38.6	Very low	46	Very low	133 Å²	133	140.7 Å²	140.7	82%	0.816	77%	0.773	S	S	*	*			trans	88.2	41.2	176.6	74.5	0	0	0	0	117.9	I50	T48-I50 PolarHBondContact O-N 3.49Å
49	G	30.3	Very low	49	Very low	70 Å²	70	137.2 Å²	137.2	72%	0.722	75%	0.754	S	S	*	*			trans	-73.5	95	146	0	0	0	0	0	109.3	S51	G49-S51 PolarHBondContact O-N 3.43Å
50	I	41.5	Very low	51.8	Low	153 Å²	153	133 Å²	133	79%	0.785	73%	0.73	S	S	*	*			trans	-68.2	90.7	166	-59.4	175.5	0	0	0	106.3	T48 R52	T48-I50 PolarHBondContact O-N 3.49Å; I50-R52 PolarHBondContact O-N 3.42Å
51	S	39.3	Very low	54.8	Low	105 Å²	105	123.3 Å²	123.3	73%	0.734	70%	0.696	S	S	*	*			trans	-60.3	107.2	165.6	-53.8	0	0	0	0	105.6	G49 P53	G49-S51 PolarHBondContact O-N 3.43Å; S51-P53 WeakPolarHBondContact O-CD 3.17Å; S51-P53 VanDerWaalsContact O-N 3.13Å
52	R	48.3	Very low	57.6	Low	232 Å²	232	120.1 Å²	120.1	88%	0.875	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-54.3	121.3	166.4	-71.3	-176.6	178.4	-168.9	-1.6	105.9	I50 G54	I50-R52 PolarHBondContact O-N 3.42Å; R52-G54 PolarHBondContact O-N 2.94Å; R52-G54 VanDerWaalsContact O-N 3.17Å
53	P	51.2	Low	60.6	Low	119 Å²	119	114.9 Å²	114.9	77%	0.773	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-57.7	129.7	174.9	-15.4	27.5	0	0	0	106.6	S51	S51-P53 WeakPolarHBondContact O-CD 3.17Å; S51-P53 VanDerWaalsContact O-N 3.13Å
54	G	55.2	Low	63.5	Low	52 Å²	52	114.1 Å²	114.1	54%	0.536	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-54.5	169.8	162.3	0	0	0	0	0	109.8	R52 S56	R52-G54 PolarHBondContact O-N 2.94Å; R52-G54 VanDerWaalsContact O-N 3.17Å; G54-S56 PolarHBondContact O-N 2.73Å
55	P	59.5	Low	66.3	Low	134 Å²	134	106.8 Å²	106.8	87%	0.87	59%	0.593	S	S	*	*			trans	-51	112.2	177.9	20.2	-30.3	0	0	0	109.4	V57	P55-V57 PolarHBondContact O-N 3.14Å
56	S	74.8	Confident	69	Low	94 Å²	94	104.7 Å²	104.7	66%	0.657	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-65.6	128.2	178.3	51.9	0	0	0	0	107.7	G54	G54-S56 PolarHBondContact O-N 2.73Å
57	V	91.8	Very high	71.3	Confident	136 Å²	136	99.7 Å²	99.7	82%	0.824	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-60.9	143.1	172.5	-177.7	0	0	0	0	108.4	P55 D59	P55-V57 PolarHBondContact O-N 3.14Å; V57-D59 PolarHBondContact O-N 3.16Å
58	W	94.9	Very high	73.4	Confident	98 Å²	98	93.9 Å²	93.9	37%	0.371	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-55.1	125.3	176.6	173.8	-88.3	0	0	0	111.6	S60 W62 A240 Q242 G267 V269	W58-S60 PolarHBondContact O-N 3.23Å; W58-W62 AromaticContact CZ2-CD1 3.74Å; W58-W62 AromaticContact CZ2-NE1 3.77Å; W58-A240 WeakPolarHBondContact CH2-O 3.25Å; W58-Q242 VanDerWaalsContact CA-OE1 3.3Å; W58-Q242 HydrophobicContact CE3-CB 4.04Å; W58-Q242 HydrophobicContact CE3-CG 3.77Å; W58-Q242 HydrophobicContact CH2-CG 4.04Å; W58-Q242 HydrophobicContact CZ3-CB 3.97Å; W58-Q242 VanDerWaalsContact CZ3-CD 3.5Å; W58-Q242 HydrophobicContact CZ3-CG 3.5Å; W58-G267 WeakPolarHBondContact CZ2-O 3.17Å; W58-V269 HydrophobicContact CH2-CB 4.05Å; W58-V269 HydrophobicContact CH2-CG2 4.02Å; W58-V269 HydrophobicContact CZ2-CG2 4.44Å
59	D	95.4	Very high	75.6	Confident	82 Å²	82	90.4 Å²	90.4	44%	0.439	51%	0.507	S	S	.	.			trans	-80.7	111.2	171.6	177.9	4.5	0	0	0	110	V57 N61 W62 Q242	V57-D59 PolarHBondContact O-N 3.16Å; D59-N61 VanDerWaalsContact C-N 3.26Å; D59-N61 PolarHBondContact O-N 3.41Å; D59-N61 WeakPolarHBondContact OD1-CA 3.3Å; D59-N61 PolarHBondContact OD1-N 3Å; D59-W62 HydrophobicContact CB-CB 4.41Å; D59-W62 PolarHBondContact OD1-N 3.48Å; D59-W62 WeakPolarHBondContact OD2-CA 3.45Å; D59-Q242 PolarHBondContact O-NE2 3.45Å
60	S	93.9	Very high	78.1	Confident	57 Å²	57	90.7 Å²	90.7	40%	0.399	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-16.8	179.1	55.7	0	0	0	0	114.3	W58 R213	W58-S60 PolarHBondContact O-N 3.23Å; S60-R213 PolarHBondContact O-NH2 3.39Å
61	N	95	Very high	80	Confident	32 Å²	32	84.4 Å²	84.4	17%	0.171	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	30.7	179.5	-163.6	22.6	0	0	0	112.4	D59 D63 R64 R65 E66 S69	D59-N61 VanDerWaalsContact C-N 3.26Å; D59-N61 PolarHBondContact O-N 3.41Å; D59-N61 WeakPolarHBondContact OD1-CA 3.3Å; D59-N61 PolarHBondContact OD1-N 3Å; N61-D63 PolarHBondContact O-N 3.29Å; N61-R64 PolarHBondContact O-N 2.96Å; N61-R64 VanDerWaalsContact OD1-C 3.32Å; N61-R64 WeakPolarHBondContact OD1-CA 3.39Å; N61-R64 PolarHBondContact OD1-N 3.35Å; N61-R65 PolarHBondContact OD1-N 3.29Å; N61-E66 HydrophobicContact CB-CB 3.98Å; N61-E66 VanDerWaalsContact CG-CB 3.43Å; N61-E66 WeakPolarHBondContact OD1-CB 3.08Å; N61-E66 PolarHBondContact OD1-N 2.89Å; N61-S69 VanDerWaalsContact ND2-CB 3.31Å; N61-S69 WeakPolarHBondContact ND2-CB 3.43Å; N61-S69 PolarHBondContact ND2-OG 2.89Å; N61-S69 VanDerWaalsContact ND2-OG 3.16Å
62	W	95.7	Very high	81.6	Confident	22 Å²	22	84.6 Å²	84.6	8%	0.083	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-28.6	179.8	65.3	-93.4	0	0	0	114.2	W58 D59 F207 I211 I263 G267 V269	W58-W62 AromaticContact CZ2-CD1 3.74Å; W58-W62 AromaticContact CZ2-NE1 3.77Å; D59-W62 HydrophobicContact CB-CB 4.41Å; D59-W62 PolarHBondContact OD1-N 3.48Å; D59-W62 WeakPolarHBondContact OD2-CA 3.45Å; W62-F207 HydrophobicContact CE3-CE1 4.07Å; W62-F207 AromaticContact CE3-CZ 3.65Å; W62-F207 HydrophobicContact CE3-CZ 3.65Å; W62-F207 HydrophobicContact CH2-CZ 4.35Å; W62-F207 AromaticContact CZ3-CE1 3.92Å; W62-F207 HydrophobicContact CZ3-CE1 3.92Å; W62-F207 HydrophobicContact CZ3-CE2 4.05Å; W62-F207 AromaticContact CZ3-CZ 3.33Å; W62-F207 HydrophobicContact CZ3-CZ 3.33Å; W62-I211 HydrophobicContact CH2-CG2 4.18Å; W62-I211 WeakPolarHBondContact CH2-O 3.28Å; W62-I211 VanDerWaalsContact CZ3-O 3.3Å; W62-I211 WeakPolarHBondContact CZ3-O 3.38Å; W62-I263 HydrophobicContact CZ2-CG2 4.33Å; W62-G267 PolarHBondContact NE1-O 3.08Å; W62-V269 HydrophobicContact CZ2-CG2 3.7Å
63	D	95.3	Very high	82.5	Confident	20 Å²	20	78.2 Å²	78.2	11%	0.107	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-0.4	179.1	60.2	-13.5	0	0	0	114.1	N61 R65 H212 R213	N61-D63 PolarHBondContact O-N 3.29Å; D63-R65 WeakPolarHBondContact O-CG 3.21Å; D63-R65 PolarHBondContact O-N 3.07Å; D63-H212 HydrophobicContact CB-CB 3.86Å; D63-R213 IonicContact OD1-CZ 2.98Å; D63-R213 IonicContact OD1-NE 3.74Å; D63-R213 PolarHBondContact OD1-NE 3Å; D63-R213 VanDerWaalsContact OD1-NE 3.12Å; D63-R213 IonicContact OD1-NH2 3.89Å; D63-R213 PolarHBondContact OD1-NH2 2.86Å; D63-R213 WeakPolarHBondContact OD2-CB 3.2Å; D63-R213 WeakPolarHBondContact OD2-CG 3.31Å; D63-R213 IonicContact OD2-CZ 3.83Å; D63-R213 PolarHBondContact OD2-N 3.11Å; D63-R213 IonicContact OD2-NE 2.61Å; D63-R213 PolarHBondContact OD2-NE 3.22Å; D63-R213 IonicContact OD2-NH2 2.91Å
64	R	92.5	Very high	83.1	Confident	178 Å²	178	81.9 Å²	81.9	67%	0.672	44%	0.439	S	S	*	.	S	Bend	trans	56.6	33.4	-177.5	-56	-175.9	178.1	175.3	-1.2	113.6	N61	N61-R64 PolarHBondContact O-N 2.96Å; N61-R64 VanDerWaalsContact OD1-C 3.32Å; N61-R64 WeakPolarHBondContact OD1-CA 3.39Å; N61-R64 PolarHBondContact OD1-N 3.35Å
65	R	90.9	Very high	83.3	Confident	78 Å²	78	87.8 Å²	87.8	29%	0.294	45%	0.45	S	S	.	.			trans	-122.9	13.1	-177.5	-69.7	174	-174.7	-102.2	4.8	113.2	N61 D63 H212 R213	N61-R65 PolarHBondContact OD1-N 3.29Å; D63-R65 WeakPolarHBondContact O-CG 3.21Å; D63-R65 PolarHBondContact O-N 3.07Å; R65-H212 VanDerWaalsContact CZ-CE1 3.47Å; R65-H212 VanDerWaalsContact CZ-ND1 3.34Å; R65-H212 VanDerWaalsContact NE-CG 3.35Å; R65-H212 PolarHBondContact NE-ND1 3.42Å; R65-H212 PolarHBondContact NH2-CE1 3.13Å; R65-H212 PolarHBondContact NH2-NE2 2.74Å; R65-R213 HydrophobicContact CB-CG 3.77Å
66	E	88.2	Confident	83.1	Confident	63 Å²	63	89.7 Å²	89.7	29%	0.294	44%	0.44	S	S	.	.			trans	-63	131.8	170.5	-176.4	176.9	-129	0	0	110.4	N61 L68 S69 L70	N61-E66 HydrophobicContact CB-CB 3.98Å; N61-E66 VanDerWaalsContact CG-CB 3.43Å; N61-E66 WeakPolarHBondContact OD1-CB 3.08Å; N61-E66 PolarHBondContact OD1-N 2.89Å; E66-L68 VanDerWaalsContact C-N 3.29Å; E66-L68 PolarHBondContact O-N 3.46Å; E66-L68 VanDerWaalsContact O-N 3.16Å; E66-S69 WeakPolarHBondContact O-CA 3.45Å; E66-S69 WeakPolarHBondContact O-CB 3.42Å; E66-S69 PolarHBondContact O-N 3.29Å; E66-S69 PolarHBondContact O-OG 2.84Å; E66-L70 PolarHBondContact O-N 3.31Å
67	P	85.4	Confident	82.1	Confident	22 Å²	22	91.4 Å²	91.4	14%	0.143	44%	0.441	C	S	.	.	H	α-helix	trans	-52.3	-42	-174.1	-31.7	37.1	0	0	0	114.6	S69 L70 I71 L89 K93	P67-S69 PolarHBondContact O-N 3.35Å; P67-L70 PolarHBondContact O-N 3.16Å; P67-L70 VanDerWaalsContact O-N 3.09Å; P67-I71 PolarHBondContact O-N 2.61Å; P67-L89 HydrophobicContact CB-CD2 3.68Å; P67-K93 HydrophobicContact CG-CB 4.28Å
68	L	84.3	Confident	80.4	Confident	92 Å²	92	91.8 Å²	91.8	48%	0.482	44%	0.444	S	S	.	.	H	α-helix	trans	-62	-32.3	178.2	-76.3	166.9	0	0	0	112.7	E66 L70 L89	E66-L68 VanDerWaalsContact C-N 3.29Å; E66-L68 PolarHBondContact O-N 3.46Å; E66-L68 VanDerWaalsContact O-N 3.16Å; L68-L70 VanDerWaalsContact C-N 3.26Å; L68-L70 PolarHBondContact O-N 3.44Å; L68-L89 HydrophobicContact CD2-CD1 4.25Å; L68-L89 HydrophobicContact CD2-CD2 3.69Å; L68-L89 HydrophobicContact CG-CD2 3.78Å
69	S	83.5	Confident	78.4	Confident	60 Å²	60	96.9 Å²	96.9	42%	0.42	47%	0.471	S	S	.	.	H	α-helix	trans	-75.5	-14.4	178.1	72.8	0	0	0	0	113.8	N61 E66 P67	N61-S69 VanDerWaalsContact ND2-CB 3.31Å; N61-S69 WeakPolarHBondContact ND2-CB 3.43Å; N61-S69 PolarHBondContact ND2-OG 2.89Å; N61-S69 VanDerWaalsContact ND2-OG 3.16Å; E66-S69 WeakPolarHBondContact O-CA 3.45Å; E66-S69 WeakPolarHBondContact O-CB 3.42Å; E66-S69 PolarHBondContact O-N 3.29Å; E66-S69 PolarHBondContact O-OG 2.84Å; P67-S69 PolarHBondContact O-N 3.35Å
70	L	82.8	Confident	76.5	Confident	75 Å²	75	96 Å²	96	39%	0.393	47%	0.472	S	S	.	.	H	α-helix	trans	-95.9	-12.8	179.9	-59.7	176.9	0	0	0	113	E66 P67 L68 Y92	E66-L70 PolarHBondContact O-N 3.31Å; P67-L70 PolarHBondContact O-N 3.16Å; P67-L70 VanDerWaalsContact O-N 3.09Å; L68-L70 VanDerWaalsContact C-N 3.26Å; L68-L70 PolarHBondContact O-N 3.44Å; L70-Y92 HydrophobicContact CB-CD1 4.11Å; L70-Y92 HydrophobicContact CB-CD2 4.5Å; L70-Y92 HydrophobicContact CB-CE1 4.44Å; L70-Y92 HydrophobicContact CB-CG 4.16Å; L70-Y92 HydrophobicContact CD1-CD1 3.85Å; L70-Y92 HydrophobicContact CD1-CG 4.21Å
71	I	81.2	Confident	74.9	Confident	22 Å²	22	94.1 Å²	94.1	11%	0.113	46%	0.462	C	S	.	.	S	Bend	trans	-93.7	127.2	-179.3	-62.2	173.7	0	0	0	110.3	P67 L73 L85 R88 L89 Y92	P67-I71 PolarHBondContact O-N 2.61Å; I71-L73 HydrophobicContact CG2-CD2 4.26Å; I71-L73 PolarHBondContact O-N 3.5Å; I71-L73 VanDerWaalsContact O-N 3.16Å; I71-L85 HydrophobicContact CD1-CD1 3.98Å; I71-L85 HydrophobicContact CG2-CD1 4.33Å; I71-R88 HydrophobicContact CD1-CB 3.95Å; I71-L89 HydrophobicContact CD1-CB 4.45Å; I71-L89 HydrophobicContact CD1-CD2 3.48Å; I71-L89 VanDerWaalsContact CD1-CD2 3.48Å; I71-L89 HydrophobicContact CD1-CG 3.67Å; I71-Y92 HydrophobicContact CG1-CD2 3.98Å; I71-Y92 HydrophobicContact CG1-CE2 4.19Å
72	N	73.8	Confident	73.5	Confident	109 Å²	109	100.7 Å²	100.7	58%	0.583	49%	0.491	S	S	*	.			trans	-78.4	99.2	171.6	-171.3	-15.2	0	0	0	110.8	K74	N72-K74 PolarHBondContact O-N 3.08Å; N72-K74 WeakPolarHBondContact OD1-CB 3.4Å; N72-K74 PolarHBondContact OD1-N 3.44Å
73	L	66.8	Low	71.9	Confident	97 Å²	97	107.9 Å²	107.9	51%	0.508	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.3	-176.4	-65.1	171.6	0	0	0	114.7	I71 K75 L85	I71-L73 HydrophobicContact CG2-CD2 4.26Å; I71-L73 PolarHBondContact O-N 3.5Å; I71-L73 VanDerWaalsContact O-N 3.16Å; L73-K75 VanDerWaalsContact C-N 3.28Å; L73-K75 PolarHBondContact O-N 3.08Å; L73-L85 HydrophobicContact CD2-CD1 4.42Å
74	K	64.1	Low	70.9	Confident	196 Å²	196	110.5 Å²	110.5	85%	0.852	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-6.9	-176.9	-66.5	-173	177.1	-177.3	0	114.9	N72	N72-K74 PolarHBondContact O-N 3.08Å; N72-K74 WeakPolarHBondContact OD1-CB 3.4Å; N72-K74 PolarHBondContact OD1-N 3.44Å
75	K	58.5	Low	70	Confident	176 Å²	176	103.9 Å²	103.9	77%	0.765	52%	0.515	S	S	*	.			trans	-103.6	56.2	177.7	-71.5	-172.8	175.9	-176.6	0	112.1	L73	L73-K75 VanDerWaalsContact C-N 3.28Å; L73-K75 PolarHBondContact O-N 3.08Å
76	R	56.2	Low	69.3	Low	175 Å²	175	103 Å²	103	66%	0.66	52%	0.524	S	S	*	.			trans	-95.7	117.1	-175.9	-129.4	176.6	179.4	175.8	-1.9	110.9
77	N	54.2	Low	68.9	Low	130 Å²	130	103.1 Å²	103.1	70%	0.695	53%	0.532	S	S	*	.			trans	-90.6	136	156.4	-89.7	-13.3	0	0	0	108	E79	N77-E79 PolarHBondContact O-N 2.97Å
78	V	56.2	Low	68.6	Low	144 Å²	144	107 Å²	107	87%	0.873	54%	0.544	S	S	*	.	S	Bend	trans	-79.1	-18.8	-164.3	-178.4	0	0	0	0	113
79	E	53.4	Low	68.5	Low	204 Å²	204	104.8 Å²	104.8	95%	0.953	53%	0.532	S	S	*	.	S	Bend	trans	-102.1	-18.7	-170.1	-71.3	177.6	158.5	0	0	115.6	N77	N77-E79 PolarHBondContact O-N 2.97Å
80	S	54.3	Low	68.4	Low	64 Å²	64	106.5 Å²	106.5	45%	0.448	54%	0.537	S	S	.	.	S	Bend	trans	-112.6	4.9	177.8	64.1	0	0	0	0	114	E82 E84	S80-E82 PolarHBondContact O-N 3.45Å; S80-E84 WeakPolarHBondContact O-CB 3.3Å; S80-E84 PolarHBondContact OG-OE2 2.65Å
81	G	60.8	Low	68.4	Low	18 Å²	18	109.4 Å²	109.4	19%	0.186	55%	0.548	C	S	.	.	H	α-helix	trans	-75.9	-16.5	-151.9	0	0	0	0	0	117.6	L85	G81-L85 WeakPolarHBondContact O-CB 3.48Å; G81-L85 PolarHBondContact O-N 3.41Å
82	E	64.8	Low	68.6	Low	169 Å²	169	113.6 Å²	113.6	79%	0.79	56%	0.563	S	S	*	*	H	α-helix	trans	-87.5	-49.2	-175.1	-67.3	-170.5	164.8	0	0	113	S80 L85 A86	S80-E82 PolarHBondContact O-N 3.45Å; E82-L85 PolarHBondContact O-N 3.26Å; E82-A86 WeakPolarHBondContact O-CB 3.39Å; E82-A86 PolarHBondContact O-N 2.71Å
83	E	63.5	Low	69.3	Low	173 Å²	173	114.1 Å²	114.1	81%	0.808	56%	0.56	S	S	*	*	H	α-helix	trans	-66.6	-38.9	176.3	-70.7	-176.7	167.8	0	0	111.8	L85 A86 S87	E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 2.98Å; E83-A86 PolarHBondContact O-N 2.91Å; E83-S87 WeakPolarHBondContact O-CB 3.46Å; E83-S87 PolarHBondContact O-N 2.98Å
84	E	73	Confident	70.5	Confident	75 Å²	75	110 Å²	110	35%	0.35	54%	0.54	S	S	.	.	H	α-helix	trans	-64	-37.9	174.9	-170.8	-176.8	163.2	0	0	111.6	S80 R88	S80-E84 WeakPolarHBondContact O-CB 3.3Å; S80-E84 PolarHBondContact OG-OE2 2.65Å; E84-R88 WeakPolarHBondContact O-CB 3.26Å; E84-R88 WeakPolarHBondContact O-CG 3.45Å; E84-R88 PolarHBondContact O-N 3.26Å; E84-R88 VanDerWaalsContact O-N 3.07Å; E84-R88 IonicContact OE1-CZ 2.68Å; E84-R88 IonicContact OE1-NE 2.67Å; E84-R88 IonicContact OE1-NH1 3.41Å; E84-R88 PolarHBondContact OE1-NH1 3.19Å; E84-R88 IonicContact OE1-NH2 3.14Å; E84-R88 PolarHBondContact OE1-NH2 3.5Å
85	L	74.8	Confident	72	Confident	40 Å²	40	105.5 Å²	105.5	21%	0.209	52%	0.52	C	S	.	.	H	α-helix	trans	-70.8	-42.3	175.6	179.8	63.9	0	0	0	111.6	I71 L73 G81 E82 E83 R88 L89	I71-L85 HydrophobicContact CD1-CD1 3.98Å; I71-L85 HydrophobicContact CG2-CD1 4.33Å; L73-L85 HydrophobicContact CD2-CD1 4.42Å; G81-L85 WeakPolarHBondContact O-CB 3.48Å; G81-L85 PolarHBondContact O-N 3.41Å; E82-L85 PolarHBondContact O-N 3.26Å; E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 2.98Å; L85-R88 PolarHBondContact O-N 2.86Å; L85-L89 HydrophobicContact CD1-CD1 4.32Å; L85-L89 HydrophobicContact CD1-CG 4.31Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.42Å; L85-L89 WeakPolarHBondContact O-CB 3.39Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.36Å; L85-L89 PolarHBondContact O-N 3.24Å
86	A	75.6	Confident	73.9	Confident	59 Å²	59	97.2 Å²	97.2	49%	0.488	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-46.1	177.1	0	0	0	0	0	111.5	E82 E83 R88 L89 D90	E82-A86 WeakPolarHBondContact O-CB 3.39Å; E82-A86 PolarHBondContact O-N 2.71Å; E83-A86 PolarHBondContact O-N 2.91Å; A86-R88 PolarHBondContact O-N 3.3Å; A86-L89 PolarHBondContact O-N 3.07Å; A86-D90 PolarHBondContact O-N 2.75Å
87	S	78.9	Confident	75.9	Confident	65 Å²	65	89.2 Å²	89.2	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-62.1	-41.1	175.5	176.7	0	0	0	0	112.5	E83 D90 H91	E83-S87 WeakPolarHBondContact O-CB 3.46Å; E83-S87 PolarHBondContact O-N 2.98Å; S87-D90 PolarHBondContact O-N 2.84Å; S87-H91 PolarHBondContact O-N 3.01Å; S87-H91 VanDerWaalsContact O-N 3.16Å; S87-H91 PolarHBondContact O-ND1 3.01Å
88	R	79.4	Confident	78	Confident	105 Å²	105	83.4 Å²	83.4	40%	0.396	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-38.7	175.2	-76.9	175	176.2	174.6	5.4	112.7	I71 E84 L85 A86 D90 H91 Y92	I71-R88 HydrophobicContact CD1-CB 3.95Å; E84-R88 WeakPolarHBondContact O-CB 3.26Å; E84-R88 WeakPolarHBondContact O-CG 3.45Å; E84-R88 PolarHBondContact O-N 3.26Å; E84-R88 VanDerWaalsContact O-N 3.07Å; E84-R88 IonicContact OE1-CZ 2.68Å; E84-R88 IonicContact OE1-NE 2.67Å; E84-R88 IonicContact OE1-NH1 3.41Å; E84-R88 PolarHBondContact OE1-NH1 3.19Å; E84-R88 IonicContact OE1-NH2 3.14Å; E84-R88 PolarHBondContact OE1-NH2 3.5Å; L85-R88 PolarHBondContact O-N 2.86Å; A86-R88 PolarHBondContact O-N 3.3Å; R88-D90 VanDerWaalsContact C-N 3.32Å; R88-H91 WeakPolarHBondContact O-CB 3.43Å; R88-H91 PolarHBondContact O-N 3.42Å; R88-Y92 VanDerWaalsContact O-CD2 3.24Å; R88-Y92 WeakPolarHBondContact O-CD2 3.42Å; R88-Y92 PolarHBondContact O-N 3.35Å
89	L	82.7	Confident	80.1	Confident	45 Å²	45	77.3 Å²	77.3	24%	0.236	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-40.9	176.4	-77.3	167.7	0	0	0	111.2	P67 L68 I71 L85 A86 H91 Y92 K93	P67-L89 HydrophobicContact CB-CD2 3.68Å; L68-L89 HydrophobicContact CD2-CD1 4.25Å; L68-L89 HydrophobicContact CD2-CD2 3.69Å; L68-L89 HydrophobicContact CG-CD2 3.78Å; I71-L89 HydrophobicContact CD1-CB 4.45Å; I71-L89 HydrophobicContact CD1-CD2 3.48Å; I71-L89 VanDerWaalsContact CD1-CD2 3.48Å; I71-L89 HydrophobicContact CD1-CG 3.67Å; L85-L89 HydrophobicContact CD1-CD1 4.32Å; L85-L89 HydrophobicContact CD1-CG 4.31Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.42Å; L85-L89 WeakPolarHBondContact O-CB 3.39Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.36Å; L85-L89 PolarHBondContact O-N 3.24Å; A86-L89 PolarHBondContact O-N 3.07Å; L89-H91 VanDerWaalsContact C-N 3.3Å; L89-H91 PolarHBondContact O-N 3.09Å; L89-Y92 PolarHBondContact O-N 3.38Å; L89-K93 PolarHBondContact O-N 3.19Å; L89-K93 VanDerWaalsContact O-N 3.13Å
90	D	81.1	Confident	82.2	Confident	96 Å²	96	67.6 Å²	67.6	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-63.3	-38	177.9	-159.4	56.6	0	0	0	111.8	A86 S87 R88 Y92 K93	A86-D90 PolarHBondContact O-N 2.75Å; S87-D90 PolarHBondContact O-N 2.84Å; R88-D90 VanDerWaalsContact C-N 3.32Å; D90-Y92 PolarHBondContact O-N 3.19Å; D90-K93 WeakPolarHBondContact O-CB 3.48Å; D90-K93 PolarHBondContact O-N 2.76Å; D90-K93 VanDerWaalsContact O-N 3.14Å
91	H	82.9	Confident	84.4	Confident	136 Å²	136	64.9 Å²	64.9	63%	0.63	32%	0.32	S	S	*	.	H	α-helix	trans	-60.8	-28	174.9	-85.9	77.2	0	0	0	114.6	S87 R88 L89 A216	S87-H91 PolarHBondContact O-N 3.01Å; S87-H91 VanDerWaalsContact O-N 3.16Å; S87-H91 PolarHBondContact O-ND1 3.01Å; R88-H91 WeakPolarHBondContact O-CB 3.43Å; R88-H91 PolarHBondContact O-N 3.42Å; L89-H91 VanDerWaalsContact C-N 3.3Å; L89-H91 PolarHBondContact O-N 3.09Å; H91-A216 VanDerWaalsContact O-CB 3.31Å; H91-A216 WeakPolarHBondContact O-CB 3.48Å
92	Y	85.1	Confident	86.2	Confident	110 Å²	110	64 Å²	64	43%	0.431	31%	0.312	S	S	.	.	H	α-helix	trans	-100.7	-2.4	179.1	-71.7	-67.5	0	0	0	113.1	L70 I71 R88 L89 D90 A94	L70-Y92 HydrophobicContact CB-CD1 4.11Å; L70-Y92 HydrophobicContact CB-CD2 4.5Å; L70-Y92 HydrophobicContact CB-CE1 4.44Å; L70-Y92 HydrophobicContact CB-CG 4.16Å; L70-Y92 HydrophobicContact CD1-CD1 3.85Å; L70-Y92 HydrophobicContact CD1-CG 4.21Å; I71-Y92 HydrophobicContact CG1-CD2 3.98Å; I71-Y92 HydrophobicContact CG1-CE2 4.19Å; R88-Y92 VanDerWaalsContact O-CD2 3.24Å; R88-Y92 WeakPolarHBondContact O-CD2 3.42Å; R88-Y92 PolarHBondContact O-N 3.35Å; L89-Y92 PolarHBondContact O-N 3.38Å; D90-Y92 PolarHBondContact O-N 3.19Å; Y92-A94 PolarHBondContact O-N 3.13Å
93	K	88.9	Confident	87.8	Confident	120 Å²	120	56 Å²	56	52%	0.522	27%	0.274	S	S	.	.			trans	-78.6	120.8	-176.7	-167.1	175.9	178.2	-175.8	0	109.8	P67 L89 D90 K95	P67-K93 HydrophobicContact CG-CB 4.28Å; L89-K93 PolarHBondContact O-N 3.19Å; L89-K93 VanDerWaalsContact O-N 3.13Å; D90-K93 WeakPolarHBondContact O-CB 3.48Å; D90-K93 PolarHBondContact O-N 2.76Å; D90-K93 VanDerWaalsContact O-N 3.14Å; K93-K95 PolarHBondContact O-N 3.13Å
94	A	93.2	Very high	89.5	Confident	9 Å²	9	49 Å²	49	7%	0.074	24%	0.24	C	C	.	.			trans	-60.7	137.8	169.2	0	0	0	0	0	109.9	Y92 R213 A214 P265	Y92-A94 PolarHBondContact O-N 3.13Å; A94-R213 HydrophobicContact CB-CB 4.4Å; A94-R213 HydrophobicContact CB-CG 4.16Å; A94-A214 HydrophobicContact CB-CB 4.3Å; A94-A214 WeakPolarHBondContact CB-O 3.45Å; A94-P265 HydrophobicContact CB-CB 4.04Å; A94-P265 WeakPolarHBondContact O-CB 3.34Å
95	K	94.9	Very high	90.7	Very high	103 Å²	103	45.6 Å²	45.6	45%	0.448	22%	0.224	S	C	.	.			trans	-109.4	-28.6	-176.9	-58.9	172.2	-175.4	173.1	0	113.1	K93 E219 P265	K93-K95 PolarHBondContact O-N 3.13Å; K95-E219 WeakPolarHBondContact CD-OE2 3.5Å; K95-E219 IonicContact NZ-OE1 3.14Å; K95-E219 PolarHBondContact NZ-OE1 3.39Å; K95-E219 IonicContact NZ-OE2 3.79Å; K95-E219 PolarHBondContact NZ-OE2 2.93Å; K95-P265 WeakPolarHBondContact O-CG 3.2Å
96	A	97.8	Very high	91.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.008	21%	0.214	C	C	.	.	S	Bend	trans	-104.9	152.4	-171.9	0	0	0	0	0	114.2	A214 Q218 E220 P265	A96-A214 HydrophobicContact CB-CB 4.08Å; A96-A214 WeakPolarHBondContact O-CB 3.47Å; A96-Q218 HydrophobicContact CB-CG 3.93Å; A96-E220 VanDerWaalsContact CB-C 3.49Å; A96-E220 WeakPolarHBondContact CB-O 3.45Å; A96-P265 WeakPolarHBondContact O-CG 3.38Å
97	T	98.7	Very high	93	Very high	8 Å²	8	42.8 Å²	42.8	5%	0.049	20%	0.2	C	C	.	.			trans	-84	138	167.5	-59.3	0	0	0	0	109.7	D221 S222 V262 I263 R264	T97-D221 WeakPolarHBondContact CB-OD1 3.23Å; T97-D221 PolarHBondContact N-OD1 2.9Å; T97-D221 VanDerWaalsContact O-CA 3.25Å; T97-D221 WeakPolarHBondContact O-CA 3.42Å; T97-S222 PolarHBondContact O-N 3.47Å; T97-V262 HydrophobicContact CG2-CG1 3.45Å; T97-V262 VanDerWaalsContact CG2-CG1 3.45Å; T97-I263 WeakPolarHBondContact CA-O 3.48Å; T97-R264 PolarHBondContact OG1-NH1 3.02Å; T97-R264 VanDerWaalsContact OG1-NH1 3.08Å
98	R	98.8	Very high	93.9	Very high	7 Å²	7	41.6 Å²	41.6	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.1	169.4	-57.9	179	61.4	-155.3	-1	110.4	I100 Y210 H212 A214 S222 E224 I263	R98-I100 HydrophobicContact CB-CD1 4.08Å; R98-Y210 PolarHBondContact NH1-O 2.96Å; R98-Y210 PolarHBondContact NH2-O 3.17Å; R98-H212 WeakPolarHBondContact CD-O 3.5Å; R98-H212 PolarHBondContact NH1-O 2.78Å; R98-A214 HydrophobicContact CG-CB 4.04Å; R98-S222 WeakPolarHBondContact CG-OG 3.2Å; R98-E224 IonicContact CZ-OE1 2.74Å; R98-E224 IonicContact CZ-OE2 3.85Å; R98-E224 IonicContact NE-OE1 3.05Å; R98-E224 PolarHBondContact NE-OE1 3.48Å; R98-E224 IonicContact NE-OE2 3.44Å; R98-E224 VanDerWaalsContact NH2-CD 3.3Å; R98-E224 IonicContact NH2-OE1 2.95Å; R98-E224 PolarHBondContact NH2-OE1 2.84Å; R98-E224 VanDerWaalsContact NH2-OE1 3.14Å; R98-E224 IonicContact NH2-OE2 3.46Å; R98-E224 PolarHBondContact NH2-OE2 2.7Å; R98-I263 HydrophobicContact CB-CB 4.35Å; R98-I263 PolarHBondContact N-O 3.19Å; R98-I263 PolarHBondContact O-N 3.19Å
99	H	98.9	Very high	94.8	Very high	16 Å²	16	40.1 Å²	40.1	7%	0.074	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	113.7	174	-66	-70	0	0	0	109.2	F101 S222 Y223 E224 Y260	H99-F101 HydrophobicContact CB-CE2 3.97Å; H99-S222 WeakPolarHBondContact CA-O 3.36Å; H99-S222 VanDerWaalsContact CB-O 3.26Å; H99-S222 WeakPolarHBondContact CB-O 3.15Å; H99-S222 PolarHBondContact N-O 3.21Å; H99-Y223 HydrophobicContact CB-CD1 3.53Å; H99-Y223 HydrophobicContact CB-CE1 4Å; H99-Y223 HydrophobicContact CB-CG 4.31Å; H99-Y223 AromaticContact CD2-CD1 3.73Å; H99-Y223 AromaticContact CD2-CE1 3.3Å; H99-Y223 WeakPolarHBondContact CD2-CE1 3.25Å; H99-Y223 AromaticContact CD2-CZ 3.79Å; H99-Y223 AromaticContact CG-CD1 3.8Å; H99-Y223 AromaticContact CG-CE1 3.71Å; H99-Y223 AromaticContact NE2-CE1 3.99Å; H99-Y223 WeakPolarHBondContact O-CA 3.25Å; H99-E224 PolarHBondContact O-N 3.3Å; H99-Y260 HydrophobicContact CB-CE2 3.71Å; H99-Y260 PolarHBondContact CE1-OH 3.28Å; H99-Y260 VanDerWaalsContact CE1-OH 3.24Å; H99-Y260 AromaticContact CG-CE2 3.97Å; H99-Y260 AromaticContact ND1-CE2 3.48Å; H99-Y260 WeakPolarHBondContact ND1-CE2 3.37Å; H99-Y260 AromaticContact ND1-CZ 3.47Å; H99-Y260 PolarHBondContact ND1-OH 2.96Å
100	I	98.9	Very high	95.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	116.3	-172	-50.2	-61.7	0	0	0	108.9	R98 L102 I211 E224 F226 Y260 L261 I263	R98-I100 HydrophobicContact CB-CD1 4.08Å; I100-L102 HydrophobicContact CG2-CD2 3.71Å; I100-L102 HydrophobicContact CG2-CG 4.04Å; I100-I211 HydrophobicContact CG2-CD1 3.93Å; I100-E224 HydrophobicContact CD1-CB 4.24Å; I100-F226 HydrophobicContact CD1-CE2 4.13Å; I100-F226 HydrophobicContact CG2-CD2 3.69Å; I100-F226 HydrophobicContact CG2-CE2 3.78Å; I100-Y260 WeakPolarHBondContact O-CA 3.28Å; I100-L261 HydrophobicContact CB-CB 4.19Å; I100-L261 PolarHBondContact N-O 3.49Å; I100-L261 PolarHBondContact O-N 2.83Å; I100-I263 HydrophobicContact CG1-CD1 4Å; I100-I263 HydrophobicContact CG1-CG1 4.37Å
101	F	98.9	Very high	96	Very high	7 Å²	7	44 Å²	44	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	100.2	176.4	-63.1	-95.1	0	0	0	109	H99 L135 L138 L140 F142 Y223 E224 I225 F226 I258 T259 Y260	H99-F101 HydrophobicContact CB-CE2 3.97Å; F101-L135 HydrophobicContact CD1-CD2 4.38Å; F101-L138 HydrophobicContact CE1-CD1 3.95Å; F101-L138 HydrophobicContact CZ-CD1 4.37Å; F101-L140 HydrophobicContact CE2-CD1 4.27Å; F101-L140 HydrophobicContact CZ-CD1 3.75Å; F101-F142 HydrophobicContact CD2-CD1 4.47Å; F101-F142 AromaticContact CD2-CE1 3.74Å; F101-F142 HydrophobicContact CD2-CE1 3.74Å; F101-F142 AromaticContact CE2-CE1 3.78Å; F101-F142 HydrophobicContact CE2-CE1 3.78Å; F101-F142 HydrophobicContact CG-CE1 4.25Å; F101-F142 HydrophobicContact CZ-CE1 4.31Å; F101-Y223 HydrophobicContact CE2-CD1 4.08Å; F101-E224 PolarHBondContact N-O 3.29Å; F101-I225 HydrophobicContact CB-CG1 4.14Å; F101-I225 CarbonylContact O-C 3.57Å; F101-I225 WeakPolarHBondContact O-CA 3.19Å; F101-F226 PolarHBondContact O-N 3.45Å; F101-I258 HydrophobicContact CD1-CG2 3.96Å; F101-T259 CarbonylContact C-O 3.57Å; F101-T259 WeakPolarHBondContact CA-O 3.46Å; F101-Y260 HydrophobicContact CD1-CD2 4.34Å; F101-Y260 HydrophobicContact CD1-CG 4.41Å; F101-Y260 HydrophobicContact CE1-CD1 4.3Å; F101-Y260 HydrophobicContact CE1-CD2 4.02Å; F101-Y260 HydrophobicContact CE1-CE2 4.29Å; F101-Y260 HydrophobicContact CE1-CG 4.04Å; F101-Y260 HydrophobicContact CE2-CD2 4.38Å; F101-Y260 HydrophobicContact CE2-CE2 4.17Å; F101-Y260 HydrophobicContact CZ-CD2 4.05Å; F101-Y260 HydrophobicContact CZ-CE1 4.48Å; F101-Y260 AromaticContact CZ-CE2 3.87Å; F101-Y260 HydrophobicContact CZ-CE2 3.87Å; F101-Y260 HydrophobicContact CZ-CG 4.44Å
102	L	98.9	Very high	96.4	Very high	1 Å²	1	38 Å²	38	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.1	175.2	-56.2	176.5	0	0	0	108.8	I100 F226 I233 I236 V237 T259 L261	I100-L102 HydrophobicContact CG2-CD2 3.71Å; I100-L102 HydrophobicContact CG2-CG 4.04Å; L102-F226 HydrophobicContact CD2-CB 3.78Å; L102-F226 HydrophobicContact CD2-CD2 4.14Å; L102-F226 HydrophobicContact CD2-CG 4.12Å; L102-I233 HydrophobicContact CB-CD1 4.37Å; L102-I233 HydrophobicContact CB-CG1 4.11Å; L102-I233 HydrophobicContact CB-CG2 3.92Å; L102-I233 HydrophobicContact CD1-CG2 3.95Å; L102-I236 HydrophobicContact CD1-CB 4.29Å; L102-I236 HydrophobicContact CD1-CG2 3.65Å; L102-V237 HydrophobicContact CD1-CG2 4.27Å; L102-T259 HydrophobicContact CD1-CG2 4.47Å; L102-T259 PolarHBondContact N-O 2.84Å; L102-T259 PolarHBondContact O-N 2.86Å; L102-L261 HydrophobicContact CD1-CD1 3.91Å
103	I	98.9	Very high	96.6	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.1	-174.6	-55.8	179	0	0	0	109.2	T131 L135 I160 I225 F226 I227 C228 S257	I103-T131 HydrophobicContact CD1-CG2 4.27Å; I103-T131 HydrophobicContact CG2-CG2 4.02Å; I103-L135 HydrophobicContact CD1-CD1 3.54Å; I103-L135 HydrophobicContact CD1-CD2 4.28Å; I103-L135 HydrophobicContact CD1-CG 4.44Å; I103-I160 HydrophobicContact CD1-CD1 4.3Å; I103-I160 HydrophobicContact CG2-CD1 4.25Å; I103-I225 HydrophobicContact CD1-CG2 3.63Å; I103-I225 HydrophobicContact CG1-CG2 4.38Å; I103-F226 PolarHBondContact N-O 3.1Å; I103-I227 HydrophobicContact CB-CG1 4.08Å; I103-I227 HydrophobicContact CD1-CG1 4.22Å; I103-I227 HydrophobicContact CG2-CG1 4.45Å; I103-I227 WeakPolarHBondContact O-CA 3.4Å; I103-C228 PolarHBondContact O-N 2.93Å; I103-S257 WeakPolarHBondContact CA-O 3.18Å
104	R	98.9	Very high	96.9	Very high	26 Å²	26	37 Å²	37	10%	0.098	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	137.8	170.9	-170.8	-172.5	173.3	-161.7	-4.7	109	A230 I233 L253 N254 G256 S257 R287	R104-A230 HydrophobicContact CG-CB 4.49Å; R104-I233 HydrophobicContact CB-CD1 4Å; R104-L253 PolarHBondContact NH1-O 2.84Å; R104-N254 WeakPolarHBondContact CD-O 3.39Å; R104-G256 WeakPolarHBondContact O-CA 3.45Å; R104-G256 PolarHBondContact O-N 3.1Å; R104-S257 PolarHBondContact N-O 2.94Å; R104-R287 VanDerWaalsContact CZ-O 3.24Å; R104-R287 PolarHBondContact NH1-O 2.83Å; R104-R287 PolarHBondContact NH2-O 3.15Å
105	H	98.9	Very high	97	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.019	21%	0.205	C	C	.	.			trans	-50.2	153.6	170.1	71.2	79.5	0	0	0	112.6	Y108 R152 A153 C228 H229 N255 G256	H105-Y108 AromaticContact CE1-CD1 3.39Å; H105-Y108 WeakPolarHBondContact CE1-CD1 3.31Å; H105-Y108 AromaticContact CE1-CE1 3.45Å; H105-Y108 VanDerWaalsContact CE1-CE1 3.45Å; H105-Y108 WeakPolarHBondContact CE1-CE1 3.4Å; H105-Y108 AromaticContact ND1-CD1 3.79Å; H105-R152 HydrophobicContact CB-CB 4.45Å; H105-R152 HydrophobicContact CB-CG 4.16Å; H105-R152 PolarHBondContact NE2-NE 3.49Å; H105-A153 HydrophobicContact CB-CB 4.49Å; H105-C228 PolarHBondContact CD2-O 3.02Å; H105-C228 PolarHBondContact N-O 2.84Å; H105-H229 AromaticContact CD2-CG 3.98Å; H105-H229 AromaticContact CD2-ND1 3.13Å; H105-H229 PolarHBondContact CD2-ND1 2.9Å; H105-H229 AromaticContact NE2-ND1 3.69Å; H105-N255 WeakPolarHBondContact O-CA 3.28Å; H105-N255 PolarHBondContact O-ND2 3.25Å; H105-G256 PolarHBondContact O-N 3.18Å
106	S	98.9	Very high	97	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.			trans	-74.6	174.5	177.1	-62.9	0	0	0	0	112.7	G124 A128 T156 N255	S106-G124 WeakPolarHBondContact CB-O 3.4Å; S106-G124 PolarHBondContact OG-O 2.9Å; S106-A128 WeakPolarHBondContact OG-CA 3.42Å; S106-A128 WeakPolarHBondContact OG-CB 3.49Å; S106-A128 PolarHBondContact OG-N 3.19Å; S106-A128 VanDerWaalsContact OG-N 3.16Å; S106-T156 PolarHBondContact N-OG1 2.77Å; S106-T156 VanDerWaalsContact N-OG1 3.09Å; S106-N255 PolarHBondContact O-ND2 2.92Å
107	Q	98.9	Very high	96.9	Very high	40 Å²	40	43.6 Å²	43.6	19%	0.187	23%	0.229	C	C	.	.			trans	-56.6	140.2	178.4	179.3	178.1	75.3	0	0	111.7	L120 T121 G124 N255 S288	Q107-L120 WeakPolarHBondContact O-CA 3.26Å; Q107-L120 VanDerWaalsContact O-CD2 3.28Å; Q107-L120 WeakPolarHBondContact O-CD2 3.43Å; Q107-T121 HydrophobicContact CG-CG2 3.82Å; Q107-T121 WeakPolarHBondContact CG-OG1 3.44Å; Q107-T121 PolarHBondContact O-N 2.86Å; Q107-T121 VanDerWaalsContact O-N 3.12Å; Q107-T121 PolarHBondContact OE1-OG1 2.9Å; Q107-G124 WeakPolarHBondContact O-CA 3.38Å; Q107-N255 PolarHBondContact N-ND2 3.22Å; Q107-S288 WeakPolarHBondContact CG-O 3.41Å; Q107-S288 PolarHBondContact NE2-O 3.1Å
108	Y	98.8	Very high	96.8	Very high	40 Å²	40	47.1 Å²	47.1	16%	0.157	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-143.3	164.1	-175.1	79.2	-74.8	0	0	0	112.2	H105 V110 R118 T119 R152	H105-Y108 AromaticContact CE1-CD1 3.39Å; H105-Y108 WeakPolarHBondContact CE1-CD1 3.31Å; H105-Y108 AromaticContact CE1-CE1 3.45Å; H105-Y108 VanDerWaalsContact CE1-CE1 3.45Å; H105-Y108 WeakPolarHBondContact CE1-CE1 3.4Å; H105-Y108 AromaticContact ND1-CD1 3.79Å; Y108-V110 HydrophobicContact CD1-CG2 4.49Å; Y108-V110 HydrophobicContact CE1-CG2 3.99Å; Y108-V110 HydrophobicContact CE2-CB 4.4Å; Y108-V110 HydrophobicContact CE2-CG2 4.13Å; Y108-V110 PolarHBondContact O-N 3.42Å; Y108-V110 VanDerWaalsContact O-N 3.16Å; Y108-R118 HydrophobicContact CD2-CB 3.89Å; Y108-R118 HydrophobicContact CE2-CB 4.03Å; Y108-R118 HydrophobicContact CE2-CG 4.41Å; Y108-T119 CarbonylContact C-O 3.53Å; Y108-T119 VanDerWaalsContact CA-O 3.25Å; Y108-T119 WeakPolarHBondContact CA-O 3.35Å; Y108-T119 VanDerWaalsContact CB-O 3.27Å; Y108-T119 WeakPolarHBondContact CB-O 3.33Å; Y108-R152 HydrophobicContact CD1-CB 4.48Å; Y108-R152 HydrophobicContact CD2-CB 4.27Å; Y108-R152 HydrophobicContact CG-CB 3.93Å; Y108-R152 HydrophobicContact CG-CG 4.38Å
109	H	98.2	Very high	96.8	Very high	74 Å²	74	48.6 Å²	48.6	34%	0.343	25%	0.251	S	S	.	.			trans	-73.7	99.9	175.3	-68.6	-74.6	0	0	0	110.5	D111 R118 T119	H109-D111 VanDerWaalsContact C-N 3.32Å; H109-R118 WeakPolarHBondContact O-CA 3.49Å; H109-T119 PolarHBondContact CD2-O 2.95Å; H109-T119 PolarHBondContact N-O 3.41Å
110	V	95.6	Very high	96.8	Very high	82 Å²	82	47.9 Å²	47.9	50%	0.497	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-29.6	-176.7	-173.1	0	0	0	0	112.1	Y108 G112	Y108-V110 HydrophobicContact CD1-CG2 4.49Å; Y108-V110 HydrophobicContact CE1-CG2 3.99Å; Y108-V110 HydrophobicContact CE2-CB 4.4Å; Y108-V110 HydrophobicContact CE2-CG2 4.13Å; Y108-V110 PolarHBondContact O-N 3.42Å; Y108-V110 VanDerWaalsContact O-N 3.16Å; V110-G112 VanDerWaalsContact C-N 3.25Å; V110-G112 PolarHBondContact O-N 2.92Å
111	D	93.8	Very high	96.8	Very high	139 Å²	139	48.6 Å²	48.6	74%	0.743	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-0.9	-178.8	59.1	-30.5	0	0	0	114.1	H109 S113	H109-D111 VanDerWaalsContact C-N 3.32Å; D111-S113 PolarHBondContact O-N 3.28Å
112	G	89.3	Confident	96.8	Very high	12 Å²	12	52 Å²	52	12%	0.124	28%	0.275	C	S	.	.			trans	-56.8	125.4	173.3	0	0	0	0	0	112.4	V110 R118	V110-G112 VanDerWaalsContact C-N 3.25Å; V110-G112 PolarHBondContact O-N 2.92Å; G112-R118 PolarHBondContact O-NE 2.99Å
113	S	90.3	Very high	96.8	Very high	108 Å²	108	54 Å²	54	76%	0.755	29%	0.285	S	S	*	.	S	Bend	trans	-62	-44.4	-176.2	-61.1	0	0	0	0	112.9	D111	D111-S113 PolarHBondContact O-N 3.28Å
114	L	95.1	Very high	96.8	Very high	99 Å²	99	54 Å²	54	52%	0.518	29%	0.285	S	S	.	.	S	Bend	trans	-113.7	160.8	177.9	-56.2	172.2	0	0	0	110.5	K116 D117 R118	L114-K116 HydrophobicContact CB-CG 4.05Å; L114-K116 PolarHBondContact O-N 3.18Å; L114-D117 WeakPolarHBondContact CB-OD2 3.49Å; L114-D117 PolarHBondContact N-OD2 3.32Å; L114-D117 WeakPolarHBondContact O-CB 3.24Å; L114-D117 PolarHBondContact O-N 2.99Å; L114-R118 PolarHBondContact O-N 3.39Å
115	E	94.8	Very high	96.8	Very high	46 Å²	46	58 Å²	58	22%	0.215	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.3	-34.8	-179.8	-176.2	59.3	-157.5	0	0	112.5	D117 R118 M150 T151 R152	E115-D117 PolarHBondContact O-N 3.26Å; E115-R118 PolarHBondContact O-N 2.91Å; E115-R118 IonicContact OE2-NH1 2.8Å; E115-M150 WeakPolarHBondContact OE1-CA 3.34Å; E115-M150 VanDerWaalsContact OE1-CB 3.24Å; E115-M150 WeakPolarHBondContact OE1-CB 3.45Å; E115-M150 WeakPolarHBondContact OE1-CG 3.27Å; E115-T151 VanDerWaalsContact O-CB 3.28Å; E115-T151 WeakPolarHBondContact O-CB 3.49Å; E115-T151 PolarHBondContact O-OG1 2.87Å; E115-T151 PolarHBondContact OE1-N 3.41Å; E115-R152 IonicContact OE1-NH1 3.82Å; E115-R152 PolarHBondContact OE1-NH1 2.8Å
116	K	95	Very high	96.8	Very high	143 Å²	143	61.9 Å²	61.9	62%	0.622	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66.3	-21.4	175.9	64.2	170.5	-174	177.2	0	114.2	L114 T119	L114-K116 HydrophobicContact CB-CG 4.05Å; L114-K116 PolarHBondContact O-N 3.18Å; K116-T119 WeakPolarHBondContact O-CG2 3.32Å
117	D	95.3	Very high	96.8	Very high	64 Å²	64	61.9 Å²	61.9	34%	0.342	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-90.1	-10.6	-178.8	-50.4	-39	0	0	0	111.4	L114 E115 T119	L114-D117 WeakPolarHBondContact CB-OD2 3.49Å; L114-D117 PolarHBondContact N-OD2 3.32Å; L114-D117 WeakPolarHBondContact O-CB 3.24Å; L114-D117 PolarHBondContact O-N 2.99Å; E115-D117 PolarHBondContact O-N 3.26Å; D117-T119 PolarHBondContact O-N 2.85Å
118	R	97.8	Very high	96.8	Very high	82 Å²	82	60 Å²	60	31%	0.309	31%	0.309	S	S	.	.			trans	-85.3	54	179.3	-64.5	178.1	-177.2	178.7	-3	111.4	Y108 H109 G112 L114 E115	Y108-R118 HydrophobicContact CD2-CB 3.89Å; Y108-R118 HydrophobicContact CE2-CB 4.03Å; Y108-R118 HydrophobicContact CE2-CG 4.41Å; H109-R118 WeakPolarHBondContact O-CA 3.49Å; G112-R118 PolarHBondContact O-NE 2.99Å; L114-R118 PolarHBondContact O-N 3.39Å; E115-R118 PolarHBondContact O-N 2.91Å; E115-R118 IonicContact OE2-NH1 2.8Å
119	T	98.6	Very high	96.8	Very high	38 Å²	38	61.6 Å²	61.6	23%	0.233	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-81.3	166.2	-179.4	59.4	0	0	0	0	111.5	Y108 H109 K116 D117 T151 E155	Y108-T119 CarbonylContact C-O 3.53Å; Y108-T119 VanDerWaalsContact CA-O 3.25Å; Y108-T119 WeakPolarHBondContact CA-O 3.35Å; Y108-T119 VanDerWaalsContact CB-O 3.27Å; Y108-T119 WeakPolarHBondContact CB-O 3.33Å; H109-T119 PolarHBondContact CD2-O 2.95Å; H109-T119 PolarHBondContact N-O 3.41Å; K116-T119 WeakPolarHBondContact O-CG2 3.32Å; D117-T119 PolarHBondContact O-N 2.85Å; T119-T151 HydrophobicContact CG2-CG2 3.87Å; T119-E155 VanDerWaalsContact CB-OE1 3.3Å; T119-E155 WeakPolarHBondContact CB-OE1 3.41Å; T119-E155 WeakPolarHBondContact CB-OE2 3.31Å; T119-E155 WeakPolarHBondContact CG2-OE1 3.44Å
120	L	98.8	Very high	96.8	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-63.7	142.6	176	-63	-175.4	0	0	0	111.3	Q107 R125 R152 E155 I159	Q107-L120 WeakPolarHBondContact O-CA 3.26Å; Q107-L120 VanDerWaalsContact O-CD2 3.28Å; Q107-L120 WeakPolarHBondContact O-CD2 3.43Å; L120-R125 HydrophobicContact CB-CG 4.02Å; L120-R125 HydrophobicContact CD1-CG 4.34Å; L120-R125 PolarHBondContact O-NH1 2.83Å; L120-R152 HydrophobicContact CD2-CB 4.16Å; L120-E155 WeakPolarHBondContact CB-OE2 3.5Å; L120-E155 HydrophobicContact CD1-CB 3.79Å; L120-E155 HydrophobicContact CG-CB 3.78Å; L120-E155 WeakPolarHBondContact CG-OE2 3.38Å; L120-E155 PolarHBondContact N-OE2 3.31Å; L120-I159 HydrophobicContact CD1-CD1 4.01Å
121	T	98.8	Very high	97	Very high	15 Å²	15	55.9 Å²	55.9	9%	0.092	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-71.5	168.5	168.3	68.1	0	0	0	0	110	Q107 L123 G124 R125	Q107-T121 HydrophobicContact CG-CG2 3.82Å; Q107-T121 WeakPolarHBondContact CG-OG1 3.44Å; Q107-T121 PolarHBondContact O-N 2.86Å; Q107-T121 VanDerWaalsContact O-N 3.12Å; Q107-T121 PolarHBondContact OE1-OG1 2.9Å; T121-L123 VanDerWaalsContact C-N 3.29Å; T121-L123 PolarHBondContact O-N 2.89Å; T121-L123 PolarHBondContact OG1-N 3.46Å; T121-G124 PolarHBondContact O-N 3.33Å; T121-G124 VanDerWaalsContact O-N 3.12Å; T121-G124 PolarHBondContact OG1-N 2.91Å; T121-R125 PolarHBondContact O-N 3.03Å
122	P	98.8	Very high	97.2	Very high	78 Å²	78	49.2 Å²	49.2	51%	0.506	25%	0.252	S	S	.	.	H	α-helix	trans	-52.2	-47.2	169.4	-26.4	34.8	0	0	0	112.6	G124 R125 E126	P122-G124 VanDerWaalsContact C-N 3.34Å; P122-G124 PolarHBondContact O-N 2.9Å; P122-R125 WeakPolarHBondContact O-CB 3.33Å; P122-R125 PolarHBondContact O-N 2.84Å; P122-E126 PolarHBondContact O-N 2.87Å
123	L	98.9	Very high	97.7	Very high	42 Å²	42	52.8 Å²	52.8	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-38.3	175.9	177.7	60.4	0	0	0	112.2	T121 R125 E126 Q127 K284 T286	T121-L123 VanDerWaalsContact C-N 3.29Å; T121-L123 PolarHBondContact O-N 2.89Å; T121-L123 PolarHBondContact OG1-N 3.46Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 2.87Å; L123-E126 WeakPolarHBondContact O-CB 3.4Å; L123-E126 PolarHBondContact O-N 2.89Å; L123-E126 VanDerWaalsContact O-N 3.13Å; L123-Q127 WeakPolarHBondContact O-CG 3.45Å; L123-Q127 PolarHBondContact O-N 2.82Å; L123-K284 HydrophobicContact CD1-CB 3.98Å; L123-K284 HydrophobicContact CD1-CG 4.09Å; L123-T286 HydrophobicContact CD2-CG2 3.71Å
124	G	98.9	Very high	98.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-36.9	175.4	0	0	0	0	0	113.2	S106 Q107 T121 P122 Q127 A128	S106-G124 WeakPolarHBondContact CB-O 3.4Å; S106-G124 PolarHBondContact OG-O 2.9Å; Q107-G124 WeakPolarHBondContact O-CA 3.38Å; T121-G124 PolarHBondContact O-N 3.33Å; T121-G124 VanDerWaalsContact O-N 3.12Å; T121-G124 PolarHBondContact OG1-N 2.91Å; P122-G124 VanDerWaalsContact C-N 3.34Å; P122-G124 PolarHBondContact O-N 2.9Å; G124-Q127 PolarHBondContact O-N 2.88Å; G124-A128 PolarHBondContact O-N 3.41Å
125	R	98.9	Very high	98.3	Very high	112 Å²	112	47.4 Å²	47.4	42%	0.423	22%	0.224	S	C	.	.	H	α-helix	trans	-65.4	-41.9	173.6	-66.4	-174.5	-84.9	-83.1	-0.9	111.5	L120 T121 P122 L123 A128 E129 I159	L120-R125 HydrophobicContact CB-CG 4.02Å; L120-R125 HydrophobicContact CD1-CG 4.34Å; L120-R125 PolarHBondContact O-NH1 2.83Å; T121-R125 PolarHBondContact O-N 3.03Å; P122-R125 WeakPolarHBondContact O-CB 3.33Å; P122-R125 PolarHBondContact O-N 2.84Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 2.87Å; R125-A128 PolarHBondContact O-N 2.84Å; R125-E129 WeakPolarHBondContact O-CB 3.47Å; R125-E129 PolarHBondContact O-N 2.68Å; R125-I159 HydrophobicContact CB-CD1 3.81Å; R125-I159 HydrophobicContact CG-CD1 3.76Å
126	E	98.9	Very high	98.5	Very high	84 Å²	84	47.2 Å²	47.2	39%	0.393	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-40.3	174.8	-64.8	179.6	-132.5	0	0	112.6	P122 L123 E129 L130 K284	P122-E126 PolarHBondContact O-N 2.87Å; L123-E126 WeakPolarHBondContact O-CB 3.4Å; L123-E126 PolarHBondContact O-N 2.89Å; L123-E126 VanDerWaalsContact O-N 3.13Å; E126-E129 WeakPolarHBondContact O-CB 3.49Å; E126-E129 PolarHBondContact O-N 3.12Å; E126-L130 WeakPolarHBondContact O-CG 3.47Å; E126-L130 PolarHBondContact O-N 2.85Å; E126-K284 WeakPolarHBondContact OE2-CE 3.47Å; E126-K284 IonicContact OE2-NZ 2.9Å; E126-K284 PolarHBondContact OE2-NZ 3.39Å
127	Q	98.9	Very high	98.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-46.1	174	-72.1	170	-14.3	0	0	111.3	L123 G124 E129 L130 T131 M280 K284 T286	L123-Q127 WeakPolarHBondContact O-CG 3.45Å; L123-Q127 PolarHBondContact O-N 2.82Å; G124-Q127 PolarHBondContact O-N 2.88Å; Q127-E129 VanDerWaalsContact C-N 3.28Å; Q127-E129 PolarHBondContact O-N 2.9Å; Q127-L130 PolarHBondContact O-N 2.82Å; Q127-T131 PolarHBondContact O-N 2.8Å; Q127-T131 PolarHBondContact O-OG1 3.16Å; Q127-M280 HydrophobicContact CB-CE 4.03Å; Q127-M280 HydrophobicContact CB-SD 4.42Å; Q127-M280 HydrophobicContact CG-CE 4.38Å; Q127-M280 HydrophobicContact CG-SD 4.15Å; Q127-K284 PolarHBondContact NE2-O 3.03Å; Q127-T286 PolarHBondContact NE2-OG1 3.16Å
128	A	98.9	Very high	98.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-36.8	178.7	0	0	0	0	0	111.8	S106 G124 R125 T131 G132 T156 I159 I160	S106-A128 WeakPolarHBondContact OG-CA 3.42Å; S106-A128 WeakPolarHBondContact OG-CB 3.49Å; S106-A128 PolarHBondContact OG-N 3.19Å; S106-A128 VanDerWaalsContact OG-N 3.16Å; G124-A128 PolarHBondContact O-N 3.41Å; R125-A128 PolarHBondContact O-N 2.84Å; A128-T131 PolarHBondContact O-N 3.14Å; A128-G132 PolarHBondContact O-N 3.42Å; A128-T156 HydrophobicContact CB-CG2 4.09Å; A128-I159 HydrophobicContact CB-CB 3.82Å; A128-I159 HydrophobicContact CB-CD1 3.9Å; A128-I159 HydrophobicContact CB-CG1 4.47Å; A128-I159 HydrophobicContact CB-CG2 3.74Å; A128-I160 WeakPolarHBondContact O-CG1 3.5Å
129	E	98.9	Very high	98.8	Very high	74 Å²	74	43.4 Å²	43.4	35%	0.346	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-48.5	174.7	-174	66.2	-169.8	0	0	111.2	R125 E126 Q127 T131 G132 L133 I159 H163	R125-E129 WeakPolarHBondContact O-CB 3.47Å; R125-E129 PolarHBondContact O-N 2.68Å; E126-E129 WeakPolarHBondContact O-CB 3.49Å; E126-E129 PolarHBondContact O-N 3.12Å; Q127-E129 VanDerWaalsContact C-N 3.28Å; Q127-E129 PolarHBondContact O-N 2.9Å; E129-T131 VanDerWaalsContact C-N 3.32Å; E129-T131 PolarHBondContact O-N 2.77Å; E129-G132 PolarHBondContact O-N 3.02Å; E129-L133 HydrophobicContact CG-CD1 4.38Å; E129-L133 WeakPolarHBondContact O-CG 3.21Å; E129-L133 PolarHBondContact O-N 3.32Å; E129-I159 HydrophobicContact CB-CG2 4.2Å; E129-I159 WeakPolarHBondContact OE2-CG2 3.33Å; E129-H163 IonicContact OE1-CE1 2.73Å; E129-H163 PolarHBondContact OE1-CE1 3.33Å; E129-H163 IonicContact OE1-NE2 3.86Å; E129-H163 PolarHBondContact OE1-NE2 3.25Å; E129-H163 IonicContact OE2-CD2 2.94Å; E129-H163 IonicContact OE2-CE1 2.92Å; E129-H163 IonicContact OE2-NE2 2.75Å; E129-H163 PolarHBondContact OE2-NE2 2.95Å
130	L	98.9	Very high	98.8	Very high	36 Å²	36	44.1 Å²	44.1	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-41	176.5	-71.1	166.2	0	0	0	112.1	E126 Q127 R134 F279 M280 K284	E126-L130 WeakPolarHBondContact O-CG 3.47Å; E126-L130 PolarHBondContact O-N 2.85Å; Q127-L130 PolarHBondContact O-N 2.82Å; L130-R134 WeakPolarHBondContact O-CB 3.16Å; L130-R134 PolarHBondContact O-N 2.86Å; L130-F279 HydrophobicContact CB-CD2 4.11Å; L130-F279 HydrophobicContact CB-CE2 4.13Å; L130-M280 HydrophobicContact CB-CG 4.29Å; L130-M280 HydrophobicContact CD1-CB 4.3Å; L130-M280 HydrophobicContact CD1-CG 4.11Å; L130-K284 HydrophobicContact CD1-CD 3.9Å
131	T	98.9	Very high	98.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-41.5	175.8	-56.5	0	0	0	0	111.3	I103 Q127 A128 E129 R134 L135 I160 G256 I258 F279 M280	I103-T131 HydrophobicContact CD1-CG2 4.27Å; I103-T131 HydrophobicContact CG2-CG2 4.02Å; Q127-T131 PolarHBondContact O-N 2.8Å; Q127-T131 PolarHBondContact O-OG1 3.16Å; A128-T131 PolarHBondContact O-N 3.14Å; E129-T131 VanDerWaalsContact C-N 3.32Å; E129-T131 PolarHBondContact O-N 2.77Å; T131-R134 PolarHBondContact O-N 3.09Å; T131-L135 HydrophobicContact CG2-CD1 4.19Å; T131-L135 WeakPolarHBondContact O-CG 3.18Å; T131-L135 PolarHBondContact O-N 3.43Å; T131-I160 HydrophobicContact CG2-CD1 3.74Å; T131-I160 HydrophobicContact CG2-CG1 4.49Å; T131-G256 WeakPolarHBondContact CG2-O 3.36Å; T131-G256 PolarHBondContact OG1-O 2.91Å; T131-I258 HydrophobicContact CG2-CD1 4.21Å; T131-I258 HydrophobicContact CG2-CG1 4.03Å; T131-F279 HydrophobicContact CG2-CZ 4.28Å; T131-F279 WeakPolarHBondContact OG1-CZ 3.36Å; T131-M280 VanDerWaalsContact OG1-CE 3.31Å; T131-M280 WeakPolarHBondContact OG1-CE 3.16Å
132	G	98.9	Very high	98.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-49.7	175.1	0	0	0	0	0	112.4	A128 E129 R134 L135 A136	A128-G132 PolarHBondContact O-N 3.42Å; E129-G132 PolarHBondContact O-N 3.02Å; G132-R134 VanDerWaalsContact C-N 3.31Å; G132-R134 PolarHBondContact O-N 3.45Å; G132-L135 PolarHBondContact O-N 3.3Å; G132-A136 PolarHBondContact O-N 2.89Å
133	L	98.9	Very high	98.7	Very high	87 Å²	87	53 Å²	53	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-44	174.7	-72.8	169.2	0	0	0	111.6	E129 A136 S137	E129-L133 HydrophobicContact CG-CD1 4.38Å; E129-L133 WeakPolarHBondContact O-CG 3.21Å; E129-L133 PolarHBondContact O-N 3.32Å; L133-A136 PolarHBondContact O-N 3.05Å; L133-S137 WeakPolarHBondContact O-CB 3.36Å; L133-S137 PolarHBondContact O-N 3.45Å
134	R	98.9	Very high	98.7	Very high	94 Å²	94	54.2 Å²	54.2	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-60.8	-48.5	178	177.6	57.2	176.3	161	-3.5	111.4	L130 T131 G132 S137 L138 I258 F279	L130-R134 WeakPolarHBondContact O-CB 3.16Å; L130-R134 PolarHBondContact O-N 2.86Å; T131-R134 PolarHBondContact O-N 3.09Å; G132-R134 VanDerWaalsContact C-N 3.31Å; G132-R134 PolarHBondContact O-N 3.45Å; R134-S137 PolarHBondContact O-N 3.33Å; R134-S137 PolarHBondContact O-OG 3.18Å; R134-L138 PolarHBondContact O-N 2.94Å; R134-I258 HydrophobicContact CB-CD1 4.37Å; R134-I258 HydrophobicContact CG-CD1 3.82Å; R134-F279 HydrophobicContact CB-CB 4.16Å; R134-F279 HydrophobicContact CB-CD1 4.02Å; R134-F279 HydrophobicContact CB-CD2 3.83Å; R134-F279 HydrophobicContact CB-CE1 4.36Å; R134-F279 HydrophobicContact CB-CE2 4.21Å; R134-F279 HydrophobicContact CB-CG 3.73Å; R134-F279 HydrophobicContact CB-CZ 4.45Å; R134-F279 HydrophobicContact CG-CB 4.09Å; R134-F279 HydrophobicContact CG-CD1 3.6Å; R134-F279 HydrophobicContact CG-CD2 4.34Å; R134-F279 HydrophobicContact CG-CE1 4.06Å; R134-F279 HydrophobicContact CG-CG 3.75Å
135	L	98.9	Very high	98.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-44.4	-179.7	-69.5	162.4	0	0	0	111.8	F101 I103 T131 G132 S137 L138 F142 I160 L164 I225 I258	F101-L135 HydrophobicContact CD1-CD2 4.38Å; I103-L135 HydrophobicContact CD1-CD1 3.54Å; I103-L135 HydrophobicContact CD1-CD2 4.28Å; I103-L135 HydrophobicContact CD1-CG 4.44Å; T131-L135 HydrophobicContact CG2-CD1 4.19Å; T131-L135 WeakPolarHBondContact O-CG 3.18Å; T131-L135 PolarHBondContact O-N 3.43Å; G132-L135 PolarHBondContact O-N 3.3Å; L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 3.18Å; L135-L138 HydrophobicContact CD2-CD1 4.46Å; L135-L138 WeakPolarHBondContact O-CB 3.41Å; L135-L138 PolarHBondContact O-N 2.81Å; L135-F142 HydrophobicContact CB-CE2 4.18Å; L135-F142 HydrophobicContact CB-CZ 4.23Å; L135-F142 HydrophobicContact CD2-CE1 4.43Å; L135-F142 HydrophobicContact CD2-CZ 3.9Å; L135-I160 HydrophobicContact CD1-CD1 4.49Å; L135-I160 HydrophobicContact CD1-CG2 3.71Å; L135-L164 HydrophobicContact CB-CD1 4.31Å; L135-L164 HydrophobicContact CB-CD2 4.43Å; L135-L164 HydrophobicContact CD1-CD1 4.39Å; L135-I225 HydrophobicContact CD1-CD1 4.15Å; L135-I225 HydrophobicContact CD2-CD1 4.41Å; L135-I258 HydrophobicContact CD2-CD1 4.05Å; L135-I258 HydrophobicContact CG-CD1 4.21Å
136	A	98.8	Very high	98.7	Very high	42 Å²	42	49 Å²	49	35%	0.347	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-38.5	176.9	0	0	0	0	0	112	G132 L133 L138 G139 H163 L164	G132-A136 PolarHBondContact O-N 2.89Å; L133-A136 PolarHBondContact O-N 3.05Å; A136-L138 PolarHBondContact O-N 2.66Å; A136-L138 VanDerWaalsContact O-N 3.13Å; A136-G139 PolarHBondContact O-N 3.16Å; A136-H163 HydrophobicContact CB-CB 4.13Å; A136-L164 HydrophobicContact CB-CD2 4.21Å
137	S	98.7	Very high	98.7	Very high	78 Å²	78	45.5 Å²	45.5	55%	0.545	25%	0.249	S	C	.	.	H	α-helix	trans	-65	-14.8	178.7	78.1	0	0	0	0	114.6	L133 R134 L135 G139	L133-S137 WeakPolarHBondContact O-CB 3.36Å; L133-S137 PolarHBondContact O-N 3.45Å; R134-S137 PolarHBondContact O-N 3.33Å; R134-S137 PolarHBondContact O-OG 3.18Å; L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 3.18Å; S137-G139 PolarHBondContact O-N 3.19Å
138	L	98.4	Very high	98.7	Very high	58 Å²	58	45.5 Å²	45.5	30%	0.304	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.3	178.3	-59	179.3	0	0	0	112.9	F101 R134 L135 A136 L140 F142	F101-L138 HydrophobicContact CE1-CD1 3.95Å; F101-L138 HydrophobicContact CZ-CD1 4.37Å; R134-L138 PolarHBondContact O-N 2.94Å; L135-L138 HydrophobicContact CD2-CD1 4.46Å; L135-L138 WeakPolarHBondContact O-CB 3.41Å; L135-L138 PolarHBondContact O-N 2.81Å; A136-L138 PolarHBondContact O-N 2.66Å; A136-L138 VanDerWaalsContact O-N 3.13Å; L138-L140 HydrophobicContact CB-CB 4.48Å; L138-L140 HydrophobicContact CB-CD1 3.84Å; L138-L140 HydrophobicContact CB-CG 3.8Å; L138-L140 HydrophobicContact CD1-CD1 3.97Å; L138-L140 PolarHBondContact O-N 2.68Å; L138-F142 HydrophobicContact CD1-CZ 4.35Å
139	G	97.7	Very high	98.7	Very high	73 Å²	73	46.9 Å²	46.9	75%	0.753	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	22.5	-178.2	0	0	0	0	0	113.7	A136 S137	A136-G139 PolarHBondContact O-N 3.16Å; S137-G139 PolarHBondContact O-N 3.19Å
140	L	98.1	Very high	98.7	Very high	53 Å²	53	44.2 Å²	44.2	28%	0.277	25%	0.246	S	C	.	.			trans	-95	139.7	-177.6	-60.1	174.9	0	0	0	111.2	F101 L138 F142 Y223	F101-L140 HydrophobicContact CE2-CD1 4.27Å; F101-L140 HydrophobicContact CZ-CD1 3.75Å; L138-L140 HydrophobicContact CB-CB 4.48Å; L138-L140 HydrophobicContact CB-CD1 3.84Å; L138-L140 HydrophobicContact CB-CG 3.8Å; L138-L140 HydrophobicContact CD1-CD1 3.97Å; L138-L140 PolarHBondContact O-N 2.68Å; L140-F142 HydrophobicContact CB-CE2 4.19Å; L140-F142 HydrophobicContact CB-CZ 4.18Å; L140-F142 HydrophobicContact CD1-CZ 4.31Å; L140-F142 PolarHBondContact O-N 2.95Å; L140-Y223 HydrophobicContact CB-CD1 4.32Å; L140-Y223 HydrophobicContact CB-CG 4.27Å; L140-Y223 HydrophobicContact CD1-CD1 3.66Å; L140-Y223 HydrophobicContact CD1-CE1 3.94Å; L140-Y223 HydrophobicContact CD1-CG 4.37Å; L140-Y223 HydrophobicContact CD2-CD1 4.02Å; L140-Y223 HydrophobicContact CD2-CE1 3.58Å; L140-Y223 HydrophobicContact CD2-CE2 4.37Å; L140-Y223 HydrophobicContact CG-CD1 4.2Å; L140-Y223 HydrophobicContact CG-CE1 4.25Å
141	K	98.1	Very high	98.7	Very high	182 Å²	182	43.9 Å²	43.9	79%	0.791	25%	0.246	S	C	*	.			trans	-84.9	91.9	170.9	-173	-177.3	177.5	-174.5	0	109.7
142	F	98.7	Very high	98.7	Very high	11 Å²	11	44.2 Å²	44.2	5%	0.048	25%	0.247	C	C	.	.			trans	-67.1	132.9	177.1	-65	-78.3	0	0	0	111.7	F101 L135 L138 L140 L164 V167 Y223 I225	F101-F142 HydrophobicContact CD2-CD1 4.47Å; F101-F142 AromaticContact CD2-CE1 3.74Å; F101-F142 HydrophobicContact CD2-CE1 3.74Å; F101-F142 AromaticContact CE2-CE1 3.78Å; F101-F142 HydrophobicContact CE2-CE1 3.78Å; F101-F142 HydrophobicContact CG-CE1 4.25Å; F101-F142 HydrophobicContact CZ-CE1 4.31Å; L135-F142 HydrophobicContact CB-CE2 4.18Å; L135-F142 HydrophobicContact CB-CZ 4.23Å; L135-F142 HydrophobicContact CD2-CE1 4.43Å; L135-F142 HydrophobicContact CD2-CZ 3.9Å; L138-F142 HydrophobicContact CD1-CZ 4.35Å; L140-F142 HydrophobicContact CB-CE2 4.19Å; L140-F142 HydrophobicContact CB-CZ 4.18Å; L140-F142 HydrophobicContact CD1-CZ 4.31Å; L140-F142 PolarHBondContact O-N 2.95Å; F142-L164 HydrophobicContact CD2-CD1 4.05Å; F142-L164 HydrophobicContact CD2-CD2 3.79Å; F142-L164 HydrophobicContact CE2-CD1 4.34Å; F142-L164 HydrophobicContact CE2-CD2 3.92Å; F142-V167 HydrophobicContact CB-CG1 4.16Å; F142-V167 HydrophobicContact CB-CG2 4.14Å; F142-Y223 CarbonylContact C-O 3.57Å; F142-Y223 WeakPolarHBondContact CA-O 3.32Å; F142-I225 HydrophobicContact CB-CD1 4.22Å; F142-I225 HydrophobicContact CD1-CD1 3.47Å; F142-I225 VanDerWaalsContact CD1-CD1 3.47Å; F142-I225 HydrophobicContact CD1-CG1 3.56Å; F142-I225 HydrophobicContact CD2-CD1 3.99Å; F142-I225 HydrophobicContact CE1-CD1 3.69Å; F142-I225 HydrophobicContact CE1-CG1 3.71Å; F142-I225 HydrophobicContact CE2-CD1 4.18Å; F142-I225 HydrophobicContact CG-CD1 3.61Å; F142-I225 HydrophobicContact CG-CG1 4.2Å; F142-I225 HydrophobicContact CZ-CD1 4.04Å; F142-I225 HydrophobicContact CZ-CG1 4.46Å
143	N	98.6	Very high	98.7	Very high	88 Å²	88	44.2 Å²	44.2	47%	0.471	25%	0.247	S	C	.	.			trans	-78.3	-39.7	-178.1	-57.4	85.6	0	0	0	111.9	S222 Y223	N143-S222 VanDerWaalsContact OD1-CA 3.23Å; N143-S222 WeakPolarHBondContact OD1-CA 3.26Å; N143-S222 WeakPolarHBondContact OD1-CB 3.46Å; N143-Y223 PolarHBondContact N-O 3.07Å; N143-Y223 PolarHBondContact OD1-N 3.28Å; N143-Y223 PolarHBondContact OD1-O 2.85Å
144	K	98.6	Very high	98.7	Very high	66 Å²	66	42.1 Å²	42.1	29%	0.287	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	156.8	-176.4	65.7	-170.7	-177.7	-159	0	112	V146 C168 E224 I225	K144-V146 HydrophobicContact CD-CG2 4.01Å; K144-V146 HydrophobicContact CG-CG2 4.19Å; K144-C168 CarbonylContact C-O 3.57Å; K144-C168 WeakPolarHBondContact CA-O 3.37Å; K144-E224 WeakPolarHBondContact CE-OE2 3.38Å; K144-E224 HydrophobicContact CG-CG 4.42Å; K144-E224 IonicContact NZ-OE2 3.66Å; K144-E224 PolarHBondContact NZ-OE2 3.13Å; K144-I225 PolarHBondContact O-N 3.39Å
145	I	98.9	Very high	98.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	109.5	166.7	-60.4	163.4	0	0	0	107.7	T157 L164 V167 C168 R169 V170 I225 I227	I145-T157 HydrophobicContact CG2-CG2 3.76Å; I145-L164 HydrophobicContact CD1-CD1 4.19Å; I145-V167 HydrophobicContact CD1-CB 4.37Å; I145-V167 HydrophobicContact CD1-CG1 4.12Å; I145-V167 HydrophobicContact CG1-CG1 3.85Å; I145-C168 PolarHBondContact N-O 3.24Å; I145-R169 HydrophobicContact CB-CG 4.44Å; I145-R169 CarbonylContact O-C 3.53Å; I145-R169 WeakPolarHBondContact O-CA 3.35Å; I145-V170 PolarHBondContact O-N 3.32Å; I145-I225 WeakPolarHBondContact CA-O 2.94Å; I145-I225 HydrophobicContact CB-CB 4.5Å; I145-I225 HydrophobicContact CG1-CB 4.05Å; I145-I225 HydrophobicContact CG1-CD1 4.09Å; I145-I225 HydrophobicContact CG1-CG2 4.27Å; I145-I225 HydrophobicContact CG2-CG2 4.08Å; I145-I227 HydrophobicContact CG2-CD1 3.73Å; I145-I227 HydrophobicContact CG2-CG1 4.31Å
146	V	98.9	Very high	98.7	Very high	3 Å²	3	40 Å²	40	2%	0.018	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133	169.9	-174.2	0	0	0	0	107.7	K144 V170 T172 L175 Y210 I225 F226 I227	K144-V146 HydrophobicContact CD-CG2 4.01Å; K144-V146 HydrophobicContact CG-CG2 4.19Å; V146-V170 CarbonylContact C-O 3.6Å; V146-V170 VanDerWaalsContact CA-O 3.31Å; V146-V170 WeakPolarHBondContact CA-O 3.44Å; V146-V170 HydrophobicContact CG2-CB 4.47Å; V146-T172 HydrophobicContact CG1-CG2 3.67Å; V146-L175 HydrophobicContact CG1-CD1 3.84Å; V146-Y210 HydrophobicContact CG1-CE1 4.14Å; V146-I225 PolarHBondContact N-O 3.2Å; V146-F226 HydrophobicContact CB-CD1 3.67Å; V146-F226 HydrophobicContact CB-CE1 3.75Å; V146-F226 HydrophobicContact CG1-CD1 4.14Å; V146-F226 HydrophobicContact CG1-CE1 4.2Å; V146-F226 HydrophobicContact CG2-CD1 4.24Å; V146-F226 HydrophobicContact CG2-CE1 3.81Å; V146-F226 HydrophobicContact CG2-CZ 4.42Å; V146-F226 CarbonylContact O-C 3.59Å; V146-F226 WeakPolarHBondContact O-CA 3.45Å; V146-I227 PolarHBondContact O-N 3.17Å
147	H	98.9	Very high	98.7	Very high	10 Å²	10	38 Å²	38	5%	0.046	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.5	-177.9	67.3	88.5	0	0	0	113	T157 V170 S171 T172 I227	H147-T157 HydrophobicContact CB-CG2 4.28Å; H147-T157 WeakPolarHBondContact CB-OG1 3.44Å; H147-V170 PolarHBondContact N-O 2.92Å; H147-S171 CarbonylContact O-C 3.57Å; H147-S171 WeakPolarHBondContact O-CA 3.17Å; H147-T172 PolarHBondContact O-N 2.88Å; H147-I227 CarbonylContact C-O 3.57Å; H147-I227 VanDerWaalsContact CA-O 3.26Å; H147-I227 WeakPolarHBondContact CA-O 3.49Å; H147-I227 HydrophobicContact CB-CB 4.02Å
148	S	98.9	Very high	98.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	147.2	170.5	-179.1	0	0	0	0	111.3	M150 L175 R176 I227 H229	S148-M150 PolarHBondContact O-N 3.46Å; S148-M150 PolarHBondContact OG-N 2.89Å; S148-L175 WeakPolarHBondContact CB-O 3.32Å; S148-L175 PolarHBondContact OG-O 3.49Å; S148-L175 VanDerWaalsContact OG-O 3.1Å; S148-R176 WeakPolarHBondContact OG-CA 3.4Å; S148-R176 PolarHBondContact OG-N 3.33Å; S148-I227 PolarHBondContact N-O 2.8Å; S148-H229 VanDerWaalsContact CB-NE2 3.26Å; S148-H229 WeakPolarHBondContact CB-NE2 3.1Å; S148-H229 PolarHBondContact OG-NE2 3.39Å
149	S	98.8	Very high	98.7	Very high	28 Å²	28	35.4 Å²	35.4	20%	0.196	20%	0.196	C	C	.	.	S	Bend	trans	-76.4	-1.8	172.9	63	0	0	0	0	114.8	T172 D173 R176	S149-T172 PolarHBondContact N-O 3.4Å; S149-D173 WeakPolarHBondContact CB-OD1 3.43Å; S149-D173 PolarHBondContact OG-OD1 3.03Å; S149-R176 WeakPolarHBondContact OG-CD 3.3Å; S149-R176 WeakPolarHBondContact OG-CG 3.28Å; S149-R176 PolarHBondContact OG-NH1 3.42Å
150	M	98.8	Very high	98.8	Very high	18 Å²	18	32 Å²	32	9%	0.089	16%	0.16	C	C	.	.	S	Bend	trans	-72.9	140.7	175.9	-72.7	-176.2	106.1	0	0	111.8	E115 S148 R152 A153 V154 R176 E177 H229	E115-M150 WeakPolarHBondContact OE1-CA 3.34Å; E115-M150 VanDerWaalsContact OE1-CB 3.24Å; E115-M150 WeakPolarHBondContact OE1-CB 3.45Å; E115-M150 WeakPolarHBondContact OE1-CG 3.27Å; S148-M150 PolarHBondContact O-N 3.46Å; S148-M150 PolarHBondContact OG-N 2.89Å; M150-R152 VanDerWaalsContact CE-NH2 3.32Å; M150-R152 PolarHBondContact O-N 2.74Å; M150-R152 PolarHBondContact SD-NH1 3.21Å; M150-R152 PolarHBondContact SD-NH2 2.79Å; M150-A153 WeakPolarHBondContact O-CA 3.43Å; M150-A153 WeakPolarHBondContact O-CB 3.34Å; M150-A153 PolarHBondContact O-N 3.41Å; M150-V154 PolarHBondContact O-N 2.86Å; M150-R176 HydrophobicContact CG-CB 4.2Å; M150-R176 HydrophobicContact CG-CG 4.02Å; M150-R176 HydrophobicContact SD-CB 4.08Å; M150-E177 HydrophobicContact SD-CB 3.86Å; M150-E177 PolarHBondContact SD-N 3.35Å; M150-H229 VanDerWaalsContact SD-CE1 3.59Å
151	T	98.8	Very high	98.8	Very high	29 Å²	29	30.6 Å²	30.6	18%	0.178	16%	0.155	C	C	.	.	H	α-helix	trans	-50.9	-51.8	-168.6	-54	0	0	0	0	113	E115 T119 A153 V154 E155	E115-T151 VanDerWaalsContact O-CB 3.28Å; E115-T151 WeakPolarHBondContact O-CB 3.49Å; E115-T151 PolarHBondContact O-OG1 2.87Å; E115-T151 PolarHBondContact OE1-N 3.41Å; T119-T151 HydrophobicContact CG2-CG2 3.87Å; T151-A153 VanDerWaalsContact C-N 3.26Å; T151-A153 PolarHBondContact O-N 3.39Å; T151-V154 WeakPolarHBondContact O-CB 3.46Å; T151-V154 PolarHBondContact O-N 2.83Å; T151-V154 VanDerWaalsContact O-N 3.11Å; T151-E155 PolarHBondContact O-N 2.81Å
152	R	98.8	Very high	98.8	Very high	7 Å²	7	29.2 Å²	29.2	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-56.2	-33.9	176.4	63.8	-164.1	-178.2	-79.6	0.3	114.7	H105 Y108 E115 L120 M150 T156 H229	H105-R152 HydrophobicContact CB-CB 4.45Å; H105-R152 HydrophobicContact CB-CG 4.16Å; H105-R152 PolarHBondContact NE2-NE 3.49Å; Y108-R152 HydrophobicContact CD1-CB 4.48Å; Y108-R152 HydrophobicContact CD2-CB 4.27Å; Y108-R152 HydrophobicContact CG-CB 3.93Å; Y108-R152 HydrophobicContact CG-CG 4.38Å; E115-R152 IonicContact OE1-NH1 3.82Å; E115-R152 PolarHBondContact OE1-NH1 2.8Å; L120-R152 HydrophobicContact CD2-CB 4.16Å; M150-R152 VanDerWaalsContact CE-NH2 3.32Å; M150-R152 PolarHBondContact O-N 2.74Å; M150-R152 PolarHBondContact SD-NH1 3.21Å; M150-R152 PolarHBondContact SD-NH2 2.79Å; R152-T156 WeakPolarHBondContact O-CB 3.33Å; R152-T156 PolarHBondContact O-N 2.99Å; R152-T156 VanDerWaalsContact O-N 3.13Å; R152-T156 PolarHBondContact O-OG1 2.8Å; R152-H229 PolarHBondContact NE-ND1 2.74Å; R152-H229 PolarHBondContact NH2-CE1 3.49Å; R152-H229 PolarHBondContact NH2-ND1 3.25Å
153	A	98.9	Very high	98.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-79.3	-36.3	177.2	0	0	0	0	0	111.6	H105 M150 T151 T157 I227	H105-A153 HydrophobicContact CB-CB 4.49Å; M150-A153 WeakPolarHBondContact O-CA 3.43Å; M150-A153 WeakPolarHBondContact O-CB 3.34Å; M150-A153 PolarHBondContact O-N 3.41Å; T151-A153 VanDerWaalsContact C-N 3.26Å; T151-A153 PolarHBondContact O-N 3.39Å; A153-T157 WeakPolarHBondContact O-CB 3.4Å; A153-T157 PolarHBondContact O-N 3.06Å; A153-T157 PolarHBondContact O-OG1 3.02Å; A153-I227 HydrophobicContact CB-CG2 4.48Å
154	V	98.9	Very high	98.8	Very high	43 Å²	43	27.1 Å²	27.1	26%	0.261	14%	0.137	S	C	.	.	H	α-helix	trans	-60.1	-52.2	172.6	176.3	0	0	0	0	110.1	M150 T151 T156 T157 D158	M150-V154 PolarHBondContact O-N 2.86Å; T151-V154 WeakPolarHBondContact O-CB 3.46Å; T151-V154 PolarHBondContact O-N 2.83Å; T151-V154 VanDerWaalsContact O-N 3.11Å; V154-T156 PolarHBondContact O-N 3.16Å; V154-T157 CarbonylContact O-C 3.54Å; V154-T157 WeakPolarHBondContact O-CA 3.42Å; V154-T157 VanDerWaalsContact O-CB 3.3Å; V154-T157 WeakPolarHBondContact O-CB 3.43Å; V154-T157 PolarHBondContact O-N 3.39Å; V154-D158 PolarHBondContact O-N 3.16Å
155	E	98.9	Very high	98.7	Very high	51 Å²	51	29.4 Å²	29.4	24%	0.238	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-38	179.8	-71.5	-171.1	176.1	0	0	112.9	T119 L120 T151 T157 D158 I159	T119-E155 VanDerWaalsContact CB-OE1 3.3Å; T119-E155 WeakPolarHBondContact CB-OE1 3.41Å; T119-E155 WeakPolarHBondContact CB-OE2 3.31Å; T119-E155 WeakPolarHBondContact CG2-OE1 3.44Å; L120-E155 WeakPolarHBondContact CB-OE2 3.5Å; L120-E155 HydrophobicContact CD1-CB 3.79Å; L120-E155 HydrophobicContact CG-CB 3.78Å; L120-E155 WeakPolarHBondContact CG-OE2 3.38Å; L120-E155 PolarHBondContact N-OE2 3.31Å; T151-E155 PolarHBondContact O-N 2.81Å; E155-T157 VanDerWaalsContact C-N 3.26Å; E155-T157 PolarHBondContact O-N 3.23Å; E155-D158 PolarHBondContact O-N 2.98Å; E155-I159 PolarHBondContact O-N 3.28Å; E155-I159 VanDerWaalsContact O-N 3.16Å
156	T	98.9	Very high	98.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-41.8	173	-58.8	0	0	0	0	110.2	S106 A128 R152 V154 I159 I160 I227	S106-T156 PolarHBondContact N-OG1 2.77Å; S106-T156 VanDerWaalsContact N-OG1 3.09Å; A128-T156 HydrophobicContact CB-CG2 4.09Å; R152-T156 WeakPolarHBondContact O-CB 3.33Å; R152-T156 PolarHBondContact O-N 2.99Å; R152-T156 VanDerWaalsContact O-N 3.13Å; R152-T156 PolarHBondContact O-OG1 2.8Å; V154-T156 PolarHBondContact O-N 3.16Å; T156-I159 PolarHBondContact O-N 3.42Å; T156-I160 HydrophobicContact CG2-CD1 3.79Å; T156-I160 HydrophobicContact CG2-CG1 4.45Å; T156-I160 WeakPolarHBondContact O-CB 3.39Å; T156-I160 WeakPolarHBondContact O-CG1 3.43Å; T156-I160 PolarHBondContact O-N 3.09Å; T156-I227 HydrophobicContact CG2-CG2 3.94Å
157	T	98.9	Very high	98.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.4	-42.1	177.2	-56.2	0	0	0	0	111.9	I145 H147 A153 V154 E155 I159 I160 S161 I227	I145-T157 HydrophobicContact CG2-CG2 3.76Å; H147-T157 HydrophobicContact CB-CG2 4.28Å; H147-T157 WeakPolarHBondContact CB-OG1 3.44Å; A153-T157 WeakPolarHBondContact O-CB 3.4Å; A153-T157 PolarHBondContact O-N 3.06Å; A153-T157 PolarHBondContact O-OG1 3.02Å; V154-T157 CarbonylContact O-C 3.54Å; V154-T157 WeakPolarHBondContact O-CA 3.42Å; V154-T157 VanDerWaalsContact O-CB 3.3Å; V154-T157 WeakPolarHBondContact O-CB 3.43Å; V154-T157 PolarHBondContact O-N 3.39Å; E155-T157 VanDerWaalsContact C-N 3.26Å; E155-T157 PolarHBondContact O-N 3.23Å; T157-I159 VanDerWaalsContact C-N 3.27Å; T157-I159 PolarHBondContact O-N 2.85Å; T157-I160 PolarHBondContact O-N 2.95Å; T157-S161 WeakPolarHBondContact O-CB 3.19Å; T157-S161 PolarHBondContact O-N 3.06Å; T157-S161 PolarHBondContact O-OG 2.89Å; T157-S161 VanDerWaalsContact O-OG 3.09Å; T157-I227 HydrophobicContact CG2-CD1 4.04Å; T157-I227 WeakPolarHBondContact OG1-CD1 3.45Å
158	D	98.9	Very high	98.5	Very high	62 Å²	62	38.2 Å²	38.2	33%	0.332	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-42.8	178.4	-70.7	-32.6	0	0	0	111.3	V154 E155 S161 R169	V154-D158 PolarHBondContact O-N 3.16Å; E155-D158 PolarHBondContact O-N 2.98Å; D158-S161 PolarHBondContact O-OG 3.16Å; D158-R169 IonicContact OD1-CZ 3.13Å; D158-R169 IonicContact OD1-NH1 2.83Å; D158-R169 PolarHBondContact OD1-NH1 3.36Å; D158-R169 IonicContact OD1-NH2 2.89Å; D158-R169 PolarHBondContact OD1-NH2 3.45Å
159	I	98.9	Very high	98.5	Very high	19 Å²	19	42.7 Å²	42.7	10%	0.097	25%	0.25	C	S	.	.	H	α-helix	trans	-70.4	-52.1	178.2	-64.1	169.1	0	0	0	111.1	L120 R125 A128 E129 E155 T156 T157 S161 K162	L120-I159 HydrophobicContact CD1-CD1 4.01Å; R125-I159 HydrophobicContact CB-CD1 3.81Å; R125-I159 HydrophobicContact CG-CD1 3.76Å; A128-I159 HydrophobicContact CB-CB 3.82Å; A128-I159 HydrophobicContact CB-CD1 3.9Å; A128-I159 HydrophobicContact CB-CG1 4.47Å; A128-I159 HydrophobicContact CB-CG2 3.74Å; E129-I159 HydrophobicContact CB-CG2 4.2Å; E129-I159 WeakPolarHBondContact OE2-CG2 3.33Å; E155-I159 PolarHBondContact O-N 3.28Å; E155-I159 VanDerWaalsContact O-N 3.16Å; T156-I159 PolarHBondContact O-N 3.42Å; T157-I159 VanDerWaalsContact C-N 3.27Å; T157-I159 PolarHBondContact O-N 2.85Å; I159-S161 PolarHBondContact O-N 2.72Å; I159-K162 WeakPolarHBondContact O-CB 3.3Å; I159-K162 PolarHBondContact O-N 2.89Å; I159-K162 VanDerWaalsContact O-N 3.16Å
160	I	98.9	Very high	98.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-39.4	-179.6	-71.8	176.3	0	0	0	111.4	I103 A128 T131 L135 T156 T157 K162 H163 L164 I227	I103-I160 HydrophobicContact CD1-CD1 4.3Å; I103-I160 HydrophobicContact CG2-CD1 4.25Å; A128-I160 WeakPolarHBondContact O-CG1 3.5Å; T131-I160 HydrophobicContact CG2-CD1 3.74Å; T131-I160 HydrophobicContact CG2-CG1 4.49Å; L135-I160 HydrophobicContact CD1-CD1 4.49Å; L135-I160 HydrophobicContact CD1-CG2 3.71Å; T156-I160 HydrophobicContact CG2-CD1 3.79Å; T156-I160 HydrophobicContact CG2-CG1 4.45Å; T156-I160 WeakPolarHBondContact O-CB 3.39Å; T156-I160 WeakPolarHBondContact O-CG1 3.43Å; T156-I160 PolarHBondContact O-N 3.09Å; T157-I160 PolarHBondContact O-N 2.95Å; I160-K162 PolarHBondContact O-N 2.86Å; I160-H163 PolarHBondContact O-N 2.84Å; I160-H163 VanDerWaalsContact O-N 3.09Å; I160-L164 HydrophobicContact CG2-CD1 4.05Å; I160-I227 HydrophobicContact CB-CD1 4.34Å; I160-I227 HydrophobicContact CD1-CD1 3.91Å; I160-I227 HydrophobicContact CG2-CD1 4.37Å
161	S	98.6	Very high	98.5	Very high	25 Å²	25	46.7 Å²	46.7	18%	0.175	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-22.4	-177.2	69.5	0	0	0	0	114.1	T157 D158 I159 H163 L164	T157-S161 WeakPolarHBondContact O-CB 3.19Å; T157-S161 PolarHBondContact O-N 3.06Å; T157-S161 PolarHBondContact O-OG 2.89Å; T157-S161 VanDerWaalsContact O-OG 3.09Å; D158-S161 PolarHBondContact O-OG 3.16Å; I159-S161 PolarHBondContact O-N 2.72Å; S161-H163 PolarHBondContact O-N 3.48Å; S161-L164 CarbonylContact O-C 3.49Å; S161-L164 PolarHBondContact O-N 2.8Å
162	K	98.7	Very high	98.5	Very high	153 Å²	153	46.1 Å²	46.1	67%	0.665	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-29.1	174.9	-64.9	171.4	-174.2	177.3	0	112.4	I159 I160	I159-K162 WeakPolarHBondContact O-CB 3.3Å; I159-K162 PolarHBondContact O-N 2.89Å; I159-K162 VanDerWaalsContact O-N 3.16Å; I160-K162 PolarHBondContact O-N 2.86Å
163	H	98.8	Very high	98.5	Very high	42 Å²	42	50.7 Å²	50.7	19%	0.194	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-10.8	178.6	-63.5	-81	0	0	0	113.1	E129 A136 I160 S161 P165	E129-H163 IonicContact OE1-CE1 2.73Å; E129-H163 PolarHBondContact OE1-CE1 3.33Å; E129-H163 IonicContact OE1-NE2 3.86Å; E129-H163 PolarHBondContact OE1-NE2 3.25Å; E129-H163 IonicContact OE2-CD2 2.94Å; E129-H163 IonicContact OE2-CE1 2.92Å; E129-H163 IonicContact OE2-NE2 2.75Å; E129-H163 PolarHBondContact OE2-NE2 2.95Å; A136-H163 HydrophobicContact CB-CB 4.13Å; I160-H163 PolarHBondContact O-N 2.84Å; I160-H163 VanDerWaalsContact O-N 3.09Å; S161-H163 PolarHBondContact O-N 3.48Å; H163-P165 VanDerWaalsContact C-CD 3.43Å; H163-P165 WeakPolarHBondContact O-CD 3.46Å
164	L	98.4	Very high	98.5	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.068	31%	0.309	C	S	.	.	S	Bend	trans	-125.1	64.1	-174.7	-59.1	178.6	0	0	0	110.3	L135 A136 F142 I145 I160 S161 V167 I225	L135-L164 HydrophobicContact CB-CD1 4.31Å; L135-L164 HydrophobicContact CB-CD2 4.43Å; L135-L164 HydrophobicContact CD1-CD1 4.39Å; A136-L164 HydrophobicContact CB-CD2 4.21Å; F142-L164 HydrophobicContact CD2-CD1 4.05Å; F142-L164 HydrophobicContact CD2-CD2 3.79Å; F142-L164 HydrophobicContact CE2-CD1 4.34Å; F142-L164 HydrophobicContact CE2-CD2 3.92Å; I145-L164 HydrophobicContact CD1-CD1 4.19Å; I160-L164 HydrophobicContact CG2-CD1 4.05Å; S161-L164 CarbonylContact O-C 3.49Å; S161-L164 PolarHBondContact O-N 2.8Å; L164-V167 HydrophobicContact CB-CB 4.48Å; L164-V167 HydrophobicContact CB-CG2 3.98Å; L164-V167 WeakPolarHBondContact O-CG2 3.27Å; L164-V167 PolarHBondContact O-N 3.42Å; L164-I225 HydrophobicContact CD1-CD1 3.45Å; L164-I225 VanDerWaalsContact CD1-CD1 3.45Å
165	P	97	Very high	98.5	Very high	113 Å²	113	50.7 Å²	50.7	73%	0.734	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	139	-174.3	27	-35.4	0	0	0	111.7	H163 V167	H163-P165 VanDerWaalsContact C-CD 3.43Å; H163-P165 WeakPolarHBondContact O-CD 3.46Å; P165-V167 VanDerWaalsContact C-N 3.3Å; P165-V167 PolarHBondContact O-N 3Å
166	G	96.1	Very high	98.5	Very high	91 Å²	91	51.7 Å²	51.7	94%	0.938	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-1.7	177.8	0	0	0	0	0	115.5
167	V	98.5	Very high	98.4	Very high	29 Å²	29	53.8 Å²	53.8	18%	0.176	31%	0.309	C	S	.	.			trans	-80.4	126	176.4	-175.7	0	0	0	0	110.5	F142 I145 L164 P165	F142-V167 HydrophobicContact CB-CG1 4.16Å; F142-V167 HydrophobicContact CB-CG2 4.14Å; I145-V167 HydrophobicContact CD1-CB 4.37Å; I145-V167 HydrophobicContact CD1-CG1 4.12Å; I145-V167 HydrophobicContact CG1-CG1 3.85Å; L164-V167 HydrophobicContact CB-CB 4.48Å; L164-V167 HydrophobicContact CB-CG2 3.98Å; L164-V167 WeakPolarHBondContact O-CG2 3.27Å; L164-V167 PolarHBondContact O-N 3.42Å; P165-V167 VanDerWaalsContact C-N 3.3Å; P165-V167 PolarHBondContact O-N 3Å
168	C	98.2	Very high	98.2	Very high	80 Å²	80	54.2 Å²	54.2	54%	0.541	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	137.2	-179.8	-177.9	0	0	0	0	111.7	K144 I145	K144-C168 CarbonylContact C-O 3.57Å; K144-C168 WeakPolarHBondContact CA-O 3.37Å; I145-C168 PolarHBondContact N-O 3.24Å
169	R	98.6	Very high	97.8	Very high	93 Å²	93	51.7 Å²	51.7	35%	0.351	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.5	179.5	-65.4	173.6	55.5	-179.3	-2.5	111	I145 D158	I145-R169 HydrophobicContact CB-CG 4.44Å; I145-R169 CarbonylContact O-C 3.53Å; I145-R169 WeakPolarHBondContact O-CA 3.35Å; D158-R169 IonicContact OD1-CZ 3.13Å; D158-R169 IonicContact OD1-NH1 2.83Å; D158-R169 PolarHBondContact OD1-NH1 3.36Å; D158-R169 IonicContact OD1-NH2 2.89Å; D158-R169 PolarHBondContact OD1-NH2 3.45Å
170	V	98.7	Very high	97.4	Very high	62 Å²	62	50.8 Å²	50.8	38%	0.376	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	114.9	179.9	-175.7	0	0	0	0	110	I145 V146 H147	I145-V170 PolarHBondContact O-N 3.32Å; V146-V170 CarbonylContact C-O 3.6Å; V146-V170 VanDerWaalsContact CA-O 3.31Å; V146-V170 WeakPolarHBondContact CA-O 3.44Å; V146-V170 HydrophobicContact CG2-CB 4.47Å; H147-V170 PolarHBondContact N-O 2.92Å
171	S	98.7	Very high	97	Very high	68 Å²	68	52.8 Å²	52.8	48%	0.476	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	144	172.5	-172.3	0	0	0	0	110.8	H147	H147-S171 CarbonylContact O-C 3.57Å; H147-S171 WeakPolarHBondContact O-CA 3.17Å
172	T	98.8	Very high	96.7	Very high	18 Å²	18	57.9 Å²	57.9	11%	0.11	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	141.4	177	-178.5	0	0	0	0	112.7	V146 H147 S149 L174 L175 Y210	V146-T172 HydrophobicContact CG1-CG2 3.67Å; H147-T172 PolarHBondContact O-N 2.88Å; S149-T172 PolarHBondContact N-O 3.4Å; T172-L174 PolarHBondContact OG1-N 2.67Å; T172-L175 HydrophobicContact CG2-CB 3.95Å; T172-L175 HydrophobicContact CG2-CD1 3.58Å; T172-L175 HydrophobicContact CG2-CG 3.66Å; T172-Y210 WeakPolarHBondContact CB-OH 3.31Å; T172-Y210 HydrophobicContact CG2-CE2 4.19Å; T172-Y210 PolarHBondContact OG1-OH 2.75Å; T172-Y210 VanDerWaalsContact OG1-OH 3.07Å
173	D	98.5	Very high	96.4	Very high	102 Å²	102	51 Å²	51	55%	0.545	30%	0.298	S	S	.	.	S	Bend	trans	-79.7	-20.4	174.5	-69.8	-32.3	0	0	0	113	S149 L175 R176	S149-D173 WeakPolarHBondContact CB-OD1 3.43Å; S149-D173 PolarHBondContact OG-OD1 3.03Å; D173-L175 PolarHBondContact O-N 2.85Å; D173-L175 VanDerWaalsContact O-N 3.15Å; D173-R176 HydrophobicContact CB-CG 4.5Å; D173-R176 WeakPolarHBondContact O-CB 3.16Å; D173-R176 VanDerWaalsContact O-CG 3.28Å; D173-R176 WeakPolarHBondContact O-CG 3.38Å; D173-R176 PolarHBondContact O-N 3.31Å; D173-R176 VanDerWaalsContact O-N 3.09Å
174	L	98.4	Very high	96.1	Very high	42 Å²	42	53 Å²	53	22%	0.22	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.1	178	-67.2	179.8	0	0	0	111.8	T172 R202 A205 A206 N209 Y210	T172-L174 PolarHBondContact OG1-N 2.67Å; L174-R202 HydrophobicContact CD2-CG 4.16Å; L174-R202 PolarHBondContact O-NH1 3.26Å; L174-R202 VanDerWaalsContact O-NH1 3.14Å; L174-A205 HydrophobicContact CD2-CB 4.32Å; L174-A206 HydrophobicContact CB-CB 3.89Å; L174-N209 HydrophobicContact CD1-CB 4.46Å; L174-N209 WeakPolarHBondContact CD1-ND2 3.35Å; L174-Y210 HydrophobicContact CB-CE2 4.25Å; L174-Y210 HydrophobicContact CD1-CE2 4.09Å
175	L	98.8	Very high	95.8	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	11.2	-178.8	-63.8	176.8	0	0	0	114.1	V146 S148 T172 D173 A206 Y210 F226 C228 H229 V232	V146-L175 HydrophobicContact CG1-CD1 3.84Å; S148-L175 WeakPolarHBondContact CB-O 3.32Å; S148-L175 PolarHBondContact OG-O 3.49Å; S148-L175 VanDerWaalsContact OG-O 3.1Å; T172-L175 HydrophobicContact CG2-CB 3.95Å; T172-L175 HydrophobicContact CG2-CD1 3.58Å; T172-L175 HydrophobicContact CG2-CG 3.66Å; D173-L175 PolarHBondContact O-N 2.85Å; D173-L175 VanDerWaalsContact O-N 3.15Å; L175-A206 HydrophobicContact CD2-CB 3.96Å; L175-Y210 HydrophobicContact CD1-CE2 4.47Å; L175-Y210 HydrophobicContact CD2-CD2 4.38Å; L175-Y210 HydrophobicContact CG-CE2 4.27Å; L175-F226 HydrophobicContact CD1-CD1 4.1Å; L175-C228 HydrophobicContact CB-CB 3.97Å; L175-H229 PolarHBondContact O-CD2 2.9Å; L175-H229 PolarHBondContact O-NE2 2.92Å; L175-V232 HydrophobicContact CD2-CG1 3.86Å
176	R	98.6	Very high	95.3	Very high	72 Å²	72	55 Å²	55	27%	0.272	33%	0.325	S	S	.	.	S	Bend	trans	-60.7	150.4	170.3	-64.5	178.2	69.3	78.6	0.4	110.5	S148 S149 M150 D173 R202 V232	S148-R176 WeakPolarHBondContact OG-CA 3.4Å; S148-R176 PolarHBondContact OG-N 3.33Å; S149-R176 WeakPolarHBondContact OG-CD 3.3Å; S149-R176 WeakPolarHBondContact OG-CG 3.28Å; S149-R176 PolarHBondContact OG-NH1 3.42Å; M150-R176 HydrophobicContact CG-CB 4.2Å; M150-R176 HydrophobicContact CG-CG 4.02Å; M150-R176 HydrophobicContact SD-CB 4.08Å; D173-R176 HydrophobicContact CB-CG 4.5Å; D173-R176 WeakPolarHBondContact O-CB 3.16Å; D173-R176 VanDerWaalsContact O-CG 3.28Å; D173-R176 WeakPolarHBondContact O-CG 3.38Å; D173-R176 PolarHBondContact O-N 3.31Å; D173-R176 VanDerWaalsContact O-N 3.09Å; R176-R202 PolarHBondContact O-NH1 3.2Å; R176-R202 PolarHBondContact O-NH2 3.25Å; R176-V232 WeakPolarHBondContact O-CG2 3.48Å
177	E	97.4	Very high	94.8	Very high	44 Å²	44	54 Å²	54	21%	0.206	30%	0.3	C	S	.	.			trans	-61.9	152.7	178.1	-171.3	58.9	-60.3	0	0	110.1	M150 R202 H229 A230 N231 V232	M150-E177 HydrophobicContact SD-CB 3.86Å; M150-E177 PolarHBondContact SD-N 3.35Å; E177-R202 PolarHBondContact O-NH2 3.05Å; E177-H229 HydrophobicContact CB-CB 3.74Å; E177-H229 HydrophobicContact CG-CB 3.91Å; E177-H229 PolarHBondContact N-CD2 2.82Å; E177-H229 WeakPolarHBondContact OE1-CB 3.35Å; E177-H229 WeakPolarHBondContact OE2-CB 3.44Å; E177-A230 PolarHBondContact OE2-N 3.38Å; E177-A230 VanDerWaalsContact OE2-N 3.1Å; E177-N231 WeakPolarHBondContact OE1-CB 3.16Å; E177-N231 PolarHBondContact OE1-N 3.49Å; E177-N231 PolarHBondContact OE2-N 2.92Å; E177-N231 VanDerWaalsContact OE2-N 3.12Å; E177-V232 PolarHBondContact OE1-N 2.96Å
178	G	93.9	Very high	93.4	Very high	9 Å²	9	57.8 Å²	57.8	9%	0.093	33%	0.327	C	S	.	.			trans	-172.4	177.1	178.4	0	0	0	0	0	112.6	P180 D199 N231	G178-P180 VanDerWaalsContact O-CD 3.28Å; G178-P180 WeakPolarHBondContact O-CD 3.44Å; G178-D199 WeakPolarHBondContact CA-OD2 3.3Å; G178-N231 VanDerWaalsContact O-CB 3.23Å; G178-N231 WeakPolarHBondContact O-CB 3.28Å; G178-N231 PolarHBondContact O-ND2 3.47Å
179	A	91.5	Very high	92	Very high	8 Å²	8	62 Å²	62	7%	0.066	34%	0.339	C	S	.	.			trans	-95.1	102.3	172.1	0	0	0	0	0	109.8	W190 V195 Y196 D199	A179-W190 HydrophobicContact CB-CZ2 3.76Å; A179-V195 HydrophobicContact CB-CG1 4.06Å; A179-Y196 HydrophobicContact CB-CD1 3.82Å; A179-Y196 HydrophobicContact CB-CE1 3.9Å; A179-D199 PolarHBondContact N-OD2 2.79Å; A179-D199 VanDerWaalsContact O-CB 3.3Å; A179-D199 WeakPolarHBondContact O-CB 3.26Å
180	P	89.9	Confident	90.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.336	C	S	.	.			trans	-64.7	-54.9	-174.9	22.6	-34.9	0	0	0	113.5	G178 G200 I203 N231 Y235 W248	G178-P180 VanDerWaalsContact O-CD 3.28Å; G178-P180 WeakPolarHBondContact O-CD 3.44Å; P180-G200 WeakPolarHBondContact O-CA 3.31Å; P180-I203 HydrophobicContact CB-CD1 4Å; P180-I203 HydrophobicContact CB-CG2 4.37Å; P180-N231 HydrophobicContact CG-CB 4.49Å; P180-Y235 HydrophobicContact CB-CD1 4.49Å; P180-Y235 HydrophobicContact CB-CD2 3.4Å; P180-Y235 HydrophobicContact CB-CE2 3.93Å; P180-Y235 HydrophobicContact CB-CG 3.69Å; P180-Y235 HydrophobicContact CG-CD2 4.01Å; P180-Y235 HydrophobicContact CG-CG 4.28Å; P180-W248 HydrophobicContact CG-CD2 4.05Å; P180-W248 HydrophobicContact CG-CG 4.39Å; P180-W248 HydrophobicContact CG-CH2 4.28Å; P180-W248 HydrophobicContact CG-CZ2 3.53Å
181	I	91.9	Very high	88.4	Confident	43 Å²	43	65.8 Å²	65.8	22%	0.221	35%	0.351	C	S	.	.	S	Bend	trans	-154.9	167.8	177.8	59	169.7	0	0	0	109.2	Y196 Y235 P245 E246 W248	I181-Y196 VanDerWaalsContact O-CE1 3.29Å; I181-Y196 WeakPolarHBondContact O-CE1 3.41Å; I181-Y235 HydrophobicContact CD1-CE2 4.39Å; I181-Y235 HydrophobicContact CG1-CE2 4.32Å; I181-Y235 HydrophobicContact CG2-CE2 4.34Å; I181-P245 HydrophobicContact CD1-CB 3.55Å; I181-P245 HydrophobicContact CD1-CG 3.62Å; I181-E246 HydrophobicContact CD1-CG 4.07Å; I181-W248 PolarHBondContact O-NE1 3.39Å
182	E	91.4	Very high	86.4	Confident	131 Å²	131	67 Å²	67	61%	0.612	36%	0.357	S	S	*	.			trans	-57.1	131.8	173.6	-167.6	174.3	-172.8	0	0	110.8
183	P	92.6	Very high	84.7	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.052	38%	0.382	C	S	.	.			trans	-81.9	155	-179.8	39.7	-41.5	0	0	0	111.3	P185 W190 E246 L249	P183-P185 CarbonylContact O-C 3.58Å; P183-W190 HydrophobicContact CB-CH2 4.12Å; P183-W190 HydrophobicContact CB-CZ3 3.74Å; P183-W190 VanDerWaalsContact CD-CH2 3.46Å; P183-W190 HydrophobicContact CG-CE3 3.74Å; P183-W190 HydrophobicContact CG-CH2 3.8Å; P183-W190 HydrophobicContact CG-CZ3 3.21Å; P183-E246 CarbonylContact C-O 3.58Å; P183-E246 WeakPolarHBondContact CA-O 3.47Å; P183-L249 HydrophobicContact CB-CB 4.04Å; P183-L249 HydrophobicContact CB-CD1 3.78Å; P183-L249 HydrophobicContact CB-CG 3.93Å; P183-L249 HydrophobicContact CG-CD1 4.01Å
184	D	91.7	Very high	83	Confident	84 Å²	84	71.2 Å²	71.2	45%	0.449	39%	0.385	S	S	.	.	S	Bend	trans	-126.9	118.9	164.2	175.9	50.3	0	0	0	109.7	E246 R250	D184-E246 HydrophobicContact CB-CB 3.85Å; D184-E246 PolarHBondContact N-O 3.15Å; D184-R250 VanDerWaalsContact O-CZ 3.25Å; D184-R250 PolarHBondContact O-NE 2.65Å; D184-R250 PolarHBondContact O-NH2 3.26Å; D184-R250 IonicContact OD2-NH2 3.34Å; D184-R250 PolarHBondContact OD2-NH2 2.94Å
185	P	92.9	Very high	81.7	Confident	75 Å²	75	72 Å²	72	49%	0.487	39%	0.391	S	S	.	.	S	Bend	cis	-72.2	156.6	4.1	30.8	-36.4	0	0	0	113.8	P183	P183-P185 CarbonylContact O-C 3.58Å
186	P	86.8	Confident	80.5	Confident	95 Å²	95	73.5 Å²	73.5	62%	0.617	40%	0.397	S	S	*	.			trans	-66.3	152.1	174.7	29	-35.1	0	0	0	111
187	V	84.2	Confident	79.7	Confident	69 Å²	69	77.6 Å²	77.6	42%	0.418	41%	0.413	S	S	.	.			trans	-119.5	138.6	174.7	-64.3	0	0	0	0	110.7	H189 W190 L249	V187-H189 PolarHBondContact O-N 3.08Å; V187-W190 HydrophobicContact CG2-CB 4.33Å; V187-W190 HydrophobicContact CG2-CE3 3.52Å; V187-W190 HydrophobicContact CG2-CZ3 4.25Å; V187-W190 PolarHBondContact O-N 3Å; V187-L249 HydrophobicContact CG1-CD1 3.88Å; V187-L249 HydrophobicContact CG2-CD1 3.87Å
188	S	69.9	Low	79.3	Confident	108 Å²	108	82.8 Å²	82.8	76%	0.755	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-8.7	-169.4	43	0	0	0	0	116.2
189	H	68.7	Low	79.2	Confident	170 Å²	170	83.8 Å²	83.8	79%	0.787	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	11.1	-170.9	-45.1	-56.6	0	0	0	113.5	V187	V187-H189 PolarHBondContact O-N 3.08Å
190	W	58.6	Low	79.4	Confident	73 Å²	73	83.8 Å²	83.8	28%	0.277	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-89.1	139.6	-171.9	-149.2	-61.2	0	0	0	114.6	A179 P183 V187 Y196 W248 L249	A179-W190 HydrophobicContact CB-CZ2 3.76Å; P183-W190 HydrophobicContact CB-CH2 4.12Å; P183-W190 HydrophobicContact CB-CZ3 3.74Å; P183-W190 VanDerWaalsContact CD-CH2 3.46Å; P183-W190 HydrophobicContact CG-CE3 3.74Å; P183-W190 HydrophobicContact CG-CH2 3.8Å; P183-W190 HydrophobicContact CG-CZ3 3.21Å; V187-W190 HydrophobicContact CG2-CB 4.33Å; V187-W190 HydrophobicContact CG2-CE3 3.52Å; V187-W190 HydrophobicContact CG2-CZ3 4.25Å; V187-W190 PolarHBondContact O-N 3Å; W190-Y196 AromaticContact CD1-CZ 3.79Å; W190-Y196 AromaticContact CE2-CE1 3.63Å; W190-Y196 AromaticContact CE2-CZ 3.65Å; W190-Y196 HydrophobicContact CH2-CE1 4.13Å; W190-Y196 HydrophobicContact CZ2-CD1 4.43Å; W190-Y196 AromaticContact CZ2-CE1 3.33Å; W190-Y196 HydrophobicContact CZ2-CE1 3.33Å; W190-Y196 AromaticContact CZ2-CZ 3.81Å; W190-Y196 WeakPolarHBondContact CZ2-OH 3.49Å; W190-Y196 AromaticContact NE1-CE1 3.58Å; W190-Y196 AromaticContact NE1-CZ 3.37Å; W190-Y196 PolarHBondContact NE1-OH 3.41Å; W190-W248 AromaticContact CH2-CE2 3.62Å; W190-W248 AromaticContact CH2-CH2 3.4Å; W190-W248 HydrophobicContact CH2-CH2 3.4Å; W190-W248 AromaticContact CH2-CZ2 2.89Å; W190-W248 HydrophobicContact CH2-CZ2 2.89Å; W190-W248 AromaticContact CZ2-CH2 3.91Å; W190-W248 HydrophobicContact CZ2-CH2 3.91Å; W190-W248 AromaticContact CZ2-CZ2 3.47Å; W190-W248 HydrophobicContact CZ2-CZ2 3.47Å; W190-W248 VanDerWaalsContact CZ2-CZ2 3.47Å; W190-W248 HydrophobicContact CZ3-CH2 4.01Å; W190-W248 AromaticContact CZ3-CZ2 3.81Å; W190-W248 HydrophobicContact CZ3-CZ2 3.81Å; W190-L249 HydrophobicContact CE3-CD1 4.06Å; W190-L249 HydrophobicContact CH2-CD1 4.46Å; W190-L249 HydrophobicContact CZ3-CD1 3.42Å; W190-L249 VanDerWaalsContact CZ3-CD1 3.42Å; W190-L249 HydrophobicContact CZ3-CG 3.91Å
191	K	62.2	Low	79.6	Confident	161 Å²	161	86.9 Å²	86.9	70%	0.7	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-74.5	168.6	-176.4	-79.1	-174.2	-179.7	-177.2	0	115.9
192	P	58.1	Low	79.9	Confident	92 Å²	92	87 Å²	87	60%	0.597	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-57.4	151.9	-166.2	-23.5	32.9	0	0	0	115.6	A194 V195	P192-A194 PolarHBondContact O-N 2.9Å; P192-V195 PolarHBondContact O-N 3.21Å; P192-V195 VanDerWaalsContact O-N 3.12Å
193	E	62.7	Low	80.2	Confident	137 Å²	137	80.8 Å²	80.8	64%	0.64	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-32.8	-178.8	-156.5	-175.9	160.3	0	0	114.1	V195 Y196 Y197	E193-V195 VanDerWaalsContact C-N 3.26Å; E193-V195 PolarHBondContact O-N 3.45Å; E193-Y196 WeakPolarHBondContact O-CD2 3.29Å; E193-Y196 PolarHBondContact O-N 3.05Å; E193-Y197 HydrophobicContact CG-CE2 4.21Å; E193-Y197 WeakPolarHBondContact O-CD2 3.47Å; E193-Y197 PolarHBondContact OE1-OH 3.43Å
194	A	61.7	Low	80.5	Confident	73 Å²	73	81.7 Å²	81.7	60%	0.603	44%	0.44	S	S	*	.	H	α-helix	trans	-58.9	-30.5	-179.3	0	0	0	0	0	114.4	P192 Y196 Y197	P192-A194 PolarHBondContact O-N 2.9Å; A194-Y196 VanDerWaalsContact C-N 3.28Å; A194-Y196 PolarHBondContact O-N 3.43Å; A194-Y197 PolarHBondContact O-N 3.21Å
195	V	72.3	Confident	80.8	Confident	57 Å²	57	79.3 Å²	79.3	35%	0.345	43%	0.431	S	S	.	.	H	α-helix	trans	-67.1	-31.7	-176.2	-177.6	0	0	0	0	111.4	A179 P192 E193 Y197 D199	A179-V195 HydrophobicContact CB-CG1 4.06Å; P192-V195 PolarHBondContact O-N 3.21Å; P192-V195 VanDerWaalsContact O-N 3.12Å; E193-V195 VanDerWaalsContact C-N 3.26Å; E193-V195 PolarHBondContact O-N 3.45Å; V195-Y197 VanDerWaalsContact C-N 3.33Å; V195-Y197 PolarHBondContact O-N 3.02Å; V195-D199 WeakPolarHBondContact O-CB 3.31Å; V195-D199 PolarHBondContact O-N 3.37Å
196	Y	73.9	Confident	81	Confident	34 Å²	34	75.7 Å²	75.7	13%	0.133	41%	0.408	C	S	.	.	H	α-helix	trans	-68.8	-30.1	-179.1	-61.1	-69.9	0	0	0	113.4	A179 I181 W190 E193 A194 G200	A179-Y196 HydrophobicContact CB-CD1 3.82Å; A179-Y196 HydrophobicContact CB-CE1 3.9Å; I181-Y196 VanDerWaalsContact O-CE1 3.29Å; I181-Y196 WeakPolarHBondContact O-CE1 3.41Å; W190-Y196 AromaticContact CD1-CZ 3.79Å; W190-Y196 AromaticContact CE2-CE1 3.63Å; W190-Y196 AromaticContact CE2-CZ 3.65Å; W190-Y196 HydrophobicContact CH2-CE1 4.13Å; W190-Y196 HydrophobicContact CZ2-CD1 4.43Å; W190-Y196 AromaticContact CZ2-CE1 3.33Å; W190-Y196 HydrophobicContact CZ2-CE1 3.33Å; W190-Y196 AromaticContact CZ2-CZ 3.81Å; W190-Y196 WeakPolarHBondContact CZ2-OH 3.49Å; W190-Y196 AromaticContact NE1-CE1 3.58Å; W190-Y196 AromaticContact NE1-CZ 3.37Å; W190-Y196 PolarHBondContact NE1-OH 3.41Å; E193-Y196 WeakPolarHBondContact O-CD2 3.29Å; E193-Y196 PolarHBondContact O-N 3.05Å; A194-Y196 VanDerWaalsContact C-N 3.28Å; A194-Y196 PolarHBondContact O-N 3.43Å; Y196-G200 WeakPolarHBondContact O-CA 3.16Å; Y196-G200 PolarHBondContact O-N 3.5Å
197	Y	81.4	Confident	81.6	Confident	159 Å²	159	71.4 Å²	71.4	62%	0.624	38%	0.38	S	S	*	.	H	α-helix	trans	-68.1	-44.6	-175.8	-68.9	-79.5	0	0	0	111.7	E193 A194 V195 A201	E193-Y197 HydrophobicContact CG-CE2 4.21Å; E193-Y197 WeakPolarHBondContact O-CD2 3.47Å; E193-Y197 PolarHBondContact OE1-OH 3.43Å; A194-Y197 PolarHBondContact O-N 3.21Å; V195-Y197 VanDerWaalsContact C-N 3.33Å; V195-Y197 PolarHBondContact O-N 3.02Å; Y197-A201 VanDerWaalsContact O-CB 3.23Å; Y197-A201 WeakPolarHBondContact O-CB 3.36Å; Y197-A201 PolarHBondContact O-N 3.38Å
198	E	88.6	Confident	82.3	Confident	152 Å²	152	73.1 Å²	73.1	71%	0.71	38%	0.379	S	S	*	.	H	α-helix	trans	-75.4	-52.4	179.3	-172.3	178.6	178.6	0	0	111.4	R202	E198-R202 WeakPolarHBondContact O-CB 3.41Å; E198-R202 PolarHBondContact O-N 3.3Å; E198-R202 VanDerWaalsContact O-N 3.08Å
199	D	93.2	Very high	83.6	Confident	30 Å²	30	72.4 Å²	72.4	16%	0.16	37%	0.367	C	S	.	.	H	α-helix	trans	-68.2	-40.4	-177.5	-78.7	-20.6	0	0	0	112.1	G178 A179 V195 R202 I203	G178-D199 WeakPolarHBondContact CA-OD2 3.3Å; A179-D199 PolarHBondContact N-OD2 2.79Å; A179-D199 VanDerWaalsContact O-CB 3.3Å; A179-D199 WeakPolarHBondContact O-CB 3.26Å; V195-D199 WeakPolarHBondContact O-CB 3.31Å; V195-D199 PolarHBondContact O-N 3.37Å; D199-R202 PolarHBondContact O-N 3.13Å; D199-R202 IonicContact OD1-CZ 2.88Å; D199-R202 IonicContact OD1-NE 3.73Å; D199-R202 IonicContact OD1-NH2 2.86Å; D199-R202 PolarHBondContact OD1-NH2 2.68Å; D199-I203 WeakPolarHBondContact O-CB 3.16Å; D199-I203 WeakPolarHBondContact O-CG1 3.46Å; D199-I203 PolarHBondContact O-N 3.26Å
200	G	93.9	Very high	85	Confident	9 Å²	9	66.3 Å²	66.3	9%	0.093	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-47.4	177.4	0	0	0	0	0	112.7	P180 Y196 R202 I203 E204	P180-G200 WeakPolarHBondContact O-CA 3.31Å; Y196-G200 WeakPolarHBondContact O-CA 3.16Å; Y196-G200 PolarHBondContact O-N 3.5Å; G200-R202 VanDerWaalsContact C-N 3.32Å; G200-R202 PolarHBondContact O-N 2.87Å; G200-I203 PolarHBondContact O-N 3.04Å; G200-E204 WeakPolarHBondContact O-CB 3.39Å; G200-E204 PolarHBondContact O-N 2.9Å
201	A	95.3	Very high	86.9	Confident	65 Å²	65	62.9 Å²	62.9	54%	0.537	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-42.7	175.9	0	0	0	0	0	111.6	Y197 A205	Y197-A201 VanDerWaalsContact O-CB 3.23Å; Y197-A201 WeakPolarHBondContact O-CB 3.36Å; Y197-A201 PolarHBondContact O-N 3.38Å; A201-A205 VanDerWaalsContact O-CB 3.3Å; A201-A205 WeakPolarHBondContact O-CB 3.42Å; A201-A205 PolarHBondContact O-N 3.45Å
202	R	97.8	Very high	88.7	Confident	45 Å²	45	56.4 Å²	56.4	17%	0.17	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-43.4	178.5	-178.9	176.6	54.7	74.2	-6.4	112.6	L174 R176 E177 E198 D199 G200 A205 A206	L174-R202 HydrophobicContact CD2-CG 4.16Å; L174-R202 PolarHBondContact O-NH1 3.26Å; L174-R202 VanDerWaalsContact O-NH1 3.14Å; R176-R202 PolarHBondContact O-NH1 3.2Å; R176-R202 PolarHBondContact O-NH2 3.25Å; E177-R202 PolarHBondContact O-NH2 3.05Å; E198-R202 WeakPolarHBondContact O-CB 3.41Å; E198-R202 PolarHBondContact O-N 3.3Å; E198-R202 VanDerWaalsContact O-N 3.08Å; D199-R202 PolarHBondContact O-N 3.13Å; D199-R202 IonicContact OD1-CZ 2.88Å; D199-R202 IonicContact OD1-NE 3.73Å; D199-R202 IonicContact OD1-NH2 2.86Å; D199-R202 PolarHBondContact OD1-NH2 2.68Å; G200-R202 VanDerWaalsContact C-N 3.32Å; G200-R202 PolarHBondContact O-N 2.87Å; R202-A205 WeakPolarHBondContact O-CB 3.39Å; R202-A205 PolarHBondContact O-N 3.13Å; R202-A206 PolarHBondContact O-N 3.28Å
203	I	98.1	Very high	90.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.8	-38.8	-179.7	-66	168.5	0	0	0	110.7	P180 D199 G200 A205 A206 F207 V232 Y235	P180-I203 HydrophobicContact CB-CD1 4Å; P180-I203 HydrophobicContact CB-CG2 4.37Å; D199-I203 WeakPolarHBondContact O-CB 3.16Å; D199-I203 WeakPolarHBondContact O-CG1 3.46Å; D199-I203 PolarHBondContact O-N 3.26Å; G200-I203 PolarHBondContact O-N 3.04Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A206 WeakPolarHBondContact O-CB 3.14Å; I203-A206 PolarHBondContact O-N 3.45Å; I203-F207 PolarHBondContact O-N 3.04Å; I203-V232 HydrophobicContact CD1-CG2 4.13Å; I203-V232 HydrophobicContact CG1-CG2 4.18Å; I203-V232 HydrophobicContact CG2-CG1 4.44Å; I203-Y235 HydrophobicContact CG2-CD1 3.43Å; I203-Y235 VanDerWaalsContact CG2-CD1 3.43Å; I203-Y235 HydrophobicContact CG2-CE1 4.04Å; I203-Y235 HydrophobicContact CG2-CG 3.95Å
204	E	98	Very high	92.2	Very high	28 Å²	28	46.1 Å²	46.1	13%	0.131	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-36.6	171.9	177.1	65.4	-175.2	0	0	111.3	G200 A206 F207 R208 Y235 R239	G200-E204 WeakPolarHBondContact O-CB 3.39Å; G200-E204 PolarHBondContact O-N 2.9Å; E204-A206 VanDerWaalsContact C-N 3.34Å; E204-F207 WeakPolarHBondContact O-CB 3.4Å; E204-F207 PolarHBondContact O-N 3.43Å; E204-R208 WeakPolarHBondContact O-CG 3.48Å; E204-R208 PolarHBondContact O-N 3.12Å; E204-R208 IonicContact OE1-CZ 2.72Å; E204-R208 IonicContact OE1-NE 3.69Å; E204-R208 PolarHBondContact OE1-NE 3.32Å; E204-R208 IonicContact OE1-NH2 3.79Å; E204-R208 PolarHBondContact OE1-NH2 3.2Å; E204-Y235 HydrophobicContact CB-CE1 4.34Å; E204-Y235 PolarHBondContact OE2-OH 3.49Å; E204-Y235 VanDerWaalsContact OE2-OH 3.06Å; E204-R239 IonicContact OE1-CZ 2.87Å; E204-R239 IonicContact OE1-NE 2.83Å; E204-R239 IonicContact OE1-NH2 3.12Å; E204-R239 PolarHBondContact OE1-NH2 3.07Å; E204-R239 IonicContact OE2-CZ 3.19Å; E204-R239 IonicContact OE2-NE 3.97Å; E204-R239 PolarHBondContact OE2-NE 3.16Å; E204-R239 IonicContact OE2-NH2 3.61Å; E204-R239 PolarHBondContact OE2-NH2 3.33Å
205	A	98.1	Very high	93.8	Very high	33 Å²	33	46.3 Å²	46.3	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-40.1	171	0	0	0	0	0	111.6	L174 A201 R202 I203 R208 N209	L174-A205 HydrophobicContact CD2-CB 4.32Å; A201-A205 VanDerWaalsContact O-CB 3.3Å; A201-A205 WeakPolarHBondContact O-CB 3.42Å; A201-A205 PolarHBondContact O-N 3.45Å; R202-A205 WeakPolarHBondContact O-CB 3.39Å; R202-A205 PolarHBondContact O-N 3.13Å; I203-A205 VanDerWaalsContact C-N 3.32Å; A205-R208 PolarHBondContact O-N 2.93Å; A205-N209 VanDerWaalsContact O-CB 3.25Å; A205-N209 WeakPolarHBondContact O-CB 3.31Å; A205-N209 PolarHBondContact O-N 3.09Å; A205-N209 PolarHBondContact O-OD1 2.83Å
206	A	98.5	Very high	94.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-45.4	173	0	0	0	0	0	111.7	L174 L175 R202 I203 E204 N209 Y210	L174-A206 HydrophobicContact CB-CB 3.89Å; L175-A206 HydrophobicContact CD2-CB 3.96Å; R202-A206 PolarHBondContact O-N 3.28Å; I203-A206 WeakPolarHBondContact O-CB 3.14Å; I203-A206 PolarHBondContact O-N 3.45Å; E204-A206 VanDerWaalsContact C-N 3.34Å; A206-N209 PolarHBondContact O-N 3.19Å; A206-Y210 HydrophobicContact CB-CD2 4.35Å; A206-Y210 WeakPolarHBondContact O-CB 3.5Å; A206-Y210 VanDerWaalsContact O-CD2 3.25Å; A206-Y210 WeakPolarHBondContact O-CD2 3.47Å; A206-Y210 PolarHBondContact O-N 2.88Å
207	F	98.7	Very high	95.6	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-57.1	-52.5	175.2	172.4	-102.2	0	0	0	111	W62 I203 E204 N209 Y210 I211 I236 R239 A240	W62-F207 HydrophobicContact CE3-CE1 4.07Å; W62-F207 AromaticContact CE3-CZ 3.65Å; W62-F207 HydrophobicContact CE3-CZ 3.65Å; W62-F207 HydrophobicContact CH2-CZ 4.35Å; W62-F207 AromaticContact CZ3-CE1 3.92Å; W62-F207 HydrophobicContact CZ3-CE1 3.92Å; W62-F207 HydrophobicContact CZ3-CE2 4.05Å; W62-F207 AromaticContact CZ3-CZ 3.33Å; W62-F207 HydrophobicContact CZ3-CZ 3.33Å; I203-F207 PolarHBondContact O-N 3.04Å; E204-F207 WeakPolarHBondContact O-CB 3.4Å; E204-F207 PolarHBondContact O-N 3.43Å; F207-N209 VanDerWaalsContact C-N 3.33Å; F207-N209 PolarHBondContact O-N 2.7Å; F207-Y210 PolarHBondContact O-N 3.45Å; F207-I211 HydrophobicContact CD2-CB 3.72Å; F207-I211 HydrophobicContact CD2-CG1 4.04Å; F207-I211 HydrophobicContact CD2-CG2 3.97Å; F207-I211 HydrophobicContact CE2-CB 3.9Å; F207-I211 HydrophobicContact CE2-CG2 3.67Å; F207-I211 HydrophobicContact CG-CB 4.47Å; F207-I211 WeakPolarHBondContact O-CA 2.94Å; F207-I211 VanDerWaalsContact O-CB 3.27Å; F207-I211 WeakPolarHBondContact O-CB 3.36Å; F207-I211 PolarHBondContact O-N 2.88Å; F207-I236 HydrophobicContact CB-CG1 4.48Å; F207-I236 HydrophobicContact CD2-CG1 4.42Å; F207-I236 HydrophobicContact CD2-CG2 4.44Å; F207-R239 HydrophobicContact CD1-CB 4.35Å; F207-R239 HydrophobicContact CD2-CB 3.83Å; F207-R239 HydrophobicContact CE1-CB 4.13Å; F207-R239 HydrophobicContact CE2-CB 3.57Å; F207-R239 HydrophobicContact CG-CB 4.22Å; F207-R239 HydrophobicContact CZ-CB 3.73Å; F207-A240 HydrophobicContact CE2-CB 4.02Å
208	R	98.1	Very high	96.3	Very high	105 Å²	105	46.3 Å²	46.3	40%	0.396	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-36.3	-178.9	-69.5	178	-177.3	-81	-7.5	113.5	E204 A205	E204-R208 WeakPolarHBondContact O-CG 3.48Å; E204-R208 PolarHBondContact O-N 3.12Å; E204-R208 IonicContact OE1-CZ 2.72Å; E204-R208 IonicContact OE1-NE 3.69Å; E204-R208 PolarHBondContact OE1-NE 3.32Å; E204-R208 IonicContact OE1-NH2 3.79Å; E204-R208 PolarHBondContact OE1-NH2 3.2Å; A205-R208 PolarHBondContact O-N 2.93Å
209	N	97.9	Very high	96.7	Very high	94 Å²	94	44.8 Å²	44.8	50%	0.503	23%	0.228	S	C	.	.	H	α-helix	trans	-77	-33.6	-177.6	-74	0.6	0	0	0	112.7	L174 A205 A206 F207 H212	L174-N209 HydrophobicContact CD1-CB 4.46Å; L174-N209 WeakPolarHBondContact CD1-ND2 3.35Å; A205-N209 VanDerWaalsContact O-CB 3.25Å; A205-N209 WeakPolarHBondContact O-CB 3.31Å; A205-N209 PolarHBondContact O-N 3.09Å; A205-N209 PolarHBondContact O-OD1 2.83Å; A206-N209 PolarHBondContact O-N 3.19Å; F207-N209 VanDerWaalsContact C-N 3.33Å; F207-N209 PolarHBondContact O-N 2.7Å; N209-H212 PolarHBondContact O-NE2 2.9Å
210	Y	98.6	Very high	96.9	Very high	42 Å²	42	50.9 Å²	50.9	17%	0.165	26%	0.256	C	S	.	.	H	α-helix	trans	-111	-25.3	-171.5	-62.4	-56.3	0	0	0	114.1	R98 V146 T172 L174 L175 A206 F207 F226	R98-Y210 PolarHBondContact NH1-O 2.96Å; R98-Y210 PolarHBondContact NH2-O 3.17Å; V146-Y210 HydrophobicContact CG1-CE1 4.14Å; T172-Y210 WeakPolarHBondContact CB-OH 3.31Å; T172-Y210 HydrophobicContact CG2-CE2 4.19Å; T172-Y210 PolarHBondContact OG1-OH 2.75Å; T172-Y210 VanDerWaalsContact OG1-OH 3.07Å; L174-Y210 HydrophobicContact CB-CE2 4.25Å; L174-Y210 HydrophobicContact CD1-CE2 4.09Å; L175-Y210 HydrophobicContact CD1-CE2 4.47Å; L175-Y210 HydrophobicContact CD2-CD2 4.38Å; L175-Y210 HydrophobicContact CG-CE2 4.27Å; A206-Y210 HydrophobicContact CB-CD2 4.35Å; A206-Y210 WeakPolarHBondContact O-CB 3.5Å; A206-Y210 VanDerWaalsContact O-CD2 3.25Å; A206-Y210 WeakPolarHBondContact O-CD2 3.47Å; A206-Y210 PolarHBondContact O-N 2.88Å; F207-Y210 PolarHBondContact O-N 3.45Å; Y210-F226 AromaticContact CD1-CE1 3.83Å; Y210-F226 HydrophobicContact CD1-CE1 3.83Å; Y210-F226 HydrophobicContact CD1-CZ 4.47Å; Y210-F226 HydrophobicContact CD2-CE1 4.38Å; Y210-F226 HydrophobicContact CG-CD1 4.49Å; Y210-F226 AromaticContact CG-CE1 3.68Å; Y210-F226 HydrophobicContact CG-CE1 3.68Å; Y210-F226 HydrophobicContact CG-CZ 4.42Å
211	I	98.6	Very high	97.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.269	C	S	.	.	S	Bend	trans	-116.3	99.9	-171.1	-47	-62.5	0	0	0	108.9	W62 I100 F207 I236 A240 I263	W62-I211 HydrophobicContact CH2-CG2 4.18Å; W62-I211 WeakPolarHBondContact CH2-O 3.28Å; W62-I211 VanDerWaalsContact CZ3-O 3.3Å; W62-I211 WeakPolarHBondContact CZ3-O 3.38Å; I100-I211 HydrophobicContact CG2-CD1 3.93Å; F207-I211 HydrophobicContact CD2-CB 3.72Å; F207-I211 HydrophobicContact CD2-CG1 4.04Å; F207-I211 HydrophobicContact CD2-CG2 3.97Å; F207-I211 HydrophobicContact CE2-CB 3.9Å; F207-I211 HydrophobicContact CE2-CG2 3.67Å; F207-I211 HydrophobicContact CG-CB 4.47Å; F207-I211 WeakPolarHBondContact O-CA 2.94Å; F207-I211 VanDerWaalsContact O-CB 3.27Å; F207-I211 WeakPolarHBondContact O-CB 3.36Å; F207-I211 PolarHBondContact O-N 2.88Å; I211-I236 HydrophobicContact CD1-CG2 4.05Å; I211-I236 HydrophobicContact CG1-CD1 4.42Å; I211-I236 HydrophobicContact CG1-CG1 4.49Å; I211-I236 HydrophobicContact CG1-CG2 3.82Å; I211-A240 HydrophobicContact CG2-CB 4.21Å; I211-I263 HydrophobicContact CG2-CD1 3.93Å
212	H	98.3	Very high	97.3	Very high	24 Å²	24	50.9 Å²	50.9	11%	0.111	25%	0.245	C	C	.	.	S	Bend	trans	-164.9	171	-178.6	57.6	79.4	0	0	0	109.9	D63 R65 R98 N209	D63-H212 HydrophobicContact CB-CB 3.86Å; R65-H212 VanDerWaalsContact CZ-CE1 3.47Å; R65-H212 VanDerWaalsContact CZ-ND1 3.34Å; R65-H212 VanDerWaalsContact NE-CG 3.35Å; R65-H212 PolarHBondContact NE-ND1 3.42Å; R65-H212 PolarHBondContact NH2-CE1 3.13Å; R65-H212 PolarHBondContact NH2-NE2 2.74Å; R98-H212 WeakPolarHBondContact CD-O 3.5Å; R98-H212 PolarHBondContact NH1-O 2.78Å; N209-H212 PolarHBondContact O-NE2 2.9Å
213	R	97.7	Very high	97.3	Very high	11 Å²	11	51.4 Å²	51.4	4%	0.042	25%	0.247	C	C	.	.	S	Bend	trans	-62.3	159.6	172.7	71.5	-168.6	63.3	-165.4	-3.9	112.4	S60 D63 R65 A94 I263	S60-R213 PolarHBondContact O-NH2 3.39Å; D63-R213 IonicContact OD1-CZ 2.98Å; D63-R213 IonicContact OD1-NE 3.74Å; D63-R213 PolarHBondContact OD1-NE 3Å; D63-R213 VanDerWaalsContact OD1-NE 3.12Å; D63-R213 IonicContact OD1-NH2 3.89Å; D63-R213 PolarHBondContact OD1-NH2 2.86Å; D63-R213 WeakPolarHBondContact OD2-CB 3.2Å; D63-R213 WeakPolarHBondContact OD2-CG 3.31Å; D63-R213 IonicContact OD2-CZ 3.83Å; D63-R213 PolarHBondContact OD2-N 3.11Å; D63-R213 IonicContact OD2-NE 2.61Å; D63-R213 PolarHBondContact OD2-NE 3.22Å; D63-R213 IonicContact OD2-NH2 2.91Å; R65-R213 HydrophobicContact CB-CG 3.77Å; A94-R213 HydrophobicContact CB-CB 4.4Å; A94-R213 HydrophobicContact CB-CG 4.16Å; R213-I263 HydrophobicContact CB-CG2 4.45Å
214	A	97.3	Very high	97.4	Very high	3 Å²	3	51.7 Å²	51.7	3%	0.025	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-51.2	147.1	177.1	0	0	0	0	0	112.3	A94 A96 R98 Q218	A94-A214 HydrophobicContact CB-CB 4.3Å; A94-A214 WeakPolarHBondContact CB-O 3.45Å; A96-A214 HydrophobicContact CB-CB 4.08Å; A96-A214 WeakPolarHBondContact O-CB 3.47Å; R98-A214 HydrophobicContact CG-CB 4.04Å; A214-Q218 HydrophobicContact CB-CB 4.27Å; A214-Q218 HydrophobicContact CB-CG 4.47Å
215	D	94.5	Very high	97.4	Very high	76 Å²	76	50.4 Å²	50.4	41%	0.406	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-61	145.8	168.3	-165.8	-67.9	0	0	0	108.8	K217 Q218	D215-K217 PolarHBondContact O-N 2.92Å; D215-K217 VanDerWaalsContact O-N 3.13Å; D215-K217 WeakPolarHBondContact OD1-CB 3.39Å; D215-K217 PolarHBondContact OD1-N 3.42Å; D215-Q218 WeakPolarHBondContact O-CB 3.37Å; D215-Q218 PolarHBondContact O-N 3.36Å
216	A	91.9	Very high	97.5	Very high	24 Å²	24	49 Å²	49	20%	0.198	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.6	179.4	0	0	0	0	0	112.5	H91 Q218	H91-A216 VanDerWaalsContact O-CB 3.31Å; H91-A216 WeakPolarHBondContact O-CB 3.48Å; A216-Q218 VanDerWaalsContact C-N 3.33Å
217	K	93.8	Very high	97.5	Very high	183 Å²	183	49 Å²	49	80%	0.796	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-10.7	175.5	-61	178.7	-178.2	179.1	0	114.1	D215 E219	D215-K217 PolarHBondContact O-N 2.92Å; D215-K217 VanDerWaalsContact O-N 3.13Å; D215-K217 WeakPolarHBondContact OD1-CB 3.39Å; D215-K217 PolarHBondContact OD1-N 3.42Å; K217-E219 PolarHBondContact O-N 2.92Å
218	Q	96.3	Very high	97.5	Very high	44 Å²	44	48.8 Å²	48.8	21%	0.206	23%	0.229	C	C	.	.			trans	-81.5	112.8	179.3	-178.1	-176.3	-27.9	0	0	109.6	A96 A214 D215 A216 E220 S222	A96-Q218 HydrophobicContact CB-CG 3.93Å; A214-Q218 HydrophobicContact CB-CB 4.27Å; A214-Q218 HydrophobicContact CB-CG 4.47Å; D215-Q218 WeakPolarHBondContact O-CB 3.37Å; D215-Q218 PolarHBondContact O-N 3.36Å; A216-Q218 VanDerWaalsContact C-N 3.33Å; Q218-E220 VanDerWaalsContact CG-O 3.3Å; Q218-E220 WeakPolarHBondContact CG-O 3.46Å; Q218-E220 PolarHBondContact NE2-O 3.3Å; Q218-S222 VanDerWaalsContact NE2-CB 3.3Å; Q218-S222 PolarHBondContact NE2-OG 3.41Å
219	E	95.4	Very high	97.5	Very high	120 Å²	120	43.8 Å²	43.8	56%	0.561	21%	0.21	S	C	*	.			trans	-91.5	-23.1	-176.6	-59.1	-61.8	152.7	0	0	113.7	K95 K217	K95-E219 WeakPolarHBondContact CD-OE2 3.5Å; K95-E219 IonicContact NZ-OE1 3.14Å; K95-E219 PolarHBondContact NZ-OE1 3.39Å; K95-E219 IonicContact NZ-OE2 3.79Å; K95-E219 PolarHBondContact NZ-OE2 2.93Å; K217-E219 PolarHBondContact O-N 2.92Å
220	E	97.9	Very high	97.5	Very high	157 Å²	157	39.5 Å²	39.5	73%	0.734	19%	0.188	S	C	*	.	S	Bend	trans	-117.7	152.6	-177.5	-64.4	-177.6	179	0	0	112.3	A96 Q218	A96-E220 VanDerWaalsContact CB-C 3.49Å; A96-E220 WeakPolarHBondContact CB-O 3.45Å; Q218-E220 VanDerWaalsContact CG-O 3.3Å; Q218-E220 WeakPolarHBondContact CG-O 3.46Å; Q218-E220 PolarHBondContact NE2-O 3.3Å
221	D	98.6	Very high	97.5	Very high	71 Å²	71	38.9 Å²	38.9	38%	0.38	19%	0.188	S	C	.	.			trans	-57.9	138.3	173	-75.3	-1.8	0	0	0	111.1	T97	T97-D221 WeakPolarHBondContact CB-OD1 3.23Å; T97-D221 PolarHBondContact N-OD1 2.9Å; T97-D221 VanDerWaalsContact O-CA 3.25Å; T97-D221 WeakPolarHBondContact O-CA 3.42Å
222	S	98.8	Very high	97.5	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.028	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.5	179.4	62.9	0	0	0	0	112.5	T97 R98 H99 N143 Q218 E224	T97-S222 PolarHBondContact O-N 3.47Å; R98-S222 WeakPolarHBondContact CG-OG 3.2Å; H99-S222 WeakPolarHBondContact CA-O 3.36Å; H99-S222 VanDerWaalsContact CB-O 3.26Å; H99-S222 WeakPolarHBondContact CB-O 3.15Å; H99-S222 PolarHBondContact N-O 3.21Å; N143-S222 VanDerWaalsContact OD1-CA 3.23Å; N143-S222 WeakPolarHBondContact OD1-CA 3.26Å; N143-S222 WeakPolarHBondContact OD1-CB 3.46Å; Q218-S222 VanDerWaalsContact NE2-CB 3.3Å; Q218-S222 PolarHBondContact NE2-OG 3.41Å; S222-E224 PolarHBondContact OG-OE1 2.9Å
223	Y	98.9	Very high	97.5	Very high	56 Å²	56	37.8 Å²	37.8	22%	0.22	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	107.9	172.4	-54.6	-88	0	0	0	108.2	H99 F101 L140 F142 N143	H99-Y223 HydrophobicContact CB-CD1 3.53Å; H99-Y223 HydrophobicContact CB-CE1 4Å; H99-Y223 HydrophobicContact CB-CG 4.31Å; H99-Y223 AromaticContact CD2-CD1 3.73Å; H99-Y223 AromaticContact CD2-CE1 3.3Å; H99-Y223 WeakPolarHBondContact CD2-CE1 3.25Å; H99-Y223 AromaticContact CD2-CZ 3.79Å; H99-Y223 AromaticContact CG-CD1 3.8Å; H99-Y223 AromaticContact CG-CE1 3.71Å; H99-Y223 AromaticContact NE2-CE1 3.99Å; H99-Y223 WeakPolarHBondContact O-CA 3.25Å; F101-Y223 HydrophobicContact CE2-CD1 4.08Å; L140-Y223 HydrophobicContact CB-CD1 4.32Å; L140-Y223 HydrophobicContact CB-CG 4.27Å; L140-Y223 HydrophobicContact CD1-CD1 3.66Å; L140-Y223 HydrophobicContact CD1-CE1 3.94Å; L140-Y223 HydrophobicContact CD1-CG 4.37Å; L140-Y223 HydrophobicContact CD2-CD1 4.02Å; L140-Y223 HydrophobicContact CD2-CE1 3.58Å; L140-Y223 HydrophobicContact CD2-CE2 4.37Å; L140-Y223 HydrophobicContact CG-CD1 4.2Å; L140-Y223 HydrophobicContact CG-CE1 4.25Å; F142-Y223 CarbonylContact C-O 3.57Å; F142-Y223 WeakPolarHBondContact CA-O 3.32Å; N143-Y223 PolarHBondContact N-O 3.07Å; N143-Y223 PolarHBondContact OD1-N 3.28Å; N143-Y223 PolarHBondContact OD1-O 2.85Å
224	E	98.9	Very high	97.6	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.028	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.7	-169.6	-62	173.9	-124.3	0	0	110.1	R98 H99 I100 F101 K144 S222 F226	R98-E224 IonicContact CZ-OE1 2.74Å; R98-E224 IonicContact CZ-OE2 3.85Å; R98-E224 IonicContact NE-OE1 3.05Å; R98-E224 PolarHBondContact NE-OE1 3.48Å; R98-E224 IonicContact NE-OE2 3.44Å; R98-E224 VanDerWaalsContact NH2-CD 3.3Å; R98-E224 IonicContact NH2-OE1 2.95Å; R98-E224 PolarHBondContact NH2-OE1 2.84Å; R98-E224 VanDerWaalsContact NH2-OE1 3.14Å; R98-E224 IonicContact NH2-OE2 3.46Å; R98-E224 PolarHBondContact NH2-OE2 2.7Å; H99-E224 PolarHBondContact O-N 3.3Å; I100-E224 HydrophobicContact CD1-CB 4.24Å; F101-E224 PolarHBondContact N-O 3.29Å; K144-E224 WeakPolarHBondContact CE-OE2 3.38Å; K144-E224 HydrophobicContact CG-CG 4.42Å; K144-E224 IonicContact NZ-OE2 3.66Å; K144-E224 PolarHBondContact NZ-OE2 3.13Å; S222-E224 PolarHBondContact OG-OE1 2.9Å; E224-F226 HydrophobicContact CB-CE2 3.7Å; E224-F226 HydrophobicContact CB-CZ 4.34Å
225	I	98.9	Very high	97.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.1	178.2	-67.4	164	0	0	0	109.6	F101 I103 L135 F142 K144 I145 V146 L164 I227	F101-I225 HydrophobicContact CB-CG1 4.14Å; F101-I225 CarbonylContact O-C 3.57Å; F101-I225 WeakPolarHBondContact O-CA 3.19Å; I103-I225 HydrophobicContact CD1-CG2 3.63Å; I103-I225 HydrophobicContact CG1-CG2 4.38Å; L135-I225 HydrophobicContact CD1-CD1 4.15Å; L135-I225 HydrophobicContact CD2-CD1 4.41Å; F142-I225 HydrophobicContact CB-CD1 4.22Å; F142-I225 HydrophobicContact CD1-CD1 3.47Å; F142-I225 VanDerWaalsContact CD1-CD1 3.47Å; F142-I225 HydrophobicContact CD1-CG1 3.56Å; F142-I225 HydrophobicContact CD2-CD1 3.99Å; F142-I225 HydrophobicContact CE1-CD1 3.69Å; F142-I225 HydrophobicContact CE1-CG1 3.71Å; F142-I225 HydrophobicContact CE2-CD1 4.18Å; F142-I225 HydrophobicContact CG-CD1 3.61Å; F142-I225 HydrophobicContact CG-CG1 4.2Å; F142-I225 HydrophobicContact CZ-CD1 4.04Å; F142-I225 HydrophobicContact CZ-CG1 4.46Å; K144-I225 PolarHBondContact O-N 3.39Å; I145-I225 WeakPolarHBondContact CA-O 2.94Å; I145-I225 HydrophobicContact CB-CB 4.5Å; I145-I225 HydrophobicContact CG1-CB 4.05Å; I145-I225 HydrophobicContact CG1-CD1 4.09Å; I145-I225 HydrophobicContact CG1-CG2 4.27Å; I145-I225 HydrophobicContact CG2-CG2 4.08Å; V146-I225 PolarHBondContact N-O 3.2Å; L164-I225 HydrophobicContact CD1-CD1 3.45Å; L164-I225 VanDerWaalsContact CD1-CD1 3.45Å; I225-I227 HydrophobicContact CG2-CD1 4.18Å; I225-I227 HydrophobicContact CG2-CG1 3.81Å
226	F	98.9	Very high	97.9	Very high	3 Å²	3	36 Å²	36	1%	0.013	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	111.2	173.5	-64.1	-92.8	0	0	0	109.8	I100 F101 L102 I103 V146 L175 Y210 E224	I100-F226 HydrophobicContact CD1-CE2 4.13Å; I100-F226 HydrophobicContact CG2-CD2 3.69Å; I100-F226 HydrophobicContact CG2-CE2 3.78Å; F101-F226 PolarHBondContact O-N 3.45Å; L102-F226 HydrophobicContact CD2-CB 3.78Å; L102-F226 HydrophobicContact CD2-CD2 4.14Å; L102-F226 HydrophobicContact CD2-CG 4.12Å; I103-F226 PolarHBondContact N-O 3.1Å; V146-F226 HydrophobicContact CB-CD1 3.67Å; V146-F226 HydrophobicContact CB-CE1 3.75Å; V146-F226 HydrophobicContact CG1-CD1 4.14Å; V146-F226 HydrophobicContact CG1-CE1 4.2Å; V146-F226 HydrophobicContact CG2-CD1 4.24Å; V146-F226 HydrophobicContact CG2-CE1 3.81Å; V146-F226 HydrophobicContact CG2-CZ 4.42Å; V146-F226 CarbonylContact O-C 3.59Å; V146-F226 WeakPolarHBondContact O-CA 3.45Å; L175-F226 HydrophobicContact CD1-CD1 4.1Å; Y210-F226 AromaticContact CD1-CE1 3.83Å; Y210-F226 HydrophobicContact CD1-CE1 3.83Å; Y210-F226 HydrophobicContact CD1-CZ 4.47Å; Y210-F226 HydrophobicContact CD2-CE1 4.38Å; Y210-F226 HydrophobicContact CG-CD1 4.49Å; Y210-F226 AromaticContact CG-CE1 3.68Å; Y210-F226 HydrophobicContact CG-CE1 3.68Å; Y210-F226 HydrophobicContact CG-CZ 4.42Å; E224-F226 HydrophobicContact CB-CE2 3.7Å; E224-F226 HydrophobicContact CB-CZ 4.34Å
227	I	98.9	Very high	98.2	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	109.7	179.2	-59.7	167.6	0	0	0	109.2	I103 I145 V146 H147 S148 A153 T156 T157 I160 I225	I103-I227 HydrophobicContact CB-CG1 4.08Å; I103-I227 HydrophobicContact CD1-CG1 4.22Å; I103-I227 HydrophobicContact CG2-CG1 4.45Å; I103-I227 WeakPolarHBondContact O-CA 3.4Å; I145-I227 HydrophobicContact CG2-CD1 3.73Å; I145-I227 HydrophobicContact CG2-CG1 4.31Å; V146-I227 PolarHBondContact O-N 3.17Å; H147-I227 CarbonylContact C-O 3.57Å; H147-I227 VanDerWaalsContact CA-O 3.26Å; H147-I227 WeakPolarHBondContact CA-O 3.49Å; H147-I227 HydrophobicContact CB-CB 4.02Å; S148-I227 PolarHBondContact N-O 2.8Å; A153-I227 HydrophobicContact CB-CG2 4.48Å; T156-I227 HydrophobicContact CG2-CG2 3.94Å; T157-I227 HydrophobicContact CG2-CD1 4.04Å; T157-I227 WeakPolarHBondContact OG1-CD1 3.45Å; I160-I227 HydrophobicContact CB-CD1 4.34Å; I160-I227 HydrophobicContact CD1-CD1 3.91Å; I160-I227 HydrophobicContact CG2-CD1 4.37Å; I225-I227 HydrophobicContact CG2-CD1 4.18Å; I225-I227 HydrophobicContact CG2-CG1 3.81Å
228	C	98.8	Very high	98.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	-136.2	-175.6	61.2	0	0	0	0	111.9	I103 H105 L175 I233	I103-C228 PolarHBondContact O-N 2.93Å; H105-C228 PolarHBondContact CD2-O 3.02Å; H105-C228 PolarHBondContact N-O 2.84Å; L175-C228 HydrophobicContact CB-CB 3.97Å; C228-I233 WeakPolarHBondContact SG-CG1 3.22Å
229	H	98.8	Very high	98.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.126	C	C	.	.			trans	-132.3	165.8	-163.5	-45.8	-86.4	0	0	0	112.5	H105 S148 M150 R152 L175 E177 N231 I233	H105-H229 AromaticContact CD2-CG 3.98Å; H105-H229 AromaticContact CD2-ND1 3.13Å; H105-H229 PolarHBondContact CD2-ND1 2.9Å; H105-H229 AromaticContact NE2-ND1 3.69Å; S148-H229 VanDerWaalsContact CB-NE2 3.26Å; S148-H229 WeakPolarHBondContact CB-NE2 3.1Å; S148-H229 PolarHBondContact OG-NE2 3.39Å; M150-H229 VanDerWaalsContact SD-CE1 3.59Å; R152-H229 PolarHBondContact NE-ND1 2.74Å; R152-H229 PolarHBondContact NH2-CE1 3.49Å; R152-H229 PolarHBondContact NH2-ND1 3.25Å; L175-H229 PolarHBondContact O-CD2 2.9Å; L175-H229 PolarHBondContact O-NE2 2.92Å; E177-H229 HydrophobicContact CB-CB 3.74Å; E177-H229 HydrophobicContact CG-CB 3.91Å; E177-H229 PolarHBondContact N-CD2 2.82Å; E177-H229 WeakPolarHBondContact OE1-CB 3.35Å; E177-H229 WeakPolarHBondContact OE2-CB 3.44Å; H229-N231 PolarHBondContact O-N 3.32Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 2.9Å
230	A	98.4	Very high	98.7	Very high	4 Å²	4	21.6 Å²	21.6	3%	0.033	10%	0.1	C	C	.	.	H	α-helix	trans	-65.1	-44.6	-168.2	0	0	0	0	0	112	R104 E177 I233 R234	R104-A230 HydrophobicContact CG-CB 4.49Å; E177-A230 PolarHBondContact OE2-N 3.38Å; E177-A230 VanDerWaalsContact OE2-N 3.1Å; A230-I233 PolarHBondContact O-N 3.02Å; A230-R234 VanDerWaalsContact C-NE 3.28Å; A230-R234 WeakPolarHBondContact O-CB 3.37Å; A230-R234 WeakPolarHBondContact O-CG 3.44Å; A230-R234 PolarHBondContact O-N 3.35Å; A230-R234 PolarHBondContact O-NE 3.1Å
231	N	98.2	Very high	98.7	Very high	30 Å²	30	15.3 Å²	15.3	16%	0.16	7%	0.071	C	C	.	.	H	α-helix	trans	-69.8	-40.6	-175.3	-51.1	-12.5	0	0	0	110.9	E177 G178 P180 H229 I233 R234 Y235 W248	E177-N231 WeakPolarHBondContact OE1-CB 3.16Å; E177-N231 PolarHBondContact OE1-N 3.49Å; E177-N231 PolarHBondContact OE2-N 2.92Å; E177-N231 VanDerWaalsContact OE2-N 3.12Å; G178-N231 VanDerWaalsContact O-CB 3.23Å; G178-N231 WeakPolarHBondContact O-CB 3.28Å; G178-N231 PolarHBondContact O-ND2 3.47Å; P180-N231 HydrophobicContact CG-CB 4.49Å; H229-N231 PolarHBondContact O-N 3.32Å; N231-I233 PolarHBondContact O-N 3.46Å; N231-R234 PolarHBondContact O-N 3.13Å; N231-R234 PolarHBondContact OD1-NH2 2.99Å; N231-Y235 WeakPolarHBondContact O-CB 3.15Å; N231-Y235 PolarHBondContact O-N 3.12Å; N231-W248 HydrophobicContact CB-CE3 4.23Å; N231-W248 HydrophobicContact CB-CH2 3.7Å; N231-W248 HydrophobicContact CB-CZ3 3.55Å; N231-W248 WeakPolarHBondContact ND2-CH2 3.46Å; N231-W248 WeakPolarHBondContact OD1-CZ3 3.24Å
232	V	98.7	Very high	98.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-56.9	-50.1	174.8	-177.2	0	0	0	0	111.3	L175 R176 E177 I203 Y235 I236	L175-V232 HydrophobicContact CD2-CG1 3.86Å; R176-V232 WeakPolarHBondContact O-CG2 3.48Å; E177-V232 PolarHBondContact OE1-N 2.96Å; I203-V232 HydrophobicContact CD1-CG2 4.13Å; I203-V232 HydrophobicContact CG1-CG2 4.18Å; I203-V232 HydrophobicContact CG2-CG1 4.44Å; V232-Y235 PolarHBondContact O-N 3.32Å; V232-I236 HydrophobicContact CG1-CD1 3.9Å; V232-I236 WeakPolarHBondContact O-CB 3.37Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.27Å; V232-I236 PolarHBondContact O-N 2.94Å
233	I	98.9	Very high	98.6	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-63.6	-45.9	-179.3	-64.8	169.5	0	0	0	110.7	L102 R104 C228 H229 A230 N231 Y235 I236 V237 L253 T259	L102-I233 HydrophobicContact CB-CD1 4.37Å; L102-I233 HydrophobicContact CB-CG1 4.11Å; L102-I233 HydrophobicContact CB-CG2 3.92Å; L102-I233 HydrophobicContact CD1-CG2 3.95Å; R104-I233 HydrophobicContact CB-CD1 4Å; C228-I233 WeakPolarHBondContact SG-CG1 3.22Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 2.9Å; A230-I233 PolarHBondContact O-N 3.02Å; N231-I233 PolarHBondContact O-N 3.46Å; I233-Y235 VanDerWaalsContact C-N 3.35Å; I233-Y235 PolarHBondContact O-N 3.45Å; I233-I236 PolarHBondContact O-N 3.12Å; I233-V237 HydrophobicContact CG2-CG2 4.36Å; I233-V237 VanDerWaalsContact O-CG2 3.31Å; I233-V237 WeakPolarHBondContact O-CG2 3.25Å; I233-V237 PolarHBondContact O-N 2.95Å; I233-L253 HydrophobicContact CB-CD1 3.71Å; I233-L253 HydrophobicContact CD1-CD1 4.36Å; I233-L253 HydrophobicContact CG2-CD1 3.49Å; I233-L253 VanDerWaalsContact CG2-CD1 3.49Å; I233-T259 HydrophobicContact CG2-CG2 4.41Å
234	R	98.8	Very high	98.5	Very high	35 Å²	35	20.8 Å²	20.8	13%	0.132	10%	0.102	C	C	.	.	H	α-helix	trans	-60.4	-45	-179.9	-70.5	177.9	-90.1	-174	0.7	111.8	A230 N231 V237 C238 W248 L251 L253	A230-R234 VanDerWaalsContact C-NE 3.28Å; A230-R234 WeakPolarHBondContact O-CB 3.37Å; A230-R234 WeakPolarHBondContact O-CG 3.44Å; A230-R234 PolarHBondContact O-N 3.35Å; A230-R234 PolarHBondContact O-NE 3.1Å; N231-R234 PolarHBondContact O-N 3.13Å; N231-R234 PolarHBondContact OD1-NH2 2.99Å; R234-V237 PolarHBondContact O-N 2.74Å; R234-C238 PolarHBondContact O-N 3.22Å; R234-C238 PolarHBondContact O-SG 3.13Å; R234-W248 HydrophobicContact CB-CB 4.04Å; R234-W248 HydrophobicContact CB-CE3 4.31Å; R234-W248 WeakPolarHBondContact CD-O 3.09Å; R234-L251 HydrophobicContact CB-CB 4.46Å; R234-L251 HydrophobicContact CB-CD1 4.32Å; R234-L251 WeakPolarHBondContact CD-O 3.47Å; R234-L251 HydrophobicContact CG-CB 3.79Å; R234-L251 HydrophobicContact CG-CD1 4.37Å; R234-L251 PolarHBondContact NH1-O 2.83Å; R234-L251 VanDerWaalsContact NH1-O 3.13Å; R234-L253 HydrophobicContact CG-CD1 3.85Å; R234-L253 HydrophobicContact CG-CG 4.34Å
235	Y	98.6	Very high	98.3	Very high	16 Å²	16	22 Å²	22	6%	0.063	11%	0.109	C	C	.	.	H	α-helix	trans	-62.3	-48	175.8	-176.1	-97.3	0	0	0	111.7	P180 I181 I203 E204 N231 V232 I233 V237 C238 R239 P245	P180-Y235 HydrophobicContact CB-CD1 4.49Å; P180-Y235 HydrophobicContact CB-CD2 3.4Å; P180-Y235 HydrophobicContact CB-CE2 3.93Å; P180-Y235 HydrophobicContact CB-CG 3.69Å; P180-Y235 HydrophobicContact CG-CD2 4.01Å; P180-Y235 HydrophobicContact CG-CG 4.28Å; I181-Y235 HydrophobicContact CD1-CE2 4.39Å; I181-Y235 HydrophobicContact CG1-CE2 4.32Å; I181-Y235 HydrophobicContact CG2-CE2 4.34Å; I203-Y235 HydrophobicContact CG2-CD1 3.43Å; I203-Y235 VanDerWaalsContact CG2-CD1 3.43Å; I203-Y235 HydrophobicContact CG2-CE1 4.04Å; I203-Y235 HydrophobicContact CG2-CG 3.95Å; E204-Y235 HydrophobicContact CB-CE1 4.34Å; E204-Y235 PolarHBondContact OE2-OH 3.49Å; E204-Y235 VanDerWaalsContact OE2-OH 3.06Å; N231-Y235 WeakPolarHBondContact O-CB 3.15Å; N231-Y235 PolarHBondContact O-N 3.12Å; V232-Y235 PolarHBondContact O-N 3.32Å; I233-Y235 VanDerWaalsContact C-N 3.35Å; I233-Y235 PolarHBondContact O-N 3.45Å; Y235-V237 VanDerWaalsContact C-N 3.28Å; Y235-V237 PolarHBondContact O-N 2.89Å; Y235-C238 PolarHBondContact O-N 2.87Å; Y235-R239 HydrophobicContact CD1-CG 3.75Å; Y235-R239 HydrophobicContact CD2-CG 4.32Å; Y235-R239 HydrophobicContact CE1-CG 3.43Å; Y235-R239 VanDerWaalsContact CE1-CG 3.43Å; Y235-R239 HydrophobicContact CE2-CG 4.04Å; Y235-R239 HydrophobicContact CG-CG 4.22Å; Y235-R239 WeakPolarHBondContact O-CB 3.38Å; Y235-R239 VanDerWaalsContact O-CG 3.24Å; Y235-R239 WeakPolarHBondContact O-CG 3.36Å; Y235-R239 PolarHBondContact O-N 3.04Å; Y235-P245 HydrophobicContact CD2-CB 4.32Å; Y235-P245 HydrophobicContact CE2-CB 3.96Å
236	I	98.9	Very high	98.2	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-56.1	-44	176.6	-74.5	170.6	0	0	0	110.9	L102 F207 I211 V232 I233 R239 A240 L261	L102-I236 HydrophobicContact CD1-CB 4.29Å; L102-I236 HydrophobicContact CD1-CG2 3.65Å; F207-I236 HydrophobicContact CB-CG1 4.48Å; F207-I236 HydrophobicContact CD2-CG1 4.42Å; F207-I236 HydrophobicContact CD2-CG2 4.44Å; I211-I236 HydrophobicContact CD1-CG2 4.05Å; I211-I236 HydrophobicContact CG1-CD1 4.42Å; I211-I236 HydrophobicContact CG1-CG1 4.49Å; I211-I236 HydrophobicContact CG1-CG2 3.82Å; V232-I236 HydrophobicContact CG1-CD1 3.9Å; V232-I236 WeakPolarHBondContact O-CB 3.37Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.27Å; V232-I236 PolarHBondContact O-N 2.94Å; I233-I236 PolarHBondContact O-N 3.12Å; I236-R239 PolarHBondContact O-N 3.06Å; I236-A240 WeakPolarHBondContact O-CB 3.24Å; I236-A240 PolarHBondContact O-N 3.46Å; I236-L261 HydrophobicContact CG2-CD1 4.23Å
237	V	98.9	Very high	98.1	Very high	2 Å²	2	26 Å²	26	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-51	178.9	169.1	0	0	0	0	111	L102 I233 R234 Y235 R239 A240 L241 L251 T259 L271 L274	L102-V237 HydrophobicContact CD1-CG2 4.27Å; I233-V237 HydrophobicContact CG2-CG2 4.36Å; I233-V237 VanDerWaalsContact O-CG2 3.31Å; I233-V237 WeakPolarHBondContact O-CG2 3.25Å; I233-V237 PolarHBondContact O-N 2.95Å; R234-V237 PolarHBondContact O-N 2.74Å; Y235-V237 VanDerWaalsContact C-N 3.28Å; Y235-V237 PolarHBondContact O-N 2.89Å; V237-R239 VanDerWaalsContact C-N 3.34Å; V237-R239 PolarHBondContact O-N 3.49Å; V237-A240 PolarHBondContact O-N 3.02Å; V237-L241 HydrophobicContact CG1-CD1 3.78Å; V237-L241 WeakPolarHBondContact O-CB 3.39Å; V237-L241 WeakPolarHBondContact O-CG 3.45Å; V237-L241 PolarHBondContact O-N 3.27Å; V237-L251 HydrophobicContact CB-CD1 4.35Å; V237-L251 HydrophobicContact CG1-CD1 4.07Å; V237-T259 HydrophobicContact CG2-CG2 3.81Å; V237-L271 HydrophobicContact CG1-CD2 4.33Å; V237-L274 HydrophobicContact CG1-CD1 3.91Å; V237-L274 HydrophobicContact CG2-CD1 4.46Å
238	C	98.6	Very high	97.9	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.034	13%	0.131	C	C	.	.	H	α-helix	trans	-58.9	-46.6	178.5	-66.3	0	0	0	0	111.3	R234 Y235 L241 Q242 F243	R234-C238 PolarHBondContact O-N 3.22Å; R234-C238 PolarHBondContact O-SG 3.13Å; Y235-C238 PolarHBondContact O-N 2.87Å; C238-L241 PolarHBondContact O-N 3.29Å; C238-Q242 PolarHBondContact O-N 3.46Å; C238-F243 HydrophobicContact CB-CB 4.39Å; C238-F243 PolarHBondContact O-N 2.71Å
239	R	98.3	Very high	97.8	Very high	60 Å²	60	28.6 Å²	28.6	23%	0.226	14%	0.144	C	C	.	.	H	α-helix	trans	-63	-46.1	179.6	-68.7	-69.8	-68	114.7	1.9	112.5	E204 F207 Y235 I236 V237 L241 Q242	E204-R239 IonicContact OE1-CZ 2.87Å; E204-R239 IonicContact OE1-NE 2.83Å; E204-R239 IonicContact OE1-NH2 3.12Å; E204-R239 PolarHBondContact OE1-NH2 3.07Å; E204-R239 IonicContact OE2-CZ 3.19Å; E204-R239 IonicContact OE2-NE 3.97Å; E204-R239 PolarHBondContact OE2-NE 3.16Å; E204-R239 IonicContact OE2-NH2 3.61Å; E204-R239 PolarHBondContact OE2-NH2 3.33Å; F207-R239 HydrophobicContact CD1-CB 4.35Å; F207-R239 HydrophobicContact CD2-CB 3.83Å; F207-R239 HydrophobicContact CE1-CB 4.13Å; F207-R239 HydrophobicContact CE2-CB 3.57Å; F207-R239 HydrophobicContact CG-CB 4.22Å; F207-R239 HydrophobicContact CZ-CB 3.73Å; Y235-R239 HydrophobicContact CD1-CG 3.75Å; Y235-R239 HydrophobicContact CD2-CG 4.32Å; Y235-R239 HydrophobicContact CE1-CG 3.43Å; Y235-R239 VanDerWaalsContact CE1-CG 3.43Å; Y235-R239 HydrophobicContact CE2-CG 4.04Å; Y235-R239 HydrophobicContact CG-CG 4.22Å; Y235-R239 WeakPolarHBondContact O-CB 3.38Å; Y235-R239 VanDerWaalsContact O-CG 3.24Å; Y235-R239 WeakPolarHBondContact O-CG 3.36Å; Y235-R239 PolarHBondContact O-N 3.04Å; I236-R239 PolarHBondContact O-N 3.06Å; V237-R239 VanDerWaalsContact C-N 3.34Å; V237-R239 PolarHBondContact O-N 3.49Å; R239-L241 VanDerWaalsContact C-N 3.31Å; R239-L241 PolarHBondContact O-N 3.47Å; R239-Q242 PolarHBondContact O-N 3.1Å
240	A	98.4	Very high	97.7	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-33	-178	0	0	0	0	0	112.5	W58 F207 I211 I236 V237 L261 V269	W58-A240 WeakPolarHBondContact CH2-O 3.25Å; F207-A240 HydrophobicContact CE2-CB 4.02Å; I211-A240 HydrophobicContact CG2-CB 4.21Å; I236-A240 WeakPolarHBondContact O-CB 3.24Å; I236-A240 PolarHBondContact O-N 3.46Å; V237-A240 PolarHBondContact O-N 3.02Å; A240-L261 HydrophobicContact CB-CD1 4.09Å; A240-V269 HydrophobicContact CB-CG1 4.11Å; A240-V269 WeakPolarHBondContact O-CB 3.34Å; A240-V269 WeakPolarHBondContact O-CG2 3.23Å
241	L	98.4	Very high	97.7	Very high	24 Å²	24	38.1 Å²	38.1	13%	0.126	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	1.3	177.4	-61.2	174.5	0	0	0	113.4	V237 C238 R239 F243 L261 V269 L271	V237-L241 HydrophobicContact CG1-CD1 3.78Å; V237-L241 WeakPolarHBondContact O-CB 3.39Å; V237-L241 WeakPolarHBondContact O-CG 3.45Å; V237-L241 PolarHBondContact O-N 3.27Å; C238-L241 PolarHBondContact O-N 3.29Å; R239-L241 VanDerWaalsContact C-N 3.31Å; R239-L241 PolarHBondContact O-N 3.47Å; L241-F243 HydrophobicContact CB-CD1 4.48Å; L241-F243 HydrophobicContact CB-CD2 3.88Å; L241-F243 HydrophobicContact CB-CE1 4.49Å; L241-F243 HydrophobicContact CB-CE2 3.9Å; L241-F243 HydrophobicContact CB-CG 4.18Å; L241-F243 HydrophobicContact CB-CZ 4.21Å; L241-F243 HydrophobicContact CD1-CD2 4.05Å; L241-F243 HydrophobicContact CD1-CE2 3.58Å; L241-F243 HydrophobicContact CD1-CZ 4.27Å; L241-F243 HydrophobicContact CG-CE2 4.4Å; L241-F243 PolarHBondContact O-N 3.14Å; L241-L261 HydrophobicContact CD2-CD2 4.39Å; L241-V269 HydrophobicContact CD2-CB 4.46Å; L241-V269 HydrophobicContact CD2-CG1 3.98Å; L241-L271 HydrophobicContact CD1-CB 3.84Å; L241-L271 HydrophobicContact CD1-CD2 3.88Å; L241-L271 HydrophobicContact CD1-CG 4.42Å; L241-L271 HydrophobicContact CD2-CB 4.11Å
242	Q	97.9	Very high	97.8	Very high	40 Å²	40	40.2 Å²	40.2	19%	0.187	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	32.4	-175.8	-55.5	-177.5	13.6	0	0	113.3	W58 D59 C238 R239	W58-Q242 VanDerWaalsContact CA-OE1 3.3Å; W58-Q242 HydrophobicContact CE3-CB 4.04Å; W58-Q242 HydrophobicContact CE3-CG 3.77Å; W58-Q242 HydrophobicContact CH2-CG 4.04Å; W58-Q242 HydrophobicContact CZ3-CB 3.97Å; W58-Q242 VanDerWaalsContact CZ3-CD 3.5Å; W58-Q242 HydrophobicContact CZ3-CG 3.5Å; D59-Q242 PolarHBondContact O-NE2 3.45Å; C238-Q242 PolarHBondContact O-N 3.46Å; R239-Q242 PolarHBondContact O-N 3.1Å
243	F	97.5	Very high	97.8	Very high	121 Å²	121	40.4 Å²	40.4	53%	0.531	20%	0.201	S	C	.	.			trans	-77.5	156.4	165.3	-63.9	-28	0	0	0	110.2	C238 L241 P245	C238-F243 HydrophobicContact CB-CB 4.39Å; C238-F243 PolarHBondContact O-N 2.71Å; L241-F243 HydrophobicContact CB-CD1 4.48Å; L241-F243 HydrophobicContact CB-CD2 3.88Å; L241-F243 HydrophobicContact CB-CE1 4.49Å; L241-F243 HydrophobicContact CB-CE2 3.9Å; L241-F243 HydrophobicContact CB-CG 4.18Å; L241-F243 HydrophobicContact CB-CZ 4.21Å; L241-F243 HydrophobicContact CD1-CD2 4.05Å; L241-F243 HydrophobicContact CD1-CE2 3.58Å; L241-F243 HydrophobicContact CD1-CZ 4.27Å; L241-F243 HydrophobicContact CG-CE2 4.4Å; L241-F243 PolarHBondContact O-N 3.14Å; F243-P245 WeakPolarHBondContact O-CD 3.06Å
244	P	96.9	Very high	97.8	Very high	86 Å²	86	41.8 Å²	41.8	56%	0.558	21%	0.208	S	C	*	.			trans	-51.6	117	171.2	-25.7	34.5	0	0	0	109.9	E246 G247	P244-E246 VanDerWaalsContact C-OE2 3.3Å; P244-E246 WeakPolarHBondContact CB-OE2 3.42Å; P244-E246 PolarHBondContact O-N 3.46Å; P244-G247 PolarHBondContact O-N 3.09Å; P244-G247 VanDerWaalsContact O-N 3.1Å
245	P	95.4	Very high	97.8	Very high	30 Å²	30	40.1 Å²	40.1	20%	0.195	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-63.6	-23.1	-174	26.9	-35.3	0	0	0	112.2	I181 Y235 F243 G247 W248	I181-P245 HydrophobicContact CD1-CB 3.55Å; I181-P245 HydrophobicContact CD1-CG 3.62Å; Y235-P245 HydrophobicContact CD2-CB 4.32Å; Y235-P245 HydrophobicContact CE2-CB 3.96Å; F243-P245 WeakPolarHBondContact O-CD 3.06Å; P245-G247 PolarHBondContact O-N 3.18Å; P245-W248 WeakPolarHBondContact O-CB 3.3Å; P245-W248 PolarHBondContact O-N 2.91Å
246	E	95.4	Very high	97.8	Very high	79 Å²	79	39.3 Å²	39.3	37%	0.369	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-62.6	-25.1	177.8	-54.8	77.4	-170	0	0	111.5	I181 P183 D184 P244 W248	I181-E246 HydrophobicContact CD1-CG 4.07Å; P183-E246 CarbonylContact C-O 3.58Å; P183-E246 WeakPolarHBondContact CA-O 3.47Å; D184-E246 HydrophobicContact CB-CB 3.85Å; D184-E246 PolarHBondContact N-O 3.15Å; P244-E246 VanDerWaalsContact C-OE2 3.3Å; P244-E246 WeakPolarHBondContact CB-OE2 3.42Å; P244-E246 PolarHBondContact O-N 3.46Å; E246-W248 PolarHBondContact O-N 2.85Å; E246-W248 VanDerWaalsContact O-N 3.1Å
247	G	96.4	Very high	97.8	Very high	9 Å²	9	39.2 Å²	39.2	9%	0.093	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-71	1.5	177	0	0	0	0	0	114.4	P244 P245 L249 R250	P244-G247 PolarHBondContact O-N 3.09Å; P244-G247 VanDerWaalsContact O-N 3.1Å; P245-G247 PolarHBondContact O-N 3.18Å; G247-L249 VanDerWaalsContact C-N 3.28Å; G247-L249 PolarHBondContact O-N 3.37Å; G247-R250 WeakPolarHBondContact O-CB 3.33Å; G247-R250 WeakPolarHBondContact O-CG 3.19Å; G247-R250 PolarHBondContact O-N 2.89Å
248	W	96.5	Very high	97.8	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-56.5	-38.2	-173.6	70	-91.9	0	0	0	113.3	P180 I181 W190 N231 R234 P245 E246 R250 L251	P180-W248 HydrophobicContact CG-CD2 4.05Å; P180-W248 HydrophobicContact CG-CG 4.39Å; P180-W248 HydrophobicContact CG-CH2 4.28Å; P180-W248 HydrophobicContact CG-CZ2 3.53Å; I181-W248 PolarHBondContact O-NE1 3.39Å; W190-W248 AromaticContact CH2-CE2 3.62Å; W190-W248 AromaticContact CH2-CH2 3.4Å; W190-W248 HydrophobicContact CH2-CH2 3.4Å; W190-W248 AromaticContact CH2-CZ2 2.89Å; W190-W248 HydrophobicContact CH2-CZ2 2.89Å; W190-W248 AromaticContact CZ2-CH2 3.91Å; W190-W248 HydrophobicContact CZ2-CH2 3.91Å; W190-W248 AromaticContact CZ2-CZ2 3.47Å; W190-W248 HydrophobicContact CZ2-CZ2 3.47Å; W190-W248 VanDerWaalsContact CZ2-CZ2 3.47Å; W190-W248 HydrophobicContact CZ3-CH2 4.01Å; W190-W248 AromaticContact CZ3-CZ2 3.81Å; W190-W248 HydrophobicContact CZ3-CZ2 3.81Å; N231-W248 HydrophobicContact CB-CE3 4.23Å; N231-W248 HydrophobicContact CB-CH2 3.7Å; N231-W248 HydrophobicContact CB-CZ3 3.55Å; N231-W248 WeakPolarHBondContact ND2-CH2 3.46Å; N231-W248 WeakPolarHBondContact OD1-CZ3 3.24Å; R234-W248 HydrophobicContact CB-CB 4.04Å; R234-W248 HydrophobicContact CB-CE3 4.31Å; R234-W248 WeakPolarHBondContact CD-O 3.09Å; P245-W248 WeakPolarHBondContact O-CB 3.3Å; P245-W248 PolarHBondContact O-N 2.91Å; E246-W248 PolarHBondContact O-N 2.85Å; E246-W248 VanDerWaalsContact O-N 3.1Å; W248-R250 PolarHBondContact O-N 2.9Å; W248-L251 WeakPolarHBondContact O-CB 3.38Å; W248-L251 PolarHBondContact O-N 2.5Å
249	L	96	Very high	97.8	Very high	52 Å²	52	39.2 Å²	39.2	27%	0.272	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-69.8	-12.6	176.8	-91.3	-162.2	0	0	0	114.7	P183 V187 W190 G247 L251	P183-L249 HydrophobicContact CB-CB 4.04Å; P183-L249 HydrophobicContact CB-CD1 3.78Å; P183-L249 HydrophobicContact CB-CG 3.93Å; P183-L249 HydrophobicContact CG-CD1 4.01Å; V187-L249 HydrophobicContact CG1-CD1 3.88Å; V187-L249 HydrophobicContact CG2-CD1 3.87Å; W190-L249 HydrophobicContact CE3-CD1 4.06Å; W190-L249 HydrophobicContact CH2-CD1 4.46Å; W190-L249 HydrophobicContact CZ3-CD1 3.42Å; W190-L249 VanDerWaalsContact CZ3-CD1 3.42Å; W190-L249 HydrophobicContact CZ3-CG 3.91Å; G247-L249 VanDerWaalsContact C-N 3.28Å; G247-L249 PolarHBondContact O-N 3.37Å; L249-L251 PolarHBondContact O-N 2.84Å
250	R	97.6	Very high	97.8	Very high	158 Å²	158	38.7 Å²	38.7	60%	0.596	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-72.7	-16.6	174.1	-53.6	177	-171.7	179.8	0.9	111.8	D184 G247 W248	D184-R250 VanDerWaalsContact O-CZ 3.25Å; D184-R250 PolarHBondContact O-NE 2.65Å; D184-R250 PolarHBondContact O-NH2 3.26Å; D184-R250 IonicContact OD2-NH2 3.34Å; D184-R250 PolarHBondContact OD2-NH2 2.94Å; G247-R250 WeakPolarHBondContact O-CB 3.33Å; G247-R250 WeakPolarHBondContact O-CG 3.19Å; G247-R250 PolarHBondContact O-N 2.89Å; W248-R250 PolarHBondContact O-N 2.9Å
251	L	98.4	Very high	97.9	Very high	46 Å²	46	38.6 Å²	38.6	24%	0.241	20%	0.195	C	C	.	.			trans	-90.4	139.1	175.9	-56	176.4	0	0	0	109.8	R234 V237 W248 L249 L274	R234-L251 HydrophobicContact CB-CB 4.46Å; R234-L251 HydrophobicContact CB-CD1 4.32Å; R234-L251 WeakPolarHBondContact CD-O 3.47Å; R234-L251 HydrophobicContact CG-CB 3.79Å; R234-L251 HydrophobicContact CG-CD1 4.37Å; R234-L251 PolarHBondContact NH1-O 2.83Å; R234-L251 VanDerWaalsContact NH1-O 3.13Å; V237-L251 HydrophobicContact CB-CD1 4.35Å; V237-L251 HydrophobicContact CG1-CD1 4.07Å; W248-L251 WeakPolarHBondContact O-CB 3.38Å; W248-L251 PolarHBondContact O-N 2.5Å; L249-L251 PolarHBondContact O-N 2.84Å; L251-L274 HydrophobicContact CD1-CD1 4.19Å; L251-L274 HydrophobicContact CD2-CD1 4.08Å
252	S	98.4	Very high	97.9	Very high	74 Å²	74	37.8 Å²	37.8	52%	0.517	19%	0.191	S	C	.	.			trans	-126.4	130.2	177.6	-176.3	0	0	0	0	109.1	R287	S252-R287 WeakPolarHBondContact OG-CD 3.39Å
253	L	98.8	Very high	97.9	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	18%	0.182	C	C	.	.			trans	-124.9	126	-175.1	-61.8	173.9	0	0	0	108.7	R104 I233 R234 L274	R104-L253 PolarHBondContact NH1-O 2.84Å; I233-L253 HydrophobicContact CB-CD1 3.71Å; I233-L253 HydrophobicContact CD1-CD1 4.36Å; I233-L253 HydrophobicContact CG2-CD1 3.49Å; I233-L253 VanDerWaalsContact CG2-CD1 3.49Å; R234-L253 HydrophobicContact CG-CD1 3.85Å; R234-L253 HydrophobicContact CG-CG 4.34Å; L253-L274 HydrophobicContact CD2-CD2 3.71Å; L253-L274 HydrophobicContact CD2-CG 4.01Å
254	N	98.9	Very high	98	Very high	29 Å²	29	35.5 Å²	35.5	16%	0.155	18%	0.177	C	C	.	.			trans	-70.3	158	173.6	-64.9	-27	0	0	0	110.9	R104 S257 T277 I285 T286 R287	R104-N254 WeakPolarHBondContact CD-O 3.39Å; N254-S257 WeakPolarHBondContact O-CB 3.34Å; N254-S257 PolarHBondContact O-N 3.23Å; N254-S257 PolarHBondContact O-OG 3.17Å; N254-T277 HydrophobicContact CB-CG2 3.63Å; N254-T277 PolarHBondContact ND2-OG1 3.05Å; N254-I285 HydrophobicContact CB-CG2 4.12Å; N254-I285 VanDerWaalsContact ND2-CG2 3.29Å; N254-I285 WeakPolarHBondContact ND2-CG2 3.29Å; N254-T286 CarbonylContact C-O 3.54Å; N254-T286 VanDerWaalsContact CA-O 3.31Å; N254-T286 WeakPolarHBondContact CA-O 3.34Å; N254-T286 WeakPolarHBondContact CB-O 3.3Å; N254-R287 WeakPolarHBondContact OD1-CG 3.33Å
255	N	98.9	Very high	98	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	139	170.3	-71.4	103.3	0	0	0	110.4	H105 S106 Q107 S257 T286 R287 S288	H105-N255 WeakPolarHBondContact O-CA 3.28Å; H105-N255 PolarHBondContact O-ND2 3.25Å; S106-N255 PolarHBondContact O-ND2 2.92Å; Q107-N255 PolarHBondContact N-ND2 3.22Å; N255-S257 PolarHBondContact O-N 2.74Å; N255-S257 VanDerWaalsContact O-N 3.13Å; N255-T286 PolarHBondContact N-O 3.13Å; N255-T286 VanDerWaalsContact OD1-C 3.29Å; N255-T286 PolarHBondContact OD1-O 2.93Å; N255-T286 PolarHBondContact OD1-OG1 3.2Å; N255-R287 VanDerWaalsContact OD1-CA 3.28Å; N255-R287 WeakPolarHBondContact OD1-CA 3.3Å; N255-R287 PolarHBondContact OD1-N 3.08Å; N255-S288 PolarHBondContact OD1-N 3.06Å
256	G	98.8	Very high	97.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	5.1	-176.9	0	0	0	0	0	115.1	R104 H105 T131	R104-G256 WeakPolarHBondContact O-CA 3.45Å; R104-G256 PolarHBondContact O-N 3.1Å; H105-G256 PolarHBondContact O-N 3.18Å; T131-G256 WeakPolarHBondContact CG2-O 3.36Å; T131-G256 PolarHBondContact OG1-O 2.91Å
257	S	98.9	Very high	98	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.			trans	-68.4	148.1	-176.2	63.5	0	0	0	0	113.4	I103 R104 N254 N255 D276	I103-S257 WeakPolarHBondContact CA-O 3.18Å; R104-S257 PolarHBondContact N-O 2.94Å; N254-S257 WeakPolarHBondContact O-CB 3.34Å; N254-S257 PolarHBondContact O-N 3.23Å; N254-S257 PolarHBondContact O-OG 3.17Å; N255-S257 PolarHBondContact O-N 2.74Å; N255-S257 VanDerWaalsContact O-N 3.13Å; S257-D276 VanDerWaalsContact CA-O 3.3Å; S257-D276 WeakPolarHBondContact CA-O 3.08Å
258	I	98.9	Very high	98.1	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.036	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128	177.4	-56.8	173.6	0	0	0	109.5	F101 T131 R134 L135 G275 D276 F279	F101-I258 HydrophobicContact CD1-CG2 3.96Å; T131-I258 HydrophobicContact CG2-CD1 4.21Å; T131-I258 HydrophobicContact CG2-CG1 4.03Å; R134-I258 HydrophobicContact CB-CD1 4.37Å; R134-I258 HydrophobicContact CG-CD1 3.82Å; L135-I258 HydrophobicContact CD2-CD1 4.05Å; L135-I258 HydrophobicContact CG-CD1 4.21Å; I258-G275 PolarHBondContact O-N 3.16Å; I258-D276 HydrophobicContact CB-CB 4.44Å; I258-D276 PolarHBondContact N-O 3.43Å; I258-D276 WeakPolarHBondContact O-CB 3.43Å; I258-D276 PolarHBondContact O-N 3.38Å; I258-F279 HydrophobicContact CD1-CD1 4.5Å; I258-F279 HydrophobicContact CD1-CE1 3.7Å; I258-F279 HydrophobicContact CD1-CZ 4.07Å; I258-F279 HydrophobicContact CG1-CE1 3.98Å; I258-F279 HydrophobicContact CG1-CZ 4.21Å
259	T	98.9	Very high	98.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129	170	-64.2	0	0	0	0	108.6	F101 L102 I233 V237 L271 T273 L274 G275	F101-T259 CarbonylContact C-O 3.57Å; F101-T259 WeakPolarHBondContact CA-O 3.46Å; L102-T259 HydrophobicContact CD1-CG2 4.47Å; L102-T259 PolarHBondContact N-O 2.84Å; L102-T259 PolarHBondContact O-N 2.86Å; I233-T259 HydrophobicContact CG2-CG2 4.41Å; V237-T259 HydrophobicContact CG2-CG2 3.81Å; T259-L271 HydrophobicContact CG2-CD1 3.91Å; T259-T273 WeakPolarHBondContact CA-O 3.28Å; T259-L274 HydrophobicContact CG2-CB 4.46Å; T259-L274 HydrophobicContact CG2-CG 4.37Å; T259-G275 PolarHBondContact OG1-N 3.24Å; T259-G275 VanDerWaalsContact OG1-N 3.08Å
260	Y	98.9	Very high	98.3	Very high	49 Å²	49	39.3 Å²	39.3	19%	0.192	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	112.8	-169.4	179.2	-159.7	0	0	0	111.4	H99 I100 F101 V262 R272 T273	H99-Y260 HydrophobicContact CB-CE2 3.71Å; H99-Y260 PolarHBondContact CE1-OH 3.28Å; H99-Y260 VanDerWaalsContact CE1-OH 3.24Å; H99-Y260 AromaticContact CG-CE2 3.97Å; H99-Y260 AromaticContact ND1-CE2 3.48Å; H99-Y260 WeakPolarHBondContact ND1-CE2 3.37Å; H99-Y260 AromaticContact ND1-CZ 3.47Å; H99-Y260 PolarHBondContact ND1-OH 2.96Å; I100-Y260 WeakPolarHBondContact O-CA 3.28Å; F101-Y260 HydrophobicContact CD1-CD2 4.34Å; F101-Y260 HydrophobicContact CD1-CG 4.41Å; F101-Y260 HydrophobicContact CE1-CD1 4.3Å; F101-Y260 HydrophobicContact CE1-CD2 4.02Å; F101-Y260 HydrophobicContact CE1-CE2 4.29Å; F101-Y260 HydrophobicContact CE1-CG 4.04Å; F101-Y260 HydrophobicContact CE2-CD2 4.38Å; F101-Y260 HydrophobicContact CE2-CE2 4.17Å; F101-Y260 HydrophobicContact CZ-CD2 4.05Å; F101-Y260 HydrophobicContact CZ-CE1 4.48Å; F101-Y260 AromaticContact CZ-CE2 3.87Å; F101-Y260 HydrophobicContact CZ-CE2 3.87Å; F101-Y260 HydrophobicContact CZ-CG 4.44Å; Y260-V262 HydrophobicContact CD2-CG2 4.36Å; Y260-V262 HydrophobicContact CE1-CG2 4.47Å; Y260-V262 HydrophobicContact CE2-CG2 3.67Å; Y260-R272 HydrophobicContact CD1-CB 3.44Å; Y260-R272 VanDerWaalsContact CD1-CB 3.44Å; Y260-R272 HydrophobicContact CD1-CG 3.93Å; Y260-R272 HydrophobicContact CE1-CB 3.94Å; Y260-R272 HydrophobicContact CE1-CG 3.95Å; Y260-R272 HydrophobicContact CG-CB 3.91Å; Y260-R272 HydrophobicContact CG-CG 4.36Å; Y260-R272 PolarHBondContact O-N 3.39Å; Y260-T273 PolarHBondContact N-O 3.04Å
261	L	98.9	Very high	98.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	146.9	172.2	-64.1	167.7	0	0	0	110.7	I100 L102 I236 A240 L241 V269 A270 L271	I100-L261 HydrophobicContact CB-CB 4.19Å; I100-L261 PolarHBondContact N-O 3.49Å; I100-L261 PolarHBondContact O-N 2.83Å; L102-L261 HydrophobicContact CD1-CD1 3.91Å; I236-L261 HydrophobicContact CG2-CD1 4.23Å; A240-L261 HydrophobicContact CB-CD1 4.09Å; L241-L261 HydrophobicContact CD2-CD2 4.39Å; L261-V269 HydrophobicContact CD2-CG1 4.16Å; L261-A270 CarbonylContact C-O 3.46Å; L261-A270 WeakPolarHBondContact CA-O 3.2Å; L261-L271 HydrophobicContact CD2-CB 4.03Å; L261-L271 HydrophobicContact CD2-CD1 3.66Å; L261-L271 HydrophobicContact CD2-CG 4.46Å; L261-L271 HydrophobicContact CG-CD1 4.36Å
262	V	98.9	Very high	98.4	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.036	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.1	172.9	-178.5	0	0	0	0	108.5	T97 Y260 V269 A270 R272	T97-V262 HydrophobicContact CG2-CG1 3.45Å; T97-V262 VanDerWaalsContact CG2-CG1 3.45Å; Y260-V262 HydrophobicContact CD2-CG2 4.36Å; Y260-V262 HydrophobicContact CE1-CG2 4.47Å; Y260-V262 HydrophobicContact CE2-CG2 3.67Å; V262-V269 CarbonylContact O-C 3.59Å; V262-V269 WeakPolarHBondContact O-CA 3.49Å; V262-A270 PolarHBondContact N-O 2.82Å; V262-A270 PolarHBondContact O-N 3.03Å; V262-R272 HydrophobicContact CG2-CG 3.53Å
263	I	98.8	Very high	98.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	109.4	176.6	-49.7	175.8	0	0	0	107.7	W62 T97 R98 I100 I211 R213 V269	W62-I263 HydrophobicContact CZ2-CG2 4.33Å; T97-I263 WeakPolarHBondContact CA-O 3.48Å; R98-I263 HydrophobicContact CB-CB 4.35Å; R98-I263 PolarHBondContact N-O 3.19Å; R98-I263 PolarHBondContact O-N 3.19Å; I100-I263 HydrophobicContact CG1-CD1 4Å; I100-I263 HydrophobicContact CG1-CG1 4.37Å; I211-I263 HydrophobicContact CG2-CD1 3.93Å; R213-I263 HydrophobicContact CB-CG2 4.45Å; I263-V269 HydrophobicContact CG1-CG2 4.31Å; I263-V269 HydrophobicContact CG2-CG2 4.4Å
264	R	98.4	Very high	98.4	Very high	113 Å²	113	42.1 Å²	42.1	43%	0.426	20%	0.199	S	C	.	.			trans	-74.4	157.8	177.7	-64.7	-59.4	-173.2	-178.4	2.2	110.7	T97 N266 G267 R268	T97-R264 PolarHBondContact OG1-NH1 3.02Å; T97-R264 VanDerWaalsContact OG1-NH1 3.08Å; R264-N266 WeakPolarHBondContact CB-OD1 3.36Å; R264-N266 PolarHBondContact O-N 2.72Å; R264-N266 VanDerWaalsContact O-N 3.07Å; R264-G267 PolarHBondContact O-N 2.8Å; R264-R268 HydrophobicContact CB-CB 4.4Å; R264-R268 PolarHBondContact N-O 3.47Å
265	P	97.1	Very high	98.4	Very high	36 Å²	36	41.4 Å²	41.4	23%	0.234	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.6	-179.4	-12.5	16.5	0	0	0	113.5	A94 K95 A96 G267	A94-P265 HydrophobicContact CB-CB 4.04Å; A94-P265 WeakPolarHBondContact O-CB 3.34Å; K95-P265 WeakPolarHBondContact O-CG 3.2Å; A96-P265 WeakPolarHBondContact O-CG 3.38Å; P265-G267 PolarHBondContact O-N 3.33Å
266	N	94.6	Very high	98.4	Very high	85 Å²	85	43.5 Å²	43.5	46%	0.455	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	8.2	176.6	77	-16.4	0	0	0	114.7	R264 R268	R264-N266 WeakPolarHBondContact CB-OD1 3.36Å; R264-N266 PolarHBondContact O-N 2.72Å; R264-N266 VanDerWaalsContact O-N 3.07Å; N266-R268 VanDerWaalsContact C-N 3.34Å; N266-R268 PolarHBondContact ND2-NE 3.34Å; N266-R268 PolarHBondContact ND2-NH2 2.91Å; N266-R268 PolarHBondContact O-N 3.43Å; N266-R268 WeakPolarHBondContact OD1-CB 3.33Å; N266-R268 WeakPolarHBondContact OD1-CG 3.15Å; N266-R268 PolarHBondContact OD1-N 2.95Å; N266-R268 PolarHBondContact OD1-NE 3.33Å; N266-R268 VanDerWaalsContact OD1-NE 3.08Å
267	G	96.3	Very high	98.4	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	85.7	-5.4	177.5	0	0	0	0	0	115.3	W58 W62 R264 P265 V269	W58-G267 WeakPolarHBondContact CZ2-O 3.17Å; W62-G267 PolarHBondContact NE1-O 3.08Å; R264-G267 PolarHBondContact O-N 2.8Å; P265-G267 PolarHBondContact O-N 3.33Å; G267-V269 PolarHBondContact O-N 3.17Å
268	R	98.1	Very high	98.4	Very high	151 Å²	151	47.5 Å²	47.5	57%	0.57	25%	0.249	S	C	*	.			trans	-65.3	135.2	173.4	-70.7	-178.5	-63.5	174.4	-5.7	110.5	R264 N266	R264-R268 HydrophobicContact CB-CB 4.4Å; R264-R268 PolarHBondContact N-O 3.47Å; N266-R268 VanDerWaalsContact C-N 3.34Å; N266-R268 PolarHBondContact ND2-NE 3.34Å; N266-R268 PolarHBondContact ND2-NH2 2.91Å; N266-R268 PolarHBondContact O-N 3.43Å; N266-R268 WeakPolarHBondContact OD1-CB 3.33Å; N266-R268 WeakPolarHBondContact OD1-CG 3.15Å; N266-R268 PolarHBondContact OD1-N 2.95Å; N266-R268 PolarHBondContact OD1-NE 3.33Å; N266-R268 VanDerWaalsContact OD1-NE 3.08Å
269	V	98.8	Very high	98.4	Very high	22 Å²	22	49.1 Å²	49.1	13%	0.133	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137.6	177.1	-174	0	0	0	0	109.9	W58 W62 A240 L241 L261 V262 I263 G267	W58-V269 HydrophobicContact CH2-CB 4.05Å; W58-V269 HydrophobicContact CH2-CG2 4.02Å; W58-V269 HydrophobicContact CZ2-CG2 4.44Å; W62-V269 HydrophobicContact CZ2-CG2 3.7Å; A240-V269 HydrophobicContact CB-CG1 4.11Å; A240-V269 WeakPolarHBondContact O-CB 3.34Å; A240-V269 WeakPolarHBondContact O-CG2 3.23Å; L241-V269 HydrophobicContact CD2-CB 4.46Å; L241-V269 HydrophobicContact CD2-CG1 3.98Å; L261-V269 HydrophobicContact CD2-CG1 4.16Å; V262-V269 CarbonylContact O-C 3.59Å; V262-V269 WeakPolarHBondContact O-CA 3.49Å; I263-V269 HydrophobicContact CG1-CG2 4.31Å; I263-V269 HydrophobicContact CG2-CG2 4.4Å; G267-V269 PolarHBondContact O-N 3.17Å
270	A	98.8	Very high	98.4	Very high	45 Å²	45	49.6 Å²	49.6	37%	0.372	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135	171.7	0	0	0	0	0	110.6	L261 V262	L261-A270 CarbonylContact C-O 3.46Å; L261-A270 WeakPolarHBondContact CA-O 3.2Å; V262-A270 PolarHBondContact N-O 2.82Å; V262-A270 PolarHBondContact O-N 3.03Å
271	L	98.9	Very high	98.4	Very high	61 Å²	61	49.7 Å²	49.7	32%	0.319	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.3	168.6	-179.7	66.6	0	0	0	109.1	V237 L241 T259 L261 T273 L274	V237-L271 HydrophobicContact CG1-CD2 4.33Å; L241-L271 HydrophobicContact CD1-CB 3.84Å; L241-L271 HydrophobicContact CD1-CD2 3.88Å; L241-L271 HydrophobicContact CD1-CG 4.42Å; L241-L271 HydrophobicContact CD2-CB 4.11Å; T259-L271 HydrophobicContact CG2-CD1 3.91Å; L261-L271 HydrophobicContact CD2-CB 4.03Å; L261-L271 HydrophobicContact CD2-CD1 3.66Å; L261-L271 HydrophobicContact CD2-CG 4.46Å; L261-L271 HydrophobicContact CG-CD1 4.36Å; L271-T273 VanDerWaalsContact CD1-O 3.27Å; L271-T273 WeakPolarHBondContact CD1-O 2.96Å; L271-L274 HydrophobicContact CD1-CB 4.25Å; L271-L274 HydrophobicContact CD2-CB 4.05Å; L271-L274 HydrophobicContact CD2-CD1 3.84Å; L271-L274 HydrophobicContact CG-CB 4.47Å
272	R	98.8	Very high	98.3	Very high	176 Å²	176	55.2 Å²	55.2	66%	0.664	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	-36.6	-177.7	-63.1	-59.1	-59.2	172.4	0	112.6	Y260 V262	Y260-R272 HydrophobicContact CD1-CB 3.44Å; Y260-R272 VanDerWaalsContact CD1-CB 3.44Å; Y260-R272 HydrophobicContact CD1-CG 3.93Å; Y260-R272 HydrophobicContact CE1-CB 3.94Å; Y260-R272 HydrophobicContact CE1-CG 3.95Å; Y260-R272 HydrophobicContact CG-CB 3.91Å; Y260-R272 HydrophobicContact CG-CG 4.36Å; Y260-R272 PolarHBondContact O-N 3.39Å; V262-R272 HydrophobicContact CG2-CG 3.53Å
273	T	98.8	Very high	98.3	Very high	48 Å²	48	61.1 Å²	61.1	29%	0.294	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.7	169.9	-167	0	0	0	0	109.8	T259 Y260 L271 D276	T259-T273 WeakPolarHBondContact CA-O 3.28Å; Y260-T273 PolarHBondContact N-O 3.04Å; L271-T273 VanDerWaalsContact CD1-O 3.27Å; L271-T273 WeakPolarHBondContact CD1-O 2.96Å; T273-D276 HydrophobicContact CG2-CB 3.92Å
274	L	98.9	Very high	98.3	Very high	56 Å²	56	63.6 Å²	63.6	29%	0.293	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.7	177.6	-175.8	146.5	0	0	0	109.6	V237 L251 L253 T259 L271 D276	V237-L274 HydrophobicContact CG1-CD1 3.91Å; V237-L274 HydrophobicContact CG2-CD1 4.46Å; L251-L274 HydrophobicContact CD1-CD1 4.19Å; L251-L274 HydrophobicContact CD2-CD1 4.08Å; L253-L274 HydrophobicContact CD2-CD2 3.71Å; L253-L274 HydrophobicContact CD2-CG 4.01Å; T259-L274 HydrophobicContact CG2-CB 4.46Å; T259-L274 HydrophobicContact CG2-CG 4.37Å; L271-L274 HydrophobicContact CD1-CB 4.25Å; L271-L274 HydrophobicContact CD2-CB 4.05Å; L271-L274 HydrophobicContact CD2-CD1 3.84Å; L271-L274 HydrophobicContact CG-CB 4.47Å; L274-D276 VanDerWaalsContact C-N 3.31Å; L274-D276 PolarHBondContact O-N 3.3Å
275	G	98.7	Very high	98.3	Very high	14 Å²	14	61 Å²	61	14%	0.144	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	65.3	30.5	177.3	0	0	0	0	0	114.3	I258 T259 T277	I258-G275 PolarHBondContact O-N 3.16Å; T259-G275 PolarHBondContact OG1-N 3.24Å; T259-G275 VanDerWaalsContact OG1-N 3.08Å; G275-T277 PolarHBondContact O-N 3.38Å
276	D	98.9	Very high	98.4	Very high	45 Å²	45	60.6 Å²	60.6	24%	0.241	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	118.1	-178.5	-176.2	7.5	0	0	0	111.3	S257 I258 T273 L274 G278 F279	S257-D276 VanDerWaalsContact CA-O 3.3Å; S257-D276 WeakPolarHBondContact CA-O 3.08Å; I258-D276 HydrophobicContact CB-CB 4.44Å; I258-D276 PolarHBondContact N-O 3.43Å; I258-D276 WeakPolarHBondContact O-CB 3.43Å; I258-D276 PolarHBondContact O-N 3.38Å; T273-D276 HydrophobicContact CG2-CB 3.92Å; L274-D276 VanDerWaalsContact C-N 3.31Å; L274-D276 PolarHBondContact O-N 3.3Å; D276-G278 PolarHBondContact OD1-N 3.24Å; D276-F279 VanDerWaalsContact O-CE1 3.28Å; D276-F279 WeakPolarHBondContact O-CE1 3.44Å
277	T	98.8	Very high	98.6	Very high	10 Å²	10	64.1 Å²	64.1	6%	0.061	34%	0.34	C	S	.	.			trans	-131.4	25.4	165.8	55.3	0	0	0	0	110.9	N254 G275 F279 M280	N254-T277 HydrophobicContact CB-CG2 3.63Å; N254-T277 PolarHBondContact ND2-OG1 3.05Å; G275-T277 PolarHBondContact O-N 3.38Å; T277-F279 PolarHBondContact O-N 2.99Å; T277-F279 VanDerWaalsContact O-N 3.17Å; T277-M280 HydrophobicContact CG2-CE 4.06Å; T277-M280 HydrophobicContact CG2-SD 3.86Å; T277-M280 WeakPolarHBondContact O-CB 3.23Å; T277-M280 PolarHBondContact O-N 3.46Å
278	G	98.8	Very high	98.6	Very high	73 Å²	73	68 Å²	68	75%	0.753	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.9	179.3	0	0	0	0	0	113.5	D276	D276-G278 PolarHBondContact OD1-N 3.24Å
279	F	98.8	Very high	98.6	Very high	42 Å²	42	63.8 Å²	63.8	18%	0.184	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-8.8	171.6	60.9	-93.1	0	0	0	113.6	L130 T131 R134 I258 D276 T277	L130-F279 HydrophobicContact CB-CD2 4.11Å; L130-F279 HydrophobicContact CB-CE2 4.13Å; T131-F279 HydrophobicContact CG2-CZ 4.28Å; T131-F279 WeakPolarHBondContact OG1-CZ 3.36Å; R134-F279 HydrophobicContact CB-CB 4.16Å; R134-F279 HydrophobicContact CB-CD1 4.02Å; R134-F279 HydrophobicContact CB-CD2 3.83Å; R134-F279 HydrophobicContact CB-CE1 4.36Å; R134-F279 HydrophobicContact CB-CE2 4.21Å; R134-F279 HydrophobicContact CB-CG 3.73Å; R134-F279 HydrophobicContact CB-CZ 4.45Å; R134-F279 HydrophobicContact CG-CB 4.09Å; R134-F279 HydrophobicContact CG-CD1 3.6Å; R134-F279 HydrophobicContact CG-CD2 4.34Å; R134-F279 HydrophobicContact CG-CE1 4.06Å; R134-F279 HydrophobicContact CG-CG 3.75Å; I258-F279 HydrophobicContact CD1-CD1 4.5Å; I258-F279 HydrophobicContact CD1-CE1 3.7Å; I258-F279 HydrophobicContact CD1-CZ 4.07Å; I258-F279 HydrophobicContact CG1-CE1 3.98Å; I258-F279 HydrophobicContact CG1-CZ 4.21Å; D276-F279 VanDerWaalsContact O-CE1 3.28Å; D276-F279 WeakPolarHBondContact O-CE1 3.44Å; T277-F279 PolarHBondContact O-N 2.99Å; T277-F279 VanDerWaalsContact O-N 3.17Å
280	M	98.8	Very high	98.6	Very high	9 Å²	9	66 Å²	66	4%	0.044	37%	0.369	C	S	.	.	S	Bend	trans	-94.2	136.8	176.8	-60.1	-173.3	-178.9	0	0	110.1	Q127 L130 T131 T277 I285	Q127-M280 HydrophobicContact CB-CE 4.03Å; Q127-M280 HydrophobicContact CB-SD 4.42Å; Q127-M280 HydrophobicContact CG-CE 4.38Å; Q127-M280 HydrophobicContact CG-SD 4.15Å; L130-M280 HydrophobicContact CB-CG 4.29Å; L130-M280 HydrophobicContact CD1-CB 4.3Å; L130-M280 HydrophobicContact CD1-CG 4.11Å; T131-M280 VanDerWaalsContact OG1-CE 3.31Å; T131-M280 WeakPolarHBondContact OG1-CE 3.16Å; T277-M280 HydrophobicContact CG2-CE 4.06Å; T277-M280 HydrophobicContact CG2-SD 3.86Å; T277-M280 WeakPolarHBondContact O-CB 3.23Å; T277-M280 PolarHBondContact O-N 3.46Å; M280-I285 HydrophobicContact CB-CD1 4.47Å; M280-I285 HydrophobicContact CB-CG1 3.91Å
281	P	98.8	Very high	98.6	Very high	51 Å²	51	67.2 Å²	67.2	33%	0.331	37%	0.369	S	S	.	.			trans	-52.9	140.3	165	-27.7	37.3	0	0	0	111.4	D283 K284	P281-D283 VanDerWaalsContact C-N 3.25Å; P281-D283 WeakPolarHBondContact CB-OD1 3.47Å; P281-D283 PolarHBondContact O-N 3.05Å; P281-K284 HydrophobicContact CB-CD 4.45Å; P281-K284 HydrophobicContact CB-CG 4.28Å; P281-K284 HydrophobicContact CG-CD 4.27Å; P281-K284 PolarHBondContact O-N 3.21Å
282	P	98.7	Very high	98.5	Very high	116 Å²	116	67.5 Å²	67.5	75%	0.753	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-57.1	-34.4	-174	-28.7	35.9	0	0	0	114.9	K284 I285	P282-K284 PolarHBondContact O-N 3.29Å; P282-I285 PolarHBondContact O-N 3.12Å
283	D	98.5	Very high	98.5	Very high	130 Å²	130	60.8 Å²	60.8	70%	0.695	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-67.9	-12.7	177.5	63.3	-39.5	0	0	0	113.6	P281	P281-D283 VanDerWaalsContact C-N 3.25Å; P281-D283 WeakPolarHBondContact CB-OD1 3.47Å; P281-D283 PolarHBondContact O-N 3.05Å
284	K	98.6	Very high	98.5	Very high	52 Å²	52	61.6 Å²	61.6	23%	0.226	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-102.2	-2.1	178.5	-58.3	-168.2	-177	-161.3	0	113.9	L123 E126 Q127 L130 P281 P282	L123-K284 HydrophobicContact CD1-CB 3.98Å; L123-K284 HydrophobicContact CD1-CG 4.09Å; E126-K284 WeakPolarHBondContact OE2-CE 3.47Å; E126-K284 IonicContact OE2-NZ 2.9Å; E126-K284 PolarHBondContact OE2-NZ 3.39Å; Q127-K284 PolarHBondContact NE2-O 3.03Å; L130-K284 HydrophobicContact CD1-CD 3.9Å; P281-K284 HydrophobicContact CB-CD 4.45Å; P281-K284 HydrophobicContact CB-CG 4.28Å; P281-K284 HydrophobicContact CG-CD 4.27Å; P281-K284 PolarHBondContact O-N 3.21Å; P282-K284 PolarHBondContact O-N 3.29Å
285	I	98.9	Very high	98.5	Very high	60 Å²	60	62 Å²	62	31%	0.308	36%	0.362	S	S	.	.			trans	-85.5	122.3	-176	-62.8	175.2	0	0	0	110.6	N254 M280 P282	N254-I285 HydrophobicContact CB-CG2 4.12Å; N254-I285 VanDerWaalsContact ND2-CG2 3.29Å; N254-I285 WeakPolarHBondContact ND2-CG2 3.29Å; M280-I285 HydrophobicContact CB-CD1 4.47Å; M280-I285 HydrophobicContact CB-CG1 3.91Å; P282-I285 PolarHBondContact O-N 3.12Å
286	T	98.8	Very high	98.5	Very high	26 Å²	26	65.7 Å²	65.7	16%	0.16	38%	0.378	C	S	.	.			trans	-132.8	166.4	177	69.1	0	0	0	0	112.2	L123 Q127 N254 N255	L123-T286 HydrophobicContact CD2-CG2 3.71Å; Q127-T286 PolarHBondContact NE2-OG1 3.16Å; N254-T286 CarbonylContact C-O 3.54Å; N254-T286 VanDerWaalsContact CA-O 3.31Å; N254-T286 WeakPolarHBondContact CA-O 3.34Å; N254-T286 WeakPolarHBondContact CB-O 3.3Å; N255-T286 PolarHBondContact N-O 3.13Å; N255-T286 VanDerWaalsContact OD1-C 3.29Å; N255-T286 PolarHBondContact OD1-O 2.93Å; N255-T286 PolarHBondContact OD1-OG1 3.2Å
287	R	98.4	Very high	98.4	Very high	160 Å²	160	67.4 Å²	67.4	60%	0.604	39%	0.39	S	S	*	.			trans	-120.9	-4.7	175.9	-69.3	-173.1	-62.3	-82.3	-0.5	114.2	R104 S252 N254 N255	R104-R287 VanDerWaalsContact CZ-O 3.24Å; R104-R287 PolarHBondContact NH1-O 2.83Å; R104-R287 PolarHBondContact NH2-O 3.15Å; S252-R287 WeakPolarHBondContact OG-CD 3.39Å; N254-R287 WeakPolarHBondContact OD1-CG 3.33Å; N255-R287 VanDerWaalsContact OD1-CA 3.28Å; N255-R287 WeakPolarHBondContact OD1-CA 3.3Å; N255-R287 PolarHBondContact OD1-N 3.08Å
288	S	95.1	Very high	98.4	Very high	80 Å²	80	72.6 Å²	72.6	56%	0.559	42%	0.42	S	S	*	.			trans	-138.5	0	174.6	54.5	0	0	0	0	108.9	Q107 N255	Q107-S288 WeakPolarHBondContact CG-O 3.41Å; Q107-S288 PolarHBondContact NE2-O 3.1Å; N255-S288 PolarHBondContact OD1-N 3.06Å

Retrieved 288 of 288 residues in 77.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).