A0A077Z6L3_TRITR Loading...

Glycogen synthase kinase-3

Phosphorylates oma-1, a regulator of the oocyte-to-embryo transition, enabling its degradation. Phosphorylates skn-1, preventing it from accumulating in nuclei and thus inhibiting phase II gene expression in the oxidative stress defense. Involved in mesendoderm specification and mitotic spindle orientation in EMS blastomeres. Thought to be a branch point in these processes as proteins downstream are not required. Negatively regulates Wnt signaling in vulval precursor cells and acts as a Wnt-independent repressor of med-1 and med-2 in the C lineage inhibiting mesoderm development. Required for normal lifespan and LiCl-induced lifespan extension.

AlphaFold DB , UniProt , Accession A0A077Z6L3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 448 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	39.4	Very low	37.1	Very low	240 Å²	240	146.2 Å²	146.2	100%	1.182	83%	0.83	S	S	*	*				0	131.9	0	-61.5	166.3	176.9	0	0	107.7
2	S	41.9	Very low	36.9	Very low	99 Å²	99	145 Å²	145	69%	0.692	83%	0.832	S	S	*	*			cis	-161	120.7	-21.4	-71.2	0	0	0	0	107.1
3	N	38.3	Very low	36.5	Very low	140 Å²	140	141 Å²	141	75%	0.749	83%	0.828	S	S	*	*			trans	64.5	137.4	159	-55.7	24.6	0	0	0	116.3
4	E	38.3	Very low	36	Very low	177 Å²	177	142.8 Å²	142.8	83%	0.827	83%	0.831	S	S	*	*			cis	64.5	138.1	49	-62.7	-168.8	126.9	0	0	114
5	A	37.5	Very low	35.5	Very low	84 Å²	84	140.9 Å²	140.9	69%	0.694	83%	0.828	S	S	*	*			cis	-168.8	171.3	-16.4	0	0	0	0	0	109.1
6	Q	35.9	Very low	35.8	Very low	185 Å²	185	139.4 Å²	139.4	86%	0.864	82%	0.821	S	S	*	*			trans	138	129.1	139.3	-75	-173.7	10.8	0	0	114.1
7	P	38	Very low	35.5	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-95.7	146.5	168.2	36.3	-31.5	0	0	0	112.3
8	S	36.4	Very low	35.4	Very low	127 Å²	127	134.3 Å²	134.3	89%	0.888	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.3	141.8	174.5	45.5	0	0	0	0	112.8
9	R	35.5	Very low	35.2	Very low	236 Å²	236	135.5 Å²	135.5	89%	0.891	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-87.6	161	-179.7	-84.8	-176.8	173.7	-171.1	-1.3	112.5
10	P	35.3	Very low	35.4	Very low	126 Å²	126	135.3 Å²	135.3	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.5	155.9	-177.7	29	-36.9	0	0	0	113.9
11	G	32.2	Very low	35.1	Very low	70 Å²	70	132.5 Å²	132.5	72%	0.722	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.2	161.3	176.3	0	0	0	0	0	114.3
12	P	34	Very low	34.8	Very low	132 Å²	132	127.3 Å²	127.3	86%	0.857	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-85.7	169	-166.8	35.2	-37.5	0	0	0	114.7
13	A	31.9	Very low	34.3	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70	154.3	176.4	0	0	0	0	0	113.2	S15	A13-S15 PolarHBondContact O-N 3.14Å
14	L	29.9	Very low	33.9	Very low	166 Å²	166	124.7 Å²	124.7	87%	0.869	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-68.5	125.8	170.5	-79.3	161.6	0	0	0	110.9
15	S	28.8	Very low	33.4	Very low	114 Å²	114	125 Å²	125	80%	0.797	79%	0.789	S	S	*	*			trans	-129.4	127.7	158.5	55.9	0	0	0	0	108.4	A13	A13-S15 PolarHBondContact O-N 3.14Å
16	V	39.5	Very low	33	Very low	118 Å²	118	129 Å²	129	72%	0.715	80%	0.798	S	S	*	*			trans	-130.8	87.8	-179.2	-176.1	0	0	0	0	108.6	G18	V16-G18 VanDerWaalsContact C-N 3.3Å; V16-G18 PolarHBondContact O-N 3.46Å; V16-G18 VanDerWaalsContact O-N 3.14Å
17	S	31.1	Very low	32.6	Very low	124 Å²	124	128.8 Å²	128.8	87%	0.867	80%	0.797	S	S	*	*			trans	-83.1	73.3	172.2	55.3	0	0	0	0	110.4
18	G	34	Very low	32.2	Very low	63 Å²	63	128.4 Å²	128.4	65%	0.649	78%	0.784	S	S	*	*			trans	-93.6	90.2	174.9	0	0	0	0	0	111.6	V16 T20	V16-G18 VanDerWaalsContact C-N 3.3Å; V16-G18 PolarHBondContact O-N 3.46Å; V16-G18 VanDerWaalsContact O-N 3.14Å; G18-T20 PolarHBondContact O-N 3.34Å
19	N	31.7	Very low	31.7	Very low	156 Å²	156	126.1 Å²	126.1	83%	0.834	77%	0.768	S	S	*	*			trans	-92.6	91.1	-178	-175.5	33.7	0	0	0	112.3
20	T	39.1	Very low	31.5	Very low	132 Å²	132	121 Å²	121	81%	0.81	76%	0.758	S	S	*	*			trans	-117.1	110.7	162.6	50.4	0	0	0	0	108.7	G18 D22	G18-T20 PolarHBondContact O-N 3.34Å; T20-D22 PolarHBondContact O-N 2.83Å
21	G	29.2	Very low	31.2	Very low	76 Å²	76	117.3 Å²	117.3	78%	0.784	74%	0.736	S	S	*	*			trans	-74.6	111	-173.4	0	0	0	0	0	113.2
22	D	32.1	Very low	31.1	Very low	131 Å²	131	115.7 Å²	115.7	70%	0.701	71%	0.713	S	S	*	*			trans	-99.3	120.4	165.8	-179.3	21.5	0	0	0	109.5	T20 G24	T20-D22 PolarHBondContact O-N 2.83Å; D22-G24 PolarHBondContact O-N 3.31Å
23	P	31.2	Very low	31	Very low	137 Å²	137	110.4 Å²	110.4	89%	0.89	68%	0.679	S	S	*	*	S	Bend	trans	-75.4	56.1	177.4	33	-36.3	0	0	0	112.2
24	G	29.6	Very low	31	Very low	47 Å²	47	109 Å²	109	49%	0.485	66%	0.661	S	S	.	*			trans	-126.8	17	-171	0	0	0	0	0	115.5	D22 L26	D22-G24 PolarHBondContact O-N 3.31Å; G24-L26 VanDerWaalsContact C-N 3.29Å; G24-L26 PolarHBondContact O-N 3.14Å
25	Q	27.8	Very low	31.3	Very low	185 Å²	185	103.3 Å²	103.3	86%	0.864	63%	0.63	S	S	*	*			trans	-69.9	76.5	-179.4	-73.5	-167.7	-6.8	0	0	113.6
26	L	29.5	Very low	31.4	Very low	168 Å²	168	100.7 Å²	100.7	88%	0.88	61%	0.614	S	S	*	*			trans	-74	116.8	151.1	-72	171.9	0	0	0	107.9	G24 E28	G24-L26 VanDerWaalsContact C-N 3.29Å; G24-L26 PolarHBondContact O-N 3.14Å; L26-E28 PolarHBondContact O-N 3.49Å
27	H	28.2	Very low	31.1	Very low	180 Å²	180	97.2 Å²	97.2	83%	0.833	59%	0.592	S	S	*	*			trans	-51.5	126.9	179.1	-96.2	-95.4	0	0	0	111.9	S29	H27-S29 PolarHBondContact O-N 2.63Å
28	E	28.8	Very low	31	Very low	115 Å²	115	94.1 Å²	94.1	54%	0.537	57%	0.574	S	S	.	*			trans	-65.7	81.6	164.9	-79.1	-162.5	136	0	0	110	L26 Y237 R241	L26-E28 PolarHBondContact O-N 3.49Å; E28-Y237 PolarHBondContact OE1-OH 3.41Å; E28-R241 IonicContact OE1-CZ 2.63Å; E28-R241 IonicContact OE1-NE 3.22Å; E28-R241 IonicContact OE1-NH2 2.83Å; E28-R241 PolarHBondContact OE1-NH2 3.19Å; E28-R241 IonicContact OE2-NH2 3.31Å; E28-R241 PolarHBondContact OE2-NH2 3.35Å
29	S	27.5	Very low	30.9	Very low	79 Å²	79	99.1 Å²	99.1	55%	0.552	59%	0.586	S	S	*	*			trans	-74.3	139.7	149.7	75.6	0	0	0	0	107.8	H27 S31	H27-S29 PolarHBondContact O-N 2.63Å; S29-S31 PolarHBondContact O-N 3.27Å; S29-S31 WeakPolarHBondContact OG-CB 3.49Å; S29-S31 PolarHBondContact OG-OG 2.84Å
30	N	30.2	Very low	31	Very low	129 Å²	129	96.4 Å²	96.4	69%	0.69	58%	0.579	S	S	*	*			trans	-77.9	46.2	179.2	-137.1	-19.5	0	0	0	110.9	S32	N30-S32 PolarHBondContact O-N 3.07Å
31	S	28.4	Very low	30.6	Very low	49 Å²	49	96.2 Å²	96.2	34%	0.343	58%	0.583	S	S	.	*			trans	-76.9	60.9	-172.2	67.4	0	0	0	0	111.8	S29 S33 S87	S29-S31 PolarHBondContact O-N 3.27Å; S29-S31 WeakPolarHBondContact OG-CB 3.49Å; S29-S31 PolarHBondContact OG-OG 2.84Å; S31-S33 PolarHBondContact O-N 3.19Å; S31-S87 PolarHBondContact OG-OG 2.86Å
32	S	31.1	Very low	30.7	Very low	36 Å²	36	99.3 Å²	99.3	25%	0.252	58%	0.581	S	S	.	*			trans	-52.1	137.5	152.3	57.7	0	0	0	0	109.1	N30 T34	N30-S32 PolarHBondContact O-N 3.07Å; S32-T34 VanDerWaalsContact C-N 3.33Å; S32-T34 PolarHBondContact O-N 3.06Å
33	S	31.8	Very low	30.9	Very low	20 Å²	20	98.5 Å²	98.5	14%	0.14	58%	0.583	C	S	.	*			trans	-61.3	92.9	174	-0.5	0	0	0	0	108.7	S31 F35 K204 N207 D221	S31-S33 PolarHBondContact O-N 3.19Å; S33-F35 PolarHBondContact O-N 2.88Å; S33-K204 PolarHBondContact OG-NZ 2.86Å; S33-N207 PolarHBondContact OG-OD1 3.48Å; S33-D221 WeakPolarHBondContact CB-OD2 3.48Å; S33-D221 PolarHBondContact OG-OD2 2.97Å
34	T	32.6	Very low	31.2	Very low	63 Å²	63	97 Å²	97	39%	0.387	57%	0.567	S	S	.	*	B	Isolated β-bridge	trans	-85.6	103.5	-170.9	42.6	0	0	0	0	110.2	S32 A36 G84 N85	S32-T34 VanDerWaalsContact C-N 3.33Å; S32-T34 PolarHBondContact O-N 3.06Å; T34-A36 PolarHBondContact O-N 3.31Å; T34-G84 WeakPolarHBondContact O-CA 3.22Å; T34-N85 PolarHBondContact OG1-O 2.61Å
35	F	36.2	Very low	31.8	Very low	48 Å²	48	103.5 Å²	103.5	21%	0.211	59%	0.585	C	S	.	*			trans	-67.4	56.1	155.7	-71.6	-84.7	0	0	0	110.5	S33 N37 T159 Q206 L209	S33-F35 PolarHBondContact O-N 2.88Å; F35-N37 PolarHBondContact O-N 3.43Å; F35-T159 HydrophobicContact CB-CG2 3.86Å; F35-T159 HydrophobicContact CD2-CG2 4.18Å; F35-T159 HydrophobicContact CG-CG2 4.01Å; F35-Q206 VanDerWaalsContact CD2-O 3.26Å; F35-Q206 WeakPolarHBondContact CD2-O 3.46Å; F35-L209 HydrophobicContact CD1-CD2 4.38Å; F35-L209 HydrophobicContact CD2-CD2 4.41Å; F35-L209 HydrophobicContact CE1-CD2 4Å; F35-L209 HydrophobicContact CE2-CD2 4.02Å; F35-L209 HydrophobicContact CZ-CD2 3.81Å
36	A	29.8	Very low	32.3	Very low	58 Å²	58	101 Å²	101	48%	0.479	58%	0.577	S	S	.	*			trans	-89.3	74.6	177.3	0	0	0	0	0	109.3	T34 A38 I83	T34-A36 PolarHBondContact O-N 3.31Å; A36-A38 PolarHBondContact O-N 2.89Å; A36-I83 CarbonylContact C-O 3.57Å
37	N	32.2	Very low	32.8	Very low	45 Å²	45	101.5 Å²	101.5	24%	0.241	57%	0.567	C	S	.	*			trans	-62.4	105.3	173.1	-160	-18.5	0	0	0	108.4	F35 N39 K81 I83	F35-N37 PolarHBondContact O-N 3.43Å; N37-N39 PolarHBondContact O-N 3.08Å; N37-N39 VanDerWaalsContact O-N 3.12Å; N37-K81 PolarHBondContact OD1-NZ 2.55Å; N37-I83 PolarHBondContact N-O 3.06Å
38	A	30.9	Very low	33.3	Very low	60 Å²	60	100.2 Å²	100.2	50%	0.496	57%	0.566	S	S	.	*	S	Bend	trans	-69.4	110.8	-159.7	0	0	0	0	0	112.7	A36	A36-A38 PolarHBondContact O-N 2.89Å
39	N	30.7	Very low	34	Very low	168 Å²	168	101 Å²	101	90%	0.898	57%	0.572	S	S	*	*			trans	-145	40.2	167.3	-105.9	0.9	0	0	0	111	N37	N37-N39 PolarHBondContact O-N 3.08Å; N37-N39 VanDerWaalsContact O-N 3.12Å
40	S	33.4	Very low	35	Very low	99 Å²	99	101.7 Å²	101.7	69%	0.692	57%	0.565	S	S	*	*	S	Bend	trans	-152.9	138.2	164.9	56.8	0	0	0	0	107.8	L42	S40-L42 PolarHBondContact O-N 3.24Å
41	S	30.8	Very low	35.7	Very low	127 Å²	127	100.6 Å²	100.6	89%	0.888	57%	0.565	S	S	*	*			trans	-58.5	128	-172.6	34.7	0	0	0	0	113.1
42	L	32.6	Very low	36.8	Very low	142 Å²	142	102.9 Å²	102.9	74%	0.743	59%	0.587	S	S	*	*			trans	-107.1	145.8	163.9	-75.2	167.6	0	0	0	108.2	S40	S40-L42 PolarHBondContact O-N 3.24Å
43	P	35.3	Very low	37.9	Very low	114 Å²	114	103.8 Å²	103.8	74%	0.74	59%	0.588	S	S	*	*			trans	-66.2	146.6	177.9	28.4	-34.6	0	0	0	111.4	H45	P43-H45 PolarHBondContact O-N 3.2Å
44	D	38.8	Very low	39	Very low	104 Å²	104	106.7 Å²	106.7	56%	0.556	61%	0.606	S	S	*	*	S	Bend	trans	-67	-11	-163.7	-84.5	-58.9	0	0	0	116.7	N46 R47	D44-N46 PolarHBondContact O-N 2.98Å; D44-R47 PolarHBondContact O-N 3.24Å; D44-R47 WeakPolarHBondContact OD1-CD 3.49Å; D44-R47 IonicContact OD1-CZ 2.65Å; D44-R47 VanDerWaalsContact OD1-CZ 3.24Å; D44-R47 IonicContact OD1-NE 3.78Å; D44-R47 IonicContact OD1-NH1 2.63Å; D44-R47 PolarHBondContact OD1-NH1 3.12Å
45	H	40.5	Very low	40.1	Very low	185 Å²	185	114.4 Å²	114.4	86%	0.856	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	19.1	-161.5	-129.9	-20.1	0	0	0	116.7	P43	P43-H45 PolarHBondContact O-N 3.2Å
46	N	39.6	Very low	41.4	Very low	132 Å²	132	119.4 Å²	119.4	71%	0.706	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.9	21	178.3	-140	-2.2	0	0	0	113.6	D44	D44-N46 PolarHBondContact O-N 2.98Å
47	R	39	Very low	44	Very low	179 Å²	179	123.5 Å²	123.5	68%	0.675	66%	0.66	S	S	*	*	S	Bend	trans	-78.6	-28.2	178.8	-86.5	-179.8	162.6	160.4	4.2	114.1	D44 M49	D44-R47 PolarHBondContact O-N 3.24Å; D44-R47 WeakPolarHBondContact OD1-CD 3.49Å; D44-R47 IonicContact OD1-CZ 2.65Å; D44-R47 VanDerWaalsContact OD1-CZ 3.24Å; D44-R47 IonicContact OD1-NE 3.78Å; D44-R47 IonicContact OD1-NH1 2.63Å; D44-R47 PolarHBondContact OD1-NH1 3.12Å; R47-M49 PolarHBondContact O-N 2.9Å
48	D	39.6	Very low	46.8	Very low	152 Å²	152	124.9 Å²	124.9	81%	0.813	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-9	-164.5	-54.6	-48.4	0	0	0	114.9
49	M	42.5	Very low	49.8	Very low	133 Å²	133	123.4 Å²	123.4	66%	0.655	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-19.7	175.5	-84.9	-166	62.8	0	0	114.5	R47	R47-M49 PolarHBondContact O-N 2.9Å
50	F	48.4	Very low	52.9	Low	92 Å²	92	121.1 Å²	121.1	40%	0.404	64%	0.64	S	S	.	*	S	Bend	trans	-143	93.5	-178	-63.3	-68.5	0	0	0	110.7	A52 V90	F50-A52 PolarHBondContact O-N 3.11Å; F50-V90 HydrophobicContact CD1-CG2 4.24Å; F50-V90 HydrophobicContact CD2-CG2 4.13Å; F50-V90 HydrophobicContact CE1-CG2 4.25Å; F50-V90 HydrophobicContact CE2-CG2 4.13Å; F50-V90 HydrophobicContact CG-CG2 4.19Å; F50-V90 HydrophobicContact CZ-CG2 4.2Å
51	P	45.3	Very low	55.9	Low	107 Å²	107	117.4 Å²	117.4	70%	0.695	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-60.4	132.7	-176.9	23.4	-33.3	0	0	0	111.5	M53	P51-M53 PolarHBondContact O-N 3.37Å
52	A	51.7	Low	59	Low	96 Å²	96	114 Å²	114	79%	0.793	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-63.1	121.2	177.7	0	0	0	0	0	110.1	F50	F50-A52 PolarHBondContact O-N 3.11Å
53	M	54.8	Low	62.1	Low	56 Å²	56	107.3 Å²	107.3	28%	0.276	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-68.2	140.5	-176.6	-60.3	-139.4	-68	0	0	111	P51 R55 F59 T80	P51-M53 PolarHBondContact O-N 3.37Å; M53-R55 PolarHBondContact O-N 3.22Å; M53-F59 HydrophobicContact CB-CZ 4.2Å; M53-F59 HydrophobicContact CE-CD1 4.47Å; M53-F59 HydrophobicContact CE-CD2 4.4Å; M53-F59 HydrophobicContact CE-CE1 3.74Å; M53-F59 HydrophobicContact CE-CE2 3.66Å; M53-F59 HydrophobicContact CE-CZ 3.29Å; M53-F59 HydrophobicContact CG-CZ 4.44Å; M53-F59 HydrophobicContact SD-CE1 3.7Å; M53-F59 HydrophobicContact SD-CE2 4.36Å; M53-F59 HydrophobicContact SD-CZ 3.43Å; M53-F59 WeakPolarHBondContact SD-CZ 3.29Å; M53-T80 HydrophobicContact CE-CG2 3.77Å
54	P	53.4	Low	65	Low	80 Å²	80	102.6 Å²	102.6	52%	0.519	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-59.4	128.7	-176.8	-24.3	33.8	0	0	0	111.7	N56 R57	P54-N56 PolarHBondContact O-N 2.82Å; P54-R57 HydrophobicContact CB-CB 4.28Å; P54-R57 PolarHBondContact O-N 3.28Å; P54-R57 VanDerWaalsContact O-N 3.11Å
55	R	56.1	Low	67.8	Low	225 Å²	225	99.2 Å²	99.2	85%	0.849	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-1.8	-170.3	-70.6	-170.2	-179.4	-175.2	2.6	116.5	M53	M53-R55 PolarHBondContact O-N 3.22Å
56	N	65.2	Low	70.4	Confident	154 Å²	154	90.4 Å²	90.4	82%	0.824	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	22.6	-178.4	-134	36.4	0	0	0	112.1	P54	P54-N56 PolarHBondContact O-N 2.82Å
57	R	84	Confident	73.1	Confident	144 Å²	144	86.4 Å²	86.4	54%	0.543	44%	0.443	S	S	.	.			trans	-94.8	117.2	179.6	-178.7	171.5	-178.6	178.8	3.4	110.5	P54 F59	P54-R57 HydrophobicContact CB-CB 4.28Å; P54-R57 PolarHBondContact O-N 3.28Å; P54-R57 VanDerWaalsContact O-N 3.11Å; R57-F59 HydrophobicContact CB-CE2 4.01Å; R57-F59 HydrophobicContact CB-CZ 4.12Å; R57-F59 HydrophobicContact CG-CD2 4.48Å; R57-F59 HydrophobicContact CG-CE1 4.18Å; R57-F59 HydrophobicContact CG-CE2 3.92Å; R57-F59 HydrophobicContact CG-CZ 3.75Å; R57-F59 WeakPolarHBondContact O-CD2 3.17Å; R57-F59 WeakPolarHBondContact O-CE2 3.42Å
58	T	91.2	Very high	75.6	Confident	74 Å²	74	80.6 Å²	80.6	45%	0.454	44%	0.438	S	S	.	.			trans	-69.8	137.4	164.4	-58	0	0	0	0	110.6	N60 Y77 I97	T58-N60 WeakPolarHBondContact CG2-OD1 3.41Å; T58-Y77 WeakPolarHBondContact CA-O 3.09Å; T58-I97 HydrophobicContact CG2-CD1 3.56Å
59	F	93.5	Very high	78	Confident	28 Å²	28	78.5 Å²	78.5	12%	0.123	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127	170.4	-61.3	-91.2	0	0	0	108.7	M53 R57 S76 Y77 T80	M53-F59 HydrophobicContact CB-CZ 4.2Å; M53-F59 HydrophobicContact CE-CD1 4.47Å; M53-F59 HydrophobicContact CE-CD2 4.4Å; M53-F59 HydrophobicContact CE-CE1 3.74Å; M53-F59 HydrophobicContact CE-CE2 3.66Å; M53-F59 HydrophobicContact CE-CZ 3.29Å; M53-F59 HydrophobicContact CG-CZ 4.44Å; M53-F59 HydrophobicContact SD-CE1 3.7Å; M53-F59 HydrophobicContact SD-CE2 4.36Å; M53-F59 HydrophobicContact SD-CZ 3.43Å; M53-F59 WeakPolarHBondContact SD-CZ 3.29Å; R57-F59 HydrophobicContact CB-CE2 4.01Å; R57-F59 HydrophobicContact CB-CZ 4.12Å; R57-F59 HydrophobicContact CG-CD2 4.48Å; R57-F59 HydrophobicContact CG-CE1 4.18Å; R57-F59 HydrophobicContact CG-CE2 3.92Å; R57-F59 HydrophobicContact CG-CZ 3.75Å; R57-F59 WeakPolarHBondContact O-CD2 3.17Å; R57-F59 WeakPolarHBondContact O-CE2 3.42Å; F59-S76 CarbonylContact O-C 3.37Å; F59-S76 VanDerWaalsContact O-CA 3.29Å; F59-S76 WeakPolarHBondContact O-CA 3.33Å; F59-Y77 HydrophobicContact CB-CD1 4.24Å; F59-Y77 HydrophobicContact CB-CD2 3.96Å; F59-Y77 HydrophobicContact CB-CE1 3.85Å; F59-Y77 HydrophobicContact CB-CE2 3.53Å; F59-Y77 HydrophobicContact CB-CG 4.29Å; F59-Y77 VanDerWaalsContact CB-CZ 3.47Å; F59-Y77 AromaticContact CD2-CD2 3.99Å; F59-Y77 HydrophobicContact CD2-CD2 3.99Å; F59-Y77 AromaticContact CD2-CE2 3.61Å; F59-Y77 HydrophobicContact CD2-CE2 3.61Å; F59-Y77 HydrophobicContact CG-CD2 4.3Å; F59-Y77 AromaticContact CG-CE2 3.68Å; F59-Y77 HydrophobicContact CG-CE2 3.68Å; F59-Y77 AromaticContact CG-CZ 3.95Å; F59-Y77 PolarHBondContact N-O 3.27Å; F59-Y77 PolarHBondContact O-N 3.14Å; F59-T80 HydrophobicContact CD2-CG2 4.26Å; F59-T80 HydrophobicContact CE2-CG2 4.1Å
60	N	95.3	Very high	80.4	Confident	120 Å²	120	77.3 Å²	77.3	64%	0.642	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.2	172.2	-61.9	-24	0	0	0	107.6	T58 S76	T58-N60 WeakPolarHBondContact CG2-OD1 3.41Å; N60-S76 WeakPolarHBondContact OD1-CB 3.2Å; N60-S76 PolarHBondContact OD1-OG 2.98Å
61	V	95.7	Very high	82.5	Confident	21 Å²	21	82.3 Å²	82.3	13%	0.127	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	139.3	-179.7	-59.9	0	0	0	0	110.3	A63 V75 Y77 F137	V61-A63 HydrophobicContact CG2-CB 4.42Å; V61-V75 HydrophobicContact CG2-CB 4.24Å; V61-V75 PolarHBondContact N-O 3.18Å; V61-V75 PolarHBondContact O-N 3.5Å; V61-Y77 HydrophobicContact CG1-CE1 4.02Å; V61-Y77 HydrophobicContact CG2-CD1 4.38Å; V61-Y77 HydrophobicContact CG2-CE1 3.85Å; V61-F137 HydrophobicContact CB-CD2 3.91Å; V61-F137 HydrophobicContact CB-CE2 4.08Å; V61-F137 HydrophobicContact CB-CG 4.22Å; V61-F137 HydrophobicContact CG1-CD2 3.96Å; V61-F137 HydrophobicContact CG1-CE2 3.67Å; V61-F137 HydrophobicContact CG1-CZ 4.18Å; V61-F137 HydrophobicContact CG2-CD1 3.97Å; V61-F137 HydrophobicContact CG2-CD2 4.07Å; V61-F137 HydrophobicContact CG2-CE1 4.04Å; V61-F137 HydrophobicContact CG2-CE2 4.13Å; V61-F137 HydrophobicContact CG2-CG 3.99Å; V61-F137 HydrophobicContact CG2-CZ 4.11Å
62	S	96.3	Very high	84.9	Confident	57 Å²	57	83.1 Å²	83.1	40%	0.399	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	116.5	168.5	-152.4	0	0	0	0	108.3	D74	S62-D74 PolarHBondContact OG-OD1 3.49Å
63	A	97.2	Very high	87.1	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.008	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149.7	-169.9	0	0	0	0	0	111.6	V61 Q72 V73 V75 F137	V61-A63 HydrophobicContact CG2-CB 4.42Å; A63-Q72 WeakPolarHBondContact O-CA 3.1Å; A63-V73 PolarHBondContact N-O 3.39Å; A63-V73 WeakPolarHBondContact O-CG2 3.47Å; A63-V73 PolarHBondContact O-N 2.86Å; A63-V73 VanDerWaalsContact O-O 3.13Å; A63-V75 HydrophobicContact CB-CB 4.42Å; A63-V75 HydrophobicContact CB-CG2 3.95Å; A63-F137 HydrophobicContact CB-CB 3.88Å; A63-F137 HydrophobicContact CB-CD1 4.35Å; A63-F137 HydrophobicContact CB-CG 4.47Å
64	T	97.7	Very high	89	Confident	15 Å²	15	85.1 Å²	85.1	9%	0.092	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	133.7	175.8	-55.7	0	0	0	0	109.3	D70 Y135 F136	T64-D70 HydrophobicContact CG2-CB 4.25Å; T64-Y135 CarbonylContact O-C 3.54Å; T64-Y135 WeakPolarHBondContact O-CA 3.49Å; T64-F136 HydrophobicContact CG2-CE1 3.66Å; T64-F136 HydrophobicContact CG2-CE2 4.47Å; T64-F136 HydrophobicContact CG2-CZ 3.59Å; T64-F136 PolarHBondContact N-O 3.31Å; T64-F136 WeakPolarHBondContact O-CD1 3.45Å; T64-F136 PolarHBondContact O-N 3.29Å
65	P	97.2	Very high	91.1	Very high	33 Å²	33	81.8 Å²	81.8	21%	0.214	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	145.5	171.5	-26.5	36.1	0	0	0	112.6	Y67 R71 V73 Y135 F136	P65-Y67 VanDerWaalsContact C-N 3.28Å; P65-Y67 PolarHBondContact O-N 3.41Å; P65-R71 WeakPolarHBondContact CD-O 3.41Å; P65-V73 HydrophobicContact CG-CG2 4.32Å; P65-Y135 HydrophobicContact CB-CD1 4.45Å; P65-Y135 HydrophobicContact CG-CD1 4.4Å; P65-Y135 HydrophobicContact CG-CE1 4.45Å; P65-F136 WeakPolarHBondContact O-CE1 3.35Å
66	G	95.8	Very high	93.1	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	39%	0.391	C	S	.	.	S	Bend	trans	-62.4	-36.4	178.4	0	0	0	0	0	113.1	R123 L133 K134	G66-R123 WeakPolarHBondContact O-CB 3.49Å; G66-R123 WeakPolarHBondContact O-CG 3.26Å; G66-R123 PolarHBondContact O-NE 3.22Å; G66-L133 WeakPolarHBondContact CA-O 3.49Å; G66-K134 PolarHBondContact N-O 3.09Å
67	Y	94.5	Very high	94.6	Very high	48 Å²	48	66.3 Å²	66.3	19%	0.188	35%	0.354	C	S	.	.	S	Bend	trans	-119.2	155.6	-177.5	-46.4	-82.2	0	0	0	111	P65 L125 E126 R132 L133	P65-Y67 VanDerWaalsContact C-N 3.28Å; P65-Y67 PolarHBondContact O-N 3.41Å; Y67-L125 VanDerWaalsContact CE1-O 3.25Å; Y67-L125 WeakPolarHBondContact CE1-O 3.47Å; Y67-L125 PolarHBondContact OH-O 3.36Å; Y67-E126 HydrophobicContact CE1-CB 4.17Å; Y67-R132 HydrophobicContact CE2-CG 3.58Å; Y67-L133 WeakPolarHBondContact CE2-O 3.4Å; Y67-L133 PolarHBondContact OH-N 3.41Å
68	G	91.3	Very high	95.1	Very high	57 Å²	57	60.3 Å²	60.3	59%	0.588	33%	0.334	S	S	*	.	S	Bend	trans	78.9	-159.9	-177	0	0	0	0	0	113.5	R123	G68-R123 PolarHBondContact O-NH2 2.84Å; G68-R123 VanDerWaalsContact O-NH2 3.1Å
69	P	90.4	Very high	95.1	Very high	107 Å²	107	59.8 Å²	59.8	70%	0.695	33%	0.328	S	S	*	.			trans	-72.7	156.3	-170.8	30.5	-36.1	0	0	0	113.2	R71	P69-R71 PolarHBondContact O-N 2.96Å
70	D	92.5	Very high	94.9	Very high	108 Å²	108	58.9 Å²	58.9	58%	0.578	33%	0.325	S	S	*	.			trans	-74.7	36.2	-179.8	-72.6	-18.6	0	0	0	114.3	T64 Q72 R123	T64-D70 HydrophobicContact CG2-CB 4.25Å; D70-Q72 PolarHBondContact O-N 2.64Å; D70-R123 IonicContact OD1-CZ 3.85Å; D70-R123 IonicContact OD1-NH1 3.76Å; D70-R123 PolarHBondContact OD1-NH1 3.44Å; D70-R123 IonicContact OD1-NH2 3.4Å; D70-R123 PolarHBondContact OD1-NH2 2.81Å; D70-R123 IonicContact OD2-NH1 3.37Å
71	R	94.4	Very high	94.9	Very high	198 Å²	198	57.4 Å²	57.4	75%	0.747	31%	0.313	S	S	*	.			trans	-78.8	117.9	173.8	-178.7	175.6	179.5	172.6	1.2	109.5	P65 P69	P65-R71 WeakPolarHBondContact CD-O 3.41Å; P69-R71 PolarHBondContact O-N 2.96Å
72	Q	95.8	Very high	94.8	Very high	124 Å²	124	59 Å²	59	58%	0.579	32%	0.322	S	S	*	.			trans	-65.9	145	172.6	-71.1	177.7	-37.8	0	0	111.6	A63 D70	A63-Q72 WeakPolarHBondContact O-CA 3.1Å; D70-Q72 PolarHBondContact O-N 2.64Å
73	V	96.1	Very high	94.6	Very high	55 Å²	55	56.6 Å²	56.6	33%	0.333	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.3	173.2	-64.4	0	0	0	0	108.9	A63 P65 V75 Y135	A63-V73 PolarHBondContact N-O 3.39Å; A63-V73 WeakPolarHBondContact O-CG2 3.47Å; A63-V73 PolarHBondContact O-N 2.86Å; A63-V73 VanDerWaalsContact O-O 3.13Å; P65-V73 HydrophobicContact CG-CG2 4.32Å; V73-V75 HydrophobicContact CG2-CG2 4.22Å; V73-Y135 HydrophobicContact CG2-CD1 4.14Å; V73-Y135 HydrophobicContact CG2-CE1 3.87Å
74	D	96.4	Very high	94.1	Very high	139 Å²	139	56.8 Å²	56.8	74%	0.743	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.9	176.8	-62.8	-39.9	0	0	0	110.4	S62	S62-D74 PolarHBondContact OG-OD1 3.49Å
75	V	96.6	Very high	93.5	Very high	9 Å²	9	60.2 Å²	60.2	6%	0.055	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.7	-179.9	-180	0	0	0	0	108.7	V61 A63 V73 I96 Y135 I152	V61-V75 HydrophobicContact CG2-CB 4.24Å; V61-V75 PolarHBondContact N-O 3.18Å; V61-V75 PolarHBondContact O-N 3.5Å; A63-V75 HydrophobicContact CB-CB 4.42Å; A63-V75 HydrophobicContact CB-CG2 3.95Å; V73-V75 HydrophobicContact CG2-CG2 4.22Å; V75-I96 HydrophobicContact CG1-CD1 3.9Å; V75-Y135 HydrophobicContact CG2-CD1 4.11Å; V75-Y135 HydrophobicContact CG2-CD2 4.34Å; V75-Y135 HydrophobicContact CG2-CE1 4.19Å; V75-Y135 HydrophobicContact CG2-CE2 4.41Å; V75-Y135 HydrophobicContact CG2-CG 4.2Å; V75-I152 HydrophobicContact CG1-CD1 4.14Å
76	S	97	Very high	92.3	Very high	39 Å²	39	60.3 Å²	60.3	27%	0.273	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.2	176.4	-65.9	0	0	0	0	110.7	F59 N60 I97	F59-S76 CarbonylContact O-C 3.37Å; F59-S76 VanDerWaalsContact O-CA 3.29Å; F59-S76 WeakPolarHBondContact O-CA 3.33Å; N60-S76 WeakPolarHBondContact OD1-CB 3.2Å; N60-S76 PolarHBondContact OD1-OG 2.98Å; S76-I97 PolarHBondContact O-N 3.02Å
77	Y	96.6	Very high	91.3	Very high	15 Å²	15	63.8 Å²	63.8	6%	0.059	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	156.7	178	64.6	-95.4	0	0	0	113.8	T58 F59 V61 T80 A94 R95 I105 F137	T58-Y77 WeakPolarHBondContact CA-O 3.09Å; F59-Y77 HydrophobicContact CB-CD1 4.24Å; F59-Y77 HydrophobicContact CB-CD2 3.96Å; F59-Y77 HydrophobicContact CB-CE1 3.85Å; F59-Y77 HydrophobicContact CB-CE2 3.53Å; F59-Y77 HydrophobicContact CB-CG 4.29Å; F59-Y77 VanDerWaalsContact CB-CZ 3.47Å; F59-Y77 AromaticContact CD2-CD2 3.99Å; F59-Y77 HydrophobicContact CD2-CD2 3.99Å; F59-Y77 AromaticContact CD2-CE2 3.61Å; F59-Y77 HydrophobicContact CD2-CE2 3.61Å; F59-Y77 HydrophobicContact CG-CD2 4.3Å; F59-Y77 AromaticContact CG-CE2 3.68Å; F59-Y77 HydrophobicContact CG-CE2 3.68Å; F59-Y77 AromaticContact CG-CZ 3.95Å; F59-Y77 PolarHBondContact N-O 3.27Å; F59-Y77 PolarHBondContact O-N 3.14Å; V61-Y77 HydrophobicContact CG1-CE1 4.02Å; V61-Y77 HydrophobicContact CG2-CD1 4.38Å; V61-Y77 HydrophobicContact CG2-CE1 3.85Å; Y77-T80 HydrophobicContact CD2-CG2 3.83Å; Y77-T80 HydrophobicContact CE2-CG2 3.64Å; Y77-A94 HydrophobicContact CD2-CB 3.92Å; Y77-A94 HydrophobicContact CG-CB 4.46Å; Y77-R95 CarbonylContact C-O 3.56Å; Y77-R95 WeakPolarHBondContact CA-O 3.19Å; Y77-R95 VanDerWaalsContact CB-O 3.3Å; Y77-R95 WeakPolarHBondContact CB-O 3.18Å; Y77-I105 HydrophobicContact CD1-CD1 4.31Å; Y77-I105 HydrophobicContact CD2-CD1 3.95Å; Y77-I105 HydrophobicContact CE1-CD1 4.11Å; Y77-I105 HydrophobicContact CE2-CD1 3.74Å; Y77-I105 HydrophobicContact CG-CD1 4.24Å; Y77-F137 HydrophobicContact CE1-CE1 4.45Å; Y77-F137 HydrophobicContact CE1-CZ 4.06Å
78	T	96.2	Very high	90.4	Very high	18 Å²	18	66.9 Å²	66.9	11%	0.11	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	-174.2	-178.5	-177.9	0	0	0	0	110.6	T80 A94 R95 I97	T78-T80 VanDerWaalsContact C-N 3.27Å; T78-T80 PolarHBondContact O-N 3.01Å; T78-A94 WeakPolarHBondContact O-CA 3.5Å; T78-R95 HydrophobicContact CG2-CB 4.04Å; T78-R95 HydrophobicContact CG2-CG 4.23Å; T78-R95 PolarHBondContact N-O 2.81Å; T78-R95 PolarHBondContact O-N 2.89Å; T78-I97 HydrophobicContact CG2-CD1 4.24Å; T78-I97 HydrophobicContact CG2-CG1 3.94Å
79	D	89.7	Confident	90.1	Very high	64 Å²	64	65.3 Å²	65.3	34%	0.342	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.2	26.3	167.5	-57.7	10.7	0	0	0	114.5	K81 R95	D79-K81 PolarHBondContact O-N 3.31Å; D79-K81 VanDerWaalsContact O-N 3.15Å; D79-R95 HydrophobicContact CB-CB 4.1Å; D79-R95 WeakPolarHBondContact OD2-CD 3.39Å; D79-R95 IonicContact OD2-CZ 3.73Å; D79-R95 IonicContact OD2-NE 2.76Å; D79-R95 PolarHBondContact OD2-NE 3.43Å; D79-R95 IonicContact OD2-NH2 3.81Å
80	T	91.1	Very high	90.3	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.055	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	116	-174.1	44.2	0	0	0	0	113.2	M53 F59 Y77 T78 Q93 A94	M53-T80 HydrophobicContact CE-CG2 3.77Å; F59-T80 HydrophobicContact CD2-CG2 4.26Å; F59-T80 HydrophobicContact CE2-CG2 4.1Å; Y77-T80 HydrophobicContact CD2-CG2 3.83Å; Y77-T80 HydrophobicContact CE2-CG2 3.64Å; T78-T80 VanDerWaalsContact C-N 3.27Å; T78-T80 PolarHBondContact O-N 3.01Å; T80-Q93 CarbonylContact C-O 3.51Å; T80-Q93 VanDerWaalsContact CA-O 3.28Å; T80-Q93 WeakPolarHBondContact CA-O 3.14Å; T80-A94 HydrophobicContact CG2-CB 3.96Å
81	K	94	Very high	90.4	Very high	88 Å²	88	56.3 Å²	56.3	38%	0.383	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	175.9	-172.9	-154.6	174.2	-174.6	0	110	N37 D79 I83 Y92 Q93	N37-K81 PolarHBondContact OD1-NZ 2.55Å; D79-K81 PolarHBondContact O-N 3.31Å; D79-K81 VanDerWaalsContact O-N 3.15Å; K81-I83 HydrophobicContact CD-CG2 4.44Å; K81-I83 PolarHBondContact O-N 3.17Å; K81-Y92 CarbonylContact O-C 3.56Å; K81-Y92 VanDerWaalsContact O-CA 3.24Å; K81-Y92 WeakPolarHBondContact O-CA 3.4Å; K81-Q93 PolarHBondContact N-O 2.79Å; K81-Q93 PolarHBondContact O-N 3.22Å
82	V	93.9	Very high	90.5	Very high	54 Å²	54	48 Å²	48	33%	0.327	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	130	169	179.6	0	0	0	0	110	V90 Y92	V82-V90 HydrophobicContact CG1-CG1 4.01Å; V82-V90 HydrophobicContact CG2-CG1 3.98Å; V82-Y92 HydrophobicContact CG2-CD1 3.73Å; V82-Y92 HydrophobicContact CG2-CE1 3.56Å
83	I	92.5	Very high	90.6	Very high	8 Å²	8	44 Å²	44	4%	0.041	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	-12	178.2	59	170.4	0	0	0	113.7	A36 N37 K81 V91 Q93 Y155	A36-I83 CarbonylContact C-O 3.57Å; N37-I83 PolarHBondContact N-O 3.06Å; K81-I83 HydrophobicContact CD-CG2 4.44Å; K81-I83 PolarHBondContact O-N 3.17Å; I83-V91 HydrophobicContact CD1-CG1 3.96Å; I83-V91 HydrophobicContact CG1-CB 4.22Å; I83-V91 HydrophobicContact CG1-CG1 3.88Å; I83-V91 WeakPolarHBondContact CG1-O 3.37Å; I83-V91 PolarHBondContact N-O 3.25Å; I83-Q93 HydrophobicContact CD1-CB 4.2Å; I83-Q93 HydrophobicContact CG2-CB 3.64Å; I83-Y155 HydrophobicContact CD1-CD2 4.18Å; I83-Y155 HydrophobicContact CD1-CE2 3.82Å
84	G	86.3	Confident	90.6	Very high	4 Å²	4	41.3 Å²	41.3	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	153.2	174.8	0	0	0	0	0	112.2	T34 V91	T34-G84 WeakPolarHBondContact O-CA 3.22Å; G84-V91 PolarHBondContact N-O 3.37Å; G84-V91 PolarHBondContact O-N 3.43Å
85	N	84.5	Confident	90.7	Very high	88 Å²	88	38 Å²	38	47%	0.471	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	149.7	176.3	-67.4	-43.6	0	0	0	108.8	T34 V90	T34-N85 PolarHBondContact OG1-O 2.61Å; N85-V90 WeakPolarHBondContact OD1-CG1 3.43Å
86	G	73.1	Confident	90.7	Very high	34 Å²	34	38.2 Å²	38.2	35%	0.351	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	175.7	175.1	0	0	0	0	0	112	F88 G89	G86-F88 PolarHBondContact O-N 3.41Å; G86-F88 VanDerWaalsContact O-N 3.11Å; G86-G89 PolarHBondContact N-O 3.37Å; G86-G89 PolarHBondContact O-N 3.4Å; G86-G89 VanDerWaalsContact O-O 3.12Å
87	S	73.7	Confident	90.6	Very high	74 Å²	74	40.2 Å²	40.2	52%	0.517	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.3	179.5	47.7	0	0	0	0	114	S31	S31-S87 PolarHBondContact OG-OG 2.86Å
88	F	75.5	Confident	90.4	Very high	112 Å²	112	43.5 Å²	43.5	49%	0.491	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-12.3	-179.7	-52.3	-64.5	0	0	0	114.6	G86 V108	G86-F88 PolarHBondContact O-N 3.41Å; G86-F88 VanDerWaalsContact O-N 3.11Å; F88-V108 HydrophobicContact CB-CG1 4.5Å; F88-V108 WeakPolarHBondContact O-CA 3.5Å; F88-V108 WeakPolarHBondContact O-CB 3.36Å; F88-V108 WeakPolarHBondContact O-CG1 3.23Å
89	G	86.6	Confident	90.4	Very high	24 Å²	24	46 Å²	46	25%	0.247	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.9	-155	-178.5	0	0	0	0	0	115.4	G86 K107	G86-G89 PolarHBondContact N-O 3.37Å; G86-G89 PolarHBondContact O-N 3.4Å; G86-G89 VanDerWaalsContact O-O 3.12Å; G89-K107 WeakPolarHBondContact CA-O 3.34Å
90	V	93.4	Very high	90.6	Very high	4 Å²	4	48 Å²	48	2%	0.024	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.4	-169.9	-178.9	0	0	0	0	110.6	F50 V82 N85 Y92 K107	F50-V90 HydrophobicContact CD1-CG2 4.24Å; F50-V90 HydrophobicContact CD2-CG2 4.13Å; F50-V90 HydrophobicContact CE1-CG2 4.25Å; F50-V90 HydrophobicContact CE2-CG2 4.13Å; F50-V90 HydrophobicContact CG-CG2 4.19Å; F50-V90 HydrophobicContact CZ-CG2 4.2Å; V82-V90 HydrophobicContact CG1-CG1 4.01Å; V82-V90 HydrophobicContact CG2-CG1 3.98Å; N85-V90 WeakPolarHBondContact OD1-CG1 3.43Å; V90-Y92 HydrophobicContact CB-CE2 3.89Å; V90-Y92 HydrophobicContact CG1-CD1 4.43Å; V90-Y92 HydrophobicContact CG1-CD2 4.07Å; V90-Y92 HydrophobicContact CG1-CE1 3.95Å; V90-Y92 HydrophobicContact CG1-CE2 3.54Å; V90-Y92 HydrophobicContact CG1-CG 4.48Å; V90-Y92 VanDerWaalsContact CG1-CZ 3.47Å; V90-K107 PolarHBondContact N-O 3.12Å; V90-K107 PolarHBondContact O-N 2.92Å
91	V	95.4	Very high	90.8	Very high	23 Å²	23	51.3 Å²	51.3	14%	0.139	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.5	173.3	-168.7	0	0	0	0	109.8	I83 G84 A104 I105 K106	I83-V91 HydrophobicContact CD1-CG1 3.96Å; I83-V91 HydrophobicContact CG1-CB 4.22Å; I83-V91 HydrophobicContact CG1-CG1 3.88Å; I83-V91 WeakPolarHBondContact CG1-O 3.37Å; I83-V91 PolarHBondContact N-O 3.25Å; G84-V91 PolarHBondContact N-O 3.37Å; G84-V91 PolarHBondContact O-N 3.43Å; V91-A104 HydrophobicContact CG1-CB 4.35Å; V91-I105 WeakPolarHBondContact CA-O 3.19Å; V91-K106 HydrophobicContact CG2-CG 4.25Å
92	Y	96.5	Very high	91	Very high	24 Å²	24	49.7 Å²	49.7	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.2	174.7	-53.1	-96.1	0	0	0	110.4	K81 V82 V90 A104 I105 K107	K81-Y92 CarbonylContact O-C 3.56Å; K81-Y92 VanDerWaalsContact O-CA 3.24Å; K81-Y92 WeakPolarHBondContact O-CA 3.4Å; V82-Y92 HydrophobicContact CG2-CD1 3.73Å; V82-Y92 HydrophobicContact CG2-CE1 3.56Å; V90-Y92 HydrophobicContact CB-CE2 3.89Å; V90-Y92 HydrophobicContact CG1-CD1 4.43Å; V90-Y92 HydrophobicContact CG1-CD2 4.07Å; V90-Y92 HydrophobicContact CG1-CE1 3.95Å; V90-Y92 HydrophobicContact CG1-CE2 3.54Å; V90-Y92 HydrophobicContact CG1-CG 4.48Å; V90-Y92 VanDerWaalsContact CG1-CZ 3.47Å; Y92-A104 CarbonylContact O-C 3.39Å; Y92-A104 WeakPolarHBondContact O-CA 3.17Å; Y92-I105 PolarHBondContact N-O 3.48Å; Y92-I105 PolarHBondContact O-N 2.95Å; Y92-K107 HydrophobicContact CE2-CB 3.98Å; Y92-K107 HydrophobicContact CE2-CD 4.26Å
93	Q	97.2	Very high	91.2	Very high	38 Å²	38	47.1 Å²	47.1	18%	0.178	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	141.5	152.7	178.7	-176.6	-4.6	0	0	107.9	T80 K81 I83 L102 V103 Y155	T80-Q93 CarbonylContact C-O 3.51Å; T80-Q93 VanDerWaalsContact CA-O 3.28Å; T80-Q93 WeakPolarHBondContact CA-O 3.14Å; K81-Q93 PolarHBondContact N-O 2.79Å; K81-Q93 PolarHBondContact O-N 3.22Å; I83-Q93 HydrophobicContact CD1-CB 4.2Å; I83-Q93 HydrophobicContact CG2-CB 3.64Å; Q93-L102 HydrophobicContact CG-CD2 4.47Å; Q93-V103 WeakPolarHBondContact CA-O 3.36Å; Q93-Y155 HydrophobicContact CB-CD2 4.48Å; Q93-Y155 HydrophobicContact CB-CE2 4.25Å; Q93-Y155 HydrophobicContact CG-CD2 4.2Å; Q93-Y155 HydrophobicContact CG-CE2 4.07Å
94	A	97.4	Very high	91.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	170.6	168.5	0	0	0	0	0	110.3	Y77 T78 T80 L102 V103 I105	Y77-A94 HydrophobicContact CD2-CB 3.92Å; Y77-A94 HydrophobicContact CG-CB 4.46Å; T78-A94 WeakPolarHBondContact O-CA 3.5Å; T80-A94 HydrophobicContact CG2-CB 3.96Å; A94-L102 WeakPolarHBondContact O-CA 3.42Å; A94-V103 HydrophobicContact CB-CG2 4.07Å; A94-V103 PolarHBondContact N-O 2.86Å; A94-V103 PolarHBondContact O-N 3.36Å; A94-I105 HydrophobicContact CB-CD1 3.75Å; A94-I105 HydrophobicContact CB-CG1 4.26Å
95	R	97.6	Very high	92	Very high	68 Å²	68	47.2 Å²	47.2	26%	0.257	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126	176.8	174.8	-173.8	-62.6	-72.1	-3.2	109.7	Y77 T78 D79 D100 L102	Y77-R95 CarbonylContact C-O 3.56Å; Y77-R95 WeakPolarHBondContact CA-O 3.19Å; Y77-R95 VanDerWaalsContact CB-O 3.3Å; Y77-R95 WeakPolarHBondContact CB-O 3.18Å; T78-R95 HydrophobicContact CG2-CB 4.04Å; T78-R95 HydrophobicContact CG2-CG 4.23Å; T78-R95 PolarHBondContact N-O 2.81Å; T78-R95 PolarHBondContact O-N 2.89Å; D79-R95 HydrophobicContact CB-CB 4.1Å; D79-R95 WeakPolarHBondContact OD2-CD 3.39Å; D79-R95 IonicContact OD2-CZ 3.73Å; D79-R95 IonicContact OD2-NE 2.76Å; D79-R95 PolarHBondContact OD2-NE 3.43Å; D79-R95 IonicContact OD2-NH2 3.81Å; R95-D100 WeakPolarHBondContact CD-OD1 3.25Å; R95-D100 IonicContact CZ-OD1 3.55Å; R95-D100 IonicContact NE-OD1 3.71Å; R95-D100 PolarHBondContact NH1-O 3.29Å; R95-D100 VanDerWaalsContact NH1-O 3.14Å; R95-D100 IonicContact NH1-OD1 2.72Å; R95-D100 PolarHBondContact NH1-OD1 3.44Å; R95-D100 IonicContact NH1-OD2 3.02Å; R95-D100 PolarHBondContact NH1-OD2 2.98Å; R95-L102 HydrophobicContact CB-CD2 4.18Å
96	I	97	Very high	92.6	Very high	15 Å²	15	44 Å²	44	8%	0.077	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.7	175.7	-58.8	-60.1	0	0	0	109.6	V75 S99 D100 E101 V103	V75-I96 HydrophobicContact CG1-CD1 3.9Å; I96-S99 WeakPolarHBondContact CG2-OG 3.4Å; I96-D100 WeakPolarHBondContact O-CA 3.49Å; I96-D100 PolarHBondContact O-N 3.06Å; I96-E101 PolarHBondContact N-O 3.33Å; I96-V103 HydrophobicContact CD1-CG1 4.07Å; I96-V103 HydrophobicContact CD1-CG2 3.72Å; I96-V103 HydrophobicContact CG1-CB 4.45Å; I96-V103 HydrophobicContact CG1-CG1 3.64Å; I96-V103 HydrophobicContact CG1-CG2 3.93Å
97	I	95.4	Very high	93.7	Very high	80 Å²	80	44.4 Å²	44.4	41%	0.41	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	135.1	176.1	-62.4	177.4	0	0	0	108.7	T58 S76 T78	T58-I97 HydrophobicContact CG2-CD1 3.56Å; S76-I97 PolarHBondContact O-N 3.02Å; T78-I97 HydrophobicContact CG2-CD1 4.24Å; T78-I97 HydrophobicContact CG2-CG1 3.94Å
98	G	92.2	Very high	94.7	Very high	85 Å²	85	41.2 Å²	41.2	88%	0.876	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.7	-39.5	-178.3	0	0	0	0	0	114
99	S	94.6	Very high	95.5	Very high	70 Å²	70	40.7 Å²	40.7	49%	0.49	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-8.8	173.2	68.9	0	0	0	0	114.6	I96 E101	I96-S99 WeakPolarHBondContact CG2-OG 3.4Å; S99-E101 PolarHBondContact O-N 2.93Å; S99-E101 WeakPolarHBondContact OG-CB 3.5Å
100	D	94.2	Very high	95.7	Very high	105 Å²	105	40.6 Å²	40.6	56%	0.561	23%	0.229	S	C	*	.			trans	58	7.3	-172.6	-159.7	47.1	0	0	0	115.4	R95 I96	R95-D100 WeakPolarHBondContact CD-OD1 3.25Å; R95-D100 IonicContact CZ-OD1 3.55Å; R95-D100 IonicContact NE-OD1 3.71Å; R95-D100 PolarHBondContact NH1-O 3.29Å; R95-D100 VanDerWaalsContact NH1-O 3.14Å; R95-D100 IonicContact NH1-OD1 2.72Å; R95-D100 PolarHBondContact NH1-OD1 3.44Å; R95-D100 IonicContact NH1-OD2 3.02Å; R95-D100 PolarHBondContact NH1-OD2 2.98Å; I96-D100 WeakPolarHBondContact O-CA 3.49Å; I96-D100 PolarHBondContact O-N 3.06Å
101	E	96.2	Very high	95.4	Very high	80 Å²	80	43.2 Å²	43.2	37%	0.374	24%	0.243	S	C	.	.			trans	-76.4	134	-168.6	-161.2	-162.9	133.1	0	0	112.1	I96 S99 K134	I96-E101 PolarHBondContact N-O 3.33Å; S99-E101 PolarHBondContact O-N 2.93Å; S99-E101 WeakPolarHBondContact OG-CB 3.5Å; E101-K134 WeakPolarHBondContact OE1-CE 3.49Å; E101-K134 IonicContact OE1-NZ 3.24Å; E101-K134 PolarHBondContact OE1-NZ 3.08Å; E101-K134 IonicContact OE2-NZ 2.77Å; E101-K134 PolarHBondContact OE2-NZ 3.04Å
102	L	97.4	Very high	94.8	Very high	53 Å²	53	48.4 Å²	48.4	28%	0.277	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136	172.6	-67.1	-179.2	0	0	0	111.3	Q93 A94 R95 Y155	Q93-L102 HydrophobicContact CG-CD2 4.47Å; A94-L102 WeakPolarHBondContact O-CA 3.42Å; R95-L102 HydrophobicContact CB-CD2 4.18Å; L102-Y155 HydrophobicContact CB-CD1 3.92Å; L102-Y155 HydrophobicContact CB-CG 4.1Å; L102-Y155 HydrophobicContact CD1-CD1 4.05Å; L102-Y155 HydrophobicContact CD1-CE1 4.21Å; L102-Y155 WeakPolarHBondContact O-CB 3.44Å; L102-Y155 PolarHBondContact O-N 3.15Å
103	V	98.1	Very high	94.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.2	179.4	-68.6	0	0	0	0	111.4	Q93 A94 I96 I105 K134 I152 L153	Q93-V103 WeakPolarHBondContact CA-O 3.36Å; A94-V103 HydrophobicContact CB-CG2 4.07Å; A94-V103 PolarHBondContact N-O 2.86Å; A94-V103 PolarHBondContact O-N 3.36Å; I96-V103 HydrophobicContact CD1-CG1 4.07Å; I96-V103 HydrophobicContact CD1-CG2 3.72Å; I96-V103 HydrophobicContact CG1-CB 4.45Å; I96-V103 HydrophobicContact CG1-CG1 3.64Å; I96-V103 HydrophobicContact CG1-CG2 3.93Å; V103-I105 HydrophobicContact CG2-CG1 4.36Å; V103-K134 HydrophobicContact CG1-CD 3.94Å; V103-I152 HydrophobicContact CB-CG2 3.7Å; V103-I152 HydrophobicContact CG1-CG2 3.85Å; V103-I152 HydrophobicContact CG2-CG2 3.89Å; V103-L153 WeakPolarHBondContact CA-O 3.46Å; V103-L153 VanDerWaalsContact CB-O 3.3Å; V103-L153 WeakPolarHBondContact CB-O 3.48Å
104	A	98	Very high	93.6	Very high	10 Å²	10	61.2 Å²	61.2	8%	0.083	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.6	170.3	0	0	0	0	0	109.6	V91 Y92 L153 Y155	V91-A104 HydrophobicContact CG1-CB 4.35Å; Y92-A104 CarbonylContact O-C 3.39Å; Y92-A104 WeakPolarHBondContact O-CA 3.17Å; A104-L153 HydrophobicContact CB-CB 4.34Å; A104-L153 PolarHBondContact N-O 3.48Å; A104-L153 WeakPolarHBondContact O-CB 3.5Å; A104-L153 PolarHBondContact O-N 2.97Å; A104-Y155 HydrophobicContact CB-CD2 4.45Å
105	I	97.8	Very high	93.1	Very high	5 Å²	5	70.9 Å²	70.9	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	105.5	177.7	-52.3	-177.9	0	0	0	108.7	Y77 V91 Y92 A94 V103 F137 N150 L151 I152	Y77-I105 HydrophobicContact CD1-CD1 4.31Å; Y77-I105 HydrophobicContact CD2-CD1 3.95Å; Y77-I105 HydrophobicContact CE1-CD1 4.11Å; Y77-I105 HydrophobicContact CE2-CD1 3.74Å; Y77-I105 HydrophobicContact CG-CD1 4.24Å; V91-I105 WeakPolarHBondContact CA-O 3.19Å; Y92-I105 PolarHBondContact N-O 3.48Å; Y92-I105 PolarHBondContact O-N 2.95Å; A94-I105 HydrophobicContact CB-CD1 3.75Å; A94-I105 HydrophobicContact CB-CG1 4.26Å; V103-I105 HydrophobicContact CG2-CG1 4.36Å; I105-F137 HydrophobicContact CG2-CE1 4.43Å; I105-F137 HydrophobicContact CG2-CZ 4.47Å; I105-N150 HydrophobicContact CG2-CB 4.09Å; I105-L151 CarbonylContact C-O 3.59Å; I105-L151 VanDerWaalsContact CA-O 3.3Å; I105-L151 WeakPolarHBondContact CA-O 3.09Å; I105-I152 HydrophobicContact CG1-CG1 4.35Å
106	K	96.9	Very high	92.8	Very high	19 Å²	19	69.1 Å²	69.1	8%	0.083	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	106.7	173.2	-166.5	-169.4	-164.1	-174.3	0	108.9	V91 V108 E118 N150 L151 D221	V91-K106 HydrophobicContact CG2-CG 4.25Å; K106-V108 HydrophobicContact CD-CG1 4.16Å; K106-V108 HydrophobicContact CG-CG1 4.01Å; K106-E118 IonicContact NZ-OE1 2.66Å; K106-E118 PolarHBondContact NZ-OE1 3.24Å; K106-E118 IonicContact NZ-OE2 3.38Å; K106-E118 PolarHBondContact NZ-OE2 2.8Å; K106-N150 WeakPolarHBondContact O-CA 3.48Å; K106-L151 HydrophobicContact CB-CB 4.3Å; K106-L151 HydrophobicContact CD-CD1 4.45Å; K106-L151 PolarHBondContact N-O 3.4Å; K106-L151 PolarHBondContact O-N 3.42Å; K106-D221 IonicContact NZ-OD1 2.71Å; K106-D221 PolarHBondContact NZ-OD1 3.41Å
107	K	96.2	Very high	92.7	Very high	43 Å²	43	74.5 Å²	74.5	19%	0.187	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	112.1	176.3	-178.6	-179.7	177.7	-171.6	0	109.4	G89 V90 Y92 Y148 L149 N150	G89-K107 WeakPolarHBondContact CA-O 3.34Å; V90-K107 PolarHBondContact N-O 3.12Å; V90-K107 PolarHBondContact O-N 2.92Å; Y92-K107 HydrophobicContact CE2-CB 3.98Å; Y92-K107 HydrophobicContact CE2-CD 4.26Å; K107-Y148 HydrophobicContact CD-CD1 4.21Å; K107-Y148 HydrophobicContact CD-CG 4.31Å; K107-Y148 VanDerWaalsContact CE-CD1 3.43Å; K107-Y148 HydrophobicContact CG-CD1 3.8Å; K107-Y148 HydrophobicContact CG-CG 4.1Å; K107-L149 WeakPolarHBondContact CA-O 3.38Å; K107-N150 WeakPolarHBondContact CG-OD1 3.29Å
108	V	94.3	Very high	92.7	Very high	8 Å²	8	71.2 Å²	71.2	5%	0.048	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	147	178.9	-56.6	0	0	0	0	110.8	F88 K106 Y148 L149	F88-V108 HydrophobicContact CB-CG1 4.5Å; F88-V108 WeakPolarHBondContact O-CA 3.5Å; F88-V108 WeakPolarHBondContact O-CB 3.36Å; F88-V108 WeakPolarHBondContact O-CG1 3.23Å; K106-V108 HydrophobicContact CD-CG1 4.16Å; K106-V108 HydrophobicContact CG-CG1 4.01Å; V108-Y148 CarbonylContact O-C 3.59Å; V108-Y148 VanDerWaalsContact O-CA 3.27Å; V108-Y148 WeakPolarHBondContact O-CA 3.36Å; V108-Y148 WeakPolarHBondContact O-CD1 3.42Å; V108-L149 HydrophobicContact CG2-CB 3.93Å; V108-L149 HydrophobicContact CG2-CD2 4.35Å; V108-L149 HydrophobicContact CG2-CG 4.38Å; V108-L149 PolarHBondContact N-O 2.89Å; V108-L149 PolarHBondContact O-N 2.83Å
109	L	92.7	Very high	92.9	Very high	101 Å²	101	67.8 Å²	67.8	53%	0.529	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.5	174.4	-176.8	67.1	0	0	0	109.5	E146 Y148	L109-E146 HydrophobicContact CD1-CB 4.22Å; L109-E146 HydrophobicContact CD1-CG 4.13Å; L109-Y148 HydrophobicContact CB-CD1 4.29Å; L109-Y148 HydrophobicContact CB-CE1 3.99Å; L109-Y148 HydrophobicContact CD1-CD1 4.35Å; L109-Y148 HydrophobicContact CD1-CE1 3.94Å; L109-Y148 HydrophobicContact CD1-CE2 4.17Å
110	Q	91.5	Very high	93	Very high	22 Å²	22	66.8 Å²	66.8	10%	0.103	31%	0.312	C	S	.	.			trans	-106.8	116.2	-177.3	-176.6	58	43.7	0	0	111.4	K112 F114 N116 Y138 V147 L149	Q110-K112 PolarHBondContact O-N 3.24Å; Q110-F114 PolarHBondContact NE2-O 3.1Å; Q110-N116 PolarHBondContact OE1-ND2 2.7Å; Q110-Y138 HydrophobicContact CG-CE1 4.13Å; Q110-V147 WeakPolarHBondContact CA-O 3.34Å; Q110-V147 HydrophobicContact CB-CG1 4.32Å; Q110-V147 WeakPolarHBondContact CB-O 3.44Å; Q110-V147 PolarHBondContact N-O 3.48Å; Q110-L149 HydrophobicContact CB-CB 4.27Å
111	D	87.2	Confident	93.2	Very high	58 Å²	58	62.3 Å²	62.3	31%	0.31	29%	0.288	S	S	.	.			trans	-68	119.9	163.6	-168.8	-28.8	0	0	0	109.4	R113 F114	D111-R113 PolarHBondContact O-N 3.14Å; D111-R113 VanDerWaalsContact OD1-CB 3.25Å; D111-R113 WeakPolarHBondContact OD1-CB 3.42Å; D111-R113 WeakPolarHBondContact OD1-CG 3.18Å; D111-R113 IonicContact OD1-CZ 2.86Å; D111-R113 PolarHBondContact OD1-N 3.21Å; D111-R113 IonicContact OD1-NE 3.43Å; D111-R113 PolarHBondContact OD1-NE 3.26Å; D111-R113 IonicContact OD1-NH2 3.51Å; D111-R113 IonicContact OD2-CZ 2.61Å; D111-R113 IonicContact OD2-NE 2.76Å; D111-R113 PolarHBondContact OD2-NE 3Å; D111-R113 VanDerWaalsContact OD2-NE 3.14Å; D111-R113 IonicContact OD2-NH2 3.58Å; D111-R113 PolarHBondContact OD2-NH2 3.25Å; D111-F114 HydrophobicContact CB-CD2 4.25Å; D111-F114 PolarHBondContact O-N 2.76Å; D111-F114 WeakPolarHBondContact OD2-CD2 3.3Å
112	K	82.9	Confident	93.2	Very high	132 Å²	132	58.6 Å²	58.6	57%	0.574	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.3	179.9	-70.2	168.9	172.7	164.7	0	113.3	Q110 E145	Q110-K112 PolarHBondContact O-N 3.24Å; K112-E145 VanDerWaalsContact CE-O 3.24Å; K112-E145 WeakPolarHBondContact CE-O 3.45Å; K112-E145 PolarHBondContact NZ-O 3.3Å
113	R	84	Confident	93.2	Very high	195 Å²	195	59.2 Å²	59.2	74%	0.736	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-19.3	-176.1	-58.5	171.1	-67.7	-174	3.3	113.5	D111	D111-R113 PolarHBondContact O-N 3.14Å; D111-R113 VanDerWaalsContact OD1-CB 3.25Å; D111-R113 WeakPolarHBondContact OD1-CB 3.42Å; D111-R113 WeakPolarHBondContact OD1-CG 3.18Å; D111-R113 IonicContact OD1-CZ 2.86Å; D111-R113 PolarHBondContact OD1-N 3.21Å; D111-R113 IonicContact OD1-NE 3.43Å; D111-R113 PolarHBondContact OD1-NE 3.26Å; D111-R113 IonicContact OD1-NH2 3.51Å; D111-R113 IonicContact OD2-CZ 2.61Å; D111-R113 IonicContact OD2-NE 2.76Å; D111-R113 PolarHBondContact OD2-NE 3Å; D111-R113 VanDerWaalsContact OD2-NE 3.14Å; D111-R113 IonicContact OD2-NH2 3.58Å; D111-R113 PolarHBondContact OD2-NH2 3.25Å
114	F	83.7	Confident	93.1	Very high	137 Å²	137	67.4 Å²	67.4	60%	0.601	30%	0.3	S	S	*	.	S	Bend	trans	-129.5	140.5	-171.4	-58.9	-71.5	0	0	0	112	Q110 D111 N116	Q110-F114 PolarHBondContact NE2-O 3.1Å; D111-F114 HydrophobicContact CB-CD2 4.25Å; D111-F114 PolarHBondContact O-N 2.76Å; D111-F114 WeakPolarHBondContact OD2-CD2 3.3Å; F114-N116 PolarHBondContact O-N 2.93Å
115	K	86.9	Confident	93.1	Very high	203 Å²	203	67 Å²	67	88%	0.883	30%	0.296	S	S	*	.			trans	-67.1	133	169.8	-68.8	-174.7	178.4	-178.4	0	109.6	R117	K115-R117 PolarHBondContact O-N 2.81Å
116	N	91.8	Very high	93	Very high	31 Å²	31	71.8 Å²	71.8	17%	0.166	32%	0.318	C	S	.	.			trans	-65.2	122.3	178.3	-164.7	-64.7	0	0	0	111	Q110 F114 E118 L119 A120 L149	Q110-N116 PolarHBondContact OE1-ND2 2.7Å; F114-N116 PolarHBondContact O-N 2.93Å; N116-E118 WeakPolarHBondContact OD1-CB 3.31Å; N116-E118 PolarHBondContact OD1-N 3.29Å; N116-L119 HydrophobicContact CB-CB 4.03Å; N116-L119 PolarHBondContact OD1-N 3.2Å; N116-A120 WeakPolarHBondContact O-CB 3.33Å; N116-A120 PolarHBondContact O-N 2.88Å; N116-L149 HydrophobicContact CB-CD2 3.65Å; N116-L149 VanDerWaalsContact CG-CD2 3.48Å; N116-L149 WeakPolarHBondContact ND2-CD2 3.32Å
117	R	94.5	Very high	93.1	Very high	128 Å²	128	71.8 Å²	71.8	48%	0.483	32%	0.319	S	S	.	.	H	α-helix	trans	-70.5	-38.6	-176.2	-167.4	-171.1	-63.9	161	3.1	112.5	K115 A120 I121 A225	K115-R117 PolarHBondContact O-N 2.81Å; R117-A120 PolarHBondContact O-N 3.16Å; R117-I121 HydrophobicContact CG-CD1 4.02Å; R117-I121 WeakPolarHBondContact O-CB 3.31Å; R117-I121 WeakPolarHBondContact O-CG1 3.35Å; R117-I121 PolarHBondContact O-N 2.99Å; R117-A225 WeakPolarHBondContact CD-O 3.27Å
118	E	95.9	Very high	93.2	Very high	10 Å²	10	72.4 Å²	72.4	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-48.4	177.8	-178	167.6	-158.7	0	0	110.1	K106 N116 A120 I121 M122 L151 F222 G223	K106-E118 IonicContact NZ-OE1 2.66Å; K106-E118 PolarHBondContact NZ-OE1 3.24Å; K106-E118 IonicContact NZ-OE2 3.38Å; K106-E118 PolarHBondContact NZ-OE2 2.8Å; N116-E118 WeakPolarHBondContact OD1-CB 3.31Å; N116-E118 PolarHBondContact OD1-N 3.29Å; E118-A120 PolarHBondContact O-N 3.16Å; E118-I121 PolarHBondContact O-N 2.84Å; E118-M122 HydrophobicContact CG-CG 4.21Å; E118-M122 HydrophobicContact CG-SD 4.39Å; E118-M122 WeakPolarHBondContact O-CB 3.46Å; E118-M122 VanDerWaalsContact O-CG 3.32Å; E118-M122 WeakPolarHBondContact O-CG 3.34Å; E118-M122 PolarHBondContact O-N 3.02Å; E118-L151 HydrophobicContact CG-CD1 4.04Å; E118-F222 HydrophobicContact CG-CB 3.98Å; E118-F222 PolarHBondContact OE1-N 3.22Å; E118-G223 VanDerWaalsContact CD-N 3.34Å; E118-G223 PolarHBondContact OE1-N 3.17Å
119	L	96.6	Very high	93.4	Very high	14 Å²	14	72.1 Å²	72.1	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-49.2	174.1	179.5	62.5	0	0	0	112.1	N116 I121 M122 R123 L133 F136 L149 L151	N116-L119 HydrophobicContact CB-CB 4.03Å; N116-L119 PolarHBondContact OD1-N 3.2Å; L119-I121 PolarHBondContact O-N 2.88Å; L119-M122 PolarHBondContact O-N 3.29Å; L119-R123 HydrophobicContact CD1-CG 3.87Å; L119-R123 HydrophobicContact CG-CG 4.41Å; L119-R123 WeakPolarHBondContact O-CG 3.42Å; L119-R123 PolarHBondContact O-N 3.14Å; L119-L133 HydrophobicContact CD1-CD2 3.78Å; L119-F136 HydrophobicContact CD1-CB 3.96Å; L119-F136 HydrophobicContact CD1-CD1 3.69Å; L119-F136 HydrophobicContact CD1-CD2 3.98Å; L119-F136 HydrophobicContact CD1-CE1 4.15Å; L119-F136 HydrophobicContact CD1-CE2 4.41Å; L119-F136 HydrophobicContact CD1-CG 3.6Å; L119-F136 HydrophobicContact CD1-CZ 4.48Å; L119-F136 HydrophobicContact CD2-CD2 3.8Å; L119-F136 HydrophobicContact CD2-CE2 3.92Å; L119-F136 HydrophobicContact CD2-CG 4.29Å; L119-F136 HydrophobicContact CD2-CZ 4.48Å; L119-L149 HydrophobicContact CB-CD2 4.08Å; L119-L149 HydrophobicContact CD2-CD1 4.18Å; L119-L149 HydrophobicContact CD2-CD2 4.17Å; L119-L151 HydrophobicContact CB-CD2 4.39Å; L119-L151 HydrophobicContact CD1-CD2 3.81Å
120	A	96.4	Very high	93.6	Very high	49 Å²	49	67.4 Å²	67.4	41%	0.405	30%	0.296	S	S	.	.	H	α-helix	trans	-63.2	-26.7	-178.3	0	0	0	0	0	113.5	N116 R117 E118	N116-A120 WeakPolarHBondContact O-CB 3.33Å; N116-A120 PolarHBondContact O-N 2.88Å; R117-A120 PolarHBondContact O-N 3.16Å; E118-A120 PolarHBondContact O-N 3.16Å
121	I	97.6	Very high	94	Very high	11 Å²	11	66.4 Å²	66.4	6%	0.056	29%	0.292	C	S	.	.	H	α-helix	trans	-78.2	-57.5	170.5	-76.7	172.4	0	0	0	110.1	R117 E118 L119 R123 R124 L125 I198 F222 A225	R117-I121 HydrophobicContact CG-CD1 4.02Å; R117-I121 WeakPolarHBondContact O-CB 3.31Å; R117-I121 WeakPolarHBondContact O-CG1 3.35Å; R117-I121 PolarHBondContact O-N 2.99Å; E118-I121 PolarHBondContact O-N 2.84Å; L119-I121 PolarHBondContact O-N 2.88Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 3.38Å; I121-R124 WeakPolarHBondContact O-CB 3.37Å; I121-R124 PolarHBondContact O-N 2.63Å; I121-L125 HydrophobicContact CG2-CD1 3.76Å; I121-L125 HydrophobicContact CG2-CG 4.21Å; I121-I198 HydrophobicContact CD1-CG2 4.25Å; I121-I198 HydrophobicContact CG2-CD1 4.27Å; I121-I198 HydrophobicContact CG2-CG2 4.16Å; I121-F222 HydrophobicContact CG2-CB 4.3Å; I121-F222 HydrophobicContact CG2-CD1 3.91Å; I121-F222 HydrophobicContact CG2-CG 4.32Å; I121-A225 HydrophobicContact CD1-CB 3.64Å
122	M	97.8	Very high	94.5	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-57.8	-35.5	-172.3	-75.4	-150.8	77.7	0	0	114	E118 L119 R124 L125 V131 L133 L151 L153 F222	E118-M122 HydrophobicContact CG-CG 4.21Å; E118-M122 HydrophobicContact CG-SD 4.39Å; E118-M122 WeakPolarHBondContact O-CB 3.46Å; E118-M122 VanDerWaalsContact O-CG 3.32Å; E118-M122 WeakPolarHBondContact O-CG 3.34Å; E118-M122 PolarHBondContact O-N 3.02Å; L119-M122 PolarHBondContact O-N 3.29Å; M122-R124 PolarHBondContact O-N 2.85Å; M122-L125 PolarHBondContact O-N 2.74Å; M122-V131 HydrophobicContact CE-CG1 3.75Å; M122-V131 WeakPolarHBondContact CE-O 3.39Å; M122-L133 HydrophobicContact CB-CB 4.17Å; M122-L133 HydrophobicContact CB-CD2 3.92Å; M122-L133 HydrophobicContact CE-CB 4.03Å; M122-L151 HydrophobicContact SD-CD1 4.44Å; M122-L153 HydrophobicContact CE-CD2 3.83Å; M122-L153 HydrophobicContact SD-CD2 3.91Å; M122-F222 HydrophobicContact CE-CD2 4.4Å; M122-F222 HydrophobicContact CG-CB 4.17Å; M122-F222 HydrophobicContact CG-CD2 4.24Å; M122-F222 HydrophobicContact CG-CG 4.38Å; M122-F222 HydrophobicContact SD-CD2 4.47Å
123	R	97.1	Very high	95.2	Very high	66 Å²	66	63.4 Å²	63.4	25%	0.249	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.2	174.8	-67.5	-164.7	70.6	-175.4	7.4	114.6	G66 G68 D70 L119 I121 L133	G66-R123 WeakPolarHBondContact O-CB 3.49Å; G66-R123 WeakPolarHBondContact O-CG 3.26Å; G66-R123 PolarHBondContact O-NE 3.22Å; G68-R123 PolarHBondContact O-NH2 2.84Å; G68-R123 VanDerWaalsContact O-NH2 3.1Å; D70-R123 IonicContact OD1-CZ 3.85Å; D70-R123 IonicContact OD1-NH1 3.76Å; D70-R123 PolarHBondContact OD1-NH1 3.44Å; D70-R123 IonicContact OD1-NH2 3.4Å; D70-R123 PolarHBondContact OD1-NH2 2.81Å; D70-R123 IonicContact OD2-NH1 3.37Å; L119-R123 HydrophobicContact CD1-CG 3.87Å; L119-R123 HydrophobicContact CG-CG 4.41Å; L119-R123 WeakPolarHBondContact O-CG 3.42Å; L119-R123 PolarHBondContact O-N 3.14Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 3.38Å; R123-L133 HydrophobicContact CG-CD2 3.75Å
124	R	96	Very high	95.9	Very high	172 Å²	172	55.9 Å²	55.9	65%	0.649	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-6.6	176.5	-55.2	178.4	177.3	-162	-4.2	113.3	I121 M122 Y192	I121-R124 WeakPolarHBondContact O-CB 3.37Å; I121-R124 PolarHBondContact O-N 2.63Å; M122-R124 PolarHBondContact O-N 2.85Å; R124-Y192 PolarHBondContact O-OH 2.83Å
125	L	97.5	Very high	96.5	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	23%	0.229	C	C	.	.			trans	-103.6	107.2	-172.2	-56.9	-172.9	0	0	0	111.1	Y67 I121 M122 V130 Y192 I193 L196 I198 F222	Y67-L125 VanDerWaalsContact CE1-O 3.25Å; Y67-L125 WeakPolarHBondContact CE1-O 3.47Å; Y67-L125 PolarHBondContact OH-O 3.36Å; I121-L125 HydrophobicContact CG2-CD1 3.76Å; I121-L125 HydrophobicContact CG2-CG 4.21Å; M122-L125 PolarHBondContact O-N 2.74Å; L125-V130 HydrophobicContact CB-CG1 4.09Å; L125-V130 HydrophobicContact CD1-CG1 4.11Å; L125-Y192 HydrophobicContact CB-CE1 4.3Å; L125-Y192 HydrophobicContact CD2-CE1 3.95Å; L125-I193 HydrophobicContact CD1-CG2 4.16Å; L125-I193 HydrophobicContact CD2-CG2 4.03Å; L125-L196 HydrophobicContact CD2-CD1 3.66Å; L125-I198 HydrophobicContact CD2-CD1 3.92Å; L125-F222 HydrophobicContact CD1-CD1 3.74Å; L125-F222 HydrophobicContact CD1-CD2 4.35Å; L125-F222 HydrophobicContact CD1-CE1 3.34Å; L125-F222 HydrophobicContact CD1-CE2 4.03Å; L125-F222 HydrophobicContact CD1-CG 4.23Å; L125-F222 HydrophobicContact CD1-CZ 3.52Å
126	E	96.2	Very high	97.1	Very high	106 Å²	106	43.5 Å²	43.5	50%	0.495	19%	0.189	S	C	.	.			trans	-129.9	93.3	173.2	-174	152.4	-120.2	0	0	109.2	Y67 R132 Y192	Y67-E126 HydrophobicContact CE1-CB 4.17Å; E126-R132 IonicContact OE1-CZ 1.86Å; E126-R132 IonicContact OE1-NE 3.71Å; E126-R132 PolarHBondContact OE1-NE 2.81Å; E126-R132 IonicContact OE1-NH2 3.76Å; E126-R132 PolarHBondContact OE1-NH2 2.78Å; E126-Y192 PolarHBondContact N-OH 2.78Å; E126-Y192 PolarHBondContact O-OH 2.65Å
127	H	98	Very high	97.3	Very high	20 Å²	20	42.3 Å²	42.3	9%	0.093	18%	0.183	C	C	.	.			trans	-149.3	145	179	-177.2	-85.1	0	0	0	109.4	N129 V130 R188 Y192 E387	H127-N129 VanDerWaalsContact C-N 3.28Å; H127-N129 WeakPolarHBondContact CE1-CB 3.22Å; H127-N129 PolarHBondContact CE1-OD1 2.69Å; H127-N129 PolarHBondContact ND1-N 3.15Å; H127-N129 PolarHBondContact O-N 3.46Å; H127-V130 HydrophobicContact CB-CB 4.35Å; H127-V130 HydrophobicContact CB-CG2 4.1Å; H127-V130 PolarHBondContact O-N 3.17Å; H127-V130 VanDerWaalsContact O-N 3.08Å; H127-R188 WeakPolarHBondContact CE1-CB 3.03Å; H127-R188 PolarHBondContact NE2-NE 3.12Å; H127-R188 PolarHBondContact NE2-NH2 3.1Å; H127-Y192 HydrophobicContact CB-CD1 3.51Å; H127-Y192 HydrophobicContact CB-CD2 4Å; H127-Y192 HydrophobicContact CB-CE1 3.65Å; H127-Y192 HydrophobicContact CB-CE2 4.11Å; H127-Y192 HydrophobicContact CB-CG 3.7Å; H127-Y192 AromaticContact CD2-CD2 3.68Å; H127-Y192 AromaticContact CD2-CG 3.62Å; H127-Y192 AromaticContact CG-CG 3.78Å; H127-E387 IonicContact CD2-OE1 2.69Å; H127-E387 IonicContact CD2-OE2 3.83Å; H127-E387 IonicContact NE2-OE1 3.33Å; H127-E387 PolarHBondContact NE2-OE1 3.03Å; H127-E387 IonicContact NE2-OE2 2.81Å; H127-E387 PolarHBondContact NE2-OE2 3.49Å
128	Q	97.6	Very high	97.4	Very high	55 Å²	55	42 Å²	42	26%	0.257	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.1	-172.6	70.5	-158.8	-54.4	0	0	114.1	V130 R188 K218 P379 N382	Q128-V130 VanDerWaalsContact C-N 3.33Å; Q128-R188 VanDerWaalsContact NE2-NH1 3.16Å; Q128-K218 WeakPolarHBondContact O-CE 3.35Å; Q128-K218 WeakPolarHBondContact O-CG 3.24Å; Q128-K218 PolarHBondContact O-NZ 2.85Å; Q128-P379 PolarHBondContact OE1-O 3.45Å; Q128-N382 VanDerWaalsContact NE2-CG 3.3Å; Q128-N382 PolarHBondContact NE2-ND2 3.09Å; Q128-N382 PolarHBondContact NE2-OD1 2.93Å; Q128-N382 PolarHBondContact OE1-ND2 3.17Å; Q128-N382 PolarHBondContact OE1-OD1 3.45Å
129	N	98.7	Very high	97.3	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.011	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	16.6	179.1	-56.5	117.5	0	0	0	113.1	H127 Q185 A189 L217 K218 L219	H127-N129 VanDerWaalsContact C-N 3.28Å; H127-N129 WeakPolarHBondContact CE1-CB 3.22Å; H127-N129 PolarHBondContact CE1-OD1 2.69Å; H127-N129 PolarHBondContact ND1-N 3.15Å; H127-N129 PolarHBondContact O-N 3.46Å; N129-Q185 HydrophobicContact CB-CB 4.49Å; N129-Q185 WeakPolarHBondContact CB-O 3.23Å; N129-Q185 WeakPolarHBondContact ND2-CB 3.3Å; N129-Q185 WeakPolarHBondContact ND2-CG 3.32Å; N129-Q185 PolarHBondContact ND2-OE1 3.28Å; N129-A189 HydrophobicContact CB-CB 3.94Å; N129-A189 WeakPolarHBondContact O-CB 3.22Å; N129-L217 WeakPolarHBondContact CA-O 3.4Å; N129-L217 WeakPolarHBondContact CB-O 3.32Å; N129-L217 PolarHBondContact ND2-O 3.08Å; N129-K218 CarbonylContact O-C 3.45Å; N129-K218 WeakPolarHBondContact O-CA 3.35Å; N129-L219 PolarHBondContact O-N 3.47Å
130	V	98.6	Very high	97.1	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-116.9	145.1	169.1	177.3	0	0	0	0	108.5	L125 H127 Q128 R132 A189 Y192 I193 K218 F222	L125-V130 HydrophobicContact CB-CG1 4.09Å; L125-V130 HydrophobicContact CD1-CG1 4.11Å; H127-V130 HydrophobicContact CB-CB 4.35Å; H127-V130 HydrophobicContact CB-CG2 4.1Å; H127-V130 PolarHBondContact O-N 3.17Å; H127-V130 VanDerWaalsContact O-N 3.08Å; Q128-V130 VanDerWaalsContact C-N 3.33Å; V130-R132 PolarHBondContact O-N 3.47Å; V130-A189 HydrophobicContact CG2-CB 4.2Å; V130-Y192 HydrophobicContact CG2-CD1 4.33Å; V130-I193 HydrophobicContact CG2-CG2 4.31Å; V130-K218 PolarHBondContact O-NZ 2.86Å; V130-F222 HydrophobicContact CG1-CE2 3.68Å; V130-F222 HydrophobicContact CG1-CZ 3.67Å
131	V	98.3	Very high	96.8	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.012	21%	0.214	C	C	.	.			trans	-69.8	124.8	176.6	74.6	0	0	0	0	110.7	M122 L153 E154 L209 L219 C220	M122-V131 HydrophobicContact CE-CG1 3.75Å; M122-V131 WeakPolarHBondContact CE-O 3.39Å; V131-L153 HydrophobicContact CG2-CB 4.22Å; V131-E154 WeakPolarHBondContact CA-OE1 3.45Å; V131-E154 HydrophobicContact CG2-CG 3.65Å; V131-L209 HydrophobicContact CB-CD1 4.48Å; V131-L209 HydrophobicContact CG2-CD1 4.08Å; V131-L219 WeakPolarHBondContact CG1-O 3.36Å; V131-L219 PolarHBondContact N-O 3.31Å; V131-C220 HydrophobicContact CB-CB 4.06Å; V131-C220 HydrophobicContact CG1-CB 3.63Å
132	R	98.1	Very high	96.3	Very high	127 Å²	127	56.9 Å²	56.9	48%	0.479	25%	0.253	S	S	.	.			trans	-76	128.6	-175.6	-165.4	174.2	-161	-165.8	5.2	111.5	Y67 E126 V130 K134 L153 E154	Y67-R132 HydrophobicContact CE2-CG 3.58Å; E126-R132 IonicContact OE1-CZ 1.86Å; E126-R132 IonicContact OE1-NE 3.71Å; E126-R132 PolarHBondContact OE1-NE 2.81Å; E126-R132 IonicContact OE1-NH2 3.76Å; E126-R132 PolarHBondContact OE1-NH2 2.78Å; V130-R132 PolarHBondContact O-N 3.47Å; R132-K134 PolarHBondContact O-N 3.38Å; R132-L153 WeakPolarHBondContact O-CA 3.36Å; R132-E154 HydrophobicContact CB-CG 4.34Å; R132-E154 WeakPolarHBondContact CB-OE1 3.36Å; R132-E154 PolarHBondContact N-OE1 2.79Å; R132-E154 PolarHBondContact O-N 3.34Å
133	L	98.2	Very high	95.8	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	106.3	168.3	176.4	66	0	0	0	109	G66 Y67 L119 M122 R123 Y135 L151 L153	G66-L133 WeakPolarHBondContact CA-O 3.49Å; Y67-L133 WeakPolarHBondContact CE2-O 3.4Å; Y67-L133 PolarHBondContact OH-N 3.41Å; L119-L133 HydrophobicContact CD1-CD2 3.78Å; M122-L133 HydrophobicContact CB-CB 4.17Å; M122-L133 HydrophobicContact CB-CD2 3.92Å; M122-L133 HydrophobicContact CE-CB 4.03Å; R123-L133 HydrophobicContact CG-CD2 3.75Å; L133-Y135 WeakPolarHBondContact CD1-O 3.47Å; L133-L151 HydrophobicContact CD1-CB 3.95Å; L133-L151 HydrophobicContact CD1-CD2 4.04Å; L133-L153 HydrophobicContact CB-CD2 4.33Å; L133-L153 HydrophobicContact CD1-CD2 3.78Å
134	K	97.5	Very high	95	Very high	37 Å²	37	65.5 Å²	65.5	16%	0.161	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-51.4	-178.8	-59.3	-174.8	68.6	-169.3	0	111.6	G66 E101 V103 R132 I152	G66-K134 PolarHBondContact N-O 3.09Å; E101-K134 WeakPolarHBondContact OE1-CE 3.49Å; E101-K134 IonicContact OE1-NZ 3.24Å; E101-K134 PolarHBondContact OE1-NZ 3.08Å; E101-K134 IonicContact OE2-NZ 2.77Å; E101-K134 PolarHBondContact OE2-NZ 3.04Å; V103-K134 HydrophobicContact CG1-CD 3.94Å; R132-K134 PolarHBondContact O-N 3.38Å; K134-I152 WeakPolarHBondContact CA-O 3.36Å; K134-I152 HydrophobicContact CB-CG2 4.48Å; K134-I152 WeakPolarHBondContact CB-O 3.41Å; K134-I152 PolarHBondContact N-O 3.48Å
135	Y	98	Very high	94.5	Very high	66 Å²	66	64.9 Å²	64.9	26%	0.259	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	164.3	-179.9	-50.9	-86.2	0	0	0	110.8	T64 P65 V73 V75 L133 I152	T64-Y135 CarbonylContact O-C 3.54Å; T64-Y135 WeakPolarHBondContact O-CA 3.49Å; P65-Y135 HydrophobicContact CB-CD1 4.45Å; P65-Y135 HydrophobicContact CG-CD1 4.4Å; P65-Y135 HydrophobicContact CG-CE1 4.45Å; V73-Y135 HydrophobicContact CG2-CD1 4.14Å; V73-Y135 HydrophobicContact CG2-CE1 3.87Å; V75-Y135 HydrophobicContact CG2-CD1 4.11Å; V75-Y135 HydrophobicContact CG2-CD2 4.34Å; V75-Y135 HydrophobicContact CG2-CE1 4.19Å; V75-Y135 HydrophobicContact CG2-CE2 4.41Å; V75-Y135 HydrophobicContact CG2-CG 4.2Å; L133-Y135 WeakPolarHBondContact CD1-O 3.47Å; Y135-I152 HydrophobicContact CD2-CB 4.39Å; Y135-I152 HydrophobicContact CD2-CD1 4.35Å; Y135-I152 HydrophobicContact CD2-CG2 4.35Å; Y135-I152 PolarHBondContact N-O 3.16Å; Y135-I152 PolarHBondContact O-N 3.07Å
136	F	97.9	Very high	94.2	Very high	13 Å²	13	66.6 Å²	66.6	6%	0.057	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.3	165.9	65.5	-82	0	0	0	111.3	T64 P65 L119 Y138 L149 N150 L151	T64-F136 HydrophobicContact CG2-CE1 3.66Å; T64-F136 HydrophobicContact CG2-CE2 4.47Å; T64-F136 HydrophobicContact CG2-CZ 3.59Å; T64-F136 PolarHBondContact N-O 3.31Å; T64-F136 WeakPolarHBondContact O-CD1 3.45Å; T64-F136 PolarHBondContact O-N 3.29Å; P65-F136 WeakPolarHBondContact O-CE1 3.35Å; L119-F136 HydrophobicContact CD1-CB 3.96Å; L119-F136 HydrophobicContact CD1-CD1 3.69Å; L119-F136 HydrophobicContact CD1-CD2 3.98Å; L119-F136 HydrophobicContact CD1-CE1 4.15Å; L119-F136 HydrophobicContact CD1-CE2 4.41Å; L119-F136 HydrophobicContact CD1-CG 3.6Å; L119-F136 HydrophobicContact CD1-CZ 4.48Å; L119-F136 HydrophobicContact CD2-CD2 3.8Å; L119-F136 HydrophobicContact CD2-CE2 3.92Å; L119-F136 HydrophobicContact CD2-CG 4.29Å; L119-F136 HydrophobicContact CD2-CZ 4.48Å; F136-Y138 HydrophobicContact CD2-CE2 4.48Å; F136-Y138 HydrophobicContact CE2-CE2 4.48Å; F136-L149 HydrophobicContact CB-CD1 4.24Å; F136-L149 HydrophobicContact CD2-CD1 4.27Å; F136-N150 VanDerWaalsContact CA-O 3.26Å; F136-N150 WeakPolarHBondContact CA-O 3.48Å; F136-L151 HydrophobicContact CB-CD2 3.9Å
137	F	97.4	Very high	94	Very high	6 Å²	6	62.9 Å²	62.9	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	158.4	177.9	66	-82.1	0	0	0	111.7	V61 A63 Y77 I105 T139 N150 I152	V61-F137 HydrophobicContact CB-CD2 3.91Å; V61-F137 HydrophobicContact CB-CE2 4.08Å; V61-F137 HydrophobicContact CB-CG 4.22Å; V61-F137 HydrophobicContact CG1-CD2 3.96Å; V61-F137 HydrophobicContact CG1-CE2 3.67Å; V61-F137 HydrophobicContact CG1-CZ 4.18Å; V61-F137 HydrophobicContact CG2-CD1 3.97Å; V61-F137 HydrophobicContact CG2-CD2 4.07Å; V61-F137 HydrophobicContact CG2-CE1 4.04Å; V61-F137 HydrophobicContact CG2-CE2 4.13Å; V61-F137 HydrophobicContact CG2-CG 3.99Å; V61-F137 HydrophobicContact CG2-CZ 4.11Å; A63-F137 HydrophobicContact CB-CB 3.88Å; A63-F137 HydrophobicContact CB-CD1 4.35Å; A63-F137 HydrophobicContact CB-CG 4.47Å; Y77-F137 HydrophobicContact CE1-CE1 4.45Å; Y77-F137 HydrophobicContact CE1-CZ 4.06Å; I105-F137 HydrophobicContact CG2-CE1 4.43Å; I105-F137 HydrophobicContact CG2-CZ 4.47Å; F137-T139 HydrophobicContact CD2-CG2 3.88Å; F137-T139 HydrophobicContact CE2-CG2 3.64Å; F137-N150 HydrophobicContact CD1-CB 3.8Å; F137-N150 HydrophobicContact CD2-CB 4Å; F137-N150 HydrophobicContact CE1-CB 3.45Å; F137-N150 VanDerWaalsContact CE1-CB 3.45Å; F137-N150 HydrophobicContact CE2-CB 3.68Å; F137-N150 HydrophobicContact CG-CB 4.05Å; F137-N150 HydrophobicContact CZ-CB 3.4Å; F137-N150 PolarHBondContact N-O 2.69Å; F137-N150 WeakPolarHBondContact O-CB 3.22Å; F137-N150 PolarHBondContact O-N 2.98Å; F137-N150 PolarHBondContact O-ND2 3.44Å; F137-I152 HydrophobicContact CD1-CD1 4.03Å; F137-I152 HydrophobicContact CD1-CG1 4.06Å; F137-I152 HydrophobicContact CE1-CD1 3.74Å; F137-I152 HydrophobicContact CE1-CG1 3.73Å
138	Y	95.6	Very high	93.9	Very high	122 Å²	122	63.5 Å²	63.5	48%	0.478	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.5	178	-64	-80.5	0	0	0	111.1	Q110 F136 V147 Y148 L149	Q110-Y138 HydrophobicContact CG-CE1 4.13Å; F136-Y138 HydrophobicContact CD2-CE2 4.48Å; F136-Y138 HydrophobicContact CE2-CE2 4.48Å; Y138-V147 HydrophobicContact CD1-CG1 3.84Å; Y138-V147 HydrophobicContact CG-CG1 4.38Å; Y138-Y148 CarbonylContact C-O 3.45Å; Y138-Y148 VanDerWaalsContact CA-O 3.31Å; Y138-Y148 WeakPolarHBondContact CA-O 3.47Å; Y138-L149 HydrophobicContact CD1-CB 4.18Å; Y138-L149 HydrophobicContact CD1-CD1 4.13Å; Y138-L149 HydrophobicContact CE1-CB 3.94Å; Y138-L149 HydrophobicContact CE1-CD1 3.64Å; Y138-L149 HydrophobicContact CE1-CG 4.29Å
139	T	94.5	Very high	93.8	Very high	44 Å²	44	60.9 Å²	60.9	27%	0.27	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.2	172.3	45.5	0	0	0	0	110.3	F137 V147 Y148 N150	F137-T139 HydrophobicContact CD2-CG2 3.88Å; F137-T139 HydrophobicContact CE2-CG2 3.64Å; T139-V147 CarbonylContact O-C 3.56Å; T139-V147 WeakPolarHBondContact O-CA 3.48Å; T139-Y148 PolarHBondContact N-O 3.03Å; T139-Y148 PolarHBondContact O-N 3Å; T139-N150 PolarHBondContact N-ND2 3.49Å; T139-N150 PolarHBondContact OG1-ND2 3.24Å; T139-N150 PolarHBondContact OG1-OD1 2.75Å
140	K	92.7	Very high	93.8	Very high	175 Å²	175	61.1 Å²	61.1	76%	0.761	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	149.2	169.2	-64.9	-177.4	-180	-179.9	0	109.5
141	G	88.6	Confident	93.8	Very high	15 Å²	15	61 Å²	61	16%	0.155	29%	0.293	C	S	.	.			trans	-80.7	-176.4	165.7	0	0	0	0	0	112.2	K143 E146	G141-K143 VanDerWaalsContact C-N 3.28Å; G141-E146 PolarHBondContact N-O 3.22Å
142	D	87.5	Confident	93.7	Very high	163 Å²	163	61 Å²	61	87%	0.872	29%	0.293	S	S	*	.	S	Bend	trans	-72.5	-27.6	175.1	-54.7	-57.7	0	0	0	110.9
143	K	87.4	Confident	93.7	Very high	135 Å²	135	55.7 Å²	55.7	59%	0.587	27%	0.274	S	S	*	.	S	Bend	trans	-86.7	137.7	165.6	-48.3	-166.4	-164.9	85.3	0	110.1	G141 E145 E146	G141-K143 VanDerWaalsContact C-N 3.28Å; K143-E145 PolarHBondContact O-N 3.43Å; K143-E145 VanDerWaalsContact O-N 3.1Å; K143-E146 HydrophobicContact CB-CB 4.49Å; K143-E146 HydrophobicContact CB-CG 4.04Å; K143-E146 WeakPolarHBondContact CD-OE1 3.44Å; K143-E146 IonicContact NZ-OE1 3.82Å; K143-E146 PolarHBondContact NZ-OE1 3.32Å; K143-E146 PolarHBondContact O-N 3Å
144	S	81.2	Confident	93.7	Very high	112 Å²	112	57.4 Å²	57.4	78%	0.783	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.9	-179.5	52.4	0	0	0	0	114.6
145	E	85.5	Confident	93.7	Very high	159 Å²	159	57.8 Å²	57.8	74%	0.743	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-20.4	178.5	-63.5	-167.4	173.8	0	0	113.9	K112 K143	K112-E145 VanDerWaalsContact CE-O 3.24Å; K112-E145 WeakPolarHBondContact CE-O 3.45Å; K112-E145 PolarHBondContact NZ-O 3.3Å; K143-E145 PolarHBondContact O-N 3.43Å; K143-E145 VanDerWaalsContact O-N 3.1Å
146	E	90.2	Very high	93.6	Very high	37 Å²	37	56 Å²	56	17%	0.173	28%	0.278	C	S	.	.			trans	-77.2	131	-179.1	-72.4	168.8	-176.4	0	0	111	L109 G141 K143 Y148	L109-E146 HydrophobicContact CD1-CB 4.22Å; L109-E146 HydrophobicContact CD1-CG 4.13Å; G141-E146 PolarHBondContact N-O 3.22Å; K143-E146 HydrophobicContact CB-CB 4.49Å; K143-E146 HydrophobicContact CB-CG 4.04Å; K143-E146 WeakPolarHBondContact CD-OE1 3.44Å; K143-E146 IonicContact NZ-OE1 3.82Å; K143-E146 PolarHBondContact NZ-OE1 3.32Å; K143-E146 PolarHBondContact O-N 3Å; E146-Y148 HydrophobicContact CB-CE2 4.17Å
147	V	93.4	Very high	93.5	Very high	29 Å²	29	57.7 Å²	57.7	18%	0.176	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.8	165.9	168.4	0	0	0	0	107.3	Q110 Y138 T139	Q110-V147 WeakPolarHBondContact CA-O 3.34Å; Q110-V147 HydrophobicContact CB-CG1 4.32Å; Q110-V147 WeakPolarHBondContact CB-O 3.44Å; Q110-V147 PolarHBondContact N-O 3.48Å; Y138-V147 HydrophobicContact CD1-CG1 3.84Å; Y138-V147 HydrophobicContact CG-CG1 4.38Å; T139-V147 CarbonylContact O-C 3.56Å; T139-V147 WeakPolarHBondContact O-CA 3.48Å
148	Y	94.9	Very high	93.4	Very high	33 Å²	33	59.8 Å²	59.8	13%	0.129	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	135	174.6	-71.2	-91.2	0	0	0	109.5	K107 V108 L109 Y138 T139 E146 N150	K107-Y148 HydrophobicContact CD-CD1 4.21Å; K107-Y148 HydrophobicContact CD-CG 4.31Å; K107-Y148 VanDerWaalsContact CE-CD1 3.43Å; K107-Y148 HydrophobicContact CG-CD1 3.8Å; K107-Y148 HydrophobicContact CG-CG 4.1Å; V108-Y148 CarbonylContact O-C 3.59Å; V108-Y148 VanDerWaalsContact O-CA 3.27Å; V108-Y148 WeakPolarHBondContact O-CA 3.36Å; V108-Y148 WeakPolarHBondContact O-CD1 3.42Å; L109-Y148 HydrophobicContact CB-CD1 4.29Å; L109-Y148 HydrophobicContact CB-CE1 3.99Å; L109-Y148 HydrophobicContact CD1-CD1 4.35Å; L109-Y148 HydrophobicContact CD1-CE1 3.94Å; L109-Y148 HydrophobicContact CD1-CE2 4.17Å; Y138-Y148 CarbonylContact C-O 3.45Å; Y138-Y148 VanDerWaalsContact CA-O 3.31Å; Y138-Y148 WeakPolarHBondContact CA-O 3.47Å; T139-Y148 PolarHBondContact N-O 3.03Å; T139-Y148 PolarHBondContact O-N 3Å; E146-Y148 HydrophobicContact CB-CE2 4.17Å; Y148-N150 PolarHBondContact O-ND2 2.89Å
149	L	96.5	Very high	93.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.9	165.5	172.3	63.5	0	0	0	108.2	K107 V108 Q110 N116 L119 F136 Y138 L151	K107-L149 WeakPolarHBondContact CA-O 3.38Å; V108-L149 HydrophobicContact CG2-CB 3.93Å; V108-L149 HydrophobicContact CG2-CD2 4.35Å; V108-L149 HydrophobicContact CG2-CG 4.38Å; V108-L149 PolarHBondContact N-O 2.89Å; V108-L149 PolarHBondContact O-N 2.83Å; Q110-L149 HydrophobicContact CB-CB 4.27Å; N116-L149 HydrophobicContact CB-CD2 3.65Å; N116-L149 VanDerWaalsContact CG-CD2 3.48Å; N116-L149 WeakPolarHBondContact ND2-CD2 3.32Å; L119-L149 HydrophobicContact CB-CD2 4.08Å; L119-L149 HydrophobicContact CD2-CD1 4.18Å; L119-L149 HydrophobicContact CD2-CD2 4.17Å; F136-L149 HydrophobicContact CB-CD1 4.24Å; F136-L149 HydrophobicContact CD2-CD1 4.27Å; Y138-L149 HydrophobicContact CD1-CB 4.18Å; Y138-L149 HydrophobicContact CD1-CD1 4.13Å; Y138-L149 HydrophobicContact CE1-CB 3.94Å; Y138-L149 HydrophobicContact CE1-CD1 3.64Å; Y138-L149 HydrophobicContact CE1-CG 4.29Å; L149-L151 HydrophobicContact CD1-CD2 4.05Å; L149-L151 HydrophobicContact CD2-CD2 3.98Å; L149-L151 HydrophobicContact CG-CD2 3.95Å; L149-L151 HydrophobicContact CG-CG 4.4Å
150	N	97.5	Very high	93.7	Very high	7 Å²	7	52 Å²	52	4%	0.037	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	113.2	-179.6	-48.5	-98	0	0	0	107.1	I105 K106 K107 F136 F137 T139 Y148	I105-N150 HydrophobicContact CG2-CB 4.09Å; K106-N150 WeakPolarHBondContact O-CA 3.48Å; K107-N150 WeakPolarHBondContact CG-OD1 3.29Å; F136-N150 VanDerWaalsContact CA-O 3.26Å; F136-N150 WeakPolarHBondContact CA-O 3.48Å; F137-N150 HydrophobicContact CD1-CB 3.8Å; F137-N150 HydrophobicContact CD2-CB 4Å; F137-N150 HydrophobicContact CE1-CB 3.45Å; F137-N150 VanDerWaalsContact CE1-CB 3.45Å; F137-N150 HydrophobicContact CE2-CB 3.68Å; F137-N150 HydrophobicContact CG-CB 4.05Å; F137-N150 HydrophobicContact CZ-CB 3.4Å; F137-N150 PolarHBondContact N-O 2.69Å; F137-N150 WeakPolarHBondContact O-CB 3.22Å; F137-N150 PolarHBondContact O-N 2.98Å; F137-N150 PolarHBondContact O-ND2 3.44Å; T139-N150 PolarHBondContact N-ND2 3.49Å; T139-N150 PolarHBondContact OG1-ND2 3.24Å; T139-N150 PolarHBondContact OG1-OD1 2.75Å; Y148-N150 PolarHBondContact O-ND2 2.89Å
151	L	97.8	Very high	93.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.1	175.8	-55.1	179.4	0	0	0	108.7	I105 K106 E118 L119 M122 L133 F136 L149 L153	I105-L151 CarbonylContact C-O 3.59Å; I105-L151 VanDerWaalsContact CA-O 3.3Å; I105-L151 WeakPolarHBondContact CA-O 3.09Å; K106-L151 HydrophobicContact CB-CB 4.3Å; K106-L151 HydrophobicContact CD-CD1 4.45Å; K106-L151 PolarHBondContact N-O 3.4Å; K106-L151 PolarHBondContact O-N 3.42Å; E118-L151 HydrophobicContact CG-CD1 4.04Å; L119-L151 HydrophobicContact CB-CD2 4.39Å; L119-L151 HydrophobicContact CD1-CD2 3.81Å; M122-L151 HydrophobicContact SD-CD1 4.44Å; L133-L151 HydrophobicContact CD1-CB 3.95Å; L133-L151 HydrophobicContact CD1-CD2 4.04Å; F136-L151 HydrophobicContact CB-CD2 3.9Å; L149-L151 HydrophobicContact CD1-CD2 4.05Å; L149-L151 HydrophobicContact CD2-CD2 3.98Å; L149-L151 HydrophobicContact CG-CD2 3.95Å; L149-L151 HydrophobicContact CG-CG 4.4Å; L151-L153 HydrophobicContact CB-CD2 4.16Å; L151-L153 HydrophobicContact CB-CG 4.44Å
152	I	98	Very high	94.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.1	171.6	-50.9	-170.5	0	0	0	108	V75 V103 I105 K134 Y135 F137	V75-I152 HydrophobicContact CG1-CD1 4.14Å; V103-I152 HydrophobicContact CB-CG2 3.7Å; V103-I152 HydrophobicContact CG1-CG2 3.85Å; V103-I152 HydrophobicContact CG2-CG2 3.89Å; I105-I152 HydrophobicContact CG1-CG1 4.35Å; K134-I152 WeakPolarHBondContact CA-O 3.36Å; K134-I152 HydrophobicContact CB-CG2 4.48Å; K134-I152 WeakPolarHBondContact CB-O 3.41Å; K134-I152 PolarHBondContact N-O 3.48Å; Y135-I152 HydrophobicContact CD2-CB 4.39Å; Y135-I152 HydrophobicContact CD2-CD1 4.35Å; Y135-I152 HydrophobicContact CD2-CG2 4.35Å; Y135-I152 PolarHBondContact N-O 3.16Å; Y135-I152 PolarHBondContact O-N 3.07Å; F137-I152 HydrophobicContact CD1-CD1 4.03Å; F137-I152 HydrophobicContact CD1-CG1 4.06Å; F137-I152 HydrophobicContact CE1-CD1 3.74Å; F137-I152 HydrophobicContact CE1-CG1 3.73Å
153	L	98.2	Very high	94.7	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.089	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	160	-179.3	-50.9	179.4	0	0	0	110.3	V103 A104 M122 V131 R132 L133 L151	V103-L153 WeakPolarHBondContact CA-O 3.46Å; V103-L153 VanDerWaalsContact CB-O 3.3Å; V103-L153 WeakPolarHBondContact CB-O 3.48Å; A104-L153 HydrophobicContact CB-CB 4.34Å; A104-L153 PolarHBondContact N-O 3.48Å; A104-L153 WeakPolarHBondContact O-CB 3.5Å; A104-L153 PolarHBondContact O-N 2.97Å; M122-L153 HydrophobicContact CE-CD2 3.83Å; M122-L153 HydrophobicContact SD-CD2 3.91Å; V131-L153 HydrophobicContact CG2-CB 4.22Å; R132-L153 WeakPolarHBondContact O-CA 3.36Å; L133-L153 HydrophobicContact CB-CD2 4.33Å; L133-L153 HydrophobicContact CD1-CD2 3.78Å; L151-L153 HydrophobicContact CB-CD2 4.16Å; L151-L153 HydrophobicContact CB-CG 4.44Å
154	E	97.1	Very high	95.1	Very high	35 Å²	35	37.8 Å²	37.8	16%	0.164	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	142.7	163.3	67.8	-174.4	138.2	0	0	110.8	V131 R132 I156 K218	V131-E154 WeakPolarHBondContact CA-OE1 3.45Å; V131-E154 HydrophobicContact CG2-CG 3.65Å; R132-E154 HydrophobicContact CB-CG 4.34Å; R132-E154 WeakPolarHBondContact CB-OE1 3.36Å; R132-E154 PolarHBondContact N-OE1 2.79Å; R132-E154 PolarHBondContact O-N 3.34Å; E154-I156 HydrophobicContact CG-CD1 4.42Å; E154-I156 HydrophobicContact CG-CG1 4.34Å; E154-K218 VanDerWaalsContact CD-NZ 3.26Å; E154-K218 WeakPolarHBondContact OE1-CD 3.25Å; E154-K218 WeakPolarHBondContact OE1-CE 3.27Å; E154-K218 IonicContact OE1-NZ 2.9Å; E154-K218 PolarHBondContact OE1-NZ 2.79Å; E154-K218 WeakPolarHBondContact OE2-CE 3.49Å; E154-K218 IonicContact OE2-NZ 3.67Å; E154-K218 PolarHBondContact OE2-NZ 2.87Å; E154-K218 VanDerWaalsContact OE2-NZ 3.07Å
155	Y	97.7	Very high	95.8	Very high	46 Å²	46	38.6 Å²	38.6	18%	0.18	18%	0.177	C	C	.	.			trans	-92.6	127.4	176.6	177.2	-96.9	0	0	0	111.1	I83 Q93 L102 A104 P157	I83-Y155 HydrophobicContact CD1-CD2 4.18Å; I83-Y155 HydrophobicContact CD1-CE2 3.82Å; Q93-Y155 HydrophobicContact CB-CD2 4.48Å; Q93-Y155 HydrophobicContact CB-CE2 4.25Å; Q93-Y155 HydrophobicContact CG-CD2 4.2Å; Q93-Y155 HydrophobicContact CG-CE2 4.07Å; L102-Y155 HydrophobicContact CB-CD1 3.92Å; L102-Y155 HydrophobicContact CB-CG 4.1Å; L102-Y155 HydrophobicContact CD1-CD1 4.05Å; L102-Y155 HydrophobicContact CD1-CE1 4.21Å; L102-Y155 WeakPolarHBondContact O-CB 3.44Å; L102-Y155 PolarHBondContact O-N 3.15Å; A104-Y155 HydrophobicContact CB-CD2 4.45Å; Y155-P157 HydrophobicContact CE1-CB 3.95Å
156	I	96.8	Very high	96.3	Very high	29 Å²	29	36.2 Å²	36.2	15%	0.149	17%	0.165	C	C	.	.			trans	-125	129.6	176.2	-54.3	-64.7	0	0	0	107.5	E154 L209 L210 K218	E154-I156 HydrophobicContact CG-CD1 4.42Å; E154-I156 HydrophobicContact CG-CG1 4.34Å; I156-L209 HydrophobicContact CB-CB 3.78Å; I156-L209 HydrophobicContact CB-CD1 4Å; I156-L209 HydrophobicContact CB-CG 4.48Å; I156-L209 HydrophobicContact CG1-CB 4.36Å; I156-L209 HydrophobicContact CG1-CD1 4.19Å; I156-L209 HydrophobicContact CG2-CB 3.62Å; I156-L210 VanDerWaalsContact CG2-O 3.29Å; I156-L210 WeakPolarHBondContact CG2-O 3.45Å; I156-K218 HydrophobicContact CD1-CD 3.62Å; I156-K218 HydrophobicContact CG1-CD 3.81Å
157	P	94.5	Very high	96.5	Very high	48 Å²	48	36.8 Å²	36.8	31%	0.312	17%	0.166	S	C	.	.			trans	-83.8	-25.7	-156.5	30.7	-37.1	0	0	0	116.1	Y155 R162	Y155-P157 HydrophobicContact CE1-CB 3.95Å; P157-R162 PolarHBondContact O-NH1 2.83Å
158	E	96.4	Very high	96.5	Very high	49 Å²	49	39.3 Å²	39.3	23%	0.229	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	170.2	-177.3	-78.2	-64.2	166.2	0	0	112.2	R162 L209 L210 P212	E158-R162 IonicContact OE1-CZ 2.6Å; E158-R162 VanDerWaalsContact OE1-CZ 3.31Å; E158-R162 IonicContact OE1-NE 2.68Å; E158-R162 IonicContact OE1-NH2 2.68Å; E158-R162 PolarHBondContact OE1-NH2 3.2Å; E158-R162 WeakPolarHBondContact OE2-CB 3.24Å; E158-R162 WeakPolarHBondContact OE2-CD 3.42Å; E158-R162 IonicContact OE2-CZ 3.5Å; E158-R162 IonicContact OE2-NE 2.68Å; E158-R162 PolarHBondContact OE2-NE 2.78Å; E158-R162 IonicContact OE2-NH1 2.94Å; E158-R162 IonicContact OE2-NH2 2.67Å; E158-R162 PolarHBondContact OE2-NH2 3.38Å; E158-L209 WeakPolarHBondContact O-CA 3.39Å; E158-L210 HydrophobicContact CB-CB 4.4Å; E158-L210 WeakPolarHBondContact CB-O 3.39Å; E158-L210 PolarHBondContact N-O 2.69Å; E158-L210 VanDerWaalsContact N-O 3.15Å; E158-L210 PolarHBondContact O-N 2.95Å; E158-P212 HydrophobicContact CB-CG 3.9Å; E158-P212 HydrophobicContact CG-CG 3.58Å
159	T	97.5	Very high	96.4	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.9	170	65.6	0	0	0	0	110.8	F35 Y161 R162 V163 L208 L209	F35-T159 HydrophobicContact CB-CG2 3.86Å; F35-T159 HydrophobicContact CD2-CG2 4.18Å; F35-T159 HydrophobicContact CG-CG2 4.01Å; T159-Y161 PolarHBondContact O-N 2.96Å; T159-R162 PolarHBondContact O-N 2.98Å; T159-R162 WeakPolarHBondContact OG1-CG 3.44Å; T159-R162 PolarHBondContact OG1-N 2.95Å; T159-V163 PolarHBondContact O-N 3.14Å; T159-L208 CarbonylContact C-O 3.49Å; T159-L208 VanDerWaalsContact CA-O 3.23Å; T159-L208 WeakPolarHBondContact CA-O 3.47Å; T159-L208 WeakPolarHBondContact CB-O 3.41Å; T159-L209 HydrophobicContact CG2-CD2 3.82Å
160	V	98.1	Very high	96.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-35.6	175.5	178	0	0	0	0	110.8	V163 A164 F182 P205 L208 L217 L271	V160-V163 PolarHBondContact O-N 2.98Å; V160-A164 WeakPolarHBondContact O-CB 3.4Å; V160-A164 PolarHBondContact O-N 2.67Å; V160-F182 HydrophobicContact CG1-CD2 4.38Å; V160-F182 HydrophobicContact CG2-CD2 4.16Å; V160-F182 HydrophobicContact CG2-CG 4.47Å; V160-P205 HydrophobicContact CB-CB 4.31Å; V160-P205 HydrophobicContact CG1-CB 4.22Å; V160-P205 PolarHBondContact N-O 3.33Å; V160-L208 HydrophobicContact CB-CB 3.92Å; V160-L208 HydrophobicContact CB-CD1 4.32Å; V160-L208 HydrophobicContact CG2-CB 3.51Å; V160-L208 HydrophobicContact CG2-CD1 4.16Å; V160-L208 HydrophobicContact CG2-CG 4.49Å; V160-L208 PolarHBondContact N-O 3.04Å; V160-L217 HydrophobicContact CG2-CD1 3.71Å; V160-L271 HydrophobicContact CG1-CD1 4.26Å; V160-L271 HydrophobicContact CG1-CD2 3.71Å; V160-L271 HydrophobicContact CG1-CG 4.43Å
161	Y	97.3	Very high	96.2	Very high	79 Å²	79	56.3 Å²	56.3	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-58	-47.6	171.2	177.2	-106.7	0	0	0	113	T159 A164 R165 P205 Q206	T159-Y161 PolarHBondContact O-N 2.96Å; Y161-A164 PolarHBondContact O-N 3.07Å; Y161-R165 WeakPolarHBondContact O-CB 3.41Å; Y161-R165 PolarHBondContact O-N 3.37Å; Y161-P205 WeakPolarHBondContact CB-O 3.38Å; Y161-P205 PolarHBondContact N-O 3.04Å; Y161-Q206 HydrophobicContact CD1-CG 4.19Å; Y161-Q206 HydrophobicContact CD2-CG 4.31Å; Y161-Q206 HydrophobicContact CG-CG 3.89Å
162	R	96	Very high	95.9	Very high	75 Å²	75	61.6 Å²	61.6	28%	0.283	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-39.1	-179.5	-75.2	171.4	62.9	-167.5	-7.5	111.4	P157 E158 T159 H166	P157-R162 PolarHBondContact O-NH1 2.83Å; E158-R162 IonicContact OE1-CZ 2.6Å; E158-R162 VanDerWaalsContact OE1-CZ 3.31Å; E158-R162 IonicContact OE1-NE 2.68Å; E158-R162 IonicContact OE1-NH2 2.68Å; E158-R162 PolarHBondContact OE1-NH2 3.2Å; E158-R162 WeakPolarHBondContact OE2-CB 3.24Å; E158-R162 WeakPolarHBondContact OE2-CD 3.42Å; E158-R162 IonicContact OE2-CZ 3.5Å; E158-R162 IonicContact OE2-NE 2.68Å; E158-R162 PolarHBondContact OE2-NE 2.78Å; E158-R162 IonicContact OE2-NH1 2.94Å; E158-R162 IonicContact OE2-NH2 2.67Å; E158-R162 PolarHBondContact OE2-NH2 3.38Å; T159-R162 PolarHBondContact O-N 2.98Å; T159-R162 WeakPolarHBondContact OG1-CG 3.44Å; T159-R162 PolarHBondContact OG1-N 2.95Å; R162-H166 PolarHBondContact O-N 3.03Å
163	V	95.5	Very high	95.6	Very high	26 Å²	26	66.1 Å²	66.1	16%	0.158	31%	0.306	C	S	.	.	H	α-helix	trans	-64.4	-52.9	173.8	176.3	0	0	0	0	111.4	T159 V160 R165 H166 Y167 F182 L210	T159-V163 PolarHBondContact O-N 3.14Å; V160-V163 PolarHBondContact O-N 2.98Å; V163-R165 VanDerWaalsContact C-N 3.29Å; V163-R165 PolarHBondContact O-N 2.88Å; V163-H166 WeakPolarHBondContact O-CB 3.22Å; V163-H166 PolarHBondContact O-N 3.23Å; V163-Y167 HydrophobicContact CG1-CD2 3.86Å; V163-Y167 HydrophobicContact CG1-CE2 3.83Å; V163-Y167 WeakPolarHBondContact O-CD2 3Å; V163-Y167 PolarHBondContact O-N 3.05Å; V163-Y167 VanDerWaalsContact O-N 3.09Å; V163-F182 HydrophobicContact CG1-CE2 4.49Å; V163-L210 HydrophobicContact CG2-CD2 3.71Å
164	A	96.1	Very high	95.4	Very high	8 Å²	8	65.6 Å²	65.6	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-41.7	179.1	0	0	0	0	0	111.9	V160 Y161 H166 Y167 N168 I174 L271	V160-A164 WeakPolarHBondContact O-CB 3.4Å; V160-A164 PolarHBondContact O-N 2.67Å; Y161-A164 PolarHBondContact O-N 3.07Å; A164-H166 VanDerWaalsContact C-N 3.33Å; A164-H166 PolarHBondContact O-N 3.47Å; A164-Y167 PolarHBondContact O-N 3.36Å; A164-N168 WeakPolarHBondContact O-CB 3.48Å; A164-N168 PolarHBondContact O-N 3.27Å; A164-I174 HydrophobicContact CB-CD1 4.08Å; A164-L271 HydrophobicContact CB-CD2 4.22Å
165	R	96.1	Very high	95.3	Very high	130 Å²	130	66.2 Å²	66.2	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-31.2	175.1	-168.5	-179.9	-172.2	-150.1	5.8	113.1	Y161 V163 K169	Y161-R165 WeakPolarHBondContact O-CB 3.41Å; Y161-R165 PolarHBondContact O-N 3.37Å; V163-R165 VanDerWaalsContact C-N 3.29Å; V163-R165 PolarHBondContact O-N 2.88Å; R165-K169 WeakPolarHBondContact O-CB 3.35Å; R165-K169 VanDerWaalsContact O-CG 3.29Å; R165-K169 WeakPolarHBondContact O-CG 3.21Å; R165-K169 PolarHBondContact O-N 2.96Å; R165-K169 VanDerWaalsContact O-N 3.14Å
166	H	95.7	Very high	95.3	Very high	108 Å²	108	66.4 Å²	66.4	50%	0.5	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-55.2	172.2	176.5	92.6	0	0	0	110.8	R162 V163 A164 N168 K169 T170	R162-H166 PolarHBondContact O-N 3.03Å; V163-H166 WeakPolarHBondContact O-CB 3.22Å; V163-H166 PolarHBondContact O-N 3.23Å; A164-H166 VanDerWaalsContact C-N 3.33Å; A164-H166 PolarHBondContact O-N 3.47Å; H166-N168 VanDerWaalsContact C-N 3.34Å; H166-N168 PolarHBondContact O-N 3.5Å; H166-K169 PolarHBondContact O-N 2.69Å; H166-K169 VanDerWaalsContact O-N 3.13Å; H166-T170 PolarHBondContact O-N 2.81Å; H166-T170 PolarHBondContact O-OG1 3.02Å
167	Y	95	Very high	95.3	Very high	49 Å²	49	66 Å²	66	19%	0.192	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-40.3	-180	-80.2	-84.7	0	0	0	112.6	V163 A164 T170 K171 Q172 I173 I174 P175	V163-Y167 HydrophobicContact CG1-CD2 3.86Å; V163-Y167 HydrophobicContact CG1-CE2 3.83Å; V163-Y167 WeakPolarHBondContact O-CD2 3Å; V163-Y167 PolarHBondContact O-N 3.05Å; V163-Y167 VanDerWaalsContact O-N 3.09Å; A164-Y167 PolarHBondContact O-N 3.36Å; Y167-T170 PolarHBondContact O-N 2.86Å; Y167-T170 PolarHBondContact O-OG1 3.4Å; Y167-K171 PolarHBondContact O-N 3.03Å; Y167-K171 VanDerWaalsContact O-N 3.1Å; Y167-Q172 HydrophobicContact CD1-CB 3.73Å; Y167-Q172 HydrophobicContact CE1-CB 4.4Å; Y167-Q172 PolarHBondContact O-N 2.94Å; Y167-I173 WeakPolarHBondContact CD1-O 3.45Å; Y167-I174 HydrophobicContact CD1-CG1 4.47Å; Y167-I174 HydrophobicContact CD2-CB 4.43Å; Y167-I174 HydrophobicContact CD2-CG1 3.79Å; Y167-I174 HydrophobicContact CE2-CG2 4.49Å; Y167-I174 HydrophobicContact CG-CB 4.45Å; Y167-I174 HydrophobicContact CG-CG1 3.78Å; Y167-P175 HydrophobicContact CE1-CG 4.44Å; Y167-P175 VanDerWaalsContact CZ-CD 3.5Å; Y167-P175 WeakPolarHBondContact OH-CD 3.48Å
168	N	92.7	Very high	95.4	Very high	83 Å²	83	65.7 Å²	65.7	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-58.3	-49.9	172.7	176.2	-73.6	0	0	0	111.6	A164 H166 T170 K171 G274	A164-N168 WeakPolarHBondContact O-CB 3.48Å; A164-N168 PolarHBondContact O-N 3.27Å; H166-N168 VanDerWaalsContact C-N 3.34Å; H166-N168 PolarHBondContact O-N 3.5Å; N168-T170 PolarHBondContact O-N 3.37Å; N168-K171 WeakPolarHBondContact O-CA 3.36Å; N168-K171 PolarHBondContact O-N 3.4Å; N168-G274 PolarHBondContact ND2-O 2.98Å
169	K	94.6	Very high	95.5	Very high	144 Å²	144	63.4 Å²	63.4	63%	0.626	29%	0.294	S	S	*	.	H	α-helix	trans	-61.7	-38	178.9	-80.6	-178	173.1	-166	0	113.4	R165 H166 K171	R165-K169 WeakPolarHBondContact O-CB 3.35Å; R165-K169 VanDerWaalsContact O-CG 3.29Å; R165-K169 WeakPolarHBondContact O-CG 3.21Å; R165-K169 PolarHBondContact O-N 2.96Å; R165-K169 VanDerWaalsContact O-N 3.14Å; H166-K169 PolarHBondContact O-N 2.69Å; H166-K169 VanDerWaalsContact O-N 3.13Å; K169-K171 PolarHBondContact O-N 3.01Å
170	T	95.6	Very high	95.5	Very high	62 Å²	62	64.1 Å²	64.1	38%	0.38	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.3	176	60.2	0	0	0	0	113.1	H166 Y167 N168 Q172	H166-T170 PolarHBondContact O-N 2.81Å; H166-T170 PolarHBondContact O-OG1 3.02Å; Y167-T170 PolarHBondContact O-N 2.86Å; Y167-T170 PolarHBondContact O-OG1 3.4Å; N168-T170 PolarHBondContact O-N 3.37Å; T170-Q172 PolarHBondContact O-N 3.1Å; T170-Q172 PolarHBondContact OG1-OE1 2.86Å
171	K	92.9	Very high	95.5	Very high	191 Å²	191	64.1 Å²	64.1	83%	0.83	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	21.3	-173.6	-56.8	-177.4	179.8	179.6	0	113.9	Y167 N168 K169	Y167-K171 PolarHBondContact O-N 3.03Å; Y167-K171 VanDerWaalsContact O-N 3.1Å; N168-K171 WeakPolarHBondContact O-CA 3.36Å; N168-K171 PolarHBondContact O-N 3.4Å; K169-K171 PolarHBondContact O-N 3.01Å
172	Q	92.6	Very high	95.6	Very high	111 Å²	111	60.6 Å²	60.6	52%	0.519	28%	0.283	S	S	.	.			trans	-90.6	169.3	177.6	-69	173.1	-17.1	0	0	111	Y167 T170	Y167-Q172 HydrophobicContact CD1-CB 3.73Å; Y167-Q172 HydrophobicContact CE1-CB 4.4Å; Y167-Q172 PolarHBondContact O-N 2.94Å; T170-Q172 PolarHBondContact O-N 3.1Å; T170-Q172 PolarHBondContact OG1-OE1 2.86Å
173	I	90.8	Very high	95.7	Very high	94 Å²	94	57 Å²	57	48%	0.482	27%	0.269	S	S	.	.			trans	-106.3	138.7	173.2	-61.1	170.5	0	0	0	107.3	Y167 P175	Y167-I173 WeakPolarHBondContact CD1-O 3.45Å; I173-P175 WeakPolarHBondContact O-CD 3.27Å
174	I	94.6	Very high	95.9	Very high	7 Å²	7	55.8 Å²	55.8	4%	0.036	26%	0.262	C	S	.	.			trans	-62.5	125.1	174.9	-53	173.8	0	0	0	108.2	A164 Y167 M176 V179 L271	A164-I174 HydrophobicContact CB-CD1 4.08Å; Y167-I174 HydrophobicContact CD1-CG1 4.47Å; Y167-I174 HydrophobicContact CD2-CB 4.43Å; Y167-I174 HydrophobicContact CD2-CG1 3.79Å; Y167-I174 HydrophobicContact CE2-CG2 4.49Å; Y167-I174 HydrophobicContact CG-CB 4.45Å; Y167-I174 HydrophobicContact CG-CG1 3.78Å; I174-M176 PolarHBondContact O-N 3.2Å; I174-V179 HydrophobicContact CB-CG2 4.1Å; I174-V179 HydrophobicContact CG2-CG2 3.92Å; I174-L271 HydrophobicContact CD1-CB 4.34Å; I174-L271 HydrophobicContact CD1-CD2 3.37Å; I174-L271 HydrophobicContact CD1-CG 4.47Å
175	P	95	Very high	96	Very high	48 Å²	48	55.5 Å²	55.5	31%	0.312	26%	0.259	S	S	.	.			trans	-53.6	130.9	177.8	-27.8	33.3	0	0	0	111.7	Y167 I173 M177 Y178 V179	Y167-P175 HydrophobicContact CE1-CG 4.44Å; Y167-P175 VanDerWaalsContact CZ-CD 3.5Å; Y167-P175 WeakPolarHBondContact OH-CD 3.48Å; I173-P175 WeakPolarHBondContact O-CD 3.27Å; P175-M177 PolarHBondContact O-N 3.44Å; P175-M177 VanDerWaalsContact O-N 3.09Å; P175-Y178 HydrophobicContact CB-CD2 3.8Å; P175-Y178 HydrophobicContact CB-CE2 4.21Å; P175-Y178 HydrophobicContact CG-CD2 3.92Å; P175-Y178 HydrophobicContact CG-CE2 4.09Å; P175-Y178 WeakPolarHBondContact O-CB 3.34Å; P175-Y178 PolarHBondContact O-N 3.45Å; P175-V179 PolarHBondContact O-N 2.9Å
176	M	96.8	Very high	96.2	Very high	49 Å²	49	49.3 Å²	49.3	24%	0.241	24%	0.236	C	C	.	.	H	α-helix	trans	-57.7	-32.4	-169	-168.8	57.6	53.9	0	0	113.2	I174 Y178 V179 K180 L272 P331 F360	I174-M176 PolarHBondContact O-N 3.2Å; M176-Y178 VanDerWaalsContact C-N 3.28Å; M176-Y178 PolarHBondContact O-N 3.33Å; M176-V179 PolarHBondContact O-N 3.05Å; M176-V179 VanDerWaalsContact O-N 3.12Å; M176-V179 HydrophobicContact SD-CB 4.13Å; M176-V179 HydrophobicContact SD-CG1 4.48Å; M176-K180 HydrophobicContact CG-CD 4.49Å; M176-K180 WeakPolarHBondContact O-CG 3.2Å; M176-K180 PolarHBondContact O-N 3.01Å; M176-L272 HydrophobicContact CE-CD2 3.78Å; M176-L272 HydrophobicContact SD-CD2 4.17Å; M176-P331 HydrophobicContact CE-CG 3.96Å; M176-P331 HydrophobicContact CG-CG 4.21Å; M176-P331 HydrophobicContact SD-CG 4.2Å; M176-F360 HydrophobicContact CG-CE2 4.34Å; M176-F360 HydrophobicContact SD-CE2 3.66Å; M176-F360 HydrophobicContact SD-CZ 3.73Å
177	M	96.9	Very high	96.3	Very high	20 Å²	20	44.2 Å²	44.2	10%	0.099	21%	0.212	C	C	.	.	H	α-helix	trans	-52.8	-43.8	172.6	-174.6	53.6	65.3	0	0	112.6	P175 K180 L181 E363 L364 C369 P372 L377	P175-M177 PolarHBondContact O-N 3.44Å; P175-M177 VanDerWaalsContact O-N 3.09Å; M177-K180 PolarHBondContact O-N 2.87Å; M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 WeakPolarHBondContact O-CB 3.37Å; M177-L181 WeakPolarHBondContact O-CD1 3.46Å; M177-L181 VanDerWaalsContact O-CG 3.29Å; M177-L181 WeakPolarHBondContact O-CG 3.34Å; M177-L181 PolarHBondContact O-N 3.39Å; M177-L181 HydrophobicContact SD-CD1 4.17Å; M177-L181 HydrophobicContact SD-CG 4.38Å; M177-E363 HydrophobicContact CE-CG 3.96Å; M177-E363 WeakPolarHBondContact CE-OE1 3.33Å; M177-L364 HydrophobicContact SD-CD2 3.59Å; M177-L364 VanDerWaalsContact SD-CD2 3.59Å; M177-C369 WeakPolarHBondContact CE-SG 3.49Å; M177-P372 HydrophobicContact CB-CG 4.17Å; M177-P372 HydrophobicContact CG-CG 4.27Å; M177-L377 HydrophobicContact SD-CD2 4.42Å
178	Y	97.2	Very high	96.5	Very high	43 Å²	43	41.9 Å²	41.9	17%	0.169	20%	0.203	C	C	.	.	H	α-helix	trans	-70	-39.4	177.3	-65.5	-53.6	0	0	0	111.9	P175 M176 K180 L181 F182 A215 P372	P175-Y178 HydrophobicContact CB-CD2 3.8Å; P175-Y178 HydrophobicContact CB-CE2 4.21Å; P175-Y178 HydrophobicContact CG-CD2 3.92Å; P175-Y178 HydrophobicContact CG-CE2 4.09Å; P175-Y178 WeakPolarHBondContact O-CB 3.34Å; P175-Y178 PolarHBondContact O-N 3.45Å; M176-Y178 VanDerWaalsContact C-N 3.28Å; M176-Y178 PolarHBondContact O-N 3.33Å; Y178-K180 VanDerWaalsContact C-N 3.31Å; Y178-K180 PolarHBondContact O-N 3.18Å; Y178-L181 PolarHBondContact O-N 2.93Å; Y178-F182 HydrophobicContact CD1-CE1 4.18Å; Y178-F182 HydrophobicContact CD1-CZ 4.13Å; Y178-F182 HydrophobicContact CG-CZ 4.14Å; Y178-F182 WeakPolarHBondContact O-CB 3.26Å; Y178-F182 VanDerWaalsContact O-CD1 3.26Å; Y178-F182 WeakPolarHBondContact O-CD1 3.3Å; Y178-F182 WeakPolarHBondContact O-CD2 3.42Å; Y178-F182 WeakPolarHBondContact O-CG 3.37Å; Y178-F182 PolarHBondContact O-N 3.32Å; Y178-A215 HydrophobicContact CD1-CB 4.45Å; Y178-A215 HydrophobicContact CE1-CB 4.4Å; Y178-P372 HydrophobicContact CE1-CG 4.4Å; Y178-P372 HydrophobicContact CE2-CG 3.95Å
179	V	98	Very high	96.8	Very high	1 Å²	1	38 Å²	38	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-43.5	174.9	-174.7	0	0	0	0	110.6	I174 P175 M176 M183 L268 L271 L272 F360	I174-V179 HydrophobicContact CB-CG2 4.1Å; I174-V179 HydrophobicContact CG2-CG2 3.92Å; P175-V179 PolarHBondContact O-N 2.9Å; M176-V179 PolarHBondContact O-N 3.05Å; M176-V179 VanDerWaalsContact O-N 3.12Å; M176-V179 HydrophobicContact SD-CB 4.13Å; M176-V179 HydrophobicContact SD-CG1 4.48Å; V179-M183 WeakPolarHBondContact O-CB 3.43Å; V179-M183 WeakPolarHBondContact O-CG 3.27Å; V179-M183 PolarHBondContact O-N 3.4Å; V179-M183 VanDerWaalsContact O-N 3.1Å; V179-L268 HydrophobicContact CG1-CD1 3.85Å; V179-L271 HydrophobicContact CG1-CB 4.04Å; V179-L271 HydrophobicContact CG1-CD1 4.29Å; V179-L271 HydrophobicContact CG2-CB 4.29Å; V179-L272 HydrophobicContact CG1-CD2 4.36Å; V179-F360 HydrophobicContact CG1-CZ 4.25Å
180	K	98.7	Very high	97	Very high	18 Å²	18	31.1 Å²	31.1	8%	0.078	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-51.7	174.1	-70.9	-179.5	-179.8	-161.5	0	111.7	M176 M177 Y178 F182 Y184 F360 F361 E363 L364	M176-K180 HydrophobicContact CG-CD 4.49Å; M176-K180 WeakPolarHBondContact O-CG 3.2Å; M176-K180 PolarHBondContact O-N 3.01Å; M177-K180 PolarHBondContact O-N 2.87Å; Y178-K180 VanDerWaalsContact C-N 3.31Å; Y178-K180 PolarHBondContact O-N 3.18Å; K180-F182 PolarHBondContact O-N 3.23Å; K180-Y184 VanDerWaalsContact O-CB 3.24Å; K180-Y184 WeakPolarHBondContact O-CB 3.4Å; K180-Y184 PolarHBondContact O-N 3.26Å; K180-F360 HydrophobicContact CB-CE1 4.44Å; K180-F360 HydrophobicContact CD-CE2 4.33Å; K180-F360 HydrophobicContact CD-CZ 4.43Å; K180-F360 VanDerWaalsContact CD-O 3.25Å; K180-F360 WeakPolarHBondContact CD-O 3.5Å; K180-F360 WeakPolarHBondContact CE-O 3.47Å; K180-F360 HydrophobicContact CG-CD1 4.19Å; K180-F360 HydrophobicContact CG-CD2 4.35Å; K180-F360 HydrophobicContact CG-CE1 3.66Å; K180-F360 HydrophobicContact CG-CE2 3.81Å; K180-F360 HydrophobicContact CG-CZ 3.44Å; K180-F360 VanDerWaalsContact CG-CZ 3.44Å; K180-F360 PolarHBondContact NZ-O 3.07Å; K180-F361 HydrophobicContact CB-CD1 4.18Å; K180-F361 HydrophobicContact CB-CE1 4.45Å; K180-F361 HydrophobicContact CG-CD1 4.48Å; K180-F361 WeakPolarHBondContact O-CE1 3.43Å; K180-E363 HydrophobicContact CD-CB 4.29Å; K180-E363 WeakPolarHBondContact CD-OE2 3.29Å; K180-E363 VanDerWaalsContact CE-OE2 3.28Å; K180-E363 WeakPolarHBondContact CE-OE2 3.46Å; K180-E363 IonicContact NZ-OE2 2.85Å; K180-E363 PolarHBondContact NZ-OE2 3.28Å; K180-L364 HydrophobicContact CB-CD1 4.11Å; K180-L364 HydrophobicContact CB-CD2 3.99Å; K180-L364 HydrophobicContact CB-CG 4.15Å
181	L	98.4	Very high	97.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-42.5	-179.4	-76.1	164.6	0	0	0	113.2	M177 Y178 Q185 A215 L364 L371 L377 P378 L380	M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 WeakPolarHBondContact O-CB 3.37Å; M177-L181 WeakPolarHBondContact O-CD1 3.46Å; M177-L181 VanDerWaalsContact O-CG 3.29Å; M177-L181 WeakPolarHBondContact O-CG 3.34Å; M177-L181 PolarHBondContact O-N 3.39Å; M177-L181 HydrophobicContact SD-CD1 4.17Å; M177-L181 HydrophobicContact SD-CG 4.38Å; Y178-L181 PolarHBondContact O-N 2.93Å; L181-Q185 WeakPolarHBondContact O-CB 3.4Å; L181-Q185 VanDerWaalsContact O-CG 3.27Å; L181-Q185 WeakPolarHBondContact O-CG 3.16Å; L181-Q185 PolarHBondContact O-N 3.4Å; L181-Q185 PolarHBondContact O-NE2 2.98Å; L181-A215 HydrophobicContact CD1-CB 4.14Å; L181-L364 HydrophobicContact CD2-CD1 4.47Å; L181-L364 HydrophobicContact CD2-CD2 3.91Å; L181-L364 HydrophobicContact CG-CD2 3.94Å; L181-L371 HydrophobicContact CD1-CD2 3.34Å; L181-L377 HydrophobicContact CD1-CD2 4.34Å; L181-L377 HydrophobicContact CD2-CD2 4.33Å; L181-P378 HydrophobicContact CD2-CG 4.23Å; L181-L380 HydrophobicContact CD2-CD1 3.98Å; L181-L380 HydrophobicContact CD2-CD2 4.04Å
182	F	98.5	Very high	97.4	Very high	5 Å²	5	20 Å²	20	2%	0.022	10%	0.099	C	C	.	.	H	α-helix	trans	-69.8	-46.8	-177.8	-59.4	-10	0	0	0	110.6	V160 V163 Y178 K180 Q185 L186 L210 L217	V160-F182 HydrophobicContact CG1-CD2 4.38Å; V160-F182 HydrophobicContact CG2-CD2 4.16Å; V160-F182 HydrophobicContact CG2-CG 4.47Å; V163-F182 HydrophobicContact CG1-CE2 4.49Å; Y178-F182 HydrophobicContact CD1-CE1 4.18Å; Y178-F182 HydrophobicContact CD1-CZ 4.13Å; Y178-F182 HydrophobicContact CG-CZ 4.14Å; Y178-F182 WeakPolarHBondContact O-CB 3.26Å; Y178-F182 VanDerWaalsContact O-CD1 3.26Å; Y178-F182 WeakPolarHBondContact O-CD1 3.3Å; Y178-F182 WeakPolarHBondContact O-CD2 3.42Å; Y178-F182 WeakPolarHBondContact O-CG 3.37Å; Y178-F182 PolarHBondContact O-N 3.32Å; K180-F182 PolarHBondContact O-N 3.23Å; F182-Q185 PolarHBondContact O-N 3.4Å; F182-L186 WeakPolarHBondContact O-CB 3.38Å; F182-L186 PolarHBondContact O-N 3.37Å; F182-L210 HydrophobicContact CD1-CD1 3.85Å; F182-L210 HydrophobicContact CE1-CD1 3.32Å; F182-L210 HydrophobicContact CE1-CD2 3.9Å; F182-L210 HydrophobicContact CE1-CG 4.26Å; F182-L210 HydrophobicContact CE2-CD2 4.11Å; F182-L210 HydrophobicContact CZ-CD1 3.83Å; F182-L210 HydrophobicContact CZ-CD2 3.45Å; F182-L210 VanDerWaalsContact CZ-CD2 3.45Å; F182-L210 HydrophobicContact CZ-CG 4.3Å; F182-L217 HydrophobicContact CB-CD1 3.73Å; F182-L217 HydrophobicContact CG-CD1 4.26Å
183	M	98.9	Very high	97.7	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-68.2	-40	-179.5	-68.1	-52.8	-49.9	0	0	112.5	V179 Q185 L186 F187 A264 V267 L268 L271 F361	V179-M183 WeakPolarHBondContact O-CB 3.43Å; V179-M183 WeakPolarHBondContact O-CG 3.27Å; V179-M183 PolarHBondContact O-N 3.4Å; V179-M183 VanDerWaalsContact O-N 3.1Å; M183-Q185 PolarHBondContact O-N 3.5Å; M183-L186 HydrophobicContact CE-CD2 3.87Å; M183-L186 PolarHBondContact O-N 3.02Å; M183-L186 HydrophobicContact SD-CD2 4.29Å; M183-F187 HydrophobicContact CB-CD2 4.4Å; M183-F187 HydrophobicContact CB-CE2 4.06Å; M183-F187 HydrophobicContact CE-CD2 4.48Å; M183-F187 HydrophobicContact CE-CE1 4.3Å; M183-F187 HydrophobicContact CE-CE2 3.66Å; M183-F187 HydrophobicContact CE-CZ 3.52Å; M183-F187 WeakPolarHBondContact O-CD2 3.3Å; M183-F187 WeakPolarHBondContact O-CG 3.49Å; M183-F187 PolarHBondContact O-N 2.58Å; M183-A264 HydrophobicContact CE-CB 4.07Å; M183-A264 VanDerWaalsContact CE-O 3.23Å; M183-A264 WeakPolarHBondContact CE-O 3.1Å; M183-V267 HydrophobicContact SD-CB 4.3Å; M183-V267 HydrophobicContact SD-CG1 3.8Å; M183-L268 HydrophobicContact CE-CB 4Å; M183-L268 HydrophobicContact CG-CB 4.17Å; M183-L268 HydrophobicContact CG-CD1 4.02Å; M183-L268 HydrophobicContact SD-CB 4.05Å; M183-L271 HydrophobicContact CG-CD1 4.34Å; M183-L271 HydrophobicContact SD-CD1 4.13Å; M183-F361 HydrophobicContact CB-CE1 4.07Å; M183-F361 HydrophobicContact CB-CZ 3.94Å
184	Y	98.9	Very high	98.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.6	-44.8	175.9	-175.2	-89.6	0	0	0	112.1	K180 F187 R188 C356 F361 L364 L380 F383	K180-Y184 VanDerWaalsContact O-CB 3.24Å; K180-Y184 WeakPolarHBondContact O-CB 3.4Å; K180-Y184 PolarHBondContact O-N 3.26Å; Y184-F187 PolarHBondContact O-N 3.44Å; Y184-R188 HydrophobicContact CD1-CG 4.4Å; Y184-R188 HydrophobicContact CE1-CG 4.11Å; Y184-R188 PolarHBondContact O-N 3.15Å; Y184-C356 HydrophobicContact CD2-CB 4.18Å; Y184-C356 HydrophobicContact CE2-CB 3.87Å; Y184-C356 WeakPolarHBondContact CE2-O 3.42Å; Y184-F361 HydrophobicContact CD2-CB 3.97Å; Y184-F361 HydrophobicContact CD2-CD1 4.08Å; Y184-F361 HydrophobicContact CD2-CD2 4.21Å; Y184-F361 AromaticContact CD2-CG 3.83Å; Y184-F361 HydrophobicContact CD2-CG 3.83Å; Y184-F361 HydrophobicContact CE2-CB 4.49Å; Y184-F361 HydrophobicContact CG-CD1 4.43Å; Y184-L364 HydrophobicContact CD2-CD1 4.27Å; Y184-L364 HydrophobicContact CG-CD1 4.01Å; Y184-L380 HydrophobicContact CD1-CB 4.47Å; Y184-L380 HydrophobicContact CD1-CD2 4Å; Y184-L380 HydrophobicContact CE1-CB 3.84Å; Y184-L380 HydrophobicContact CE1-CD2 4.2Å; Y184-L380 HydrophobicContact CE1-CG 4.41Å; Y184-L380 PolarHBondContact OH-O 2.99Å; Y184-F383 WeakPolarHBondContact OH-CZ 3.37Å
185	Q	98.9	Very high	98.2	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.009	7%	0.07	C	C	.	.	H	α-helix	trans	-67.8	-36.5	177.7	-74.1	176.8	93.4	0	0	112.6	N129 L181 F182 M183 R188 A189 A215 L217 L380	N129-Q185 HydrophobicContact CB-CB 4.49Å; N129-Q185 WeakPolarHBondContact CB-O 3.23Å; N129-Q185 WeakPolarHBondContact ND2-CB 3.3Å; N129-Q185 WeakPolarHBondContact ND2-CG 3.32Å; N129-Q185 PolarHBondContact ND2-OE1 3.28Å; L181-Q185 WeakPolarHBondContact O-CB 3.4Å; L181-Q185 VanDerWaalsContact O-CG 3.27Å; L181-Q185 WeakPolarHBondContact O-CG 3.16Å; L181-Q185 PolarHBondContact O-N 3.4Å; L181-Q185 PolarHBondContact O-NE2 2.98Å; F182-Q185 PolarHBondContact O-N 3.4Å; M183-Q185 PolarHBondContact O-N 3.5Å; Q185-R188 PolarHBondContact O-N 2.89Å; Q185-A189 PolarHBondContact O-N 3.22Å; Q185-A215 PolarHBondContact NE2-O 3.34Å; Q185-L217 HydrophobicContact CB-CB 3.95Å; Q185-L217 HydrophobicContact CB-CD2 4.15Å; Q185-L380 HydrophobicContact CG-CD2 4.25Å
186	L	98.9	Very high	98.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.4	-45.9	170.9	173.1	55.9	0	0	0	111	F182 M183 R188 A189 L190 I203 L208 L217 A264	F182-L186 WeakPolarHBondContact O-CB 3.38Å; F182-L186 PolarHBondContact O-N 3.37Å; M183-L186 HydrophobicContact CE-CD2 3.87Å; M183-L186 PolarHBondContact O-N 3.02Å; M183-L186 HydrophobicContact SD-CD2 4.29Å; L186-R188 VanDerWaalsContact C-N 3.32Å; L186-R188 PolarHBondContact O-N 3.48Å; L186-A189 WeakPolarHBondContact O-CB 3.43Å; L186-A189 PolarHBondContact O-N 3.27Å; L186-A189 VanDerWaalsContact O-N 3.16Å; L186-L190 HydrophobicContact CD1-CD1 4.17Å; L186-L190 HydrophobicContact CD1-CD2 4.43Å; L186-L190 HydrophobicContact CD1-CG 3.95Å; L186-L190 HydrophobicContact CG-CD1 4.27Å; L186-L190 HydrophobicContact CG-CG 4.44Å; L186-L190 WeakPolarHBondContact O-CG 3.39Å; L186-L190 PolarHBondContact O-N 2.98Å; L186-I203 HydrophobicContact CD1-CD1 4.43Å; L186-I203 HydrophobicContact CD1-CG2 4.28Å; L186-I203 HydrophobicContact CD2-CG2 4.09Å; L186-L208 HydrophobicContact CD1-CD2 3.72Å; L186-L208 HydrophobicContact CD2-CD1 3.94Å; L186-L208 HydrophobicContact CD2-CD2 4.21Å; L186-L208 HydrophobicContact CG-CD2 4.45Å; L186-L217 HydrophobicContact CB-CD2 4.28Å; L186-A264 HydrophobicContact CD2-CB 3.87Å; L186-A264 HydrophobicContact CG-CB 4.43Å
187	F	98.9	Very high	98.4	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.9	-33.2	177.7	-69.1	-51.4	0	0	0	112.9	M183 Y184 L190 A191 A264 L341 P352 A355 C356 F361	M183-F187 HydrophobicContact CB-CD2 4.4Å; M183-F187 HydrophobicContact CB-CE2 4.06Å; M183-F187 HydrophobicContact CE-CD2 4.48Å; M183-F187 HydrophobicContact CE-CE1 4.3Å; M183-F187 HydrophobicContact CE-CE2 3.66Å; M183-F187 HydrophobicContact CE-CZ 3.52Å; M183-F187 WeakPolarHBondContact O-CD2 3.3Å; M183-F187 WeakPolarHBondContact O-CG 3.49Å; M183-F187 PolarHBondContact O-N 2.58Å; Y184-F187 PolarHBondContact O-N 3.44Å; F187-L190 HydrophobicContact CD1-CD1 4.4Å; F187-A191 WeakPolarHBondContact O-CB 3.35Å; F187-A191 PolarHBondContact O-N 3.48Å; F187-A264 HydrophobicContact CD1-CB 4.48Å; F187-A264 HydrophobicContact CE1-CB 3.65Å; F187-A264 HydrophobicContact CZ-CB 4.12Å; F187-L341 HydrophobicContact CE1-CD1 4.37Å; F187-L341 HydrophobicContact CE1-CD2 3.87Å; F187-L341 HydrophobicContact CE2-CD1 4.37Å; F187-L341 HydrophobicContact CZ-CD1 3.58Å; F187-L341 HydrophobicContact CZ-CD2 3.87Å; F187-L341 HydrophobicContact CZ-CG 4.4Å; F187-P352 HydrophobicContact CB-CB 4.43Å; F187-P352 HydrophobicContact CD1-CB 4.44Å; F187-P352 VanDerWaalsContact O-CB 3.23Å; F187-P352 WeakPolarHBondContact O-CB 3.37Å; F187-A355 HydrophobicContact CB-CB 4.37Å; F187-A355 HydrophobicContact CD1-CB 3.76Å; F187-A355 HydrophobicContact CD2-CB 3.68Å; F187-A355 HydrophobicContact CE1-CB 3.93Å; F187-A355 HydrophobicContact CE2-CB 3.86Å; F187-A355 HydrophobicContact CG-CB 3.67Å; F187-A355 HydrophobicContact CZ-CB 4Å; F187-C356 WeakPolarHBondContact CB-SG 3.43Å; F187-F361 HydrophobicContact CD2-CE2 4.16Å; F187-F361 AromaticContact CD2-CZ 3.97Å; F187-F361 HydrophobicContact CD2-CZ 3.97Å; F187-F361 HydrophobicContact CE2-CE2 4.34Å; F187-F361 HydrophobicContact CE2-CZ 4.04Å
188	R	98.7	Very high	98.5	Very high	1 Å²	1	11.7 Å²	11.7	0%	0.004	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-44.9	168.6	-75.4	-162.4	63.4	-167.5	-7.1	112.7	H127 Q128 Y184 Q185 L186 L190 A191 Y192 L380 N382 F383 E387	H127-R188 WeakPolarHBondContact CE1-CB 3.03Å; H127-R188 PolarHBondContact NE2-NE 3.12Å; H127-R188 PolarHBondContact NE2-NH2 3.1Å; Q128-R188 VanDerWaalsContact NE2-NH1 3.16Å; Y184-R188 HydrophobicContact CD1-CG 4.4Å; Y184-R188 HydrophobicContact CE1-CG 4.11Å; Y184-R188 PolarHBondContact O-N 3.15Å; Q185-R188 PolarHBondContact O-N 2.89Å; L186-R188 VanDerWaalsContact C-N 3.32Å; L186-R188 PolarHBondContact O-N 3.48Å; R188-L190 VanDerWaalsContact C-N 3.33Å; R188-L190 PolarHBondContact O-N 3.03Å; R188-A191 PolarHBondContact O-N 3.48Å; R188-Y192 PolarHBondContact O-N 3.46Å; R188-L380 PolarHBondContact NH1-O 3.48Å; R188-N382 PolarHBondContact NH1-OD1 3.23Å; R188-N382 PolarHBondContact NH2-O 3.38Å; R188-F383 HydrophobicContact CG-CE1 3.88Å; R188-F383 HydrophobicContact CG-CZ 4.27Å; R188-E387 IonicContact CZ-OE1 3.26Å; R188-E387 VanDerWaalsContact CZ-OE1 3.28Å; R188-E387 IonicContact NE-OE1 3.38Å; R188-E387 PolarHBondContact NE-OE1 2.86Å; R188-E387 VanDerWaalsContact NH2-CD 3.34Å; R188-E387 IonicContact NH2-OE1 3.73Å; R188-E387 PolarHBondContact NH2-OE1 2.84Å; R188-E387 IonicContact NH2-OE2 2.65Å; R188-E387 PolarHBondContact NH2-OE2 3.37Å; R188-E387 VanDerWaalsContact NH2-OE2 3.12Å
189	A	98.8	Very high	98.5	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.4	-42.9	175.8	0	0	0	0	0	111.9	N129 V130 Q185 L186 Y192 I193 L219	N129-A189 HydrophobicContact CB-CB 3.94Å; N129-A189 WeakPolarHBondContact O-CB 3.22Å; V130-A189 HydrophobicContact CG2-CB 4.2Å; Q185-A189 PolarHBondContact O-N 3.22Å; L186-A189 WeakPolarHBondContact O-CB 3.43Å; L186-A189 PolarHBondContact O-N 3.27Å; L186-A189 VanDerWaalsContact O-N 3.16Å; A189-Y192 PolarHBondContact O-N 3.04Å; A189-I193 PolarHBondContact O-N 3.2Å; A189-I193 VanDerWaalsContact O-N 3.08Å; A189-L219 HydrophobicContact CB-CB 4.1Å; A189-L219 HydrophobicContact CB-CD2 4.14Å
190	L	98.9	Very high	98.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.9	-46.3	175.6	-69.6	-177	0	0	0	112.1	L186 F187 R188 Y192 I193 H194 I203 L219 D260 A264 P352	L186-L190 HydrophobicContact CD1-CD1 4.17Å; L186-L190 HydrophobicContact CD1-CD2 4.43Å; L186-L190 HydrophobicContact CD1-CG 3.95Å; L186-L190 HydrophobicContact CG-CD1 4.27Å; L186-L190 HydrophobicContact CG-CG 4.44Å; L186-L190 WeakPolarHBondContact O-CG 3.39Å; L186-L190 PolarHBondContact O-N 2.98Å; F187-L190 HydrophobicContact CD1-CD1 4.4Å; R188-L190 VanDerWaalsContact C-N 3.33Å; R188-L190 PolarHBondContact O-N 3.03Å; L190-Y192 VanDerWaalsContact C-N 3.28Å; L190-Y192 PolarHBondContact O-N 3.26Å; L190-I193 HydrophobicContact CD2-CD1 4.1Å; L190-I193 PolarHBondContact O-N 3.38Å; L190-H194 WeakPolarHBondContact O-CB 3.48Å; L190-H194 PolarHBondContact O-CD2 2.93Å; L190-H194 PolarHBondContact O-N 2.83Å; L190-I203 HydrophobicContact CD2-CD1 3.84Å; L190-I203 HydrophobicContact CD2-CG1 4.09Å; L190-L219 HydrophobicContact CD2-CD2 4.37Å; L190-D260 HydrophobicContact CD1-CB 4.23Å; L190-D260 HydrophobicContact CD2-CB 3.79Å; L190-A264 HydrophobicContact CD1-CB 3.99Å; L190-P352 HydrophobicContact CB-CB 3.9Å; L190-P352 HydrophobicContact CB-CG 3.78Å
191	A	98.8	Very high	98.6	Very high	3 Å²	3	9.4 Å²	9.4	3%	0.025	6%	0.056	C	C	.	.	H	α-helix	trans	-53.4	-48.2	175.5	0	0	0	0	0	111.3	F187 R188 S195 P352 L353 I390	F187-A191 WeakPolarHBondContact O-CB 3.35Å; F187-A191 PolarHBondContact O-N 3.48Å; R188-A191 PolarHBondContact O-N 3.48Å; A191-S195 WeakPolarHBondContact O-CB 3.19Å; A191-S195 PolarHBondContact O-N 3.21Å; A191-P352 HydrophobicContact CB-CB 3.98Å; A191-L353 HydrophobicContact CB-CD2 3.58Å; A191-L353 HydrophobicContact CB-CG 3.78Å; A191-I390 HydrophobicContact CB-CD1 4.18Å; A191-I390 WeakPolarHBondContact O-CD1 3.23Å
192	Y	98.7	Very high	98.6	Very high	17 Å²	17	9.8 Å²	9.8	7%	0.067	6%	0.058	C	C	.	.	H	α-helix	trans	-59.7	-55.5	178.4	176	-100.3	0	0	0	112.2	R124 L125 E126 H127 V130 R188 A189 L190 H194 S195 L196 L386	R124-Y192 PolarHBondContact O-OH 2.83Å; L125-Y192 HydrophobicContact CB-CE1 4.3Å; L125-Y192 HydrophobicContact CD2-CE1 3.95Å; E126-Y192 PolarHBondContact N-OH 2.78Å; E126-Y192 PolarHBondContact O-OH 2.65Å; H127-Y192 HydrophobicContact CB-CD1 3.51Å; H127-Y192 HydrophobicContact CB-CD2 4Å; H127-Y192 HydrophobicContact CB-CE1 3.65Å; H127-Y192 HydrophobicContact CB-CE2 4.11Å; H127-Y192 HydrophobicContact CB-CG 3.7Å; H127-Y192 AromaticContact CD2-CD2 3.68Å; H127-Y192 AromaticContact CD2-CG 3.62Å; H127-Y192 AromaticContact CG-CG 3.78Å; V130-Y192 HydrophobicContact CG2-CD1 4.33Å; R188-Y192 PolarHBondContact O-N 3.46Å; A189-Y192 PolarHBondContact O-N 3.04Å; L190-Y192 VanDerWaalsContact C-N 3.28Å; L190-Y192 PolarHBondContact O-N 3.26Å; Y192-H194 PolarHBondContact O-N 3.44Å; Y192-S195 PolarHBondContact O-N 3.21Å; Y192-S195 PolarHBondContact O-OG 3.07Å; Y192-L196 HydrophobicContact CE1-CD1 3.93Å; Y192-L196 HydrophobicContact CE2-CD1 4.48Å; Y192-L196 PolarHBondContact O-N 2.92Å; Y192-L386 HydrophobicContact CD2-CD2 4.18Å; Y192-L386 HydrophobicContact CE2-CD2 3.91Å
193	I	98.7	Very high	98.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.8	-33.5	-177.2	68.5	175.1	0	0	0	112.7	L125 V130 A189 L190 S195 L196 G197 I198 H200 L219 F222	L125-I193 HydrophobicContact CD1-CG2 4.16Å; L125-I193 HydrophobicContact CD2-CG2 4.03Å; V130-I193 HydrophobicContact CG2-CG2 4.31Å; A189-I193 PolarHBondContact O-N 3.2Å; A189-I193 VanDerWaalsContact O-N 3.08Å; L190-I193 HydrophobicContact CD2-CD1 4.1Å; L190-I193 PolarHBondContact O-N 3.38Å; I193-S195 VanDerWaalsContact C-N 3.33Å; I193-S195 PolarHBondContact O-N 2.64Å; I193-L196 PolarHBondContact O-N 3.29Å; I193-L196 VanDerWaalsContact O-N 3.15Å; I193-G197 PolarHBondContact O-N 3.42Å; I193-I198 CarbonylContact C-O 3.54Å; I193-I198 HydrophobicContact CB-CB 4.35Å; I193-I198 WeakPolarHBondContact O-CB 3.35Å; I193-I198 PolarHBondContact O-N 2.79Å; I193-H200 HydrophobicContact CD1-CB 4.03Å; I193-L219 HydrophobicContact CD1-CD2 4.02Å; I193-F222 HydrophobicContact CD1-CE1 4.17Å; I193-F222 HydrophobicContact CG2-CE1 4.2Å; I193-F222 HydrophobicContact CG2-CZ 4.47Å
194	H	98.6	Very high	98.5	Very high	26 Å²	26	9.6 Å²	9.6	12%	0.12	6%	0.057	C	C	.	.	H	α-helix	trans	-66.8	-34.4	176	-67.1	-177.1	0	0	0	111.7	L190 Y192 L196 G197 I198 T257 D260	L190-H194 WeakPolarHBondContact O-CB 3.48Å; L190-H194 PolarHBondContact O-CD2 2.93Å; L190-H194 PolarHBondContact O-N 2.83Å; Y192-H194 PolarHBondContact O-N 3.44Å; H194-L196 PolarHBondContact O-N 3.5Å; H194-G197 PolarHBondContact O-N 3.45Å; H194-I198 PolarHBondContact CD2-O 2.91Å; H194-T257 HydrophobicContact CB-CG2 4.26Å; H194-T257 PolarHBondContact CE1-O 2.68Å; H194-T257 VanDerWaalsContact CE1-O 3.23Å; H194-D260 IonicContact CD2-OD2 3.07Å; H194-D260 IonicContact CE1-OD2 3.66Å; H194-D260 IonicContact NE2-OD2 3.71Å; H194-D260 PolarHBondContact NE2-OD2 2.96Å
195	S	97.7	Very high	98.5	Very high	45 Å²	45	9.7 Å²	9.7	32%	0.315	6%	0.057	S	C	.	.	H	α-helix	trans	-63.3	-25.1	173.5	79.1	0	0	0	0	113.5	A191 Y192 I193 G197	A191-S195 WeakPolarHBondContact O-CB 3.19Å; A191-S195 PolarHBondContact O-N 3.21Å; Y192-S195 PolarHBondContact O-N 3.21Å; Y192-S195 PolarHBondContact O-OG 3.07Å; I193-S195 VanDerWaalsContact C-N 3.33Å; I193-S195 PolarHBondContact O-N 2.64Å; S195-G197 VanDerWaalsContact C-N 3.31Å
196	L	97.6	Very high	98.4	Very high	57 Å²	57	10.6 Å²	10.6	30%	0.298	6%	0.061	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	8.6	174.7	-59	175.9	0	0	0	112.8	L125 Y192 I193 H194 I198 H227 L386	L125-L196 HydrophobicContact CD2-CD1 3.66Å; Y192-L196 HydrophobicContact CE1-CD1 3.93Å; Y192-L196 HydrophobicContact CE2-CD1 4.48Å; Y192-L196 PolarHBondContact O-N 2.92Å; I193-L196 PolarHBondContact O-N 3.29Å; I193-L196 VanDerWaalsContact O-N 3.15Å; H194-L196 PolarHBondContact O-N 3.5Å; L196-I198 HydrophobicContact CB-CD1 3.9Å; L196-I198 HydrophobicContact CB-CG1 4.3Å; L196-I198 HydrophobicContact CD1-CD1 4.46Å; L196-I198 PolarHBondContact O-N 3.46Å; L196-H227 PolarHBondContact O-CD2 3.29Å; L196-H227 VanDerWaalsContact O-CD2 3.26Å; L196-L386 HydrophobicContact CD2-CD2 3.98Å
197	G	97.6	Very high	98.4	Very high	22 Å²	22	10.6 Å²	10.6	23%	0.227	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	9.5	-176.1	0	0	0	0	0	114.6	I193 H194 S195 H227 L228	I193-G197 PolarHBondContact O-N 3.42Å; H194-G197 PolarHBondContact O-N 3.45Å; S195-G197 VanDerWaalsContact C-N 3.31Å; G197-H227 CarbonylContact O-C 3.35Å; G197-H227 WeakPolarHBondContact O-CA 3.45Å; G197-L228 PolarHBondContact O-N 2.92Å
198	I	98.6	Very high	98.4	Very high	4 Å²	4	10.6 Å²	10.6	2%	0.021	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.8	-173.1	-63.1	162	0	0	0	109.8	I121 L125 I193 H194 L196 A225	I121-I198 HydrophobicContact CD1-CG2 4.25Å; I121-I198 HydrophobicContact CG2-CD1 4.27Å; I121-I198 HydrophobicContact CG2-CG2 4.16Å; L125-I198 HydrophobicContact CD2-CD1 3.92Å; I193-I198 CarbonylContact C-O 3.54Å; I193-I198 HydrophobicContact CB-CB 4.35Å; I193-I198 WeakPolarHBondContact O-CB 3.35Å; I193-I198 PolarHBondContact O-N 2.79Å; H194-I198 PolarHBondContact CD2-O 2.91Å; L196-I198 HydrophobicContact CB-CD1 3.9Å; L196-I198 HydrophobicContact CB-CG1 4.3Å; L196-I198 HydrophobicContact CD1-CD1 4.46Å; L196-I198 PolarHBondContact O-N 3.46Å; I198-A225 HydrophobicContact CG2-CB 4.29Å
199	C	98.7	Very high	98.4	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138	168.8	-171.3	0	0	0	0	109.7	R201 A225 K226 L228 T257 I259 D260	C199-R201 HydrophobicContact CB-CG 3.93Å; C199-R201 VanDerWaalsContact SG-CG 3.57Å; C199-A225 VanDerWaalsContact O-CA 3.22Å; C199-A225 WeakPolarHBondContact O-CA 3.48Å; C199-A225 WeakPolarHBondContact O-CB 3.46Å; C199-K226 PolarHBondContact N-O 3.05Å; C199-K226 PolarHBondContact O-N 3.43Å; C199-L228 HydrophobicContact CB-CD1 3.49Å; C199-L228 VanDerWaalsContact CB-CD1 3.49Å; C199-L228 HydrophobicContact CB-CD2 4.33Å; C199-L228 HydrophobicContact CB-CG 3.72Å; C199-T257 HydrophobicContact CB-CG2 3.95Å; C199-I259 VanDerWaalsContact SG-CG1 3.54Å; C199-D260 WeakPolarHBondContact CA-OD2 3.43Å; C199-D260 PolarHBondContact SG-OD2 3.44Å
200	H	98.7	Very high	98.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.			trans	-77	-39.6	-179.6	-160.8	-76.2	0	0	0	111.9	I193 D202 I203 C220 D221 F222 S224 A225 D260	I193-H200 HydrophobicContact CD1-CB 4.03Å; H200-D202 PolarHBondContact O-N 2.89Å; H200-I203 HydrophobicContact CB-CD1 3.6Å; H200-I203 HydrophobicContact CB-CG1 4.03Å; H200-C220 PolarHBondContact CE1-O 3.25Å; H200-C220 VanDerWaalsContact CE1-O 3.25Å; H200-C220 PolarHBondContact NE2-O 2.89Å; H200-C220 VanDerWaalsContact NE2-O 3.09Å; H200-D221 PolarHBondContact CE1-O 3.16Å; H200-F222 AromaticContact CD2-CD1 3.75Å; H200-F222 AromaticContact CD2-CE1 3.49Å; H200-F222 VanDerWaalsContact CD2-CE1 3.49Å; H200-F222 WeakPolarHBondContact CD2-CE1 3.07Å; H200-F222 AromaticContact CD2-CZ 3.88Å; H200-F222 AromaticContact NE2-CD1 4Å; H200-F222 AromaticContact NE2-CE1 3.97Å; H200-S224 CarbonylContact O-C 3.59Å; H200-S224 WeakPolarHBondContact O-CB 2.98Å; H200-A225 WeakPolarHBondContact O-CA 3.39Å; H200-A225 PolarHBondContact O-N 3.49Å; H200-D260 WeakPolarHBondContact CB-OD1 3.33Å; H200-D260 PolarHBondContact N-OD1 3.26Å; H200-D260 PolarHBondContact N-OD2 3.07Å
201	R	98.6	Very high	98.2	Very high	15 Å²	15	13 Å²	13	6%	0.057	7%	0.074	C	C	.	.	S	Bend	trans	61.9	17.4	176.9	-40.1	-167.6	-62.2	142	10.9	114.9	C199 S224 I238 C239 Y255 I259 D260	C199-R201 HydrophobicContact CB-CG 3.93Å; C199-R201 VanDerWaalsContact SG-CG 3.57Å; R201-S224 VanDerWaalsContact CZ-O 3.23Å; R201-S224 PolarHBondContact NE-O 3.15Å; R201-S224 PolarHBondContact NH2-O 3.49Å; R201-I238 HydrophobicContact CB-CG1 3.75Å; R201-I238 HydrophobicContact CB-CG2 4.35Å; R201-C239 WeakPolarHBondContact O-CA 3.13Å; R201-C239 VanDerWaalsContact O-CB 3.27Å; R201-C239 WeakPolarHBondContact O-CB 3.15Å; R201-C239 PolarHBondContact O-N 2.92Å; R201-Y255 PolarHBondContact NH1-OH 2.85Å; R201-I259 HydrophobicContact CB-CD1 4.12Å; R201-I259 HydrophobicContact CG-CD1 4.02Å; R201-D260 PolarHBondContact N-OD1 3Å
202	D	98.2	Very high	97.8	Very high	8 Å²	8	16 Å²	16	4%	0.043	9%	0.093	C	C	.	.			trans	-163.8	49.9	177.9	-165.2	37.2	0	0	0	111.8	H200 K204 N207 S240	H200-D202 PolarHBondContact O-N 2.89Å; D202-K204 IonicContact OD1-NZ 3.94Å; D202-K204 PolarHBondContact OD1-NZ 3.21Å; D202-K204 IonicContact OD2-NZ 2.88Å; D202-K204 PolarHBondContact OD2-NZ 2.92Å; D202-N207 PolarHBondContact O-ND2 3.25Å; D202-N207 PolarHBondContact OD2-ND2 3.42Å; D202-S240 WeakPolarHBondContact OD1-CB 3.26Å; D202-S240 PolarHBondContact OD1-N 2.96Å; D202-S240 PolarHBondContact OD1-OG 3.27Å
203	I	98.8	Very high	97.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.115	C	C	.	.			trans	-76.7	121.7	174.5	-60.7	-60.4	0	0	0	108.9	L186 L190 H200 L219 Y243 D260 V267	L186-I203 HydrophobicContact CD1-CD1 4.43Å; L186-I203 HydrophobicContact CD1-CG2 4.28Å; L186-I203 HydrophobicContact CD2-CG2 4.09Å; L190-I203 HydrophobicContact CD2-CD1 3.84Å; L190-I203 HydrophobicContact CD2-CG1 4.09Å; H200-I203 HydrophobicContact CB-CD1 3.6Å; H200-I203 HydrophobicContact CB-CG1 4.03Å; I203-L219 HydrophobicContact CD1-CD1 3.5Å; I203-L219 VanDerWaalsContact CD1-CD1 3.5Å; I203-L219 HydrophobicContact CD1-CD2 3.94Å; I203-L219 HydrophobicContact CD1-CG 4.37Å; I203-Y243 WeakPolarHBondContact O-CB 3.34Å; I203-D260 HydrophobicContact CG1-CB 3.9Å; I203-V267 HydrophobicContact CG2-CG2 4.45Å
204	K	98.4	Very high	97.2	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.009	13%	0.132	C	C	.	.			trans	-160.7	156.3	-177.2	65.1	-166.1	-170.5	-145.1	0	110.3	S33 D202 Q206 N207 S240 Y243	S33-K204 PolarHBondContact OG-NZ 2.86Å; D202-K204 IonicContact OD1-NZ 3.94Å; D202-K204 PolarHBondContact OD1-NZ 3.21Å; D202-K204 IonicContact OD2-NZ 2.88Å; D202-K204 PolarHBondContact OD2-NZ 2.92Å; K204-Q206 HydrophobicContact CG-CB 4.27Å; K204-Q206 VanDerWaalsContact CG-OE1 3.26Å; K204-Q206 PolarHBondContact O-N 3.18Å; K204-N207 WeakPolarHBondContact CE-ND2 3.11Å; K204-N207 VanDerWaalsContact CE-OD1 3.26Å; K204-N207 WeakPolarHBondContact CE-OD1 3.34Å; K204-N207 HydrophobicContact CG-CB 4.06Å; K204-N207 PolarHBondContact O-N 3.25Å; K204-S240 WeakPolarHBondContact CD-OG 3.48Å; K204-S240 PolarHBondContact NZ-OG 3.32Å; K204-Y243 HydrophobicContact CB-CD2 3.63Å; K204-Y243 HydrophobicContact CB-CE2 3.62Å; K204-Y243 HydrophobicContact CB-CG 4.12Å
205	P	98.4	Very high	97.1	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.013	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.5	-175.3	-24.7	35.5	0	0	0	115	V160 Y161 Y243 V267	V160-P205 HydrophobicContact CB-CB 4.31Å; V160-P205 HydrophobicContact CG1-CB 4.22Å; V160-P205 PolarHBondContact N-O 3.33Å; Y161-P205 WeakPolarHBondContact CB-O 3.38Å; Y161-P205 PolarHBondContact N-O 3.04Å; P205-Y243 VanDerWaalsContact CD-OH 3.3Å; P205-Y243 WeakPolarHBondContact CD-OH 3.42Å; P205-Y243 HydrophobicContact CG-CE1 4.06Å; P205-V267 HydrophobicContact CG-CG1 4.41Å; P205-V267 HydrophobicContact CG-CG2 4.12Å
206	Q	97	Very high	97.1	Very high	20 Å²	20	21.5 Å²	21.5	9%	0.093	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-33	174.4	-60.2	78.5	5.9	0	0	112.6	F35 Y161 K204 L208	F35-Q206 VanDerWaalsContact CD2-O 3.26Å; F35-Q206 WeakPolarHBondContact CD2-O 3.46Å; Y161-Q206 HydrophobicContact CD1-CG 4.19Å; Y161-Q206 HydrophobicContact CD2-CG 4.31Å; Y161-Q206 HydrophobicContact CG-CG 3.89Å; K204-Q206 HydrophobicContact CG-CB 4.27Å; K204-Q206 VanDerWaalsContact CG-OE1 3.26Å; K204-Q206 PolarHBondContact O-N 3.18Å; Q206-L208 VanDerWaalsContact C-N 3.27Å; Q206-L208 PolarHBondContact O-N 2.87Å
207	N	98.1	Very high	97.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-88.9	5.9	-178.4	-70.7	-0.1	0	0	0	112.7	S33 D202 K204 C220	S33-N207 PolarHBondContact OG-OD1 3.48Å; D202-N207 PolarHBondContact O-ND2 3.25Å; D202-N207 PolarHBondContact OD2-ND2 3.42Å; K204-N207 WeakPolarHBondContact CE-ND2 3.11Å; K204-N207 VanDerWaalsContact CE-OD1 3.26Å; K204-N207 WeakPolarHBondContact CE-OD1 3.34Å; K204-N207 HydrophobicContact CG-CB 4.06Å; K204-N207 PolarHBondContact O-N 3.25Å; N207-C220 PolarHBondContact O-N 2.93Å; N207-C220 PolarHBondContact O-SG 3.47Å; N207-C220 VanDerWaalsContact O-SG 3.33Å
208	L	98.6	Very high	97.2	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	97	175.8	-56	-179.1	0	0	0	108.2	T159 V160 L186 Q206 L217 L219 V267	T159-L208 CarbonylContact C-O 3.49Å; T159-L208 VanDerWaalsContact CA-O 3.23Å; T159-L208 WeakPolarHBondContact CA-O 3.47Å; T159-L208 WeakPolarHBondContact CB-O 3.41Å; V160-L208 HydrophobicContact CB-CB 3.92Å; V160-L208 HydrophobicContact CB-CD1 4.32Å; V160-L208 HydrophobicContact CG2-CB 3.51Å; V160-L208 HydrophobicContact CG2-CD1 4.16Å; V160-L208 HydrophobicContact CG2-CG 4.49Å; V160-L208 PolarHBondContact N-O 3.04Å; L186-L208 HydrophobicContact CD1-CD2 3.72Å; L186-L208 HydrophobicContact CD2-CD1 3.94Å; L186-L208 HydrophobicContact CD2-CD2 4.21Å; L186-L208 HydrophobicContact CG-CD2 4.45Å; Q206-L208 VanDerWaalsContact C-N 3.27Å; Q206-L208 PolarHBondContact O-N 2.87Å; L208-L217 HydrophobicContact CB-CD1 4.11Å; L208-L217 HydrophobicContact CD1-CD1 4.46Å; L208-L217 HydrophobicContact CD2-CD2 4.49Å; L208-L219 HydrophobicContact CD2-CD1 3.88Å; L208-V267 HydrophobicContact CD1-CG1 3.86Å; L208-V267 HydrophobicContact CD1-CG2 4.45Å
209	L	98.5	Very high	97.3	Very high	8 Å²	8	18.8 Å²	18.8	4%	0.042	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	148.1	175.7	-50.2	-177.6	0	0	0	110	F35 V131 I156 E158 T159 L217 K218 C220	F35-L209 HydrophobicContact CD1-CD2 4.38Å; F35-L209 HydrophobicContact CD2-CD2 4.41Å; F35-L209 HydrophobicContact CE1-CD2 4Å; F35-L209 HydrophobicContact CE2-CD2 4.02Å; F35-L209 HydrophobicContact CZ-CD2 3.81Å; V131-L209 HydrophobicContact CB-CD1 4.48Å; V131-L209 HydrophobicContact CG2-CD1 4.08Å; I156-L209 HydrophobicContact CB-CB 3.78Å; I156-L209 HydrophobicContact CB-CD1 4Å; I156-L209 HydrophobicContact CB-CG 4.48Å; I156-L209 HydrophobicContact CG1-CB 4.36Å; I156-L209 HydrophobicContact CG1-CD1 4.19Å; I156-L209 HydrophobicContact CG2-CB 3.62Å; E158-L209 WeakPolarHBondContact O-CA 3.39Å; T159-L209 HydrophobicContact CG2-CD2 3.82Å; L209-L217 WeakPolarHBondContact O-CA 3.49Å; L209-K218 HydrophobicContact CB-CB 4.41Å; L209-K218 WeakPolarHBondContact CB-O 3.48Å; L209-K218 PolarHBondContact N-O 3.27Å; L209-K218 PolarHBondContact O-N 3.32Å; L209-C220 HydrophobicContact CD1-CB 3.75Å; L209-C220 HydrophobicContact CD2-CB 4.47Å; L209-C220 VanDerWaalsContact CD2-SG 3.56Å; L209-C220 HydrophobicContact CG-CB 3.88Å; L209-C220 VanDerWaalsContact CG-SG 3.56Å
210	L	97.7	Very high	97.2	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.021	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135	-179.4	-179.3	70.7	0	0	0	111.1	I156 E158 V163 F182 P212	I156-L210 VanDerWaalsContact CG2-O 3.29Å; I156-L210 WeakPolarHBondContact CG2-O 3.45Å; E158-L210 HydrophobicContact CB-CB 4.4Å; E158-L210 WeakPolarHBondContact CB-O 3.39Å; E158-L210 PolarHBondContact N-O 2.69Å; E158-L210 VanDerWaalsContact N-O 3.15Å; E158-L210 PolarHBondContact O-N 2.95Å; V163-L210 HydrophobicContact CG2-CD2 3.71Å; F182-L210 HydrophobicContact CD1-CD1 3.85Å; F182-L210 HydrophobicContact CE1-CD1 3.32Å; F182-L210 HydrophobicContact CE1-CD2 3.9Å; F182-L210 HydrophobicContact CE1-CG 4.26Å; F182-L210 HydrophobicContact CE2-CD2 4.11Å; F182-L210 HydrophobicContact CZ-CD1 3.83Å; F182-L210 HydrophobicContact CZ-CD2 3.45Å; F182-L210 VanDerWaalsContact CZ-CD2 3.45Å; F182-L210 HydrophobicContact CZ-CG 4.3Å; L210-P212 WeakPolarHBondContact O-CD 3.22Å
211	D	95.8	Very high	97.1	Very high	39 Å²	39	19.6 Å²	19.6	21%	0.209	11%	0.105	C	C	.	.			trans	-90.7	113.2	156	174.1	13.2	0	0	0	109.7	E213 T214 A215 V216	D211-E213 VanDerWaalsContact C-N 3.26Å; D211-E213 PolarHBondContact O-N 3.25Å; D211-E213 WeakPolarHBondContact OD1-CB 3.41Å; D211-E213 PolarHBondContact OD1-N 3.36Å; D211-T214 VanDerWaalsContact CG-OG1 3.25Å; D211-T214 WeakPolarHBondContact OD2-CB 3.38Å; D211-T214 WeakPolarHBondContact OD2-CG2 3.23Å; D211-T214 PolarHBondContact OD2-N 3.18Å; D211-T214 PolarHBondContact OD2-OG1 2.86Å; D211-A215 VanDerWaalsContact O-CA 3.22Å; D211-A215 WeakPolarHBondContact O-CA 3.39Å; D211-A215 PolarHBondContact O-N 3.01Å; D211-V216 PolarHBondContact N-O 3.08Å
212	P	91.6	Very high	97	Very high	65 Å²	65	18.9 Å²	18.9	42%	0.422	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.5	178.5	-21	34.2	0	0	0	114.7	E158 L210	E158-P212 HydrophobicContact CB-CG 3.9Å; E158-P212 HydrophobicContact CG-CG 3.58Å; L210-P212 WeakPolarHBondContact O-CD 3.22Å
213	E	90.5	Very high	96.8	Very high	113 Å²	113	19.7 Å²	19.7	53%	0.528	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-35.3	-175.8	-79.9	-139.3	-134.6	0	0	113.2	D211 R375	D211-E213 VanDerWaalsContact C-N 3.26Å; D211-E213 PolarHBondContact O-N 3.25Å; D211-E213 WeakPolarHBondContact OD1-CB 3.41Å; D211-E213 PolarHBondContact OD1-N 3.36Å; E213-R375 PolarHBondContact O-NH1 2.87Å; E213-R375 IonicContact OE2-CZ 2.68Å; E213-R375 VanDerWaalsContact OE2-CZ 3.28Å; E213-R375 IonicContact OE2-NH1 2.76Å; E213-R375 PolarHBondContact OE2-NH1 3.3Å; E213-R375 IonicContact OE2-NH2 2.96Å; E213-R375 PolarHBondContact OE2-NH2 3.14Å
214	T	94.5	Very high	96.7	Very high	58 Å²	58	20.3 Å²	20.3	36%	0.356	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-9.3	179.7	62.7	0	0	0	0	113.5	D211 V216 P378	D211-T214 VanDerWaalsContact CG-OG1 3.25Å; D211-T214 WeakPolarHBondContact OD2-CB 3.38Å; D211-T214 WeakPolarHBondContact OD2-CG2 3.23Å; D211-T214 PolarHBondContact OD2-N 3.18Å; D211-T214 PolarHBondContact OD2-OG1 2.86Å; T214-V216 PolarHBondContact O-N 3.33Å; T214-V216 WeakPolarHBondContact OG1-CB 3.42Å; T214-V216 VanDerWaalsContact OG1-CG2 3.3Å; T214-V216 WeakPolarHBondContact OG1-CG2 3.36Å; T214-V216 PolarHBondContact OG1-N 3.46Å; T214-P378 WeakPolarHBondContact O-CD 3.06Å
215	A	96.3	Very high	96.7	Very high	2 Å²	2	20.2 Å²	20.2	2%	0.017	12%	0.117	C	C	.	.			trans	57.8	19.4	-169.3	0	0	0	0	0	114.7	Y178 L181 Q185 D211 L217 L371	Y178-A215 HydrophobicContact CD1-CB 4.45Å; Y178-A215 HydrophobicContact CE1-CB 4.4Å; L181-A215 HydrophobicContact CD1-CB 4.14Å; Q185-A215 PolarHBondContact NE2-O 3.34Å; D211-A215 VanDerWaalsContact O-CA 3.22Å; D211-A215 WeakPolarHBondContact O-CA 3.39Å; D211-A215 PolarHBondContact O-N 3.01Å; A215-L217 PolarHBondContact O-N 2.86Å; A215-L371 HydrophobicContact CB-CD1 4.27Å; A215-L371 HydrophobicContact CB-CD2 3.79Å
216	V	98	Very high	96.6	Very high	31 Å²	31	21.6 Å²	21.6	19%	0.188	12%	0.123	C	C	.	.			trans	-70.5	122.7	174.7	172	0	0	0	0	110.2	D211 T214 K218 P378	D211-V216 PolarHBondContact N-O 3.08Å; T214-V216 PolarHBondContact O-N 3.33Å; T214-V216 WeakPolarHBondContact OG1-CB 3.42Å; T214-V216 VanDerWaalsContact OG1-CG2 3.3Å; T214-V216 WeakPolarHBondContact OG1-CG2 3.36Å; T214-V216 PolarHBondContact OG1-N 3.46Å; V216-K218 HydrophobicContact CG1-CD 4.41Å; V216-K218 HydrophobicContact CG1-CG 4.33Å; V216-P378 HydrophobicContact CG2-CB 3.63Å
217	L	98.7	Very high	96.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138	173	177.2	149.5	0	0	0	110.7	N129 V160 F182 Q185 L186 L208 L209 A215	N129-L217 WeakPolarHBondContact CA-O 3.4Å; N129-L217 WeakPolarHBondContact CB-O 3.32Å; N129-L217 PolarHBondContact ND2-O 3.08Å; V160-L217 HydrophobicContact CG2-CD1 3.71Å; F182-L217 HydrophobicContact CB-CD1 3.73Å; F182-L217 HydrophobicContact CG-CD1 4.26Å; Q185-L217 HydrophobicContact CB-CB 3.95Å; Q185-L217 HydrophobicContact CB-CD2 4.15Å; L186-L217 HydrophobicContact CB-CD2 4.28Å; L208-L217 HydrophobicContact CB-CD1 4.11Å; L208-L217 HydrophobicContact CD1-CD1 4.46Å; L208-L217 HydrophobicContact CD2-CD2 4.49Å; L209-L217 WeakPolarHBondContact O-CA 3.49Å; A215-L217 PolarHBondContact O-N 2.86Å
218	K	98.8	Very high	96.6	Very high	25 Å²	25	26 Å²	26	11%	0.109	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.5	177.4	-79.7	163.6	173	-68.9	0	111.8	Q128 N129 V130 E154 I156 L209 V216	Q128-K218 WeakPolarHBondContact O-CE 3.35Å; Q128-K218 WeakPolarHBondContact O-CG 3.24Å; Q128-K218 PolarHBondContact O-NZ 2.85Å; N129-K218 CarbonylContact O-C 3.45Å; N129-K218 WeakPolarHBondContact O-CA 3.35Å; V130-K218 PolarHBondContact O-NZ 2.86Å; E154-K218 VanDerWaalsContact CD-NZ 3.26Å; E154-K218 WeakPolarHBondContact OE1-CD 3.25Å; E154-K218 WeakPolarHBondContact OE1-CE 3.27Å; E154-K218 IonicContact OE1-NZ 2.9Å; E154-K218 PolarHBondContact OE1-NZ 2.79Å; E154-K218 WeakPolarHBondContact OE2-CE 3.49Å; E154-K218 IonicContact OE2-NZ 3.67Å; E154-K218 PolarHBondContact OE2-NZ 2.87Å; E154-K218 VanDerWaalsContact OE2-NZ 3.07Å; I156-K218 HydrophobicContact CD1-CD 3.62Å; I156-K218 HydrophobicContact CG1-CD 3.81Å; L209-K218 HydrophobicContact CB-CB 4.41Å; L209-K218 WeakPolarHBondContact CB-O 3.48Å; L209-K218 PolarHBondContact N-O 3.27Å; L209-K218 PolarHBondContact O-N 3.32Å; V216-K218 HydrophobicContact CG1-CD 4.41Å; V216-K218 HydrophobicContact CG1-CG 4.33Å
219	L	98.8	Very high	96.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	134.3	174.6	179.2	58.7	0	0	0	111.1	N129 V131 A189 L190 I193 I203 L208 F222	N129-L219 PolarHBondContact O-N 3.47Å; V131-L219 WeakPolarHBondContact CG1-O 3.36Å; V131-L219 PolarHBondContact N-O 3.31Å; A189-L219 HydrophobicContact CB-CB 4.1Å; A189-L219 HydrophobicContact CB-CD2 4.14Å; L190-L219 HydrophobicContact CD2-CD2 4.37Å; I193-L219 HydrophobicContact CD1-CD2 4.02Å; I203-L219 HydrophobicContact CD1-CD1 3.5Å; I203-L219 VanDerWaalsContact CD1-CD1 3.5Å; I203-L219 HydrophobicContact CD1-CD2 3.94Å; I203-L219 HydrophobicContact CD1-CG 4.37Å; L208-L219 HydrophobicContact CD2-CD1 3.88Å; L219-F222 HydrophobicContact CD2-CZ 4.2Å; L219-F222 HydrophobicContact CG-CZ 4.12Å
220	C	97.8	Very high	96.4	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.02	21%	0.206	C	C	.	.			trans	-139.4	176.1	-177.8	77.8	0	0	0	0	113.6	V131 H200 N207 L209	V131-C220 HydrophobicContact CB-CB 4.06Å; V131-C220 HydrophobicContact CG1-CB 3.63Å; H200-C220 PolarHBondContact CE1-O 3.25Å; H200-C220 VanDerWaalsContact CE1-O 3.25Å; H200-C220 PolarHBondContact NE2-O 2.89Å; H200-C220 VanDerWaalsContact NE2-O 3.09Å; N207-C220 PolarHBondContact O-N 2.93Å; N207-C220 PolarHBondContact O-SG 3.47Å; N207-C220 VanDerWaalsContact O-SG 3.33Å; L209-C220 HydrophobicContact CD1-CB 3.75Å; L209-C220 HydrophobicContact CD2-CB 4.47Å; L209-C220 VanDerWaalsContact CD2-SG 3.56Å; L209-C220 HydrophobicContact CG-CB 3.88Å; L209-C220 VanDerWaalsContact CG-SG 3.56Å
221	D	95.5	Very high	96.2	Very high	14 Å²	14	44.9 Å²	44.9	8%	0.075	24%	0.244	C	C	.	.			trans	66.9	61.8	179.7	-162.5	18.5	0	0	0	114.7	S33 K106 H200 G223	S33-D221 WeakPolarHBondContact CB-OD2 3.48Å; S33-D221 PolarHBondContact OG-OD2 2.97Å; K106-D221 IonicContact NZ-OD1 2.71Å; K106-D221 PolarHBondContact NZ-OD1 3.41Å; H200-D221 PolarHBondContact CE1-O 3.16Å; D221-G223 PolarHBondContact O-N 2.91Å
222	F	96.9	Very high	96.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-74	13.1	176.8	-70.5	-91.2	0	0	0	113.6	E118 I121 M122 L125 V130 I193 H200 L219 S224 A225	E118-F222 HydrophobicContact CG-CB 3.98Å; E118-F222 PolarHBondContact OE1-N 3.22Å; I121-F222 HydrophobicContact CG2-CB 4.3Å; I121-F222 HydrophobicContact CG2-CD1 3.91Å; I121-F222 HydrophobicContact CG2-CG 4.32Å; M122-F222 HydrophobicContact CE-CD2 4.4Å; M122-F222 HydrophobicContact CG-CB 4.17Å; M122-F222 HydrophobicContact CG-CD2 4.24Å; M122-F222 HydrophobicContact CG-CG 4.38Å; M122-F222 HydrophobicContact SD-CD2 4.47Å; L125-F222 HydrophobicContact CD1-CD1 3.74Å; L125-F222 HydrophobicContact CD1-CD2 4.35Å; L125-F222 HydrophobicContact CD1-CE1 3.34Å; L125-F222 HydrophobicContact CD1-CE2 4.03Å; L125-F222 HydrophobicContact CD1-CG 4.23Å; L125-F222 HydrophobicContact CD1-CZ 3.52Å; V130-F222 HydrophobicContact CG1-CE2 3.68Å; V130-F222 HydrophobicContact CG1-CZ 3.67Å; I193-F222 HydrophobicContact CD1-CE1 4.17Å; I193-F222 HydrophobicContact CG2-CE1 4.2Å; I193-F222 HydrophobicContact CG2-CZ 4.47Å; H200-F222 AromaticContact CD2-CD1 3.75Å; H200-F222 AromaticContact CD2-CE1 3.49Å; H200-F222 VanDerWaalsContact CD2-CE1 3.49Å; H200-F222 WeakPolarHBondContact CD2-CE1 3.07Å; H200-F222 AromaticContact CD2-CZ 3.88Å; H200-F222 AromaticContact NE2-CD1 4Å; H200-F222 AromaticContact NE2-CE1 3.97Å; L219-F222 HydrophobicContact CD2-CZ 4.2Å; L219-F222 HydrophobicContact CG-CZ 4.12Å; F222-S224 VanDerWaalsContact C-N 3.25Å; F222-S224 PolarHBondContact O-N 3.02Å; F222-A225 HydrophobicContact CB-CB 4.16Å; F222-A225 HydrophobicContact CD1-CB 3.95Å; F222-A225 WeakPolarHBondContact O-CB 3.37Å; F222-A225 PolarHBondContact O-N 2.67Å; F222-A225 VanDerWaalsContact O-N 3.08Å
223	G	94.8	Very high	96.5	Very high	26 Å²	26	48.4 Å²	48.4	27%	0.268	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-58.5	-35.4	176.2	0	0	0	0	0	113.3	E118 D221	E118-G223 VanDerWaalsContact CD-N 3.34Å; E118-G223 PolarHBondContact OE1-N 3.17Å; D221-G223 PolarHBondContact O-N 2.91Å
224	S	95.9	Very high	96.8	Very high	12 Å²	12	43.6 Å²	43.6	8%	0.084	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-82.3	-14.4	176.3	-69.1	0	0	0	0	114.1	H200 R201 F222	H200-S224 CarbonylContact O-C 3.59Å; H200-S224 WeakPolarHBondContact O-CB 2.98Å; R201-S224 VanDerWaalsContact CZ-O 3.23Å; R201-S224 PolarHBondContact NE-O 3.15Å; R201-S224 PolarHBondContact NH2-O 3.49Å; F222-S224 VanDerWaalsContact C-N 3.25Å; F222-S224 PolarHBondContact O-N 3.02Å
225	A	97.7	Very high	96.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.25	C	S	.	.			trans	-68	153.7	-167.7	0	0	0	0	0	113.4	R117 I121 I198 C199 H200 F222	R117-A225 WeakPolarHBondContact CD-O 3.27Å; I121-A225 HydrophobicContact CD1-CB 3.64Å; I198-A225 HydrophobicContact CG2-CB 4.29Å; C199-A225 VanDerWaalsContact O-CA 3.22Å; C199-A225 WeakPolarHBondContact O-CA 3.48Å; C199-A225 WeakPolarHBondContact O-CB 3.46Å; H200-A225 WeakPolarHBondContact O-CA 3.39Å; H200-A225 PolarHBondContact O-N 3.49Å; F222-A225 HydrophobicContact CB-CB 4.16Å; F222-A225 HydrophobicContact CD1-CB 3.95Å; F222-A225 WeakPolarHBondContact O-CB 3.37Å; F222-A225 PolarHBondContact O-N 2.67Å; F222-A225 VanDerWaalsContact O-N 3.08Å
226	K	97.7	Very high	96.9	Very high	32 Å²	32	46.8 Å²	46.8	14%	0.139	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143	171	-161.9	-154.9	162.3	-172.3	0	109.4	C199 L228 E232 N234	C199-K226 PolarHBondContact N-O 3.05Å; C199-K226 PolarHBondContact O-N 3.43Å; K226-L228 HydrophobicContact CB-CD2 4.3Å; K226-L228 HydrophobicContact CD-CD2 4.24Å; K226-L228 PolarHBondContact O-N 2.82Å; K226-E232 IonicContact NZ-OE2 3.73Å; K226-E232 PolarHBondContact NZ-OE2 2.92Å; K226-N234 WeakPolarHBondContact CD-OD1 3.42Å; K226-N234 PolarHBondContact NZ-OD1 3.44Å
227	H	97.5	Very high	96.8	Very high	82 Å²	82	51.4 Å²	51.4	38%	0.38	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	120.6	158.2	-176.7	-91.3	0	0	0	108.6	L196 G197 I229	L196-H227 PolarHBondContact O-CD2 3.29Å; L196-H227 VanDerWaalsContact O-CD2 3.26Å; G197-H227 CarbonylContact O-C 3.35Å; G197-H227 WeakPolarHBondContact O-CA 3.45Å; H227-I229 VanDerWaalsContact ND1-CG1 3.32Å; H227-I229 WeakPolarHBondContact ND1-CG1 3.27Å
228	L	97.7	Very high	96.6	Very high	29 Å²	29	52.7 Å²	52.7	15%	0.152	28%	0.281	C	S	.	.			trans	-90.3	123.4	-178.9	-60	-174.3	0	0	0	109.7	G197 C199 K226 Y255 T257	G197-L228 PolarHBondContact O-N 2.92Å; C199-L228 HydrophobicContact CB-CD1 3.49Å; C199-L228 VanDerWaalsContact CB-CD1 3.49Å; C199-L228 HydrophobicContact CB-CD2 4.33Å; C199-L228 HydrophobicContact CB-CG 3.72Å; K226-L228 HydrophobicContact CB-CD2 4.3Å; K226-L228 HydrophobicContact CD-CD2 4.24Å; K226-L228 PolarHBondContact O-N 2.82Å; L228-Y255 HydrophobicContact CD1-CD2 4.33Å; L228-Y255 HydrophobicContact CD1-CE2 4.46Å; L228-Y255 HydrophobicContact CD2-CE2 4.31Å; L228-T257 HydrophobicContact CD1-CG2 4.32Å
229	I	97.2	Very high	96.4	Very high	75 Å²	75	51.9 Å²	51.9	39%	0.385	28%	0.279	S	S	.	.			trans	-112.1	124.5	179	-64	174.1	0	0	0	107.5	H227 G231 E232	H227-I229 VanDerWaalsContact ND1-CG1 3.32Å; H227-I229 WeakPolarHBondContact ND1-CG1 3.27Å; I229-G231 PolarHBondContact O-N 3.46Å; I229-E232 HydrophobicContact CB-CB 4.28Å; I229-E232 HydrophobicContact CB-CG 3.91Å; I229-E232 WeakPolarHBondContact CD1-OE1 3.44Å; I229-E232 HydrophobicContact CG2-CG 3.97Å; I229-E232 PolarHBondContact O-N 2.81Å
230	R	94.7	Very high	96.3	Very high	257 Å²	257	53.3 Å²	53.3	97%	0.97	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	121.9	-177.2	-171.5	179.9	-174.1	-175.7	2.2	109.9
231	G	94.7	Very high	96.2	Very high	79 Å²	79	54.6 Å²	54.6	81%	0.814	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	-12.3	-175.8	0	0	0	0	0	114.6	I229	I229-G231 PolarHBondContact O-N 3.46Å
232	E	96.5	Very high	96.4	Very high	81 Å²	81	57.1 Å²	57.1	38%	0.379	30%	0.302	S	S	.	.	S	Bend	trans	-83.3	131.1	165.2	-72.8	-173.1	-174.8	0	0	110.6	K226 I229 N234	K226-E232 IonicContact NZ-OE2 3.73Å; K226-E232 PolarHBondContact NZ-OE2 2.92Å; I229-E232 HydrophobicContact CB-CB 4.28Å; I229-E232 HydrophobicContact CB-CG 3.91Å; I229-E232 WeakPolarHBondContact CD1-OE1 3.44Å; I229-E232 HydrophobicContact CG2-CG 3.97Å; I229-E232 PolarHBondContact O-N 2.81Å; E232-N234 PolarHBondContact O-ND2 3.15Å
233	P	96.6	Very high	96.5	Very high	97 Å²	97	57.8 Å²	57.8	63%	0.63	31%	0.305	S	S	*	.			trans	-70.7	151.9	172.1	30.1	-34.5	0	0	0	112
234	N	97	Very high	96.6	Very high	12 Å²	12	57.3 Å²	57.3	6%	0.064	30%	0.295	C	S	.	.			trans	-134	145.5	-177.7	-52.2	-83.8	0	0	0	109.4	K226 E232 S236 T253 Y255	K226-N234 WeakPolarHBondContact CD-OD1 3.42Å; K226-N234 PolarHBondContact NZ-OD1 3.44Å; E232-N234 PolarHBondContact O-ND2 3.15Å; N234-S236 PolarHBondContact O-N 3.37Å; N234-T253 WeakPolarHBondContact CB-O 3.48Å; N234-T253 PolarHBondContact N-O 3.24Å; N234-T253 PolarHBondContact ND2-O 2.67Å; N234-T253 VanDerWaalsContact O-CA 3.3Å; N234-T253 WeakPolarHBondContact O-CA 3.39Å; N234-T253 VanDerWaalsContact O-CB 3.23Å; N234-T253 WeakPolarHBondContact O-CB 3.37Å; N234-T253 WeakPolarHBondContact O-CG2 3.24Å; N234-Y255 HydrophobicContact CB-CE1 3.72Å; N234-Y255 HydrophobicContact CB-CE2 4.2Å; N234-Y255 WeakPolarHBondContact CB-OH 3.25Å
235	V	96.5	Very high	96.8	Very high	95 Å²	95	56.8 Å²	56.8	58%	0.576	29%	0.291	S	S	*	.			trans	-60.7	122.8	178	178.8	0	0	0	0	109.9	Y255	V235-Y255 WeakPolarHBondContact O-CE1 3.22Å; V235-Y255 PolarHBondContact O-OH 3.15Å
236	S	95.5	Very high	96.8	Very high	31 Å²	31	56.8 Å²	56.8	22%	0.217	29%	0.291	C	S	.	.	S	Bend	trans	-74.1	-39.3	178.6	53.9	0	0	0	0	112.5	N234 I238 A252	N234-S236 PolarHBondContact O-N 3.37Å; S236-I238 VanDerWaalsContact C-N 3.26Å; S236-I238 PolarHBondContact O-N 3.21Å; S236-A252 WeakPolarHBondContact CB-O 3.45Å
237	Y	95.9	Very high	96.8	Very high	129 Å²	129	55.3 Å²	55.3	51%	0.506	29%	0.285	S	S	.	.	S	Bend	trans	-72.5	79.6	173.8	-165.6	-87.4	0	0	0	110.8	E28 R244	E28-Y237 PolarHBondContact OE1-OH 3.41Å; Y237-R244 VanDerWaalsContact CE2-NH1 3.31Å
238	I	95	Very high	96.8	Very high	27 Å²	27	51.8 Å²	51.8	14%	0.138	27%	0.268	C	S	.	.			trans	-145.5	172.9	-179.6	-161.8	57.1	0	0	0	109.8	R201 S236 R244 L248	R201-I238 HydrophobicContact CB-CG1 3.75Å; R201-I238 HydrophobicContact CB-CG2 4.35Å; S236-I238 VanDerWaalsContact C-N 3.26Å; S236-I238 PolarHBondContact O-N 3.21Å; I238-R244 PolarHBondContact O-NE 2.94Å; I238-R244 PolarHBondContact O-NH2 3.17Å; I238-L248 HydrophobicContact CG2-CD1 3.93Å; I238-L248 HydrophobicContact CG2-CD2 4.08Å
239	C	95.1	Very high	96.7	Very high	9 Å²	9	52.2 Å²	52.2	6%	0.061	27%	0.271	C	S	.	.	S	Bend	trans	63.8	144.2	-171.7	-163.6	0	0	0	0	114.3	R201 R244 L248	R201-C239 WeakPolarHBondContact O-CA 3.13Å; R201-C239 VanDerWaalsContact O-CB 3.27Å; R201-C239 WeakPolarHBondContact O-CB 3.15Å; R201-C239 PolarHBondContact O-N 2.92Å; C239-R244 HydrophobicContact CB-CB 4.5Å; C239-R244 PolarHBondContact O-NE 2.97Å; C239-R244 PolarHBondContact O-NH2 2.84Å; C239-L248 HydrophobicContact CB-CD1 4.37Å
240	S	95.6	Very high	96.5	Very high	29 Å²	29	49 Å²	49	20%	0.203	25%	0.254	C	S	.	.			trans	-63.4	131.7	173.7	-62.2	0	0	0	0	110.9	D202 K204 Y242 Y243 R244	D202-S240 WeakPolarHBondContact OD1-CB 3.26Å; D202-S240 PolarHBondContact OD1-N 2.96Å; D202-S240 PolarHBondContact OD1-OG 3.27Å; K204-S240 WeakPolarHBondContact CD-OG 3.48Å; K204-S240 PolarHBondContact NZ-OG 3.32Å; S240-Y242 PolarHBondContact O-N 2.99Å; S240-Y242 VanDerWaalsContact O-N 3.15Å; S240-Y243 PolarHBondContact O-N 3.2Å; S240-R244 PolarHBondContact O-N 3.07Å
241	R	97.2	Very high	96.6	Very high	31 Å²	31	38.3 Å²	38.3	12%	0.117	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-47.3	-51	-158.6	-162.2	-174.2	-69.3	154.3	-11.3	115.7	E28 Y243 R244 G280 E281 Q286	E28-R241 IonicContact OE1-CZ 2.63Å; E28-R241 IonicContact OE1-NE 3.22Å; E28-R241 IonicContact OE1-NH2 2.83Å; E28-R241 PolarHBondContact OE1-NH2 3.19Å; E28-R241 IonicContact OE2-NH2 3.31Å; E28-R241 PolarHBondContact OE2-NH2 3.35Å; R241-Y243 PolarHBondContact O-N 3.28Å; R241-Y243 VanDerWaalsContact O-N 3.12Å; R241-R244 WeakPolarHBondContact O-CB 3.32Å; R241-R244 PolarHBondContact O-N 2.6Å; R241-R244 VanDerWaalsContact O-N 3.1Å; R241-G280 WeakPolarHBondContact CD-O 3.45Å; R241-E281 PolarHBondContact NH1-O 3.07Å; R241-Q286 HydrophobicContact CG-CB 4.45Å; R241-Q286 HydrophobicContact CG-CG 4.39Å; R241-Q286 PolarHBondContact O-NE2 3.13Å; R241-Q286 PolarHBondContact O-OE1 3.14Å
242	Y	98.3	Very high	96.6	Very high	67 Å²	67	34.6 Å²	34.6	26%	0.263	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-64.6	-16.4	-176.5	-59.2	-14.9	0	0	0	114.9	S240 P276 F278 P279 G280	S240-Y242 PolarHBondContact O-N 2.99Å; S240-Y242 VanDerWaalsContact O-N 3.15Å; Y242-P276 HydrophobicContact CD2-CB 3.77Å; Y242-P276 HydrophobicContact CD2-CG 3.74Å; Y242-P276 HydrophobicContact CE2-CB 4.37Å; Y242-P276 HydrophobicContact CE2-CG 4.09Å; Y242-P276 HydrophobicContact CG-CB 4.34Å; Y242-F278 WeakPolarHBondContact CD1-O 3.45Å; Y242-P279 HydrophobicContact CE1-CB 4.3Å; Y242-G280 WeakPolarHBondContact CE1-O 3.47Å
243	Y	98.7	Very high	96.7	Very high	13 Å²	13	33.6 Å²	33.6	5%	0.051	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-112	3.9	-179.1	-39.5	-86.3	0	0	0	111.7	I203 K204 P205 S240 R241 A245 S263 C266 V267 E270	I203-Y243 WeakPolarHBondContact O-CB 3.34Å; K204-Y243 HydrophobicContact CB-CD2 3.63Å; K204-Y243 HydrophobicContact CB-CE2 3.62Å; K204-Y243 HydrophobicContact CB-CG 4.12Å; P205-Y243 VanDerWaalsContact CD-OH 3.3Å; P205-Y243 WeakPolarHBondContact CD-OH 3.42Å; P205-Y243 HydrophobicContact CG-CE1 4.06Å; S240-Y243 PolarHBondContact O-N 3.2Å; R241-Y243 PolarHBondContact O-N 3.28Å; R241-Y243 VanDerWaalsContact O-N 3.12Å; Y243-A245 PolarHBondContact O-N 2.8Å; Y243-S263 WeakPolarHBondContact O-CB 3.41Å; Y243-S263 PolarHBondContact O-OG 2.97Å; Y243-C266 HydrophobicContact CD1-CB 3.83Å; Y243-V267 HydrophobicContact CD1-CG2 4.22Å; Y243-V267 HydrophobicContact CE1-CG2 4.39Å; Y243-E270 WeakPolarHBondContact CE1-OE2 3.45Å; Y243-E270 PolarHBondContact OH-OE2 3.1Å; Y243-E270 VanDerWaalsContact OH-OE2 3.07Å
244	R	98.5	Very high	96.7	Very high	17 Å²	17	33.9 Å²	33.9	6%	0.064	18%	0.181	C	C	.	.			trans	-70.1	125.9	-177.9	-174.6	174.9	-68.2	165.6	2.1	110.1	Y237 I238 C239 S240 R241 L248 I249 W262	Y237-R244 VanDerWaalsContact CE2-NH1 3.31Å; I238-R244 PolarHBondContact O-NE 2.94Å; I238-R244 PolarHBondContact O-NH2 3.17Å; C239-R244 HydrophobicContact CB-CB 4.5Å; C239-R244 PolarHBondContact O-NE 2.97Å; C239-R244 PolarHBondContact O-NH2 2.84Å; S240-R244 PolarHBondContact O-N 3.07Å; R241-R244 WeakPolarHBondContact O-CB 3.32Å; R241-R244 PolarHBondContact O-N 2.6Å; R241-R244 VanDerWaalsContact O-N 3.1Å; R244-L248 HydrophobicContact CG-CB 3.71Å; R244-L248 HydrophobicContact CG-CD1 3.95Å; R244-L248 HydrophobicContact CG-CG 4.47Å; R244-I249 HydrophobicContact CG-CG1 4.04Å; R244-W262 PolarHBondContact O-NE1 3.11Å
245	A	98.7	Very high	96.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.			trans	-66.4	144.5	176.9	0	0	0	0	0	111.5	Y243 E247 L248 I249 I259 W262	Y243-A245 PolarHBondContact O-N 2.8Å; A245-E247 VanDerWaalsContact C-N 3.29Å; A245-E247 HydrophobicContact CB-CG 4.41Å; A245-E247 WeakPolarHBondContact CB-OE2 3.36Å; A245-E247 PolarHBondContact O-N 2.69Å; A245-L248 HydrophobicContact CB-CD1 4.33Å; A245-L248 HydrophobicContact CB-CG 4.44Å; A245-L248 VanDerWaalsContact O-CB 3.31Å; A245-L248 WeakPolarHBondContact O-CB 3.4Å; A245-L248 PolarHBondContact O-N 2.58Å; A245-I249 PolarHBondContact O-N 2.91Å; A245-I259 HydrophobicContact CB-CB 3.87Å; A245-I259 HydrophobicContact CB-CG2 3.76Å; A245-W262 HydrophobicContact CB-CB 3.89Å; A245-W262 HydrophobicContact CB-CD2 4.46Å; A245-W262 HydrophobicContact CB-CG 3.77Å
246	P	97.8	Very high	96.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-32.9	-170.6	25.2	-35.4	0	0	0	112.9	L248 I249 F250 W262 I290 M305 Y344	P246-L248 PolarHBondContact O-N 3.45Å; P246-I249 CarbonylContact O-C 3.6Å; P246-I249 WeakPolarHBondContact O-CA 3.44Å; P246-I249 WeakPolarHBondContact O-CB 3.28Å; P246-I249 PolarHBondContact O-N 3.49Å; P246-F250 HydrophobicContact CB-CD2 4.47Å; P246-F250 HydrophobicContact CB-CE2 4.44Å; P246-F250 WeakPolarHBondContact O-CD2 2.94Å; P246-F250 PolarHBondContact O-N 2.99Å; P246-W262 HydrophobicContact CG-CE3 4.21Å; P246-W262 HydrophobicContact CG-CH2 4.04Å; P246-W262 HydrophobicContact CG-CZ2 4.39Å; P246-W262 HydrophobicContact CG-CZ3 3.94Å; P246-I290 HydrophobicContact CB-CD1 4.46Å; P246-M305 HydrophobicContact CB-SD 3.6Å; P246-M305 HydrophobicContact CG-SD 3.57Å; P246-M305 VanDerWaalsContact CG-SD 3.57Å; P246-Y344 HydrophobicContact CB-CD1 4.22Å; P246-Y344 HydrophobicContact CB-CE1 4.47Å; P246-Y344 HydrophobicContact CG-CD1 4.04Å
247	E	97.7	Very high	97	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-57.7	-33.4	173.3	60.6	-91	-138.6	0	0	113.5	A245 I249 F250 G251 A252 I259 M305 P346 R349	A245-E247 VanDerWaalsContact C-N 3.29Å; A245-E247 HydrophobicContact CB-CG 4.41Å; A245-E247 WeakPolarHBondContact CB-OE2 3.36Å; A245-E247 PolarHBondContact O-N 2.69Å; E247-I249 VanDerWaalsContact C-N 3.33Å; E247-F250 CarbonylContact O-C 3.54Å; E247-F250 PolarHBondContact O-N 2.88Å; E247-G251 PolarHBondContact O-N 3.44Å; E247-G251 VanDerWaalsContact O-N 3.14Å; E247-A252 HydrophobicContact CB-CB 4.03Å; E247-A252 WeakPolarHBondContact O-CB 3.34Å; E247-A252 PolarHBondContact O-N 3.31Å; E247-I259 HydrophobicContact CG-CG2 4.07Å; E247-I259 WeakPolarHBondContact OE1-CG2 3.49Å; E247-M305 HydrophobicContact CB-CB 3.9Å; E247-M305 HydrophobicContact CB-CG 4.23Å; E247-M305 VanDerWaalsContact CB-O 3.31Å; E247-M305 WeakPolarHBondContact CB-O 3.37Å; E247-P346 HydrophobicContact CG-CG 4.45Å; E247-P346 WeakPolarHBondContact OE1-CG 3.44Å; E247-R349 IonicContact OE1-CZ 3.24Å; E247-R349 IonicContact OE1-NH1 3.6Å; E247-R349 PolarHBondContact OE1-NH1 2.82Å; E247-R349 IonicContact OE1-NH2 2.99Å; E247-R349 PolarHBondContact OE1-NH2 3.31Å; E247-R349 IonicContact OE2-CZ 2.71Å; E247-R349 IonicContact OE2-NH1 3.12Å; E247-R349 IonicContact OE2-NH2 2.61Å; E247-R349 PolarHBondContact OE2-NH2 2.89Å
248	L	97.6	Very high	97.1	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-71.5	-30.9	175.1	-59.5	175.7	0	0	0	111.5	I238 C239 R244 A245 P246 G251 Y255 I259	I238-L248 HydrophobicContact CG2-CD1 3.93Å; I238-L248 HydrophobicContact CG2-CD2 4.08Å; C239-L248 HydrophobicContact CB-CD1 4.37Å; R244-L248 HydrophobicContact CG-CB 3.71Å; R244-L248 HydrophobicContact CG-CD1 3.95Å; R244-L248 HydrophobicContact CG-CG 4.47Å; A245-L248 HydrophobicContact CB-CD1 4.33Å; A245-L248 HydrophobicContact CB-CG 4.44Å; A245-L248 VanDerWaalsContact O-CB 3.31Å; A245-L248 WeakPolarHBondContact O-CB 3.4Å; A245-L248 PolarHBondContact O-N 2.58Å; P246-L248 PolarHBondContact O-N 3.45Å; L248-G251 PolarHBondContact O-N 3.21Å; L248-Y255 HydrophobicContact CD2-CD1 3.34Å; L248-Y255 HydrophobicContact CD2-CD2 4.24Å; L248-Y255 HydrophobicContact CD2-CE1 3.42Å; L248-Y255 VanDerWaalsContact CD2-CE1 3.42Å; L248-Y255 HydrophobicContact CD2-CE2 4.33Å; L248-Y255 HydrophobicContact CD2-CG 3.76Å; L248-I259 HydrophobicContact CD1-CB 4.27Å; L248-I259 HydrophobicContact CD1-CD1 3.93Å; L248-I259 HydrophobicContact CD1-CG2 4.18Å; L248-I259 HydrophobicContact CD2-CD1 4.38Å; L248-I259 HydrophobicContact CD2-CG2 4.34Å; L248-I259 HydrophobicContact CG-CG2 4.14Å
249	I	95.8	Very high	97.3	Very high	39 Å²	39	26.6 Å²	26.6	20%	0.2	15%	0.149	C	C	.	.	H	α-helix	trans	-73.8	-38.7	174.1	-49.2	174.2	0	0	0	110.2	R244 A245 P246 E247 G251 G283 Q286 L287 I290	R244-I249 HydrophobicContact CG-CG1 4.04Å; A245-I249 PolarHBondContact O-N 2.91Å; P246-I249 CarbonylContact O-C 3.6Å; P246-I249 WeakPolarHBondContact O-CA 3.44Å; P246-I249 WeakPolarHBondContact O-CB 3.28Å; P246-I249 PolarHBondContact O-N 3.49Å; E247-I249 VanDerWaalsContact C-N 3.33Å; I249-G251 PolarHBondContact O-N 2.91Å; I249-G283 WeakPolarHBondContact CG2-O 3.23Å; I249-Q286 HydrophobicContact CD1-CB 4.03Å; I249-Q286 HydrophobicContact CD1-CG 3.59Å; I249-L287 HydrophobicContact CG2-CB 4.18Å; I249-I290 HydrophobicContact CD1-CD1 3.87Å
250	F	94.2	Very high	97.4	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.035	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	5.7	168.5	-71.7	-68.1	0	0	0	113.7	P246 E247 A252 L287 P297 M305 N306 F309 L314	P246-F250 HydrophobicContact CB-CD2 4.47Å; P246-F250 HydrophobicContact CB-CE2 4.44Å; P246-F250 WeakPolarHBondContact O-CD2 2.94Å; P246-F250 PolarHBondContact O-N 2.99Å; E247-F250 CarbonylContact O-C 3.54Å; E247-F250 PolarHBondContact O-N 2.88Å; F250-A252 PolarHBondContact O-N 3.04Å; F250-L287 HydrophobicContact CE1-CD2 4.01Å; F250-L287 HydrophobicContact CE2-CD1 3.86Å; F250-L287 HydrophobicContact CE2-CD2 4.39Å; F250-L287 HydrophobicContact CZ-CD1 3.88Å; F250-L287 HydrophobicContact CZ-CD2 3.75Å; F250-L287 HydrophobicContact CZ-CG 4.48Å; F250-P297 HydrophobicContact CZ-CG 4.42Å; F250-M305 HydrophobicContact CD2-CB 4.23Å; F250-M305 HydrophobicContact CD2-CE 3.81Å; F250-M305 HydrophobicContact CD2-SD 3.83Å; F250-M305 HydrophobicContact CE2-CE 3.38Å; F250-M305 HydrophobicContact CE2-SD 3.82Å; F250-M305 HydrophobicContact CZ-CE 4.2Å; F250-N306 HydrophobicContact CB-CB 4.19Å; F250-N306 PolarHBondContact O-ND2 2.91Å; F250-F309 HydrophobicContact CB-CD2 4.38Å; F250-F309 AromaticContact CD1-CD1 3.76Å; F250-F309 HydrophobicContact CD1-CD1 3.76Å; F250-F309 AromaticContact CD1-CD2 3.89Å; F250-F309 HydrophobicContact CD1-CD2 3.89Å; F250-F309 AromaticContact CD1-CE1 3.56Å; F250-F309 HydrophobicContact CD1-CE1 3.56Å; F250-F309 AromaticContact CD1-CE2 3.73Å; F250-F309 HydrophobicContact CD1-CE2 3.73Å; F250-F309 AromaticContact CD1-CG 3.91Å; F250-F309 HydrophobicContact CD1-CG 3.91Å; F250-F309 AromaticContact CD1-CZ 3.55Å; F250-F309 HydrophobicContact CD1-CZ 3.55Å; F250-F309 HydrophobicContact CE1-CD1 4.04Å; F250-F309 AromaticContact CE1-CE1 3.58Å; F250-F309 HydrophobicContact CE1-CE1 3.58Å; F250-F309 HydrophobicContact CE1-CE2 4.45Å; F250-F309 AromaticContact CE1-CZ 3.82Å; F250-F309 HydrophobicContact CE1-CZ 3.82Å; F250-L314 HydrophobicContact CZ-CD1 4.33Å
251	G	94.9	Very high	97.6	Very high	31 Å²	31	25 Å²	25	32%	0.32	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	14	171.7	0	0	0	0	0	116	E247 L248 I249	E247-G251 PolarHBondContact O-N 3.44Å; E247-G251 VanDerWaalsContact O-N 3.14Å; L248-G251 PolarHBondContact O-N 3.21Å; I249-G251 PolarHBondContact O-N 2.91Å
252	A	96.5	Very high	97.7	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.008	13%	0.132	C	C	.	.			trans	-57.4	141	179.7	0	0	0	0	0	112	S236 E247 F250 Y255 M305 N306	S236-A252 WeakPolarHBondContact CB-O 3.45Å; E247-A252 HydrophobicContact CB-CB 4.03Å; E247-A252 WeakPolarHBondContact O-CB 3.34Å; E247-A252 PolarHBondContact O-N 3.31Å; F250-A252 PolarHBondContact O-N 3.04Å; A252-Y255 WeakPolarHBondContact O-CD1 3.35Å; A252-M305 WeakPolarHBondContact CB-O 3.21Å; A252-N306 HydrophobicContact CB-CB 4.14Å
253	T	97	Very high	97.7	Very high	61 Å²	61	20.3 Å²	20.3	37%	0.374	12%	0.12	S	C	.	.	S	Bend	trans	-115.8	-10.7	179	62.4	0	0	0	0	113.1	N234	N234-T253 WeakPolarHBondContact CB-O 3.48Å; N234-T253 PolarHBondContact N-O 3.24Å; N234-T253 PolarHBondContact ND2-O 2.67Å; N234-T253 VanDerWaalsContact O-CA 3.3Å; N234-T253 WeakPolarHBondContact O-CA 3.39Å; N234-T253 VanDerWaalsContact O-CB 3.23Å; N234-T253 WeakPolarHBondContact O-CB 3.37Å; N234-T253 WeakPolarHBondContact O-CG2 3.24Å
254	D	96.8	Very high	97.7	Very high	103 Å²	103	19.7 Å²	19.7	55%	0.551	12%	0.117	S	C	*	.	S	Bend	trans	-103.4	14.1	-178.3	58.1	-38.8	0	0	0	113.2
255	Y	97.8	Very high	97.7	Very high	14 Å²	14	18.9 Å²	18.9	6%	0.055	11%	0.114	C	C	.	.			trans	-57	154.2	178.4	59.9	-99.6	0	0	0	113.6	R201 L228 N234 V235 L248 A252 I259	R201-Y255 PolarHBondContact NH1-OH 2.85Å; L228-Y255 HydrophobicContact CD1-CD2 4.33Å; L228-Y255 HydrophobicContact CD1-CE2 4.46Å; L228-Y255 HydrophobicContact CD2-CE2 4.31Å; N234-Y255 HydrophobicContact CB-CE1 3.72Å; N234-Y255 HydrophobicContact CB-CE2 4.2Å; N234-Y255 WeakPolarHBondContact CB-OH 3.25Å; V235-Y255 WeakPolarHBondContact O-CE1 3.22Å; V235-Y255 PolarHBondContact O-OH 3.15Å; L248-Y255 HydrophobicContact CD2-CD1 3.34Å; L248-Y255 HydrophobicContact CD2-CD2 4.24Å; L248-Y255 HydrophobicContact CD2-CE1 3.42Å; L248-Y255 VanDerWaalsContact CD2-CE1 3.42Å; L248-Y255 HydrophobicContact CD2-CE2 4.33Å; L248-Y255 HydrophobicContact CD2-CG 3.76Å; A252-Y255 WeakPolarHBondContact O-CD1 3.35Å; Y255-I259 HydrophobicContact CD2-CD1 3.67Å; Y255-I259 HydrophobicContact CD2-CG1 4.3Å; Y255-I259 HydrophobicContact CD2-CG2 4.18Å; Y255-I259 HydrophobicContact CE2-CD1 3.58Å; Y255-I259 HydrophobicContact CG-CG2 4.33Å
256	T	98.3	Very high	97.8	Very high	75 Å²	75	19 Å²	19	46%	0.46	12%	0.115	S	C	.	.			trans	-104.3	-177.5	-178.9	68.4	0	0	0	0	112	S258 I259	T256-S258 PolarHBondContact O-N 2.68Å; T256-S258 VanDerWaalsContact O-N 3.08Å; T256-S258 WeakPolarHBondContact OG1-CB 3.34Å; T256-S258 PolarHBondContact OG1-N 3.09Å; T256-S258 PolarHBondContact OG1-OG 3.48Å; T256-I259 PolarHBondContact O-N 3.28Å
257	T	98.6	Very high	97.8	Very high	38 Å²	38	19 Å²	19	23%	0.233	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.2	173.5	51.1	0	0	0	0	114.1	H194 C199 L228 I259 D260	H194-T257 HydrophobicContact CB-CG2 4.26Å; H194-T257 PolarHBondContact CE1-O 2.68Å; H194-T257 VanDerWaalsContact CE1-O 3.23Å; C199-T257 HydrophobicContact CB-CG2 3.95Å; L228-T257 HydrophobicContact CD1-CG2 4.32Å; T257-I259 PolarHBondContact O-N 2.81Å; T257-I259 VanDerWaalsContact O-N 3.09Å; T257-D260 WeakPolarHBondContact O-CB 3.32Å; T257-D260 PolarHBondContact O-N 3.45Å
258	S	98.7	Very high	97.9	Very high	12 Å²	12	19 Å²	19	8%	0.084	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-13.2	176.7	63.9	0	0	0	0	114.9	T256 D260 V261 W262 P346 R349	T256-S258 PolarHBondContact O-N 2.68Å; T256-S258 VanDerWaalsContact O-N 3.08Å; T256-S258 WeakPolarHBondContact OG1-CB 3.34Å; T256-S258 PolarHBondContact OG1-N 3.09Å; T256-S258 PolarHBondContact OG1-OG 3.48Å; S258-D260 VanDerWaalsContact C-N 3.31Å; S258-V261 WeakPolarHBondContact O-CB 3.17Å; S258-V261 PolarHBondContact O-N 3.33Å; S258-W262 PolarHBondContact O-N 2.97Å; S258-W262 VanDerWaalsContact O-N 3.16Å; S258-P346 WeakPolarHBondContact OG-CB 3.49Å; S258-R349 PolarHBondContact O-NH1 3.24Å
259	I	98.8	Very high	97.9	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-34.6	170.1	64.9	168.5	0	0	0	111.8	C199 R201 A245 E247 L248 Y255 T256 T257 V261 W262 S263	C199-I259 VanDerWaalsContact SG-CG1 3.54Å; R201-I259 HydrophobicContact CB-CD1 4.12Å; R201-I259 HydrophobicContact CG-CD1 4.02Å; A245-I259 HydrophobicContact CB-CB 3.87Å; A245-I259 HydrophobicContact CB-CG2 3.76Å; E247-I259 HydrophobicContact CG-CG2 4.07Å; E247-I259 WeakPolarHBondContact OE1-CG2 3.49Å; L248-I259 HydrophobicContact CD1-CB 4.27Å; L248-I259 HydrophobicContact CD1-CD1 3.93Å; L248-I259 HydrophobicContact CD1-CG2 4.18Å; L248-I259 HydrophobicContact CD2-CD1 4.38Å; L248-I259 HydrophobicContact CD2-CG2 4.34Å; L248-I259 HydrophobicContact CG-CG2 4.14Å; Y255-I259 HydrophobicContact CD2-CD1 3.67Å; Y255-I259 HydrophobicContact CD2-CG1 4.3Å; Y255-I259 HydrophobicContact CD2-CG2 4.18Å; Y255-I259 HydrophobicContact CE2-CD1 3.58Å; Y255-I259 HydrophobicContact CG-CG2 4.33Å; T256-I259 PolarHBondContact O-N 3.28Å; T257-I259 PolarHBondContact O-N 2.81Å; T257-I259 VanDerWaalsContact O-N 3.09Å; I259-V261 VanDerWaalsContact C-N 3.28Å; I259-V261 PolarHBondContact O-N 2.9Å; I259-W262 PolarHBondContact O-N 3.1Å; I259-S263 PolarHBondContact O-N 3.28Å; I259-S263 PolarHBondContact O-OG 3.4Å
260	D	98.9	Very high	98	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-69.2	-30.1	175.9	-64.9	-33.9	0	0	0	111.2	L190 H194 C199 H200 R201 I203 T257 S258 S263 A264	L190-D260 HydrophobicContact CD1-CB 4.23Å; L190-D260 HydrophobicContact CD2-CB 3.79Å; H194-D260 IonicContact CD2-OD2 3.07Å; H194-D260 IonicContact CE1-OD2 3.66Å; H194-D260 IonicContact NE2-OD2 3.71Å; H194-D260 PolarHBondContact NE2-OD2 2.96Å; C199-D260 WeakPolarHBondContact CA-OD2 3.43Å; C199-D260 PolarHBondContact SG-OD2 3.44Å; H200-D260 WeakPolarHBondContact CB-OD1 3.33Å; H200-D260 PolarHBondContact N-OD1 3.26Å; H200-D260 PolarHBondContact N-OD2 3.07Å; R201-D260 PolarHBondContact N-OD1 3Å; I203-D260 HydrophobicContact CG1-CB 3.9Å; T257-D260 WeakPolarHBondContact O-CB 3.32Å; T257-D260 PolarHBondContact O-N 3.45Å; S258-D260 VanDerWaalsContact C-N 3.31Å; D260-S263 PolarHBondContact O-N 3.04Å; D260-A264 WeakPolarHBondContact O-CB 3.42Å; D260-A264 PolarHBondContact O-N 2.96Å
261	V	98.9	Very high	98.2	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.024	11%	0.106	C	C	.	.	H	α-helix	trans	-68.6	-45.8	176.6	177.8	0	0	0	0	110.6	S258 I259 S263 A264 G265 L341 R349 L350 P352	S258-V261 WeakPolarHBondContact O-CB 3.17Å; S258-V261 PolarHBondContact O-N 3.33Å; I259-V261 VanDerWaalsContact C-N 3.28Å; I259-V261 PolarHBondContact O-N 2.9Å; V261-S263 VanDerWaalsContact C-N 3.34Å; V261-A264 PolarHBondContact O-N 3.32Å; V261-G265 PolarHBondContact O-N 3.42Å; V261-L341 HydrophobicContact CG1-CD2 3.47Å; V261-L341 VanDerWaalsContact CG1-CD2 3.47Å; V261-R349 HydrophobicContact CG1-CB 3.96Å; V261-L350 WeakPolarHBondContact CG1-O 3.47Å; V261-P352 HydrophobicContact CG2-CG 4.15Å
262	W	98.9	Very high	98.3	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.9	-48	171.6	172	-80.5	0	0	0	111.2	R244 A245 P246 S258 I259 A264 G265 C266 F278 I290 L294 L342	R244-W262 PolarHBondContact O-NE1 3.11Å; A245-W262 HydrophobicContact CB-CB 3.89Å; A245-W262 HydrophobicContact CB-CD2 4.46Å; A245-W262 HydrophobicContact CB-CG 3.77Å; P246-W262 HydrophobicContact CG-CE3 4.21Å; P246-W262 HydrophobicContact CG-CH2 4.04Å; P246-W262 HydrophobicContact CG-CZ2 4.39Å; P246-W262 HydrophobicContact CG-CZ3 3.94Å; S258-W262 PolarHBondContact O-N 2.97Å; S258-W262 VanDerWaalsContact O-N 3.16Å; I259-W262 PolarHBondContact O-N 3.1Å; W262-A264 VanDerWaalsContact C-N 3.29Å; W262-A264 PolarHBondContact O-N 3.46Å; W262-G265 WeakPolarHBondContact O-CA 3.38Å; W262-G265 PolarHBondContact O-N 3.44Å; W262-C266 PolarHBondContact NE1-SG 3.18Å; W262-C266 VanDerWaalsContact NE1-SG 3.38Å; W262-C266 PolarHBondContact O-N 2.9Å; W262-C266 PolarHBondContact O-SG 3.07Å; W262-C266 VanDerWaalsContact O-SG 3.4Å; W262-F278 HydrophobicContact CH2-CE2 4.07Å; W262-F278 HydrophobicContact CH2-CZ 4.45Å; W262-F278 HydrophobicContact CZ2-CD2 4.05Å; W262-F278 AromaticContact CZ2-CE2 3.53Å; W262-F278 HydrophobicContact CZ2-CE2 3.53Å; W262-F278 HydrophobicContact CZ2-CZ 4.31Å; W262-I290 HydrophobicContact CH2-CD1 4.28Å; W262-I290 HydrophobicContact CH2-CG1 4.33Å; W262-I290 HydrophobicContact CH2-CG2 3.78Å; W262-I290 HydrophobicContact CZ2-CD1 3.67Å; W262-I290 HydrophobicContact CZ2-CG1 3.9Å; W262-I290 HydrophobicContact CZ2-CG2 4.21Å; W262-L294 HydrophobicContact CH2-CD1 3.72Å; W262-L294 HydrophobicContact CZ3-CD1 3.94Å; W262-L342 HydrophobicContact CD2-CD2 3.67Å; W262-L342 HydrophobicContact CE3-CB 4.42Å; W262-L342 HydrophobicContact CE3-CD2 3.85Å; W262-L342 HydrophobicContact CG-CD2 4.12Å; W262-L342 HydrophobicContact CH2-CD2 4.34Å; W262-L342 HydrophobicContact CZ2-CD2 4.18Å; W262-L342 HydrophobicContact CZ3-CB 4.16Å; W262-L342 HydrophobicContact CZ3-CD2 4.19Å; W262-L342 WeakPolarHBondContact O-CD2 3.45Å
263	S	98.9	Very high	98.3	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-59.2	-40	177.8	-60.1	0	0	0	0	112	Y243 I259 D260 V261 C266 V267	Y243-S263 WeakPolarHBondContact O-CB 3.41Å; Y243-S263 PolarHBondContact O-OG 2.97Å; I259-S263 PolarHBondContact O-N 3.28Å; I259-S263 PolarHBondContact O-OG 3.4Å; D260-S263 PolarHBondContact O-N 3.04Å; V261-S263 VanDerWaalsContact C-N 3.34Å; S263-C266 WeakPolarHBondContact O-CB 3.48Å; S263-C266 PolarHBondContact O-N 3.06Å; S263-V267 WeakPolarHBondContact O-CG2 3.29Å; S263-V267 PolarHBondContact O-N 2.89Å
264	A	98.9	Very high	98.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.4	-35.6	173	0	0	0	0	0	112.8	M183 L186 F187 L190 D260 V261 W262 C266 V267 L268	M183-A264 HydrophobicContact CE-CB 4.07Å; M183-A264 VanDerWaalsContact CE-O 3.23Å; M183-A264 WeakPolarHBondContact CE-O 3.1Å; L186-A264 HydrophobicContact CD2-CB 3.87Å; L186-A264 HydrophobicContact CG-CB 4.43Å; F187-A264 HydrophobicContact CD1-CB 4.48Å; F187-A264 HydrophobicContact CE1-CB 3.65Å; F187-A264 HydrophobicContact CZ-CB 4.12Å; L190-A264 HydrophobicContact CD1-CB 3.99Å; D260-A264 WeakPolarHBondContact O-CB 3.42Å; D260-A264 PolarHBondContact O-N 2.96Å; V261-A264 PolarHBondContact O-N 3.32Å; W262-A264 VanDerWaalsContact C-N 3.29Å; W262-A264 PolarHBondContact O-N 3.46Å; A264-C266 VanDerWaalsContact C-N 3.32Å; A264-C266 PolarHBondContact O-N 2.93Å; A264-V267 PolarHBondContact O-N 3.42Å; A264-L268 PolarHBondContact O-N 2.9Å
265	G	98.9	Very high	98.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.7	-40.7	169.1	0	0	0	0	0	112.7	V261 W262 L268 A269	V261-G265 PolarHBondContact O-N 3.42Å; W262-G265 WeakPolarHBondContact O-CA 3.38Å; W262-G265 PolarHBondContact O-N 3.44Å; G265-L268 PolarHBondContact O-N 2.96Å; G265-A269 WeakPolarHBondContact O-CB 3.14Å; G265-A269 PolarHBondContact O-N 2.99Å
266	C	98.9	Very high	98.1	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-64.9	-39.3	174.3	-63.8	0	0	0	0	111.8	Y243 W262 S263 A264 A269 E270 I277	Y243-C266 HydrophobicContact CD1-CB 3.83Å; W262-C266 PolarHBondContact NE1-SG 3.18Å; W262-C266 VanDerWaalsContact NE1-SG 3.38Å; W262-C266 PolarHBondContact O-N 2.9Å; W262-C266 PolarHBondContact O-SG 3.07Å; W262-C266 VanDerWaalsContact O-SG 3.4Å; S263-C266 WeakPolarHBondContact O-CB 3.48Å; S263-C266 PolarHBondContact O-N 3.06Å; A264-C266 VanDerWaalsContact C-N 3.32Å; A264-C266 PolarHBondContact O-N 2.93Å; C266-A269 PolarHBondContact O-N 2.68Å; C266-E270 WeakPolarHBondContact O-CB 3.39Å; C266-E270 PolarHBondContact O-N 2.94Å; C266-I277 HydrophobicContact CB-CG2 4.45Å
267	V	98.8	Very high	98.1	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-63.6	-46.5	174.1	174.4	0	0	0	0	111.5	M183 I203 P205 L208 Y243 S263 A264 A269 E270 L271	M183-V267 HydrophobicContact SD-CB 4.3Å; M183-V267 HydrophobicContact SD-CG1 3.8Å; I203-V267 HydrophobicContact CG2-CG2 4.45Å; P205-V267 HydrophobicContact CG-CG1 4.41Å; P205-V267 HydrophobicContact CG-CG2 4.12Å; L208-V267 HydrophobicContact CD1-CG1 3.86Å; L208-V267 HydrophobicContact CD1-CG2 4.45Å; Y243-V267 HydrophobicContact CD1-CG2 4.22Å; Y243-V267 HydrophobicContact CE1-CG2 4.39Å; S263-V267 WeakPolarHBondContact O-CG2 3.29Å; S263-V267 PolarHBondContact O-N 2.89Å; A264-V267 PolarHBondContact O-N 3.42Å; V267-A269 VanDerWaalsContact C-N 3.35Å; V267-A269 PolarHBondContact O-N 3.26Å; V267-E270 PolarHBondContact O-N 3.09Å; V267-L271 HydrophobicContact CG1-CD1 4.06Å; V267-L271 HydrophobicContact CG1-CG 4.46Å; V267-L271 VanDerWaalsContact O-CG 3.3Å; V267-L271 WeakPolarHBondContact O-CG 3.29Å; V267-L271 PolarHBondContact O-N 3.41Å
268	L	98.8	Very high	98.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.1	-48.2	175.5	171.4	59.7	0	0	0	110.8	V179 M183 A264 G265 E270 L271 L272 L337 T338 L341 F360	V179-L268 HydrophobicContact CG1-CD1 3.85Å; M183-L268 HydrophobicContact CE-CB 4Å; M183-L268 HydrophobicContact CG-CB 4.17Å; M183-L268 HydrophobicContact CG-CD1 4.02Å; M183-L268 HydrophobicContact SD-CB 4.05Å; A264-L268 PolarHBondContact O-N 2.9Å; G265-L268 PolarHBondContact O-N 2.96Å; L268-E270 VanDerWaalsContact C-N 3.35Å; L268-E270 PolarHBondContact O-N 1.86Å; L268-L271 PolarHBondContact O-N 2.95Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 4.09Å; L268-L272 HydrophobicContact CG-CD1 4.11Å; L268-L272 VanDerWaalsContact O-CG 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.49Å; L268-L272 PolarHBondContact O-N 3.45Å; L268-L337 HydrophobicContact CD2-CB 4.22Å; L268-L337 HydrophobicContact CD2-CD2 3.75Å; L268-L337 HydrophobicContact CD2-CG 3.72Å; L268-T338 VanDerWaalsContact CD2-OG1 3.24Å; L268-T338 WeakPolarHBondContact CD2-OG1 3.33Å; L268-T338 WeakPolarHBondContact CG-OG1 3.37Å; L268-L341 HydrophobicContact CD2-CD1 4.01Å; L268-F360 HydrophobicContact CD1-CE1 4.23Å; L268-F360 HydrophobicContact CD1-CZ 4.44Å
269	A	98.6	Very high	98	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.7	-43.1	178	0	0	0	0	0	112.4	G265 C266 V267 L271 L272 L273 I277 F326 T338 L342	G265-A269 WeakPolarHBondContact O-CB 3.14Å; G265-A269 PolarHBondContact O-N 2.99Å; C266-A269 PolarHBondContact O-N 2.68Å; V267-A269 VanDerWaalsContact C-N 3.35Å; V267-A269 PolarHBondContact O-N 3.26Å; A269-L271 PolarHBondContact O-N 2.77Å; A269-L272 PolarHBondContact O-N 2.68Å; A269-L273 WeakPolarHBondContact O-CB 3.49Å; A269-L273 VanDerWaalsContact O-CG 3.27Å; A269-L273 WeakPolarHBondContact O-CG 3.08Å; A269-L273 PolarHBondContact O-N 3Å; A269-I277 HydrophobicContact CB-CB 3.76Å; A269-I277 HydrophobicContact CB-CD1 3.72Å; A269-I277 HydrophobicContact CB-CG1 4.33Å; A269-I277 HydrophobicContact CB-CG2 3.6Å; A269-F326 HydrophobicContact CB-CE1 4.21Å; A269-F326 HydrophobicContact CB-CZ 4.27Å; A269-T338 HydrophobicContact CB-CG2 4Å; A269-L342 HydrophobicContact CB-CD1 4.45Å
270	E	98.1	Very high	97.9	Very high	13 Å²	13	15 Å²	15	6%	0.061	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-41.2	176.4	176.3	168.4	168.9	0	0	112.5	Y243 C266 V267 L268 L272 L273 G274 Q275	Y243-E270 WeakPolarHBondContact CE1-OE2 3.45Å; Y243-E270 PolarHBondContact OH-OE2 3.1Å; Y243-E270 VanDerWaalsContact OH-OE2 3.07Å; C266-E270 WeakPolarHBondContact O-CB 3.39Å; C266-E270 PolarHBondContact O-N 2.94Å; V267-E270 PolarHBondContact O-N 3.09Å; L268-E270 VanDerWaalsContact C-N 3.35Å; L268-E270 PolarHBondContact O-N 1.86Å; E270-L272 VanDerWaalsContact C-N 3.31Å; E270-L272 PolarHBondContact O-N 2.96Å; E270-L273 PolarHBondContact O-N 3.27Å; E270-G274 WeakPolarHBondContact O-CA 3.49Å; E270-G274 PolarHBondContact O-N 3.28Å; E270-Q275 WeakPolarHBondContact CA-O 3.17Å; E270-Q275 PolarHBondContact O-N 2.71Å
271	L	97.9	Very high	97.7	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-33.3	176.5	-68	171.5	0	0	0	112.7	V160 A164 I174 V179 M183 V267 L268 A269	V160-L271 HydrophobicContact CG1-CD1 4.26Å; V160-L271 HydrophobicContact CG1-CD2 3.71Å; V160-L271 HydrophobicContact CG1-CG 4.43Å; A164-L271 HydrophobicContact CB-CD2 4.22Å; I174-L271 HydrophobicContact CD1-CB 4.34Å; I174-L271 HydrophobicContact CD1-CD2 3.37Å; I174-L271 HydrophobicContact CD1-CG 4.47Å; V179-L271 HydrophobicContact CG1-CB 4.04Å; V179-L271 HydrophobicContact CG1-CD1 4.29Å; V179-L271 HydrophobicContact CG2-CB 4.29Å; M183-L271 HydrophobicContact CG-CD1 4.34Å; M183-L271 HydrophobicContact SD-CD1 4.13Å; V267-L271 HydrophobicContact CG1-CD1 4.06Å; V267-L271 HydrophobicContact CG1-CG 4.46Å; V267-L271 VanDerWaalsContact O-CG 3.3Å; V267-L271 WeakPolarHBondContact O-CG 3.29Å; V267-L271 PolarHBondContact O-N 3.41Å; L268-L271 PolarHBondContact O-N 2.95Å; A269-L271 PolarHBondContact O-N 2.77Å
272	L	97.1	Very high	97.5	Very high	7 Å²	7	23.2 Å²	23.2	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-78.4	-36	177.4	-68	176.2	0	0	0	113.2	M176 V179 L268 A269 E270 F326 T330 A334	M176-L272 HydrophobicContact CE-CD2 3.78Å; M176-L272 HydrophobicContact SD-CD2 4.17Å; V179-L272 HydrophobicContact CG1-CD2 4.36Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 4.09Å; L268-L272 HydrophobicContact CG-CD1 4.11Å; L268-L272 VanDerWaalsContact O-CG 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.49Å; L268-L272 PolarHBondContact O-N 3.45Å; A269-L272 PolarHBondContact O-N 2.68Å; E270-L272 VanDerWaalsContact C-N 3.31Å; E270-L272 PolarHBondContact O-N 2.96Å; L272-F326 HydrophobicContact CB-CD1 3.81Å; L272-F326 HydrophobicContact CB-CE1 3.92Å; L272-F326 HydrophobicContact CD1-CD1 4.29Å; L272-F326 HydrophobicContact CD1-CE1 4.07Å; L272-F326 HydrophobicContact CD1-CZ 4.42Å; L272-T330 HydrophobicContact CD1-CG2 4.09Å; L272-T330 HydrophobicContact CD2-CG2 4.01Å; L272-T330 HydrophobicContact CG-CG2 4.46Å; L272-A334 HydrophobicContact CD1-CB 3.92Å; L272-A334 HydrophobicContact CD2-CB 4.19Å
273	L	95.5	Very high	97.1	Very high	28 Å²	28	24.7 Å²	24.7	15%	0.147	14%	0.143	C	C	.	.	H	α-helix	trans	-83.2	-35.8	179.5	-67.7	170.1	0	0	0	112.3	A269 E270 Q275 I277 V325 F326 R327	A269-L273 WeakPolarHBondContact O-CB 3.49Å; A269-L273 VanDerWaalsContact O-CG 3.27Å; A269-L273 WeakPolarHBondContact O-CG 3.08Å; A269-L273 PolarHBondContact O-N 3Å; E270-L273 PolarHBondContact O-N 3.27Å; L273-Q275 HydrophobicContact CB-CG 4.3Å; L273-I277 HydrophobicContact CD1-CB 3.8Å; L273-I277 HydrophobicContact CD1-CD1 4.37Å; L273-I277 HydrophobicContact CD1-CG1 4.05Å; L273-V325 WeakPolarHBondContact CD2-O 3.35Å; L273-F326 HydrophobicContact CD1-CE1 4.28Å; L273-F326 HydrophobicContact CD2-CD1 3.66Å; L273-F326 HydrophobicContact CD2-CE1 4.11Å; L273-F326 HydrophobicContact CG-CD1 3.85Å; L273-F326 HydrophobicContact CG-CE1 3.87Å; L273-R327 PolarHBondContact O-NH2 3.3Å
274	G	94.8	Very high	96.8	Very high	20 Å²	20	29.1 Å²	29.1	21%	0.206	17%	0.17	C	C	.	.	S	Bend	trans	85.7	8.7	-167	0	0	0	0	0	114	N168 E270	N168-G274 PolarHBondContact ND2-O 2.98Å; E270-G274 WeakPolarHBondContact O-CA 3.49Å; E270-G274 PolarHBondContact O-N 3.28Å
275	Q	95.3	Very high	96.6	Very high	124 Å²	124	32.3 Å²	32.3	58%	0.579	19%	0.187	S	C	*	.	S	Bend	trans	-157	155.5	178.1	67.6	-175.5	15.9	0	0	109.8	E270 L273 I277	E270-Q275 WeakPolarHBondContact CA-O 3.17Å; E270-Q275 PolarHBondContact O-N 2.71Å; L273-Q275 HydrophobicContact CB-CG 4.3Å; Q275-I277 PolarHBondContact O-N 2.81Å
276	P	97.8	Very high	96.5	Very high	35 Å²	35	32.3 Å²	32.3	23%	0.227	19%	0.187	C	C	.	.			trans	-54.2	136.2	178	-26.3	34.2	0	0	0	112.7	Y242	Y242-P276 HydrophobicContact CD2-CB 3.77Å; Y242-P276 HydrophobicContact CD2-CG 3.74Å; Y242-P276 HydrophobicContact CE2-CB 4.37Å; Y242-P276 HydrophobicContact CE2-CG 4.09Å; Y242-P276 HydrophobicContact CG-CB 4.34Å
277	I	98.4	Very high	96.3	Very high	17 Å²	17	33.1 Å²	33.1	9%	0.087	19%	0.191	C	C	.	.	S	Bend	trans	-73.1	-30.8	-179.4	-176.8	163.8	0	0	0	113.1	C266 A269 L273 Q275 W322 V325 F326 L342	C266-I277 HydrophobicContact CB-CG2 4.45Å; A269-I277 HydrophobicContact CB-CB 3.76Å; A269-I277 HydrophobicContact CB-CD1 3.72Å; A269-I277 HydrophobicContact CB-CG1 4.33Å; A269-I277 HydrophobicContact CB-CG2 3.6Å; L273-I277 HydrophobicContact CD1-CB 3.8Å; L273-I277 HydrophobicContact CD1-CD1 4.37Å; L273-I277 HydrophobicContact CD1-CG1 4.05Å; Q275-I277 PolarHBondContact O-N 2.81Å; I277-W322 HydrophobicContact CD1-CH2 4.42Å; I277-W322 HydrophobicContact CD1-CZ3 3.94Å; I277-V325 HydrophobicContact CD1-CG1 4.09Å; I277-F326 HydrophobicContact CD1-CZ 4.49Å; I277-L342 HydrophobicContact CD1-CD1 4.37Å
278	F	98.4	Very high	96.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.207	C	C	.	.			trans	-126.8	78.7	-178.4	-52.7	-50.9	0	0	0	111.1	Y242 W262 G280 Q286 E289 I290 I293 L342	Y242-F278 WeakPolarHBondContact CD1-O 3.45Å; W262-F278 HydrophobicContact CH2-CE2 4.07Å; W262-F278 HydrophobicContact CH2-CZ 4.45Å; W262-F278 HydrophobicContact CZ2-CD2 4.05Å; W262-F278 AromaticContact CZ2-CE2 3.53Å; W262-F278 HydrophobicContact CZ2-CE2 3.53Å; W262-F278 HydrophobicContact CZ2-CZ 4.31Å; F278-G280 PolarHBondContact O-N 3.02Å; F278-Q286 PolarHBondContact O-NE2 3.27Å; F278-Q286 PolarHBondContact O-OE1 3.01Å; F278-E289 HydrophobicContact CB-CB 4.13Å; F278-E289 HydrophobicContact CD1-CB 4.35Å; F278-I290 HydrophobicContact CB-CG1 4.25Å; F278-I290 HydrophobicContact CD1-CB 4.45Å; F278-I290 HydrophobicContact CD1-CG1 3.9Å; F278-I290 HydrophobicContact CD2-CG1 3.79Å; F278-I290 HydrophobicContact CE1-CB 4.42Å; F278-I290 HydrophobicContact CE1-CG1 4.14Å; F278-I290 HydrophobicContact CE2-CG1 4.05Å; F278-I290 HydrophobicContact CG-CG1 3.72Å; F278-I290 HydrophobicContact CZ-CG1 4.22Å; F278-I293 HydrophobicContact CD1-CG1 4.44Å; F278-I293 HydrophobicContact CE1-CB 3.98Å; F278-I293 HydrophobicContact CE1-CG1 3.82Å; F278-L342 HydrophobicContact CE2-CD1 3.99Å; F278-L342 HydrophobicContact CE2-CD2 4.28Å; F278-L342 HydrophobicContact CZ-CD1 4.15Å
279	P	97.6	Very high	96.1	Very high	58 Å²	58	37.7 Å²	37.7	38%	0.377	22%	0.217	S	C	.	.			trans	-87.7	74	-177	35.4	-35.6	0	0	0	112.6	Y242	Y242-P279 HydrophobicContact CE1-CB 4.3Å
280	G	96.7	Very high	96	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.			trans	-85	130.8	179.4	0	0	0	0	0	114.5	R241 Y242 F278 Q286	R241-G280 WeakPolarHBondContact CD-O 3.45Å; Y242-G280 WeakPolarHBondContact CE1-O 3.47Å; F278-G280 PolarHBondContact O-N 3.02Å; G280-Q286 VanDerWaalsContact N-OE1 3.14Å
281	E	95.1	Very high	96	Very high	135 Å²	135	37.3 Å²	37.3	63%	0.631	22%	0.215	S	C	*	.	S	Bend	trans	-78.7	-23.8	177.7	-65.9	-63	171.9	0	0	113.9	R241	R241-E281 PolarHBondContact NH1-O 3.07Å
282	S	94.6	Very high	95.9	Very high	40 Å²	40	41.8 Å²	41.8	28%	0.28	23%	0.234	S	C	.	.	S	Bend	trans	-129.1	177.1	168.8	76.8	0	0	0	0	111.4	V284 D285 Q286	S282-V284 VanDerWaalsContact C-N 3.25Å; S282-V284 PolarHBondContact O-N 2.76Å; S282-V284 PolarHBondContact OG-N 2.95Å; S282-D285 WeakPolarHBondContact CB-OD2 3.46Å; S282-D285 PolarHBondContact N-OD2 3.4Å; S282-D285 PolarHBondContact O-N 3.04Å; S282-D285 VanDerWaalsContact OG-CG 3.32Å; S282-D285 PolarHBondContact OG-N 3Å; S282-D285 VanDerWaalsContact OG-N 3.17Å; S282-D285 PolarHBondContact OG-OD2 3.3Å; S282-Q286 WeakPolarHBondContact O-CB 3.1Å; S282-Q286 PolarHBondContact O-N 3.41Å
283	G	90.6	Very high	96	Very high	31 Å²	31	42.7 Å²	42.7	32%	0.32	24%	0.239	S	C	.	.	H	α-helix	trans	-61.5	-32.6	171.3	0	0	0	0	0	113.3	I249 L287	I249-G283 WeakPolarHBondContact CG2-O 3.23Å; G283-L287 PolarHBondContact O-N 3.22Å
284	V	91.5	Very high	96.1	Very high	94 Å²	94	42.7 Å²	42.7	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-74.1	-44.7	177.2	178.3	0	0	0	0	110.4	S282 Q286 L287 V288	S282-V284 VanDerWaalsContact C-N 3.25Å; S282-V284 PolarHBondContact O-N 2.76Å; S282-V284 PolarHBondContact OG-N 2.95Å; V284-Q286 VanDerWaalsContact C-N 3.27Å; V284-Q286 PolarHBondContact O-N 2.98Å; V284-L287 WeakPolarHBondContact O-CB 3.43Å; V284-L287 PolarHBondContact O-N 3.1Å; V284-L287 VanDerWaalsContact O-N 3.12Å; V284-V288 WeakPolarHBondContact O-CG2 3.4Å; V284-V288 PolarHBondContact O-N 2.83Å
285	D	94.8	Very high	96.2	Very high	67 Å²	67	41.9 Å²	41.9	36%	0.358	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-36.1	177.4	-54.9	-59.4	0	0	0	111.3	S282 L287 V288 E289	S282-D285 WeakPolarHBondContact CB-OD2 3.46Å; S282-D285 PolarHBondContact N-OD2 3.4Å; S282-D285 PolarHBondContact O-N 3.04Å; S282-D285 VanDerWaalsContact OG-CG 3.32Å; S282-D285 PolarHBondContact OG-N 3Å; S282-D285 VanDerWaalsContact OG-N 3.17Å; S282-D285 PolarHBondContact OG-OD2 3.3Å; D285-L287 VanDerWaalsContact C-N 3.29Å; D285-L287 PolarHBondContact O-N 3.23Å; D285-V288 CarbonylContact O-C 3.55Å; D285-V288 WeakPolarHBondContact O-CA 3.42Å; D285-V288 WeakPolarHBondContact O-CB 3.43Å; D285-V288 PolarHBondContact O-N 3.35Å; D285-E289 WeakPolarHBondContact O-CG 3.31Å; D285-E289 PolarHBondContact O-N 3.42Å
286	Q	97.1	Very high	96.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-41.5	173.9	-170.2	66.1	40.6	0	0	111.9	R241 I249 F278 G280 S282 V284 I290	R241-Q286 HydrophobicContact CG-CB 4.45Å; R241-Q286 HydrophobicContact CG-CG 4.39Å; R241-Q286 PolarHBondContact O-NE2 3.13Å; R241-Q286 PolarHBondContact O-OE1 3.14Å; I249-Q286 HydrophobicContact CD1-CB 4.03Å; I249-Q286 HydrophobicContact CD1-CG 3.59Å; F278-Q286 PolarHBondContact O-NE2 3.27Å; F278-Q286 PolarHBondContact O-OE1 3.01Å; G280-Q286 VanDerWaalsContact N-OE1 3.14Å; S282-Q286 WeakPolarHBondContact O-CB 3.1Å; S282-Q286 PolarHBondContact O-N 3.41Å; V284-Q286 VanDerWaalsContact C-N 3.27Å; V284-Q286 PolarHBondContact O-N 2.98Å; Q286-I290 WeakPolarHBondContact O-CD1 3.4Å; Q286-I290 VanDerWaalsContact O-CG1 3.25Å; Q286-I290 WeakPolarHBondContact O-CG1 3.26Å; Q286-I290 PolarHBondContact O-N 3.42Å
287	L	95.1	Very high	96.2	Very high	19 Å²	19	35.9 Å²	35.9	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-36.1	174	-178.5	60.4	0	0	0	111.9	I249 F250 G283 V284 D285 I290 I291 L314	I249-L287 HydrophobicContact CG2-CB 4.18Å; F250-L287 HydrophobicContact CE1-CD2 4.01Å; F250-L287 HydrophobicContact CE2-CD1 3.86Å; F250-L287 HydrophobicContact CE2-CD2 4.39Å; F250-L287 HydrophobicContact CZ-CD1 3.88Å; F250-L287 HydrophobicContact CZ-CD2 3.75Å; F250-L287 HydrophobicContact CZ-CG 4.48Å; G283-L287 PolarHBondContact O-N 3.22Å; V284-L287 WeakPolarHBondContact O-CB 3.43Å; V284-L287 PolarHBondContact O-N 3.1Å; V284-L287 VanDerWaalsContact O-N 3.12Å; D285-L287 VanDerWaalsContact C-N 3.29Å; D285-L287 PolarHBondContact O-N 3.23Å; L287-I290 PolarHBondContact O-N 2.89Å; L287-I291 HydrophobicContact CD1-CD1 4.13Å; L287-I291 HydrophobicContact CD1-CG1 4.33Å; L287-I291 HydrophobicContact CD2-CD1 4.5Å; L287-I291 HydrophobicContact CG-CD1 3.85Å; L287-I291 HydrophobicContact CG-CG1 4.47Å; L287-I291 WeakPolarHBondContact O-CB 3.38Å; L287-I291 VanDerWaalsContact O-CG1 3.29Å; L287-I291 WeakPolarHBondContact O-CG1 3.44Å; L287-I291 PolarHBondContact O-N 3.02Å; L287-L314 HydrophobicContact CD2-CD2 4.19Å
288	V	95	Very high	96	Very high	57 Å²	57	37.6 Å²	37.6	35%	0.345	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-43.1	175.8	170.5	0	0	0	0	111.7	V284 D285 I290 I291 K292	V284-V288 WeakPolarHBondContact O-CG2 3.4Å; V284-V288 PolarHBondContact O-N 2.83Å; D285-V288 CarbonylContact O-C 3.55Å; D285-V288 WeakPolarHBondContact O-CA 3.42Å; D285-V288 WeakPolarHBondContact O-CB 3.43Å; D285-V288 PolarHBondContact O-N 3.35Å; V288-I290 VanDerWaalsContact C-N 3.31Å; V288-I290 PolarHBondContact O-N 2.85Å; V288-I291 PolarHBondContact O-N 3.22Å; V288-K292 WeakPolarHBondContact O-CG 3.33Å; V288-K292 PolarHBondContact O-N 2.8Å
289	E	97.5	Very high	95.7	Very high	41 Å²	41	44 Å²	44	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-37.1	174.8	-61.8	-42.3	122.7	0	0	112.3	F278 D285 K292	F278-E289 HydrophobicContact CB-CB 4.13Å; F278-E289 HydrophobicContact CD1-CB 4.35Å; D285-E289 WeakPolarHBondContact O-CG 3.31Å; D285-E289 PolarHBondContact O-N 3.42Å; E289-K292 PolarHBondContact O-N 3.25Å; E289-K292 IonicContact OE1-NZ 3.22Å; E289-K292 PolarHBondContact OE1-NZ 2.91Å; E289-K292 WeakPolarHBondContact OE2-CD 3.47Å; E289-K292 IonicContact OE2-NZ 2.79Å; E289-K292 PolarHBondContact OE2-NZ 3.43Å
290	I	98.1	Very high	95.5	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-47.7	174.3	-66.7	165.2	0	0	0	110.7	P246 I249 W262 F278 Q286 L287 V288 K292 I293 L294 Y344	P246-I290 HydrophobicContact CB-CD1 4.46Å; I249-I290 HydrophobicContact CD1-CD1 3.87Å; W262-I290 HydrophobicContact CH2-CD1 4.28Å; W262-I290 HydrophobicContact CH2-CG1 4.33Å; W262-I290 HydrophobicContact CH2-CG2 3.78Å; W262-I290 HydrophobicContact CZ2-CD1 3.67Å; W262-I290 HydrophobicContact CZ2-CG1 3.9Å; W262-I290 HydrophobicContact CZ2-CG2 4.21Å; F278-I290 HydrophobicContact CB-CG1 4.25Å; F278-I290 HydrophobicContact CD1-CB 4.45Å; F278-I290 HydrophobicContact CD1-CG1 3.9Å; F278-I290 HydrophobicContact CD2-CG1 3.79Å; F278-I290 HydrophobicContact CE1-CB 4.42Å; F278-I290 HydrophobicContact CE1-CG1 4.14Å; F278-I290 HydrophobicContact CE2-CG1 4.05Å; F278-I290 HydrophobicContact CG-CG1 3.72Å; F278-I290 HydrophobicContact CZ-CG1 4.22Å; Q286-I290 WeakPolarHBondContact O-CD1 3.4Å; Q286-I290 VanDerWaalsContact O-CG1 3.25Å; Q286-I290 WeakPolarHBondContact O-CG1 3.26Å; Q286-I290 PolarHBondContact O-N 3.42Å; L287-I290 PolarHBondContact O-N 2.89Å; V288-I290 VanDerWaalsContact C-N 3.31Å; V288-I290 PolarHBondContact O-N 2.85Å; I290-K292 VanDerWaalsContact C-N 3.31Å; I290-K292 PolarHBondContact O-N 3.49Å; I290-I293 PolarHBondContact O-N 2.99Å; I290-I293 VanDerWaalsContact O-N 3.1Å; I290-L294 HydrophobicContact CG2-CD1 3.74Å; I290-L294 HydrophobicContact CG2-CG 4.14Å; I290-L294 PolarHBondContact O-N 2.92Å; I290-Y344 HydrophobicContact CG2-CE1 3.62Å
291	I	97.1	Very high	95.5	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-32.9	179.7	-70.9	168.8	0	0	0	112.2	L287 V288 I293 G295 L314 I317 Y344	L287-I291 HydrophobicContact CD1-CD1 4.13Å; L287-I291 HydrophobicContact CD1-CG1 4.33Å; L287-I291 HydrophobicContact CD2-CD1 4.5Å; L287-I291 HydrophobicContact CG-CD1 3.85Å; L287-I291 HydrophobicContact CG-CG1 4.47Å; L287-I291 WeakPolarHBondContact O-CB 3.38Å; L287-I291 VanDerWaalsContact O-CG1 3.29Å; L287-I291 WeakPolarHBondContact O-CG1 3.44Å; L287-I291 PolarHBondContact O-N 3.02Å; V288-I291 PolarHBondContact O-N 3.22Å; I291-I293 PolarHBondContact O-N 3.03Å; I291-G295 CarbonylContact O-C 3.54Å; I291-G295 WeakPolarHBondContact O-CA 3.36Å; I291-G295 PolarHBondContact O-N 3.38Å; I291-L314 HydrophobicContact CD1-CD1 4.11Å; I291-L314 HydrophobicContact CD1-CD2 4.12Å; I291-I317 HydrophobicContact CG2-CB 3.9Å; I291-I317 HydrophobicContact CG2-CD1 3.8Å; I291-I317 HydrophobicContact CG2-CG1 4.32Å; I291-I317 HydrophobicContact CG2-CG2 4.28Å; I291-Y344 WeakPolarHBondContact CG1-OH 3.4Å
292	K	96.5	Very high	95.4	Very high	100 Å²	100	43.9 Å²	43.9	44%	0.435	23%	0.234	S	C	.	.	H	α-helix	trans	-59.8	-28.2	174.3	-75.7	172.4	-172	168.6	0	113.4	V288 E289 I290	V288-K292 WeakPolarHBondContact O-CG 3.33Å; V288-K292 PolarHBondContact O-N 2.8Å; E289-K292 PolarHBondContact O-N 3.25Å; E289-K292 IonicContact OE1-NZ 3.22Å; E289-K292 PolarHBondContact OE1-NZ 2.91Å; E289-K292 WeakPolarHBondContact OE2-CD 3.47Å; E289-K292 IonicContact OE2-NZ 2.79Å; E289-K292 PolarHBondContact OE2-NZ 3.43Å; I290-K292 VanDerWaalsContact C-N 3.31Å; I290-K292 PolarHBondContact O-N 3.49Å
293	I	97.7	Very high	95.4	Very high	27 Å²	27	45.4 Å²	45.4	14%	0.138	24%	0.239	C	C	.	.	H	α-helix	trans	-99	-55.6	-179.9	-55.2	-57.5	0	0	0	111	F278 I290 I291 G295 H320 W322 V325	F278-I293 HydrophobicContact CD1-CG1 4.44Å; F278-I293 HydrophobicContact CE1-CB 3.98Å; F278-I293 HydrophobicContact CE1-CG1 3.82Å; I290-I293 PolarHBondContact O-N 2.99Å; I290-I293 VanDerWaalsContact O-N 3.1Å; I291-I293 PolarHBondContact O-N 3.03Å; I293-G295 VanDerWaalsContact C-N 3.29Å; I293-G295 PolarHBondContact O-N 3.38Å; I293-H320 PolarHBondContact O-N 3.32Å; I293-W322 HydrophobicContact CG2-CE3 4.28Å; I293-W322 HydrophobicContact CG2-CH2 4.01Å; I293-W322 HydrophobicContact CG2-CZ2 4.48Å; I293-W322 HydrophobicContact CG2-CZ3 3.9Å; I293-V325 HydrophobicContact CD1-CG1 4.24Å; I293-V325 HydrophobicContact CD1-CG2 4.24Å; I293-V325 HydrophobicContact CG2-CG1 4.47Å; I293-V325 HydrophobicContact CG2-CG2 3.92Å
294	L	98.2	Very high	95.7	Very high	28 Å²	28	47.4 Å²	47.4	15%	0.147	24%	0.239	C	C	.	.	H	α-helix	trans	-79.3	-10.6	-174.8	-56.5	-171.1	0	0	0	113.7	W262 I290 A319 W322 L342 Y344	W262-L294 HydrophobicContact CH2-CD1 3.72Å; W262-L294 HydrophobicContact CZ3-CD1 3.94Å; I290-L294 HydrophobicContact CG2-CD1 3.74Å; I290-L294 HydrophobicContact CG2-CG 4.14Å; I290-L294 PolarHBondContact O-N 2.92Å; L294-A319 WeakPolarHBondContact O-CB 3.36Å; L294-W322 HydrophobicContact CD2-CH2 3.95Å; L294-W322 HydrophobicContact CD2-CZ2 3.36Å; L294-L342 VanDerWaalsContact CD1-O 3.27Å; L294-L342 WeakPolarHBondContact CD1-O 3.09Å; L294-L342 WeakPolarHBondContact CD2-O 3.39Å; L294-Y344 HydrophobicContact CB-CD2 4.2Å; L294-Y344 HydrophobicContact CB-CE2 3.44Å; L294-Y344 VanDerWaalsContact CB-CE2 3.44Å; L294-Y344 HydrophobicContact CD1-CD1 4.21Å; L294-Y344 HydrophobicContact CD1-CD2 4.06Å; L294-Y344 HydrophobicContact CD1-CE1 4.05Å; L294-Y344 HydrophobicContact CD1-CE2 3.91Å; L294-Y344 HydrophobicContact CD1-CG 4.21Å; L294-Y344 HydrophobicContact CG-CE2 4.33Å
295	G	97.7	Very high	95.9	Very high	2 Å²	2	43.2 Å²	43.2	2%	0.021	21%	0.213	C	C	.	.			trans	74.5	179.6	-166.5	0	0	0	0	0	111.6	I291 I293 I317 Y344	I291-G295 CarbonylContact O-C 3.54Å; I291-G295 WeakPolarHBondContact O-CA 3.36Å; I291-G295 PolarHBondContact O-N 3.38Å; I293-G295 VanDerWaalsContact C-N 3.29Å; I293-G295 PolarHBondContact O-N 3.38Å; G295-I317 CarbonylContact C-O 3.42Å; G295-I317 WeakPolarHBondContact CA-O 3.38Å; G295-Y344 WeakPolarHBondContact O-CE2 3.4Å; G295-Y344 PolarHBondContact O-OH 3.18Å
296	T	96.3	Very high	96	Very high	25 Å²	25	40.9 Å²	40.9	15%	0.153	20%	0.201	C	C	.	.	S	Bend	trans	-71.3	130.6	179.2	-44.6	0	0	0	0	110.6	L314 P315 Q316 I317	T296-L314 HydrophobicContact CG2-CB 3.62Å; T296-L314 HydrophobicContact CG2-CD1 4.16Å; T296-P315 WeakPolarHBondContact CG2-O 2.99Å; T296-P315 PolarHBondContact OG1-O 3.42Å; T296-Q316 WeakPolarHBondContact OG1-CA 3.23Å; T296-I317 PolarHBondContact N-O 2.92Å; T296-I317 PolarHBondContact OG1-N 2.86Å; T296-I317 PolarHBondContact OG1-O 3.19Å
297	P	95.9	Very high	95.6	Very high	8 Å²	8	44.2 Å²	44.2	5%	0.052	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-65.1	140.3	179.4	26.8	-33.6	0	0	0	111	F250 Q301 I302 M305 L314 Y344	F250-P297 HydrophobicContact CZ-CG 4.42Å; P297-Q301 HydrophobicContact CB-CB 4.07Å; P297-I302 HydrophobicContact CB-CG1 4.03Å; P297-I302 HydrophobicContact CG-CD1 4.23Å; P297-I302 HydrophobicContact CG-CG1 3.9Å; P297-M305 HydrophobicContact CB-CE 3.88Å; P297-M305 HydrophobicContact CG-CE 4.23Å; P297-L314 HydrophobicContact CG-CD1 3.85Å; P297-Y344 HydrophobicContact CB-CD1 4.1Å; P297-Y344 HydrophobicContact CB-CD2 3.79Å; P297-Y344 HydrophobicContact CB-CE1 4.08Å; P297-Y344 HydrophobicContact CB-CE2 3.76Å; P297-Y344 HydrophobicContact CB-CG 3.96Å; P297-Y344 HydrophobicContact CG-CE1 4.21Å; P297-Y344 HydrophobicContact CG-CE2 4.39Å
298	S	94	Very high	95.3	Very high	54 Å²	54	49.3 Å²	49.3	38%	0.378	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-66.4	162	173.7	82.7	0	0	0	0	111.3	E300 Q301 I302	S298-E300 PolarHBondContact O-N 2.92Å; S298-E300 PolarHBondContact OG-N 3.27Å; S298-Q301 PolarHBondContact O-N 3.09Å; S298-Q301 VanDerWaalsContact O-N 3.08Å; S298-Q301 PolarHBondContact OG-N 2.86Å; S298-Q301 VanDerWaalsContact OG-N 3.11Å; S298-I302 WeakPolarHBondContact O-CG1 3.03Å; S298-I302 PolarHBondContact O-N 3.42Å
299	R	91.7	Very high	94.7	Very high	133 Å²	133	48.6 Å²	48.6	50%	0.502	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-31.2	175.2	-174.1	54.2	170.8	161.4	-1.9	112.2	N303 F309	R299-N303 VanDerWaalsContact CZ-OD1 3.28Å; R299-N303 PolarHBondContact NE-OD1 3.29Å; R299-N303 PolarHBondContact NH1-OD1 2.8Å; R299-N303 WeakPolarHBondContact O-CB 3.37Å; R299-N303 PolarHBondContact O-N 2.99Å; R299-N303 PolarHBondContact O-OD1 2.91Å; R299-N303 VanDerWaalsContact O-OD1 3.12Å; R299-F309 PolarHBondContact NH1-O 2.89Å; R299-F309 PolarHBondContact NH2-O 2.84Å
300	E	94.3	Very high	93.5	Very high	123 Å²	123	52 Å²	52	58%	0.575	27%	0.272	S	S	*	.	H	α-helix	trans	-66	-47.1	172.2	-168.1	-162.1	144.3	0	0	111.4	S298 I302 N303 K304	S298-E300 PolarHBondContact O-N 2.92Å; S298-E300 PolarHBondContact OG-N 3.27Å; E300-I302 VanDerWaalsContact C-N 3.33Å; E300-I302 PolarHBondContact O-N 3.44Å; E300-N303 PolarHBondContact O-N 2.85Å; E300-K304 HydrophobicContact CG-CD 4.34Å; E300-K304 WeakPolarHBondContact O-CB 3.49Å; E300-K304 WeakPolarHBondContact O-CG 3.37Å; E300-K304 PolarHBondContact O-N 2.96Å; E300-K304 WeakPolarHBondContact OE1-CE 3.26Å; E300-K304 IonicContact OE1-NZ 3.1Å; E300-K304 PolarHBondContact OE1-NZ 3.04Å
301	Q	96.2	Very high	92.1	Very high	48 Å²	48	59.3 Å²	59.3	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-41.3	177.1	-74.5	170	-38.3	0	0	111.5	P297 S298 K304 M305	P297-Q301 HydrophobicContact CB-CB 4.07Å; S298-Q301 PolarHBondContact O-N 3.09Å; S298-Q301 VanDerWaalsContact O-N 3.08Å; S298-Q301 PolarHBondContact OG-N 2.86Å; S298-Q301 VanDerWaalsContact OG-N 3.11Å; Q301-K304 PolarHBondContact O-N 2.9Å; Q301-M305 WeakPolarHBondContact O-CE 3.5Å; Q301-M305 WeakPolarHBondContact O-CG 3.38Å; Q301-M305 PolarHBondContact O-N 2.85Å
302	I	94.6	Very high	90.7	Very high	21 Å²	21	65.7 Å²	65.7	11%	0.108	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-48.7	173.6	-65.5	168.7	0	0	0	110.6	P297 S298 E300 K304 M305 N306 F309 L314	P297-I302 HydrophobicContact CB-CG1 4.03Å; P297-I302 HydrophobicContact CG-CD1 4.23Å; P297-I302 HydrophobicContact CG-CG1 3.9Å; S298-I302 WeakPolarHBondContact O-CG1 3.03Å; S298-I302 PolarHBondContact O-N 3.42Å; E300-I302 VanDerWaalsContact C-N 3.33Å; E300-I302 PolarHBondContact O-N 3.44Å; I302-K304 VanDerWaalsContact C-N 3.26Å; I302-K304 PolarHBondContact O-N 2.93Å; I302-M305 HydrophobicContact CG1-CE 4.28Å; I302-M305 PolarHBondContact O-N 3.21Å; I302-N306 PolarHBondContact O-N 2.96Å; I302-F309 HydrophobicContact CG2-CB 4.33Å; I302-F309 HydrophobicContact CG2-CD1 3.88Å; I302-L314 HydrophobicContact CD1-CD1 4.42Å
303	N	94.2	Very high	89.6	Confident	71 Å²	71	67.8 Å²	67.8	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-32.9	178.9	-68	-0.2	0	0	0	112.6	R299 E300 A307	R299-N303 VanDerWaalsContact CZ-OD1 3.28Å; R299-N303 PolarHBondContact NE-OD1 3.29Å; R299-N303 PolarHBondContact NH1-OD1 2.8Å; R299-N303 WeakPolarHBondContact O-CB 3.37Å; R299-N303 PolarHBondContact O-N 2.99Å; R299-N303 PolarHBondContact O-OD1 2.91Å; R299-N303 VanDerWaalsContact O-OD1 3.12Å; E300-N303 PolarHBondContact O-N 2.85Å; N303-A307 WeakPolarHBondContact O-CA 3.29Å; N303-A307 PolarHBondContact O-N 2.9Å
304	K	96.5	Very high	88.9	Confident	73 Å²	73	67.5 Å²	67.5	32%	0.317	35%	0.353	S	S	.	.	H	α-helix	trans	-74.9	-23.4	174.5	-74.7	178.4	164.4	-161.1	0	113.8	E300 Q301 I302 A345 P346 D347	E300-K304 HydrophobicContact CG-CD 4.34Å; E300-K304 WeakPolarHBondContact O-CB 3.49Å; E300-K304 WeakPolarHBondContact O-CG 3.37Å; E300-K304 PolarHBondContact O-N 2.96Å; E300-K304 WeakPolarHBondContact OE1-CE 3.26Å; E300-K304 IonicContact OE1-NZ 3.1Å; E300-K304 PolarHBondContact OE1-NZ 3.04Å; Q301-K304 PolarHBondContact O-N 2.9Å; I302-K304 VanDerWaalsContact C-N 3.26Å; I302-K304 PolarHBondContact O-N 2.93Å; K304-A345 HydrophobicContact CB-CB 4.44Å; K304-A345 HydrophobicContact CD-CB 3.83Å; K304-P346 WeakPolarHBondContact O-CD 3.27Å; K304-D347 WeakPolarHBondContact CD-OD1 3.38Å; K304-D347 IonicContact NZ-OD1 3.6Å; K304-D347 IonicContact NZ-OD2 2.67Å; K304-D347 PolarHBondContact NZ-OD2 2.61Å
305	M	96.4	Very high	88.1	Confident	7 Å²	7	70 Å²	70	3%	0.034	37%	0.371	C	S	.	.	H	α-helix	trans	-84.9	-47	174.4	-74.2	-176.7	-67.4	0	0	112	P246 E247 F250 A252 P297 Q301 I302 Y344 P346	P246-M305 HydrophobicContact CB-SD 3.6Å; P246-M305 HydrophobicContact CG-SD 3.57Å; P246-M305 VanDerWaalsContact CG-SD 3.57Å; E247-M305 HydrophobicContact CB-CB 3.9Å; E247-M305 HydrophobicContact CB-CG 4.23Å; E247-M305 VanDerWaalsContact CB-O 3.31Å; E247-M305 WeakPolarHBondContact CB-O 3.37Å; F250-M305 HydrophobicContact CD2-CB 4.23Å; F250-M305 HydrophobicContact CD2-CE 3.81Å; F250-M305 HydrophobicContact CD2-SD 3.83Å; F250-M305 HydrophobicContact CE2-CE 3.38Å; F250-M305 HydrophobicContact CE2-SD 3.82Å; F250-M305 HydrophobicContact CZ-CE 4.2Å; A252-M305 WeakPolarHBondContact CB-O 3.21Å; P297-M305 HydrophobicContact CB-CE 3.88Å; P297-M305 HydrophobicContact CG-CE 4.23Å; Q301-M305 WeakPolarHBondContact O-CE 3.5Å; Q301-M305 WeakPolarHBondContact O-CG 3.38Å; Q301-M305 PolarHBondContact O-N 2.85Å; I302-M305 HydrophobicContact CG1-CE 4.28Å; I302-M305 PolarHBondContact O-N 3.21Å; M305-Y344 HydrophobicContact CE-CD1 3.83Å; M305-Y344 HydrophobicContact CE-CG 4.25Å; M305-Y344 WeakPolarHBondContact CG-O 3.42Å; M305-Y344 HydrophobicContact SD-CD1 3.71Å; M305-Y344 HydrophobicContact SD-CG 4.32Å; M305-P346 HydrophobicContact CG-CG 4.5Å
306	N	95.2	Very high	87.8	Confident	17 Å²	17	77.9 Å²	77.9	9%	0.091	41%	0.407	C	S	.	.			trans	-153.6	106.8	171.3	-178.6	-0.8	0	0	0	109.8	F250 A252 I302 N308 F309	F250-N306 HydrophobicContact CB-CB 4.19Å; F250-N306 PolarHBondContact O-ND2 2.91Å; A252-N306 HydrophobicContact CB-CB 4.14Å; I302-N306 PolarHBondContact O-N 2.96Å; N306-N308 PolarHBondContact O-N 2.86Å; N306-N308 WeakPolarHBondContact OD1-CB 3.49Å; N306-N308 PolarHBondContact OD1-N 2.91Å; N306-N308 PolarHBondContact OD1-ND2 3.45Å; N306-F309 HydrophobicContact CB-CB 4.07Å; N306-F309 VanDerWaalsContact O-CB 3.29Å; N306-F309 WeakPolarHBondContact O-CB 3.42Å; N306-F309 PolarHBondContact O-N 3.09Å; N306-F309 VanDerWaalsContact O-N 3.07Å
307	A	90.5	Very high	87.7	Confident	70 Å²	70	80 Å²	80	58%	0.579	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.3	179.9	0	0	0	0	0	113.7	N303 F309	N303-A307 WeakPolarHBondContact O-CA 3.29Å; N303-A307 PolarHBondContact O-N 2.9Å; A307-F309 VanDerWaalsContact C-N 3.3Å
308	N	87	Confident	87.7	Confident	126 Å²	126	89 Å²	89	67%	0.674	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.8	178	-54.3	-68.2	0	0	0	113	N306 T310	N306-N308 PolarHBondContact O-N 2.86Å; N306-N308 WeakPolarHBondContact OD1-CB 3.49Å; N306-N308 PolarHBondContact OD1-N 2.91Å; N306-N308 PolarHBondContact OD1-ND2 3.45Å; N308-T310 PolarHBondContact O-N 3.31Å; N308-T310 VanDerWaalsContact O-N 3.14Å
309	F	82.5	Confident	87.8	Confident	42 Å²	42	89.4 Å²	89.4	18%	0.184	46%	0.462	C	S	.	.			trans	-80.2	98.3	-176.6	-164.1	-98.6	0	0	0	111.3	F250 R299 I302 N306 A307 E311 F312	F250-F309 HydrophobicContact CB-CD2 4.38Å; F250-F309 AromaticContact CD1-CD1 3.76Å; F250-F309 HydrophobicContact CD1-CD1 3.76Å; F250-F309 AromaticContact CD1-CD2 3.89Å; F250-F309 HydrophobicContact CD1-CD2 3.89Å; F250-F309 AromaticContact CD1-CE1 3.56Å; F250-F309 HydrophobicContact CD1-CE1 3.56Å; F250-F309 AromaticContact CD1-CE2 3.73Å; F250-F309 HydrophobicContact CD1-CE2 3.73Å; F250-F309 AromaticContact CD1-CG 3.91Å; F250-F309 HydrophobicContact CD1-CG 3.91Å; F250-F309 AromaticContact CD1-CZ 3.55Å; F250-F309 HydrophobicContact CD1-CZ 3.55Å; F250-F309 HydrophobicContact CE1-CD1 4.04Å; F250-F309 AromaticContact CE1-CE1 3.58Å; F250-F309 HydrophobicContact CE1-CE1 3.58Å; F250-F309 HydrophobicContact CE1-CE2 4.45Å; F250-F309 AromaticContact CE1-CZ 3.82Å; F250-F309 HydrophobicContact CE1-CZ 3.82Å; R299-F309 PolarHBondContact NH1-O 2.89Å; R299-F309 PolarHBondContact NH2-O 2.84Å; I302-F309 HydrophobicContact CG2-CB 4.33Å; I302-F309 HydrophobicContact CG2-CD1 3.88Å; N306-F309 HydrophobicContact CB-CB 4.07Å; N306-F309 VanDerWaalsContact O-CB 3.29Å; N306-F309 WeakPolarHBondContact O-CB 3.42Å; N306-F309 PolarHBondContact O-N 3.09Å; N306-F309 VanDerWaalsContact O-N 3.07Å; A307-F309 VanDerWaalsContact C-N 3.3Å; F309-E311 WeakPolarHBondContact CE1-O 3.48Å; F309-E311 WeakPolarHBondContact CZ-O 3.25Å; F309-F312 HydrophobicContact CE1-CB 4Å; F309-F312 HydrophobicContact CZ-CB 4.15Å; F309-F312 HydrophobicContact CZ-CD2 4.01Å
310	T	72.1	Confident	88.1	Confident	114 Å²	114	86.9 Å²	86.9	70%	0.699	46%	0.456	S	S	*	.			trans	-89.8	-24.5	-173.6	46.2	0	0	0	0	114.7	N308	N308-T310 PolarHBondContact O-N 3.31Å; N308-T310 VanDerWaalsContact O-N 3.14Å
311	E	69.5	Low	88.2	Confident	152 Å²	152	84.4 Å²	84.4	71%	0.71	45%	0.45	S	S	*	.			trans	-130.6	115.8	-166.6	-66	-179.9	-177.1	0	0	112.5	F309	F309-E311 WeakPolarHBondContact CE1-O 3.48Å; F309-E311 WeakPolarHBondContact CZ-O 3.25Å
312	F	67.2	Low	88.2	Confident	139 Å²	139	84.7 Å²	84.7	61%	0.61	45%	0.449	S	S	*	.			trans	-174.9	139.4	139.1	-122.1	-87.8	0	0	0	110	F309 L314	F309-F312 HydrophobicContact CE1-CB 4Å; F309-F312 HydrophobicContact CZ-CB 4.15Å; F309-F312 HydrophobicContact CZ-CD2 4.01Å; F312-L314 HydrophobicContact CB-CD2 4.34Å; F312-L314 HydrophobicContact CB-CG 4.41Å; F312-L314 HydrophobicContact CD1-CD2 4.23Å; F312-L314 PolarHBondContact O-N 2.83Å
313	V	74.9	Confident	88.2	Confident	144 Å²	144	88.1 Å²	88.1	87%	0.873	48%	0.475	S	S	*	.			trans	-89.4	90.1	165.2	-178	0	0	0	0	108
314	L	81.6	Confident	88.3	Confident	21 Å²	21	92 Å²	92	11%	0.11	49%	0.489	C	S	.	.			trans	-73.4	136.9	173.2	-63	177.4	0	0	0	110.2	F250 L287 I291 T296 P297 I302 F312 Q316	F250-L314 HydrophobicContact CZ-CD1 4.33Å; L287-L314 HydrophobicContact CD2-CD2 4.19Å; I291-L314 HydrophobicContact CD1-CD1 4.11Å; I291-L314 HydrophobicContact CD1-CD2 4.12Å; T296-L314 HydrophobicContact CG2-CB 3.62Å; T296-L314 HydrophobicContact CG2-CD1 4.16Å; P297-L314 HydrophobicContact CG-CD1 3.85Å; I302-L314 HydrophobicContact CD1-CD1 4.42Å; F312-L314 HydrophobicContact CB-CD2 4.34Å; F312-L314 HydrophobicContact CB-CG 4.41Å; F312-L314 HydrophobicContact CD1-CD2 4.23Å; F312-L314 PolarHBondContact O-N 2.83Å; L314-Q316 PolarHBondContact O-NE2 2.9Å
315	P	82.3	Confident	88.4	Confident	79 Å²	79	89.8 Å²	89.8	51%	0.513	48%	0.481	S	S	.	.			trans	-60.2	140.8	174.6	27.5	-34.9	0	0	0	109.8	T296 I317	T296-P315 WeakPolarHBondContact CG2-O 2.99Å; T296-P315 PolarHBondContact OG1-O 3.42Å; P315-I317 HydrophobicContact CB-CD1 4.28Å; P315-I317 HydrophobicContact CB-CG1 4.41Å; P315-I317 HydrophobicContact CG-CD1 3.99Å; P315-I317 PolarHBondContact O-N 3.44Å
316	Q	90.6	Very high	88.3	Confident	169 Å²	169	90.2 Å²	90.2	79%	0.79	48%	0.483	S	S	*	.			trans	-84.2	100.3	-177.9	-63.6	-59.7	-59.6	0	0	110.5	T296 L314	T296-Q316 WeakPolarHBondContact OG1-CA 3.23Å; L314-Q316 PolarHBondContact O-NE2 2.9Å
317	I	94.4	Very high	88.2	Confident	68 Å²	68	95 Å²	95	35%	0.349	50%	0.5	S	S	.	.			trans	-118.1	129.4	-174.6	-67.1	173.2	0	0	0	107.8	I291 G295 T296 P315	I291-I317 HydrophobicContact CG2-CB 3.9Å; I291-I317 HydrophobicContact CG2-CD1 3.8Å; I291-I317 HydrophobicContact CG2-CG1 4.32Å; I291-I317 HydrophobicContact CG2-CG2 4.28Å; G295-I317 CarbonylContact C-O 3.42Å; G295-I317 WeakPolarHBondContact CA-O 3.38Å; T296-I317 PolarHBondContact N-O 2.92Å; T296-I317 PolarHBondContact OG1-N 2.86Å; T296-I317 PolarHBondContact OG1-O 3.19Å; P315-I317 HydrophobicContact CB-CD1 4.28Å; P315-I317 HydrophobicContact CB-CG1 4.41Å; P315-I317 HydrophobicContact CG-CD1 3.99Å; P315-I317 PolarHBondContact O-N 3.44Å
318	K	95.8	Very high	88.3	Confident	198 Å²	198	98.9 Å²	98.9	86%	0.861	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-76.8	141.6	175.5	-69.1	-177.7	176.1	-179.1	0	110	H320	K318-H320 PolarHBondContact O-N 3.31Å
319	A	97	Very high	88.6	Confident	63 Å²	63	104 Å²	104	52%	0.521	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-54.7	137.3	175.3	0	0	0	0	0	111.9	L294	L294-A319 WeakPolarHBondContact O-CB 3.36Å
320	H	96.4	Very high	89.2	Confident	79 Å²	79	103 Å²	103	37%	0.366	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-78.6	125.2	172.4	-160.6	-66.5	0	0	0	108.6	I293 K318 W322 K324 V325	I293-H320 PolarHBondContact O-N 3.32Å; K318-H320 PolarHBondContact O-N 3.31Å; H320-W322 PolarHBondContact O-N 2.91Å; H320-W322 VanDerWaalsContact O-N 3.14Å; H320-K324 VanDerWaalsContact CE1-CB 3.49Å; H320-K324 WeakPolarHBondContact CE1-CB 3.5Å; H320-V325 HydrophobicContact CB-CG2 4.45Å
321	P	97	Very high	90.4	Very high	71 Å²	71	99.1 Å²	99.1	46%	0.461	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-56.2	123.5	178.8	-27.3	35.6	0	0	0	111.3	S323 K324 V325	P321-S323 PolarHBondContact O-N 3.12Å; P321-S323 VanDerWaalsContact O-N 3.15Å; P321-K324 WeakPolarHBondContact O-CA 3.44Å; P321-K324 WeakPolarHBondContact O-CB 3.18Å; P321-K324 PolarHBondContact O-N 3.33Å; P321-V325 PolarHBondContact O-N 2.94Å
322	W	97.4	Very high	91.8	Very high	54 Å²	54	96.3 Å²	96.3	21%	0.205	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-52.9	-36.8	-175.2	-81.8	116.5	0	0	0	113.7	I277 I293 L294 H320 K324 V325 F326 V335 T338 S339 L342	I277-W322 HydrophobicContact CD1-CH2 4.42Å; I277-W322 HydrophobicContact CD1-CZ3 3.94Å; I293-W322 HydrophobicContact CG2-CE3 4.28Å; I293-W322 HydrophobicContact CG2-CH2 4.01Å; I293-W322 HydrophobicContact CG2-CZ2 4.48Å; I293-W322 HydrophobicContact CG2-CZ3 3.9Å; L294-W322 HydrophobicContact CD2-CH2 3.95Å; L294-W322 HydrophobicContact CD2-CZ2 3.36Å; H320-W322 PolarHBondContact O-N 2.91Å; H320-W322 VanDerWaalsContact O-N 3.14Å; W322-K324 PolarHBondContact O-N 2.67Å; W322-K324 VanDerWaalsContact O-N 3.09Å; W322-V325 HydrophobicContact CE3-CB 4.29Å; W322-V325 HydrophobicContact CE3-CG1 4.48Å; W322-V325 HydrophobicContact CE3-CG2 4.09Å; W322-V325 HydrophobicContact CZ3-CG1 4.5Å; W322-V325 WeakPolarHBondContact O-CB 3.4Å; W322-V325 PolarHBondContact O-N 3.39Å; W322-F326 AromaticContact CE3-CE2 3.75Å; W322-F326 HydrophobicContact CE3-CE2 3.75Å; W322-F326 HydrophobicContact CE3-CZ 4.32Å; W322-F326 HydrophobicContact CZ3-CE2 4.08Å; W322-F326 HydrophobicContact CZ3-CZ 4.17Å; W322-V335 HydrophobicContact CB-CG1 3.62Å; W322-T338 HydrophobicContact CH2-CG2 4.29Å; W322-T338 HydrophobicContact CZ3-CG2 4.12Å; W322-S339 VanDerWaalsContact CD1-CB 3.48Å; W322-S339 VanDerWaalsContact NE1-CB 3.26Å; W322-L342 HydrophobicContact CH2-CB 3.99Å; W322-L342 HydrophobicContact CH2-CD1 3.84Å; W322-L342 HydrophobicContact CZ2-CB 4.12Å
323	S	94.2	Very high	93.3	Very high	93 Å²	93	93.3 Å²	93.3	65%	0.65	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-63.7	-10.6	175.4	55.5	0	0	0	0	115	P321	P321-S323 PolarHBondContact O-N 3.12Å; P321-S323 VanDerWaalsContact O-N 3.15Å
324	K	96.5	Very high	94.4	Very high	154 Å²	154	86.5 Å²	86.5	67%	0.67	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-109.4	-5	173.6	-61.7	-176.2	176.3	-176.1	0	113.7	H320 P321 W322	H320-K324 VanDerWaalsContact CE1-CB 3.49Å; H320-K324 WeakPolarHBondContact CE1-CB 3.5Å; P321-K324 WeakPolarHBondContact O-CA 3.44Å; P321-K324 WeakPolarHBondContact O-CB 3.18Å; P321-K324 PolarHBondContact O-N 3.33Å; W322-K324 PolarHBondContact O-N 2.67Å; W322-K324 VanDerWaalsContact O-N 3.09Å
325	V	97.3	Very high	95.2	Very high	26 Å²	26	86.4 Å²	86.4	16%	0.158	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-39.4	174.9	179.6	0	0	0	0	109.9	L273 I277 I293 H320 P321 W322	L273-V325 WeakPolarHBondContact CD2-O 3.35Å; I277-V325 HydrophobicContact CD1-CG1 4.09Å; I293-V325 HydrophobicContact CD1-CG1 4.24Å; I293-V325 HydrophobicContact CD1-CG2 4.24Å; I293-V325 HydrophobicContact CG2-CG1 4.47Å; I293-V325 HydrophobicContact CG2-CG2 3.92Å; H320-V325 HydrophobicContact CB-CG2 4.45Å; P321-V325 PolarHBondContact O-N 2.94Å; W322-V325 HydrophobicContact CE3-CB 4.29Å; W322-V325 HydrophobicContact CE3-CG1 4.48Å; W322-V325 HydrophobicContact CE3-CG2 4.09Å; W322-V325 HydrophobicContact CZ3-CG1 4.5Å; W322-V325 WeakPolarHBondContact O-CB 3.4Å; W322-V325 PolarHBondContact O-N 3.39Å
326	F	96.1	Very high	96	Very high	16 Å²	16	85.9 Å²	85.9	7%	0.07	44%	0.435	C	S	.	.	S	Bend	trans	-94.9	170	-179.9	-57.5	-73.8	0	0	0	112.9	A269 L272 L273 I277 W322 T330 V335 T338	A269-F326 HydrophobicContact CB-CE1 4.21Å; A269-F326 HydrophobicContact CB-CZ 4.27Å; L272-F326 HydrophobicContact CB-CD1 3.81Å; L272-F326 HydrophobicContact CB-CE1 3.92Å; L272-F326 HydrophobicContact CD1-CD1 4.29Å; L272-F326 HydrophobicContact CD1-CE1 4.07Å; L272-F326 HydrophobicContact CD1-CZ 4.42Å; L273-F326 HydrophobicContact CD1-CE1 4.28Å; L273-F326 HydrophobicContact CD2-CD1 3.66Å; L273-F326 HydrophobicContact CD2-CE1 4.11Å; L273-F326 HydrophobicContact CG-CD1 3.85Å; L273-F326 HydrophobicContact CG-CE1 3.87Å; I277-F326 HydrophobicContact CD1-CZ 4.49Å; W322-F326 AromaticContact CE3-CE2 3.75Å; W322-F326 HydrophobicContact CE3-CE2 3.75Å; W322-F326 HydrophobicContact CE3-CZ 4.32Å; W322-F326 HydrophobicContact CZ3-CE2 4.08Å; W322-F326 HydrophobicContact CZ3-CZ 4.17Å; F326-T330 HydrophobicContact CB-CG2 3.99Å; F326-T330 HydrophobicContact CG-CG2 4.24Å; F326-V335 HydrophobicContact CD2-CB 4.34Å; F326-V335 HydrophobicContact CD2-CG1 4.03Å; F326-V335 HydrophobicContact CD2-CG2 3.78Å; F326-V335 HydrophobicContact CE2-CG1 4.24Å; F326-V335 HydrophobicContact CE2-CG2 4.46Å; F326-V335 HydrophobicContact CG-CG2 4.43Å; F326-T338 HydrophobicContact CE2-CG2 4.41Å; F326-T338 HydrophobicContact CZ-CG2 3.84Å
327	R	92.3	Very high	96.4	Very high	117 Å²	117	77.9 Å²	77.9	44%	0.442	40%	0.398	S	S	.	.			trans	-67.8	147.4	175.6	-51.9	-177.8	-168	-163.4	5	109.5	L273 R329 T330	L273-R327 PolarHBondContact O-NH2 3.3Å; R327-R329 PolarHBondContact O-N 3.44Å; R327-T330 WeakPolarHBondContact O-CB 3.36Å; R327-T330 PolarHBondContact O-N 3.2Å; R327-T330 PolarHBondContact O-OG1 2.67Å
328	T	92.1	Very high	96.6	Very high	152 Å²	152	74.6 Å²	74.6	93%	0.933	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-10.3	-177.6	-34	0	0	0	0	115.6
329	R	92.9	Very high	96.7	Very high	232 Å²	232	66.1 Å²	66.1	88%	0.875	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	4.6	176.2	-62	-173	-177.9	-176	0.5	113.8	R327	R327-R329 PolarHBondContact O-N 3.44Å
330	T	96.6	Very high	96.8	Very high	23 Å²	23	68.3 Å²	68.3	14%	0.141	34%	0.341	C	S	.	.	S	Bend	trans	-71.5	130.4	174.5	-65.5	0	0	0	0	109.6	L272 F326 R327 A334 V335	L272-T330 HydrophobicContact CD1-CG2 4.09Å; L272-T330 HydrophobicContact CD2-CG2 4.01Å; L272-T330 HydrophobicContact CG-CG2 4.46Å; F326-T330 HydrophobicContact CB-CG2 3.99Å; F326-T330 HydrophobicContact CG-CG2 4.24Å; R327-T330 WeakPolarHBondContact O-CB 3.36Å; R327-T330 PolarHBondContact O-N 3.2Å; R327-T330 PolarHBondContact O-OG1 2.67Å; T330-A334 HydrophobicContact CG2-CB 4.17Å; T330-V335 HydrophobicContact CG2-CG2 3.79Å
331	P	97.4	Very high	96.9	Very high	31 Å²	31	64.5 Å²	64.5	20%	0.201	32%	0.324	C	S	.	.			trans	-59.6	137.5	-179	-24.2	33.6	0	0	0	112.5	M176 E333 A334 V335	M176-P331 HydrophobicContact CE-CG 3.96Å; M176-P331 HydrophobicContact CG-CG 4.21Å; M176-P331 HydrophobicContact SD-CG 4.2Å; P331-E333 WeakPolarHBondContact CB-OE2 3.21Å; P331-E333 PolarHBondContact O-N 3.41Å; P331-A334 HydrophobicContact CB-CB 4.33Å; P331-A334 VanDerWaalsContact O-CB 3.3Å; P331-A334 WeakPolarHBondContact O-CB 3.37Å; P331-A334 PolarHBondContact O-N 3.25Å; P331-V335 PolarHBondContact O-N 3.04Å
332	P	98.1	Very high	97	Very high	94 Å²	94	61.2 Å²	61.2	61%	0.61	30%	0.302	S	S	*	.	H	α-helix	trans	-54.6	-35.8	-179.9	-26.7	35.6	0	0	0	113.7	A334 V335 D336	P332-A334 VanDerWaalsContact C-N 3.27Å; P332-A334 PolarHBondContact O-N 3.08Å; P332-V335 WeakPolarHBondContact O-CB 3.49Å; P332-V335 PolarHBondContact O-N 2.88Å; P332-D336 WeakPolarHBondContact O-CB 3.46Å; P332-D336 PolarHBondContact O-N 3Å
333	E	98.4	Very high	97.1	Very high	76 Å²	76	61.6 Å²	61.6	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-69.4	-27.3	-178.8	-46.8	72	-157	0	0	111.8	P331 L337 F360	P331-E333 WeakPolarHBondContact CB-OE2 3.21Å; P331-E333 PolarHBondContact O-N 3.41Å; E333-L337 VanDerWaalsContact O-CB 3.27Å; E333-L337 WeakPolarHBondContact O-CB 3.4Å; E333-L337 PolarHBondContact O-N 2.6Å; E333-F360 HydrophobicContact CB-CB 3.99Å; E333-F360 HydrophobicContact CB-CD2 4.37Å
334	A	98.5	Very high	97.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-74.7	-37.4	173.9	0	0	0	0	0	111.2	L272 T330 P331 P332 T338 F360	L272-A334 HydrophobicContact CD1-CB 3.92Å; L272-A334 HydrophobicContact CD2-CB 4.19Å; T330-A334 HydrophobicContact CG2-CB 4.17Å; P331-A334 HydrophobicContact CB-CB 4.33Å; P331-A334 VanDerWaalsContact O-CB 3.3Å; P331-A334 WeakPolarHBondContact O-CB 3.37Å; P331-A334 PolarHBondContact O-N 3.25Å; P332-A334 VanDerWaalsContact C-N 3.27Å; P332-A334 PolarHBondContact O-N 3.08Å; A334-T338 WeakPolarHBondContact O-CB 3.36Å; A334-T338 PolarHBondContact O-N 2.71Å; A334-T338 PolarHBondContact O-OG1 2.88Å; A334-F360 HydrophobicContact CB-CD2 3.69Å; A334-F360 HydrophobicContact CB-CE2 3.42Å; A334-F360 VanDerWaalsContact CB-CE2 3.42Å; A334-F360 HydrophobicContact CB-CZ 4.06Å
335	V	98.5	Very high	97.4	Very high	19 Å²	19	50.1 Å²	50.1	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-67.9	-46.2	175.3	-177.1	0	0	0	0	110.3	W322 F326 T330 P331 P332 T338 S339	W322-V335 HydrophobicContact CB-CG1 3.62Å; F326-V335 HydrophobicContact CD2-CB 4.34Å; F326-V335 HydrophobicContact CD2-CG1 4.03Å; F326-V335 HydrophobicContact CD2-CG2 3.78Å; F326-V335 HydrophobicContact CE2-CG1 4.24Å; F326-V335 HydrophobicContact CE2-CG2 4.46Å; F326-V335 HydrophobicContact CG-CG2 4.43Å; T330-V335 HydrophobicContact CG2-CG2 3.79Å; P331-V335 PolarHBondContact O-N 3.04Å; P332-V335 WeakPolarHBondContact O-CB 3.49Å; P332-V335 PolarHBondContact O-N 2.88Å; V335-T338 PolarHBondContact O-N 3.1Å; V335-S339 PolarHBondContact O-N 2.84Å
336	D	98.7	Very high	97.4	Very high	69 Å²	69	49.9 Å²	49.9	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-54.1	175.3	-176.3	39.4	0	0	0	111	P332 T338 S339 R340 H358	P332-D336 WeakPolarHBondContact O-CB 3.46Å; P332-D336 PolarHBondContact O-N 3Å; D336-T338 VanDerWaalsContact C-N 3.26Å; D336-T338 PolarHBondContact O-N 3.19Å; D336-S339 WeakPolarHBondContact O-CB 3.47Å; D336-S339 PolarHBondContact O-N 3.3Å; D336-S339 PolarHBondContact O-OG 2.83Å; D336-R340 WeakPolarHBondContact O-CG 3.47Å; D336-R340 PolarHBondContact O-N 3.12Å; D336-H358 IonicContact OD2-CE1 3.29Å; D336-H358 PolarHBondContact OD2-CE1 2.8Å; D336-H358 IonicContact OD2-NE2 2.7Å; D336-H358 PolarHBondContact OD2-NE2 3.23Å
337	L	98.8	Very high	97.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-53.1	-44.1	176.3	178.3	57.4	0	0	0	112	L268 E333 S339 R340 L341 L350 A355 H358 F360 F361	L268-L337 HydrophobicContact CD2-CB 4.22Å; L268-L337 HydrophobicContact CD2-CD2 3.75Å; L268-L337 HydrophobicContact CD2-CG 3.72Å; E333-L337 VanDerWaalsContact O-CB 3.27Å; E333-L337 WeakPolarHBondContact O-CB 3.4Å; E333-L337 PolarHBondContact O-N 2.6Å; L337-S339 PolarHBondContact O-N 3.5Å; L337-R340 PolarHBondContact O-N 2.77Å; L337-L341 HydrophobicContact CD1-CD1 3.84Å; L337-L341 HydrophobicContact CD1-CG 4.14Å; L337-L341 HydrophobicContact CG-CD1 3.83Å; L337-L341 WeakPolarHBondContact O-CD1 3.3Å; L337-L341 WeakPolarHBondContact O-CG 3.35Å; L337-L341 PolarHBondContact O-N 2.94Å; L337-L350 HydrophobicContact CD1-CD1 3.94Å; L337-A355 HydrophobicContact CD1-CB 4.3Å; L337-H358 HydrophobicContact CD1-CB 4.02Å; L337-F360 HydrophobicContact CD2-CB 4.11Å; L337-F360 HydrophobicContact CD2-CD1 3.51Å; L337-F360 HydrophobicContact CD2-CE1 4.28Å; L337-F360 HydrophobicContact CD2-CG 4.12Å; L337-F361 HydrophobicContact CD2-CE2 3.61Å; L337-F361 HydrophobicContact CD2-CZ 3.72Å
338	T	98.8	Very high	97.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-42.5	178.8	-53.5	0	0	0	0	111.7	L268 A269 W322 F326 A334 V335 D336 R340 L341 L342	L268-T338 VanDerWaalsContact CD2-OG1 3.24Å; L268-T338 WeakPolarHBondContact CD2-OG1 3.33Å; L268-T338 WeakPolarHBondContact CG-OG1 3.37Å; A269-T338 HydrophobicContact CB-CG2 4Å; W322-T338 HydrophobicContact CH2-CG2 4.29Å; W322-T338 HydrophobicContact CZ3-CG2 4.12Å; F326-T338 HydrophobicContact CE2-CG2 4.41Å; F326-T338 HydrophobicContact CZ-CG2 3.84Å; A334-T338 WeakPolarHBondContact O-CB 3.36Å; A334-T338 PolarHBondContact O-N 2.71Å; A334-T338 PolarHBondContact O-OG1 2.88Å; V335-T338 PolarHBondContact O-N 3.1Å; D336-T338 VanDerWaalsContact C-N 3.26Å; D336-T338 PolarHBondContact O-N 3.19Å; T338-R340 VanDerWaalsContact C-N 3.32Å; T338-R340 PolarHBondContact O-N 3.24Å; T338-L341 PolarHBondContact O-N 3.46Å; T338-L342 HydrophobicContact CG2-CD1 3.75Å; T338-L342 HydrophobicContact CG2-CG 4.37Å; T338-L342 PolarHBondContact O-N 2.97Å
339	S	98.5	Very high	98.1	Very high	20 Å²	20	46.1 Å²	46.1	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-39.7	176.6	75.7	0	0	0	0	112.6	W322 V335 D336 L337 L341 L342	W322-S339 VanDerWaalsContact CD1-CB 3.48Å; W322-S339 VanDerWaalsContact NE1-CB 3.26Å; V335-S339 PolarHBondContact O-N 2.84Å; D336-S339 WeakPolarHBondContact O-CB 3.47Å; D336-S339 PolarHBondContact O-N 3.3Å; D336-S339 PolarHBondContact O-OG 2.83Å; L337-S339 PolarHBondContact O-N 3.5Å; S339-L341 VanDerWaalsContact C-N 3.25Å; S339-L341 PolarHBondContact O-N 3.35Å; S339-L342 PolarHBondContact O-N 2.79Å
340	R	98.7	Very high	98.4	Very high	108 Å²	108	35.8 Å²	35.8	41%	0.408	19%	0.186	S	C	.	.	H	α-helix	trans	-77.3	-5.5	-179.7	-57.7	-63.5	-65.9	-80.6	0.3	114.3	D336 L337 T338 L350	D336-R340 WeakPolarHBondContact O-CG 3.47Å; D336-R340 PolarHBondContact O-N 3.12Å; L337-R340 PolarHBondContact O-N 2.77Å; T338-R340 VanDerWaalsContact C-N 3.32Å; T338-R340 PolarHBondContact O-N 3.24Å; R340-L350 HydrophobicContact CB-CD1 3.8Å; R340-L350 HydrophobicContact CB-CD2 4.33Å; R340-L350 HydrophobicContact CB-CG 3.81Å; R340-L350 PolarHBondContact O-N 3.12Å
341	L	98.9	Very high	98.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-103.2	-35.6	173.3	-67	164.3	0	0	0	112	F187 V261 L268 L337 T338 S339 E343 R349 L350 A355	F187-L341 HydrophobicContact CE1-CD1 4.37Å; F187-L341 HydrophobicContact CE1-CD2 3.87Å; F187-L341 HydrophobicContact CE2-CD1 4.37Å; F187-L341 HydrophobicContact CZ-CD1 3.58Å; F187-L341 HydrophobicContact CZ-CD2 3.87Å; F187-L341 HydrophobicContact CZ-CG 4.4Å; V261-L341 HydrophobicContact CG1-CD2 3.47Å; V261-L341 VanDerWaalsContact CG1-CD2 3.47Å; L268-L341 HydrophobicContact CD2-CD1 4.01Å; L337-L341 HydrophobicContact CD1-CD1 3.84Å; L337-L341 HydrophobicContact CD1-CG 4.14Å; L337-L341 HydrophobicContact CG-CD1 3.83Å; L337-L341 WeakPolarHBondContact O-CD1 3.3Å; L337-L341 WeakPolarHBondContact O-CG 3.35Å; L337-L341 PolarHBondContact O-N 2.94Å; T338-L341 PolarHBondContact O-N 3.46Å; S339-L341 VanDerWaalsContact C-N 3.25Å; S339-L341 PolarHBondContact O-N 3.35Å; L341-E343 VanDerWaalsContact C-N 3.3Å; L341-E343 PolarHBondContact O-N 3.39Å; L341-R349 WeakPolarHBondContact O-CD 3.5Å; L341-R349 WeakPolarHBondContact O-CG 3.44Å; L341-L350 HydrophobicContact CD2-CB 4.44Å; L341-A355 HydrophobicContact CD2-CB 4.35Å
342	L	98.8	Very high	98.5	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.182	C	C	.	.	S	Bend	trans	-95	48.2	-177.2	-64	-179.4	0	0	0	112.3	W262 A269 I277 F278 L294 W322 T338 S339	W262-L342 HydrophobicContact CD2-CD2 3.67Å; W262-L342 HydrophobicContact CE3-CB 4.42Å; W262-L342 HydrophobicContact CE3-CD2 3.85Å; W262-L342 HydrophobicContact CG-CD2 4.12Å; W262-L342 HydrophobicContact CH2-CD2 4.34Å; W262-L342 HydrophobicContact CZ2-CD2 4.18Å; W262-L342 HydrophobicContact CZ3-CB 4.16Å; W262-L342 HydrophobicContact CZ3-CD2 4.19Å; W262-L342 WeakPolarHBondContact O-CD2 3.45Å; A269-L342 HydrophobicContact CB-CD1 4.45Å; I277-L342 HydrophobicContact CD1-CD1 4.37Å; F278-L342 HydrophobicContact CE2-CD1 3.99Å; F278-L342 HydrophobicContact CE2-CD2 4.28Å; F278-L342 HydrophobicContact CZ-CD1 4.15Å; L294-L342 VanDerWaalsContact CD1-O 3.27Å; L294-L342 WeakPolarHBondContact CD1-O 3.09Å; L294-L342 WeakPolarHBondContact CD2-O 3.39Å; W322-L342 HydrophobicContact CH2-CB 3.99Å; W322-L342 HydrophobicContact CH2-CD1 3.84Å; W322-L342 HydrophobicContact CZ2-CB 4.12Å; T338-L342 HydrophobicContact CG2-CD1 3.75Å; T338-L342 HydrophobicContact CG2-CG 4.37Å; T338-L342 PolarHBondContact O-N 2.97Å; S339-L342 PolarHBondContact O-N 2.79Å
343	E	98.8	Very high	98.6	Very high	62 Å²	62	30.7 Å²	30.7	29%	0.29	15%	0.154	S	C	.	.			trans	-85.3	140	171.8	-77.2	-69.4	178.6	0	0	111.6	L341 Q348 R349	L341-E343 VanDerWaalsContact C-N 3.3Å; L341-E343 PolarHBondContact O-N 3.39Å; E343-Q348 HydrophobicContact CB-CB 4.29Å; E343-Q348 HydrophobicContact CG-CB 4.25Å; E343-R349 HydrophobicContact CB-CG 3.89Å; E343-R349 PolarHBondContact O-NE 3.12Å; E343-R349 PolarHBondContact O-NH2 3.36Å; E343-R349 VanDerWaalsContact O-NH2 3.16Å
344	Y	98.5	Very high	98.6	Very high	3 Å²	3	30.8 Å²	30.8	1%	0.012	15%	0.154	C	C	.	.	S	Bend	trans	-60.9	-50.1	172.5	-80.2	-60.4	0	0	0	111.3	P246 I290 I291 L294 G295 P297 M305 P346 R349	P246-Y344 HydrophobicContact CB-CD1 4.22Å; P246-Y344 HydrophobicContact CB-CE1 4.47Å; P246-Y344 HydrophobicContact CG-CD1 4.04Å; I290-Y344 HydrophobicContact CG2-CE1 3.62Å; I291-Y344 WeakPolarHBondContact CG1-OH 3.4Å; L294-Y344 HydrophobicContact CB-CD2 4.2Å; L294-Y344 HydrophobicContact CB-CE2 3.44Å; L294-Y344 VanDerWaalsContact CB-CE2 3.44Å; L294-Y344 HydrophobicContact CD1-CD1 4.21Å; L294-Y344 HydrophobicContact CD1-CD2 4.06Å; L294-Y344 HydrophobicContact CD1-CE1 4.05Å; L294-Y344 HydrophobicContact CD1-CE2 3.91Å; L294-Y344 HydrophobicContact CD1-CG 4.21Å; L294-Y344 HydrophobicContact CG-CE2 4.33Å; G295-Y344 WeakPolarHBondContact O-CE2 3.4Å; G295-Y344 PolarHBondContact O-OH 3.18Å; P297-Y344 HydrophobicContact CB-CD1 4.1Å; P297-Y344 HydrophobicContact CB-CD2 3.79Å; P297-Y344 HydrophobicContact CB-CE1 4.08Å; P297-Y344 HydrophobicContact CB-CE2 3.76Å; P297-Y344 HydrophobicContact CB-CG 3.96Å; P297-Y344 HydrophobicContact CG-CE1 4.21Å; P297-Y344 HydrophobicContact CG-CE2 4.39Å; M305-Y344 HydrophobicContact CE-CD1 3.83Å; M305-Y344 HydrophobicContact CE-CG 4.25Å; M305-Y344 WeakPolarHBondContact CG-O 3.42Å; M305-Y344 HydrophobicContact SD-CD1 3.71Å; M305-Y344 HydrophobicContact SD-CG 4.32Å; Y344-P346 VanDerWaalsContact O-CD 3.26Å; Y344-P346 WeakPolarHBondContact O-CD 3.21Å; Y344-R349 PolarHBondContact O-NH2 2.93Å
345	A	98.1	Very high	98.6	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.033	15%	0.154	C	C	.	.	S	Bend	trans	-68.5	112.2	-179.8	0	0	0	0	0	110.3	K304 D347 Q348	K304-A345 HydrophobicContact CB-CB 4.44Å; K304-A345 HydrophobicContact CD-CB 3.83Å; A345-D347 WeakPolarHBondContact CB-OD1 3.29Å; A345-D347 PolarHBondContact O-N 3.38Å; A345-D347 VanDerWaalsContact O-N 3.16Å; A345-Q348 HydrophobicContact CB-CB 4.04Å; A345-Q348 HydrophobicContact CB-CG 3.6Å; A345-Q348 PolarHBondContact O-N 2.9Å
346	P	98.4	Very high	98.6	Very high	21 Å²	21	29.9 Å²	29.9	14%	0.136	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.2	-172	-21.1	33.7	0	0	0	113.7	E247 S258 K304 M305 Y344 Q348	E247-P346 HydrophobicContact CG-CG 4.45Å; E247-P346 WeakPolarHBondContact OE1-CG 3.44Å; S258-P346 WeakPolarHBondContact OG-CB 3.49Å; K304-P346 WeakPolarHBondContact O-CD 3.27Å; M305-P346 HydrophobicContact CG-CG 4.5Å; Y344-P346 VanDerWaalsContact O-CD 3.26Å; Y344-P346 WeakPolarHBondContact O-CD 3.21Å; P346-Q348 VanDerWaalsContact C-N 3.34Å
347	D	97.6	Very high	98.6	Very high	87 Å²	87	27.5 Å²	27.5	47%	0.465	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.3	174.4	59.8	-61.9	0	0	0	114.7	K304 A345	K304-D347 WeakPolarHBondContact CD-OD1 3.38Å; K304-D347 IonicContact NZ-OD1 3.6Å; K304-D347 IonicContact NZ-OD2 2.67Å; K304-D347 PolarHBondContact NZ-OD2 2.61Å; A345-D347 WeakPolarHBondContact CB-OD1 3.29Å; A345-D347 PolarHBondContact O-N 3.38Å; A345-D347 VanDerWaalsContact O-N 3.16Å
348	Q	98.4	Very high	98.6	Very high	104 Å²	104	28.5 Å²	28.5	49%	0.486	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-11.4	-178.3	-59.6	-59.8	-57	0	0	113.4	E343 A345 P346	E343-Q348 HydrophobicContact CB-CB 4.29Å; E343-Q348 HydrophobicContact CG-CB 4.25Å; A345-Q348 HydrophobicContact CB-CB 4.04Å; A345-Q348 HydrophobicContact CB-CG 3.6Å; A345-Q348 PolarHBondContact O-N 2.9Å; P346-Q348 VanDerWaalsContact C-N 3.34Å
349	R	98.7	Very high	98.6	Very high	15 Å²	15	31 Å²	31	6%	0.057	16%	0.161	C	C	.	.	S	Bend	trans	-68.5	140.9	174.7	-57.7	177.8	-167.4	144.7	10.7	110.2	E247 S258 V261 L341 E343 Y344 S351	E247-R349 IonicContact OE1-CZ 3.24Å; E247-R349 IonicContact OE1-NH1 3.6Å; E247-R349 PolarHBondContact OE1-NH1 2.82Å; E247-R349 IonicContact OE1-NH2 2.99Å; E247-R349 PolarHBondContact OE1-NH2 3.31Å; E247-R349 IonicContact OE2-CZ 2.71Å; E247-R349 IonicContact OE2-NH1 3.12Å; E247-R349 IonicContact OE2-NH2 2.61Å; E247-R349 PolarHBondContact OE2-NH2 2.89Å; S258-R349 PolarHBondContact O-NH1 3.24Å; V261-R349 HydrophobicContact CG1-CB 3.96Å; L341-R349 WeakPolarHBondContact O-CD 3.5Å; L341-R349 WeakPolarHBondContact O-CG 3.44Å; E343-R349 HydrophobicContact CB-CG 3.89Å; E343-R349 PolarHBondContact O-NE 3.12Å; E343-R349 PolarHBondContact O-NH2 3.36Å; E343-R349 VanDerWaalsContact O-NH2 3.16Å; Y344-R349 PolarHBondContact O-NH2 2.93Å; R349-S351 PolarHBondContact O-N 3.39Å
350	L	98.7	Very high	98.6	Very high	15 Å²	15	30.1 Å²	30.1	8%	0.079	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-58	137.9	174.5	-61.4	-179.4	0	0	0	111.5	V261 L337 R340 L341 Q354	V261-L350 WeakPolarHBondContact CG1-O 3.47Å; L337-L350 HydrophobicContact CD1-CD1 3.94Å; R340-L350 HydrophobicContact CB-CD1 3.8Å; R340-L350 HydrophobicContact CB-CD2 4.33Å; R340-L350 HydrophobicContact CB-CG 3.81Å; R340-L350 PolarHBondContact O-N 3.12Å; L341-L350 HydrophobicContact CD2-CB 4.44Å; L350-Q354 HydrophobicContact CB-CB 4.04Å; L350-Q354 HydrophobicContact CD2-CB 4.21Å
351	S	98.7	Very high	98.6	Very high	28 Å²	28	25 Å²	25	20%	0.196	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-61.4	156.8	164.3	77.4	0	0	0	0	110.4	R349 L353 Q354 A355 Q391	R349-S351 PolarHBondContact O-N 3.39Å; S351-L353 VanDerWaalsContact C-N 3.27Å; S351-L353 PolarHBondContact O-N 2.88Å; S351-Q354 WeakPolarHBondContact O-CB 3.47Å; S351-Q354 PolarHBondContact O-N 3.22Å; S351-Q354 WeakPolarHBondContact OG-CB 3.1Å; S351-Q354 VanDerWaalsContact OG-CG 3.29Å; S351-Q354 WeakPolarHBondContact OG-CG 3.43Å; S351-Q354 PolarHBondContact OG-N 3.3Å; S351-Q354 VanDerWaalsContact OG-N 3.15Å; S351-Q354 PolarHBondContact OG-OE1 3.17Å; S351-A355 PolarHBondContact O-N 3.45Å; S351-Q391 PolarHBondContact OG-NE2 3.41Å; S351-Q391 PolarHBondContact OG-OE1 3.34Å
352	P	98.8	Very high	98.6	Very high	11 Å²	11	29 Å²	29	7%	0.071	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-34	179.5	-25.2	33.8	0	0	0	114	F187 L190 A191 V261 A355 C356	F187-P352 HydrophobicContact CB-CB 4.43Å; F187-P352 HydrophobicContact CD1-CB 4.44Å; F187-P352 VanDerWaalsContact O-CB 3.23Å; F187-P352 WeakPolarHBondContact O-CB 3.37Å; L190-P352 HydrophobicContact CB-CB 3.9Å; L190-P352 HydrophobicContact CB-CG 3.78Å; A191-P352 HydrophobicContact CB-CB 3.98Å; V261-P352 HydrophobicContact CG2-CG 4.15Å; P352-A355 WeakPolarHBondContact O-CB 3.22Å; P352-A355 PolarHBondContact O-N 2.93Å; P352-C356 PolarHBondContact O-N 3.15Å; P352-C356 PolarHBondContact O-SG 3.49Å
353	L	98.5	Very high	98.5	Very high	2 Å²	2	33 Å²	33	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-74.4	-33.2	173.8	-69.1	-171.8	0	0	0	113.4	A191 S351 A355 C356 A357 F383 I390 Q391 L394 L398	A191-L353 HydrophobicContact CB-CD2 3.58Å; A191-L353 HydrophobicContact CB-CG 3.78Å; S351-L353 VanDerWaalsContact C-N 3.27Å; S351-L353 PolarHBondContact O-N 2.88Å; L353-A355 VanDerWaalsContact C-N 3.26Å; L353-A355 PolarHBondContact O-N 2.93Å; L353-C356 PolarHBondContact O-N 2.8Å; L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 2.99Å; L353-F383 HydrophobicContact CD2-CE1 4.13Å; L353-I390 HydrophobicContact CD1-CB 3.72Å; L353-I390 HydrophobicContact CD1-CD1 4.21Å; L353-I390 HydrophobicContact CD1-CG2 3.99Å; L353-Q391 HydrophobicContact CD1-CB 4.35Å; L353-L394 HydrophobicContact CB-CD1 3.78Å; L353-L398 HydrophobicContact CB-CD1 4.39Å; L353-L398 HydrophobicContact CD1-CD1 4.32Å; L353-L398 HydrophobicContact CD2-CD1 4.14Å
354	Q	98.7	Very high	98.5	Very high	78 Å²	78	30.1 Å²	30.1	36%	0.364	16%	0.162	S	C	.	.	H	α-helix	trans	-63.2	-36.7	169.9	-73.7	170.6	-34.3	0	0	111	L350 S351 A357 H358 L394	L350-Q354 HydrophobicContact CB-CB 4.04Å; L350-Q354 HydrophobicContact CD2-CB 4.21Å; S351-Q354 WeakPolarHBondContact O-CB 3.47Å; S351-Q354 PolarHBondContact O-N 3.22Å; S351-Q354 WeakPolarHBondContact OG-CB 3.1Å; S351-Q354 VanDerWaalsContact OG-CG 3.29Å; S351-Q354 WeakPolarHBondContact OG-CG 3.43Å; S351-Q354 PolarHBondContact OG-N 3.3Å; S351-Q354 VanDerWaalsContact OG-N 3.15Å; S351-Q354 PolarHBondContact OG-OE1 3.17Å; Q354-A357 PolarHBondContact O-N 2.63Å; Q354-H358 PolarHBondContact O-N 2.83Å; Q354-L394 HydrophobicContact CG-CD1 3.93Å
355	A	98.9	Very high	98.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.4	-48.3	171.2	0	0	0	0	0	111.4	F187 L337 L341 S351 P352 L353 A357 H358 F361	F187-A355 HydrophobicContact CB-CB 4.37Å; F187-A355 HydrophobicContact CD1-CB 3.76Å; F187-A355 HydrophobicContact CD2-CB 3.68Å; F187-A355 HydrophobicContact CE1-CB 3.93Å; F187-A355 HydrophobicContact CE2-CB 3.86Å; F187-A355 HydrophobicContact CG-CB 3.67Å; F187-A355 HydrophobicContact CZ-CB 4Å; L337-A355 HydrophobicContact CD1-CB 4.3Å; L341-A355 HydrophobicContact CD2-CB 4.35Å; S351-A355 PolarHBondContact O-N 3.45Å; P352-A355 WeakPolarHBondContact O-CB 3.22Å; P352-A355 PolarHBondContact O-N 2.93Å; L353-A355 VanDerWaalsContact C-N 3.26Å; L353-A355 PolarHBondContact O-N 2.93Å; A355-A357 PolarHBondContact O-N 2.76Å; A355-H358 WeakPolarHBondContact O-CB 3.41Å; A355-H358 PolarHBondContact O-N 2.84Å; A355-F361 WeakPolarHBondContact O-CD2 3.19Å; A355-F361 WeakPolarHBondContact O-CE2 3.24Å
356	C	98.8	Very high	98.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.2	-35.2	173.5	-71.5	0	0	0	0	113.3	Y184 F187 P352 L353 H358 R365 L398	Y184-C356 HydrophobicContact CD2-CB 4.18Å; Y184-C356 HydrophobicContact CE2-CB 3.87Å; Y184-C356 WeakPolarHBondContact CE2-O 3.42Å; F187-C356 WeakPolarHBondContact CB-SG 3.43Å; P352-C356 PolarHBondContact O-N 3.15Å; P352-C356 PolarHBondContact O-SG 3.49Å; L353-C356 PolarHBondContact O-N 2.8Å; C356-H358 VanDerWaalsContact C-N 3.28Å; C356-H358 PolarHBondContact O-N 2.88Å; C356-R365 PolarHBondContact O-NH1 2.96Å; C356-L398 HydrophobicContact CB-CD2 3.48Å; C356-L398 VanDerWaalsContact CB-CD2 3.48Å
357	A	98.6	Very high	98.2	Very high	18 Å²	18	37.6 Å²	37.6	15%	0.149	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-5.3	177.3	0	0	0	0	0	114	L353 Q354 A355 L394 I397 L398	L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 2.99Å; Q354-A357 PolarHBondContact O-N 2.63Å; A355-A357 PolarHBondContact O-N 2.76Å; A357-L394 HydrophobicContact CB-CD2 4.28Å; A357-I397 HydrophobicContact CB-CB 4.41Å; A357-I397 HydrophobicContact CB-CG2 4Å; A357-L398 HydrophobicContact CB-CD2 4.04Å
358	H	98.8	Very high	98.1	Very high	21 Å²	21	38.8 Å²	38.8	10%	0.097	20%	0.204	C	C	.	.	S	Bend	trans	-66	146.7	-177.4	-156.3	-93	0	0	0	112.8	D336 L337 Q354 A355 C356 F360 F361 R365	D336-H358 IonicContact OD2-CE1 3.29Å; D336-H358 PolarHBondContact OD2-CE1 2.8Å; D336-H358 IonicContact OD2-NE2 2.7Å; D336-H358 PolarHBondContact OD2-NE2 3.23Å; L337-H358 HydrophobicContact CD1-CB 4.02Å; Q354-H358 PolarHBondContact O-N 2.83Å; A355-H358 WeakPolarHBondContact O-CB 3.41Å; A355-H358 PolarHBondContact O-N 2.84Å; C356-H358 VanDerWaalsContact C-N 3.28Å; C356-H358 PolarHBondContact O-N 2.88Å; H358-F360 PolarHBondContact O-N 3.4Å; H358-F360 VanDerWaalsContact O-N 3.17Å; H358-F361 HydrophobicContact CB-CD2 4.19Å; H358-F361 HydrophobicContact CB-CE2 4.43Å; H358-F361 PolarHBondContact O-N 2.75Å; H358-R365 PolarHBondContact O-NH2 2.83Å
359	S	98.5	Very high	98	Very high	54 Å²	54	34.4 Å²	34.4	38%	0.378	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-60	-28.1	-176	55.2	0	0	0	0	114.2	F361 D362	S359-F361 PolarHBondContact O-N 3.2Å; S359-D362 VanDerWaalsContact CA-OD2 3.22Å; S359-D362 WeakPolarHBondContact CA-OD2 3.47Å; S359-D362 WeakPolarHBondContact CB-OD2 3.46Å; S359-D362 WeakPolarHBondContact O-CB 3.11Å; S359-D362 PolarHBondContact O-N 2.81Å
360	F	98.7	Very high	97.9	Very high	1 Å²	1	38 Å²	38	0%	0.004	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-48.9	-32.6	171.1	179.5	-120	0	0	0	112.7	M176 V179 K180 L268 E333 A334 L337 H358	M176-F360 HydrophobicContact CG-CE2 4.34Å; M176-F360 HydrophobicContact SD-CE2 3.66Å; M176-F360 HydrophobicContact SD-CZ 3.73Å; V179-F360 HydrophobicContact CG1-CZ 4.25Å; K180-F360 HydrophobicContact CB-CE1 4.44Å; K180-F360 HydrophobicContact CD-CE2 4.33Å; K180-F360 HydrophobicContact CD-CZ 4.43Å; K180-F360 VanDerWaalsContact CD-O 3.25Å; K180-F360 WeakPolarHBondContact CD-O 3.5Å; K180-F360 WeakPolarHBondContact CE-O 3.47Å; K180-F360 HydrophobicContact CG-CD1 4.19Å; K180-F360 HydrophobicContact CG-CD2 4.35Å; K180-F360 HydrophobicContact CG-CE1 3.66Å; K180-F360 HydrophobicContact CG-CE2 3.81Å; K180-F360 HydrophobicContact CG-CZ 3.44Å; K180-F360 VanDerWaalsContact CG-CZ 3.44Å; K180-F360 PolarHBondContact NZ-O 3.07Å; L268-F360 HydrophobicContact CD1-CE1 4.23Å; L268-F360 HydrophobicContact CD1-CZ 4.44Å; E333-F360 HydrophobicContact CB-CB 3.99Å; E333-F360 HydrophobicContact CB-CD2 4.37Å; A334-F360 HydrophobicContact CB-CD2 3.69Å; A334-F360 HydrophobicContact CB-CE2 3.42Å; A334-F360 VanDerWaalsContact CB-CE2 3.42Å; A334-F360 HydrophobicContact CB-CZ 4.06Å; L337-F360 HydrophobicContact CD2-CB 4.11Å; L337-F360 HydrophobicContact CD2-CD1 3.51Å; L337-F360 HydrophobicContact CD2-CE1 4.28Å; L337-F360 HydrophobicContact CD2-CG 4.12Å; H358-F360 PolarHBondContact O-N 3.4Å; H358-F360 VanDerWaalsContact O-N 3.17Å
361	F	98.8	Very high	97.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-93.6	3.1	-179.9	-55.7	-65.8	0	0	0	114.8	K180 M183 Y184 F187 L337 A355 H358 S359 E363 L364	K180-F361 HydrophobicContact CB-CD1 4.18Å; K180-F361 HydrophobicContact CB-CE1 4.45Å; K180-F361 HydrophobicContact CG-CD1 4.48Å; K180-F361 WeakPolarHBondContact O-CE1 3.43Å; M183-F361 HydrophobicContact CB-CE1 4.07Å; M183-F361 HydrophobicContact CB-CZ 3.94Å; Y184-F361 HydrophobicContact CD2-CB 3.97Å; Y184-F361 HydrophobicContact CD2-CD1 4.08Å; Y184-F361 HydrophobicContact CD2-CD2 4.21Å; Y184-F361 AromaticContact CD2-CG 3.83Å; Y184-F361 HydrophobicContact CD2-CG 3.83Å; Y184-F361 HydrophobicContact CE2-CB 4.49Å; Y184-F361 HydrophobicContact CG-CD1 4.43Å; F187-F361 HydrophobicContact CD2-CE2 4.16Å; F187-F361 AromaticContact CD2-CZ 3.97Å; F187-F361 HydrophobicContact CD2-CZ 3.97Å; F187-F361 HydrophobicContact CE2-CE2 4.34Å; F187-F361 HydrophobicContact CE2-CZ 4.04Å; L337-F361 HydrophobicContact CD2-CE2 3.61Å; L337-F361 HydrophobicContact CD2-CZ 3.72Å; A355-F361 WeakPolarHBondContact O-CD2 3.19Å; A355-F361 WeakPolarHBondContact O-CE2 3.24Å; H358-F361 HydrophobicContact CB-CD2 4.19Å; H358-F361 HydrophobicContact CB-CE2 4.43Å; H358-F361 PolarHBondContact O-N 2.75Å; S359-F361 PolarHBondContact O-N 3.2Å; F361-E363 PolarHBondContact O-N 2.71Å; F361-L364 HydrophobicContact CB-CD1 4.3Å; F361-L364 HydrophobicContact CD1-CD1 3.92Å; F361-L364 WeakPolarHBondContact O-CB 3.33Å; F361-L364 PolarHBondContact O-N 3.33Å
362	D	98.3	Very high	97.3	Very high	83 Å²	83	40 Å²	40	44%	0.444	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-32.8	-179.6	-74.2	-29.1	0	0	0	113.1	S359 L364 R365 H366	S359-D362 VanDerWaalsContact CA-OD2 3.22Å; S359-D362 WeakPolarHBondContact CA-OD2 3.47Å; S359-D362 WeakPolarHBondContact CB-OD2 3.46Å; S359-D362 WeakPolarHBondContact O-CB 3.11Å; S359-D362 PolarHBondContact O-N 2.81Å; D362-L364 PolarHBondContact O-N 3.24Å; D362-R365 WeakPolarHBondContact O-CA 3.28Å; D362-R365 WeakPolarHBondContact O-CB 3.44Å; D362-R365 PolarHBondContact O-N 2.93Å; D362-R365 IonicContact OD1-CZ 3.84Å; D362-R365 VanDerWaalsContact OD1-CZ 3.24Å; D362-R365 IonicContact OD1-NE 2.96Å; D362-R365 PolarHBondContact OD1-NE 2.85Å; D362-R365 IonicContact OD1-NH2 3.14Å; D362-R365 PolarHBondContact OD1-NH2 2.9Å; D362-H366 PolarHBondContact O-N 2.89Å
363	E	98	Very high	96.9	Very high	87 Å²	87	43.3 Å²	43.3	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-57.2	-36.6	173.5	-171.7	-176.9	-179.9	0	0	112.1	M177 K180 F361 R365 H366 C369	M177-E363 HydrophobicContact CE-CG 3.96Å; M177-E363 WeakPolarHBondContact CE-OE1 3.33Å; K180-E363 HydrophobicContact CD-CB 4.29Å; K180-E363 WeakPolarHBondContact CD-OE2 3.29Å; K180-E363 VanDerWaalsContact CE-OE2 3.28Å; K180-E363 WeakPolarHBondContact CE-OE2 3.46Å; K180-E363 IonicContact NZ-OE2 2.85Å; K180-E363 PolarHBondContact NZ-OE2 3.28Å; F361-E363 PolarHBondContact O-N 2.71Å; E363-R365 VanDerWaalsContact C-N 3.28Å; E363-R365 PolarHBondContact O-N 3.47Å; E363-H366 WeakPolarHBondContact O-CB 3.34Å; E363-H366 PolarHBondContact O-N 2.91Å; E363-C369 WeakPolarHBondContact O-CB 3.3Å; E363-C369 PolarHBondContact O-SG 2.82Å
364	L	98.2	Very high	96.6	Very high	1 Å²	1	46 Å²	46	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-30.6	176.6	-55.9	-177.5	0	0	0	111.7	M177 K180 L181 Y184 F361 D362 H366 L380 F381	M177-L364 HydrophobicContact SD-CD2 3.59Å; M177-L364 VanDerWaalsContact SD-CD2 3.59Å; K180-L364 HydrophobicContact CB-CD1 4.11Å; K180-L364 HydrophobicContact CB-CD2 3.99Å; K180-L364 HydrophobicContact CB-CG 4.15Å; L181-L364 HydrophobicContact CD2-CD1 4.47Å; L181-L364 HydrophobicContact CD2-CD2 3.91Å; L181-L364 HydrophobicContact CG-CD2 3.94Å; Y184-L364 HydrophobicContact CD2-CD1 4.27Å; Y184-L364 HydrophobicContact CG-CD1 4.01Å; F361-L364 HydrophobicContact CB-CD1 4.3Å; F361-L364 HydrophobicContact CD1-CD1 3.92Å; F361-L364 WeakPolarHBondContact O-CB 3.33Å; F361-L364 PolarHBondContact O-N 3.33Å; D362-L364 PolarHBondContact O-N 3.24Å; L364-H366 VanDerWaalsContact C-N 3.29Å; L364-L380 HydrophobicContact CB-CD1 3.75Å; L364-L380 HydrophobicContact CD1-CD1 3.94Å; L364-L380 HydrophobicContact CD2-CD1 4.46Å; L364-L380 HydrophobicContact CG-CD1 4.27Å; L364-F381 WeakPolarHBondContact O-CZ 3.33Å
365	R	97.9	Very high	96.3	Very high	21 Å²	21	47.8 Å²	47.8	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-78	-9.8	179.5	-69.6	-178.4	-85.5	-91.6	5.6	113.1	C356 H358 D362 E363 F381 I397 P400 H402	C356-R365 PolarHBondContact O-NH1 2.96Å; H358-R365 PolarHBondContact O-NH2 2.83Å; D362-R365 WeakPolarHBondContact O-CA 3.28Å; D362-R365 WeakPolarHBondContact O-CB 3.44Å; D362-R365 PolarHBondContact O-N 2.93Å; D362-R365 IonicContact OD1-CZ 3.84Å; D362-R365 VanDerWaalsContact OD1-CZ 3.24Å; D362-R365 IonicContact OD1-NE 2.96Å; D362-R365 PolarHBondContact OD1-NE 2.85Å; D362-R365 IonicContact OD1-NH2 3.14Å; D362-R365 PolarHBondContact OD1-NH2 2.9Å; E363-R365 VanDerWaalsContact C-N 3.28Å; E363-R365 PolarHBondContact O-N 3.47Å; R365-F381 HydrophobicContact CG-CE1 3.87Å; R365-F381 HydrophobicContact CG-CZ 4.07Å; R365-I397 WeakPolarHBondContact CD-O 3.48Å; R365-P400 HydrophobicContact CB-CB 4.31Å; R365-P400 HydrophobicContact CB-CG 4.31Å; R365-P400 HydrophobicContact CG-CG 4.42Å; R365-H402 PolarHBondContact O-NE2 2.84Å
366	H	96.6	Very high	96.1	Very high	105 Å²	105	53.1 Å²	53.1	49%	0.486	29%	0.285	S	S	.	.	S	Bend	trans	-70.6	132.4	176.7	-163.4	-89.4	0	0	0	111.4	D362 E363 L364 D368 C369	D362-H366 PolarHBondContact O-N 2.89Å; E363-H366 WeakPolarHBondContact O-CB 3.34Å; E363-H366 PolarHBondContact O-N 2.91Å; L364-H366 VanDerWaalsContact C-N 3.29Å; H366-D368 IonicContact CE1-OD2 2.95Å; H366-D368 PolarHBondContact CE1-OD2 3.48Å; H366-D368 VanDerWaalsContact CE1-OD2 3.26Å; H366-D368 PolarHBondContact ND1-N 2.66Å; H366-D368 IonicContact ND1-OD2 3.28Å; H366-D368 PolarHBondContact O-N 2.83Å; H366-C369 HydrophobicContact CB-CB 4.31Å; H366-C369 WeakPolarHBondContact O-CB 3.4Å; H366-C369 PolarHBondContact O-N 3.38Å
367	P	94.7	Very high	96	Very high	59 Å²	59	54.8 Å²	54.8	38%	0.383	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.8	-175.2	23	-34	0	0	0	113.8	C369 R370 H402	P367-C369 VanDerWaalsContact C-N 3.35Å; P367-R370 PolarHBondContact O-NH1 3.12Å; P367-H402 HydrophobicContact CB-CB 4.44Å
368	D	94.9	Very high	96	Very high	111 Å²	111	54.5 Å²	54.5	59%	0.594	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	6.7	179.2	-51.8	-61.7	0	0	0	113.8	H366 R370	H366-D368 IonicContact CE1-OD2 2.95Å; H366-D368 PolarHBondContact CE1-OD2 3.48Å; H366-D368 VanDerWaalsContact CE1-OD2 3.26Å; H366-D368 PolarHBondContact ND1-N 2.66Å; H366-D368 IonicContact ND1-OD2 3.28Å; H366-D368 PolarHBondContact O-N 2.83Å; D368-R370 VanDerWaalsContact C-NH1 3.34Å; D368-R370 PolarHBondContact O-N 3.03Å
369	C	96.6	Very high	95.8	Very high	13 Å²	13	57.3 Å²	57.3	9%	0.088	31%	0.31	C	S	.	.			trans	-67.1	132	177.2	-165.2	0	0	0	0	111.4	M177 E363 H366 P367 L377	M177-C369 WeakPolarHBondContact CE-SG 3.49Å; E363-C369 WeakPolarHBondContact O-CB 3.3Å; E363-C369 PolarHBondContact O-SG 2.82Å; H366-C369 HydrophobicContact CB-CB 4.31Å; H366-C369 WeakPolarHBondContact O-CB 3.4Å; H366-C369 PolarHBondContact O-N 3.38Å; P367-C369 VanDerWaalsContact C-N 3.35Å; C369-L377 HydrophobicContact CB-CD1 3.97Å
370	R	95.8	Very high	95.8	Very high	90 Å²	90	55 Å²	55	34%	0.34	29%	0.294	S	S	.	.			trans	-138.4	162.2	-177	-61.8	-63.4	177.1	-84.6	-7.7	110.4	P367 D368 R375	P367-R370 PolarHBondContact O-NH1 3.12Å; D368-R370 VanDerWaalsContact C-NH1 3.34Å; D368-R370 PolarHBondContact O-N 3.03Å; R370-R375 WeakPolarHBondContact CB-O 3.2Å
371	L	94.5	Very high	95.7	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.037	30%	0.299	C	S	.	.			trans	-66	154.7	171.1	-66.8	-179.2	0	0	0	110.5	L181 A215 N373 G374 R375 E376 L377	L181-L371 HydrophobicContact CD1-CD2 3.34Å; A215-L371 HydrophobicContact CB-CD1 4.27Å; A215-L371 HydrophobicContact CB-CD2 3.79Å; L371-N373 WeakPolarHBondContact CB-OD1 3.21Å; L371-N373 PolarHBondContact O-N 3.36Å; L371-G374 PolarHBondContact O-N 3.47Å; L371-R375 HydrophobicContact CB-CB 4.48Å; L371-R375 HydrophobicContact CD1-CB 4.16Å; L371-R375 PolarHBondContact N-O 3.2Å; L371-E376 WeakPolarHBondContact CD1-O 3.3Å; L371-L377 HydrophobicContact CD2-CD2 3.88Å; L371-L377 HydrophobicContact CG-CD2 4.18Å
372	P	91.2	Very high	95.6	Very high	77 Å²	77	59.3 Å²	59.3	50%	0.5	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.7	178.7	-25.8	36.2	0	0	0	115.5	M177 Y178	M177-P372 HydrophobicContact CB-CG 4.17Å; M177-P372 HydrophobicContact CG-CG 4.27Å; Y178-P372 HydrophobicContact CE1-CG 4.4Å; Y178-P372 HydrophobicContact CE2-CG 3.95Å
373	N	89.2	Confident	95.6	Very high	81 Å²	81	55.9 Å²	55.9	43%	0.433	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	7.8	173.8	63.8	10.6	0	0	0	113.4	L371 R375	L371-N373 WeakPolarHBondContact CB-OD1 3.21Å; L371-N373 PolarHBondContact O-N 3.36Å; N373-R375 VanDerWaalsContact C-N 3.32Å; N373-R375 PolarHBondContact O-N 2.78Å; N373-R375 WeakPolarHBondContact OD1-CB 3.37Å; N373-R375 WeakPolarHBondContact OD1-CG 3.48Å; N373-R375 PolarHBondContact OD1-N 3.26Å; N373-R375 VanDerWaalsContact OD1-N 3.1Å
374	G	92.5	Very high	95.4	Very high	58 Å²	58	53.9 Å²	53.9	60%	0.598	29%	0.292	S	S	*	.	S	Bend	trans	82.7	-7.8	-180	0	0	0	0	0	115.9	L371	L371-G374 PolarHBondContact O-N 3.47Å
375	R	93.7	Very high	95.3	Very high	116 Å²	116	59.3 Å²	59.3	44%	0.438	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-68.5	157.6	175.6	-64.6	-179.4	176.1	177.3	-3.6	111.2	E213 R370 L371 N373	E213-R375 PolarHBondContact O-NH1 2.87Å; E213-R375 IonicContact OE2-CZ 2.68Å; E213-R375 VanDerWaalsContact OE2-CZ 3.28Å; E213-R375 IonicContact OE2-NH1 2.76Å; E213-R375 PolarHBondContact OE2-NH1 3.3Å; E213-R375 IonicContact OE2-NH2 2.96Å; E213-R375 PolarHBondContact OE2-NH2 3.14Å; R370-R375 WeakPolarHBondContact CB-O 3.2Å; L371-R375 HydrophobicContact CB-CB 4.48Å; L371-R375 HydrophobicContact CD1-CB 4.16Å; L371-R375 PolarHBondContact N-O 3.2Å; N373-R375 VanDerWaalsContact C-N 3.32Å; N373-R375 PolarHBondContact O-N 2.78Å; N373-R375 WeakPolarHBondContact OD1-CB 3.37Å; N373-R375 WeakPolarHBondContact OD1-CG 3.48Å; N373-R375 PolarHBondContact OD1-N 3.26Å; N373-R375 VanDerWaalsContact OD1-N 3.1Å
376	E	94.7	Very high	95.2	Very high	113 Å²	113	61.7 Å²	61.7	53%	0.528	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-61.2	157.2	169	-71.8	-161.9	126.4	0	0	111.3	L371 R406	L371-E376 WeakPolarHBondContact CD1-O 3.3Å; E376-R406 IonicContact OE1-CZ 3.28Å; E376-R406 IonicContact OE1-NH1 2.75Å; E376-R406 PolarHBondContact OE1-NH1 3.18Å; E376-R406 IonicContact OE1-NH2 2.83Å
377	L	96.9	Very high	95.2	Very high	34 Å²	34	56.8 Å²	56.8	18%	0.178	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-67.8	153.8	172.3	-56.8	-175.4	0	0	0	110.7	M177 L181 C369 L371 L380	M177-L377 HydrophobicContact SD-CD2 4.42Å; L181-L377 HydrophobicContact CD1-CD2 4.34Å; L181-L377 HydrophobicContact CD2-CD2 4.33Å; C369-L377 HydrophobicContact CB-CD1 3.97Å; L371-L377 HydrophobicContact CD2-CD2 3.88Å; L371-L377 HydrophobicContact CG-CD2 4.18Å; L377-L380 HydrophobicContact CD1-CD1 3.96Å
378	P	96.7	Very high	95.3	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.084	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-61.8	163.3	167.3	28.3	-35.1	0	0	0	111.3	L181 T214 V216 L380	L181-P378 HydrophobicContact CD2-CG 4.23Å; T214-P378 WeakPolarHBondContact O-CD 3.06Å; V216-P378 HydrophobicContact CG2-CB 3.63Å; P378-L380 HydrophobicContact CG-CD2 4.25Å; P378-L380 WeakPolarHBondContact O-CG 3.48Å; P378-L380 PolarHBondContact O-N 2.96Å
379	P	96.1	Very high	95.5	Very high	79 Å²	79	57.1 Å²	57.1	51%	0.513	30%	0.304	S	S	.	.			trans	-60.9	104.7	-179.6	-25	35.9	0	0	0	113.1	Q128 N382	Q128-P379 PolarHBondContact OE1-O 3.45Å; P379-N382 VanDerWaalsContact CB-ND2 3.33Å; P379-N382 WeakPolarHBondContact CB-ND2 3.43Å; P379-N382 PolarHBondContact O-OD1 2.77Å
380	L	97.8	Very high	95.5	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.026	31%	0.314	C	S	.	.			trans	-95.7	-33.1	-178.5	-61.6	-170.6	0	0	0	113.8	L181 Y184 Q185 R188 L364 L377 P378	L181-L380 HydrophobicContact CD2-CD1 3.98Å; L181-L380 HydrophobicContact CD2-CD2 4.04Å; Y184-L380 HydrophobicContact CD1-CB 4.47Å; Y184-L380 HydrophobicContact CD1-CD2 4Å; Y184-L380 HydrophobicContact CE1-CB 3.84Å; Y184-L380 HydrophobicContact CE1-CD2 4.2Å; Y184-L380 HydrophobicContact CE1-CG 4.41Å; Y184-L380 PolarHBondContact OH-O 2.99Å; Q185-L380 HydrophobicContact CG-CD2 4.25Å; R188-L380 PolarHBondContact NH1-O 3.48Å; L364-L380 HydrophobicContact CB-CD1 3.75Å; L364-L380 HydrophobicContact CD1-CD1 3.94Å; L364-L380 HydrophobicContact CD2-CD1 4.46Å; L364-L380 HydrophobicContact CG-CD1 4.27Å; L377-L380 HydrophobicContact CD1-CD1 3.96Å; P378-L380 HydrophobicContact CG-CD2 4.25Å; P378-L380 WeakPolarHBondContact O-CG 3.48Å; P378-L380 PolarHBondContact O-N 2.96Å
381	F	97.7	Very high	95.6	Very high	25 Å²	25	57.2 Å²	57.2	11%	0.11	31%	0.309	C	S	.	.	S	Bend	trans	-109.5	4.8	-165.9	-46.3	-56.3	0	0	0	114.5	L364 R365 F383 L398 P400 A403	L364-F381 WeakPolarHBondContact O-CZ 3.33Å; R365-F381 HydrophobicContact CG-CE1 3.87Å; R365-F381 HydrophobicContact CG-CZ 4.07Å; F381-F383 PolarHBondContact O-N 3.15Å; F381-L398 VanDerWaalsContact CD1-O 3.29Å; F381-L398 WeakPolarHBondContact CD1-O 3.42Å; F381-P400 HydrophobicContact CD1-CG 4.28Å; F381-P400 HydrophobicContact CD2-CG 3.94Å; F381-P400 HydrophobicContact CE1-CG 4.29Å; F381-P400 HydrophobicContact CE2-CG 3.93Å; F381-P400 HydrophobicContact CG-CG 4.12Å; F381-P400 HydrophobicContact CZ-CG 4.12Å; F381-A403 HydrophobicContact CB-CB 3.77Å; F381-A403 HydrophobicContact CD2-CB 3.79Å; F381-A403 HydrophobicContact CG-CB 4.05Å
382	N	96.5	Very high	95.7	Very high	68 Å²	68	60.7 Å²	60.7	36%	0.364	33%	0.332	S	S	.	.			trans	-77.1	64.7	169.5	61.8	-17.1	0	0	0	110.4	Q128 R188 P379	Q128-N382 VanDerWaalsContact NE2-CG 3.3Å; Q128-N382 PolarHBondContact NE2-ND2 3.09Å; Q128-N382 PolarHBondContact NE2-OD1 2.93Å; Q128-N382 PolarHBondContact OE1-ND2 3.17Å; Q128-N382 PolarHBondContact OE1-OD1 3.45Å; R188-N382 PolarHBondContact NH1-OD1 3.23Å; R188-N382 PolarHBondContact NH2-O 3.38Å; P379-N382 VanDerWaalsContact CB-ND2 3.33Å; P379-N382 WeakPolarHBondContact CB-ND2 3.43Å; P379-N382 PolarHBondContact O-OD1 2.77Å
383	F	97.1	Very high	96	Very high	11 Å²	11	61.8 Å²	61.8	5%	0.048	34%	0.341	C	S	.	.			trans	-71	133.9	170.6	-68.5	-87.2	0	0	0	110	Y184 R188 L353 F381 E387 L388 L398 I399	Y184-F383 WeakPolarHBondContact OH-CZ 3.37Å; R188-F383 HydrophobicContact CG-CE1 3.88Å; R188-F383 HydrophobicContact CG-CZ 4.27Å; L353-F383 HydrophobicContact CD2-CE1 4.13Å; F381-F383 PolarHBondContact O-N 3.15Å; F383-E387 HydrophobicContact CB-CB 4.21Å; F383-E387 HydrophobicContact CD1-CB 3.94Å; F383-E387 HydrophobicContact CD1-CG 4.41Å; F383-L388 HydrophobicContact CB-CD1 4.29Å; F383-L388 HydrophobicContact CB-CD2 3.68Å; F383-L388 HydrophobicContact CB-CG 3.73Å; F383-L388 HydrophobicContact CG-CD2 4.27Å; F383-L398 HydrophobicContact CD2-CB 4.5Å; F383-L398 HydrophobicContact CE2-CB 3.83Å; F383-L398 HydrophobicContact CZ-CB 3.97Å; F383-L398 HydrophobicContact CZ-CD1 4.42Å; F383-L398 HydrophobicContact CZ-CD2 4.09Å; F383-L398 HydrophobicContact CZ-CG 4.39Å; F383-I399 HydrophobicContact CD2-CD1 4.41Å; F383-I399 HydrophobicContact CD2-CG1 3.88Å; F383-I399 HydrophobicContact CE2-CG1 4.42Å
384	S	95.1	Very high	96.5	Very high	44 Å²	44	59.1 Å²	59.1	31%	0.308	33%	0.327	S	S	.	.			trans	-72.3	160.1	174.5	59.1	0	0	0	0	112.3	L386 E387 L388	S384-L386 PolarHBondContact O-N 2.94Å; S384-E387 WeakPolarHBondContact CB-OE2 3.47Å; S384-E387 PolarHBondContact N-OE2 2.63Å; S384-E387 PolarHBondContact O-N 2.91Å; S384-E387 WeakPolarHBondContact OG-CG 3.2Å; S384-E387 PolarHBondContact OG-N 3.35Å; S384-E387 PolarHBondContact OG-OE2 2.65Å; S384-L388 WeakPolarHBondContact O-CG 3.49Å; S384-L388 PolarHBondContact O-N 2.73Å
385	D	95.4	Very high	96.7	Very high	115 Å²	115	58 Å²	58	62%	0.615	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-26.6	170.2	-116	49	0	0	0	114.1	K389	D385-K389 WeakPolarHBondContact O-CD 3.29Å; D385-K389 WeakPolarHBondContact O-CE 3.14Å; D385-K389 VanDerWaalsContact O-CG 3.23Å; D385-K389 WeakPolarHBondContact O-CG 3.38Å; D385-K389 PolarHBondContact O-NZ 2.91Å; D385-K389 IonicContact OD2-NZ 2.86Å; D385-K389 PolarHBondContact OD2-NZ 2.58Å
386	L	95.7	Very high	96.8	Very high	71 Å²	71	57.7 Å²	57.7	37%	0.372	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-50.7	174	179.4	62.3	0	0	0	110.8	Y192 L196 S384 L388 K389	Y192-L386 HydrophobicContact CD2-CD2 4.18Å; Y192-L386 HydrophobicContact CE2-CD2 3.91Å; L196-L386 HydrophobicContact CD2-CD2 3.98Å; S384-L386 PolarHBondContact O-N 2.94Å; L386-L388 VanDerWaalsContact C-N 3.32Å; L386-L388 PolarHBondContact O-N 2.94Å; L386-K389 PolarHBondContact O-N 2.89Å; L386-K389 VanDerWaalsContact O-N 3.15Å
387	E	97.3	Very high	97	Very high	3 Å²	3	56.2 Å²	56.2	1%	0.014	32%	0.315	C	S	.	.	H	α-helix	trans	-57.2	-43.9	178.5	-74.4	162.7	105.3	0	0	112.1	H127 R188 F383 S384 K389 I390	H127-E387 IonicContact CD2-OE1 2.69Å; H127-E387 IonicContact CD2-OE2 3.83Å; H127-E387 IonicContact NE2-OE1 3.33Å; H127-E387 PolarHBondContact NE2-OE1 3.03Å; H127-E387 IonicContact NE2-OE2 2.81Å; H127-E387 PolarHBondContact NE2-OE2 3.49Å; R188-E387 IonicContact CZ-OE1 3.26Å; R188-E387 VanDerWaalsContact CZ-OE1 3.28Å; R188-E387 IonicContact NE-OE1 3.38Å; R188-E387 PolarHBondContact NE-OE1 2.86Å; R188-E387 VanDerWaalsContact NH2-CD 3.34Å; R188-E387 IonicContact NH2-OE1 3.73Å; R188-E387 PolarHBondContact NH2-OE1 2.84Å; R188-E387 IonicContact NH2-OE2 2.65Å; R188-E387 PolarHBondContact NH2-OE2 3.37Å; R188-E387 VanDerWaalsContact NH2-OE2 3.12Å; F383-E387 HydrophobicContact CB-CB 4.21Å; F383-E387 HydrophobicContact CD1-CB 3.94Å; F383-E387 HydrophobicContact CD1-CG 4.41Å; S384-E387 WeakPolarHBondContact CB-OE2 3.47Å; S384-E387 PolarHBondContact N-OE2 2.63Å; S384-E387 PolarHBondContact O-N 2.91Å; S384-E387 WeakPolarHBondContact OG-CG 3.2Å; S384-E387 PolarHBondContact OG-N 3.35Å; S384-E387 PolarHBondContact OG-OE2 2.65Å; E387-K389 PolarHBondContact O-N 3.32Å; E387-I390 WeakPolarHBondContact O-CB 3.48Å; E387-I390 WeakPolarHBondContact O-CG1 3.3Å; E387-I390 PolarHBondContact O-N 3.49Å; E387-I390 VanDerWaalsContact O-N 3.15Å
388	L	96.5	Very high	97	Very high	39 Å²	39	54.6 Å²	54.6	20%	0.204	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-14.6	-178.7	-67.7	174	0	0	0	114.2	F383 S384 L386 N395 I399	F383-L388 HydrophobicContact CB-CD1 4.29Å; F383-L388 HydrophobicContact CB-CD2 3.68Å; F383-L388 HydrophobicContact CB-CG 3.73Å; F383-L388 HydrophobicContact CG-CD2 4.27Å; S384-L388 WeakPolarHBondContact O-CG 3.49Å; S384-L388 PolarHBondContact O-N 2.73Å; L386-L388 VanDerWaalsContact C-N 3.32Å; L386-L388 PolarHBondContact O-N 2.94Å; L388-N395 HydrophobicContact CD2-CB 4.18Å; L388-N395 PolarHBondContact O-ND2 3.42Å; L388-I399 HydrophobicContact CD1-CD1 4.34Å; L388-I399 HydrophobicContact CD2-CD1 3.84Å
389	K	97.6	Very high	97	Very high	137 Å²	137	55.3 Å²	55.3	60%	0.596	31%	0.309	S	S	*	.	H	α-helix	trans	-92.4	-11.2	176	-70.9	168	-162.7	147.5	0	113.1	D385 L386 E387	D385-K389 WeakPolarHBondContact O-CD 3.29Å; D385-K389 WeakPolarHBondContact O-CE 3.14Å; D385-K389 VanDerWaalsContact O-CG 3.23Å; D385-K389 WeakPolarHBondContact O-CG 3.38Å; D385-K389 PolarHBondContact O-NZ 2.91Å; D385-K389 IonicContact OD2-NZ 2.86Å; D385-K389 PolarHBondContact OD2-NZ 2.58Å; L386-K389 PolarHBondContact O-N 2.89Å; L386-K389 VanDerWaalsContact O-N 3.15Å; E387-K389 PolarHBondContact O-N 3.32Å
390	I	97.4	Very high	97	Very high	56 Å²	56	52.4 Å²	52.4	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-53.6	-178.7	-58.4	170.6	0	0	0	111	A191 L353 E387	A191-I390 HydrophobicContact CB-CD1 4.18Å; A191-I390 WeakPolarHBondContact O-CD1 3.23Å; L353-I390 HydrophobicContact CD1-CB 3.72Å; L353-I390 HydrophobicContact CD1-CD1 4.21Å; L353-I390 HydrophobicContact CD1-CG2 3.99Å; E387-I390 WeakPolarHBondContact O-CB 3.48Å; E387-I390 WeakPolarHBondContact O-CG1 3.3Å; E387-I390 PolarHBondContact O-N 3.49Å; E387-I390 VanDerWaalsContact O-N 3.15Å
391	Q	97.3	Very high	96.8	Very high	49 Å²	49	56.8 Å²	56.8	23%	0.229	32%	0.322	C	S	.	.	S	Bend	trans	-142.5	77.2	178.3	-76.6	175	-79.7	0	0	110.4	S351 L353 S393 L394	S351-Q391 PolarHBondContact OG-NE2 3.41Å; S351-Q391 PolarHBondContact OG-OE1 3.34Å; L353-Q391 HydrophobicContact CD1-CB 4.35Å; Q391-S393 PolarHBondContact O-N 2.82Å; Q391-L394 HydrophobicContact CB-CD1 3.83Å; Q391-L394 HydrophobicContact CB-CG 4.15Å; Q391-L394 PolarHBondContact O-N 3.1Å
392	P	97.7	Very high	96.6	Very high	80 Å²	80	58.1 Å²	58.1	52%	0.519	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-58.4	-25.4	-169.1	-27.3	35.4	0	0	0	115.7	L394 N395	P392-L394 PolarHBondContact O-N 2.86Å; P392-N395 WeakPolarHBondContact O-CB 3.15Å; P392-N395 VanDerWaalsContact O-CG 3.3Å; P392-N395 PolarHBondContact O-N 3.36Å
393	S	97.8	Very high	96.3	Very high	101 Å²	101	55.4 Å²	55.4	71%	0.706	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-65.3	-17.4	176	51.7	0	0	0	0	114.2	Q391	Q391-S393 PolarHBondContact O-N 2.82Å
394	L	98	Very high	95.7	Very high	24 Å²	24	59 Å²	59	13%	0.126	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-88.4	-16	176.4	-58.6	178.6	0	0	0	112.8	L353 Q354 A357 Q391 P392 P396 I397 L398	L353-L394 HydrophobicContact CB-CD1 3.78Å; Q354-L394 HydrophobicContact CG-CD1 3.93Å; A357-L394 HydrophobicContact CB-CD2 4.28Å; Q391-L394 HydrophobicContact CB-CD1 3.83Å; Q391-L394 HydrophobicContact CB-CG 4.15Å; Q391-L394 PolarHBondContact O-N 3.1Å; P392-L394 PolarHBondContact O-N 2.86Å; L394-P396 VanDerWaalsContact C-CD 3.44Å; L394-P396 VanDerWaalsContact C-N 3.35Å; L394-I397 PolarHBondContact O-N 2.94Å; L394-L398 HydrophobicContact CB-CD1 3.76Å; L394-L398 HydrophobicContact CB-CG 4.12Å; L394-L398 WeakPolarHBondContact O-CG 3.36Å; L394-L398 PolarHBondContact O-N 2.9Å
395	N	97.6	Very high	94.4	Very high	35 Å²	35	63.7 Å²	63.7	19%	0.187	36%	0.36	C	S	.	.	H	α-helix	trans	-54.8	-39.3	-173.5	-62.6	-6.8	0	0	0	113.9	L388 P392 I397 L398 I399	L388-N395 HydrophobicContact CD2-CB 4.18Å; L388-N395 PolarHBondContact O-ND2 3.42Å; P392-N395 WeakPolarHBondContact O-CB 3.15Å; P392-N395 VanDerWaalsContact O-CG 3.3Å; P392-N395 PolarHBondContact O-N 3.36Å; N395-I397 PolarHBondContact O-N 3.15Å; N395-L398 PolarHBondContact O-N 3.35Å; N395-I399 PolarHBondContact O-N 2.97Å
396	P	96.8	Very high	92.8	Very high	109 Å²	109	66.1 Å²	66.1	71%	0.708	36%	0.36	S	S	*	.	H	α-helix	trans	-67	-17.8	175.7	-21.3	34.6	0	0	0	115.2	L394	L394-P396 VanDerWaalsContact C-CD 3.44Å; L394-P396 VanDerWaalsContact C-N 3.35Å
397	I	97.5	Very high	90.7	Very high	82 Å²	82	67.6 Å²	67.6	42%	0.421	37%	0.365	S	S	.	.	H	α-helix	trans	-93.1	-38.2	174.3	-54.6	173.2	0	0	0	109.8	A357 R365 L394 N395	A357-I397 HydrophobicContact CB-CB 4.41Å; A357-I397 HydrophobicContact CB-CG2 4Å; R365-I397 WeakPolarHBondContact CD-O 3.48Å; L394-I397 PolarHBondContact O-N 2.94Å; N395-I397 PolarHBondContact O-N 3.15Å
398	L	97.6	Very high	88	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-71.8	-36.7	-176.7	-68.5	173	0	0	0	113.2	L353 C356 A357 F381 F383 L394 N395	L353-L398 HydrophobicContact CB-CD1 4.39Å; L353-L398 HydrophobicContact CD1-CD1 4.32Å; L353-L398 HydrophobicContact CD2-CD1 4.14Å; C356-L398 HydrophobicContact CB-CD2 3.48Å; C356-L398 VanDerWaalsContact CB-CD2 3.48Å; A357-L398 HydrophobicContact CB-CD2 4.04Å; F381-L398 VanDerWaalsContact CD1-O 3.29Å; F381-L398 WeakPolarHBondContact CD1-O 3.42Å; F383-L398 HydrophobicContact CD2-CB 4.5Å; F383-L398 HydrophobicContact CE2-CB 3.83Å; F383-L398 HydrophobicContact CZ-CB 3.97Å; F383-L398 HydrophobicContact CZ-CD1 4.42Å; F383-L398 HydrophobicContact CZ-CD2 4.09Å; F383-L398 HydrophobicContact CZ-CG 4.39Å; L394-L398 HydrophobicContact CB-CD1 3.76Å; L394-L398 HydrophobicContact CB-CG 4.12Å; L394-L398 WeakPolarHBondContact O-CG 3.36Å; L394-L398 PolarHBondContact O-N 2.9Å; N395-L398 PolarHBondContact O-N 3.35Å
399	I	97.3	Very high	85.2	Confident	28 Å²	28	76.8 Å²	76.8	14%	0.144	43%	0.43	C	S	.	.	S	Bend	trans	-107.3	105.9	177.1	-57.9	177.2	0	0	0	109.2	F383 L388 N395 A403 V404	F383-I399 HydrophobicContact CD2-CD1 4.41Å; F383-I399 HydrophobicContact CD2-CG1 3.88Å; F383-I399 HydrophobicContact CE2-CG1 4.42Å; L388-I399 HydrophobicContact CD1-CD1 4.34Å; L388-I399 HydrophobicContact CD2-CD1 3.84Å; N395-I399 PolarHBondContact O-N 2.97Å; I399-A403 HydrophobicContact CG2-CB 4.22Å; I399-V404 HydrophobicContact CG2-CG2 3.68Å
400	P	95.8	Very high	82.4	Confident	18 Å²	18	73.1 Å²	73.1	12%	0.117	43%	0.431	C	S	.	.			trans	-69.5	150.3	173.4	30.2	-34.2	0	0	0	110.9	R365 F381 H402 A403	R365-P400 HydrophobicContact CB-CB 4.31Å; R365-P400 HydrophobicContact CB-CG 4.31Å; R365-P400 HydrophobicContact CG-CG 4.42Å; F381-P400 HydrophobicContact CD1-CG 4.28Å; F381-P400 HydrophobicContact CD2-CG 3.94Å; F381-P400 HydrophobicContact CE1-CG 4.29Å; F381-P400 HydrophobicContact CE2-CG 3.93Å; F381-P400 HydrophobicContact CG-CG 4.12Å; F381-P400 HydrophobicContact CZ-CG 4.12Å; P400-H402 VanDerWaalsContact C-N 3.26Å; P400-H402 WeakPolarHBondContact CG-NE2 3.45Å; P400-H402 PolarHBondContact O-N 2.87Å; P400-H402 VanDerWaalsContact O-N 3.12Å; P400-A403 HydrophobicContact CG-CB 4.03Å; P400-A403 WeakPolarHBondContact O-CB 3.21Å; P400-A403 PolarHBondContact O-N 3.3Å
401	S	93.8	Very high	79.3	Confident	98 Å²	98	79.6 Å²	79.6	69%	0.685	46%	0.46	S	S	*	.	H	α-helix	trans	-55.3	-35.1	-172.7	53.7	0	0	0	0	114.6	A403 V404	S401-A403 VanDerWaalsContact C-N 3.27Å; S401-A403 PolarHBondContact O-N 3.11Å; S401-V404 PolarHBondContact O-N 2.94Å
402	H	92.7	Very high	76.4	Confident	52 Å²	52	84.4 Å²	84.4	24%	0.241	49%	0.488	C	S	.	.	H	α-helix	trans	-67.5	-24.7	176.7	66.4	81.3	0	0	0	113.8	R365 P367 P400	R365-H402 PolarHBondContact O-NE2 2.84Å; P367-H402 HydrophobicContact CB-CB 4.44Å; P400-H402 VanDerWaalsContact C-N 3.26Å; P400-H402 WeakPolarHBondContact CG-NE2 3.45Å; P400-H402 PolarHBondContact O-N 2.87Å; P400-H402 VanDerWaalsContact O-N 3.12Å
403	A	91.2	Very high	73.4	Confident	12 Å²	12	88.4 Å²	88.4	10%	0.099	50%	0.504	C	S	.	.	H	α-helix	trans	-79.5	-29.6	178.2	0	0	0	0	0	112.4	F381 I399 P400 S401 N405 R406 Q407	F381-A403 HydrophobicContact CB-CB 3.77Å; F381-A403 HydrophobicContact CD2-CB 3.79Å; F381-A403 HydrophobicContact CG-CB 4.05Å; I399-A403 HydrophobicContact CG2-CB 4.22Å; P400-A403 HydrophobicContact CG-CB 4.03Å; P400-A403 WeakPolarHBondContact O-CB 3.21Å; P400-A403 PolarHBondContact O-N 3.3Å; S401-A403 VanDerWaalsContact C-N 3.27Å; S401-A403 PolarHBondContact O-N 3.11Å; A403-N405 VanDerWaalsContact C-N 3.3Å; A403-N405 PolarHBondContact O-N 3.2Å; A403-R406 PolarHBondContact O-N 2.9Å; A403-R406 VanDerWaalsContact O-N 3.14Å; A403-Q407 PolarHBondContact O-N 2.88Å
404	V	83.8	Confident	70.4	Confident	85 Å²	85	92.8 Å²	92.8	52%	0.515	51%	0.514	S	S	.	.	H	α-helix	trans	-57.4	-47.3	173.6	-175.4	0	0	0	0	109.9	I399 S401 R406 Q407	I399-V404 HydrophobicContact CG2-CG2 3.68Å; S401-V404 PolarHBondContact O-N 2.94Å; V404-R406 PolarHBondContact O-N 2.68Å; V404-Q407 PolarHBondContact O-N 2.88Å
405	N	68.1	Low	67.7	Low	144 Å²	144	95.5 Å²	95.5	77%	0.77	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.5	-179.5	-62.9	-8.4	0	0	0	114.3	A403	A403-N405 VanDerWaalsContact C-N 3.3Å; A403-N405 PolarHBondContact O-N 3.2Å
406	R	61	Low	64.9	Low	165 Å²	165	100.1 Å²	100.1	62%	0.623	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-9	176.9	-75.7	-168.5	179.7	-153.2	4.2	113.6	E376 A403 V404	E376-R406 IonicContact OE1-CZ 3.28Å; E376-R406 IonicContact OE1-NH1 2.75Å; E376-R406 PolarHBondContact OE1-NH1 3.18Å; E376-R406 IonicContact OE1-NH2 2.83Å; A403-R406 PolarHBondContact O-N 2.9Å; A403-R406 VanDerWaalsContact O-N 3.14Å; V404-R406 PolarHBondContact O-N 2.68Å
407	Q	52.5	Low	62.3	Low	103 Å²	103	101.5 Å²	101.5	48%	0.481	58%	0.578	S	S	.	*	S	Bend	trans	-73.2	134.4	171.5	-63.6	-162.8	6.9	0	0	109.4	A403 V404 S409	A403-Q407 PolarHBondContact O-N 2.88Å; V404-Q407 PolarHBondContact O-N 2.88Å; Q407-S409 PolarHBondContact O-N 2.87Å; Q407-S409 VanDerWaalsContact O-N 3.17Å
408	P	39.5	Very low	59.4	Low	126 Å²	126	103.4 Å²	103.4	82%	0.818	60%	0.599	S	S	*	*			trans	-64.1	120.7	176	27	-33	0	0	0	108.7	G410	P408-G410 PolarHBondContact O-N 3.14Å
409	S	38	Very low	56.7	Low	108 Å²	108	107 Å²	107	76%	0.755	64%	0.635	S	S	*	*			trans	-61.5	105.9	177.9	53.8	0	0	0	0	109.9	Q407	Q407-S409 PolarHBondContact O-N 2.87Å; Q407-S409 VanDerWaalsContact O-N 3.17Å
410	G	38.4	Very low	53.9	Low	60 Å²	60	113.3 Å²	113.3	62%	0.619	67%	0.67	S	S	*	*			trans	-52.8	145.3	165.6	0	0	0	0	0	109.8	P408 N412	P408-G410 PolarHBondContact O-N 3.14Å; G410-N412 PolarHBondContact O-N 3.05Å
411	Q	32.4	Very low	51.7	Low	193 Å²	193	119 Å²	119	90%	0.902	70%	0.703	S	S	*	*			trans	-51	105.6	-167.9	-68.3	161.7	-49	0	0	112.1	N413	Q411-N413 PolarHBondContact O-N 3.03Å
412	N	36.2	Very low	49.2	Very low	150 Å²	150	117.9 Å²	117.9	80%	0.802	71%	0.708	S	S	*	*			trans	-67.4	128.9	167.3	-88.1	-27.4	0	0	0	108.3	G410 E414	G410-N412 PolarHBondContact O-N 3.05Å; N412-E414 PolarHBondContact O-N 2.83Å
413	N	34.9	Very low	46.6	Very low	163 Å²	163	120.1 Å²	120.1	87%	0.872	74%	0.735	S	S	*	*			trans	-58.5	129.1	-179.9	-64.4	-59.2	0	0	0	111	Q411 A415	Q411-N413 PolarHBondContact O-N 3.03Å; N413-A415 PolarHBondContact O-N 2.75Å
414	E	35.1	Very low	44.5	Very low	193 Å²	193	125.5 Å²	125.5	90%	0.902	77%	0.772	S	S	*	*			trans	-68.4	114.1	167	-67.1	-172	138.4	0	0	109.4	N412	N412-E414 PolarHBondContact O-N 2.83Å
415	A	40.7	Very low	42.7	Very low	82 Å²	82	127.1 Å²	127.1	68%	0.678	79%	0.785	S	S	*	*			trans	-79.2	129.2	165.4	0	0	0	0	0	108.7	N413 T417	N413-A415 PolarHBondContact O-N 2.75Å; A415-T417 PolarHBondContact O-N 2.76Å; A415-T417 VanDerWaalsContact O-N 3.15Å
416	P	38.7	Very low	41.5	Very low	132 Å²	132	126.3 Å²	126.3	86%	0.857	79%	0.785	S	S	*	*			trans	-68.8	114.3	-176.6	27	-33.9	0	0	0	110.8	S418	P416-S418 PolarHBondContact O-N 3.42Å
417	T	42.4	Very low	40.7	Very low	138 Å²	138	123.6 Å²	123.6	85%	0.847	79%	0.787	S	S	*	*			trans	-74.6	119.7	176.3	41.7	0	0	0	0	110.8	A415 G419	A415-T417 PolarHBondContact O-N 2.76Å; A415-T417 VanDerWaalsContact O-N 3.15Å; T417-G419 PolarHBondContact O-N 2.72Å
418	S	38.1	Very low	40.3	Very low	122 Å²	122	127.2 Å²	127.2	85%	0.853	80%	0.804	S	S	*	*			trans	-72.8	90.2	-178.7	55.9	0	0	0	0	112.1	P416 N420	P416-S418 PolarHBondContact O-N 3.42Å; S418-N420 PolarHBondContact O-N 3.02Å
419	G	40.4	Very low	40.6	Very low	74 Å²	74	127.4 Å²	127.4	76%	0.763	80%	0.798	S	S	*	*			trans	-78.2	102.6	174.3	0	0	0	0	0	112.6	T417	T417-G419 PolarHBondContact O-N 2.72Å
420	N	37.4	Very low	40.8	Very low	162 Å²	162	124.9 Å²	124.9	87%	0.866	79%	0.789	S	S	*	*			trans	-86.2	116.1	-179.6	-178.4	20.5	0	0	0	111.8	S418	S418-N420 PolarHBondContact O-N 3.02Å
421	V	50.4	Low	41.1	Very low	136 Å²	136	132.7 Å²	132.7	82%	0.824	80%	0.8	S	S	*	*			trans	-139.9	116.1	177.6	-176.1	0	0	0	0	112.7
422	G	40.8	Very low	41.8	Very low	76 Å²	76	130.1 Å²	130.1	78%	0.784	79%	0.792	S	S	*	*			trans	54.1	95.1	140.2	0	0	0	0	0	119.8
423	A	38.7	Very low	42.1	Very low	98 Å²	98	130.3 Å²	130.3	81%	0.81	79%	0.793	S	S	*	*			trans	-99.4	136.8	162.3	0	0	0	0	0	112
424	S	46.9	Very low	42.5	Very low	126 Å²	126	125.7 Å²	125.7	88%	0.881	78%	0.784	S	S	*	*			trans	-166.7	150.5	144.5	-82.2	0	0	0	0	111.7
425	P	46.8	Very low	42.9	Very low	119 Å²	119	128.2 Å²	128.2	77%	0.773	79%	0.785	S	S	*	*			trans	-132.2	165.7	-160.4	41.8	-25.4	0	0	0	117.4
426	T	42.4	Very low	43.1	Very low	126 Å²	126	135.5 Å²	135.5	77%	0.773	80%	0.795	S	S	*	*			trans	-157.9	118.6	159.5	24.8	0	0	0	0	108.3
427	T	44.2	Very low	43.5	Very low	108 Å²	108	133.6 Å²	133.6	66%	0.663	79%	0.79	S	S	*	*				57.1	138.6	90.8	64	0	0	0	0	115.4
428	E	44.7	Very low	43.6	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	79%	0.787	S	S	*	*			cis	-173.1	167.3	-6.2	-109.2	171.6	-94.1	0	0	106.4
429	D	44.3	Very low	43.9	Very low	130 Å²	130	130.8 Å²	130.8	70%	0.695	78%	0.782	S	S	*	*			cis	-155.2	171.7	-15.1	169.6	45.1	0	0	0	106.2
430	G	43.3	Very low	44.1	Very low	55 Å²	55	132.3 Å²	132.3	57%	0.567	78%	0.781	S	S	*	*			trans	136	98.5	142.9	0	0	0	0	0	118.8
431	R	44.8	Very low	44.6	Very low	223 Å²	223	130.8 Å²	130.8	84%	0.842	78%	0.778	S	S	*	*				34.2	142.9	127.2	-52.2	171.6	-175.3	173	0.5	118.7
432	N	46.2	Very low	44.4	Very low	139 Å²	139	129.5 Å²	129.5	74%	0.743	77%	0.774	S	S	*	*			cis	-166.4	165.1	29.8	-153.9	-4.5	0	0	0	114.2
433	N	43.7	Very low	44.6	Very low	155 Å²	155	131.6 Å²	131.6	83%	0.829	77%	0.774	S	S	*	*			trans	-31.1	153.8	173.1	-75.2	-76.2	0	0	0	122
434	G	42.3	Very low	44.9	Very low	65 Å²	65	135.8 Å²	135.8	67%	0.67	78%	0.777	S	S	*	*				157.3	95.5	117.2	0	0	0	0	0	123.3
435	R	44.6	Very low	45.2	Very low	246 Å²	246	137 Å²	137	93%	0.928	77%	0.774	S	S	*	*			trans	68.2	158.8	149.8	-56.4	174.4	171.6	174.3	-2.8	117
436	R	44.5	Very low	45.3	Very low	236 Å²	236	138.8 Å²	138.8	89%	0.891	77%	0.771	S	S	*	*			cis	-153.4	174.4	-0.6	-140.6	179.8	177.8	-178.6	-2.5	111.6
437	A	46.1	Very low	45.5	Very low	91 Å²	91	140.7 Å²	140.7	75%	0.752	77%	0.771	S	S	*	*			trans	-37.4	171.8	174.3	0	0	0	0	0	119.2
438	S	46	Very low	45.9	Very low	112 Å²	112	145 Å²	145	78%	0.783	81%	0.806	S	S	*	*			cis	-164.7	138.7	19	30.3	0	0	0	0	109.7
439	A	43.5	Very low	46	Very low	90 Å²	90	143.3 Å²	143.3	74%	0.744	81%	0.805	S	S	*	*				91.8	161.9	73.3	0	0	0	0	0	115.9
440	S	45.1	Very low	46.1	Very low	106 Å²	106	144 Å²	144	74%	0.741	81%	0.811	S	S	*	*			trans	83.9	109.5	179.4	81.8	0	0	0	0	116.3
441	T	46.6	Very low	46.2	Very low	130 Å²	130	148.9 Å²	148.9	80%	0.798	82%	0.824	S	S	*	*				74.6	140.9	85.9	57.6	0	0	0	0	115.6
442	S	47	Very low	46.3	Very low	108 Å²	108	144.6 Å²	144.6	76%	0.755	82%	0.823	S	S	*	*			cis	-164.7	162.7	-10.2	-84.7	0	0	0	0	109.7
443	P	45.2	Very low	46.3	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	83%	0.828	S	S	*	*			trans	-109.6	135.6	177.4	37.1	-27.9	0	0	0	114.7
444	E	45.7	Very low	46.5	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	83%	0.828	S	S	*	*			trans	-174	134.3	158.8	-118.2	169.8	-148.8	0	0	110.9
445	N	52.4	Low	46.8	Very low	151 Å²	151	149.9 Å²	149.9	81%	0.807	84%	0.839	S	S	*	*				-178.1	177.8	103.5	-132.5	-51.8	0	0	0	113.3
446	H	48.1	Very low	46.9	Very low	156 Å²	156	142.5 Å²	142.5	72%	0.722	83%	0.832	S	S	*	*			trans	-104.1	160.4	-164.2	-102.7	-57.4	0	0	0	116.3
447	Q	47.8	Very low	47.1	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	83%	0.828	S	S	*	*			trans	66.9	119.9	142.9	-71	167.5	14.5	0	0	121.2
448	S	52.3	Low	47.2	Very low	200 Å²	200	138.7 Å²	138.7	100%	1.399	83%	0.834	S	S	*	*				-145.1	0	129.9	-67.3	0	0	0	0	108.3

Retrieved 448 of 448 residues in 126 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).