A0A087Y8H9_POEFO Loading...

Small ribosomal subunit protein mS29

AlphaFold DB , UniProt , Accession A0A087Y8H9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 395 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	32.8	Very low	251 Å²	251	188.4 Å²	188.4	100%	1.236	90%	0.9	S	S	*	*				0	104.1	0	-71.6	-161	-120.8	0	0	108.4
2	S	33.9	Very low	32.9	Very low	103 Å²	103	182.9 Å²	182.9	72%	0.72	89%	0.891	S	S	*	*			trans	-85.1	138.4	173.6	44.8	0	0	0	0	109.3
3	L	32	Very low	32.7	Very low	181 Å²	181	179.5 Å²	179.5	95%	0.948	89%	0.888	S	S	*	*			trans	-139.4	139	158.5	-85.1	177	0	0	0	111.6
4	H	32.6	Very low	32.6	Very low	181 Å²	181	176.4 Å²	176.4	84%	0.838	88%	0.883	S	S	*	*			trans	-82.6	157.5	-161	-90.4	-92.6	0	0	0	114.8
5	R	37.1	Very low	32.4	Very low	241 Å²	241	174 Å²	174	91%	0.909	88%	0.882	S	S	*	*			trans	-59.8	146.8	165.6	-74.8	175.8	168.2	-178.1	-3.5	113.1
6	L	31.2	Very low	32.3	Very low	172 Å²	172	177.9 Å²	177.9	90%	0.901	88%	0.882	S	S	*	*			trans	-140.4	133.7	145.5	-93.5	164.6	0	0	0	109.9
7	A	33.3	Very low	32.2	Very low	92 Å²	92	175.4 Å²	175.4	76%	0.76	88%	0.879	S	S	*	*			trans	-106.7	140.8	-178.8	0	0	0	0	0	109.9
8	F	29.7	Very low	32	Very low	197 Å²	197	178.8 Å²	178.8	86%	0.864	88%	0.88	S	S	*	*			trans	-122.3	119.8	168	-102.9	-88.5	0	0	0	110.2
9	R	32	Very low	31.9	Very low	243 Å²	243	175 Å²	175	92%	0.917	87%	0.873	S	S	*	*			trans	-96.9	130	166.3	-80.3	-179.2	172.2	-177	-2.7	107.9
10	L	31.4	Very low	31.8	Very low	171 Å²	171	174.9 Å²	174.9	90%	0.895	87%	0.874	S	S	*	*			trans	-110.6	130.9	167.4	-82	160.3	0	0	0	109.7
11	R	29.9	Very low	31.6	Very low	240 Å²	240	175.5 Å²	175.5	91%	0.906	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-91.1	157	175.4	-79.3	-177.6	175.1	-176.8	-1.1	110.6
12	P	33.8	Very low	31.1	Very low	123 Å²	123	169.3 Å²	169.3	80%	0.799	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-88	146.1	-177.1	34.8	-32.1	0	0	0	112.7
13	T	29.9	Very low	30.9	Very low	138 Å²	138	170.3 Å²	170.3	85%	0.847	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-101.2	125.8	170.2	36.6	0	0	0	0	110.7
14	V	32.2	Very low	30.6	Very low	136 Å²	136	165.4 Å²	165.4	82%	0.824	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-85.4	131.8	172.3	173.1	0	0	0	0	108.6
15	T	29.6	Very low	30.3	Very low	141 Å²	141	166.3 Å²	166.3	87%	0.865	86%	0.857	S	S	*	*			trans	-121.2	132.1	166.1	15	0	0	0	0	110.2
16	R	30.8	Very low	30	Very low	236 Å²	236	160.8 Å²	160.8	89%	0.891	85%	0.85	S	S	*	*			trans	-117.1	124.5	-172.3	-179.7	-172.2	-170.7	-170.2	4.1	107.5
17	V	30.3	Very low	29.9	Very low	135 Å²	135	161 Å²	161	82%	0.818	85%	0.847	S	S	*	*			trans	-142.6	99.7	166.2	-174.7	0	0	0	0	111.7
18	R	28.6	Very low	29.8	Very low	237 Å²	237	165.3 Å²	165.3	89%	0.894	85%	0.851	S	S	*	*			trans	38.6	122.9	134	-74.2	-176.5	172.8	178.3	-1.8	120.8
19	S	30.4	Very low	29.7	Very low	107 Å²	107	164.9 Å²	164.9	75%	0.748	85%	0.852	S	S	*	*			trans	-82.6	145.5	159.4	63.3	0	0	0	0	111.5
20	L	29	Very low	29.6	Very low	173 Å²	173	162.1 Å²	162.1	91%	0.906	85%	0.849	S	S	*	*			trans	-132.9	116	160.6	-80.8	169.3	0	0	0	107.9
21	H	28.8	Very low	29.5	Very low	187 Å²	187	158.7 Å²	158.7	87%	0.866	85%	0.846	S	S	*	*			trans	-76.7	133.3	163.4	-85.4	-80.6	0	0	0	108.8
22	S	27.3	Very low	29.5	Very low	122 Å²	122	153.3 Å²	153.3	85%	0.853	84%	0.839	S	S	*	*			trans	-142.7	139.5	151.4	72.3	0	0	0	0	109.1
23	S	28.2	Very low	29.6	Very low	124 Å²	124	151.8 Å²	151.8	87%	0.867	84%	0.837	S	S	*	*			trans	-94.4	145.6	-166.6	49.3	0	0	0	0	113
24	G	27	Very low	29.9	Very low	77 Å²	77	151.1 Å²	151.1	79%	0.794	83%	0.832	S	S	*	*			trans	102.5	102.2	146.2	0	0	0	0	0	116.7
25	F	24.8	Very low	30	Very low	200 Å²	200	152.6 Å²	152.6	88%	0.877	83%	0.83	S	S	*	*				-177	123.2	104.6	-138.1	-104.8	0	0	0	108
26	V	32.5	Very low	30.4	Very low	126 Å²	126	151.7 Å²	151.7	76%	0.764	83%	0.827	S	S	*	*			trans	-85	114.9	177.2	172.7	0	0	0	0	107.7	Q28	V26-Q28 HydrophobicContact CG1-CG 4.29Å
27	Q	28.7	Very low	30.7	Very low	177 Å²	177	148.6 Å²	148.6	83%	0.827	82%	0.822	S	S	*	*			trans	-116.4	107.7	153.9	-97.7	178.3	-23.2	0	0	106.8	Q29	Q27-Q29 PolarHBondContact O-N 3.22Å
28	Q	30.4	Very low	31.1	Very low	182 Å²	182	148 Å²	148	85%	0.85	82%	0.821	S	S	*	*			trans	-63.5	110	166.5	-78.4	170.9	-35.4	0	0	107.8	V26	V26-Q28 HydrophobicContact CG1-CG 4.29Å
29	Q	27.9	Very low	32	Very low	188 Å²	188	144 Å²	144	88%	0.879	81%	0.813	S	S	*	*			trans	-90	112.5	155.7	-83.9	-179.4	-21.4	0	0	106.9	Q27 A31	Q27-Q29 PolarHBondContact O-N 3.22Å; Q29-A31 PolarHBondContact O-N 3.13Å
30	E	29.4	Very low	32.9	Very low	184 Å²	184	144.1 Å²	144.1	86%	0.86	81%	0.814	S	S	*	*			trans	-55.1	122.3	166.4	-76.8	174.3	142.3	0	0	108.8	V32	E30-V32 PolarHBondContact O-N 3.4Å
31	A	29.2	Very low	34	Very low	100 Å²	100	142.6 Å²	142.6	83%	0.826	81%	0.806	S	S	*	*			trans	-69	99.5	169.7	0	0	0	0	0	107.7	Q29 A33	Q29-A31 PolarHBondContact O-N 3.13Å; A31-A33 PolarHBondContact O-N 3.14Å; A31-A33 VanDerWaalsContact O-N 3.12Å
32	V	30.4	Very low	36	Very low	126 Å²	126	135.6 Å²	135.6	76%	0.764	78%	0.778	S	S	*	*			trans	-58.8	115.3	165.6	178.3	0	0	0	0	106.7	E30 V34	E30-V32 PolarHBondContact O-N 3.4Å; V32-V34 PolarHBondContact O-N 2.97Å
33	A	36.2	Very low	38.8	Very low	91 Å²	91	135.1 Å²	135.1	75%	0.752	77%	0.77	S	S	*	*			trans	-59.4	104.9	169.7	0	0	0	0	0	107.5	A31 E35	A31-A33 PolarHBondContact O-N 3.14Å; A31-A33 VanDerWaalsContact O-N 3.12Å; A33-E35 PolarHBondContact O-N 2.7Å
34	V	35.2	Very low	41.8	Very low	124 Å²	124	130 Å²	130	75%	0.752	73%	0.732	S	S	*	*			trans	-66	106.1	167.2	177.9	0	0	0	0	105.3	V32	V32-V34 PolarHBondContact O-N 2.97Å
35	E	35.9	Very low	45	Very low	168 Å²	168	128.7 Å²	128.7	79%	0.785	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-52	136.2	163.3	-67.7	-159.2	155.8	0	0	107.8	A33 E37	A33-E35 PolarHBondContact O-N 2.7Å; E35-E37 PolarHBondContact O-N 3.42Å
36	P	38.1	Very low	48.3	Very low	122 Å²	122	120 Å²	120	79%	0.792	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.3	117.9	178.3	24.2	-30.8	0	0	0	107.7
37	E	35.4	Very low	51.2	Low	170 Å²	170	120.1 Å²	120.1	79%	0.794	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-49.1	136.9	170.4	-72	-168.6	161.6	0	0	108.1	E35 E39	E35-E37 PolarHBondContact O-N 3.42Å; E37-E39 PolarHBondContact O-N 2.77Å
38	P	40.5	Very low	54.4	Low	123 Å²	123	114.6 Å²	114.6	80%	0.799	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-56.6	117.4	177.2	22.9	-30.7	0	0	0	107.4	S40	P38-S40 PolarHBondContact O-N 2.86Å
39	E	46.6	Very low	57.4	Low	152 Å²	152	112.3 Å²	112.3	71%	0.71	62%	0.62	S	S	*	*			trans	-44.2	113.1	176.9	-73.9	-179.7	164.8	0	0	107.7	E37 L41 H47	E37-E39 PolarHBondContact O-N 2.77Å; E39-L41 PolarHBondContact O-N 3.36Å; E39-H47 IonicContact OE2-CE1 2.75Å
40	S	49.3	Very low	60.6	Low	111 Å²	111	106.3 Å²	106.3	78%	0.776	59%	0.593	S	S	*	*			trans	-47	120.3	174.6	60.1	0	0	0	0	107.8	P38 S42	P38-S40 PolarHBondContact O-N 2.86Å; S40-S42 VanDerWaalsContact C-N 3.33Å; S40-S42 PolarHBondContact O-N 3.16Å
41	L	52.7	Low	63.7	Low	141 Å²	141	97.5 Å²	97.5	74%	0.738	55%	0.552	S	S	*	*			trans	-56.5	96.5	-171.8	-72.6	165.1	0	0	0	109	E39 V43	E39-L41 PolarHBondContact O-N 3.36Å; L41-V43 PolarHBondContact O-N 2.85Å
42	S	70.1	Confident	66.9	Low	40 Å²	40	93.8 Å²	93.8	28%	0.28	52%	0.521	S	S	.	.			trans	-68.8	106.4	176.3	44.1	0	0	0	0	106.8	S40 F44 R45	S40-S42 VanDerWaalsContact C-N 3.33Å; S40-S42 PolarHBondContact O-N 3.16Å; S42-F44 VanDerWaalsContact CB-CE1 3.49Å; S42-F44 PolarHBondContact O-N 3.33Å; S42-R45 PolarHBondContact O-N 3.01Å; S42-R45 WeakPolarHBondContact OG-CB 3.22Å; S42-R45 WeakPolarHBondContact OG-CD 3.34Å; S42-R45 WeakPolarHBondContact OG-CG 3.31Å
43	V	85.6	Confident	70	Confident	112 Å²	112	90.8 Å²	90.8	68%	0.679	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-28.1	-174.8	179.4	0	0	0	0	112.3	L41 Q61	L41-V43 PolarHBondContact O-N 2.85Å; V43-Q61 PolarHBondContact O-NE2 3.38Å; V43-Q61 VanDerWaalsContact O-NE2 3.08Å
44	F	91.1	Very high	72.9	Confident	15 Å²	15	87 Å²	87	7%	0.066	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.8	179.6	64.6	-92.6	0	0	0	114.8	S42 Q61 F62 S352 L355 Y356 D359	S42-F44 VanDerWaalsContact CB-CE1 3.49Å; S42-F44 PolarHBondContact O-N 3.33Å; F44-Q61 CarbonylContact O-C 3.53Å; F44-Q61 VanDerWaalsContact O-CA 3.29Å; F44-Q61 WeakPolarHBondContact O-CA 3.49Å; F44-F62 WeakPolarHBondContact O-CD2 3.4Å; F44-F62 PolarHBondContact O-N 2.6Å; F44-S352 WeakPolarHBondContact CB-O 3.49Å; F44-L355 HydrophobicContact CB-CB 4.26Å; F44-L355 HydrophobicContact CD1-CB 3.55Å; F44-L355 HydrophobicContact CD1-CD1 4.47Å; F44-L355 HydrophobicContact CE1-CB 4.2Å; F44-L355 HydrophobicContact CG-CB 4.08Å; F44-Y356 AromaticContact CD2-CD2 3.97Å; F44-Y356 HydrophobicContact CD2-CD2 3.97Å; F44-Y356 HydrophobicContact CD2-CG 4.35Å; F44-Y356 AromaticContact CE2-CD2 3.75Å; F44-Y356 HydrophobicContact CE2-CD2 3.75Å; F44-Y356 HydrophobicContact CE2-CG 4.41Å; F44-D359 HydrophobicContact CE1-CB 4.06Å; F44-D359 HydrophobicContact CE2-CB 4.14Å; F44-D359 HydrophobicContact CZ-CB 3.4Å; F44-D359 VanDerWaalsContact CZ-CB 3.4Å
45	R	94.8	Very high	75.8	Confident	51 Å²	51	83.3 Å²	83.3	19%	0.192	45%	0.452	C	S	.	.	B	Isolated β-bridge	trans	-106.3	158	173.3	-59.6	-172.2	-179.1	-112.4	-1.8	110.6	S42 F62 E91 D359	S42-R45 PolarHBondContact O-N 3.01Å; S42-R45 WeakPolarHBondContact OG-CB 3.22Å; S42-R45 WeakPolarHBondContact OG-CD 3.34Å; S42-R45 WeakPolarHBondContact OG-CG 3.31Å; R45-F62 WeakPolarHBondContact CA-O 3.21Å; R45-E91 IonicContact CZ-OE1 3.6Å; R45-E91 IonicContact CZ-OE2 3.45Å; R45-E91 IonicContact NH1-OE1 2.82Å; R45-E91 IonicContact NH1-OE2 2.85Å; R45-E91 PolarHBondContact NH1-OE2 3.1Å; R45-E91 IonicContact NH2-OE1 3.51Å; R45-E91 PolarHBondContact NH2-OE1 3.4Å; R45-E91 IonicContact NH2-OE2 3.7Å; R45-E91 PolarHBondContact NH2-OE2 3.01Å; R45-D359 IonicContact CZ-OD2 3.43Å; R45-D359 IonicContact NE-OD2 2.75Å; R45-D359 IonicContact NH2-OD2 3.22Å; R45-D359 PolarHBondContact NH2-OD2 3.21Å; R45-D359 VanDerWaalsContact NH2-OD2 3.08Å
46	T	94.6	Very high	78.6	Confident	16 Å²	16	80.4 Å²	80.4	10%	0.098	44%	0.441	C	S	.	.			trans	-119.7	143.2	168.4	178.1	0	0	0	0	110.1	E48 H58 Q61 F62	T46-E48 VanDerWaalsContact C-N 3.26Å; T46-E48 WeakPolarHBondContact CG2-O 3.32Å; T46-E48 WeakPolarHBondContact OG1-CB 3.31Å; T46-E48 PolarHBondContact OG1-N 2.79Å; T46-E48 VanDerWaalsContact OG1-N 3.08Å; T46-H58 PolarHBondContact OG1-CD2 2.93Å; T46-Q61 HydrophobicContact CG2-CB 4.17Å; T46-F62 PolarHBondContact N-O 2.68Å
47	H	93.2	Very high	81.3	Confident	129 Å²	129	82.9 Å²	82.9	60%	0.597	44%	0.44	S	S	*	.	S	Bend	trans	-76.4	-18.1	170.6	-64.6	-71.1	0	0	0	112.2	E39 K49	E39-H47 IonicContact OE2-CE1 2.75Å; H47-K49 PolarHBondContact O-N 3.32Å
48	E	95.4	Very high	84.2	Confident	61 Å²	61	76.4 Å²	76.4	29%	0.285	41%	0.41	S	S	.	.			trans	-71.2	115.7	174.8	-174.8	54.1	-96.6	0	0	109.5	T46 D50 C53 H54 Y63	T46-E48 VanDerWaalsContact C-N 3.26Å; T46-E48 WeakPolarHBondContact CG2-O 3.32Å; T46-E48 WeakPolarHBondContact OG1-CB 3.31Å; T46-E48 PolarHBondContact OG1-N 2.79Å; T46-E48 VanDerWaalsContact OG1-N 3.08Å; E48-D50 WeakPolarHBondContact OE1-CB 3.49Å; E48-D50 PolarHBondContact OE1-N 3.12Å; E48-C53 HydrophobicContact CG-CB 3.71Å; E48-C53 WeakPolarHBondContact OE2-CB 3.08Å; E48-H54 PolarHBondContact O-NE2 2.69Å; E48-Y63 WeakPolarHBondContact O-CB 3.45Å
49	K	93.5	Very high	86.9	Confident	135 Å²	135	71.5 Å²	71.5	59%	0.587	38%	0.377	S	S	*	.			trans	-104.4	-17.6	-178.7	-64.1	178.2	-174	174.6	0	111.8	H47 P51	H47-K49 PolarHBondContact O-N 3.32Å; K49-P51 WeakPolarHBondContact O-CD 3.39Å
50	D	94.8	Very high	89.3	Confident	61 Å²	61	64.2 Å²	64.2	33%	0.326	34%	0.343	S	S	.	.			trans	-83.6	114.2	179.5	-171.9	-10.1	0	0	0	110	E48 A52 C53 H54	E48-D50 WeakPolarHBondContact OE1-CB 3.49Å; E48-D50 PolarHBondContact OE1-N 3.12Å; D50-A52 PolarHBondContact O-N 2.71Å; D50-A52 VanDerWaalsContact O-N 3.08Å; D50-A52 VanDerWaalsContact OD1-CB 3.28Å; D50-A52 WeakPolarHBondContact OD1-CB 3.45Å; D50-A52 PolarHBondContact OD1-N 2.74Å; D50-C53 HydrophobicContact CB-CB 4.34Å; D50-C53 PolarHBondContact O-N 2.96Å; D50-H54 PolarHBondContact O-CD2 2.95Å; D50-H54 VanDerWaalsContact O-CD2 3.3Å; D50-H54 PolarHBondContact O-NE2 3.21Å
51	P	95.5	Very high	91.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.6	177.5	30.8	-40.2	0	0	0	113.4	K49 C53 F139 T142	K49-P51 WeakPolarHBondContact O-CD 3.39Å; P51-C53 VanDerWaalsContact C-N 3.3Å; P51-F139 HydrophobicContact CB-CB 3.99Å; P51-F139 HydrophobicContact CG-CB 4.07Å; P51-T142 HydrophobicContact CG-CG2 4.34Å; P51-T142 WeakPolarHBondContact CG-OG1 3.32Å
52	A	95.3	Very high	93.7	Very high	21 Å²	21	54.8 Å²	54.8	17%	0.174	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.7	172.5	0	0	0	0	0	113.1	D50 K108 F139	D50-A52 PolarHBondContact O-N 2.71Å; D50-A52 VanDerWaalsContact O-N 3.08Å; D50-A52 VanDerWaalsContact OD1-CB 3.28Å; D50-A52 WeakPolarHBondContact OD1-CB 3.45Å; D50-A52 PolarHBondContact OD1-N 2.74Å; A52-K108 WeakPolarHBondContact O-CE 3.44Å; A52-K108 PolarHBondContact O-NZ 3.42Å; A52-F139 HydrophobicContact CB-CD2 4Å; A52-F139 HydrophobicContact CB-CE2 3.8Å
53	C	96.5	Very high	95	Very high	64 Å²	64	52.9 Å²	52.9	43%	0.432	27%	0.27	S	S	.	.	S	Bend	trans	-96.6	-1.2	179.6	-67.2	0	0	0	0	112.9	E48 D50 P51	E48-C53 HydrophobicContact CG-CB 3.71Å; E48-C53 WeakPolarHBondContact OE2-CB 3.08Å; D50-C53 HydrophobicContact CB-CB 4.34Å; D50-C53 PolarHBondContact O-N 2.96Å; P51-C53 VanDerWaalsContact C-N 3.3Å
54	H	96.8	Very high	95.5	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.056	25%	0.251	C	S	.	.			trans	-67.5	141.9	176.2	-61.6	168.9	0	0	0	112.3	E48 D50 Y63 V96 L101 H135	E48-H54 PolarHBondContact O-NE2 2.69Å; D50-H54 PolarHBondContact O-CD2 2.95Å; D50-H54 VanDerWaalsContact O-CD2 3.3Å; D50-H54 PolarHBondContact O-NE2 3.21Å; H54-Y63 AromaticContact CE1-CD1 3.39Å; H54-Y63 WeakPolarHBondContact CE1-CD1 3.17Å; H54-Y63 AromaticContact CE1-CD2 3.77Å; H54-Y63 AromaticContact CE1-CE1 3.69Å; H54-Y63 AromaticContact CE1-CG 3.43Å; H54-Y63 VanDerWaalsContact CE1-CG 3.43Å; H54-Y63 AromaticContact NE2-CG 3.87Å; H54-V96 HydrophobicContact CB-CG1 4.28Å; H54-V96 WeakPolarHBondContact ND1-CG2 3.48Å; H54-L101 HydrophobicContact CB-CD2 3.59Å; H54-H135 AromaticContact CE1-NE2 3.84Å; H54-H135 AromaticContact ND1-CE1 3.57Å; H54-H135 AromaticContact ND1-NE2 3.15Å; H54-H135 PolarHBondContact ND1-NE2 3.24Å; H54-H135 VanDerWaalsContact ND1-NE2 3.15Å
55	S	95.5	Very high	95.6	Very high	46 Å²	46	49.5 Å²	49.5	32%	0.322	25%	0.25	S	S	.	.			trans	-147.3	178.7	-178.2	66.8	0	0	0	0	109.7	K57 H58 L101	S55-K57 PolarHBondContact O-N 2.9Å; S55-H58 PolarHBondContact N-ND1 2.94Å; S55-H58 PolarHBondContact O-N 3.36Å; S55-L101 WeakPolarHBondContact O-CD1 3.39Å
56	D	95.6	Very high	95.5	Very high	106 Å²	106	49.9 Å²	49.9	57%	0.567	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-56.9	-24.6	180	-57.8	-52.8	0	0	0	113.2	H58 V59 Q98	D56-H58 VanDerWaalsContact C-N 3.25Å; D56-H58 PolarHBondContact O-N 2.96Å; D56-V59 WeakPolarHBondContact O-CB 3.34Å; D56-V59 WeakPolarHBondContact O-CG2 3.4Å; D56-V59 PolarHBondContact O-N 3.43Å; D56-Q98 PolarHBondContact OD1-NE2 2.91Å; D56-Q98 PolarHBondContact OD1-OE1 2.74Å
57	K	95	Very high	95.2	Very high	174 Å²	174	53.5 Å²	53.5	76%	0.757	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61	-35.4	175.1	-63.1	-178.2	-178.8	178.5	0	112.4	S55	S55-K57 PolarHBondContact O-N 2.9Å
58	H	96.6	Very high	95	Very high	35 Å²	35	50.4 Å²	50.4	16%	0.162	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-87.7	-5.7	-175.9	-53.8	128	0	0	0	113	T46 S55 D56 G60 Q61 V96	T46-H58 PolarHBondContact OG1-CD2 2.93Å; S55-H58 PolarHBondContact N-ND1 2.94Å; S55-H58 PolarHBondContact O-N 3.36Å; D56-H58 VanDerWaalsContact C-N 3.25Å; D56-H58 PolarHBondContact O-N 2.96Å; H58-G60 PolarHBondContact O-N 3.21Å; H58-Q61 VanDerWaalsContact O-CB 3.29Å; H58-Q61 WeakPolarHBondContact O-CB 3.43Å; H58-Q61 PolarHBondContact O-N 3.3Å; H58-V96 HydrophobicContact CB-CG1 4.33Å; H58-V96 HydrophobicContact CB-CG2 4.41Å; H58-V96 WeakPolarHBondContact O-CB 3.4Å
59	V	97.3	Very high	94.9	Very high	19 Å²	19	50.4 Å²	50.4	12%	0.115	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	130	-178.1	173.6	0	0	0	0	110.9	D56 Q61 L101 K348	D56-V59 WeakPolarHBondContact O-CB 3.34Å; D56-V59 WeakPolarHBondContact O-CG2 3.4Å; D56-V59 PolarHBondContact O-N 3.43Å; V59-Q61 VanDerWaalsContact C-N 3.3Å; V59-L101 HydrophobicContact CG2-CD1 3.41Å; V59-L101 VanDerWaalsContact CG2-CD1 3.41Å; V59-K348 WeakPolarHBondContact O-CE 3.46Å; V59-K348 PolarHBondContact O-NZ 3.05Å
60	G	96.8	Very high	94.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-11	-174.8	0	0	0	0	0	114.1	H58 M95 V96 S352	H58-G60 PolarHBondContact O-N 3.21Å; G60-M95 VanDerWaalsContact O-SD 3.41Å; G60-V96 PolarHBondContact N-O 3.38Å; G60-S352 WeakPolarHBondContact O-CB 3.33Å; G60-S352 PolarHBondContact O-OG 3.24Å
61	Q	97.3	Very high	94.4	Very high	39 Å²	39	51.5 Å²	51.5	18%	0.182	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-90.3	148.4	178.8	-58.2	-177.7	-43.8	0	0	111.7	V43 F44 T46 H58 V59 M95 V96	V43-Q61 PolarHBondContact O-NE2 3.38Å; V43-Q61 VanDerWaalsContact O-NE2 3.08Å; F44-Q61 CarbonylContact O-C 3.53Å; F44-Q61 VanDerWaalsContact O-CA 3.29Å; F44-Q61 WeakPolarHBondContact O-CA 3.49Å; T46-Q61 HydrophobicContact CG2-CB 4.17Å; H58-Q61 VanDerWaalsContact O-CB 3.29Å; H58-Q61 WeakPolarHBondContact O-CB 3.43Å; H58-Q61 PolarHBondContact O-N 3.3Å; V59-Q61 VanDerWaalsContact C-N 3.3Å; Q61-M95 CarbonylContact O-C 3.19Å; Q61-M95 WeakPolarHBondContact O-CA 3.31Å; Q61-V96 PolarHBondContact O-N 3.35Å
62	F	97.4	Very high	94.2	Very high	15 Å²	15	52.8 Å²	52.8	7%	0.066	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.9	174.8	-71.9	-92.5	0	0	0	110.5	F44 R45 T46 C93 I94 M95 C353 Y356	F44-F62 WeakPolarHBondContact O-CD2 3.4Å; F44-F62 PolarHBondContact O-N 2.6Å; R45-F62 WeakPolarHBondContact CA-O 3.21Å; T46-F62 PolarHBondContact N-O 2.68Å; F62-C93 HydrophobicContact CB-CB 4.19Å; F62-C93 HydrophobicContact CD1-CB 4.1Å; F62-I94 WeakPolarHBondContact CA-O 3.36Å; F62-M95 HydrophobicContact CD1-CB 3.91Å; F62-M95 HydrophobicContact CE1-CB 3.67Å; F62-M95 HydrophobicContact CE2-CB 4.27Å; F62-M95 HydrophobicContact CE2-CG 4.29Å; F62-M95 HydrophobicContact CE2-SD 4Å; F62-M95 HydrophobicContact CG-CB 4.33Å; F62-M95 HydrophobicContact CZ-CB 3.86Å; F62-M95 HydrophobicContact CZ-CG 4.3Å; F62-M95 HydrophobicContact CZ-SD 4.05Å; F62-C353 HydrophobicContact CE2-CB 4.34Å; F62-C353 HydrophobicContact CZ-CB 4.19Å; F62-Y356 HydrophobicContact CD2-CD2 4.44Å; F62-Y356 HydrophobicContact CD2-CG 4.23Å; F62-Y356 HydrophobicContact CE1-CD1 4.28Å; F62-Y356 HydrophobicContact CE1-CE1 4.46Å; F62-Y356 HydrophobicContact CE2-CD1 4.42Å; F62-Y356 HydrophobicContact CE2-CG 4.15Å; F62-Y356 HydrophobicContact CG-CD2 4.46Å; F62-Y356 HydrophobicContact CZ-CD1 4.16Å; F62-Y356 HydrophobicContact CZ-CG 4.35Å
63	Y	97.3	Very high	94.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.9	168.4	78.3	-80.9	0	0	0	109.7	E48 H54 L65 C93 I94 V96 H135 H138	E48-Y63 WeakPolarHBondContact O-CB 3.45Å; H54-Y63 AromaticContact CE1-CD1 3.39Å; H54-Y63 WeakPolarHBondContact CE1-CD1 3.17Å; H54-Y63 AromaticContact CE1-CD2 3.77Å; H54-Y63 AromaticContact CE1-CE1 3.69Å; H54-Y63 AromaticContact CE1-CG 3.43Å; H54-Y63 VanDerWaalsContact CE1-CG 3.43Å; H54-Y63 AromaticContact NE2-CG 3.87Å; Y63-L65 HydrophobicContact CE2-CD2 3.65Å; Y63-L65 HydrophobicContact CE2-CG 4.15Å; Y63-C93 VanDerWaalsContact O-CA 3.31Å; Y63-C93 WeakPolarHBondContact O-CA 3.49Å; Y63-I94 HydrophobicContact CD1-CB 4.25Å; Y63-I94 WeakPolarHBondContact CD1-O 3.38Å; Y63-I94 HydrophobicContact CE1-CB 3.61Å; Y63-I94 HydrophobicContact CE1-CG2 3.84Å; Y63-I94 PolarHBondContact N-O 2.85Å; Y63-I94 PolarHBondContact O-N 3.35Å; Y63-V96 HydrophobicContact CD1-CG2 3.76Å; Y63-V96 HydrophobicContact CE1-CG2 4.35Å; Y63-H135 AromaticContact CE1-CD2 3.8Å; Y63-H135 AromaticContact CZ-CD2 3.79Å; Y63-H135 PolarHBondContact OH-CD2 2.89Å; Y63-H138 AromaticContact CE2-CE1 3.83Å; Y63-H138 AromaticContact CE2-ND1 3.5Å; Y63-H138 WeakPolarHBondContact CE2-ND1 3.36Å; Y63-H138 AromaticContact CZ-ND1 3.78Å; Y63-H138 PolarHBondContact OH-ND1 2.97Å; Y63-H138 VanDerWaalsContact OH-ND1 3.16Å
64	T	95.4	Very high	93.7	Very high	48 Å²	48	49 Å²	49	29%	0.294	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.3	-179.2	-54.5	0	0	0	0	110.6	C93	T64-C93 PolarHBondContact OG1-SG 2.75Å; T64-C93 VanDerWaalsContact OG1-SG 3.4Å
65	L	94.1	Very high	92.7	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.042	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-76.6	132.8	172.7	-73.3	171.2	0	0	0	110.6	Y63 S67 V70 F74 T92 I94 H138	Y63-L65 HydrophobicContact CE2-CD2 3.65Å; Y63-L65 HydrophobicContact CE2-CG 4.15Å; L65-S67 PolarHBondContact O-N 2.7Å; L65-V70 HydrophobicContact CB-CG2 3.58Å; L65-V70 HydrophobicContact CD1-CG2 4.21Å; L65-F74 HydrophobicContact CD1-CD2 4.23Å; L65-F74 HydrophobicContact CD1-CE2 3.87Å; L65-T92 HydrophobicContact CB-CG2 4.07Å; L65-T92 HydrophobicContact CD1-CG2 3.65Å; L65-T92 HydrophobicContact CG-CG2 4.37Å; L65-T92 PolarHBondContact N-O 3.4Å; L65-I94 HydrophobicContact CD1-CD1 3.43Å; L65-I94 VanDerWaalsContact CD1-CD1 3.43Å; L65-I94 HydrophobicContact CD1-CG1 3.77Å; L65-I94 HydrophobicContact CG-CD1 4.31Å; L65-I94 HydrophobicContact CG-CG1 4.43Å; L65-H138 HydrophobicContact CD2-CB 4.36Å; L65-H138 WeakPolarHBondContact CD2-CE1 3.26Å; L65-H138 VanDerWaalsContact CD2-CG 3.48Å; L65-H138 WeakPolarHBondContact CD2-ND1 3.03Å
66	S	91.3	Very high	91.7	Very high	58 Å²	58	52.7 Å²	52.7	41%	0.406	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-61.8	132.5	170.5	178	0	0	0	0	110.4	A68 H69 V70	S66-A68 PolarHBondContact O-N 3.3Å; S66-A68 VanDerWaalsContact O-N 3.12Å; S66-A68 PolarHBondContact OG-N 2.9Å; S66-H69 PolarHBondContact O-N 3.09Å; S66-V70 WeakPolarHBondContact O-CG2 3.37Å; S66-V70 PolarHBondContact O-N 3.23Å
67	S	88.6	Confident	91	Very high	93 Å²	93	48.2 Å²	48.2	65%	0.65	26%	0.258	S	S	*	.	H	α-helix	trans	-57.6	-26.9	176.1	58.2	0	0	0	0	112.7	L65 H69 R71	L65-S67 PolarHBondContact O-N 2.7Å; S67-H69 VanDerWaalsContact C-N 3.28Å; S67-H69 PolarHBondContact O-N 2.99Å; S67-R71 PolarHBondContact O-N 3.27Å
68	A	90.2	Very high	90.9	Very high	64 Å²	64	40.3 Å²	40.3	53%	0.529	22%	0.224	S	C	.	.	H	α-helix	trans	-65.4	-28	173.3	0	0	0	0	0	113.1	S66 P72	S66-A68 PolarHBondContact O-N 3.3Å; S66-A68 VanDerWaalsContact O-N 3.12Å; S66-A68 PolarHBondContact OG-N 2.9Å; A68-P72 WeakPolarHBondContact O-CD 3.36Å; A68-P72 VanDerWaalsContact O-CG 3.26Å; A68-P72 WeakPolarHBondContact O-CG 3.45Å
69	H	91.8	Very high	90.7	Very high	60 Å²	60	40.8 Å²	40.8	28%	0.278	23%	0.231	S	C	.	.	H	α-helix	trans	-92.7	-33.5	176.6	-58.3	162.7	0	0	0	112.2	S66 S67 P72 L73 H138 Y141	S66-H69 PolarHBondContact O-N 3.09Å; S67-H69 VanDerWaalsContact C-N 3.28Å; S67-H69 PolarHBondContact O-N 2.99Å; H69-P72 WeakPolarHBondContact O-CD 3.3Å; H69-L73 VanDerWaalsContact O-CB 3.22Å; H69-L73 WeakPolarHBondContact O-CB 3.33Å; H69-L73 PolarHBondContact O-N 2.86Å; H69-L73 VanDerWaalsContact O-N 3.07Å; H69-H138 AromaticContact ND1-NE2 3.4Å; H69-H138 PolarHBondContact ND1-NE2 3.39Å; H69-Y141 HydrophobicContact CB-CE1 4.35Å; H69-Y141 AromaticContact CD2-CE1 3.89Å
70	V	91	Very high	90.4	Very high	17 Å²	17	48 Å²	48	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-48.5	-176.4	175.9	0	0	0	0	111.8	L65 S66 F74 M86 T92	L65-V70 HydrophobicContact CB-CG2 3.58Å; L65-V70 HydrophobicContact CD1-CG2 4.21Å; S66-V70 WeakPolarHBondContact O-CG2 3.37Å; S66-V70 PolarHBondContact O-N 3.23Å; V70-F74 CarbonylContact O-C 3.59Å; V70-F74 WeakPolarHBondContact O-CA 3.44Å; V70-F74 WeakPolarHBondContact O-CB 3.21Å; V70-F74 PolarHBondContact O-N 2.87Å; V70-M86 HydrophobicContact CG1-CE 3.72Å; V70-T92 HydrophobicContact CG1-CG2 4.47Å; V70-T92 HydrophobicContact CG2-CG2 3.87Å
71	R	88.4	Confident	90.2	Very high	202 Å²	202	52 Å²	52	76%	0.762	27%	0.271	S	S	*	.	H	α-helix	trans	-63.9	-46.4	-177.1	-66.7	-178.5	-179.4	178.6	1.4	112.4	S67	S67-R71 PolarHBondContact O-N 3.27Å
72	P	90.8	Very high	90.1	Very high	27 Å²	27	51.4 Å²	51.4	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-72.1	-42.3	-178.5	-22.2	36.2	0	0	0	113.8	A68 H69 I188 T189	A68-P72 WeakPolarHBondContact O-CD 3.36Å; A68-P72 VanDerWaalsContact O-CG 3.26Å; A68-P72 WeakPolarHBondContact O-CG 3.45Å; H69-P72 WeakPolarHBondContact O-CD 3.3Å; P72-I188 HydrophobicContact CB-CG2 4.12Å; P72-T189 PolarHBondContact O-OG1 3.15Å
73	L	91.9	Very high	89.9	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-84	-32.1	-173.7	-174.3	60.4	0	0	0	113.1	H69 S77 H138 Y141 V147 T189	H69-L73 VanDerWaalsContact O-CB 3.22Å; H69-L73 WeakPolarHBondContact O-CB 3.33Å; H69-L73 PolarHBondContact O-N 2.86Å; H69-L73 VanDerWaalsContact O-N 3.07Å; L73-S77 PolarHBondContact O-OG 3.2Å; L73-H138 HydrophobicContact CD2-CB 4.18Å; L73-Y141 HydrophobicContact CD1-CD2 3.97Å; L73-Y141 HydrophobicContact CD1-CG 4.16Å; L73-Y141 HydrophobicContact CD2-CD1 4.33Å; L73-Y141 HydrophobicContact CD2-CG 3.98Å; L73-Y141 HydrophobicContact CG-CG 4.49Å; L73-V147 HydrophobicContact CD1-CB 4.45Å; L73-V147 HydrophobicContact CD1-CG1 4.01Å; L73-V147 HydrophobicContact CD1-CG2 4.38Å; L73-T189 HydrophobicContact CD1-CG2 3.94Å
74	F	89.5	Confident	89.7	Confident	5 Å²	5	56.9 Å²	56.9	2%	0.022	29%	0.293	C	S	.	.	H	α-helix	trans	-124.9	22.7	-165.6	-60.5	-51.9	0	0	0	115.7	L65 V70 D76 S77 L78 C134 H138	L65-F74 HydrophobicContact CD1-CD2 4.23Å; L65-F74 HydrophobicContact CD1-CE2 3.87Å; V70-F74 CarbonylContact O-C 3.59Å; V70-F74 WeakPolarHBondContact O-CA 3.44Å; V70-F74 WeakPolarHBondContact O-CB 3.21Å; V70-F74 PolarHBondContact O-N 2.87Å; F74-D76 VanDerWaalsContact C-N 3.34Å; F74-D76 PolarHBondContact O-N 2.8Å; F74-S77 PolarHBondContact O-N 2.91Å; F74-L78 HydrophobicContact CB-CD1 3.62Å; F74-L78 HydrophobicContact CB-CG 3.82Å; F74-L78 HydrophobicContact CD1-CD2 4.39Å; F74-L78 HydrophobicContact CD1-CG 4.29Å; F74-L78 HydrophobicContact CD2-CD1 4.39Å; F74-L78 HydrophobicContact CG-CD1 4.05Å; F74-L78 HydrophobicContact CG-CD2 4.41Å; F74-L78 HydrophobicContact CG-CG 4.07Å; F74-C134 HydrophobicContact CE1-CB 3.74Å; F74-C134 HydrophobicContact CZ-CB 3.97Å; F74-C134 WeakPolarHBondContact CZ-O 3.4Å; F74-H138 HydrophobicContact CE2-CB 4.38Å; F74-H138 HydrophobicContact CZ-CB 4.12Å
75	S	74.6	Confident	89.6	Confident	42 Å²	42	55.7 Å²	55.7	29%	0.294	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.9	-53.2	-179.2	57	0	0	0	0	113.5	N185	S75-N185 PolarHBondContact OG-OD1 3.26Å
76	D	75.5	Confident	89.6	Confident	93 Å²	93	56.7 Å²	56.7	50%	0.497	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	10.5	177.2	-60.8	-46.5	0	0	0	113.1	F74 N185	F74-D76 VanDerWaalsContact C-N 3.34Å; F74-D76 PolarHBondContact O-N 2.8Å; D76-N185 PolarHBondContact OD2-ND2 3.28Å
77	S	81.1	Confident	89.7	Confident	11 Å²	11	61.9 Å²	61.9	8%	0.077	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-22.2	-171.4	-61.9	0	0	0	0	113.9	L73 F74 H149	L73-S77 PolarHBondContact O-OG 3.2Å; F74-S77 PolarHBondContact O-N 2.91Å; S77-H149 WeakPolarHBondContact CB-CE1 3.31Å; S77-H149 WeakPolarHBondContact CB-ND1 3.34Å; S77-H149 PolarHBondContact OG-CE1 3.5Å; S77-H149 PolarHBondContact OG-ND1 3Å
78	L	91.9	Very high	90	Very high	8 Å²	8	61.4 Å²	61.4	4%	0.042	30%	0.297	C	S	.	.	S	Bend	trans	-89.8	147.4	-172.7	-71.8	166.3	0	0	0	111.6	F74 W80 Y82 Q83 M86 M131 C134	F74-L78 HydrophobicContact CB-CD1 3.62Å; F74-L78 HydrophobicContact CB-CG 3.82Å; F74-L78 HydrophobicContact CD1-CD2 4.39Å; F74-L78 HydrophobicContact CD1-CG 4.29Å; F74-L78 HydrophobicContact CD2-CD1 4.39Å; F74-L78 HydrophobicContact CG-CD1 4.05Å; F74-L78 HydrophobicContact CG-CD2 4.41Å; F74-L78 HydrophobicContact CG-CG 4.07Å; L78-W80 PolarHBondContact O-N 3.2Å; L78-Y82 HydrophobicContact CB-CD1 4.18Å; L78-Y82 HydrophobicContact CD1-CD1 4.11Å; L78-Y82 HydrophobicContact CD1-CE1 4.03Å; L78-Y82 HydrophobicContact CD2-CD1 3.95Å; L78-Y82 HydrophobicContact CD2-CE1 4.04Å; L78-Y82 HydrophobicContact CG-CD1 4.3Å; L78-Q83 HydrophobicContact CB-CG 3.98Å; L78-Q83 PolarHBondContact O-NE2 3.29Å; L78-M86 HydrophobicContact CD1-CE 3.75Å; L78-M86 HydrophobicContact CD1-SD 3.52Å; L78-M86 VanDerWaalsContact CD1-SD 3.52Å; L78-M131 HydrophobicContact CD2-CE 4.39Å; L78-M131 HydrophobicContact CD2-SD 4.28Å; L78-C134 HydrophobicContact CD2-CB 4.23Å
79	P	92.8	Very high	90.2	Very high	46 Å²	46	58.6 Å²	58.6	30%	0.299	27%	0.273	S	S	.	.			trans	-56.1	135.4	176.3	-24.9	33.9	0	0	0	112	R81 Y82 Q83 T130 M131	P79-R81 VanDerWaalsContact C-N 3.26Å; P79-R81 PolarHBondContact O-N 3.43Å; P79-R81 VanDerWaalsContact O-N 3.11Å; P79-Y82 WeakPolarHBondContact O-CA 3.42Å; P79-Y82 WeakPolarHBondContact O-CB 3.36Å; P79-Y82 PolarHBondContact O-N 3.41Å; P79-Q83 PolarHBondContact O-N 3.45Å; P79-T130 HydrophobicContact CG-CG2 3.76Å; P79-M131 HydrophobicContact CG-SD 4.2Å
80	W	91.9	Very high	90.3	Very high	170 Å²	170	62.9 Å²	62.9	64%	0.644	30%	0.298	S	S	*	.	H	α-helix	trans	-51	-41.2	-176.4	173.8	80.2	0	0	0	114.1	L78 Y82 Q83 Q84	L78-W80 PolarHBondContact O-N 3.2Å; W80-Y82 VanDerWaalsContact C-N 3.34Å; W80-Y82 PolarHBondContact O-N 2.94Å; W80-Q83 WeakPolarHBondContact O-CB 3.4Å; W80-Q83 PolarHBondContact O-N 3.03Å; W80-Q84 HydrophobicContact CD2-CG 4.3Å; W80-Q84 HydrophobicContact CH2-CG 4.15Å; W80-Q84 HydrophobicContact CZ2-CG 3.83Å; W80-Q84 WeakPolarHBondContact O-CG 3.43Å; W80-Q84 PolarHBondContact O-N 3.05Å
81	R	92.4	Very high	90.4	Very high	85 Å²	85	63.6 Å²	63.6	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-41.4	176.8	-72.2	175.5	165.9	-107.4	-4.5	112.2	P79 Q83 Q84 Q85 E389	P79-R81 VanDerWaalsContact C-N 3.26Å; P79-R81 PolarHBondContact O-N 3.43Å; P79-R81 VanDerWaalsContact O-N 3.11Å; R81-Q83 VanDerWaalsContact C-N 3.35Å; R81-Q84 WeakPolarHBondContact O-CB 3.46Å; R81-Q84 PolarHBondContact O-N 3.3Å; R81-Q85 PolarHBondContact O-N 3.28Å; R81-E389 WeakPolarHBondContact CD-OE2 3.47Å; R81-E389 IonicContact CZ-OE2 2.78Å; R81-E389 IonicContact NH1-OE1 3.42Å; R81-E389 IonicContact NH1-OE2 3.74Å; R81-E389 PolarHBondContact NH1-OE2 3.14Å
82	Y	94.3	Very high	90.7	Very high	25 Å²	25	54.9 Å²	54.9	10%	0.098	27%	0.27	C	S	.	.	H	α-helix	trans	-68.3	-36.4	176.3	-175.5	-105.5	0	0	0	111.2	L78 P79 W80 Q84 Q85 M86 T92 C93 M131	L78-Y82 HydrophobicContact CB-CD1 4.18Å; L78-Y82 HydrophobicContact CD1-CD1 4.11Å; L78-Y82 HydrophobicContact CD1-CE1 4.03Å; L78-Y82 HydrophobicContact CD2-CD1 3.95Å; L78-Y82 HydrophobicContact CD2-CE1 4.04Å; L78-Y82 HydrophobicContact CG-CD1 4.3Å; P79-Y82 WeakPolarHBondContact O-CA 3.42Å; P79-Y82 WeakPolarHBondContact O-CB 3.36Å; P79-Y82 PolarHBondContact O-N 3.41Å; W80-Y82 VanDerWaalsContact C-N 3.34Å; W80-Y82 PolarHBondContact O-N 2.94Å; Y82-Q84 VanDerWaalsContact C-N 3.32Å; Y82-Q84 PolarHBondContact O-N 3.39Å; Y82-Q85 WeakPolarHBondContact O-CB 3.4Å; Y82-Q85 PolarHBondContact O-N 2.91Å; Y82-Q85 VanDerWaalsContact O-N 3.15Å; Y82-M86 HydrophobicContact CD1-CG 3.97Å; Y82-M86 HydrophobicContact CD1-SD 3.47Å; Y82-M86 WeakPolarHBondContact CD1-SD 3.42Å; Y82-M86 HydrophobicContact CE1-CG 3.62Å; Y82-M86 HydrophobicContact CE1-SD 3.33Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.07Å; Y82-M86 HydrophobicContact CG-SD 4.45Å; Y82-M86 VanDerWaalsContact O-CG 3.28Å; Y82-M86 WeakPolarHBondContact O-CG 3.39Å; Y82-M86 PolarHBondContact O-N 2.84Å; Y82-T92 HydrophobicContact CE1-CG2 4.34Å; Y82-C93 PolarHBondContact OH-N 3.13Å; Y82-C93 PolarHBondContact OH-O 3.01Å; Y82-M131 HydrophobicContact CD1-CE 3.93Å; Y82-M131 HydrophobicContact CD1-SD 4.13Å; Y82-M131 HydrophobicContact CD2-CE 4.15Å; Y82-M131 HydrophobicContact CE1-CE 3.68Å; Y82-M131 HydrophobicContact CE1-SD 4.48Å; Y82-M131 HydrophobicContact CE2-CE 3.93Å; Y82-M131 HydrophobicContact CG-CE 4.15Å; Y82-M131 HydrophobicContact CG-SD 4.15Å
83	Q	93.8	Very high	90.9	Very high	55 Å²	55	53.7 Å²	53.7	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-60.3	-39.5	171	-64.2	176	-29.4	0	0	112.3	L78 P79 W80 R81 K87	L78-Q83 HydrophobicContact CB-CG 3.98Å; L78-Q83 PolarHBondContact O-NE2 3.29Å; P79-Q83 PolarHBondContact O-N 3.45Å; W80-Q83 WeakPolarHBondContact O-CB 3.4Å; W80-Q83 PolarHBondContact O-N 3.03Å; R81-Q83 VanDerWaalsContact C-N 3.35Å; Q83-K87 WeakPolarHBondContact O-CB 3.3Å; Q83-K87 PolarHBondContact O-N 3.14Å
84	Q	93.4	Very high	91.1	Very high	76 Å²	76	53.8 Å²	53.8	36%	0.355	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-45.6	172.7	-61.1	-47.8	-56.3	0	0	110.9	W80 R81 Y82 M86 K87 T88	W80-Q84 HydrophobicContact CD2-CG 4.3Å; W80-Q84 HydrophobicContact CH2-CG 4.15Å; W80-Q84 HydrophobicContact CZ2-CG 3.83Å; W80-Q84 WeakPolarHBondContact O-CG 3.43Å; W80-Q84 PolarHBondContact O-N 3.05Å; R81-Q84 WeakPolarHBondContact O-CB 3.46Å; R81-Q84 PolarHBondContact O-N 3.3Å; Y82-Q84 VanDerWaalsContact C-N 3.32Å; Y82-Q84 PolarHBondContact O-N 3.39Å; Q84-M86 PolarHBondContact O-N 3.48Å; Q84-K87 PolarHBondContact O-N 3.15Å; Q84-T88 WeakPolarHBondContact O-CB 3.43Å; Q84-T88 PolarHBondContact O-N 3.16Å; Q84-T88 PolarHBondContact O-OG1 3.3Å
85	Q	93.4	Very high	91.5	Very high	22 Å²	22	54.2 Å²	54.2	10%	0.103	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-47.2	177.1	-177.8	174.8	64.3	0	0	112.1	R81 Y82 K87 T88 F89 Y357	R81-Q85 PolarHBondContact O-N 3.28Å; Y82-Q85 WeakPolarHBondContact O-CB 3.4Å; Y82-Q85 PolarHBondContact O-N 2.91Å; Y82-Q85 VanDerWaalsContact O-N 3.15Å; Q85-K87 VanDerWaalsContact C-N 3.3Å; Q85-K87 PolarHBondContact O-N 3.47Å; Q85-T88 PolarHBondContact O-N 2.81Å; Q85-F89 HydrophobicContact CG-CD2 3.58Å; Q85-F89 HydrophobicContact CG-CE2 3.44Å; Q85-F89 VanDerWaalsContact CG-CE2 3.44Å; Q85-F89 HydrophobicContact CG-CG 4.24Å; Q85-F89 HydrophobicContact CG-CZ 3.99Å; Q85-F89 WeakPolarHBondContact O-CB 3.33Å; Q85-F89 WeakPolarHBondContact O-CG 3.32Å; Q85-F89 PolarHBondContact O-N 2.95Å; Q85-Y357 PolarHBondContact NE2-OH 2.96Å
86	M	93.6	Very high	92.6	Very high	29 Å²	29	52.2 Å²	52.2	14%	0.143	25%	0.251	C	S	.	.	H	α-helix	trans	-57.9	-43.4	176.6	-69.3	160.2	64.4	0	0	111.8	V70 L78 Y82 Q84 N90 E91 T92	V70-M86 HydrophobicContact CG1-CE 3.72Å; L78-M86 HydrophobicContact CD1-CE 3.75Å; L78-M86 HydrophobicContact CD1-SD 3.52Å; L78-M86 VanDerWaalsContact CD1-SD 3.52Å; Y82-M86 HydrophobicContact CD1-CG 3.97Å; Y82-M86 HydrophobicContact CD1-SD 3.47Å; Y82-M86 WeakPolarHBondContact CD1-SD 3.42Å; Y82-M86 HydrophobicContact CE1-CG 3.62Å; Y82-M86 HydrophobicContact CE1-SD 3.33Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.07Å; Y82-M86 HydrophobicContact CG-SD 4.45Å; Y82-M86 VanDerWaalsContact O-CG 3.28Å; Y82-M86 WeakPolarHBondContact O-CG 3.39Å; Y82-M86 PolarHBondContact O-N 2.84Å; Q84-M86 PolarHBondContact O-N 3.48Å; M86-N90 WeakPolarHBondContact O-CA 3.23Å; M86-N90 PolarHBondContact O-N 3.35Å; M86-E91 VanDerWaalsContact CA-O 3.31Å; M86-E91 WeakPolarHBondContact CA-O 3.34Å; M86-E91 PolarHBondContact O-N 2.93Å; M86-T92 HydrophobicContact CE-CG2 3.55Å; M86-T92 WeakPolarHBondContact CE-OG1 3.43Å; M86-T92 HydrophobicContact CG-CG2 4.07Å; M86-T92 HydrophobicContact SD-CG2 4.02Å
87	K	93.6	Very high	93.7	Very high	168 Å²	168	48.4 Å²	48.4	73%	0.73	23%	0.229	S	C	*	.	H	α-helix	trans	-65.1	-42.6	178.5	-175.3	-179.5	177.5	-176	0	111.4	Q83 Q84 Q85 N90	Q83-K87 WeakPolarHBondContact O-CB 3.3Å; Q83-K87 PolarHBondContact O-N 3.14Å; Q84-K87 PolarHBondContact O-N 3.15Å; Q85-K87 VanDerWaalsContact C-N 3.3Å; Q85-K87 PolarHBondContact O-N 3.47Å; K87-N90 PolarHBondContact O-N 3.19Å
88	T	95.1	Very high	94.5	Very high	82 Å²	82	52 Å²	52	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-70.7	-41.8	-179.5	-57.9	0	0	0	0	112.1	Q84 Q85 N90 W362	Q84-T88 WeakPolarHBondContact O-CB 3.43Å; Q84-T88 PolarHBondContact O-N 3.16Å; Q84-T88 PolarHBondContact O-OG1 3.3Å; Q85-T88 PolarHBondContact O-N 2.81Å; T88-N90 VanDerWaalsContact C-N 3.28Å; T88-W362 HydrophobicContact CG2-CE3 4.34Å; T88-W362 HydrophobicContact CG2-CH2 4.09Å; T88-W362 HydrophobicContact CG2-CZ3 3.54Å
89	F	94.3	Very high	94.8	Very high	5 Å²	5	51.9 Å²	51.9	2%	0.022	25%	0.245	C	C	.	.	H	α-helix	trans	-81.3	-9.9	178.4	-62.5	-9.7	0	0	0	112.6	Q85 E91 Y356 Y357 R360 W362	Q85-F89 HydrophobicContact CG-CD2 3.58Å; Q85-F89 HydrophobicContact CG-CE2 3.44Å; Q85-F89 VanDerWaalsContact CG-CE2 3.44Å; Q85-F89 HydrophobicContact CG-CG 4.24Å; Q85-F89 HydrophobicContact CG-CZ 3.99Å; Q85-F89 WeakPolarHBondContact O-CB 3.33Å; Q85-F89 WeakPolarHBondContact O-CG 3.32Å; Q85-F89 PolarHBondContact O-N 2.95Å; F89-E91 HydrophobicContact CB-CG 3.94Å; F89-E91 PolarHBondContact O-N 3.25Å; F89-E91 VanDerWaalsContact O-N 3.1Å; F89-Y356 AromaticContact CD2-CE1 3.9Å; F89-Y356 HydrophobicContact CD2-CE1 3.9Å; F89-Y356 AromaticContact CD2-CZ 3.96Å; F89-Y356 HydrophobicContact CE2-CD1 4.47Å; F89-Y356 AromaticContact CE2-CE1 3.7Å; F89-Y356 HydrophobicContact CE2-CE1 3.7Å; F89-Y357 HydrophobicContact CE2-CD1 4.14Å; F89-Y357 HydrophobicContact CE2-CE1 4.13Å; F89-Y357 HydrophobicContact CZ-CD1 4.23Å; F89-Y357 HydrophobicContact CZ-CE1 4.41Å; F89-R360 HydrophobicContact CD1-CB 4.22Å; F89-R360 HydrophobicContact CD2-CB 4.41Å; F89-R360 HydrophobicContact CD2-CG 3.97Å; F89-R360 HydrophobicContact CE1-CB 4.05Å; F89-R360 HydrophobicContact CE2-CB 4.23Å; F89-R360 HydrophobicContact CE2-CG 4.09Å; F89-R360 HydrophobicContact CG-CB 4.42Å; F89-R360 HydrophobicContact CG-CG 4.2Å; F89-R360 HydrophobicContact CZ-CB 4.06Å; F89-R360 HydrophobicContact CZ-CG 4.42Å; F89-R360 PolarHBondContact O-NH1 2.52Å; F89-R360 PolarHBondContact O-NH2 2.73Å; F89-W362 HydrophobicContact CE1-CB 3.94Å; F89-W362 AromaticContact CE1-CD2 3.58Å; F89-W362 HydrophobicContact CE1-CD2 3.58Å; F89-W362 AromaticContact CE1-CE3 3.5Å; F89-W362 HydrophobicContact CE1-CE3 3.5Å; F89-W362 VanDerWaalsContact CE1-CE3 3.5Å; F89-W362 AromaticContact CE1-CG 3.81Å; F89-W362 HydrophobicContact CE1-CG 3.81Å; F89-W362 HydrophobicContact CE1-CZ3 4.19Å; F89-W362 HydrophobicContact CZ-CB 3.77Å; F89-W362 AromaticContact CZ-CD2 3.76Å; F89-W362 HydrophobicContact CZ-CD2 3.76Å; F89-W362 HydrophobicContact CZ-CE3 4.18Å; F89-W362 AromaticContact CZ-CG 3.59Å; F89-W362 HydrophobicContact CZ-CG 3.59Å
90	N	93.6	Very high	95.1	Very high	151 Å²	151	49.7 Å²	49.7	81%	0.807	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	31.8	-175	-166.1	39.4	0	0	0	112.7	M86 K87 T88	M86-N90 WeakPolarHBondContact O-CA 3.23Å; M86-N90 PolarHBondContact O-N 3.35Å; K87-N90 PolarHBondContact O-N 3.19Å; T88-N90 VanDerWaalsContact C-N 3.28Å
91	E	92.5	Very high	95.4	Very high	32 Å²	32	42.2 Å²	42.2	15%	0.15	20%	0.203	C	C	.	.	S	Bend	trans	-149.2	158.7	176.9	71.9	179.7	159	0	0	110	R45 M86 F89 C93 Y356 R360	R45-E91 IonicContact CZ-OE1 3.6Å; R45-E91 IonicContact CZ-OE2 3.45Å; R45-E91 IonicContact NH1-OE1 2.82Å; R45-E91 IonicContact NH1-OE2 2.85Å; R45-E91 PolarHBondContact NH1-OE2 3.1Å; R45-E91 IonicContact NH2-OE1 3.51Å; R45-E91 PolarHBondContact NH2-OE1 3.4Å; R45-E91 IonicContact NH2-OE2 3.7Å; R45-E91 PolarHBondContact NH2-OE2 3.01Å; M86-E91 VanDerWaalsContact CA-O 3.31Å; M86-E91 WeakPolarHBondContact CA-O 3.34Å; M86-E91 PolarHBondContact O-N 2.93Å; F89-E91 HydrophobicContact CB-CG 3.94Å; F89-E91 PolarHBondContact O-N 3.25Å; F89-E91 VanDerWaalsContact O-N 3.1Å; E91-C93 PolarHBondContact OE2-SG 2.98Å; E91-Y356 VanDerWaalsContact OE1-CE2 3.29Å; E91-Y356 WeakPolarHBondContact OE1-CE2 3.29Å; E91-Y356 PolarHBondContact OE1-OH 3.38Å; E91-Y356 VanDerWaalsContact OE1-OH 3.08Å; E91-R360 WeakPolarHBondContact OE1-CD 3.23Å; E91-R360 IonicContact OE1-CZ 3.58Å; E91-R360 IonicContact OE1-NE 2.86Å; E91-R360 IonicContact OE1-NH1 2.52Å; E91-R360 PolarHBondContact OE1-NH1 3.42Å; E91-R360 IonicContact OE2-NH1 3.65Å; E91-R360 PolarHBondContact OE2-NH1 3.31Å
92	T	94.3	Very high	95.7	Very high	19 Å²	19	41.2 Å²	41.2	12%	0.117	20%	0.202	C	C	.	.			trans	-125	104.5	176.7	-53.4	0	0	0	0	108.9	L65 V70 Y82 M86	L65-T92 HydrophobicContact CB-CG2 4.07Å; L65-T92 HydrophobicContact CD1-CG2 3.65Å; L65-T92 HydrophobicContact CG-CG2 4.37Å; L65-T92 PolarHBondContact N-O 3.4Å; V70-T92 HydrophobicContact CG1-CG2 4.47Å; V70-T92 HydrophobicContact CG2-CG2 3.87Å; Y82-T92 HydrophobicContact CE1-CG2 4.34Å; M86-T92 HydrophobicContact CE-CG2 3.55Å; M86-T92 WeakPolarHBondContact CE-OG1 3.43Å; M86-T92 HydrophobicContact CG-CG2 4.07Å; M86-T92 HydrophobicContact SD-CG2 4.02Å
93	C	94.9	Very high	95.8	Very high	2 Å²	2	40 Å²	40	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.8	-175.7	-65.1	0	0	0	0	110.4	F62 Y63 T64 Y82 E91 Y356	F62-C93 HydrophobicContact CB-CB 4.19Å; F62-C93 HydrophobicContact CD1-CB 4.1Å; Y63-C93 VanDerWaalsContact O-CA 3.31Å; Y63-C93 WeakPolarHBondContact O-CA 3.49Å; T64-C93 PolarHBondContact OG1-SG 2.75Å; T64-C93 VanDerWaalsContact OG1-SG 3.4Å; Y82-C93 PolarHBondContact OH-N 3.13Å; Y82-C93 PolarHBondContact OH-O 3.01Å; E91-C93 PolarHBondContact OE2-SG 2.98Å; C93-Y356 HydrophobicContact CB-CE2 4.28Å
94	I	96.4	Very high	96.1	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.8	176.6	-63.6	-175.1	0	0	0	108.3	F62 Y63 L65 M131 C134 H135	F62-I94 WeakPolarHBondContact CA-O 3.36Å; Y63-I94 HydrophobicContact CD1-CB 4.25Å; Y63-I94 WeakPolarHBondContact CD1-O 3.38Å; Y63-I94 HydrophobicContact CE1-CB 3.61Å; Y63-I94 HydrophobicContact CE1-CG2 3.84Å; Y63-I94 PolarHBondContact N-O 2.85Å; Y63-I94 PolarHBondContact O-N 3.35Å; L65-I94 HydrophobicContact CD1-CD1 3.43Å; L65-I94 VanDerWaalsContact CD1-CD1 3.43Å; L65-I94 HydrophobicContact CD1-CG1 3.77Å; L65-I94 HydrophobicContact CG-CD1 4.31Å; L65-I94 HydrophobicContact CG-CG1 4.43Å; I94-M131 HydrophobicContact CD1-CE 4.09Å; I94-M131 HydrophobicContact CG1-CE 3.85Å; I94-M131 HydrophobicContact CG2-CE 4.46Å; I94-C134 HydrophobicContact CD1-CB 4.44Å; I94-H135 HydrophobicContact CG2-CB 4.17Å
95	M	97.9	Very high	96.3	Very high	15 Å²	15	36 Å²	36	7%	0.074	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.7	173.4	-171.1	168	62.6	0	0	110.5	G60 Q61 F62 R97 Y345 E349	G60-M95 VanDerWaalsContact O-SD 3.41Å; Q61-M95 CarbonylContact O-C 3.19Å; Q61-M95 WeakPolarHBondContact O-CA 3.31Å; F62-M95 HydrophobicContact CD1-CB 3.91Å; F62-M95 HydrophobicContact CE1-CB 3.67Å; F62-M95 HydrophobicContact CE2-CB 4.27Å; F62-M95 HydrophobicContact CE2-CG 4.29Å; F62-M95 HydrophobicContact CE2-SD 4Å; F62-M95 HydrophobicContact CG-CB 4.33Å; F62-M95 HydrophobicContact CZ-CB 3.86Å; F62-M95 HydrophobicContact CZ-CG 4.3Å; F62-M95 HydrophobicContact CZ-SD 4.05Å; M95-R97 HydrophobicContact CE-CG 3.94Å; M95-R97 HydrophobicContact CG-CG 4.44Å; M95-R97 PolarHBondContact O-N 2.87Å; M95-Y345 HydrophobicContact CE-CD1 3.61Å; M95-Y345 HydrophobicContact CE-CE1 3.07Å; M95-E349 HydrophobicContact CE-CB 3.86Å; M95-E349 HydrophobicContact CE-CG 4.05Å; M95-E349 HydrophobicContact SD-CB 4.09Å; M95-E349 HydrophobicContact SD-CG 4.27Å
96	V	98.3	Very high	96.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.			trans	-72.2	118.8	172	-179.8	0	0	0	0	108.9	H54 H58 G60 Q61 Y63 L101	H54-V96 HydrophobicContact CB-CG1 4.28Å; H54-V96 WeakPolarHBondContact ND1-CG2 3.48Å; H58-V96 HydrophobicContact CB-CG1 4.33Å; H58-V96 HydrophobicContact CB-CG2 4.41Å; H58-V96 WeakPolarHBondContact O-CB 3.4Å; G60-V96 PolarHBondContact N-O 3.38Å; Q61-V96 PolarHBondContact O-N 3.35Å; Y63-V96 HydrophobicContact CD1-CG2 3.76Å; Y63-V96 HydrophobicContact CE1-CG2 4.35Å; V96-L101 HydrophobicContact CG1-CD1 3.79Å; V96-L101 HydrophobicContact CG1-CD2 3.73Å; V96-L101 HydrophobicContact CG1-CG 3.8Å
97	R	98.4	Very high	96.7	Very high	12 Å²	12	37.8 Å²	37.8	5%	0.045	19%	0.188	C	C	.	.			trans	-121.4	152.1	-179.7	-58.6	-161.4	69.7	-156	-0.3	111.9	M95 P99 A100 L101 T127 P343 N344 E349	M95-R97 HydrophobicContact CE-CG 3.94Å; M95-R97 HydrophobicContact CG-CG 4.44Å; M95-R97 PolarHBondContact O-N 2.87Å; R97-P99 VanDerWaalsContact C-CD 3.49Å; R97-A100 PolarHBondContact O-N 3.03Å; R97-L101 PolarHBondContact O-N 3.29Å; R97-T127 PolarHBondContact NH1-O 3.2Å; R97-P343 PolarHBondContact NH1-O 2.9Å; R97-P343 PolarHBondContact NH2-O 3.25Å; R97-P343 VanDerWaalsContact NH2-O 3.09Å; R97-N344 PolarHBondContact NH2-O 2.86Å; R97-E349 WeakPolarHBondContact CG-OE1 3.42Å; R97-E349 IonicContact CZ-OE1 3.37Å; R97-E349 IonicContact CZ-OE2 3.83Å; R97-E349 IonicContact NE-OE1 2.88Å; R97-E349 PolarHBondContact NE-OE1 3.43Å; R97-E349 IonicContact NE-OE2 2.93Å; R97-E349 PolarHBondContact NE-OE2 3.48Å; R97-E349 IonicContact NH2-OE1 2.84Å; R97-E349 PolarHBondContact NH2-OE1 2.9Å; R97-E349 IonicContact NH2-OE2 2.73Å; R97-E349 PolarHBondContact NH2-OE2 3.44Å
98	Q	98.1	Very high	96.8	Very high	86 Å²	86	34.8 Å²	34.8	40%	0.402	18%	0.175	S	C	.	.	H	α-helix	trans	-53.9	-45.1	-178.6	-160.2	65.6	19.9	0	0	114.3	D56 A100 L101 E102	D56-Q98 PolarHBondContact OD1-NE2 2.91Å; D56-Q98 PolarHBondContact OD1-OE1 2.74Å; Q98-A100 VanDerWaalsContact C-N 3.29Å; Q98-A100 PolarHBondContact O-N 3.46Å; Q98-L101 PolarHBondContact O-N 3.16Å; Q98-L101 VanDerWaalsContact O-N 3.16Å; Q98-E102 WeakPolarHBondContact O-CB 3.45Å; Q98-E102 PolarHBondContact O-N 2.88Å
99	P	98.3	Very high	96.9	Very high	6 Å²	6	39 Å²	39	4%	0.039	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-37.1	-178	-25.7	36.7	0	0	0	113.3	R97 V103 F121 V340 S341 V342	R97-P99 VanDerWaalsContact C-CD 3.49Å; P99-V103 PolarHBondContact O-N 3Å; P99-F121 HydrophobicContact CB-CD1 4.4Å; P99-F121 HydrophobicContact CB-CE1 4.09Å; P99-V340 HydrophobicContact CB-CG1 3.94Å; P99-S341 WeakPolarHBondContact CG-O 3.36Å; P99-V342 HydrophobicContact CB-CG2 3.94Å; P99-V342 HydrophobicContact CG-CB 4.45Å; P99-V342 HydrophobicContact CG-CG1 4.37Å; P99-V342 HydrophobicContact CG-CG2 4.24Å
100	A	98.3	Very high	96.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-71.7	-41.2	177.3	0	0	0	0	0	111.4	R97 Q98 E102 V103 I104 H135	R97-A100 PolarHBondContact O-N 3.03Å; Q98-A100 VanDerWaalsContact C-N 3.29Å; Q98-A100 PolarHBondContact O-N 3.46Å; A100-E102 VanDerWaalsContact C-N 3.3Å; A100-E102 PolarHBondContact O-N 2.88Å; A100-V103 PolarHBondContact O-N 3.13Å; A100-I104 WeakPolarHBondContact O-CB 3.42Å; A100-I104 VanDerWaalsContact O-CG1 3.22Å; A100-I104 WeakPolarHBondContact O-CG1 3.22Å; A100-I104 PolarHBondContact O-N 3.47Å; A100-H135 HydrophobicContact CB-CB 4.07Å; A100-H135 VanDerWaalsContact CB-ND1 3.32Å; A100-H135 WeakPolarHBondContact CB-ND1 3.47Å
101	L	98.3	Very high	96.9	Very high	14 Å²	14	36.9 Å²	36.9	7%	0.073	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-38.7	175	-68.1	-174.6	0	0	0	112.5	H54 S55 V59 V96 R97 Q98 I104 S105	H54-L101 HydrophobicContact CB-CD2 3.59Å; S55-L101 WeakPolarHBondContact O-CD1 3.39Å; V59-L101 HydrophobicContact CG2-CD1 3.41Å; V59-L101 VanDerWaalsContact CG2-CD1 3.41Å; V96-L101 HydrophobicContact CG1-CD1 3.79Å; V96-L101 HydrophobicContact CG1-CD2 3.73Å; V96-L101 HydrophobicContact CG1-CG 3.8Å; R97-L101 PolarHBondContact O-N 3.29Å; Q98-L101 PolarHBondContact O-N 3.16Å; Q98-L101 VanDerWaalsContact O-N 3.16Å; L101-I104 PolarHBondContact O-N 2.96Å; L101-S105 VanDerWaalsContact O-CB 3.27Å; L101-S105 WeakPolarHBondContact O-CB 3.49Å; L101-S105 PolarHBondContact O-N 3.18Å
102	E	98.1	Very high	96.9	Very high	64 Å²	64	36.8 Å²	36.8	30%	0.299	18%	0.177	S	C	.	.	H	α-helix	trans	-59.6	-51.6	176.2	-173.7	-174.6	166.9	0	0	110.9	Q98 A100 I104 S105 Y106	Q98-E102 WeakPolarHBondContact O-CB 3.45Å; Q98-E102 PolarHBondContact O-N 2.88Å; A100-E102 VanDerWaalsContact C-N 3.3Å; A100-E102 PolarHBondContact O-N 2.88Å; E102-I104 PolarHBondContact O-N 3.23Å; E102-S105 WeakPolarHBondContact O-CB 3.45Å; E102-S105 PolarHBondContact O-N 3.22Å; E102-Y106 HydrophobicContact CG-CD2 4.23Å; E102-Y106 HydrophobicContact CG-CE2 3.47Å; E102-Y106 VanDerWaalsContact CG-CE2 3.47Å; E102-Y106 WeakPolarHBondContact O-CD2 3.33Å; E102-Y106 PolarHBondContact O-N 2.95Å; E102-Y106 VanDerWaalsContact OE1-CE2 3.31Å; E102-Y106 WeakPolarHBondContact OE1-CE2 3.32Å; E102-Y106 PolarHBondContact OE1-OH 3.14Å
103	V	98.4	Very high	96.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-42.2	177.6	176.8	0	0	0	0	111.9	P99 A100 S105 Y106 L107 Y119 F121 T136 I304 V340	P99-V103 PolarHBondContact O-N 3Å; A100-V103 PolarHBondContact O-N 3.13Å; V103-S105 VanDerWaalsContact C-N 3.27Å; V103-S105 PolarHBondContact O-N 3.49Å; V103-Y106 PolarHBondContact O-N 2.93Å; V103-Y106 VanDerWaalsContact O-N 3.17Å; V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.37Å; V103-L107 PolarHBondContact O-N 2.83Å; V103-Y119 HydrophobicContact CG1-CD1 4.25Å; V103-Y119 HydrophobicContact CG1-CD2 4.34Å; V103-Y119 HydrophobicContact CG1-CG 4.06Å; V103-Y119 HydrophobicContact CG2-CD1 4.34Å; V103-F121 HydrophobicContact CB-CE1 4.47Å; V103-F121 HydrophobicContact CB-CZ 3.91Å; V103-F121 HydrophobicContact CG1-CZ 4.34Å; V103-F121 HydrophobicContact CG2-CE1 3.62Å; V103-F121 HydrophobicContact CG2-CE2 4.29Å; V103-F121 HydrophobicContact CG2-CZ 3.42Å; V103-F121 VanDerWaalsContact CG2-CZ 3.42Å; V103-T136 HydrophobicContact CB-CG2 4.41Å; V103-T136 HydrophobicContact CG1-CG2 3.69Å; V103-I304 HydrophobicContact CG1-CG2 4.43Å; V103-V340 HydrophobicContact CG2-CB 4.36Å; V103-V340 HydrophobicContact CG2-CG1 4.2Å; V103-V340 HydrophobicContact CG2-CG2 3.73Å
104	I	98.4	Very high	96.6	Very high	3 Å²	3	45 Å²	45	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-39.7	175.4	-70	167.3	0	0	0	110.8	A100 L101 E102 L107 K108 T136 F139	A100-I104 WeakPolarHBondContact O-CB 3.42Å; A100-I104 VanDerWaalsContact O-CG1 3.22Å; A100-I104 WeakPolarHBondContact O-CG1 3.22Å; A100-I104 PolarHBondContact O-N 3.47Å; L101-I104 PolarHBondContact O-N 2.96Å; E102-I104 PolarHBondContact O-N 3.23Å; I104-L107 PolarHBondContact O-N 2.88Å; I104-K108 HydrophobicContact CG2-CD 4.19Å; I104-K108 VanDerWaalsContact O-CG 3.32Å; I104-K108 WeakPolarHBondContact O-CG 3.33Å; I104-K108 PolarHBondContact O-N 3.48Å; I104-T136 HydrophobicContact CG1-CG2 4.24Å; I104-F139 HydrophobicContact CD1-CB 3.97Å; I104-F139 HydrophobicContact CD1-CG 4.36Å; I104-F139 HydrophobicContact CG1-CB 4.02Å; I104-F139 HydrophobicContact CG1-CD1 4.14Å; I104-F139 HydrophobicContact CG1-CG 4.03Å; I104-F139 HydrophobicContact CG2-CD1 4.18Å; I104-F139 HydrophobicContact CG2-CD2 3.89Å; I104-F139 HydrophobicContact CG2-CE1 4.26Å; I104-F139 HydrophobicContact CG2-CE2 3.98Å; I104-F139 HydrophobicContact CG2-CG 3.99Å; I104-F139 HydrophobicContact CG2-CZ 4.16Å
105	S	98	Very high	96.5	Very high	42 Å²	42	48.1 Å²	48.1	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-42.7	175.4	-174.8	0	0	0	0	111.8	L101 E102 V103 K108 K109	L101-S105 VanDerWaalsContact O-CB 3.27Å; L101-S105 WeakPolarHBondContact O-CB 3.49Å; L101-S105 PolarHBondContact O-N 3.18Å; E102-S105 WeakPolarHBondContact O-CB 3.45Å; E102-S105 PolarHBondContact O-N 3.22Å; V103-S105 VanDerWaalsContact C-N 3.27Å; V103-S105 PolarHBondContact O-N 3.49Å; S105-K108 PolarHBondContact O-N 3.41Å; S105-K109 WeakPolarHBondContact O-CG 3.19Å; S105-K109 PolarHBondContact O-N 2.74Å
106	Y	97.8	Very high	96.4	Very high	88 Å²	88	47.6 Å²	47.6	35%	0.345	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-43.7	174.3	-61.9	-35.5	0	0	0	112.3	E102 V103 K108 K109 A110 Y119 I338	E102-Y106 HydrophobicContact CG-CD2 4.23Å; E102-Y106 HydrophobicContact CG-CE2 3.47Å; E102-Y106 VanDerWaalsContact CG-CE2 3.47Å; E102-Y106 WeakPolarHBondContact O-CD2 3.33Å; E102-Y106 PolarHBondContact O-N 2.95Å; E102-Y106 VanDerWaalsContact OE1-CE2 3.31Å; E102-Y106 WeakPolarHBondContact OE1-CE2 3.32Å; E102-Y106 PolarHBondContact OE1-OH 3.14Å; V103-Y106 PolarHBondContact O-N 2.93Å; V103-Y106 VanDerWaalsContact O-N 3.17Å; Y106-K108 VanDerWaalsContact C-N 3.33Å; Y106-K108 PolarHBondContact O-N 2.61Å; Y106-K109 PolarHBondContact O-N 2.91Å; Y106-K109 VanDerWaalsContact O-N 3.15Å; Y106-A110 WeakPolarHBondContact O-CB 3.44Å; Y106-A110 PolarHBondContact O-N 3.15Å; Y106-Y119 WeakPolarHBondContact CB-OH 3.21Å; Y106-Y119 HydrophobicContact CD2-CD1 4.18Å; Y106-Y119 AromaticContact CD2-CE1 3.68Å; Y106-Y119 HydrophobicContact CD2-CE1 3.68Å; Y106-Y119 HydrophobicContact CG-CE1 4.04Å; Y106-I338 HydrophobicContact CD2-CG2 4.5Å; Y106-I338 HydrophobicContact CE2-CG2 4.15Å
107	L	97.6	Very high	96.3	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-42.2	175.6	-67.5	171.7	0	0	0	111.5	V103 I104 K109 A110 Y112 Y119 T136 F139 W145 A302 I304	V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.37Å; V103-L107 PolarHBondContact O-N 2.83Å; I104-L107 PolarHBondContact O-N 2.88Å; L107-K109 VanDerWaalsContact C-N 3.26Å; L107-K109 PolarHBondContact O-N 3.43Å; L107-A110 PolarHBondContact O-N 3.21Å; L107-Y112 WeakPolarHBondContact CA-OH 3.38Å; L107-Y112 PolarHBondContact O-OH 2.93Å; L107-Y119 HydrophobicContact CD2-CE2 3.77Å; L107-Y119 HydrophobicContact CG-CE2 4.46Å; L107-T136 HydrophobicContact CD1-CG2 3.57Å; L107-F139 HydrophobicContact CB-CE1 4.02Å; L107-F139 HydrophobicContact CD1-CD1 4.18Å; L107-F139 HydrophobicContact CD1-CE1 4.24Å; L107-W145 HydrophobicContact CD2-CH2 4.23Å; L107-A302 HydrophobicContact CD2-CB 3.5Å; L107-I304 HydrophobicContact CD1-CD1 4Å
108	K	96.7	Very high	96.3	Very high	105 Å²	105	51 Å²	51	46%	0.457	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-32.3	177	-73.9	171.2	178.2	176	0	113.5	A52 I104 S105 Y106 F139	A52-K108 WeakPolarHBondContact O-CE 3.44Å; A52-K108 PolarHBondContact O-NZ 3.42Å; I104-K108 HydrophobicContact CG2-CD 4.19Å; I104-K108 VanDerWaalsContact O-CG 3.32Å; I104-K108 WeakPolarHBondContact O-CG 3.33Å; I104-K108 PolarHBondContact O-N 3.48Å; S105-K108 PolarHBondContact O-N 3.41Å; Y106-K108 VanDerWaalsContact C-N 3.33Å; Y106-K108 PolarHBondContact O-N 2.61Å; K108-F139 HydrophobicContact CG-CE2 4.3Å; K108-F139 HydrophobicContact CG-CZ 3.77Å
109	K	96.3	Very high	96.3	Very high	169 Å²	169	47 Å²	47	74%	0.735	24%	0.241	S	C	*	.	H	α-helix	trans	-95	-10.4	-176.2	-66.1	175.7	-174.6	177.2	0	113.8	S105 Y106 L107	S105-K109 WeakPolarHBondContact O-CG 3.19Å; S105-K109 PolarHBondContact O-N 2.74Å; Y106-K109 PolarHBondContact O-N 2.91Å; Y106-K109 VanDerWaalsContact O-N 3.15Å; L107-K109 VanDerWaalsContact C-N 3.26Å; L107-K109 PolarHBondContact O-N 3.43Å
110	A	94.5	Very high	96.3	Very high	20 Å²	20	46.7 Å²	46.7	17%	0.165	24%	0.239	C	C	.	.			trans	-69.1	139.8	-174.8	0	0	0	0	0	111.8	Y106 L107 Y112 L117	Y106-A110 WeakPolarHBondContact O-CB 3.44Å; Y106-A110 PolarHBondContact O-N 3.15Å; L107-A110 PolarHBondContact O-N 3.21Å; A110-Y112 HydrophobicContact CB-CE1 4.18Å; A110-Y112 HydrophobicContact CB-CE2 4.16Å; A110-Y112 WeakPolarHBondContact O-CE2 3.32Å; A110-L117 HydrophobicContact CB-CD1 4.01Å
111	D	94.1	Very high	96.3	Very high	93 Å²	93	46.7 Å²	46.7	50%	0.497	24%	0.239	S	C	.	.			trans	-87.9	111.4	167.8	179.4	4	0	0	0	109.3	S113 Q114	D111-S113 VanDerWaalsContact C-N 3.26Å; D111-S113 PolarHBondContact O-N 2.98Å; D111-S113 WeakPolarHBondContact OD1-CB 3.4Å; D111-S113 PolarHBondContact OD1-N 3.41Å; D111-S113 PolarHBondContact OD1-OG 3.39Å; D111-S113 PolarHBondContact OD2-OG 3.22Å; D111-Q114 HydrophobicContact CB-CG 4.13Å; D111-Q114 WeakPolarHBondContact O-CB 3.38Å; D111-Q114 PolarHBondContact O-N 3.29Å
112	Y	92.6	Very high	96.3	Very high	30 Å²	30	48.5 Å²	48.5	12%	0.118	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.2	-177.3	-64.8	-73.3	0	0	0	114.1	L107 A110 W145 G300 A302	L107-Y112 WeakPolarHBondContact CA-OH 3.38Å; L107-Y112 PolarHBondContact O-OH 2.93Å; A110-Y112 HydrophobicContact CB-CE1 4.18Å; A110-Y112 HydrophobicContact CB-CE2 4.16Å; A110-Y112 WeakPolarHBondContact O-CE2 3.32Å; Y112-W145 HydrophobicContact CD1-CH2 4.37Å; Y112-W145 AromaticContact CE1-CH2 3.41Å; Y112-W145 HydrophobicContact CE1-CH2 3.41Å; Y112-W145 VanDerWaalsContact CE1-CH2 3.41Å; Y112-W145 HydrophobicContact CE1-CZ2 4.11Å; Y112-W145 HydrophobicContact CE1-CZ3 4.21Å; Y112-W145 HydrophobicContact CE2-CH2 4.22Å; Y112-W145 HydrophobicContact CE2-CZ2 4.08Å; Y112-W145 AromaticContact CZ-CH2 3.32Å; Y112-W145 AromaticContact CZ-CZ2 3.58Å; Y112-W145 WeakPolarHBondContact OH-CH2 3.32Å; Y112-W145 WeakPolarHBondContact OH-CZ2 3.32Å; Y112-G300 WeakPolarHBondContact O-CA 3.09Å; Y112-G300 PolarHBondContact O-N 2.86Å; Y112-A302 HydrophobicContact CE1-CB 4.45Å
113	S	90.8	Very high	96.3	Very high	82 Å²	82	45.8 Å²	45.8	57%	0.573	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-19.5	165	72.4	0	0	0	0	112.3	D111	D111-S113 VanDerWaalsContact C-N 3.26Å; D111-S113 PolarHBondContact O-N 2.98Å; D111-S113 WeakPolarHBondContact OD1-CB 3.4Å; D111-S113 PolarHBondContact OD1-N 3.41Å; D111-S113 PolarHBondContact OD1-OG 3.39Å; D111-S113 PolarHBondContact OD2-OG 3.22Å
114	Q	92.6	Very high	96.3	Very high	111 Å²	111	49.8 Å²	49.8	52%	0.519	26%	0.255	S	S	.	.	S	Bend	trans	-83.2	164.9	176.6	-60.5	-60.7	-33	0	0	111.5	D111 S299	D111-Q114 HydrophobicContact CB-CG 4.13Å; D111-Q114 WeakPolarHBondContact O-CB 3.38Å; D111-Q114 PolarHBondContact O-N 3.29Å; Q114-S299 WeakPolarHBondContact O-CB 3.36Å
115	P	94.1	Very high	96.2	Very high	68 Å²	68	54.7 Å²	54.7	44%	0.442	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-52.4	142.5	172.7	-28.9	37.1	0	0	0	113.2	L117 N296	P115-L117 PolarHBondContact O-N 3.45Å; P115-N296 WeakPolarHBondContact CB-O 3.47Å
116	A	94.5	Very high	96.1	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.033	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-56.5	122.5	-175.8	0	0	0	0	0	112.1	W298	A116-W298 HydrophobicContact CB-CD2 3.94Å; A116-W298 HydrophobicContact CB-CE3 4.06Å; A116-W298 HydrophobicContact CB-CH2 3.89Å; A116-W298 HydrophobicContact CB-CZ2 3.76Å; A116-W298 HydrophobicContact CB-CZ3 4.03Å; A116-W298 WeakPolarHBondContact CB-O 3.42Å; A116-W298 PolarHBondContact N-O 2.82Å
117	L	96.6	Very high	96.1	Very high	77 Å²	77	49.6 Å²	49.6	40%	0.403	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	141.6	176.7	-65.5	175.5	0	0	0	111	A110 P115 Y119 V303	A110-L117 HydrophobicContact CB-CD1 4.01Å; P115-L117 PolarHBondContact O-N 3.45Å; L117-Y119 HydrophobicContact CB-CE2 3.87Å; L117-Y119 WeakPolarHBondContact CD1-OH 3.42Å; L117-V303 PolarHBondContact O-N 2.88Å
118	R	97.9	Very high	96.1	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.2	-179.3	-62.5	-177.9	-71.7	-167.1	-3.2	110.3	M294 V303 N333 M334 D335 P336 F337 I338	R118-M294 VanDerWaalsContact CD-O 3.23Å; R118-M294 WeakPolarHBondContact CD-O 3.42Å; R118-M294 PolarHBondContact NH1-O 2.93Å; R118-V303 CarbonylContact C-O 3.48Å; R118-V303 WeakPolarHBondContact CA-O 3.28Å; R118-V303 HydrophobicContact CG-CB 3.99Å; R118-V303 HydrophobicContact CG-CG1 4.33Å; R118-V303 HydrophobicContact CG-CG2 4.39Å; R118-N333 PolarHBondContact NH1-O 3.36Å; R118-M334 PolarHBondContact NE-O 2.66Å; R118-M334 VanDerWaalsContact NE-O 3.14Å; R118-M334 PolarHBondContact NH1-O 2.7Å; R118-M334 PolarHBondContact NH2-O 3.37Å; R118-D335 PolarHBondContact NH2-O 3.43Å; R118-P336 PolarHBondContact NE-O 3.37Å; R118-P336 VanDerWaalsContact NH2-N 3.11Å; R118-P336 PolarHBondContact NH2-O 2.87Å; R118-F337 HydrophobicContact CB-CB 3.9Å; R118-F337 CarbonylContact O-C 3.23Å; R118-F337 WeakPolarHBondContact O-CA 3.33Å; R118-I338 PolarHBondContact O-N 3.01Å
119	Y	98.4	Very high	96.1	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.1	175.8	-54	-85.2	0	0	0	109.6	V103 Y106 L107 L117 A302 V303 I304 T305 I338	V103-Y119 HydrophobicContact CG1-CD1 4.25Å; V103-Y119 HydrophobicContact CG1-CD2 4.34Å; V103-Y119 HydrophobicContact CG1-CG 4.06Å; V103-Y119 HydrophobicContact CG2-CD1 4.34Å; Y106-Y119 WeakPolarHBondContact CB-OH 3.21Å; Y106-Y119 HydrophobicContact CD2-CD1 4.18Å; Y106-Y119 AromaticContact CD2-CE1 3.68Å; Y106-Y119 HydrophobicContact CD2-CE1 3.68Å; Y106-Y119 HydrophobicContact CG-CE1 4.04Å; L107-Y119 HydrophobicContact CD2-CE2 3.77Å; L107-Y119 HydrophobicContact CG-CE2 4.46Å; L117-Y119 HydrophobicContact CB-CE2 3.87Å; L117-Y119 WeakPolarHBondContact CD1-OH 3.42Å; Y119-A302 HydrophobicContact CE2-CB 4.23Å; Y119-V303 PolarHBondContact N-O 3.11Å; Y119-I304 HydrophobicContact CD2-CG1 4.21Å; Y119-T305 PolarHBondContact O-N 3.33Å; Y119-T305 PolarHBondContact O-OG1 3.36Å; Y119-I338 HydrophobicContact CD1-CB 3.95Å; Y119-I338 HydrophobicContact CD1-CD1 3.94Å; Y119-I338 HydrophobicContact CD1-CG2 4.16Å; Y119-I338 HydrophobicContact CE1-CB 4.38Å; Y119-I338 HydrophobicContact CE1-CD1 3.48Å; Y119-I338 VanDerWaalsContact CE1-CD1 3.48Å; Y119-I338 HydrophobicContact CE1-CG1 4.5Å
120	V	98.6	Very high	96.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	104.5	-179	-176.2	0	0	0	0	109.9	Y122 T305 L307 M334 F337 I338 V340	V120-Y122 PolarHBondContact O-N 2.87Å; V120-T305 WeakPolarHBondContact CA-O 3.31Å; V120-T305 WeakPolarHBondContact CG2-OG1 3.38Å; V120-L307 HydrophobicContact CG1-CD1 4.03Å; V120-L307 HydrophobicContact CG1-CD2 4.2Å; V120-L307 HydrophobicContact CG1-CG 3.73Å; V120-M334 HydrophobicContact CG2-CE 3.91Å; V120-F337 HydrophobicContact CB-CD2 3.64Å; V120-F337 HydrophobicContact CB-CE2 3.86Å; V120-F337 HydrophobicContact CG1-CE2 4.34Å; V120-F337 HydrophobicContact CG2-CB 3.99Å; V120-F337 HydrophobicContact CG2-CD2 3.27Å; V120-F337 HydrophobicContact CG2-CE2 3.82Å; V120-F337 HydrophobicContact CG2-CG 3.73Å; V120-I338 PolarHBondContact N-O 3.25Å; V120-V340 PolarHBondContact O-N 2.9Å
121	F	98.8	Very high	96.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	119.9	170.6	-68.6	-69.7	0	0	0	110.4	P99 V103 K129 L133 I304 T305 T306 L307 V340 V342	P99-F121 HydrophobicContact CB-CD1 4.4Å; P99-F121 HydrophobicContact CB-CE1 4.09Å; V103-F121 HydrophobicContact CB-CE1 4.47Å; V103-F121 HydrophobicContact CB-CZ 3.91Å; V103-F121 HydrophobicContact CG1-CZ 4.34Å; V103-F121 HydrophobicContact CG2-CE1 3.62Å; V103-F121 HydrophobicContact CG2-CE2 4.29Å; V103-F121 HydrophobicContact CG2-CZ 3.42Å; V103-F121 VanDerWaalsContact CG2-CZ 3.42Å; F121-K129 HydrophobicContact CB-CB 4.43Å; F121-K129 HydrophobicContact CB-CG 4.45Å; F121-L133 HydrophobicContact CD2-CB 4.43Å; F121-L133 HydrophobicContact CE2-CB 4.46Å; F121-L133 HydrophobicContact CE2-CD1 4.45Å; F121-I304 HydrophobicContact CD2-CG2 4.29Å; F121-I304 HydrophobicContact CE2-CG2 3.68Å; F121-T305 WeakPolarHBondContact CD2-O 3.28Å; F121-T305 PolarHBondContact N-O 3.1Å; F121-T306 HydrophobicContact CB-CG2 3.88Å; F121-T306 HydrophobicContact CD2-CG2 4.02Å; F121-T306 HydrophobicContact CG-CG2 4.39Å; F121-T306 WeakPolarHBondContact O-CA 3.41Å; F121-L307 PolarHBondContact O-N 3.41Å; F121-V340 WeakPolarHBondContact CA-O 3.37Å; F121-V340 HydrophobicContact CD1-CB 3.87Å; F121-V340 HydrophobicContact CD1-CG1 3.79Å; F121-V340 HydrophobicContact CE1-CB 4.15Å; F121-V340 HydrophobicContact CE1-CG1 3.76Å; F121-V342 HydrophobicContact CB-CG2 4.05Å; F121-V342 HydrophobicContact CD1-CG2 3.66Å; F121-V342 HydrophobicContact CG-CG2 4.27Å
122	Y	98.5	Very high	96.6	Very high	51 Å²	51	36.4 Å²	36.4	20%	0.2	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	164.8	177.4	78.5	-78.3	0	0	0	111.6	V120 L321 P322 P339 V340 V342	V120-Y122 PolarHBondContact O-N 2.87Å; Y122-L321 HydrophobicContact CE2-CD2 4.29Å; Y122-P322 HydrophobicContact CD1-CG 4.22Å; Y122-P322 HydrophobicContact CD2-CG 4.21Å; Y122-P322 HydrophobicContact CG-CG 3.91Å; Y122-P339 HydrophobicContact CD1-CB 4.13Å; Y122-P339 HydrophobicContact CE1-CB 3.78Å; Y122-V340 WeakPolarHBondContact CD1-O 3.5Å; Y122-V340 PolarHBondContact N-O 3.13Å; Y122-V342 PolarHBondContact O-N 3.05Å
123	G	97.7	Very high	96.8	Very high	8 Å²	8	35 Å²	35	8%	0.082	20%	0.196	C	C	.	.			trans	146.3	171.6	-177.6	0	0	0	0	0	112.7	K129	G123-K129 PolarHBondContact O-NZ 2.89Å
124	L	97.4	Very high	97.1	Very high	83 Å²	83	31 Å²	31	44%	0.435	17%	0.168	S	C	.	.	S	Bend	trans	-56.7	160.4	-174.8	-66	170	0	0	0	113.4	G126 T127 K129 Y320	L124-G126 PolarHBondContact O-N 2.92Å; L124-T127 HydrophobicContact CB-CG2 3.76Å; L124-T127 VanDerWaalsContact O-CG2 3.32Å; L124-T127 WeakPolarHBondContact O-CG2 3.34Å; L124-T127 PolarHBondContact O-N 2.9Å; L124-T127 PolarHBondContact O-OG1 3.43Å; L124-K129 PolarHBondContact O-NZ 3.4Å; L124-Y320 HydrophobicContact CD2-CD1 3.47Å; L124-Y320 VanDerWaalsContact CD2-CD1 3.47Å; L124-Y320 HydrophobicContact CD2-CD2 4.38Å; L124-Y320 HydrophobicContact CD2-CE1 3.68Å; L124-Y320 HydrophobicContact CD2-CG 3.86Å; L124-Y320 HydrophobicContact CG-CD1 4.48Å; L124-Y320 HydrophobicContact CG-CG 4.47Å
125	K	96.8	Very high	97.4	Very high	106 Å²	106	25.8 Å²	25.8	46%	0.461	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	133.1	175.4	-178.8	173.5	179.4	170.2	0	110.5	T310 N384	K125-T310 VanDerWaalsContact CE-OG1 3.27Å; K125-T310 WeakPolarHBondContact CE-OG1 3.44Å; K125-N384 PolarHBondContact O-ND2 2.96Å
126	G	96.1	Very high	97.6	Very high	22 Å²	22	22.6 Å²	22.6	23%	0.227	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	10.6	174.8	0	0	0	0	0	116	L124 G128 N384 P385 S386	L124-G126 PolarHBondContact O-N 2.92Å; G126-G128 VanDerWaalsContact C-N 3.32Å; G126-G128 PolarHBondContact O-N 3.43Å; G126-N384 PolarHBondContact O-OD1 2.85Å; G126-P385 WeakPolarHBondContact O-CB 3.42Å; G126-P385 VanDerWaalsContact O-CD 3.29Å; G126-P385 WeakPolarHBondContact O-CD 3.41Å; G126-S386 VanDerWaalsContact CA-CB 3.48Å; G126-S386 PolarHBondContact O-N 3.49Å
127	T	97.8	Very high	97.7	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	12%	0.121	C	C	.	.	S	Bend	trans	-78.8	-2.6	179.6	58.4	0	0	0	0	115.7	R97 L124 K129 V342 N344	R97-T127 PolarHBondContact NH1-O 3.2Å; L124-T127 HydrophobicContact CB-CG2 3.76Å; L124-T127 VanDerWaalsContact O-CG2 3.32Å; L124-T127 WeakPolarHBondContact O-CG2 3.34Å; L124-T127 PolarHBondContact O-N 2.9Å; L124-T127 PolarHBondContact O-OG1 3.43Å; T127-K129 PolarHBondContact OG1-NZ 2.99Å; T127-V342 WeakPolarHBondContact CB-O 3.22Å; T127-V342 WeakPolarHBondContact CG2-O 3.34Å; T127-V342 WeakPolarHBondContact O-CG1 3.48Å; T127-V342 PolarHBondContact OG1-O 3.45Å; T127-N344 WeakPolarHBondContact CG2-OD1 3.42Å
128	G	97.3	Very high	97.8	Very high	20 Å²	20	18.9 Å²	18.9	21%	0.206	10%	0.103	C	C	.	.			trans	87.3	26.5	178.9	0	0	0	0	0	115.6	G126 M131 S132	G126-G128 VanDerWaalsContact C-N 3.32Å; G126-G128 PolarHBondContact O-N 3.43Å; G128-M131 PolarHBondContact O-N 2.86Å; G128-S132 PolarHBondContact O-N 3.33Å; G128-S132 PolarHBondContact O-OG 2.87Å
129	K	98.1	Very high	97.8	Very high	16 Å²	16	18.9 Å²	18.9	7%	0.07	10%	0.103	C	C	.	.	H	α-helix	trans	-53.7	-52.7	173	-69.4	177.4	-69.6	-69.4	0	112.5	F121 G123 L124 T127 M131 S132 L133 T306 L307 V342	F121-K129 HydrophobicContact CB-CB 4.43Å; F121-K129 HydrophobicContact CB-CG 4.45Å; G123-K129 PolarHBondContact O-NZ 2.89Å; L124-K129 PolarHBondContact O-NZ 3.4Å; T127-K129 PolarHBondContact OG1-NZ 2.99Å; K129-M131 VanDerWaalsContact C-N 3.3Å; K129-M131 PolarHBondContact O-N 2.64Å; K129-S132 WeakPolarHBondContact O-CB 3.31Å; K129-S132 PolarHBondContact O-N 2.91Å; K129-S132 VanDerWaalsContact O-N 3.08Å; K129-L133 PolarHBondContact O-N 3.08Å; K129-T306 HydrophobicContact CB-CG2 4.16Å; K129-L307 VanDerWaalsContact CD-O 3.29Å; K129-L307 WeakPolarHBondContact CD-O 3.41Å; K129-L307 WeakPolarHBondContact CE-O 3.34Å; K129-V342 HydrophobicContact CG-CB 3.8Å; K129-V342 HydrophobicContact CG-CG1 4.21Å; K129-V342 HydrophobicContact CG-CG2 3.85Å
130	T	97.6	Very high	97.7	Very high	33 Å²	33	18.8 Å²	18.8	20%	0.202	10%	0.103	C	C	.	.	H	α-helix	trans	-56.6	-42.7	176.5	-51.1	0	0	0	0	111.9	P79 S132 L133 C134 D260	P79-T130 HydrophobicContact CG-CG2 3.76Å; T130-S132 VanDerWaalsContact C-N 3.31Å; T130-S132 PolarHBondContact O-N 2.86Å; T130-L133 WeakPolarHBondContact O-CB 3.46Å; T130-L133 PolarHBondContact O-N 3.46Å; T130-C134 PolarHBondContact O-N 3.3Å; T130-C134 PolarHBondContact O-SG 2.91Å; T130-D260 WeakPolarHBondContact CB-OD2 3.27Å; T130-D260 WeakPolarHBondContact CG2-OD2 3.36Å; T130-D260 PolarHBondContact OG1-OD2 2.88Å
131	M	97.7	Very high	97.6	Very high	40 Å²	40	21.4 Å²	21.4	20%	0.197	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-35.2	178	-64.6	-54.6	-62.2	0	0	112.2	L78 P79 Y82 I94 G128 K129 C134 H135	L78-M131 HydrophobicContact CD2-CE 4.39Å; L78-M131 HydrophobicContact CD2-SD 4.28Å; P79-M131 HydrophobicContact CG-SD 4.2Å; Y82-M131 HydrophobicContact CD1-CE 3.93Å; Y82-M131 HydrophobicContact CD1-SD 4.13Å; Y82-M131 HydrophobicContact CD2-CE 4.15Å; Y82-M131 HydrophobicContact CE1-CE 3.68Å; Y82-M131 HydrophobicContact CE1-SD 4.48Å; Y82-M131 HydrophobicContact CE2-CE 3.93Å; Y82-M131 HydrophobicContact CG-CE 4.15Å; Y82-M131 HydrophobicContact CG-SD 4.15Å; I94-M131 HydrophobicContact CD1-CE 4.09Å; I94-M131 HydrophobicContact CG1-CE 3.85Å; I94-M131 HydrophobicContact CG2-CE 4.46Å; G128-M131 PolarHBondContact O-N 2.86Å; K129-M131 VanDerWaalsContact C-N 3.3Å; K129-M131 PolarHBondContact O-N 2.64Å; M131-C134 PolarHBondContact O-N 2.9Å; M131-H135 PolarHBondContact O-N 2.86Å
132	S	98.3	Very high	97.5	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-68.1	-38.8	174.5	-52.1	0	0	0	0	111.5	G128 K129 T130 H135 T136	G128-S132 PolarHBondContact O-N 3.33Å; G128-S132 PolarHBondContact O-OG 2.87Å; K129-S132 WeakPolarHBondContact O-CB 3.31Å; K129-S132 PolarHBondContact O-N 2.91Å; K129-S132 VanDerWaalsContact O-N 3.08Å; T130-S132 VanDerWaalsContact C-N 3.31Å; T130-S132 PolarHBondContact O-N 2.86Å; S132-H135 PolarHBondContact O-N 2.92Å; S132-T136 PolarHBondContact O-N 2.84Å; S132-T136 PolarHBondContact O-OG1 3.47Å
133	L	98.2	Very high	97.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-46.5	170.5	179.2	67.7	0	0	0	111.1	F121 K129 T130 H135 T136 L137 A258 D260 I304 T306	F121-L133 HydrophobicContact CD2-CB 4.43Å; F121-L133 HydrophobicContact CE2-CB 4.46Å; F121-L133 HydrophobicContact CE2-CD1 4.45Å; K129-L133 PolarHBondContact O-N 3.08Å; T130-L133 WeakPolarHBondContact O-CB 3.46Å; T130-L133 PolarHBondContact O-N 3.46Å; L133-H135 PolarHBondContact O-N 3.21Å; L133-T136 PolarHBondContact O-N 2.81Å; L133-L137 HydrophobicContact CG-CD1 4.1Å; L133-L137 HydrophobicContact CG-CG 4.49Å; L133-L137 WeakPolarHBondContact O-CB 3.39Å; L133-L137 WeakPolarHBondContact O-CG 3.36Å; L133-L137 PolarHBondContact O-N 2.96Å; L133-A258 HydrophobicContact CD1-CB 4.07Å; L133-D260 HydrophobicContact CD2-CB 4.21Å; L133-I304 HydrophobicContact CD1-CB 3.97Å; L133-I304 HydrophobicContact CD1-CG2 3.44Å; L133-I304 VanDerWaalsContact CD1-CG2 3.44Å; L133-I304 WeakPolarHBondContact CD1-O 3.38Å; L133-T306 HydrophobicContact CB-CG2 3.67Å; L133-T306 HydrophobicContact CD2-CG2 3.82Å; L133-T306 HydrophobicContact CG-CG2 4.22Å
134	C	97.4	Very high	97.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-40.9	177.8	-66.1	0	0	0	0	112.4	F74 L78 I94 T130 M131 L137 H138	F74-C134 HydrophobicContact CE1-CB 3.74Å; F74-C134 HydrophobicContact CZ-CB 3.97Å; F74-C134 WeakPolarHBondContact CZ-O 3.4Å; L78-C134 HydrophobicContact CD2-CB 4.23Å; I94-C134 HydrophobicContact CD1-CB 4.44Å; T130-C134 PolarHBondContact O-N 3.3Å; T130-C134 PolarHBondContact O-SG 2.91Å; M131-C134 PolarHBondContact O-N 2.9Å; C134-L137 PolarHBondContact O-N 2.96Å; C134-H138 WeakPolarHBondContact O-CB 3.38Å; C134-H138 PolarHBondContact O-N 3.39Å
135	H	97.9	Very high	97.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-45.5	174	-177.7	-162.7	0	0	0	111.1	H54 Y63 I94 A100 M131 S132 L133 L137 H138 F139	H54-H135 AromaticContact CE1-NE2 3.84Å; H54-H135 AromaticContact ND1-CE1 3.57Å; H54-H135 AromaticContact ND1-NE2 3.15Å; H54-H135 PolarHBondContact ND1-NE2 3.24Å; H54-H135 VanDerWaalsContact ND1-NE2 3.15Å; Y63-H135 AromaticContact CE1-CD2 3.8Å; Y63-H135 AromaticContact CZ-CD2 3.79Å; Y63-H135 PolarHBondContact OH-CD2 2.89Å; I94-H135 HydrophobicContact CG2-CB 4.17Å; A100-H135 HydrophobicContact CB-CB 4.07Å; A100-H135 VanDerWaalsContact CB-ND1 3.32Å; A100-H135 WeakPolarHBondContact CB-ND1 3.47Å; M131-H135 PolarHBondContact O-N 2.86Å; S132-H135 PolarHBondContact O-N 2.92Å; L133-H135 PolarHBondContact O-N 3.21Å; H135-L137 VanDerWaalsContact C-N 3.34Å; H135-L137 PolarHBondContact O-N 3.01Å; H135-H138 PolarHBondContact O-N 3.26Å; H135-F139 PolarHBondContact O-N 3.21Å; H135-F139 VanDerWaalsContact O-N 3.08Å
136	T	98.1	Very high	97.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.9	-39.2	176.8	-48.3	0	0	0	0	111.9	V103 I104 L107 S132 L133 F139 C140 I304	V103-T136 HydrophobicContact CB-CG2 4.41Å; V103-T136 HydrophobicContact CG1-CG2 3.69Å; I104-T136 HydrophobicContact CG1-CG2 4.24Å; L107-T136 HydrophobicContact CD1-CG2 3.57Å; S132-T136 PolarHBondContact O-N 2.84Å; S132-T136 PolarHBondContact O-OG1 3.47Å; L133-T136 PolarHBondContact O-N 2.81Å; T136-F139 WeakPolarHBondContact O-CB 3.38Å; T136-F139 PolarHBondContact O-N 3.41Å; T136-C140 PolarHBondContact O-N 2.87Å; T136-C140 PolarHBondContact O-SG 3.19Å; T136-C140 VanDerWaalsContact O-SG 3.4Å; T136-I304 HydrophobicContact CG2-CD1 3.79Å; T136-I304 HydrophobicContact CG2-CG2 4.34Å
137	L	97.3	Very high	97.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.1	-40.1	175	-83.3	173	0	0	0	112.5	L133 C134 H135 F139 C140 Y141 V147 H149 A258	L133-L137 HydrophobicContact CG-CD1 4.1Å; L133-L137 HydrophobicContact CG-CG 4.49Å; L133-L137 WeakPolarHBondContact O-CB 3.39Å; L133-L137 WeakPolarHBondContact O-CG 3.36Å; L133-L137 PolarHBondContact O-N 2.96Å; C134-L137 PolarHBondContact O-N 2.96Å; H135-L137 VanDerWaalsContact C-N 3.34Å; H135-L137 PolarHBondContact O-N 3.01Å; L137-F139 VanDerWaalsContact C-N 3.28Å; L137-F139 PolarHBondContact O-N 3.11Å; L137-C140 PolarHBondContact O-N 3.4Å; L137-Y141 WeakPolarHBondContact O-CB 3.32Å; L137-Y141 PolarHBondContact O-N 3.1Å; L137-V147 HydrophobicContact CD2-CG1 3.63Å; L137-H149 HydrophobicContact CD1-CB 4.44Å; L137-H149 VanDerWaalsContact CD1-CD2 3.49Å; L137-H149 WeakPolarHBondContact CD1-CD2 3.36Å; L137-A258 HydrophobicContact CD1-CB 3.73Å; L137-A258 HydrophobicContact CD2-CB 3.3Å; L137-A258 HydrophobicContact CG-CB 3.78Å
138	H	97.5	Very high	97.2	Very high	3 Å²	3	17.6 Å²	17.6	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-63.8	-36.9	175.8	-178.6	-125	0	0	0	111.4	Y63 L65 H69 L73 F74 C134 H135 T142	Y63-H138 AromaticContact CE2-CE1 3.83Å; Y63-H138 AromaticContact CE2-ND1 3.5Å; Y63-H138 WeakPolarHBondContact CE2-ND1 3.36Å; Y63-H138 AromaticContact CZ-ND1 3.78Å; Y63-H138 PolarHBondContact OH-ND1 2.97Å; Y63-H138 VanDerWaalsContact OH-ND1 3.16Å; L65-H138 HydrophobicContact CD2-CB 4.36Å; L65-H138 WeakPolarHBondContact CD2-CE1 3.26Å; L65-H138 VanDerWaalsContact CD2-CG 3.48Å; L65-H138 WeakPolarHBondContact CD2-ND1 3.03Å; H69-H138 AromaticContact ND1-NE2 3.4Å; H69-H138 PolarHBondContact ND1-NE2 3.39Å; L73-H138 HydrophobicContact CD2-CB 4.18Å; F74-H138 HydrophobicContact CE2-CB 4.38Å; F74-H138 HydrophobicContact CZ-CB 4.12Å; C134-H138 WeakPolarHBondContact O-CB 3.38Å; C134-H138 PolarHBondContact O-N 3.39Å; H135-H138 PolarHBondContact O-N 3.26Å; H138-T142 WeakPolarHBondContact NE2-CG2 3.32Å; H138-T142 WeakPolarHBondContact O-CB 3.36Å; H138-T142 WeakPolarHBondContact O-CG2 3.41Å; H138-T142 PolarHBondContact O-N 2.93Å; H138-T142 PolarHBondContact O-OG1 3.42Å
139	F	97.8	Very high	97.2	Very high	7 Å²	7	17.5 Å²	17.5	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-58.5	-55.3	167.8	169.2	-101.4	0	0	0	111.9	P51 A52 I104 L107 K108 H135 T136 L137 Y141 T142 Q143	P51-F139 HydrophobicContact CB-CB 3.99Å; P51-F139 HydrophobicContact CG-CB 4.07Å; A52-F139 HydrophobicContact CB-CD2 4Å; A52-F139 HydrophobicContact CB-CE2 3.8Å; I104-F139 HydrophobicContact CD1-CB 3.97Å; I104-F139 HydrophobicContact CD1-CG 4.36Å; I104-F139 HydrophobicContact CG1-CB 4.02Å; I104-F139 HydrophobicContact CG1-CD1 4.14Å; I104-F139 HydrophobicContact CG1-CG 4.03Å; I104-F139 HydrophobicContact CG2-CD1 4.18Å; I104-F139 HydrophobicContact CG2-CD2 3.89Å; I104-F139 HydrophobicContact CG2-CE1 4.26Å; I104-F139 HydrophobicContact CG2-CE2 3.98Å; I104-F139 HydrophobicContact CG2-CG 3.99Å; I104-F139 HydrophobicContact CG2-CZ 4.16Å; L107-F139 HydrophobicContact CB-CE1 4.02Å; L107-F139 HydrophobicContact CD1-CD1 4.18Å; L107-F139 HydrophobicContact CD1-CE1 4.24Å; K108-F139 HydrophobicContact CG-CE2 4.3Å; K108-F139 HydrophobicContact CG-CZ 3.77Å; H135-F139 PolarHBondContact O-N 3.21Å; H135-F139 VanDerWaalsContact O-N 3.08Å; T136-F139 WeakPolarHBondContact O-CB 3.38Å; T136-F139 PolarHBondContact O-N 3.41Å; L137-F139 VanDerWaalsContact C-N 3.28Å; L137-F139 PolarHBondContact O-N 3.11Å; F139-Y141 VanDerWaalsContact C-N 3.28Å; F139-Y141 PolarHBondContact O-N 3.25Å; F139-T142 PolarHBondContact O-N 2.87Å; F139-T142 PolarHBondContact O-OG1 2.99Å; F139-Q143 HydrophobicContact CD2-CG 3.89Å; F139-Q143 HydrophobicContact CE1-CG 4.3Å; F139-Q143 HydrophobicContact CE2-CG 3.5Å; F139-Q143 VanDerWaalsContact CE2-CG 3.5Å; F139-Q143 HydrophobicContact CG-CG 4.44Å; F139-Q143 HydrophobicContact CZ-CG 3.73Å; F139-Q143 VanDerWaalsContact O-CG 3.3Å; F139-Q143 WeakPolarHBondContact O-CG 3.36Å; F139-Q143 PolarHBondContact O-N 3.46Å
140	C	97.3	Very high	97.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-56.7	-43.5	-179.9	-63	0	0	0	0	112.1	T136 L137 Q143 G144 W145 A256	T136-C140 PolarHBondContact O-N 2.87Å; T136-C140 PolarHBondContact O-SG 3.19Å; T136-C140 VanDerWaalsContact O-SG 3.4Å; L137-C140 PolarHBondContact O-N 3.4Å; C140-Q143 PolarHBondContact O-N 3.35Å; C140-G144 PolarHBondContact O-N 3.16Å; C140-W145 HydrophobicContact CB-CB 4.08Å; C140-W145 HydrophobicContact CB-CD2 4.28Å; C140-W145 HydrophobicContact CB-CE3 4.48Å; C140-W145 HydrophobicContact CB-CG 4.15Å; C140-W145 VanDerWaalsContact O-CB 3.23Å; C140-W145 WeakPolarHBondContact O-CB 3.27Å; C140-W145 PolarHBondContact O-N 3.38Å; C140-A256 HydrophobicContact CB-CB 3.85Å
141	Y	96.2	Very high	97	Very high	55 Å²	55	17 Å²	17	22%	0.216	10%	0.096	C	C	.	.	H	α-helix	trans	-61.2	-46.8	178.7	-176.9	-98.1	0	0	0	112.6	H69 L73 L137 F139 Q143 G144 V147 T189	H69-Y141 HydrophobicContact CB-CE1 4.35Å; H69-Y141 AromaticContact CD2-CE1 3.89Å; L73-Y141 HydrophobicContact CD1-CD2 3.97Å; L73-Y141 HydrophobicContact CD1-CG 4.16Å; L73-Y141 HydrophobicContact CD2-CD1 4.33Å; L73-Y141 HydrophobicContact CD2-CG 3.98Å; L73-Y141 HydrophobicContact CG-CG 4.49Å; L137-Y141 WeakPolarHBondContact O-CB 3.32Å; L137-Y141 PolarHBondContact O-N 3.1Å; F139-Y141 VanDerWaalsContact C-N 3.28Å; F139-Y141 PolarHBondContact O-N 3.25Å; Y141-Q143 VanDerWaalsContact C-N 3.28Å; Y141-Q143 PolarHBondContact O-N 2.98Å; Y141-G144 PolarHBondContact O-N 3.25Å; Y141-G144 VanDerWaalsContact O-N 3.1Å; Y141-V147 HydrophobicContact CD2-CG2 4.38Å; Y141-T189 HydrophobicContact CD2-CG2 4.38Å; Y141-T189 HydrophobicContact CE2-CG2 4.33Å
142	T	95.7	Very high	96.9	Very high	45 Å²	45	17.1 Å²	17.1	28%	0.276	10%	0.097	S	C	.	.	H	α-helix	trans	-68.6	-26.4	179.2	49.6	0	0	0	0	113	P51 H138 F139 G144	P51-T142 HydrophobicContact CG-CG2 4.34Å; P51-T142 WeakPolarHBondContact CG-OG1 3.32Å; H138-T142 WeakPolarHBondContact NE2-CG2 3.32Å; H138-T142 WeakPolarHBondContact O-CB 3.36Å; H138-T142 WeakPolarHBondContact O-CG2 3.41Å; H138-T142 PolarHBondContact O-N 2.93Å; H138-T142 PolarHBondContact O-OG1 3.42Å; F139-T142 PolarHBondContact O-N 2.87Å; F139-T142 PolarHBondContact O-OG1 2.99Å; T142-G144 PolarHBondContact O-N 3.14Å
143	Q	95.4	Very high	96.8	Very high	91 Å²	91	17 Å²	17	43%	0.425	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	7.3	172.9	-61.9	-54.8	-70.1	0	0	113.7	F139 C140 Y141	F139-Q143 HydrophobicContact CD2-CG 3.89Å; F139-Q143 HydrophobicContact CE1-CG 4.3Å; F139-Q143 HydrophobicContact CE2-CG 3.5Å; F139-Q143 VanDerWaalsContact CE2-CG 3.5Å; F139-Q143 HydrophobicContact CG-CG 4.44Å; F139-Q143 HydrophobicContact CZ-CG 3.73Å; F139-Q143 VanDerWaalsContact O-CG 3.3Å; F139-Q143 WeakPolarHBondContact O-CG 3.36Å; F139-Q143 PolarHBondContact O-N 3.46Å; C140-Q143 PolarHBondContact O-N 3.35Å; Y141-Q143 VanDerWaalsContact C-N 3.28Å; Y141-Q143 PolarHBondContact O-N 2.98Å
144	G	95.3	Very high	96.7	Very high	44 Å²	44	17 Å²	17	45%	0.454	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	30.4	177.2	0	0	0	0	0	114	C140 Y141 T142 F193	C140-G144 PolarHBondContact O-N 3.16Å; Y141-G144 PolarHBondContact O-N 3.25Å; Y141-G144 VanDerWaalsContact O-N 3.1Å; T142-G144 PolarHBondContact O-N 3.14Å; G144-F193 WeakPolarHBondContact O-CZ 3.44Å
145	W	96.9	Very high	96.6	Very high	11 Å²	11	21.2 Å²	21.2	4%	0.042	12%	0.118	C	C	.	.			trans	-84.2	152.4	173.1	-66	41.2	0	0	0	111.2	L107 Y112 C140 R254 A256 A302	L107-W145 HydrophobicContact CD2-CH2 4.23Å; Y112-W145 HydrophobicContact CD1-CH2 4.37Å; Y112-W145 AromaticContact CE1-CH2 3.41Å; Y112-W145 HydrophobicContact CE1-CH2 3.41Å; Y112-W145 VanDerWaalsContact CE1-CH2 3.41Å; Y112-W145 HydrophobicContact CE1-CZ2 4.11Å; Y112-W145 HydrophobicContact CE1-CZ3 4.21Å; Y112-W145 HydrophobicContact CE2-CH2 4.22Å; Y112-W145 HydrophobicContact CE2-CZ2 4.08Å; Y112-W145 AromaticContact CZ-CH2 3.32Å; Y112-W145 AromaticContact CZ-CZ2 3.58Å; Y112-W145 WeakPolarHBondContact OH-CH2 3.32Å; Y112-W145 WeakPolarHBondContact OH-CZ2 3.32Å; C140-W145 HydrophobicContact CB-CB 4.08Å; C140-W145 HydrophobicContact CB-CD2 4.28Å; C140-W145 HydrophobicContact CB-CE3 4.48Å; C140-W145 HydrophobicContact CB-CG 4.15Å; C140-W145 VanDerWaalsContact O-CB 3.23Å; C140-W145 WeakPolarHBondContact O-CB 3.27Å; C140-W145 PolarHBondContact O-N 3.38Å; W145-R254 HydrophobicContact CB-CB 4.45Å; W145-R254 HydrophobicContact CD2-CB 3.52Å; W145-R254 HydrophobicContact CE3-CB 3.73Å; W145-R254 HydrophobicContact CG-CB 3.83Å; W145-R254 HydrophobicContact CZ2-CB 4.42Å; W145-R254 HydrophobicContact CZ3-CB 4.29Å; W145-A256 HydrophobicContact CE3-CB 3.74Å; W145-A256 HydrophobicContact CZ3-CB 4.28Å; W145-A302 HydrophobicContact CH2-CB 4.44Å; W145-A302 HydrophobicContact CZ3-CB 4.21Å
146	L	97.2	Very high	96.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.5	167.1	-167.8	152.8	0	0	0	109	F186 N190 F193 I197 L242 F253 R254 L255 A256	L146-F186 HydrophobicContact CD2-CE2 4.04Å; L146-F186 HydrophobicContact CD2-CZ 4.21Å; L146-N190 HydrophobicContact CG-CB 4.47Å; L146-F193 HydrophobicContact CB-CD2 4.35Å; L146-F193 HydrophobicContact CB-CE2 4.44Å; L146-F193 HydrophobicContact CD1-CB 3.89Å; L146-F193 HydrophobicContact CD1-CD2 4.42Å; L146-F193 HydrophobicContact CD1-CG 4.07Å; L146-F193 HydrophobicContact CG-CD2 4.33Å; L146-F193 HydrophobicContact CG-CG 4.46Å; L146-I197 HydrophobicContact CD1-CD1 3.35Å; L146-L242 HydrophobicContact CD1-CD2 3.6Å; L146-L242 HydrophobicContact CD2-CD1 3.89Å; L146-L242 HydrophobicContact CD2-CD2 3.96Å; L146-L242 HydrophobicContact CG-CD2 4.47Å; L146-F253 HydrophobicContact CB-CD2 3.8Å; L146-F253 HydrophobicContact CB-CE2 4.46Å; L146-F253 HydrophobicContact CB-CG 4.42Å; L146-F253 HydrophobicContact CD1-CD2 4.03Å; L146-F253 HydrophobicContact CD1-CE2 4.15Å; L146-F253 HydrophobicContact CD1-CG 4.41Å; L146-R254 PolarHBondContact N-O 3.31Å; L146-L255 HydrophobicContact CD2-CD1 3.61Å; L146-A256 PolarHBondContact O-N 2.84Å
147	V	97.1	Very high	96.4	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.2	-174	177.6	0	0	0	0	110.5	L73 L137 Y141 H149 T189 N190	L73-V147 HydrophobicContact CD1-CB 4.45Å; L73-V147 HydrophobicContact CD1-CG1 4.01Å; L73-V147 HydrophobicContact CD1-CG2 4.38Å; L137-V147 HydrophobicContact CD2-CG1 3.63Å; Y141-V147 HydrophobicContact CD2-CG2 4.38Å; V147-H149 HydrophobicContact CG1-CB 4.08Å; V147-T189 HydrophobicContact CB-CG2 4Å; V147-T189 HydrophobicContact CG1-CG2 4.38Å; V147-N190 PolarHBondContact N-OD1 2.86Å; V147-N190 PolarHBondContact O-ND2 3.45Å; V147-N190 PolarHBondContact O-OD1 3.41Å
148	L	97.1	Very high	96.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	92.3	171	-165.2	166.8	0	0	0	108.5	V150 W182 M239 L242 L255 A256 V257 A258 L293	L148-V150 HydrophobicContact CD2-CG2 4.38Å; L148-W182 HydrophobicContact CD2-CZ2 3.72Å; L148-W182 HydrophobicContact CG-CH2 4.35Å; L148-W182 HydrophobicContact CG-CZ2 3.82Å; L148-M239 HydrophobicContact CD1-CG 4.3Å; L148-M239 HydrophobicContact CD2-CE 4.47Å; L148-L242 HydrophobicContact CD1-CD1 3.96Å; L148-L255 HydrophobicContact CB-CD1 4.27Å; L148-A256 PolarHBondContact N-O 2.94Å; L148-V257 HydrophobicContact CD2-CG1 4.37Å; L148-A258 PolarHBondContact O-N 3.4Å; L148-L293 HydrophobicContact CD1-CD1 3.57Å; L148-L293 HydrophobicContact CD2-CD1 4.4Å
149	H	97.3	Very high	95.9	Very high	18 Å²	18	29 Å²	29	8%	0.083	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.3	-177.1	-174.6	-135.8	0	0	0	112.7	S77 L137 V147 W182 A258	S77-H149 WeakPolarHBondContact CB-CE1 3.31Å; S77-H149 WeakPolarHBondContact CB-ND1 3.34Å; S77-H149 PolarHBondContact OG-CE1 3.5Å; S77-H149 PolarHBondContact OG-ND1 3Å; L137-H149 HydrophobicContact CD1-CB 4.44Å; L137-H149 VanDerWaalsContact CD1-CD2 3.49Å; L137-H149 WeakPolarHBondContact CD1-CD2 3.36Å; V147-H149 HydrophobicContact CG1-CB 4.08Å; H149-W182 PolarHBondContact O-NE1 3.16Å; H149-A258 CarbonylContact C-O 3.6Å; H149-A258 WeakPolarHBondContact CA-O 3.23Å; H149-A258 HydrophobicContact CB-CB 4.5Å; H149-A258 PolarHBondContact CD2-O 3.23Å
150	V	97	Very high	95.6	Very high	1 Å²	1	30 Å²	30	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	100.8	169	-179.6	0	0	0	0	108.2	L148 D152 A153 W156 A258 V259 D260 L290	L148-V150 HydrophobicContact CD2-CG2 4.38Å; V150-D152 PolarHBondContact O-N 3.36Å; V150-A153 HydrophobicContact CG1-CB 4.34Å; V150-W156 HydrophobicContact CG1-CD2 4.49Å; V150-W156 HydrophobicContact CG1-CH2 4.03Å; V150-W156 HydrophobicContact CG1-CZ2 3.79Å; V150-W156 HydrophobicContact CG1-CZ3 4.47Å; V150-W156 HydrophobicContact CG2-CH2 3.68Å; V150-W156 HydrophobicContact CG2-CZ2 3.99Å; V150-W156 HydrophobicContact CG2-CZ3 4.43Å; V150-A258 PolarHBondContact N-O 3.45Å; V150-V259 HydrophobicContact CB-CG1 4.28Å; V150-V259 HydrophobicContact CB-CG2 4.39Å; V150-D260 PolarHBondContact O-N 2.79Å; V150-L290 HydrophobicContact CG1-CD2 4.43Å; V150-L290 HydrophobicContact CG2-CD1 4.33Å; V150-L290 HydrophobicContact CG2-CD2 4.12Å
151	P	95.2	Very high	95.3	Very high	37 Å²	37	39.1 Å²	39.1	24%	0.24	21%	0.205	C	C	.	.	S	Bend	trans	-62	-29.9	-173	-30.7	37.4	0	0	0	117.3	D260	P151-D260 WeakPolarHBondContact O-CB 3.32Å
152	D	95.4	Very high	95.1	Very high	42 Å²	42	40.2 Å²	40.2	23%	0.225	21%	0.212	C	C	.	.			trans	-159.1	102	173.5	-178.4	7.7	0	0	0	109	V150 H154 L155	V150-D152 PolarHBondContact O-N 3.36Å; D152-H154 PolarHBondContact O-N 3.48Å; D152-H154 WeakPolarHBondContact OD1-CB 3.45Å; D152-H154 IonicContact OD1-CG 3.84Å; D152-H154 PolarHBondContact OD1-N 3.12Å; D152-H154 IonicContact OD1-ND1 2.61Å; D152-H154 PolarHBondContact OD1-ND1 2.83Å; D152-L155 HydrophobicContact CB-CD1 4.09Å; D152-L155 HydrophobicContact CB-CG 4.03Å; D152-L155 WeakPolarHBondContact O-CB 3.42Å; D152-L155 PolarHBondContact O-N 3.46Å
153	A	96.6	Very high	95	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.4	177.8	0	0	0	0	0	112.5	V150 L155 W156 V259 D260 A264 L265	V150-A153 HydrophobicContact CG1-CB 4.34Å; A153-L155 PolarHBondContact O-N 3.43Å; A153-W156 PolarHBondContact O-N 3.08Å; A153-W156 VanDerWaalsContact O-N 3.11Å; A153-V259 HydrophobicContact CB-CG1 3.95Å; A153-D260 WeakPolarHBondContact CB-O 3.4Å; A153-D260 PolarHBondContact N-O 2.94Å; A153-A264 HydrophobicContact CB-CB 3.96Å; A153-L265 HydrophobicContact CB-CD2 4.23Å
154	H	96.1	Very high	94.9	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-28.4	176.7	-59.6	87.9	0	0	0	112.3	D152 W156 V157 K158 G261 N263 A264 G311 S312	D152-H154 PolarHBondContact O-N 3.48Å; D152-H154 WeakPolarHBondContact OD1-CB 3.45Å; D152-H154 IonicContact OD1-CG 3.84Å; D152-H154 PolarHBondContact OD1-N 3.12Å; D152-H154 IonicContact OD1-ND1 2.61Å; D152-H154 PolarHBondContact OD1-ND1 2.83Å; H154-W156 PolarHBondContact O-N 3.37Å; H154-V157 WeakPolarHBondContact O-CG2 3.23Å; H154-V157 PolarHBondContact O-N 3.33Å; H154-V157 VanDerWaalsContact O-N 3.15Å; H154-K158 HydrophobicContact CB-CD 4.26Å; H154-K158 WeakPolarHBondContact O-CD 3.46Å; H154-K158 VanDerWaalsContact O-CG 3.24Å; H154-K158 WeakPolarHBondContact O-CG 3.4Å; H154-K158 PolarHBondContact O-N 2.87Å; H154-G261 VanDerWaalsContact CE1-CA 3.5Å; H154-G261 WeakPolarHBondContact CE1-CA 3.41Å; H154-N263 PolarHBondContact NE2-ND2 2.85Å; H154-A264 HydrophobicContact CB-CB 4.41Å; H154-G311 VanDerWaalsContact CD2-C 3.45Å; H154-G311 PolarHBondContact CD2-O 3.15Å; H154-S312 VanDerWaalsContact CD2-CA 3.49Å; H154-S312 WeakPolarHBondContact CD2-CA 3.49Å; H154-S312 WeakPolarHBondContact NE2-CA 3.31Å
155	L	94.6	Very high	94.8	Very high	87 Å²	87	40.5 Å²	40.5	46%	0.455	21%	0.209	S	C	.	.	H	α-helix	trans	-66.3	-18.8	177.1	-64.2	178.8	0	0	0	112.8	D152 A153	D152-L155 HydrophobicContact CB-CD1 4.09Å; D152-L155 HydrophobicContact CB-CG 4.03Å; D152-L155 WeakPolarHBondContact O-CB 3.42Å; D152-L155 PolarHBondContact O-N 3.46Å; A153-L155 PolarHBondContact O-N 3.43Å
156	W	95.9	Very high	94.6	Very high	14 Å²	14	40.5 Å²	40.5	5%	0.053	21%	0.211	C	C	.	.	H	α-helix	trans	-84.4	-17.5	176.2	-63.4	3.3	0	0	0	112.2	V150 A153 H154 Q175 W182 M239 L286 V287 L290	V150-W156 HydrophobicContact CG1-CD2 4.49Å; V150-W156 HydrophobicContact CG1-CH2 4.03Å; V150-W156 HydrophobicContact CG1-CZ2 3.79Å; V150-W156 HydrophobicContact CG1-CZ3 4.47Å; V150-W156 HydrophobicContact CG2-CH2 3.68Å; V150-W156 HydrophobicContact CG2-CZ2 3.99Å; V150-W156 HydrophobicContact CG2-CZ3 4.43Å; A153-W156 PolarHBondContact O-N 3.08Å; A153-W156 VanDerWaalsContact O-N 3.11Å; H154-W156 PolarHBondContact O-N 3.37Å; W156-Q175 PolarHBondContact O-NE2 3.35Å; W156-Q175 PolarHBondContact O-OE1 3.38Å; W156-W182 AromaticContact CZ2-CD1 3.92Å; W156-W182 HydrophobicContact CZ2-CG 4.15Å; W156-M239 HydrophobicContact CH2-CE 4.07Å; W156-M239 HydrophobicContact CZ3-CE 4.44Å; W156-L286 HydrophobicContact CD2-CB 4.14Å; W156-L286 HydrophobicContact CD2-CD1 4.18Å; W156-L286 HydrophobicContact CE3-CB 3.65Å; W156-L286 HydrophobicContact CE3-CD1 4.5Å; W156-L286 HydrophobicContact CG-CD1 4.4Å; W156-L286 HydrophobicContact CZ3-CB 3.88Å; W156-V287 HydrophobicContact CB-CG2 4.26Å; W156-L290 HydrophobicContact CE3-CD2 4.05Å; W156-L290 HydrophobicContact CH2-CD2 4.17Å; W156-L290 HydrophobicContact CZ3-CB 4.02Å; W156-L290 HydrophobicContact CZ3-CD2 3.49Å; W156-L290 VanDerWaalsContact CZ3-CD2 3.49Å; W156-L290 HydrophobicContact CZ3-CG 4.32Å
157	V	96	Very high	94	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-112.6	4.7	-178.6	-61.8	0	0	0	0	114	H154 A264 S269 T270 P281 L284 V287 L313	H154-V157 WeakPolarHBondContact O-CG2 3.23Å; H154-V157 PolarHBondContact O-N 3.33Å; H154-V157 VanDerWaalsContact O-N 3.15Å; V157-A264 HydrophobicContact CG2-CB 3.93Å; V157-S269 WeakPolarHBondContact O-CA 3.19Å; V157-S269 WeakPolarHBondContact O-CB 3.34Å; V157-T270 PolarHBondContact O-N 3.23Å; V157-P281 HydrophobicContact CG1-CB 4.33Å; V157-P281 HydrophobicContact CG1-CG 4.49Å; V157-L284 HydrophobicContact CG1-CD1 4.12Å; V157-V287 HydrophobicContact CG1-CG2 3.8Å; V157-L313 HydrophobicContact CG2-CD1 3.95Å
158	K	94.2	Very high	93.5	Very high	28 Å²	28	53.2 Å²	53.2	12%	0.122	27%	0.274	C	S	.	.	S	Bend	trans	-145.2	164.1	176.7	78.1	-159.1	169.5	-176.5	0	112.4	H154 C160 T270 G311 L313	H154-K158 HydrophobicContact CB-CD 4.26Å; H154-K158 WeakPolarHBondContact O-CD 3.46Å; H154-K158 VanDerWaalsContact O-CG 3.24Å; H154-K158 WeakPolarHBondContact O-CG 3.4Å; H154-K158 PolarHBondContact O-N 2.87Å; K158-C160 PolarHBondContact O-N 3.13Å; K158-C160 VanDerWaalsContact O-N 3.13Å; K158-T270 WeakPolarHBondContact CA-OG1 3.18Å; K158-T270 WeakPolarHBondContact CB-OG1 3.38Å; K158-G311 VanDerWaalsContact NZ-CA 3.29Å; K158-G311 PolarHBondContact NZ-O 3.34Å; K158-L313 HydrophobicContact CB-CD1 4.22Å; K158-L313 HydrophobicContact CB-CD2 4.46Å; K158-L313 HydrophobicContact CD-CD2 4.16Å
159	N	89.9	Confident	93.1	Very high	125 Å²	125	57.4 Å²	57.4	67%	0.668	29%	0.292	S	S	*	.			trans	53.1	34.5	173.2	-58.9	-19.7	0	0	0	113.9	K161	N159-K161 PolarHBondContact O-N 3.39Å
160	C	92.1	Very high	92.7	Very high	29 Å²	29	62.3 Å²	62.3	20%	0.196	33%	0.328	C	S	.	.			trans	-74.9	114.9	178.1	-161.6	0	0	0	0	109.8	K158 E162 Q175 I271	K158-C160 PolarHBondContact O-N 3.13Å; K158-C160 VanDerWaalsContact O-N 3.13Å; C160-E162 PolarHBondContact SG-O 3.13Å; C160-Q175 PolarHBondContact SG-NE2 3.19Å; C160-Q175 VanDerWaalsContact SG-NE2 3.43Å; C160-I271 HydrophobicContact CB-CD1 3.59Å; C160-I271 HydrophobicContact CB-CG1 3.78Å; C160-I271 HydrophobicContact CB-CG2 4.31Å
161	K	90.4	Very high	92.4	Very high	190 Å²	190	65.5 Å²	65.5	83%	0.826	35%	0.35	S	S	*	.	S	Bend	trans	-76.8	-37.9	-179.8	-66.2	-176.5	178.7	179.9	0	112.6	N159 L177	N159-K161 PolarHBondContact O-N 3.39Å; K161-L177 HydrophobicContact CB-CD1 4.19Å
162	E	91.7	Very high	92.4	Very high	79 Å²	79	64.7 Å²	64.7	37%	0.369	34%	0.342	S	S	.	.			trans	-131.1	121.7	-177.9	-174.6	177.9	-168.6	0	0	108.3	C160 L164 P176 L177	C160-E162 PolarHBondContact SG-O 3.13Å; E162-L164 HydrophobicContact CG-CD2 4.16Å; E162-L164 HydrophobicContact CG-CG 4.18Å; E162-P176 HydrophobicContact CG-CG 4.26Å; E162-L177 HydrophobicContact CB-CD1 4.33Å
163	L	94	Very high	92.4	Very high	46 Å²	46	64.7 Å²	64.7	24%	0.241	34%	0.34	C	S	.	.			trans	-124.1	122.1	177	-171.7	76.5	0	0	0	107.4	F173 Q175 I271 V279 L284	L163-F173 HydrophobicContact CD1-CB 3.59Å; L163-F173 HydrophobicContact CD1-CG 4.32Å; L163-F173 HydrophobicContact CD2-CB 4.18Å; L163-F173 HydrophobicContact CD2-CD1 3.87Å; L163-F173 HydrophobicContact CD2-CE1 4.45Å; L163-F173 HydrophobicContact CD2-CG 4Å; L163-F173 HydrophobicContact CG-CB 3.84Å; L163-F173 HydrophobicContact CG-CD1 4Å; L163-F173 HydrophobicContact CG-CG 4.12Å; L163-Q175 HydrophobicContact CD1-CG 4.03Å; L163-I271 HydrophobicContact CD1-CG2 4.12Å; L163-I271 HydrophobicContact CD2-CG2 3.74Å; L163-I271 HydrophobicContact CG-CG2 4.43Å; L163-V279 HydrophobicContact CD2-CG2 4.04Å; L163-L284 HydrophobicContact CD1-CD2 4.01Å
164	L	93.7	Very high	92.4	Very high	46 Å²	46	64.8 Å²	64.8	24%	0.241	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.4	-178.7	-59.3	178.9	0	0	0	109.7	E162 F173 D174 P176	E162-L164 HydrophobicContact CG-CD2 4.16Å; E162-L164 HydrophobicContact CG-CG 4.18Å; L164-F173 CarbonylContact O-C 3.49Å; L164-F173 VanDerWaalsContact O-CA 3.23Å; L164-F173 WeakPolarHBondContact O-CA 3.45Å; L164-D174 PolarHBondContact N-O 3.39Å; L164-D174 PolarHBondContact O-N 3.2Å; L164-P176 HydrophobicContact CD1-CG 3.94Å; L164-P176 HydrophobicContact CG-CG 4.42Å
165	P	93.4	Very high	92.4	Very high	94 Å²	94	64.8 Å²	64.8	61%	0.61	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	137.5	165.7	28.7	-33	0	0	0	109.2	S167	P165-S167 PolarHBondContact O-N 3.17Å
166	S	91.8	Very high	92.4	Very high	10 Å²	10	60.6 Å²	60.6	7%	0.07	32%	0.319	C	S	.	.			trans	-68.4	134	-177.2	172.6	0	0	0	0	111.7	Y168 K169 R172 D174 D233	S166-Y168 VanDerWaalsContact C-N 3.31Å; S166-Y168 PolarHBondContact OG-N 3.09Å; S166-K169 WeakPolarHBondContact CB-O 3.34Å; S166-K169 PolarHBondContact OG-N 2.99Å; S166-R172 WeakPolarHBondContact CB-O 3.49Å; S166-R172 PolarHBondContact N-O 2.79Å; S166-D174 VanDerWaalsContact CA-OD2 3.24Å; S166-D174 WeakPolarHBondContact CA-OD2 3.38Å; S166-D174 VanDerWaalsContact CB-OD1 3.3Å; S166-D174 WeakPolarHBondContact CB-OD1 3.35Å; S166-D174 WeakPolarHBondContact CB-OD2 3.29Å; S166-D174 PolarHBondContact OG-OD1 2.88Å; S166-D174 PolarHBondContact OG-OD2 3.07Å; S166-D233 PolarHBondContact OG-OD1 2.78Å
167	S	85.4	Confident	92.4	Very high	87 Å²	87	63.3 Å²	63.3	61%	0.608	33%	0.334	S	S	*	.	S	Bend	trans	-69.3	-30	174.4	38.3	0	0	0	0	112.9	P165 D233	P165-S167 PolarHBondContact O-N 3.17Å; S167-D233 PolarHBondContact OG-OD2 3.32Å; S167-D233 VanDerWaalsContact OG-OD2 3.14Å
168	Y	86.1	Confident	92.4	Very high	182 Å²	182	64.9 Å²	64.9	71%	0.714	34%	0.341	S	S	*	.	S	Bend	trans	-84.1	-40.9	-178.7	-178.6	-103	0	0	0	112.5	S166 D233	S166-Y168 VanDerWaalsContact C-N 3.31Å; S166-Y168 PolarHBondContact OG-N 3.09Å; Y168-D233 WeakPolarHBondContact CB-OD1 3.37Å; Y168-D233 WeakPolarHBondContact CB-OD2 3.45Å
169	K	88.9	Confident	92.5	Very high	88 Å²	88	63.5 Å²	63.5	38%	0.383	34%	0.336	S	S	.	.			trans	-136.1	110.4	179.5	-166.6	174.1	-174.4	177.4	0	111.9	S166 S171 R172	S166-K169 WeakPolarHBondContact CB-O 3.34Å; S166-K169 PolarHBondContact OG-N 2.99Å; K169-S171 WeakPolarHBondContact CE-OG 3.48Å; K169-S171 PolarHBondContact O-N 2.79Å; K169-R172 HydrophobicContact CB-CG 4.41Å; K169-R172 HydrophobicContact CD-CG 4.3Å; K169-R172 VanDerWaalsContact CD-CZ 3.48Å; K169-R172 HydrophobicContact CG-CG 4.48Å; K169-R172 PolarHBondContact O-N 2.92Å
170	S	88.1	Confident	92.8	Very high	120 Å²	120	57.8 Å²	57.8	84%	0.839	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.2	-176.5	57	0	0	0	0	115.4	R172	S170-R172 VanDerWaalsContact C-N 3.25Å; S170-R172 PolarHBondContact O-N 3.14Å
171	S	91.4	Very high	92.9	Very high	68 Å²	68	59.5 Å²	59.5	48%	0.476	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	2.4	177.3	78.4	0	0	0	0	114	K169	K169-S171 WeakPolarHBondContact CE-OG 3.48Å; K169-S171 PolarHBondContact O-N 2.79Å
172	R	94.6	Very high	93.2	Very high	20 Å²	20	51 Å²	51	8%	0.075	28%	0.278	C	S	.	.	S	Bend	trans	-123.5	164	-175.3	-67.4	-173	-174.9	137.6	10.8	112.4	S166 K169 S170 E283 Y288	S166-R172 WeakPolarHBondContact CB-O 3.49Å; S166-R172 PolarHBondContact N-O 2.79Å; K169-R172 HydrophobicContact CB-CG 4.41Å; K169-R172 HydrophobicContact CD-CG 4.3Å; K169-R172 VanDerWaalsContact CD-CZ 3.48Å; K169-R172 HydrophobicContact CG-CG 4.48Å; K169-R172 PolarHBondContact O-N 2.92Å; S170-R172 VanDerWaalsContact C-N 3.25Å; S170-R172 PolarHBondContact O-N 3.14Å; R172-E283 CarbonylContact C-O 3.49Å; R172-E283 WeakPolarHBondContact CA-O 3.39Å; R172-E283 WeakPolarHBondContact CB-O 3.46Å; R172-Y288 PolarHBondContact NH2-OH 2.91Å
173	F	96	Very high	93.5	Very high	42 Å²	42	47.3 Å²	47.3	18%	0.184	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.5	175.7	-61.2	-83	0	0	0	112.2	L163 L164 K273 V279 E283 L284 T285	L163-F173 HydrophobicContact CD1-CB 3.59Å; L163-F173 HydrophobicContact CD1-CG 4.32Å; L163-F173 HydrophobicContact CD2-CB 4.18Å; L163-F173 HydrophobicContact CD2-CD1 3.87Å; L163-F173 HydrophobicContact CD2-CE1 4.45Å; L163-F173 HydrophobicContact CD2-CG 4Å; L163-F173 HydrophobicContact CG-CB 3.84Å; L163-F173 HydrophobicContact CG-CD1 4Å; L163-F173 HydrophobicContact CG-CG 4.12Å; L164-F173 CarbonylContact O-C 3.49Å; L164-F173 VanDerWaalsContact O-CA 3.23Å; L164-F173 WeakPolarHBondContact O-CA 3.45Å; F173-K273 HydrophobicContact CE2-CD 4.08Å; F173-K273 HydrophobicContact CE2-CG 4.15Å; F173-K273 HydrophobicContact CZ-CD 3.99Å; F173-K273 HydrophobicContact CZ-CG 3.97Å; F173-V279 HydrophobicContact CD2-CG1 3.93Å; F173-V279 HydrophobicContact CD2-CG2 4.45Å; F173-V279 HydrophobicContact CE2-CG1 4.42Å; F173-V279 HydrophobicContact CE2-CG2 4.5Å; F173-E283 HydrophobicContact CD2-CB 4.21Å; F173-E283 PolarHBondContact N-O 2.75Å; F173-L284 HydrophobicContact CB-CD2 4.34Å; F173-T285 PolarHBondContact O-N 2.77Å; F173-T285 PolarHBondContact O-OG1 3.21Å
174	D	96.1	Very high	93.6	Very high	3 Å²	3	51 Å²	51	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	146.3	179.1	-70.3	-13.7	0	0	0	111.2	L164 S166 P176 T285	L164-D174 PolarHBondContact N-O 3.39Å; L164-D174 PolarHBondContact O-N 3.2Å; S166-D174 VanDerWaalsContact CA-OD2 3.24Å; S166-D174 WeakPolarHBondContact CA-OD2 3.38Å; S166-D174 VanDerWaalsContact CB-OD1 3.3Å; S166-D174 WeakPolarHBondContact CB-OD1 3.35Å; S166-D174 WeakPolarHBondContact CB-OD2 3.29Å; S166-D174 PolarHBondContact OG-OD1 2.88Å; S166-D174 PolarHBondContact OG-OD2 3.07Å; D174-P176 WeakPolarHBondContact O-CD 3.41Å; D174-T285 WeakPolarHBondContact OD1-CB 3.44Å; D174-T285 PolarHBondContact OD1-OG1 3.41Å
175	Q	96.1	Very high	93.6	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.267	C	S	.	.			trans	-125.7	75.2	-176.1	-62.1	-179.4	-80.7	0	0	108.9	W156 C160 L163 L177 Q178 A179 S232 L284 L286	W156-Q175 PolarHBondContact O-NE2 3.35Å; W156-Q175 PolarHBondContact O-OE1 3.38Å; C160-Q175 PolarHBondContact SG-NE2 3.19Å; C160-Q175 VanDerWaalsContact SG-NE2 3.43Å; L163-Q175 HydrophobicContact CD1-CG 4.03Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; Q175-L177 PolarHBondContact O-N 2.84Å; Q175-Q178 HydrophobicContact CB-CB 4.33Å; Q175-Q178 PolarHBondContact O-N 3.43Å; Q175-A179 WeakPolarHBondContact O-CB 3.41Å; Q175-A179 PolarHBondContact O-N 3.37Å; Q175-S232 PolarHBondContact N-OG 2.81Å; Q175-S232 PolarHBondContact O-OG 2.65Å; Q175-L284 HydrophobicContact CG-CD2 4.41Å; Q175-L286 HydrophobicContact CB-CD1 3.91Å
176	P	95.3	Very high	93.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-32.5	-163.8	25	-35.8	0	0	0	113.9	E162 L164 D174 T180 I228 S231	E162-P176 HydrophobicContact CG-CG 4.26Å; L164-P176 HydrophobicContact CD1-CG 3.94Å; L164-P176 HydrophobicContact CG-CG 4.42Å; D174-P176 WeakPolarHBondContact O-CD 3.41Å; P176-T180 VanDerWaalsContact O-CB 3.3Å; P176-T180 WeakPolarHBondContact O-CB 3.49Å; P176-T180 PolarHBondContact O-N 3.49Å; P176-T180 PolarHBondContact O-OG1 2.91Å; P176-I228 HydrophobicContact CB-CG2 3.66Å; P176-I228 WeakPolarHBondContact CB-O 3.29Å; P176-S231 VanDerWaalsContact CA-OG 3.28Å; P176-S231 WeakPolarHBondContact CA-OG 3.27Å; P176-S231 PolarHBondContact O-OG 3.21Å
177	L	94.9	Very high	94	Very high	71 Å²	71	49 Å²	49	37%	0.372	25%	0.251	S	S	.	.	H	α-helix	trans	-68	-45.3	178.9	-63.3	178.9	0	0	0	112.1	K161 E162 Q175 T181	K161-L177 HydrophobicContact CB-CD1 4.19Å; E162-L177 HydrophobicContact CB-CD1 4.33Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; Q175-L177 PolarHBondContact O-N 2.84Å; L177-T181 WeakPolarHBondContact O-CB 3.15Å; L177-T181 PolarHBondContact O-N 3.37Å; L177-T181 VanDerWaalsContact O-N 3.08Å; L177-T181 PolarHBondContact O-OG1 2.82Å
178	Q	95.4	Very high	94.5	Very high	33 Å²	33	49.1 Å²	49.1	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-46.1	175.7	-72.5	76.3	2.8	0	0	110.3	Q175 T181 W182 L286	Q175-Q178 HydrophobicContact CB-CB 4.33Å; Q175-Q178 PolarHBondContact O-N 3.43Å; Q178-T181 PolarHBondContact O-N 3.25Å; Q178-W182 WeakPolarHBondContact O-CB 3.32Å; Q178-W182 PolarHBondContact O-N 3.26Å; Q178-L286 HydrophobicContact CB-CD1 3.82Å
179	A	96.6	Very high	94.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-48.9	179.6	0	0	0	0	0	112.1	Q175 T181 W182 L183 S231 V235 L286	Q175-A179 WeakPolarHBondContact O-CB 3.41Å; Q175-A179 PolarHBondContact O-N 3.37Å; A179-T181 PolarHBondContact O-N 2.78Å; A179-W182 PolarHBondContact O-N 3.18Å; A179-L183 WeakPolarHBondContact O-CG 3.14Å; A179-L183 PolarHBondContact O-N 3.45Å; A179-S231 WeakPolarHBondContact CB-OG 3.37Å; A179-V235 HydrophobicContact CB-CG2 3.92Å; A179-L286 HydrophobicContact CB-CD1 4.32Å; A179-L286 HydrophobicContact CB-CD2 4Å
180	T	96.1	Very high	95.3	Very high	4 Å²	4	37 Å²	37	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-41.9	179.6	-55.5	0	0	0	0	111.9	P176 W182 L183 R184 S231	P176-T180 VanDerWaalsContact O-CB 3.3Å; P176-T180 WeakPolarHBondContact O-CB 3.49Å; P176-T180 PolarHBondContact O-N 3.49Å; P176-T180 PolarHBondContact O-OG1 2.91Å; T180-W182 VanDerWaalsContact C-N 3.34Å; T180-L183 PolarHBondContact O-N 3.23Å; T180-R184 WeakPolarHBondContact O-CG 3.35Å; T180-R184 PolarHBondContact O-N 3.47Å; T180-R184 VanDerWaalsContact O-N 3.08Å; T180-S231 PolarHBondContact OG1-OG 2.96Å
181	T	95.3	Very high	95.6	Very high	65 Å²	65	37.3 Å²	37.3	40%	0.399	18%	0.184	S	C	.	.	H	α-helix	trans	-62.1	-45.2	177.2	-56.9	0	0	0	0	110.7	L177 Q178 A179 R184 N185	L177-T181 WeakPolarHBondContact O-CB 3.15Å; L177-T181 PolarHBondContact O-N 3.37Å; L177-T181 VanDerWaalsContact O-N 3.08Å; L177-T181 PolarHBondContact O-OG1 2.82Å; Q178-T181 PolarHBondContact O-N 3.25Å; A179-T181 PolarHBondContact O-N 2.78Å; T181-R184 PolarHBondContact O-N 3.34Å; T181-N185 PolarHBondContact O-N 3.21Å
182	W	96.6	Very high	95.7	Very high	13 Å²	13	37 Å²	37	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-44.6	176.4	-176.7	84.5	0	0	0	112.3	L148 H149 W156 Q178 A179 T180 R184 N185 F186 V235 V238 M239	L148-W182 HydrophobicContact CD2-CZ2 3.72Å; L148-W182 HydrophobicContact CG-CH2 4.35Å; L148-W182 HydrophobicContact CG-CZ2 3.82Å; H149-W182 PolarHBondContact O-NE1 3.16Å; W156-W182 AromaticContact CZ2-CD1 3.92Å; W156-W182 HydrophobicContact CZ2-CG 4.15Å; Q178-W182 WeakPolarHBondContact O-CB 3.32Å; Q178-W182 PolarHBondContact O-N 3.26Å; A179-W182 PolarHBondContact O-N 3.18Å; T180-W182 VanDerWaalsContact C-N 3.34Å; W182-R184 VanDerWaalsContact C-N 3.33Å; W182-R184 PolarHBondContact O-N 3.07Å; W182-N185 PolarHBondContact O-N 3.03Å; W182-F186 HydrophobicContact CE3-CB 4.35Å; W182-F186 HydrophobicContact CH2-CB 4.25Å; W182-F186 AromaticContact CH2-CD2 3.83Å; W182-F186 HydrophobicContact CH2-CD2 3.83Å; W182-F186 HydrophobicContact CH2-CE2 4.41Å; W182-F186 HydrophobicContact CH2-CG 4Å; W182-F186 HydrophobicContact CZ2-CB 4.42Å; W182-F186 AromaticContact CZ2-CD2 3.99Å; W182-F186 HydrophobicContact CZ2-CD2 3.99Å; W182-F186 HydrophobicContact CZ2-CG 4.4Å; W182-F186 HydrophobicContact CZ3-CB 4.21Å; W182-F186 HydrophobicContact CZ3-CG 4.24Å; W182-F186 WeakPolarHBondContact O-CB 3.49Å; W182-F186 PolarHBondContact O-N 3.1Å; W182-V235 HydrophobicContact CE3-CB 4.35Å; W182-V235 HydrophobicContact CE3-CG1 3.88Å; W182-V235 HydrophobicContact CE3-CG2 3.61Å; W182-V235 HydrophobicContact CH2-CG1 4.37Å; W182-V235 HydrophobicContact CZ3-CB 4.29Å; W182-V235 HydrophobicContact CZ3-CG1 3.78Å; W182-V235 HydrophobicContact CZ3-CG2 3.92Å; W182-V238 HydrophobicContact CH2-CG1 4.34Å; W182-M239 HydrophobicContact CH2-CE 4.41Å; W182-M239 HydrophobicContact CZ2-CE 4.3Å
183	L	97.2	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-39	178.2	-74.7	170.3	0	0	0	112.8	A179 T180 F186 K187 V221 I225 V234 V235 V238	A179-L183 WeakPolarHBondContact O-CG 3.14Å; A179-L183 PolarHBondContact O-N 3.45Å; T180-L183 PolarHBondContact O-N 3.23Å; L183-F186 PolarHBondContact O-N 2.8Å; L183-K187 WeakPolarHBondContact O-CB 3.47Å; L183-K187 PolarHBondContact O-N 3.49Å; L183-V221 HydrophobicContact CB-CG1 4.42Å; L183-V221 HydrophobicContact CD2-CG1 4.29Å; L183-V221 HydrophobicContact CD2-CG2 4.43Å; L183-I225 HydrophobicContact CB-CD1 4.37Å; L183-I225 HydrophobicContact CB-CG1 3.83Å; L183-V234 HydrophobicContact CD1-CB 4.38Å; L183-V234 HydrophobicContact CD1-CG1 4.04Å; L183-V234 HydrophobicContact CD2-CG1 4.12Å; L183-V235 HydrophobicContact CD1-CG2 4.06Å; L183-V235 HydrophobicContact CD2-CG2 3.87Å; L183-V235 HydrophobicContact CG-CG2 3.7Å; L183-V238 HydrophobicContact CD2-CG2 4.47Å
184	R	96.1	Very high	95.7	Very high	123 Å²	123	36.1 Å²	36.1	46%	0.464	18%	0.178	S	C	.	.	H	α-helix	trans	-62.9	-46.1	175.4	-71.6	176.8	-170.7	143.5	2.9	111.7	T180 T181 W182 K187 I188 I225	T180-R184 WeakPolarHBondContact O-CG 3.35Å; T180-R184 PolarHBondContact O-N 3.47Å; T180-R184 VanDerWaalsContact O-N 3.08Å; T181-R184 PolarHBondContact O-N 3.34Å; W182-R184 VanDerWaalsContact C-N 3.33Å; W182-R184 PolarHBondContact O-N 3.07Å; R184-K187 PolarHBondContact O-N 2.88Å; R184-I188 VanDerWaalsContact O-CG1 3.32Å; R184-I188 WeakPolarHBondContact O-CG1 3.37Å; R184-I188 PolarHBondContact O-N 3.47Å; R184-I188 VanDerWaalsContact O-N 3.12Å; R184-I225 HydrophobicContact CG-CD1 4.05Å; R184-I225 HydrophobicContact CG-CG1 4.14Å; R184-I225 HydrophobicContact CG-CG2 4.18Å
185	N	95.3	Very high	95.6	Very high	30 Å²	30	39.5 Å²	39.5	16%	0.16	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-40.2	178.3	-73.4	-21.2	0	0	0	111.6	S75 D76 T181 W182 K187 I188 T189	S75-N185 PolarHBondContact OG-OD1 3.26Å; D76-N185 PolarHBondContact OD2-ND2 3.28Å; T181-N185 PolarHBondContact O-N 3.21Å; W182-N185 PolarHBondContact O-N 3.03Å; N185-K187 VanDerWaalsContact C-N 3.35Å; N185-K187 PolarHBondContact O-N 3.27Å; N185-I188 PolarHBondContact O-N 3.08Å; N185-T189 PolarHBondContact O-N 3.08Å; N185-T189 PolarHBondContact O-OG1 3.08Å
186	F	96.5	Very high	95.4	Very high	6 Å²	6	46 Å²	46	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-43.6	173.7	179.7	-95.7	0	0	0	111.9	L146 W182 L183 I188 T189 N190 L194 L217 V221 V238 L242	L146-F186 HydrophobicContact CD2-CE2 4.04Å; L146-F186 HydrophobicContact CD2-CZ 4.21Å; W182-F186 HydrophobicContact CE3-CB 4.35Å; W182-F186 HydrophobicContact CH2-CB 4.25Å; W182-F186 AromaticContact CH2-CD2 3.83Å; W182-F186 HydrophobicContact CH2-CD2 3.83Å; W182-F186 HydrophobicContact CH2-CE2 4.41Å; W182-F186 HydrophobicContact CH2-CG 4Å; W182-F186 HydrophobicContact CZ2-CB 4.42Å; W182-F186 AromaticContact CZ2-CD2 3.99Å; W182-F186 HydrophobicContact CZ2-CD2 3.99Å; W182-F186 HydrophobicContact CZ2-CG 4.4Å; W182-F186 HydrophobicContact CZ3-CB 4.21Å; W182-F186 HydrophobicContact CZ3-CG 4.24Å; W182-F186 WeakPolarHBondContact O-CB 3.49Å; W182-F186 PolarHBondContact O-N 3.1Å; L183-F186 PolarHBondContact O-N 2.8Å; F186-I188 PolarHBondContact O-N 2.87Å; F186-T189 PolarHBondContact O-N 3.32Å; F186-N190 WeakPolarHBondContact CD2-ND2 3.23Å; F186-N190 VanDerWaalsContact CE2-ND2 3.32Å; F186-N190 WeakPolarHBondContact CE2-ND2 3.22Å; F186-N190 HydrophobicContact CZ-CB 4.47Å; F186-N190 PolarHBondContact O-N 3.47Å; F186-N190 VanDerWaalsContact O-N 3.1Å; F186-N190 PolarHBondContact O-ND2 3.21Å; F186-L194 HydrophobicContact CD1-CD2 4.46Å; F186-L194 HydrophobicContact CE1-CD2 3.85Å; F186-L217 HydrophobicContact CE1-CD2 4.35Å; F186-L217 HydrophobicContact CZ-CD2 4.4Å; F186-V221 HydrophobicContact CD1-CG2 4.01Å; F186-V221 HydrophobicContact CE1-CG2 4.04Å; F186-V238 HydrophobicContact CE1-CG1 3.91Å; F186-V238 HydrophobicContact CZ-CG1 3.94Å; F186-L242 HydrophobicContact CE2-CD1 4.06Å; F186-L242 HydrophobicContact CZ-CD1 3.86Å
187	K	96.4	Very high	95.4	Very high	73 Å²	73	46.4 Å²	46.4	32%	0.317	23%	0.232	S	C	.	.	H	α-helix	trans	-58.9	-47.6	177.3	-177.9	171.1	-179.1	171.9	0	111.6	L183 R184 N185 E191 L194 V221 D222 I225	L183-K187 WeakPolarHBondContact O-CB 3.47Å; L183-K187 PolarHBondContact O-N 3.49Å; R184-K187 PolarHBondContact O-N 2.88Å; N185-K187 VanDerWaalsContact C-N 3.35Å; N185-K187 PolarHBondContact O-N 3.27Å; K187-E191 PolarHBondContact O-N 3.25Å; K187-L194 HydrophobicContact CB-CD1 4.28Å; K187-L194 HydrophobicContact CG-CD1 3.66Å; K187-V221 HydrophobicContact CB-CG1 3.92Å; K187-V221 HydrophobicContact CD-CG1 4.48Å; K187-V221 HydrophobicContact CG-CG1 4.46Å; K187-D222 WeakPolarHBondContact CD-OD1 3.3Å; K187-D222 WeakPolarHBondContact CE-OD1 3.5Å; K187-D222 IonicContact NZ-OD1 3.01Å; K187-D222 PolarHBondContact NZ-OD1 2.98Å; K187-D222 IonicContact NZ-OD2 3.81Å; K187-D222 PolarHBondContact NZ-OD2 3.42Å; K187-I225 HydrophobicContact CB-CD1 4.36Å; K187-I225 HydrophobicContact CD-CD1 4.01Å
188	I	95.4	Very high	95.3	Very high	90 Å²	90	47.9 Å²	47.9	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-65.7	-43.8	-178.5	-65	165.6	0	0	0	110.7	P72 R184 N185 F186	P72-I188 HydrophobicContact CB-CG2 4.12Å; R184-I188 VanDerWaalsContact O-CG1 3.32Å; R184-I188 WeakPolarHBondContact O-CG1 3.37Å; R184-I188 PolarHBondContact O-N 3.47Å; R184-I188 VanDerWaalsContact O-N 3.12Å; N185-I188 PolarHBondContact O-N 3.08Å; F186-I188 PolarHBondContact O-N 2.87Å
189	T	95.3	Very high	95.3	Very high	14 Å²	14	46.6 Å²	46.6	9%	0.086	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-42.2	-176.6	-54.7	0	0	0	0	111.7	P72 L73 Y141 V147 N185 F186	P72-T189 PolarHBondContact O-OG1 3.15Å; L73-T189 HydrophobicContact CD1-CG2 3.94Å; Y141-T189 HydrophobicContact CD2-CG2 4.38Å; Y141-T189 HydrophobicContact CE2-CG2 4.33Å; V147-T189 HydrophobicContact CB-CG2 4Å; V147-T189 HydrophobicContact CG1-CG2 4.38Å; N185-T189 PolarHBondContact O-N 3.08Å; N185-T189 PolarHBondContact O-OG1 3.08Å; F186-T189 PolarHBondContact O-N 3.32Å
190	N	95.9	Very high	95.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	20.5	-167.1	-58.6	-71.2	0	0	0	113.8	L146 V147 F186 P192 F193 L194	L146-N190 HydrophobicContact CG-CB 4.47Å; V147-N190 PolarHBondContact N-OD1 2.86Å; V147-N190 PolarHBondContact O-ND2 3.45Å; V147-N190 PolarHBondContact O-OD1 3.41Å; F186-N190 WeakPolarHBondContact CD2-ND2 3.23Å; F186-N190 VanDerWaalsContact CE2-ND2 3.32Å; F186-N190 WeakPolarHBondContact CE2-ND2 3.22Å; F186-N190 HydrophobicContact CZ-CB 4.47Å; F186-N190 PolarHBondContact O-N 3.47Å; F186-N190 VanDerWaalsContact O-N 3.1Å; F186-N190 PolarHBondContact O-ND2 3.21Å; N190-P192 VanDerWaalsContact O-N 3.08Å; N190-F193 HydrophobicContact CB-CD2 4.25Å; N190-F193 PolarHBondContact O-N 3.45Å; N190-L194 WeakPolarHBondContact O-CG 3.33Å; N190-L194 PolarHBondContact O-N 3.32Å
191	E	94.8	Very high	94.9	Very high	126 Å²	126	53.1 Å²	53.1	59%	0.589	26%	0.258	S	S	*	.	H	α-helix	trans	-43.1	-44.1	-178.7	-174.4	-84	176.6	0	0	113.8	K187 F193 L194	K187-E191 PolarHBondContact O-N 3.25Å; E191-F193 PolarHBondContact O-N 3.16Å; E191-F193 VanDerWaalsContact O-N 3.09Å; E191-L194 PolarHBondContact O-N 2.81Å
192	P	93.8	Very high	94.9	Very high	63 Å²	63	57 Å²	57	41%	0.409	27%	0.266	S	S	.	.	H	α-helix	trans	-65.2	-19	-178.2	-24.7	36	0	0	0	114.9	N190 K196	N190-P192 VanDerWaalsContact O-N 3.08Å; P192-K196 VanDerWaalsContact O-CD 3.31Å; P192-K196 WeakPolarHBondContact O-CD 3.39Å; P192-K196 VanDerWaalsContact O-CE 3.22Å; P192-K196 WeakPolarHBondContact O-CE 3.42Å
193	F	95.1	Very high	94.8	Very high	33 Å²	33	57.6 Å²	57.6	15%	0.145	27%	0.268	C	S	.	.	H	α-helix	trans	-96	-24.2	-178.7	-61.7	-76	0	0	0	112.9	G144 L146 N190 E191 S195 K196 I197 F253	G144-F193 WeakPolarHBondContact O-CZ 3.44Å; L146-F193 HydrophobicContact CB-CD2 4.35Å; L146-F193 HydrophobicContact CB-CE2 4.44Å; L146-F193 HydrophobicContact CD1-CB 3.89Å; L146-F193 HydrophobicContact CD1-CD2 4.42Å; L146-F193 HydrophobicContact CD1-CG 4.07Å; L146-F193 HydrophobicContact CG-CD2 4.33Å; L146-F193 HydrophobicContact CG-CG 4.46Å; N190-F193 HydrophobicContact CB-CD2 4.25Å; N190-F193 PolarHBondContact O-N 3.45Å; E191-F193 PolarHBondContact O-N 3.16Å; E191-F193 VanDerWaalsContact O-N 3.09Å; F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 2.89Å; F193-K196 PolarHBondContact O-N 3.46Å; F193-K196 VanDerWaalsContact O-N 3.16Å; F193-I197 HydrophobicContact CB-CD1 3.99Å; F193-I197 WeakPolarHBondContact O-CG1 3.46Å; F193-I197 PolarHBondContact O-N 3.23Å; F193-F253 HydrophobicContact CD1-CB 4.13Å; F193-F253 HydrophobicContact CE1-CB 3.97Å
194	L	95.2	Very high	94.5	Very high	9 Å²	9	61.9 Å²	61.9	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-35.3	-170.1	-65.1	-179.7	0	0	0	113.6	F186 K187 N190 E191 L217 G218 V221	F186-L194 HydrophobicContact CD1-CD2 4.46Å; F186-L194 HydrophobicContact CE1-CD2 3.85Å; K187-L194 HydrophobicContact CB-CD1 4.28Å; K187-L194 HydrophobicContact CG-CD1 3.66Å; N190-L194 WeakPolarHBondContact O-CG 3.33Å; N190-L194 PolarHBondContact O-N 3.32Å; E191-L194 PolarHBondContact O-N 2.81Å; L194-L217 HydrophobicContact CD2-CD2 4.14Å; L194-L217 HydrophobicContact CD2-CG 4.24Å; L194-L217 PolarHBondContact O-N 3.29Å; L194-G218 PolarHBondContact O-N 2.81Å; L194-V221 HydrophobicContact CD2-CG2 4.33Å
195	S	94.1	Very high	94.2	Very high	75 Å²	75	57.5 Å²	57.5	52%	0.524	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-29.4	178.7	57.7	0	0	0	0	113	F193 K198	F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 2.89Å; S195-K198 PolarHBondContact O-NZ 2.91Å
196	K	93.2	Very high	93.8	Very high	137 Å²	137	59.4 Å²	59.4	60%	0.596	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-46.5	-176.5	-61.5	-179.2	-176.1	173.7	0	111.8	P192 F193 K198	P192-K196 VanDerWaalsContact O-CD 3.31Å; P192-K196 WeakPolarHBondContact O-CD 3.39Å; P192-K196 VanDerWaalsContact O-CE 3.22Å; P192-K196 WeakPolarHBondContact O-CE 3.42Å; F193-K196 PolarHBondContact O-N 3.46Å; F193-K196 VanDerWaalsContact O-N 3.16Å; K196-K198 PolarHBondContact O-N 3.28Å
197	I	93.8	Very high	93.3	Very high	8 Å²	8	69.5 Å²	69.5	4%	0.041	34%	0.335	C	S	.	.			trans	-70.8	122.7	-178.7	-64.8	175.5	0	0	0	109.2	L146 F193 S216 L217 L242 F253	L146-I197 HydrophobicContact CD1-CD1 3.35Å; F193-I197 HydrophobicContact CB-CD1 3.99Å; F193-I197 WeakPolarHBondContact O-CG1 3.46Å; F193-I197 PolarHBondContact O-N 3.23Å; I197-S216 CarbonylContact O-C 3.54Å; I197-L217 HydrophobicContact CB-CB 3.92Å; I197-L217 HydrophobicContact CB-CD2 4.2Å; I197-L217 HydrophobicContact CD1-CD2 4.03Å; I197-L217 HydrophobicContact CG2-CB 3.88Å; I197-L217 HydrophobicContact CG2-CD2 4.02Å; I197-L217 HydrophobicContact CG2-CG 4.42Å; I197-L217 PolarHBondContact O-N 2.97Å; I197-L242 HydrophobicContact CD1-CD2 4.03Å; I197-F253 HydrophobicContact CD1-CD1 3.72Å; I197-F253 HydrophobicContact CD1-CE1 3.49Å; I197-F253 VanDerWaalsContact CD1-CE1 3.49Å; I197-F253 HydrophobicContact CD1-CG 4.32Å; I197-F253 HydrophobicContact CD1-CZ 3.93Å; I197-F253 HydrophobicContact CG1-CD1 3.99Å; I197-F253 HydrophobicContact CG1-CE1 3.81Å
198	K	94.4	Very high	92.9	Very high	103 Å²	103	77.6 Å²	77.6	45%	0.448	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-105.9	138.1	177.8	-58.5	-49	-167.5	-171.2	0	110.8	S195 K196 G214 S215 Q245	S195-K198 PolarHBondContact O-NZ 2.91Å; K196-K198 PolarHBondContact O-N 3.28Å; K198-G214 WeakPolarHBondContact CD-O 3.46Å; K198-S215 CarbonylContact C-O 3.57Å; K198-S215 WeakPolarHBondContact CA-O 3.45Å; K198-Q245 PolarHBondContact O-NE2 2.62Å
199	L	94.2	Very high	92.6	Very high	5 Å²	5	76 Å²	76	3%	0.026	35%	0.354	C	S	.	.			trans	-67	135.7	179.4	-55.1	179.4	0	0	0	110.8	Y203 T211 G214 S215 L217 L220 E241	L199-Y203 HydrophobicContact CD1-CD2 4.33Å; L199-T211 HydrophobicContact CD1-CG2 3.47Å; L199-T211 VanDerWaalsContact CD1-CG2 3.47Å; L199-G214 PolarHBondContact O-N 2.93Å; L199-S215 WeakPolarHBondContact CG-O 3.39Å; L199-S215 PolarHBondContact N-O 3.38Å; L199-L217 HydrophobicContact CD2-CD1 4.08Å; L199-L220 HydrophobicContact CD1-CB 4.13Å; L199-L220 HydrophobicContact CD1-CD2 4.38Å; L199-L220 HydrophobicContact CD2-CB 4.26Å; L199-L220 HydrophobicContact CD2-CD2 3.69Å; L199-E241 HydrophobicContact CD2-CG 3.92Å
200	K	92.5	Very high	92.4	Very high	75 Å²	75	77.4 Å²	77.4	33%	0.326	36%	0.364	S	S	.	.	S	Bend	trans	-86.6	-29.3	173.6	-71	173.1	177.6	166.8	0	112.9	A213 E241 L244 Q245	K200-A213 WeakPolarHBondContact O-CB 3.47Å; K200-E241 WeakPolarHBondContact CB-OE1 3.24Å; K200-E241 VanDerWaalsContact CG-OE1 3.31Å; K200-E241 WeakPolarHBondContact CG-OE1 3.45Å; K200-E241 PolarHBondContact N-OE1 3.43Å; K200-E241 PolarHBondContact N-OE2 2.99Å; K200-L244 PolarHBondContact NZ-O 3.44Å; K200-Q245 HydrophobicContact CD-CG 4.1Å
201	E	92.9	Very high	92.3	Very high	66 Å²	66	78 Å²	78	31%	0.308	37%	0.368	S	S	.	.	S	Bend	trans	-111.7	155.2	-176.7	-65	-179.1	160.7	0	0	111.7	Y203 K240	E201-Y203 HydrophobicContact CB-CE2 4.1Å; E201-Y203 PolarHBondContact OE2-OH 3.43Å; E201-K240 WeakPolarHBondContact OE1-CE 3.33Å; E201-K240 IonicContact OE1-NZ 2.66Å; E201-K240 PolarHBondContact OE1-NZ 3.27Å; E201-K240 WeakPolarHBondContact OE2-CE 3.35Å; E201-K240 IonicContact OE2-NZ 3.01Å; E201-K240 PolarHBondContact OE2-NZ 3.48Å
202	R	94.4	Very high	92.2	Very high	146 Å²	146	75.9 Å²	75.9	55%	0.551	36%	0.358	S	S	*	.			trans	-85.9	132.1	169.2	179.6	-176	-173.1	-158.7	-3.7	109.9	S210 T211 E212	R202-S210 PolarHBondContact NH2-OG 3.28Å; R202-S210 VanDerWaalsContact NH2-OG 3.12Å; R202-T211 CarbonylContact C-O 3.51Å; R202-T211 WeakPolarHBondContact CA-O 3.42Å; R202-E212 WeakPolarHBondContact CD-OE2 3.48Å; R202-E212 WeakPolarHBondContact CG-OE2 3.35Å; R202-E212 IonicContact CZ-OE1 3.57Å; R202-E212 IonicContact CZ-OE2 2.74Å; R202-E212 VanDerWaalsContact NE-CD 3.29Å; R202-E212 IonicContact NE-OE1 2.98Å; R202-E212 PolarHBondContact NE-OE1 3.46Å; R202-E212 IonicContact NE-OE2 2.89Å; R202-E212 PolarHBondContact NE-OE2 3.21Å; R202-E212 IonicContact NH2-OE1 2.86Å; R202-E212 PolarHBondContact NH2-OE1 2.95Å
203	Y	93.8	Very high	92.3	Very high	27 Å²	27	75.6 Å²	75.6	11%	0.106	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.5	176.9	-63.2	-75.9	0	0	0	110.9	L199 E201 W205 S210 T211 A237 E241	L199-Y203 HydrophobicContact CD1-CD2 4.33Å; E201-Y203 HydrophobicContact CB-CE2 4.1Å; E201-Y203 PolarHBondContact OE2-OH 3.43Å; Y203-W205 HydrophobicContact CG-CH2 4.25Å; Y203-W205 HydrophobicContact CG-CZ2 4.16Å; Y203-S210 CarbonylContact O-C 3.55Å; Y203-S210 WeakPolarHBondContact O-CA 3.28Å; Y203-S210 WeakPolarHBondContact O-CB 3.29Å; Y203-T211 PolarHBondContact N-O 2.89Å; Y203-T211 PolarHBondContact O-N 3.15Å; Y203-A237 HydrophobicContact CD1-CB 3.86Å; Y203-A237 HydrophobicContact CD2-CB 4.45Å; Y203-A237 HydrophobicContact CE1-CB 3.74Å; Y203-A237 HydrophobicContact CE2-CB 4.31Å; Y203-A237 HydrophobicContact CG-CB 4.24Å; Y203-E241 PolarHBondContact OH-OE2 2.89Å
204	V	92.1	Very high	92.2	Very high	89 Å²	89	76.2 Å²	76.2	54%	0.539	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.7	179.7	-177.4	0	0	0	0	108.9	T206	V204-T206 VanDerWaalsContact CG1-O 3.3Å; V204-T206 WeakPolarHBondContact CG1-O 3.3Å
205	W	89.9	Confident	92.1	Very high	31 Å²	31	77 Å²	77	12%	0.117	38%	0.383	C	S	.	.			trans	-93.5	-42.1	-178.6	-49.2	109.8	0	0	0	111.5	Y203 E209 T211 L220 Q223 D233 V234 A237	Y203-W205 HydrophobicContact CG-CH2 4.25Å; Y203-W205 HydrophobicContact CG-CZ2 4.16Å; W205-E209 PolarHBondContact N-O 2.91Å; W205-T211 PolarHBondContact NE1-OG1 3.07Å; W205-L220 HydrophobicContact CH2-CD1 3.62Å; W205-L220 HydrophobicContact CZ2-CD1 3.19Å; W205-Q223 HydrophobicContact CG-CG 4.45Å; W205-D233 HydrophobicContact CZ3-CB 4Å; W205-V234 HydrophobicContact CD2-CG2 4.41Å; W205-V234 HydrophobicContact CE3-CG2 3.99Å; W205-V234 HydrophobicContact CH2-CB 4.27Å; W205-V234 HydrophobicContact CH2-CG2 3.51Å; W205-V234 HydrophobicContact CZ2-CG2 3.97Å; W205-V234 HydrophobicContact CZ3-CB 4.38Å; W205-V234 HydrophobicContact CZ3-CG2 3.51Å; W205-A237 HydrophobicContact CH2-CB 4.02Å
206	T	86.9	Confident	92.3	Very high	71 Å²	71	74.1 Å²	74.1	44%	0.436	36%	0.362	S	S	.	.	S	Bend	trans	-141.8	175.3	177	70.4	0	0	0	0	109.5	V204 R208 E209	V204-T206 VanDerWaalsContact CG1-O 3.3Å; V204-T206 WeakPolarHBondContact CG1-O 3.3Å; T206-R208 PolarHBondContact O-N 2.96Å; T206-R208 PolarHBondContact OG1-N 3.48Å; T206-E209 PolarHBondContact N-O 3.06Å; T206-E209 VanDerWaalsContact N-O 3.13Å; T206-E209 PolarHBondContact O-N 3.49Å; T206-E209 WeakPolarHBondContact OG1-CB 3.17Å; T206-E209 PolarHBondContact OG1-N 3.43Å
207	K	85	Confident	92.4	Very high	218 Å²	218	67.6 Å²	67.6	95%	0.948	33%	0.334	S	S	*	.	S	Bend	trans	-58.3	-19.7	174.2	-65	-177.4	179.1	-178.1	0	113.9
208	R	88	Confident	92.6	Very high	242 Å²	242	67.7 Å²	67.7	91%	0.913	34%	0.337	S	S	*	.	S	Bend	trans	-115	-20.6	-175.4	-63.4	-177.3	-179.2	178.8	-0.5	113.6	T206	T206-R208 PolarHBondContact O-N 2.96Å; T206-R208 PolarHBondContact OG1-N 3.48Å
209	E	89	Confident	92.6	Very high	57 Å²	57	67.3 Å²	67.3	27%	0.266	34%	0.337	S	S	.	.			trans	-117.2	118.9	-175.1	-62.7	-177.3	-179.1	0	0	109.6	W205 T206 Q223 R227	W205-E209 PolarHBondContact N-O 2.91Å; T206-E209 PolarHBondContact N-O 3.06Å; T206-E209 VanDerWaalsContact N-O 3.13Å; T206-E209 PolarHBondContact O-N 3.49Å; T206-E209 WeakPolarHBondContact OG1-CB 3.17Å; T206-E209 PolarHBondContact OG1-N 3.43Å; E209-Q223 PolarHBondContact OE2-NE2 2.94Å; E209-R227 IonicContact OE1-CZ 3.38Å; E209-R227 IonicContact OE1-NE 2.79Å; E209-R227 PolarHBondContact OE1-NE 3.06Å; E209-R227 IonicContact OE1-NH2 3.19Å; E209-R227 PolarHBondContact OE1-NH2 3.12Å; E209-R227 IonicContact OE2-NE 3.32Å; E209-R227 PolarHBondContact OE2-NE 3.3Å
210	S	91.9	Very high	92.7	Very high	43 Å²	43	67.1 Å²	67.1	30%	0.301	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.6	169.1	54.3	0	0	0	0	110.1	R202 Y203 E212	R202-S210 PolarHBondContact NH2-OG 3.28Å; R202-S210 VanDerWaalsContact NH2-OG 3.12Å; Y203-S210 CarbonylContact O-C 3.55Å; Y203-S210 WeakPolarHBondContact O-CA 3.28Å; Y203-S210 WeakPolarHBondContact O-CB 3.29Å; S210-E212 PolarHBondContact OG-OE1 2.97Å
211	T	93.4	Very high	93	Very high	14 Å²	14	63.5 Å²	63.5	9%	0.086	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.5	167.8	-51	0	0	0	0	107.1	L199 R202 Y203 W205	L199-T211 HydrophobicContact CD1-CG2 3.47Å; L199-T211 VanDerWaalsContact CD1-CG2 3.47Å; R202-T211 CarbonylContact C-O 3.51Å; R202-T211 WeakPolarHBondContact CA-O 3.42Å; Y203-T211 PolarHBondContact N-O 2.89Å; Y203-T211 PolarHBondContact O-N 3.15Å; W205-T211 PolarHBondContact NE1-OG1 3.07Å
212	E	93.6	Very high	93.1	Very high	82 Å²	82	63.5 Å²	63.5	38%	0.383	32%	0.322	S	S	.	.			trans	-80.4	158	-174.3	-60.5	-55.5	134.9	0	0	111.8	R202 S210 S215	R202-E212 WeakPolarHBondContact CD-OE2 3.48Å; R202-E212 WeakPolarHBondContact CG-OE2 3.35Å; R202-E212 IonicContact CZ-OE1 3.57Å; R202-E212 IonicContact CZ-OE2 2.74Å; R202-E212 VanDerWaalsContact NE-CD 3.29Å; R202-E212 IonicContact NE-OE1 2.98Å; R202-E212 PolarHBondContact NE-OE1 3.46Å; R202-E212 IonicContact NE-OE2 2.89Å; R202-E212 PolarHBondContact NE-OE2 3.21Å; R202-E212 IonicContact NH2-OE1 2.86Å; R202-E212 PolarHBondContact NH2-OE1 2.95Å; S210-E212 PolarHBondContact OG-OE1 2.97Å; E212-S215 WeakPolarHBondContact O-CB 3.26Å; E212-S215 PolarHBondContact O-N 3.25Å
213	A	94.1	Very high	93.1	Very high	57 Å²	57	58.4 Å²	58.4	47%	0.471	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	141.4	169.2	0	0	0	0	0	109.6	K200	K200-A213 WeakPolarHBondContact O-CB 3.47Å
214	G	92.8	Very high	93.2	Very high	45 Å²	45	57.1 Å²	57.1	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-14.4	-175.4	0	0	0	0	0	114.9	K198 L199	K198-G214 WeakPolarHBondContact CD-O 3.46Å; L199-G214 PolarHBondContact O-N 2.93Å
215	S	95.1	Very high	93.4	Very high	26 Å²	26	54.6 Å²	54.6	18%	0.182	28%	0.282	C	S	.	.			trans	-60	158.1	169.8	-88.1	0	0	0	0	111.7	K198 L199 E212 E219	K198-S215 CarbonylContact C-O 3.57Å; K198-S215 WeakPolarHBondContact CA-O 3.45Å; L199-S215 WeakPolarHBondContact CG-O 3.39Å; L199-S215 PolarHBondContact N-O 3.38Å; E212-S215 WeakPolarHBondContact O-CB 3.26Å; E212-S215 PolarHBondContact O-N 3.25Å; S215-E219 WeakPolarHBondContact CB-OE2 3.22Å; S215-E219 PolarHBondContact OG-OE2 3.12Å
216	S	96.3	Very high	93.6	Very high	14 Å²	14	56.9 Å²	56.9	10%	0.098	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-73.1	151.3	175.9	65.5	0	0	0	0	112.5	I197 G218 E219 L220	I197-S216 CarbonylContact O-C 3.54Å; S216-G218 PolarHBondContact O-N 3.08Å; S216-E219 WeakPolarHBondContact CB-OE1 3.49Å; S216-E219 PolarHBondContact N-OE1 2.91Å; S216-E219 PolarHBondContact O-N 3.49Å; S216-E219 VanDerWaalsContact OG-CD 3.31Å; S216-E219 WeakPolarHBondContact OG-CG 3.48Å; S216-E219 PolarHBondContact OG-N 3.2Å; S216-E219 PolarHBondContact OG-OE1 3.07Å; S216-L220 PolarHBondContact O-N 2.87Å
217	L	96.5	Very high	93.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-31.1	171.4	-175.1	66.4	0	0	0	111.4	F186 L194 I197 L199 L220 V221 V238 L242	F186-L217 HydrophobicContact CE1-CD2 4.35Å; F186-L217 HydrophobicContact CZ-CD2 4.4Å; L194-L217 HydrophobicContact CD2-CD2 4.14Å; L194-L217 HydrophobicContact CD2-CG 4.24Å; L194-L217 PolarHBondContact O-N 3.29Å; I197-L217 HydrophobicContact CB-CB 3.92Å; I197-L217 HydrophobicContact CB-CD2 4.2Å; I197-L217 HydrophobicContact CD1-CD2 4.03Å; I197-L217 HydrophobicContact CG2-CB 3.88Å; I197-L217 HydrophobicContact CG2-CD2 4.02Å; I197-L217 HydrophobicContact CG2-CG 4.42Å; I197-L217 PolarHBondContact O-N 2.97Å; L199-L217 HydrophobicContact CD2-CD1 4.08Å; L217-L220 HydrophobicContact CD1-CD2 4.12Å; L217-L220 WeakPolarHBondContact O-CB 3.31Å; L217-L220 PolarHBondContact O-N 3.45Å; L217-V221 WeakPolarHBondContact O-CG2 3.31Å; L217-V221 PolarHBondContact O-N 3.41Å; L217-V238 HydrophobicContact CD1-CG1 4.4Å; L217-V238 HydrophobicContact CD1-CG2 4.15Å; L217-L242 HydrophobicContact CD2-CD2 3.88Å
218	G	96.9	Very high	94.1	Very high	10 Å²	10	52.8 Å²	52.8	10%	0.103	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-45	173.9	0	0	0	0	0	113.4	L194 S216 L220 V221 D222	L194-G218 PolarHBondContact O-N 2.81Å; S216-G218 PolarHBondContact O-N 3.08Å; G218-L220 VanDerWaalsContact C-N 3.3Å; G218-L220 PolarHBondContact O-N 2.94Å; G218-V221 PolarHBondContact O-N 3Å; G218-D222 WeakPolarHBondContact O-CB 3.48Å; G218-D222 PolarHBondContact O-N 2.9Å
219	E	96.1	Very high	94.3	Very high	96 Å²	96	49.2 Å²	49.2	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-41.4	175.6	-75.5	156.1	-121.4	0	0	111.8	S215 S216 D222 Q223	S215-E219 WeakPolarHBondContact CB-OE2 3.22Å; S215-E219 PolarHBondContact OG-OE2 3.12Å; S216-E219 WeakPolarHBondContact CB-OE1 3.49Å; S216-E219 PolarHBondContact N-OE1 2.91Å; S216-E219 PolarHBondContact O-N 3.49Å; S216-E219 VanDerWaalsContact OG-CD 3.31Å; S216-E219 WeakPolarHBondContact OG-CG 3.48Å; S216-E219 PolarHBondContact OG-N 3.2Å; S216-E219 PolarHBondContact OG-OE1 3.07Å; E219-D222 PolarHBondContact O-N 2.62Å; E219-Q223 WeakPolarHBondContact O-CB 3.48Å; E219-Q223 PolarHBondContact O-N 2.73Å
220	L	96.3	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-46.7	176.1	177.5	60	0	0	0	111.4	L199 W205 S216 L217 G218 Q223 G224 V234 A237 V238	L199-L220 HydrophobicContact CD1-CB 4.13Å; L199-L220 HydrophobicContact CD1-CD2 4.38Å; L199-L220 HydrophobicContact CD2-CB 4.26Å; L199-L220 HydrophobicContact CD2-CD2 3.69Å; W205-L220 HydrophobicContact CH2-CD1 3.62Å; W205-L220 HydrophobicContact CZ2-CD1 3.19Å; S216-L220 PolarHBondContact O-N 2.87Å; L217-L220 HydrophobicContact CD1-CD2 4.12Å; L217-L220 WeakPolarHBondContact O-CB 3.31Å; L217-L220 PolarHBondContact O-N 3.45Å; G218-L220 VanDerWaalsContact C-N 3.3Å; G218-L220 PolarHBondContact O-N 2.94Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3.26Å; L220-G224 PolarHBondContact O-N 3.05Å; L220-V234 HydrophobicContact CD1-CG1 4.09Å; L220-V234 HydrophobicContact CD1-CG2 4.43Å; L220-V234 HydrophobicContact CG-CG1 4.11Å; L220-V234 WeakPolarHBondContact O-CG1 3.33Å; L220-A237 HydrophobicContact CD1-CB 4.41Å; L220-A237 HydrophobicContact CD2-CB 4.02Å; L220-V238 HydrophobicContact CD2-CG2 3.85Å; L220-V238 HydrophobicContact CG-CG2 4.1Å
221	V	97.1	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-42.5	178.6	172.6	0	0	0	0	111.1	L183 F186 K187 L194 L217 G218 Q223 G224 I225 V238	L183-V221 HydrophobicContact CB-CG1 4.42Å; L183-V221 HydrophobicContact CD2-CG1 4.29Å; L183-V221 HydrophobicContact CD2-CG2 4.43Å; F186-V221 HydrophobicContact CD1-CG2 4.01Å; F186-V221 HydrophobicContact CE1-CG2 4.04Å; K187-V221 HydrophobicContact CB-CG1 3.92Å; K187-V221 HydrophobicContact CD-CG1 4.48Å; K187-V221 HydrophobicContact CG-CG1 4.46Å; L194-V221 HydrophobicContact CD2-CG2 4.33Å; L217-V221 WeakPolarHBondContact O-CG2 3.31Å; L217-V221 PolarHBondContact O-N 3.41Å; G218-V221 PolarHBondContact O-N 3Å; V221-Q223 VanDerWaalsContact C-N 3.34Å; V221-Q223 PolarHBondContact O-N 3.28Å; V221-G224 PolarHBondContact O-N 3.19Å; V221-G224 VanDerWaalsContact O-N 3.13Å; V221-I225 HydrophobicContact CG1-CD1 3.84Å; V221-I225 HydrophobicContact CG1-CG1 4.46Å; V221-I225 WeakPolarHBondContact O-CG1 3.42Å; V221-I225 PolarHBondContact O-N 2.84Å; V221-V238 HydrophobicContact CG2-CG2 3.96Å
222	D	96.6	Very high	94.6	Very high	66 Å²	66	44.4 Å²	44.4	35%	0.353	24%	0.243	S	C	.	.	H	α-helix	trans	-66.8	-34.1	178.9	-77.7	-24.6	0	0	0	113.1	K187 G218 E219 G224 I225 S226	K187-D222 WeakPolarHBondContact CD-OD1 3.3Å; K187-D222 WeakPolarHBondContact CE-OD1 3.5Å; K187-D222 IonicContact NZ-OD1 3.01Å; K187-D222 PolarHBondContact NZ-OD1 2.98Å; K187-D222 IonicContact NZ-OD2 3.81Å; K187-D222 PolarHBondContact NZ-OD2 3.42Å; G218-D222 WeakPolarHBondContact O-CB 3.48Å; G218-D222 PolarHBondContact O-N 2.9Å; E219-D222 PolarHBondContact O-N 2.62Å; D222-G224 VanDerWaalsContact C-N 3.33Å; D222-G224 PolarHBondContact O-N 3.49Å; D222-I225 PolarHBondContact O-N 3.28Å; D222-S226 WeakPolarHBondContact O-CB 3.37Å; D222-S226 PolarHBondContact O-N 3.07Å; D222-S226 PolarHBondContact O-OG 2.74Å
223	Q	94.4	Very high	94.7	Very high	38 Å²	38	41.5 Å²	41.5	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-43.7	169.9	-179.3	65.9	7.1	0	0	111.1	W205 E209 E219 L220 V221 S226 R227	W205-Q223 HydrophobicContact CG-CG 4.45Å; E209-Q223 PolarHBondContact OE2-NE2 2.94Å; E219-Q223 WeakPolarHBondContact O-CB 3.48Å; E219-Q223 PolarHBondContact O-N 2.73Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3.26Å; V221-Q223 VanDerWaalsContact C-N 3.34Å; V221-Q223 PolarHBondContact O-N 3.28Å; Q223-S226 PolarHBondContact O-OG 3.04Å; Q223-S226 VanDerWaalsContact O-OG 3.14Å; Q223-R227 VanDerWaalsContact O-CB 3.32Å; Q223-R227 WeakPolarHBondContact O-CB 3.49Å; Q223-R227 PolarHBondContact O-N 2.69Å
224	G	94.6	Very high	94.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.1	-32.9	177.7	0	0	0	0	0	114.1	L220 V221 D222 S231	L220-G224 PolarHBondContact O-N 3.05Å; V221-G224 PolarHBondContact O-N 3.19Å; V221-G224 VanDerWaalsContact O-N 3.13Å; D222-G224 VanDerWaalsContact C-N 3.33Å; D222-G224 PolarHBondContact O-N 3.49Å; G224-S231 WeakPolarHBondContact O-CB 3.4Å
225	I	95.9	Very high	95	Very high	36 Å²	36	36.6 Å²	36.6	19%	0.185	19%	0.185	C	C	.	.	H	α-helix	trans	-73.2	-39.6	177.1	-65.8	168.9	0	0	0	111.3	L183 R184 K187 V221 D222	L183-I225 HydrophobicContact CB-CD1 4.37Å; L183-I225 HydrophobicContact CB-CG1 3.83Å; R184-I225 HydrophobicContact CG-CD1 4.05Å; R184-I225 HydrophobicContact CG-CG1 4.14Å; R184-I225 HydrophobicContact CG-CG2 4.18Å; K187-I225 HydrophobicContact CB-CD1 4.36Å; K187-I225 HydrophobicContact CD-CD1 4.01Å; V221-I225 HydrophobicContact CG1-CD1 3.84Å; V221-I225 HydrophobicContact CG1-CG1 4.46Å; V221-I225 WeakPolarHBondContact O-CG1 3.42Å; V221-I225 PolarHBondContact O-N 2.84Å; D222-I225 PolarHBondContact O-N 3.28Å
226	S	95	Very high	95.1	Very high	79 Å²	79	35.8 Å²	35.8	55%	0.552	18%	0.181	S	C	*	.	H	α-helix	trans	-78.1	-38.6	-179.4	61	0	0	0	0	112.7	D222 Q223	D222-S226 WeakPolarHBondContact O-CB 3.37Å; D222-S226 PolarHBondContact O-N 3.07Å; D222-S226 PolarHBondContact O-OG 2.74Å; Q223-S226 PolarHBondContact O-OG 3.04Å; Q223-S226 VanDerWaalsContact O-OG 3.14Å
227	R	92.3	Very high	95	Very high	128 Å²	128	35.4 Å²	35.4	48%	0.483	18%	0.178	S	C	.	.			trans	-105.2	83.6	178.7	-59.7	-59.7	-159.5	-163.4	-0.8	110.9	E209 Q223 K229 S230 S231	E209-R227 IonicContact OE1-CZ 3.38Å; E209-R227 IonicContact OE1-NE 2.79Å; E209-R227 PolarHBondContact OE1-NE 3.06Å; E209-R227 IonicContact OE1-NH2 3.19Å; E209-R227 PolarHBondContact OE1-NH2 3.12Å; E209-R227 IonicContact OE2-NE 3.32Å; E209-R227 PolarHBondContact OE2-NE 3.3Å; Q223-R227 VanDerWaalsContact O-CB 3.32Å; Q223-R227 WeakPolarHBondContact O-CB 3.49Å; Q223-R227 PolarHBondContact O-N 2.69Å; R227-K229 PolarHBondContact O-N 3.46Å; R227-K229 VanDerWaalsContact O-N 3.09Å; R227-S230 WeakPolarHBondContact CB-OG 3.32Å; R227-S230 PolarHBondContact O-N 3.35Å; R227-S230 VanDerWaalsContact O-N 3.13Å; R227-S230 PolarHBondContact O-OG 3.28Å; R227-S230 VanDerWaalsContact O-OG 3.13Å; R227-S231 PolarHBondContact O-N 3.44Å
228	I	90.7	Very high	95.1	Very high	76 Å²	76	35.4 Å²	35.4	39%	0.39	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-52.7	-36.8	-176.8	-64.9	173.9	0	0	0	113	P176 S230 S231	P176-I228 HydrophobicContact CB-CG2 3.66Å; P176-I228 WeakPolarHBondContact CB-O 3.29Å; I228-S230 PolarHBondContact O-N 2.88Å; I228-S231 VanDerWaalsContact O-CB 3.29Å; I228-S231 WeakPolarHBondContact O-CB 3.39Å; I228-S231 PolarHBondContact O-N 3.18Å; I228-S231 PolarHBondContact O-OG 2.82Å
229	K	90.8	Very high	95.1	Very high	167 Å²	167	35.1 Å²	35.1	73%	0.726	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-64	-35.4	-177.8	-68.9	-174.2	178.1	-177.2	0	113.9	R227	R227-K229 PolarHBondContact O-N 3.46Å; R227-K229 VanDerWaalsContact O-N 3.09Å
230	S	91.6	Very high	95.1	Very high	12 Å²	12	34.9 Å²	34.9	8%	0.084	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-94.3	1.8	179.2	50.2	0	0	0	0	113.1	R227 I228 S232 D233 V234	R227-S230 WeakPolarHBondContact CB-OG 3.32Å; R227-S230 PolarHBondContact O-N 3.35Å; R227-S230 VanDerWaalsContact O-N 3.13Å; R227-S230 PolarHBondContact O-OG 3.28Å; R227-S230 VanDerWaalsContact O-OG 3.13Å; I228-S230 PolarHBondContact O-N 2.88Å; S230-S232 VanDerWaalsContact C-N 3.29Å; S230-S232 PolarHBondContact O-N 3.16Å; S230-D233 PolarHBondContact O-N 2.83Å; S230-D233 VanDerWaalsContact O-N 3.16Å; S230-V234 WeakPolarHBondContact O-CG2 3.47Å; S230-V234 PolarHBondContact O-N 2.93Å
231	S	95	Very high	95	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-36.5	-174.4	60.1	0	0	0	0	113.5	P176 A179 T180 G224 R227 I228 V234 V235	P176-S231 VanDerWaalsContact CA-OG 3.28Å; P176-S231 WeakPolarHBondContact CA-OG 3.27Å; P176-S231 PolarHBondContact O-OG 3.21Å; A179-S231 WeakPolarHBondContact CB-OG 3.37Å; T180-S231 PolarHBondContact OG1-OG 2.96Å; G224-S231 WeakPolarHBondContact O-CB 3.4Å; R227-S231 PolarHBondContact O-N 3.44Å; I228-S231 VanDerWaalsContact O-CB 3.29Å; I228-S231 WeakPolarHBondContact O-CB 3.39Å; I228-S231 PolarHBondContact O-N 3.18Å; I228-S231 PolarHBondContact O-OG 2.82Å; S231-V234 PolarHBondContact O-N 2.93Å; S231-V235 WeakPolarHBondContact O-CG2 3.37Å; S231-V235 PolarHBondContact O-N 2.84Å
232	S	95.7	Very high	94.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-40.2	178.3	-64.8	0	0	0	0	112.3	Q175 S230 V235 G236	Q175-S232 PolarHBondContact N-OG 2.81Å; Q175-S232 PolarHBondContact O-OG 2.65Å; S230-S232 VanDerWaalsContact C-N 3.29Å; S230-S232 PolarHBondContact O-N 3.16Å; S232-V235 PolarHBondContact O-N 2.92Å; S232-G236 PolarHBondContact O-N 3.46Å
233	D	94.6	Very high	94.8	Very high	21 Å²	21	34.4 Å²	34.4	11%	0.112	17%	0.165	C	C	.	.	H	α-helix	trans	-67.1	-39.8	174.9	-69.2	-30.2	0	0	0	111	S166 S167 Y168 W205 S230 V235 G236 A237	S166-D233 PolarHBondContact OG-OD1 2.78Å; S167-D233 PolarHBondContact OG-OD2 3.32Å; S167-D233 VanDerWaalsContact OG-OD2 3.14Å; Y168-D233 WeakPolarHBondContact CB-OD1 3.37Å; Y168-D233 WeakPolarHBondContact CB-OD2 3.45Å; W205-D233 HydrophobicContact CZ3-CB 4Å; S230-D233 PolarHBondContact O-N 2.83Å; S230-D233 VanDerWaalsContact O-N 3.16Å; D233-V235 PolarHBondContact O-N 3.23Å; D233-G236 WeakPolarHBondContact O-CA 3.31Å; D233-G236 PolarHBondContact O-N 3.02Å; D233-G236 VanDerWaalsContact O-N 3.11Å; D233-A237 PolarHBondContact O-N 2.88Å
234	V	96.5	Very high	94.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-42.9	174.9	171.3	0	0	0	0	111.5	L183 W205 L220 S230 S231 G236 A237 V238	L183-V234 HydrophobicContact CD1-CB 4.38Å; L183-V234 HydrophobicContact CD1-CG1 4.04Å; L183-V234 HydrophobicContact CD2-CG1 4.12Å; W205-V234 HydrophobicContact CD2-CG2 4.41Å; W205-V234 HydrophobicContact CE3-CG2 3.99Å; W205-V234 HydrophobicContact CH2-CB 4.27Å; W205-V234 HydrophobicContact CH2-CG2 3.51Å; W205-V234 HydrophobicContact CZ2-CG2 3.97Å; W205-V234 HydrophobicContact CZ3-CB 4.38Å; W205-V234 HydrophobicContact CZ3-CG2 3.51Å; L220-V234 HydrophobicContact CD1-CG1 4.09Å; L220-V234 HydrophobicContact CD1-CG2 4.43Å; L220-V234 HydrophobicContact CG-CG1 4.11Å; L220-V234 WeakPolarHBondContact O-CG1 3.33Å; S230-V234 WeakPolarHBondContact O-CG2 3.47Å; S230-V234 PolarHBondContact O-N 2.93Å; S231-V234 PolarHBondContact O-N 2.93Å; V234-G236 VanDerWaalsContact C-N 3.28Å; V234-G236 PolarHBondContact O-N 3.47Å; V234-A237 PolarHBondContact O-N 3.04Å; V234-A237 VanDerWaalsContact O-N 3.16Å; V234-V238 HydrophobicContact CG1-CG2 4.34Å; V234-V238 WeakPolarHBondContact O-CG2 3.32Å; V234-V238 PolarHBondContact O-N 2.85Å
235	V	97.3	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-44.3	173.9	173.3	0	0	0	0	110.7	A179 W182 L183 S231 S232 D233 A237 V238 M239 L286	A179-V235 HydrophobicContact CB-CG2 3.92Å; W182-V235 HydrophobicContact CE3-CB 4.35Å; W182-V235 HydrophobicContact CE3-CG1 3.88Å; W182-V235 HydrophobicContact CE3-CG2 3.61Å; W182-V235 HydrophobicContact CH2-CG1 4.37Å; W182-V235 HydrophobicContact CZ3-CB 4.29Å; W182-V235 HydrophobicContact CZ3-CG1 3.78Å; W182-V235 HydrophobicContact CZ3-CG2 3.92Å; L183-V235 HydrophobicContact CD1-CG2 4.06Å; L183-V235 HydrophobicContact CD2-CG2 3.87Å; L183-V235 HydrophobicContact CG-CG2 3.7Å; S231-V235 WeakPolarHBondContact O-CG2 3.37Å; S231-V235 PolarHBondContact O-N 2.84Å; S232-V235 PolarHBondContact O-N 2.92Å; D233-V235 PolarHBondContact O-N 3.23Å; V235-A237 VanDerWaalsContact C-N 3.35Å; V235-A237 PolarHBondContact O-N 3.29Å; V235-V238 PolarHBondContact O-N 2.96Å; V235-M239 HydrophobicContact CG1-CE 3.59Å; V235-M239 HydrophobicContact CG1-CG 4.41Å; V235-M239 HydrophobicContact CG1-SD 4.09Å; V235-M239 VanDerWaalsContact O-CG 3.27Å; V235-M239 WeakPolarHBondContact O-CG 3.37Å; V235-M239 PolarHBondContact O-N 2.95Å; V235-L286 HydrophobicContact CB-CD2 3.83Å; V235-L286 HydrophobicContact CG1-CD2 3.78Å; V235-L286 HydrophobicContact CG2-CD2 4.13Å
236	G	96.1	Very high	94.4	Very high	8 Å²	8	35.5 Å²	35.5	8%	0.082	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-42.9	175	0	0	0	0	0	113.3	S232 D233 V234 M239 K240 N289	S232-G236 PolarHBondContact O-N 3.46Å; D233-G236 WeakPolarHBondContact O-CA 3.31Å; D233-G236 PolarHBondContact O-N 3.02Å; D233-G236 VanDerWaalsContact O-N 3.11Å; V234-G236 VanDerWaalsContact C-N 3.28Å; V234-G236 PolarHBondContact O-N 3.47Å; G236-M239 PolarHBondContact O-N 3.46Å; G236-K240 WeakPolarHBondContact O-CB 3.04Å; G236-K240 PolarHBondContact O-N 3.36Å; G236-N289 VanDerWaalsContact CA-ND2 3.31Å; G236-N289 WeakPolarHBondContact CA-ND2 3.18Å
237	A	96.1	Very high	94	Very high	6 Å²	6	35.5 Å²	35.5	5%	0.05	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-44.8	176.5	0	0	0	0	0	111.9	Y203 W205 L220 D233 V234 V235 M239 K240 E241	Y203-A237 HydrophobicContact CD1-CB 3.86Å; Y203-A237 HydrophobicContact CD2-CB 4.45Å; Y203-A237 HydrophobicContact CE1-CB 3.74Å; Y203-A237 HydrophobicContact CE2-CB 4.31Å; Y203-A237 HydrophobicContact CG-CB 4.24Å; W205-A237 HydrophobicContact CH2-CB 4.02Å; L220-A237 HydrophobicContact CD1-CB 4.41Å; L220-A237 HydrophobicContact CD2-CB 4.02Å; D233-A237 PolarHBondContact O-N 2.88Å; V234-A237 PolarHBondContact O-N 3.04Å; V234-A237 VanDerWaalsContact O-N 3.16Å; V235-A237 VanDerWaalsContact C-N 3.35Å; V235-A237 PolarHBondContact O-N 3.29Å; A237-M239 PolarHBondContact O-N 3.08Å; A237-K240 PolarHBondContact O-N 3.22Å; A237-E241 WeakPolarHBondContact O-CB 3.4Å; A237-E241 PolarHBondContact O-N 2.97Å
238	V	97.3	Very high	93.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-49.2	175.2	170.6	0	0	0	0	110.8	W182 L183 F186 L217 L220 V221 V234 V235 K240 E241 L242	W182-V238 HydrophobicContact CH2-CG1 4.34Å; L183-V238 HydrophobicContact CD2-CG2 4.47Å; F186-V238 HydrophobicContact CE1-CG1 3.91Å; F186-V238 HydrophobicContact CZ-CG1 3.94Å; L217-V238 HydrophobicContact CD1-CG1 4.4Å; L217-V238 HydrophobicContact CD1-CG2 4.15Å; L220-V238 HydrophobicContact CD2-CG2 3.85Å; L220-V238 HydrophobicContact CG-CG2 4.1Å; V221-V238 HydrophobicContact CG2-CG2 3.96Å; V234-V238 HydrophobicContact CG1-CG2 4.34Å; V234-V238 WeakPolarHBondContact O-CG2 3.32Å; V234-V238 PolarHBondContact O-N 2.85Å; V235-V238 PolarHBondContact O-N 2.96Å; V238-K240 VanDerWaalsContact C-N 3.31Å; V238-K240 PolarHBondContact O-N 2.85Å; V238-E241 PolarHBondContact O-N 3.33Å; V238-L242 HydrophobicContact CG1-CD1 3.79Å; V238-L242 HydrophobicContact CG1-CG 4.32Å; V238-L242 WeakPolarHBondContact O-CB 3.44Å; V238-L242 VanDerWaalsContact O-CG 3.23Å; V238-L242 WeakPolarHBondContact O-CG 3.23Å; V238-L242 PolarHBondContact O-N 2.96Å
239	M	96.9	Very high	92.7	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-41.5	177.8	-69.4	-179.2	174.3	0	0	112	L148 W156 W182 V235 G236 A237 R243 N289 L290 L293	L148-M239 HydrophobicContact CD1-CG 4.3Å; L148-M239 HydrophobicContact CD2-CE 4.47Å; W156-M239 HydrophobicContact CH2-CE 4.07Å; W156-M239 HydrophobicContact CZ3-CE 4.44Å; W182-M239 HydrophobicContact CH2-CE 4.41Å; W182-M239 HydrophobicContact CZ2-CE 4.3Å; V235-M239 HydrophobicContact CG1-CE 3.59Å; V235-M239 HydrophobicContact CG1-CG 4.41Å; V235-M239 HydrophobicContact CG1-SD 4.09Å; V235-M239 VanDerWaalsContact O-CG 3.27Å; V235-M239 WeakPolarHBondContact O-CG 3.37Å; V235-M239 PolarHBondContact O-N 2.95Å; G236-M239 PolarHBondContact O-N 3.46Å; A237-M239 PolarHBondContact O-N 3.08Å; M239-R243 WeakPolarHBondContact O-CB 3.34Å; M239-R243 PolarHBondContact O-N 3.02Å; M239-N289 HydrophobicContact SD-CB 3.93Å; M239-L290 HydrophobicContact CE-CB 4.4Å; M239-L290 HydrophobicContact CE-CD1 4.15Å; M239-L290 HydrophobicContact SD-CB 4.46Å; M239-L293 HydrophobicContact CB-CD1 3.63Å; M239-L293 HydrophobicContact CB-CG 4.09Å; M239-L293 HydrophobicContact CE-CD1 4.37Å; M239-L293 HydrophobicContact CG-CD1 3.47Å; M239-L293 VanDerWaalsContact CG-CD1 3.47Å; M239-L293 HydrophobicContact CG-CG 4.41Å; M239-L293 HydrophobicContact SD-CD1 3.76Å
240	K	95.6	Very high	91.7	Very high	92 Å²	92	32.7 Å²	32.7	40%	0.4	19%	0.19	S	C	.	.	H	α-helix	trans	-63.8	-49.3	177.4	-177	-176.3	176.3	-168.8	0	111.2	E201 G236 A237 V238 R243 L244	E201-K240 WeakPolarHBondContact OE1-CE 3.33Å; E201-K240 IonicContact OE1-NZ 2.66Å; E201-K240 PolarHBondContact OE1-NZ 3.27Å; E201-K240 WeakPolarHBondContact OE2-CE 3.35Å; E201-K240 IonicContact OE2-NZ 3.01Å; E201-K240 PolarHBondContact OE2-NZ 3.48Å; G236-K240 WeakPolarHBondContact O-CB 3.04Å; G236-K240 PolarHBondContact O-N 3.36Å; A237-K240 PolarHBondContact O-N 3.22Å; V238-K240 VanDerWaalsContact C-N 3.31Å; V238-K240 PolarHBondContact O-N 2.85Å; K240-R243 PolarHBondContact O-N 3.42Å; K240-L244 HydrophobicContact CG-CD1 3.96Å; K240-L244 HydrophobicContact CG-CG 4.44Å; K240-L244 WeakPolarHBondContact O-CB 3.31Å; K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.38Å; K240-L244 PolarHBondContact O-N 3.28Å
241	E	95.4	Very high	91	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-45.2	-176.5	-168.7	63.6	-142.8	0	0	111.5	L199 K200 Y203 A237 V238 R243 L244 Q245	L199-E241 HydrophobicContact CD2-CG 3.92Å; K200-E241 WeakPolarHBondContact CB-OE1 3.24Å; K200-E241 VanDerWaalsContact CG-OE1 3.31Å; K200-E241 WeakPolarHBondContact CG-OE1 3.45Å; K200-E241 PolarHBondContact N-OE1 3.43Å; K200-E241 PolarHBondContact N-OE2 2.99Å; Y203-E241 PolarHBondContact OH-OE2 2.89Å; A237-E241 WeakPolarHBondContact O-CB 3.4Å; A237-E241 PolarHBondContact O-N 2.97Å; V238-E241 PolarHBondContact O-N 3.33Å; E241-R243 VanDerWaalsContact C-N 3.31Å; E241-R243 PolarHBondContact O-N 3.25Å; E241-L244 PolarHBondContact O-N 2.81Å; E241-Q245 WeakPolarHBondContact O-CB 3.46Å; E241-Q245 WeakPolarHBondContact O-CG 3.44Å; E241-Q245 PolarHBondContact O-N 3.01Å; E241-Q245 PolarHBondContact OE1-NE2 2.75Å
242	L	95.4	Very high	90.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-43.3	176.8	-69.9	174.6	0	0	0	111.8	L146 L148 F186 I197 L217 V238 Q245 S246 F253 L255	L146-L242 HydrophobicContact CD1-CD2 3.6Å; L146-L242 HydrophobicContact CD2-CD1 3.89Å; L146-L242 HydrophobicContact CD2-CD2 3.96Å; L146-L242 HydrophobicContact CG-CD2 4.47Å; L148-L242 HydrophobicContact CD1-CD1 3.96Å; F186-L242 HydrophobicContact CE2-CD1 4.06Å; F186-L242 HydrophobicContact CZ-CD1 3.86Å; I197-L242 HydrophobicContact CD1-CD2 4.03Å; L217-L242 HydrophobicContact CD2-CD2 3.88Å; V238-L242 HydrophobicContact CG1-CD1 3.79Å; V238-L242 HydrophobicContact CG1-CG 4.32Å; V238-L242 WeakPolarHBondContact O-CB 3.44Å; V238-L242 VanDerWaalsContact O-CG 3.23Å; V238-L242 WeakPolarHBondContact O-CG 3.23Å; V238-L242 PolarHBondContact O-N 2.96Å; L242-Q245 PolarHBondContact O-N 3.04Å; L242-S246 WeakPolarHBondContact O-CB 3.16Å; L242-S246 PolarHBondContact O-N 2.91Å; L242-S246 PolarHBondContact O-OG 2.96Å; L242-F253 HydrophobicContact CD2-CE2 4.16Å; L242-F253 HydrophobicContact CD2-CZ 4.02Å; L242-L255 HydrophobicContact CB-CD2 4.3Å; L242-L255 HydrophobicContact CD1-CD1 4.45Å
243	R	93.9	Very high	90.2	Very high	56 Å²	56	42 Å²	42	21%	0.211	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-41.1	177.5	-173.2	-176.4	139.6	171.7	-7.5	112.5	M239 K240 E241 Q245 S246 K292 L293 D297 W298	M239-R243 WeakPolarHBondContact O-CB 3.34Å; M239-R243 PolarHBondContact O-N 3.02Å; K240-R243 PolarHBondContact O-N 3.42Å; E241-R243 VanDerWaalsContact C-N 3.31Å; E241-R243 PolarHBondContact O-N 3.25Å; R243-Q245 VanDerWaalsContact C-N 3.28Å; R243-Q245 PolarHBondContact O-N 2.96Å; R243-S246 PolarHBondContact O-OG 3.32Å; R243-K292 PolarHBondContact NH1-O 2.58Å; R243-L293 HydrophobicContact CB-CD2 3.86Å; R243-L293 HydrophobicContact CG-CD2 4.29Å; R243-D297 IonicContact CZ-OD1 3.68Å; R243-D297 IonicContact CZ-OD2 2.75Å; R243-D297 IonicContact NE-OD1 3.99Å; R243-D297 VanDerWaalsContact NH1-CG 3.32Å; R243-D297 IonicContact NH1-OD1 2.8Å; R243-D297 PolarHBondContact NH1-OD1 3.08Å; R243-D297 IonicContact NH1-OD2 3.59Å; R243-D297 PolarHBondContact NH1-OD2 2.75Å; R243-D297 IonicContact NH2-OD1 3.49Å; R243-D297 PolarHBondContact NH2-OD1 3.22Å; R243-D297 IonicContact NH2-OD2 3.47Å; R243-D297 PolarHBondContact NH2-OD2 3.45Å; R243-W298 HydrophobicContact CG-CB 3.7Å; R243-W298 HydrophobicContact CG-CD2 4.28Å; R243-W298 HydrophobicContact CG-CG 3.67Å
244	L	92.2	Very high	90.3	Very high	69 Å²	69	46.9 Å²	46.9	36%	0.361	26%	0.261	S	S	.	.	H	α-helix	trans	-69.4	-26.8	177.7	-73.8	174.8	0	0	0	112.8	K200 K240 E241	K200-L244 PolarHBondContact NZ-O 3.44Å; K240-L244 HydrophobicContact CG-CD1 3.96Å; K240-L244 HydrophobicContact CG-CG 4.44Å; K240-L244 WeakPolarHBondContact O-CB 3.31Å; K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.38Å; K240-L244 PolarHBondContact O-N 3.28Å; E241-L244 PolarHBondContact O-N 2.81Å
245	Q	92.3	Very high	90.3	Very high	26 Å²	26	46.9 Å²	46.9	12%	0.121	26%	0.261	C	S	.	.	H	α-helix	trans	-87.7	-37.9	-180	-73	-164.9	43.2	0	0	113.2	K198 K200 E241 L242 R243 D247 Q248 A251 F253	K198-Q245 PolarHBondContact O-NE2 2.62Å; K200-Q245 HydrophobicContact CD-CG 4.1Å; E241-Q245 WeakPolarHBondContact O-CB 3.46Å; E241-Q245 WeakPolarHBondContact O-CG 3.44Å; E241-Q245 PolarHBondContact O-N 3.01Å; E241-Q245 PolarHBondContact OE1-NE2 2.75Å; L242-Q245 PolarHBondContact O-N 3.04Å; R243-Q245 VanDerWaalsContact C-N 3.28Å; R243-Q245 PolarHBondContact O-N 2.96Å; Q245-D247 PolarHBondContact O-N 3.4Å; Q245-Q248 PolarHBondContact O-N 2.83Å; Q245-A251 WeakPolarHBondContact O-CB 3.39Å; Q245-F253 HydrophobicContact CB-CE1 4.03Å; Q245-F253 HydrophobicContact CB-CZ 3.86Å
246	S	90.9	Very high	90.3	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.014	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-31.5	176.6	65.6	0	0	0	0	112.3	L242 R243 Q248 W298 S299	L242-S246 WeakPolarHBondContact O-CB 3.16Å; L242-S246 PolarHBondContact O-N 2.91Å; L242-S246 PolarHBondContact O-OG 2.96Å; R243-S246 PolarHBondContact O-OG 3.32Å; S246-Q248 PolarHBondContact O-N 3.49Å; S246-W298 VanDerWaalsContact OG-CE3 3.28Å; S246-S299 CarbonylContact C-O 3.54Å; S246-S299 VanDerWaalsContact C-O 3.23Å; S246-S299 WeakPolarHBondContact CB-O 3.5Å; S246-S299 VanDerWaalsContact O-O 3.1Å; S246-S299 PolarHBondContact OG-O 3.48Å
247	D	87.1	Confident	90.4	Very high	79 Å²	79	46.5 Å²	46.5	42%	0.422	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.8	-178.7	-161.1	51.6	0	0	0	114.1	Q245 S299	Q245-D247 PolarHBondContact O-N 3.4Å; D247-S299 PolarHBondContact OD1-N 3.49Å; D247-S299 PolarHBondContact OD1-OG 3.15Å
248	Q	83.3	Confident	90.5	Very high	103 Å²	103	46.2 Å²	46.2	48%	0.481	25%	0.254	S	S	.	.	S	Bend	trans	-83.4	138.3	-178.4	-77.3	-170	-23.2	0	0	112.8	Q245 S246 G250 A251	Q245-Q248 PolarHBondContact O-N 2.83Å; S246-Q248 PolarHBondContact O-N 3.49Å; Q248-G250 PolarHBondContact O-N 2.75Å; Q248-A251 PolarHBondContact O-N 3.22Å; Q248-A251 VanDerWaalsContact O-N 3.13Å
249	P	72.1	Confident	90.5	Very high	134 Å²	134	46.2 Å²	46.2	87%	0.87	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	122.8	172.6	25.8	-31.8	0	0	0	109.5
250	G	70.5	Confident	90.6	Very high	74 Å²	74	46.5 Å²	46.5	76%	0.763	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	18.3	-175.9	0	0	0	0	0	115	Q248 D252	Q248-G250 PolarHBondContact O-N 2.75Å; G250-D252 PolarHBondContact O-N 3.21Å
251	A	77.4	Confident	90.6	Very high	40 Å²	40	42.1 Å²	42.1	33%	0.331	24%	0.237	S	C	.	.			trans	-53.9	131.8	172.3	0	0	0	0	0	112	Q245 Q248 F253	Q245-A251 WeakPolarHBondContact O-CB 3.39Å; Q248-A251 PolarHBondContact O-N 3.22Å; Q248-A251 VanDerWaalsContact O-N 3.13Å; A251-F253 PolarHBondContact O-N 2.98Å; A251-F253 VanDerWaalsContact O-N 3.14Å
252	D	82.3	Confident	90.7	Very high	153 Å²	153	42.1 Å²	42.1	82%	0.818	24%	0.237	S	C	*	.	S	Bend	trans	-71.4	-4.4	-177.7	-68.3	-36	0	0	0	113.9	G250	G250-D252 PolarHBondContact O-N 3.21Å
253	F	92.1	Very high	90.8	Very high	14 Å²	14	42.2 Å²	42.2	6%	0.061	24%	0.237	C	C	.	.	S	Bend	trans	-147.3	155.5	-175.6	66.6	-88.6	0	0	0	112.3	L146 F193 I197 L242 Q245 A251 L255	L146-F253 HydrophobicContact CB-CD2 3.8Å; L146-F253 HydrophobicContact CB-CE2 4.46Å; L146-F253 HydrophobicContact CB-CG 4.42Å; L146-F253 HydrophobicContact CD1-CD2 4.03Å; L146-F253 HydrophobicContact CD1-CE2 4.15Å; L146-F253 HydrophobicContact CD1-CG 4.41Å; F193-F253 HydrophobicContact CD1-CB 4.13Å; F193-F253 HydrophobicContact CE1-CB 3.97Å; I197-F253 HydrophobicContact CD1-CD1 3.72Å; I197-F253 HydrophobicContact CD1-CE1 3.49Å; I197-F253 VanDerWaalsContact CD1-CE1 3.49Å; I197-F253 HydrophobicContact CD1-CG 4.32Å; I197-F253 HydrophobicContact CD1-CZ 3.93Å; I197-F253 HydrophobicContact CG1-CD1 3.99Å; I197-F253 HydrophobicContact CG1-CE1 3.81Å; L242-F253 HydrophobicContact CD2-CE2 4.16Å; L242-F253 HydrophobicContact CD2-CZ 4.02Å; Q245-F253 HydrophobicContact CB-CE1 4.03Å; Q245-F253 HydrophobicContact CB-CZ 3.86Å; A251-F253 PolarHBondContact O-N 2.98Å; A251-F253 VanDerWaalsContact O-N 3.14Å; F253-L255 HydrophobicContact CE2-CB 4.4Å
254	R	94.8	Very high	90.9	Very high	124 Å²	124	39.8 Å²	39.8	47%	0.468	23%	0.229	S	C	.	.			trans	-100.1	140.5	167.7	-64.9	-176.4	-176.7	-169.1	2.4	110.1	W145 L146 G300	W145-R254 HydrophobicContact CB-CB 4.45Å; W145-R254 HydrophobicContact CD2-CB 3.52Å; W145-R254 HydrophobicContact CE3-CB 3.73Å; W145-R254 HydrophobicContact CG-CB 3.83Å; W145-R254 HydrophobicContact CZ2-CB 4.42Å; W145-R254 HydrophobicContact CZ3-CB 4.29Å; L146-R254 PolarHBondContact N-O 3.31Å; R254-G300 WeakPolarHBondContact CA-O 3.42Å
255	L	96.7	Very high	91.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.7	-177.4	-177.5	62.4	0	0	0	111.7	L146 L148 L242 F253 V257 W298 G300 G301 A302	L146-L255 HydrophobicContact CD2-CD1 3.61Å; L148-L255 HydrophobicContact CB-CD1 4.27Å; L242-L255 HydrophobicContact CB-CD2 4.3Å; L242-L255 HydrophobicContact CD1-CD1 4.45Å; F253-L255 HydrophobicContact CE2-CB 4.4Å; L255-V257 HydrophobicContact CD1-CG2 4.45Å; L255-V257 HydrophobicContact CD2-CG2 3.94Å; L255-V257 HydrophobicContact CG-CG2 3.86Å; L255-W298 HydrophobicContact CB-CH2 4.26Å; L255-W298 HydrophobicContact CB-CZ3 3.97Å; L255-W298 HydrophobicContact CD2-CE3 4.36Å; L255-W298 HydrophobicContact CD2-CH2 3.8Å; L255-W298 HydrophobicContact CD2-CZ2 4.45Å; L255-W298 HydrophobicContact CD2-CZ3 3.75Å; L255-W298 HydrophobicContact CG-CH2 4.07Å; L255-W298 HydrophobicContact CG-CZ3 4.16Å; L255-G300 PolarHBondContact N-O 3.41Å; L255-G300 VanDerWaalsContact N-O 3.14Å; L255-G301 CarbonylContact O-C 3.57Å; L255-G301 WeakPolarHBondContact O-CA 3.33Å; L255-A302 PolarHBondContact O-N 2.94Å
256	A	97.7	Very high	91.3	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	107	169.3	0	0	0	0	0	109.5	C140 W145 L146 L148	C140-A256 HydrophobicContact CB-CB 3.85Å; W145-A256 HydrophobicContact CE3-CB 3.74Å; W145-A256 HydrophobicContact CZ3-CB 4.28Å; L146-A256 PolarHBondContact O-N 2.84Å; L148-A256 PolarHBondContact N-O 2.94Å
257	V	98.1	Very high	91.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.7	174.6	-174.4	0	0	0	0	108.8	L148 L255 V259 L293 M294 W298 A302 V303 I304	L148-V257 HydrophobicContact CD2-CG1 4.37Å; L255-V257 HydrophobicContact CD1-CG2 4.45Å; L255-V257 HydrophobicContact CD2-CG2 3.94Å; L255-V257 HydrophobicContact CG-CG2 3.86Å; V257-V259 HydrophobicContact CG1-CG2 4.33Å; V257-L293 HydrophobicContact CG1-CB 4.49Å; V257-M294 HydrophobicContact CG1-CE 3.44Å; V257-M294 VanDerWaalsContact CG1-CE 3.44Å; V257-W298 HydrophobicContact CG2-CH2 3.87Å; V257-W298 HydrophobicContact CG2-CZ2 3.81Å; V257-A302 PolarHBondContact N-O 3.24Å; V257-V303 HydrophobicContact CB-CG2 4.26Å; V257-V303 CarbonylContact O-C 3.6Å; V257-V303 WeakPolarHBondContact O-CA 3.47Å; V257-I304 PolarHBondContact O-N 3.31Å
258	A	98	Very high	91.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.6	-179.6	0	0	0	0	0	112.3	L133 L137 L148 H149 V150 I304	L133-A258 HydrophobicContact CD1-CB 4.07Å; L137-A258 HydrophobicContact CD1-CB 3.73Å; L137-A258 HydrophobicContact CD2-CB 3.3Å; L137-A258 HydrophobicContact CG-CB 3.78Å; L148-A258 PolarHBondContact O-N 3.4Å; H149-A258 CarbonylContact C-O 3.6Å; H149-A258 WeakPolarHBondContact CA-O 3.23Å; H149-A258 HydrophobicContact CB-CB 4.5Å; H149-A258 PolarHBondContact CD2-O 3.23Å; V150-A258 PolarHBondContact N-O 3.45Å; A258-I304 WeakPolarHBondContact CA-O 3.29Å
259	V	98.2	Very high	92.2	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	116.8	-178.1	-174.9	0	0	0	0	110.4	V150 A153 V257 V262 L290 M294 I304 T305 T306	V150-V259 HydrophobicContact CB-CG1 4.28Å; V150-V259 HydrophobicContact CB-CG2 4.39Å; A153-V259 HydrophobicContact CB-CG1 3.95Å; V257-V259 HydrophobicContact CG1-CG2 4.33Å; V259-V262 HydrophobicContact CB-CG2 4.5Å; V259-V262 HydrophobicContact CG1-CB 4.22Å; V259-V262 HydrophobicContact CG1-CG2 4.23Å; V259-L290 HydrophobicContact CG1-CD2 4.22Å; V259-L290 HydrophobicContact CG2-CD1 3.97Å; V259-L290 HydrophobicContact CG2-CD2 4.32Å; V259-M294 HydrophobicContact CG2-CE 3.82Å; V259-M294 HydrophobicContact CG2-SD 4.13Å; V259-I304 PolarHBondContact N-O 2.65Å; V259-I304 VanDerWaalsContact N-O 3.1Å; V259-T305 HydrophobicContact CB-CG2 4.12Å; V259-T305 VanDerWaalsContact O-CA 3.27Å; V259-T305 WeakPolarHBondContact O-CA 3.18Å; V259-T306 PolarHBondContact O-N 3.49Å
260	D	97.7	Very high	93.3	Very high	10 Å²	10	32.1 Å²	32.1	5%	0.053	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	133.6	169.7	-158.2	-29.2	0	0	0	111	T130 L133 V150 P151 A153 T306	T130-D260 WeakPolarHBondContact CB-OD2 3.27Å; T130-D260 WeakPolarHBondContact CG2-OD2 3.36Å; T130-D260 PolarHBondContact OG1-OD2 2.88Å; L133-D260 HydrophobicContact CD2-CB 4.21Å; V150-D260 PolarHBondContact O-N 2.79Å; P151-D260 WeakPolarHBondContact O-CB 3.32Å; A153-D260 WeakPolarHBondContact CB-O 3.4Å; A153-D260 PolarHBondContact N-O 2.94Å; D260-T306 WeakPolarHBondContact CA-OG1 3.41Å; D260-T306 PolarHBondContact OD1-OG1 3.24Å
261	G	97.1	Very high	94.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	42.3	177.4	0	0	0	0	0	113	H154 N263 A264 T306	H154-G261 VanDerWaalsContact CE1-CA 3.5Å; H154-G261 WeakPolarHBondContact CE1-CA 3.41Å; G261-N263 PolarHBondContact O-N 3.26Å; G261-A264 VanDerWaalsContact O-CB 3.27Å; G261-A264 WeakPolarHBondContact O-CB 3.2Å; G261-A264 PolarHBondContact O-N 3.41Å; G261-T306 WeakPolarHBondContact CA-O 3.43Å; G261-T306 PolarHBondContact N-O 2.89Å; G261-T306 PolarHBondContact N-OG1 3.07Å; G261-T306 VanDerWaalsContact N-OG1 3.17Å
262	V	97.6	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-58	-23.2	-174.6	75.8	0	0	0	0	113.3	V259 A264 L265 W266 M294 T305 T306 L307 L326	V259-V262 HydrophobicContact CB-CG2 4.5Å; V259-V262 HydrophobicContact CG1-CB 4.22Å; V259-V262 HydrophobicContact CG1-CG2 4.23Å; V262-A264 PolarHBondContact O-N 2.8Å; V262-A264 VanDerWaalsContact O-N 3.13Å; V262-L265 HydrophobicContact CG2-CD1 3.72Å; V262-L265 HydrophobicContact CG2-CG 4.33Å; V262-L265 WeakPolarHBondContact O-CB 3.35Å; V262-L265 WeakPolarHBondContact O-CG 3.34Å; V262-L265 PolarHBondContact O-N 3.49Å; V262-W266 HydrophobicContact CG2-CH2 4.21Å; V262-W266 HydrophobicContact CG2-CZ3 3.79Å; V262-M294 HydrophobicContact CG2-CG 4.5Å; V262-M294 HydrophobicContact CG2-SD 3.92Å; V262-T305 HydrophobicContact CB-CG2 4.24Å; V262-T305 HydrophobicContact CG2-CG2 4.04Å; V262-T306 PolarHBondContact N-O 3.37Å; V262-L307 HydrophobicContact CG1-CD2 3.83Å; V262-L326 HydrophobicContact CG1-CD2 4.14Å
263	N	96.8	Very high	95.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.011	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-59.1	-21	172.7	56.4	-70.8	0	0	0	114.1	H154 G261 L265 G267 L307 S308 L325 L326	H154-N263 PolarHBondContact NE2-ND2 2.85Å; G261-N263 PolarHBondContact O-N 3.26Å; N263-L265 PolarHBondContact O-N 3.32Å; N263-G267 PolarHBondContact O-N 3.48Å; N263-L307 HydrophobicContact CB-CD2 4.05Å; N263-S308 PolarHBondContact ND2-O 3.12Å; N263-S308 VanDerWaalsContact ND2-O 3.08Å; N263-S308 PolarHBondContact OD1-N 2.77Å; N263-S308 PolarHBondContact OD1-O 2.86Å; N263-L325 HydrophobicContact CB-CB 4.06Å; N263-L325 WeakPolarHBondContact CB-O 3.43Å; N263-L326 HydrophobicContact CB-CD2 4.26Å
264	A	97	Very high	95.3	Very high	5 Å²	5	32.8 Å²	32.8	4%	0.041	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-61.2	-27	171.8	0	0	0	0	0	113.2	A153 H154 V157 G261 V262 W266	A153-A264 HydrophobicContact CB-CB 3.96Å; H154-A264 HydrophobicContact CB-CB 4.41Å; V157-A264 HydrophobicContact CG2-CB 3.93Å; G261-A264 VanDerWaalsContact O-CB 3.27Å; G261-A264 WeakPolarHBondContact O-CB 3.2Å; G261-A264 PolarHBondContact O-N 3.41Å; V262-A264 PolarHBondContact O-N 2.8Å; V262-A264 VanDerWaalsContact O-N 3.13Å; A264-W266 PolarHBondContact O-N 3.47Å
265	L	97.1	Very high	95.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-69.8	-33.9	-173.4	-57.3	-176.8	0	0	0	112.6	A153 V262 N263 V287 L290 R291 M294	A153-L265 HydrophobicContact CB-CD2 4.23Å; V262-L265 HydrophobicContact CG2-CD1 3.72Å; V262-L265 HydrophobicContact CG2-CG 4.33Å; V262-L265 WeakPolarHBondContact O-CB 3.35Å; V262-L265 WeakPolarHBondContact O-CG 3.34Å; V262-L265 PolarHBondContact O-N 3.49Å; N263-L265 PolarHBondContact O-N 3.32Å; L265-V287 HydrophobicContact CB-CG1 4.35Å; L265-V287 HydrophobicContact CD2-CG1 3.98Å; L265-L290 HydrophobicContact CD1-CD2 4.08Å; L265-L290 HydrophobicContact CD1-CG 4.01Å; L265-L290 HydrophobicContact CD2-CD2 3.67Å; L265-L290 HydrophobicContact CD2-CG 4.25Å; L265-L290 HydrophobicContact CG-CD2 4.49Å; L265-R291 HydrophobicContact CB-CG 4.17Å; L265-R291 PolarHBondContact O-NE 3.18Å; L265-R291 PolarHBondContact O-NH2 3.01Å; L265-M294 HydrophobicContact CD1-CG 3.84Å; L265-M294 HydrophobicContact CD1-SD 4.44Å
266	W	95.9	Very high	94.8	Very high	17 Å²	17	40 Å²	40	6%	0.064	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	1.5	-177.3	-59.8	-87.7	0	0	0	114.2	V262 A264 R291 M294 L326 N333 M334	V262-W266 HydrophobicContact CG2-CH2 4.21Å; V262-W266 HydrophobicContact CG2-CZ3 3.79Å; A264-W266 PolarHBondContact O-N 3.47Å; W266-R291 HydrophobicContact CZ2-CG 4.28Å; W266-M294 HydrophobicContact CH2-CB 4.03Å; W266-M294 HydrophobicContact CH2-CG 3.98Å; W266-M294 HydrophobicContact CZ2-CB 4.27Å; W266-M294 HydrophobicContact CZ2-CG 4.48Å; W266-L326 HydrophobicContact CE3-CD2 4.08Å; W266-L326 HydrophobicContact CZ3-CD2 4.11Å; W266-N333 HydrophobicContact CZ2-CB 3.97Å; W266-M334 HydrophobicContact CH2-CG 3.52Å; W266-M334 HydrophobicContact CH2-SD 3.5Å; W266-M334 VanDerWaalsContact CH2-SD 3.5Å; W266-M334 HydrophobicContact CZ2-CG 4.26Å; W266-M334 HydrophobicContact CZ2-SD 4.37Å; W266-M334 HydrophobicContact CZ3-CG 3.74Å; W266-M334 HydrophobicContact CZ3-SD 4.12Å
267	G	92.4	Very high	94.6	Very high	24 Å²	24	43 Å²	43	25%	0.247	23%	0.232	C	C	.	.	S	Bend	trans	-76.9	-148.3	174.8	0	0	0	0	0	113.4	N263 P281	N263-G267 PolarHBondContact O-N 3.48Å; G267-P281 WeakPolarHBondContact O-CG 3.4Å
268	R	92.4	Very high	94.3	Very high	155 Å²	155	46 Å²	46	59%	0.585	26%	0.256	S	S	*	.			trans	-112.8	149.5	175.9	-62.6	174.1	65.7	-178.6	2.7	110.1	L313 Y314	R268-L313 WeakPolarHBondContact O-CD1 3.35Å; R268-Y314 HydrophobicContact CB-CD2 3.72Å; R268-Y314 HydrophobicContact CB-CE2 3.92Å; R268-Y314 HydrophobicContact CG-CD2 4.5Å
269	S	94.4	Very high	94.1	Very high	4 Å²	4	46 Å²	46	3%	0.028	26%	0.257	C	S	.	.			trans	-93.7	156.1	173.6	94.3	0	0	0	0	111.7	V157 I271 V279	V157-S269 WeakPolarHBondContact O-CA 3.19Å; V157-S269 WeakPolarHBondContact O-CB 3.34Å; S269-I271 PolarHBondContact OG-N 3.37Å; S269-I271 PolarHBondContact OG-O 2.95Å; S269-V279 WeakPolarHBondContact CB-O 2.87Å; S269-V279 PolarHBondContact OG-O 2.96Å
270	T	94.7	Very high	93.9	Very high	53 Å²	53	48.8 Å²	48.8	33%	0.325	27%	0.271	S	S	.	.			trans	-94.2	-0.8	166.1	61.5	0	0	0	0	112.9	V157 K158 L313 Y314	V157-T270 PolarHBondContact O-N 3.23Å; K158-T270 WeakPolarHBondContact CA-OG1 3.18Å; K158-T270 WeakPolarHBondContact CB-OG1 3.38Å; T270-L313 HydrophobicContact CG2-CD1 3.85Å; T270-L313 HydrophobicContact CG2-CD2 3.7Å; T270-L313 HydrophobicContact CG2-CG 4.33Å; T270-Y314 HydrophobicContact CG2-CE2 4.35Å
271	I	94.9	Very high	93.8	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.062	27%	0.269	C	S	.	.			trans	-74.8	136.8	-177.5	-58	172	0	0	0	108.4	C160 L163 S269 A278 V279 L284	C160-I271 HydrophobicContact CB-CD1 3.59Å; C160-I271 HydrophobicContact CB-CG1 3.78Å; C160-I271 HydrophobicContact CB-CG2 4.31Å; L163-I271 HydrophobicContact CD1-CG2 4.12Å; L163-I271 HydrophobicContact CD2-CG2 3.74Å; L163-I271 HydrophobicContact CG-CG2 4.43Å; S269-I271 PolarHBondContact OG-N 3.37Å; S269-I271 PolarHBondContact OG-O 2.95Å; I271-A278 WeakPolarHBondContact O-CA 3.38Å; I271-V279 HydrophobicContact CB-CB 4.4Å; I271-V279 HydrophobicContact CB-CG2 4.42Å; I271-V279 HydrophobicContact CG2-CB 4.4Å; I271-V279 HydrophobicContact CG2-CG2 3.96Å; I271-V279 PolarHBondContact O-N 3.08Å; I271-L284 HydrophobicContact CD1-CD1 4.04Å; I271-L284 HydrophobicContact CD1-CD2 4.21Å
272	K	93	Very high	93.7	Very high	141 Å²	141	53.4 Å²	53.4	61%	0.613	29%	0.293	S	S	*	.	B	Isolated β-bridge	trans	-115.8	143.7	-179.6	-64.2	-175.8	179.4	-174.8	0	111.2	T277	K272-T277 CarbonylContact C-O 3.59Å; K272-T277 VanDerWaalsContact CA-O 3.22Å; K272-T277 WeakPolarHBondContact CA-O 3.5Å
273	K	91	Very high	93.6	Very high	53 Å²	53	55.9 Å²	55.9	23%	0.23	30%	0.304	C	S	.	.			trans	-72.8	172.9	169.5	-60.1	-176.7	-163	-176.2	0	110.2	F173 D275 K276 T277 V279 E283	F173-K273 HydrophobicContact CE2-CD 4.08Å; F173-K273 HydrophobicContact CE2-CG 4.15Å; F173-K273 HydrophobicContact CZ-CD 3.99Å; F173-K273 HydrophobicContact CZ-CG 3.97Å; K273-D275 VanDerWaalsContact CB-OD1 3.25Å; K273-D275 WeakPolarHBondContact CB-OD1 3.41Å; K273-D275 PolarHBondContact O-N 3.35Å; K273-K276 WeakPolarHBondContact O-CA 3.43Å; K273-K276 PolarHBondContact O-N 2.97Å; K273-T277 WeakPolarHBondContact CD-OG1 3.2Å; K273-T277 PolarHBondContact N-O 2.96Å; K273-V279 HydrophobicContact CG-CG2 3.52Å; K273-E283 WeakPolarHBondContact CE-OE2 2.9Å; K273-E283 IonicContact NZ-OE1 3.08Å; K273-E283 PolarHBondContact NZ-OE1 2.88Å; K273-E283 IonicContact NZ-OE2 3.9Å; K273-E283 PolarHBondContact NZ-OE2 2.94Å
274	G	86.6	Confident	93.6	Very high	89 Å²	89	55.8 Å²	55.8	92%	0.918	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.8	176.6	0	0	0	0	0	113.8	K276	G274-K276 PolarHBondContact O-N 3.24Å
275	D	90.3	Very high	93.6	Very high	105 Å²	105	55.6 Å²	55.6	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	5.7	175.3	67.5	2.2	0	0	0	113.9	K273 T277	K273-D275 VanDerWaalsContact CB-OD1 3.25Å; K273-D275 WeakPolarHBondContact CB-OD1 3.41Å; K273-D275 PolarHBondContact O-N 3.35Å; D275-T277 PolarHBondContact O-N 2.63Å; D275-T277 WeakPolarHBondContact OD1-CB 3.27Å; D275-T277 WeakPolarHBondContact OD1-CG2 3.36Å; D275-T277 PolarHBondContact OD1-N 3.17Å; D275-T277 PolarHBondContact OD1-OG1 3.06Å; D275-T277 PolarHBondContact OD2-OG1 3.44Å
276	K	90.1	Very high	93.6	Very high	171 Å²	171	55.6 Å²	55.6	74%	0.743	30%	0.302	S	S	*	.	S	Bend	trans	69.3	5.4	-177.4	-51.4	174.6	-179.5	173.4	0	115.6	K273 G274	K273-K276 WeakPolarHBondContact O-CA 3.43Å; K273-K276 PolarHBondContact O-N 2.97Å; G274-K276 PolarHBondContact O-N 3.24Å
277	T	92.4	Very high	93.6	Very high	62 Å²	62	54.8 Å²	54.8	38%	0.38	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-70.1	151	169.7	64.1	0	0	0	0	110.4	K272 K273 D275	K272-T277 CarbonylContact C-O 3.59Å; K272-T277 VanDerWaalsContact CA-O 3.22Å; K272-T277 WeakPolarHBondContact CA-O 3.5Å; K273-T277 WeakPolarHBondContact CD-OG1 3.2Å; K273-T277 PolarHBondContact N-O 2.96Å; D275-T277 PolarHBondContact O-N 2.63Å; D275-T277 WeakPolarHBondContact OD1-CB 3.27Å; D275-T277 WeakPolarHBondContact OD1-CG2 3.36Å; D275-T277 PolarHBondContact OD1-N 3.17Å; D275-T277 PolarHBondContact OD1-OG1 3.06Å; D275-T277 PolarHBondContact OD2-OG1 3.44Å
278	A	91.9	Very high	93.8	Very high	62 Å²	62	56.2 Å²	56.2	51%	0.512	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-73.4	139.6	176.8	0	0	0	0	0	110.3	I271	I271-A278 WeakPolarHBondContact O-CA 3.38Å
279	V	94.8	Very high	94	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.012	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-78.8	126.9	173.2	-178.5	0	0	0	0	108.5	L163 F173 S269 I271 K273 E283 L284	L163-V279 HydrophobicContact CD2-CG2 4.04Å; F173-V279 HydrophobicContact CD2-CG1 3.93Å; F173-V279 HydrophobicContact CD2-CG2 4.45Å; F173-V279 HydrophobicContact CE2-CG1 4.42Å; F173-V279 HydrophobicContact CE2-CG2 4.5Å; S269-V279 WeakPolarHBondContact CB-O 2.87Å; S269-V279 PolarHBondContact OG-O 2.96Å; I271-V279 HydrophobicContact CB-CB 4.4Å; I271-V279 HydrophobicContact CB-CG2 4.42Å; I271-V279 HydrophobicContact CG2-CB 4.4Å; I271-V279 HydrophobicContact CG2-CG2 3.96Å; I271-V279 PolarHBondContact O-N 3.08Å; K273-V279 HydrophobicContact CG-CG2 3.52Å; V279-E283 HydrophobicContact CG1-CB 3.91Å; V279-L284 HydrophobicContact CG1-CD2 3.72Å; V279-L284 HydrophobicContact CG1-CG 3.95Å
280	D	94.6	Very high	94.2	Very high	58 Å²	58	49.7 Å²	49.7	31%	0.31	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-69	138	170.8	-168.4	-66.1	0	0	0	109.1	E282 E283	D280-E282 PolarHBondContact O-N 2.99Å; D280-E282 WeakPolarHBondContact OD1-CB 3.41Å; D280-E282 PolarHBondContact OD1-N 3.03Å; D280-E283 HydrophobicContact CB-CG 4.2Å; D280-E283 WeakPolarHBondContact O-CB 3.29Å; D280-E283 PolarHBondContact O-N 3.13Å
281	P	94.9	Very high	94.3	Very high	2 Å²	2	49 Å²	49	1%	0.013	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-55.1	-23.4	176.2	-26.2	35.4	0	0	0	114.5	V157 G267 E283 L284 V287	V157-P281 HydrophobicContact CG1-CB 4.33Å; V157-P281 HydrophobicContact CG1-CG 4.49Å; G267-P281 WeakPolarHBondContact O-CG 3.4Å; P281-E283 VanDerWaalsContact C-N 3.28Å; P281-E283 PolarHBondContact O-N 2.58Å; P281-L284 PolarHBondContact O-N 2.93Å; P281-V287 HydrophobicContact CB-CG1 3.94Å; P281-V287 VanDerWaalsContact O-CB 3.32Å; P281-V287 WeakPolarHBondContact O-CB 3.19Å; P281-V287 VanDerWaalsContact O-CG1 3.31Å; P281-V287 WeakPolarHBondContact O-CG1 3.01Å
282	E	94.2	Very high	94.3	Very high	104 Å²	104	52.5 Å²	52.5	49%	0.486	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-69.1	-24.5	173.4	-168.3	166.4	176.1	0	0	114	D280 L284 Y288 R291	D280-E282 PolarHBondContact O-N 2.99Å; D280-E282 WeakPolarHBondContact OD1-CB 3.41Å; D280-E282 PolarHBondContact OD1-N 3.03Å; E282-L284 VanDerWaalsContact C-N 3.3Å; E282-Y288 HydrophobicContact CG-CD2 4.08Å; E282-R291 IonicContact OE2-NH1 2.6Å
283	E	95.8	Very high	94.4	Very high	52 Å²	52	45.9 Å²	45.9	24%	0.243	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-79.3	-13.5	175.1	-61.3	177.6	-176.7	0	0	112.3	R172 F173 K273 V279 D280 P281	R172-E283 CarbonylContact C-O 3.49Å; R172-E283 WeakPolarHBondContact CA-O 3.39Å; R172-E283 WeakPolarHBondContact CB-O 3.46Å; F173-E283 HydrophobicContact CD2-CB 4.21Å; F173-E283 PolarHBondContact N-O 2.75Å; K273-E283 WeakPolarHBondContact CE-OE2 2.9Å; K273-E283 IonicContact NZ-OE1 3.08Å; K273-E283 PolarHBondContact NZ-OE1 2.88Å; K273-E283 IonicContact NZ-OE2 3.9Å; K273-E283 PolarHBondContact NZ-OE2 2.94Å; V279-E283 HydrophobicContact CG1-CB 3.91Å; D280-E283 HydrophobicContact CB-CG 4.2Å; D280-E283 WeakPolarHBondContact O-CB 3.29Å; D280-E283 PolarHBondContact O-N 3.13Å; P281-E283 VanDerWaalsContact C-N 3.28Å; P281-E283 PolarHBondContact O-N 2.58Å
284	L	96.9	Very high	94.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-83.6	121.8	177.9	-62.1	172.5	0	0	0	110.4	V157 L163 F173 Q175 I271 V279 P281 E282 L286 V287 Y288	V157-L284 HydrophobicContact CG1-CD1 4.12Å; L163-L284 HydrophobicContact CD1-CD2 4.01Å; F173-L284 HydrophobicContact CB-CD2 4.34Å; Q175-L284 HydrophobicContact CG-CD2 4.41Å; I271-L284 HydrophobicContact CD1-CD1 4.04Å; I271-L284 HydrophobicContact CD1-CD2 4.21Å; V279-L284 HydrophobicContact CG1-CD2 3.72Å; V279-L284 HydrophobicContact CG1-CG 3.95Å; P281-L284 PolarHBondContact O-N 2.93Å; E282-L284 VanDerWaalsContact C-N 3.3Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.58Å; L284-V287 HydrophobicContact CB-CB 4.09Å; L284-V287 HydrophobicContact CB-CG2 4.03Å; L284-V287 HydrophobicContact CD1-CG2 4.07Å; L284-V287 PolarHBondContact O-N 2.92Å; L284-Y288 VanDerWaalsContact O-CB 3.29Å; L284-Y288 WeakPolarHBondContact O-CB 3.17Å; L284-Y288 PolarHBondContact O-N 2.84Å
285	T	96.5	Very high	95	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-43.3	-175.8	-62.7	0	0	0	0	112.7	F173 D174 N289	F173-T285 PolarHBondContact O-N 2.77Å; F173-T285 PolarHBondContact O-OG1 3.21Å; D174-T285 WeakPolarHBondContact OD1-CB 3.44Å; D174-T285 PolarHBondContact OD1-OG1 3.41Å; T285-N289 PolarHBondContact O-N 3.27Å; T285-N289 VanDerWaalsContact O-N 3.08Å; T285-N289 PolarHBondContact O-ND2 3.17Å
286	L	97.1	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-48.2	179.6	-65	-177.8	0	0	0	112.3	W156 Q175 Q178 A179 V235 L284 N289 L290	W156-L286 HydrophobicContact CD2-CB 4.14Å; W156-L286 HydrophobicContact CD2-CD1 4.18Å; W156-L286 HydrophobicContact CE3-CB 3.65Å; W156-L286 HydrophobicContact CE3-CD1 4.5Å; W156-L286 HydrophobicContact CG-CD1 4.4Å; W156-L286 HydrophobicContact CZ3-CB 3.88Å; Q175-L286 HydrophobicContact CB-CD1 3.91Å; Q178-L286 HydrophobicContact CB-CD1 3.82Å; A179-L286 HydrophobicContact CB-CD1 4.32Å; A179-L286 HydrophobicContact CB-CD2 4Å; V235-L286 HydrophobicContact CB-CD2 3.83Å; V235-L286 HydrophobicContact CG1-CD2 3.78Å; V235-L286 HydrophobicContact CG2-CD2 4.13Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.58Å; L286-N289 PolarHBondContact O-N 3.11Å; L286-L290 WeakPolarHBondContact O-CB 3.49Å; L286-L290 PolarHBondContact O-N 3.24Å
287	V	97.4	Very high	95.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-44.3	180	175.6	0	0	0	0	110.6	W156 V157 L265 P281 L284 N289 L290 R291	W156-V287 HydrophobicContact CB-CG2 4.26Å; V157-V287 HydrophobicContact CG1-CG2 3.8Å; L265-V287 HydrophobicContact CB-CG1 4.35Å; L265-V287 HydrophobicContact CD2-CG1 3.98Å; P281-V287 HydrophobicContact CB-CG1 3.94Å; P281-V287 VanDerWaalsContact O-CB 3.32Å; P281-V287 WeakPolarHBondContact O-CB 3.19Å; P281-V287 VanDerWaalsContact O-CG1 3.31Å; P281-V287 WeakPolarHBondContact O-CG1 3.01Å; L284-V287 HydrophobicContact CB-CB 4.09Å; L284-V287 HydrophobicContact CB-CG2 4.03Å; L284-V287 HydrophobicContact CD1-CG2 4.07Å; L284-V287 PolarHBondContact O-N 2.92Å; V287-N289 PolarHBondContact O-N 3.29Å; V287-L290 PolarHBondContact O-N 3.15Å; V287-R291 HydrophobicContact CG1-CG 4.4Å; V287-R291 WeakPolarHBondContact O-CG 3.24Å; V287-R291 PolarHBondContact O-N 3.19Å
288	Y	96.7	Very high	95.2	Very high	55 Å²	55	34.4 Å²	34.4	22%	0.216	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-45.7	178.7	177.9	-90.9	0	0	0	112.1	R172 E282 L284 K292	R172-Y288 PolarHBondContact NH2-OH 2.91Å; E282-Y288 HydrophobicContact CG-CD2 4.08Å; L284-Y288 VanDerWaalsContact O-CB 3.29Å; L284-Y288 WeakPolarHBondContact O-CB 3.17Å; L284-Y288 PolarHBondContact O-N 2.84Å; Y288-K292 HydrophobicContact CE1-CD 4.12Å; Y288-K292 PolarHBondContact O-N 2.73Å; Y288-K292 WeakPolarHBondContact OH-CE 3.5Å
289	N	96.8	Very high	95.3	Very high	21 Å²	21	32.5 Å²	32.5	11%	0.112	16%	0.155	C	C	.	.	H	α-helix	trans	-70.5	-37.6	178.5	-71	-44	0	0	0	112	G236 M239 T285 L286 V287 R291 K292 L293	G236-N289 VanDerWaalsContact CA-ND2 3.31Å; G236-N289 WeakPolarHBondContact CA-ND2 3.18Å; M239-N289 HydrophobicContact SD-CB 3.93Å; T285-N289 PolarHBondContact O-N 3.27Å; T285-N289 VanDerWaalsContact O-N 3.08Å; T285-N289 PolarHBondContact O-ND2 3.17Å; L286-N289 PolarHBondContact O-N 3.11Å; V287-N289 PolarHBondContact O-N 3.29Å; N289-R291 PolarHBondContact O-N 2.77Å; N289-K292 WeakPolarHBondContact O-CB 3.37Å; N289-K292 PolarHBondContact O-N 2.99Å; N289-K292 VanDerWaalsContact O-N 3.16Å; N289-L293 PolarHBondContact O-N 3.27Å
290	L	97.4	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-38.9	175.7	-174.8	58.7	0	0	0	112.3	V150 W156 M239 V259 L265 L286 V287 K292 L293 M294	V150-L290 HydrophobicContact CG1-CD2 4.43Å; V150-L290 HydrophobicContact CG2-CD1 4.33Å; V150-L290 HydrophobicContact CG2-CD2 4.12Å; W156-L290 HydrophobicContact CE3-CD2 4.05Å; W156-L290 HydrophobicContact CH2-CD2 4.17Å; W156-L290 HydrophobicContact CZ3-CB 4.02Å; W156-L290 HydrophobicContact CZ3-CD2 3.49Å; W156-L290 VanDerWaalsContact CZ3-CD2 3.49Å; W156-L290 HydrophobicContact CZ3-CG 4.32Å; M239-L290 HydrophobicContact CE-CB 4.4Å; M239-L290 HydrophobicContact CE-CD1 4.15Å; M239-L290 HydrophobicContact SD-CB 4.46Å; V259-L290 HydrophobicContact CG1-CD2 4.22Å; V259-L290 HydrophobicContact CG2-CD1 3.97Å; V259-L290 HydrophobicContact CG2-CD2 4.32Å; L265-L290 HydrophobicContact CD1-CD2 4.08Å; L265-L290 HydrophobicContact CD1-CG 4.01Å; L265-L290 HydrophobicContact CD2-CD2 3.67Å; L265-L290 HydrophobicContact CD2-CG 4.25Å; L265-L290 HydrophobicContact CG-CD2 4.49Å; L286-L290 WeakPolarHBondContact O-CB 3.49Å; L286-L290 PolarHBondContact O-N 3.24Å; V287-L290 PolarHBondContact O-N 3.15Å; L290-K292 PolarHBondContact O-N 2.86Å; L290-L293 HydrophobicContact CD1-CD1 4.35Å; L290-L293 WeakPolarHBondContact O-CB 3.38Å; L290-L293 PolarHBondContact O-N 3.39Å; L290-M294 HydrophobicContact CD1-CE 4.14Å; L290-M294 WeakPolarHBondContact O-CG 3.42Å; L290-M294 PolarHBondContact O-N 3.43Å
291	R	97.2	Very high	95.3	Very high	40 Å²	40	30.4 Å²	30.4	15%	0.151	15%	0.147	C	C	.	.	H	α-helix	trans	-57	-33.8	173	-76.2	-177.1	-177.4	-178.5	6.2	112.3	L265 W266 E282 V287 N289 L293 M294	L265-R291 HydrophobicContact CB-CG 4.17Å; L265-R291 PolarHBondContact O-NE 3.18Å; L265-R291 PolarHBondContact O-NH2 3.01Å; W266-R291 HydrophobicContact CZ2-CG 4.28Å; E282-R291 IonicContact OE2-NH1 2.6Å; V287-R291 HydrophobicContact CG1-CG 4.4Å; V287-R291 WeakPolarHBondContact O-CG 3.24Å; V287-R291 PolarHBondContact O-N 3.19Å; N289-R291 PolarHBondContact O-N 2.77Å; R291-L293 VanDerWaalsContact C-N 3.32Å; R291-M294 PolarHBondContact O-N 3.13Å
292	K	95.6	Very high	95.4	Very high	84 Å²	84	30.3 Å²	30.3	37%	0.365	15%	0.147	S	C	.	.	H	α-helix	trans	-68.1	-30.5	175.3	-68.3	178.3	168.3	179.5	0	113.1	R243 Y288 N289 L290 M294	R243-K292 PolarHBondContact NH1-O 2.58Å; Y288-K292 HydrophobicContact CE1-CD 4.12Å; Y288-K292 PolarHBondContact O-N 2.73Å; Y288-K292 WeakPolarHBondContact OH-CE 3.5Å; N289-K292 WeakPolarHBondContact O-CB 3.37Å; N289-K292 PolarHBondContact O-N 2.99Å; N289-K292 VanDerWaalsContact O-N 3.16Å; L290-K292 PolarHBondContact O-N 2.86Å; K292-M294 VanDerWaalsContact C-N 3.33Å
293	L	94.8	Very high	95.6	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-75.2	-24.2	173.8	-75.9	176.8	0	0	0	112.7	L148 M239 R243 V257 N289 L290 R291 K295 W298	L148-L293 HydrophobicContact CD1-CD1 3.57Å; L148-L293 HydrophobicContact CD2-CD1 4.4Å; M239-L293 HydrophobicContact CB-CD1 3.63Å; M239-L293 HydrophobicContact CB-CG 4.09Å; M239-L293 HydrophobicContact CE-CD1 4.37Å; M239-L293 HydrophobicContact CG-CD1 3.47Å; M239-L293 VanDerWaalsContact CG-CD1 3.47Å; M239-L293 HydrophobicContact CG-CG 4.41Å; M239-L293 HydrophobicContact SD-CD1 3.76Å; R243-L293 HydrophobicContact CB-CD2 3.86Å; R243-L293 HydrophobicContact CG-CD2 4.29Å; V257-L293 HydrophobicContact CG1-CB 4.49Å; N289-L293 PolarHBondContact O-N 3.27Å; L290-L293 HydrophobicContact CD1-CD1 4.35Å; L290-L293 WeakPolarHBondContact O-CB 3.38Å; L290-L293 PolarHBondContact O-N 3.39Å; R291-L293 VanDerWaalsContact C-N 3.32Å; L293-K295 PolarHBondContact O-N 3.45Å; L293-W298 PolarHBondContact O-NE1 3.08Å
294	M	95.9	Very high	95.7	Very high	1 Å²	1	23 Å²	23	1%	0.005	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.2	176.5	-60.2	-60.3	91.5	0	0	113.4	R118 V257 V259 V262 L265 W266 L290 R291 K292 V303 T305 M334	R118-M294 VanDerWaalsContact CD-O 3.23Å; R118-M294 WeakPolarHBondContact CD-O 3.42Å; R118-M294 PolarHBondContact NH1-O 2.93Å; V257-M294 HydrophobicContact CG1-CE 3.44Å; V257-M294 VanDerWaalsContact CG1-CE 3.44Å; V259-M294 HydrophobicContact CG2-CE 3.82Å; V259-M294 HydrophobicContact CG2-SD 4.13Å; V262-M294 HydrophobicContact CG2-CG 4.5Å; V262-M294 HydrophobicContact CG2-SD 3.92Å; L265-M294 HydrophobicContact CD1-CG 3.84Å; L265-M294 HydrophobicContact CD1-SD 4.44Å; W266-M294 HydrophobicContact CH2-CB 4.03Å; W266-M294 HydrophobicContact CH2-CG 3.98Å; W266-M294 HydrophobicContact CZ2-CB 4.27Å; W266-M294 HydrophobicContact CZ2-CG 4.48Å; L290-M294 HydrophobicContact CD1-CE 4.14Å; L290-M294 WeakPolarHBondContact O-CG 3.42Å; L290-M294 PolarHBondContact O-N 3.43Å; R291-M294 PolarHBondContact O-N 3.13Å; K292-M294 VanDerWaalsContact C-N 3.33Å; M294-V303 HydrophobicContact CE-CG1 3.81Å; M294-V303 HydrophobicContact SD-CG1 3.88Å; M294-T305 HydrophobicContact SD-CG2 4.01Å; M294-M334 HydrophobicContact CB-SD 3.98Å
295	K	94.1	Very high	95.8	Very high	98 Å²	98	23 Å²	23	43%	0.426	11%	0.113	S	C	.	.	S	Bend	trans	-72.7	148.8	171.5	-64.6	-171.6	177.2	-165.8	0	109.8	L293 D297 W298	L293-K295 PolarHBondContact O-N 3.45Å; K295-D297 VanDerWaalsContact C-N 3.26Å; K295-D297 HydrophobicContact CB-CB 4.5Å; K295-D297 WeakPolarHBondContact CB-OD1 3.25Å; K295-D297 PolarHBondContact O-N 3.15Å; K295-W298 PolarHBondContact O-NE1 2.81Å
296	N	91.5	Very high	95.8	Very high	65 Å²	65	22.9 Å²	22.9	35%	0.348	11%	0.112	S	C	.	.	S	Bend	trans	-93.5	32.2	175.9	63.5	-22.3	0	0	0	111.8	P115 W298	P115-N296 WeakPolarHBondContact CB-O 3.47Å; N296-W298 VanDerWaalsContact C-N 3.29Å; N296-W298 PolarHBondContact O-N 2.85Å
297	D	91.5	Very high	95.9	Very high	73 Å²	73	23 Å²	23	39%	0.39	11%	0.113	S	C	.	.			trans	-96.9	30.1	-178.8	58.3	-6.5	0	0	0	112	R243 K295	R243-D297 IonicContact CZ-OD1 3.68Å; R243-D297 IonicContact CZ-OD2 2.75Å; R243-D297 IonicContact NE-OD1 3.99Å; R243-D297 VanDerWaalsContact NH1-CG 3.32Å; R243-D297 IonicContact NH1-OD1 2.8Å; R243-D297 PolarHBondContact NH1-OD1 3.08Å; R243-D297 IonicContact NH1-OD2 3.59Å; R243-D297 PolarHBondContact NH1-OD2 2.75Å; R243-D297 IonicContact NH2-OD1 3.49Å; R243-D297 PolarHBondContact NH2-OD1 3.22Å; R243-D297 IonicContact NH2-OD2 3.47Å; R243-D297 PolarHBondContact NH2-OD2 3.45Å; K295-D297 VanDerWaalsContact C-N 3.26Å; K295-D297 HydrophobicContact CB-CB 4.5Å; K295-D297 WeakPolarHBondContact CB-OD1 3.25Å; K295-D297 PolarHBondContact O-N 3.15Å
298	W	94.1	Very high	95.8	Very high	3 Å²	3	23.8 Å²	23.8	1%	0.011	12%	0.119	C	C	.	.			trans	-152.1	154.5	177.4	61.1	-81.6	0	0	0	109.9	A116 R243 S246 L255 V257 L293 K295 N296 V303	A116-W298 HydrophobicContact CB-CD2 3.94Å; A116-W298 HydrophobicContact CB-CE3 4.06Å; A116-W298 HydrophobicContact CB-CH2 3.89Å; A116-W298 HydrophobicContact CB-CZ2 3.76Å; A116-W298 HydrophobicContact CB-CZ3 4.03Å; A116-W298 WeakPolarHBondContact CB-O 3.42Å; A116-W298 PolarHBondContact N-O 2.82Å; R243-W298 HydrophobicContact CG-CB 3.7Å; R243-W298 HydrophobicContact CG-CD2 4.28Å; R243-W298 HydrophobicContact CG-CG 3.67Å; S246-W298 VanDerWaalsContact OG-CE3 3.28Å; L255-W298 HydrophobicContact CB-CH2 4.26Å; L255-W298 HydrophobicContact CB-CZ3 3.97Å; L255-W298 HydrophobicContact CD2-CE3 4.36Å; L255-W298 HydrophobicContact CD2-CH2 3.8Å; L255-W298 HydrophobicContact CD2-CZ2 4.45Å; L255-W298 HydrophobicContact CD2-CZ3 3.75Å; L255-W298 HydrophobicContact CG-CH2 4.07Å; L255-W298 HydrophobicContact CG-CZ3 4.16Å; V257-W298 HydrophobicContact CG2-CH2 3.87Å; V257-W298 HydrophobicContact CG2-CZ2 3.81Å; L293-W298 PolarHBondContact O-NE1 3.08Å; K295-W298 PolarHBondContact O-NE1 2.81Å; N296-W298 VanDerWaalsContact C-N 3.29Å; N296-W298 PolarHBondContact O-N 2.85Å; W298-V303 HydrophobicContact CH2-CG2 4.41Å; W298-V303 HydrophobicContact CZ2-CG2 3.61Å
299	S	94.4	Very high	95.7	Very high	21 Å²	21	22.2 Å²	22.2	15%	0.147	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-118.1	180	179.6	61.9	0	0	0	0	112.2	Q114 S246 D247	Q114-S299 WeakPolarHBondContact O-CB 3.36Å; S246-S299 CarbonylContact C-O 3.54Å; S246-S299 VanDerWaalsContact C-O 3.23Å; S246-S299 WeakPolarHBondContact CB-O 3.5Å; S246-S299 VanDerWaalsContact O-O 3.1Å; S246-S299 PolarHBondContact OG-O 3.48Å; D247-S299 PolarHBondContact OD1-N 3.49Å; D247-S299 PolarHBondContact OD1-OG 3.15Å
300	G	92.8	Very high	95.6	Very high	13 Å²	13	24.6 Å²	24.6	13%	0.134	13%	0.129	C	C	.	.	S	Bend	trans	82.8	14.8	177.6	0	0	0	0	0	115.3	Y112 R254 L255	Y112-G300 WeakPolarHBondContact O-CA 3.09Å; Y112-G300 PolarHBondContact O-N 2.86Å; R254-G300 WeakPolarHBondContact CA-O 3.42Å; L255-G300 PolarHBondContact N-O 3.41Å; L255-G300 VanDerWaalsContact N-O 3.14Å
301	G	94.9	Very high	95.2	Very high	3 Å²	3	26 Å²	26	3%	0.031	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-166.2	179.4	0	0	0	0	0	115.4	L255	L255-G301 CarbonylContact O-C 3.57Å; L255-G301 WeakPolarHBondContact O-CA 3.33Å
302	A	97.3	Very high	95.1	Very high	1 Å²	1	25 Å²	25	1%	0.008	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150	-179.2	0	0	0	0	0	111.9	L107 Y112 Y119 W145 L255 V257	L107-A302 HydrophobicContact CD2-CB 3.5Å; Y112-A302 HydrophobicContact CE1-CB 4.45Å; Y119-A302 HydrophobicContact CE2-CB 4.23Å; W145-A302 HydrophobicContact CH2-CB 4.44Å; W145-A302 HydrophobicContact CZ3-CB 4.21Å; L255-A302 PolarHBondContact O-N 2.94Å; V257-A302 PolarHBondContact N-O 3.24Å
303	V	98.3	Very high	94.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.8	175.9	177.5	0	0	0	0	108.6	L117 R118 Y119 V257 M294 W298 T305	L117-V303 PolarHBondContact O-N 2.88Å; R118-V303 CarbonylContact C-O 3.48Å; R118-V303 WeakPolarHBondContact CA-O 3.28Å; R118-V303 HydrophobicContact CG-CB 3.99Å; R118-V303 HydrophobicContact CG-CG1 4.33Å; R118-V303 HydrophobicContact CG-CG2 4.39Å; Y119-V303 PolarHBondContact N-O 3.11Å; V257-V303 HydrophobicContact CB-CG2 4.26Å; V257-V303 CarbonylContact O-C 3.6Å; V257-V303 WeakPolarHBondContact O-CA 3.47Å; M294-V303 HydrophobicContact CE-CG1 3.81Å; M294-V303 HydrophobicContact SD-CG1 3.88Å; W298-V303 HydrophobicContact CH2-CG2 4.41Å; W298-V303 HydrophobicContact CZ2-CG2 3.61Å; V303-T305 HydrophobicContact CG1-CG2 3.73Å
304	I	98.4	Very high	94.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	112.8	-175.6	-48.4	159.1	0	0	0	107.9	V103 L107 Y119 F121 L133 T136 V257 A258 V259	V103-I304 HydrophobicContact CG1-CG2 4.43Å; L107-I304 HydrophobicContact CD1-CD1 4Å; Y119-I304 HydrophobicContact CD2-CG1 4.21Å; F121-I304 HydrophobicContact CD2-CG2 4.29Å; F121-I304 HydrophobicContact CE2-CG2 3.68Å; L133-I304 HydrophobicContact CD1-CB 3.97Å; L133-I304 HydrophobicContact CD1-CG2 3.44Å; L133-I304 VanDerWaalsContact CD1-CG2 3.44Å; L133-I304 WeakPolarHBondContact CD1-O 3.38Å; T136-I304 HydrophobicContact CG2-CD1 3.79Å; T136-I304 HydrophobicContact CG2-CG2 4.34Å; V257-I304 PolarHBondContact O-N 3.31Å; A258-I304 WeakPolarHBondContact CA-O 3.29Å; V259-I304 PolarHBondContact N-O 2.65Å; V259-I304 VanDerWaalsContact N-O 3.1Å
305	T	98.4	Very high	94.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	159.2	-171.5	64.3	0	0	0	0	111.6	Y119 V120 F121 V259 V262 M294 V303 M334	Y119-T305 PolarHBondContact O-N 3.33Å; Y119-T305 PolarHBondContact O-OG1 3.36Å; V120-T305 WeakPolarHBondContact CA-O 3.31Å; V120-T305 WeakPolarHBondContact CG2-OG1 3.38Å; F121-T305 WeakPolarHBondContact CD2-O 3.28Å; F121-T305 PolarHBondContact N-O 3.1Å; V259-T305 HydrophobicContact CB-CG2 4.12Å; V259-T305 VanDerWaalsContact O-CA 3.27Å; V259-T305 WeakPolarHBondContact O-CA 3.18Å; V262-T305 HydrophobicContact CB-CG2 4.24Å; V262-T305 HydrophobicContact CG2-CG2 4.04Å; M294-T305 HydrophobicContact SD-CG2 4.01Å; V303-T305 HydrophobicContact CG1-CG2 3.73Å; T305-M334 HydrophobicContact CG2-CE 4.47Å
306	T	98.4	Very high	94.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.1	168.9	65.2	0	0	0	0	109.5	F121 K129 L133 V259 D260 G261 V262	F121-T306 HydrophobicContact CB-CG2 3.88Å; F121-T306 HydrophobicContact CD2-CG2 4.02Å; F121-T306 HydrophobicContact CG-CG2 4.39Å; F121-T306 WeakPolarHBondContact O-CA 3.41Å; K129-T306 HydrophobicContact CB-CG2 4.16Å; L133-T306 HydrophobicContact CB-CG2 3.67Å; L133-T306 HydrophobicContact CD2-CG2 3.82Å; L133-T306 HydrophobicContact CG-CG2 4.22Å; V259-T306 PolarHBondContact O-N 3.49Å; D260-T306 WeakPolarHBondContact CA-OG1 3.41Å; D260-T306 PolarHBondContact OD1-OG1 3.24Å; G261-T306 WeakPolarHBondContact CA-O 3.43Å; G261-T306 PolarHBondContact N-O 2.89Å; G261-T306 PolarHBondContact N-OG1 3.07Å; G261-T306 VanDerWaalsContact N-OG1 3.17Å; V262-T306 PolarHBondContact N-O 3.37Å
307	L	97.6	Very high	94.5	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	19%	0.194	C	C	.	.			trans	-88.3	143.1	161.4	-60.5	175.8	0	0	0	109.5	V120 F121 K129 V262 N263 P322 L325 L326	V120-L307 HydrophobicContact CG1-CD1 4.03Å; V120-L307 HydrophobicContact CG1-CD2 4.2Å; V120-L307 HydrophobicContact CG1-CG 3.73Å; F121-L307 PolarHBondContact O-N 3.41Å; K129-L307 VanDerWaalsContact CD-O 3.29Å; K129-L307 WeakPolarHBondContact CD-O 3.41Å; K129-L307 WeakPolarHBondContact CE-O 3.34Å; V262-L307 HydrophobicContact CG1-CD2 3.83Å; N263-L307 HydrophobicContact CB-CD2 4.05Å; L307-P322 VanDerWaalsContact CD1-CA 3.42Å; L307-P322 HydrophobicContact CD1-CB 3.9Å; L307-P322 HydrophobicContact CD1-CG 3.9Å; L307-L325 HydrophobicContact CB-CD1 3.86Å; L307-L325 HydrophobicContact CD1-CD1 4.45Å; L307-L325 HydrophobicContact CD2-CB 4.5Å; L307-L326 HydrophobicContact CD2-CD1 4.38Å; L307-L326 HydrophobicContact CD2-CD2 3.76Å; L307-L326 HydrophobicContact CD2-CG 3.83Å
308	S	96.4	Very high	94.6	Very high	17 Å²	17	37.3 Å²	37.3	12%	0.119	21%	0.208	C	C	.	.			trans	-137.3	119.6	173.6	-176.1	0	0	0	0	111.6	N263 T310	N263-S308 PolarHBondContact ND2-O 3.12Å; N263-S308 VanDerWaalsContact ND2-O 3.08Å; N263-S308 PolarHBondContact OD1-N 2.77Å; N263-S308 PolarHBondContact OD1-O 2.86Å; S308-T310 VanDerWaalsContact C-N 3.29Å; S308-T310 PolarHBondContact OG-N 3Å; S308-T310 VanDerWaalsContact OG-N 3.13Å; S308-T310 PolarHBondContact OG-O 3.44Å
309	Q	95.1	Very high	94.7	Very high	21 Å²	21	37.5 Å²	37.5	10%	0.098	21%	0.21	C	C	.	.	S	Bend	trans	-69.5	-32.3	164.1	-167.8	-69.9	-39.9	0	0	110.4	G311 S312 A319	Q309-G311 PolarHBondContact O-N 3.29Å; Q309-S312 VanDerWaalsContact O-CB 3.31Å; Q309-S312 WeakPolarHBondContact O-CB 3.33Å; Q309-S312 PolarHBondContact O-N 3.41Å; Q309-S312 VanDerWaalsContact O-N 3.12Å; Q309-S312 PolarHBondContact O-OG 2.87Å; Q309-A319 WeakPolarHBondContact CG-O 3.49Å
310	T	93.3	Very high	94.8	Very high	72 Å²	72	40.6 Å²	40.6	44%	0.442	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	118.5	-177.7	-60.9	0	0	0	0	109.4	K125 S308 S312	K125-T310 VanDerWaalsContact CE-OG1 3.27Å; K125-T310 WeakPolarHBondContact CE-OG1 3.44Å; S308-T310 VanDerWaalsContact C-N 3.29Å; S308-T310 PolarHBondContact OG-N 3Å; S308-T310 VanDerWaalsContact OG-N 3.13Å; S308-T310 PolarHBondContact OG-O 3.44Å; T310-S312 VanDerWaalsContact C-N 3.26Å
311	G	90.3	Very high	95	Very high	28 Å²	28	43.2 Å²	43.2	29%	0.289	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-3.2	-176.4	0	0	0	0	0	114.3	H154 K158 Q309	H154-G311 VanDerWaalsContact CD2-C 3.45Å; H154-G311 PolarHBondContact CD2-O 3.15Å; K158-G311 VanDerWaalsContact NZ-CA 3.29Å; K158-G311 PolarHBondContact NZ-O 3.34Å; Q309-G311 PolarHBondContact O-N 3.29Å
312	S	93.3	Very high	95.1	Very high	19 Å²	19	43.8 Å²	43.8	13%	0.133	23%	0.233	C	C	.	.			trans	-59.9	149.6	169.9	67.7	0	0	0	0	111.4	H154 Q309 T310	H154-S312 VanDerWaalsContact CD2-CA 3.49Å; H154-S312 WeakPolarHBondContact CD2-CA 3.49Å; H154-S312 WeakPolarHBondContact NE2-CA 3.31Å; Q309-S312 VanDerWaalsContact O-CB 3.31Å; Q309-S312 WeakPolarHBondContact O-CB 3.33Å; Q309-S312 PolarHBondContact O-N 3.41Å; Q309-S312 VanDerWaalsContact O-N 3.12Å; Q309-S312 PolarHBondContact O-OG 2.87Å; T310-S312 VanDerWaalsContact C-N 3.26Å
313	L	91.4	Very high	95	Very high	32 Å²	32	50.2 Å²	50.2	17%	0.168	26%	0.263	C	S	.	.	S	Bend	trans	-109.6	130	-178.4	-59.8	175.4	0	0	0	108.5	V157 K158 R268 T270 H315	V157-L313 HydrophobicContact CG2-CD1 3.95Å; K158-L313 HydrophobicContact CB-CD1 4.22Å; K158-L313 HydrophobicContact CB-CD2 4.46Å; K158-L313 HydrophobicContact CD-CD2 4.16Å; R268-L313 WeakPolarHBondContact O-CD1 3.35Å; T270-L313 HydrophobicContact CG2-CD1 3.85Å; T270-L313 HydrophobicContact CG2-CD2 3.7Å; T270-L313 HydrophobicContact CG2-CG 4.33Å; L313-H315 PolarHBondContact O-CD2 2.94Å; L313-H315 PolarHBondContact O-N 3.27Å
314	Y	92.2	Very high	94.9	Very high	144 Å²	144	53.9 Å²	53.9	57%	0.565	28%	0.282	S	S	*	.	S	Bend	trans	61.6	22.2	174.7	-47.1	-81.4	0	0	0	115.7	R268 T270	R268-Y314 HydrophobicContact CB-CD2 3.72Å; R268-Y314 HydrophobicContact CB-CE2 3.92Å; R268-Y314 HydrophobicContact CG-CD2 4.5Å; T270-Y314 HydrophobicContact CG2-CE2 4.35Å
315	H	91.9	Very high	94.8	Very high	47 Å²	47	54 Å²	54	22%	0.218	28%	0.283	C	S	.	.			trans	-105.8	148.4	170.1	-69.3	-86.2	0	0	0	111.6	L313 D324 L325	L313-H315 PolarHBondContact O-CD2 2.94Å; L313-H315 PolarHBondContact O-N 3.27Å; H315-D324 PolarHBondContact CE1-O 3.42Å; H315-D324 PolarHBondContact ND1-O 3.16Å; H315-D324 VanDerWaalsContact ND1-O 3.15Å; H315-L325 HydrophobicContact CB-CD2 4.1Å; H315-L325 PolarHBondContact CE1-O 3.45Å; H315-L325 PolarHBondContact NE2-O 2.81Å
316	P	93.4	Very high	94.7	Very high	79 Å²	79	54.2 Å²	54.2	51%	0.513	28%	0.284	S	S	.	.			trans	-67	151.9	175.3	29.1	-32.9	0	0	0	110.6	S318 A319	P316-S318 PolarHBondContact O-N 3.03Å; P316-A319 HydrophobicContact CG-CB 3.74Å; P316-A319 PolarHBondContact O-N 3.06Å; P316-A319 VanDerWaalsContact O-N 3.15Å
317	K	91.8	Very high	94.5	Very high	184 Å²	184	55.5 Å²	55.5	80%	0.8	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.9	-177.9	-70.7	-178.9	-178.7	173.1	0	113.9
318	S	93.1	Very high	94.4	Very high	97 Å²	97	63.1 Å²	63.1	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-12.7	178.6	50.2	0	0	0	0	113.8	P316 Y320	P316-S318 PolarHBondContact O-N 3.03Å; S318-Y320 WeakPolarHBondContact O-CD1 3.17Å; S318-Y320 PolarHBondContact O-N 3.09Å
319	A	95.8	Very high	94.3	Very high	6 Å²	6	70.2 Å²	70.2	5%	0.05	36%	0.357	C	S	.	.			trans	-71.1	130.4	-179.8	0	0	0	0	0	111.3	Q309 P316 D324 L325	Q309-A319 WeakPolarHBondContact CG-O 3.49Å; P316-A319 HydrophobicContact CG-CB 3.74Å; P316-A319 PolarHBondContact O-N 3.06Å; P316-A319 VanDerWaalsContact O-N 3.15Å; A319-D324 HydrophobicContact CB-CB 3.89Å; A319-L325 HydrophobicContact CB-CD2 3.83Å; A319-L325 HydrophobicContact CB-CG 4.38Å
320	Y	96.3	Very high	94.3	Very high	86 Å²	86	69.2 Å²	69.2	34%	0.337	35%	0.352	S	S	.	.			trans	-147.2	-11.2	176.1	71.3	-87.8	0	0	0	113.8	L124 S318	L124-Y320 HydrophobicContact CD2-CD1 3.47Å; L124-Y320 VanDerWaalsContact CD2-CD1 3.47Å; L124-Y320 HydrophobicContact CD2-CD2 4.38Å; L124-Y320 HydrophobicContact CD2-CE1 3.68Å; L124-Y320 HydrophobicContact CD2-CG 3.86Å; L124-Y320 HydrophobicContact CG-CD1 4.48Å; L124-Y320 HydrophobicContact CG-CG 4.47Å; S318-Y320 WeakPolarHBondContact O-CD1 3.17Å; S318-Y320 PolarHBondContact O-N 3.09Å
321	L	97.4	Very high	94.4	Very high	68 Å²	68	68.7 Å²	68.7	36%	0.356	34%	0.344	S	S	.	.	S	Bend	trans	-74.9	152	179.5	-61	174.2	0	0	0	110.4	Y122 Q323 D324 L325	Y122-L321 HydrophobicContact CE2-CD2 4.29Å; L321-Q323 PolarHBondContact O-N 2.8Å; L321-D324 HydrophobicContact CB-CB 4.44Å; L321-D324 WeakPolarHBondContact CB-OD2 3.45Å; L321-D324 PolarHBondContact O-N 3.41Å; L321-L325 PolarHBondContact O-N 2.88Å; L321-L325 VanDerWaalsContact O-N 3.12Å
322	P	96.8	Very high	94.7	Very high	15 Å²	15	72.9 Å²	72.9	10%	0.097	36%	0.36	C	S	.	.	H	α-helix	trans	-54.9	-47	177.5	-27	35.5	0	0	0	114.3	Y122 L307 D324 L325 L326 F337	Y122-P322 HydrophobicContact CD1-CG 4.22Å; Y122-P322 HydrophobicContact CD2-CG 4.21Å; Y122-P322 HydrophobicContact CG-CG 3.91Å; L307-P322 VanDerWaalsContact CD1-CA 3.42Å; L307-P322 HydrophobicContact CD1-CB 3.9Å; L307-P322 HydrophobicContact CD1-CG 3.9Å; P322-D324 PolarHBondContact O-N 3.14Å; P322-L325 PolarHBondContact O-N 3.2Å; P322-L326 HydrophobicContact CB-CD1 4.35Å; P322-L326 WeakPolarHBondContact O-CB 3.33Å; P322-L326 WeakPolarHBondContact O-CG 2.91Å; P322-L326 PolarHBondContact O-N 3.02Å; P322-F337 HydrophobicContact CB-CE2 4.25Å; P322-F337 HydrophobicContact CB-CZ 3.82Å; P322-F337 HydrophobicContact CG-CE2 4.42Å; P322-F337 HydrophobicContact CG-CZ 4.42Å
323	Q	95.7	Very high	94.7	Very high	136 Å²	136	75.6 Å²	75.6	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-62.8	-41.2	-179.8	-166.6	173.8	10.1	0	0	112.2	L321 G327 F331	L321-Q323 PolarHBondContact O-N 2.8Å; Q323-G327 VanDerWaalsContact O-CA 3.31Å; Q323-G327 WeakPolarHBondContact O-CA 3.29Å; Q323-G327 PolarHBondContact O-N 3.04Å; Q323-F331 HydrophobicContact CB-CD2 4.42Å
324	D	95.1	Very high	94.9	Very high	78 Å²	78	74 Å²	74	42%	0.417	36%	0.364	S	S	.	.	H	α-helix	trans	-66.7	-38.9	-179.6	-59.4	-20	0	0	0	113	H315 A319 L321 P322	H315-D324 PolarHBondContact CE1-O 3.42Å; H315-D324 PolarHBondContact ND1-O 3.16Å; H315-D324 VanDerWaalsContact ND1-O 3.15Å; A319-D324 HydrophobicContact CB-CB 3.89Å; L321-D324 HydrophobicContact CB-CB 4.44Å; L321-D324 WeakPolarHBondContact CB-OD2 3.45Å; L321-D324 PolarHBondContact O-N 3.41Å; P322-D324 PolarHBondContact O-N 3.14Å
325	L	96.4	Very high	94.9	Very high	3 Å²	3	71.5 Å²	71.5	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-89.4	-38.7	-174.5	-70.5	-178.2	0	0	0	112.6	N263 L307 H315 A319 L321 P322	N263-L325 HydrophobicContact CB-CB 4.06Å; N263-L325 WeakPolarHBondContact CB-O 3.43Å; L307-L325 HydrophobicContact CB-CD1 3.86Å; L307-L325 HydrophobicContact CD1-CD1 4.45Å; L307-L325 HydrophobicContact CD2-CB 4.5Å; H315-L325 HydrophobicContact CB-CD2 4.1Å; H315-L325 PolarHBondContact CE1-O 3.45Å; H315-L325 PolarHBondContact NE2-O 2.81Å; A319-L325 HydrophobicContact CB-CD2 3.83Å; A319-L325 HydrophobicContact CB-CG 4.38Å; L321-L325 PolarHBondContact O-N 2.88Å; L321-L325 VanDerWaalsContact O-N 3.12Å; P322-L325 PolarHBondContact O-N 3.2Å
326	L	96.2	Very high	95.1	Very high	5 Å²	5	73.6 Å²	73.6	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-76.3	-28.3	176.4	-66.4	172	0	0	0	111.9	V262 N263 W266 L307 P322 G330 M334	V262-L326 HydrophobicContact CG1-CD2 4.14Å; N263-L326 HydrophobicContact CB-CD2 4.26Å; W266-L326 HydrophobicContact CE3-CD2 4.08Å; W266-L326 HydrophobicContact CZ3-CD2 4.11Å; L307-L326 HydrophobicContact CD2-CD1 4.38Å; L307-L326 HydrophobicContact CD2-CD2 3.76Å; L307-L326 HydrophobicContact CD2-CG 3.83Å; P322-L326 HydrophobicContact CB-CD1 4.35Å; P322-L326 WeakPolarHBondContact O-CB 3.33Å; P322-L326 WeakPolarHBondContact O-CG 2.91Å; P322-L326 PolarHBondContact O-N 3.02Å; L326-G330 WeakPolarHBondContact O-CA 3.31Å; L326-G330 PolarHBondContact O-N 3.42Å; L326-M334 HydrophobicContact CD1-CB 4.5Å
327	G	95.3	Very high	95.3	Very high	26 Å²	26	71.3 Å²	71.3	27%	0.268	36%	0.36	S	S	.	.	H	α-helix	trans	62.9	-178.8	-166.5	0	0	0	0	0	111.9	Q323 R329 G330 F331	Q323-G327 VanDerWaalsContact O-CA 3.31Å; Q323-G327 WeakPolarHBondContact O-CA 3.29Å; Q323-G327 PolarHBondContact O-N 3.04Å; G327-R329 PolarHBondContact O-N 3.3Å; G327-G330 PolarHBondContact O-N 3.02Å; G327-F331 VanDerWaalsContact O-CB 3.23Å; G327-F331 WeakPolarHBondContact O-CB 3.41Å; G327-F331 PolarHBondContact O-N 3.38Å
328	E	94.8	Very high	95.6	Very high	162 Å²	162	65.1 Å²	65.1	76%	0.757	34%	0.336	S	S	*	.	H	α-helix	trans	-56.2	-52.5	179.8	-64	172.7	179.5	0	0	111.4	G330 F331 D332	E328-G330 PolarHBondContact O-N 2.86Å; E328-F331 PolarHBondContact O-N 2.81Å; E328-D332 WeakPolarHBondContact O-CB 3.49Å; E328-D332 PolarHBondContact O-N 3.13Å
329	R	94	Very high	95.8	Very high	166 Å²	166	63.8 Å²	63.8	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-57.3	-45.9	-178.6	-65.2	-177.8	-177.9	-177.9	-1.6	112.8	G327 N333	G327-R329 PolarHBondContact O-N 3.3Å; R329-N333 WeakPolarHBondContact O-CB 3.12Å; R329-N333 PolarHBondContact O-N 2.94Å; R329-N333 PolarHBondContact O-ND2 3.42Å
330	G	95.1	Very high	95.9	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-72.2	-37.7	-178.5	0	0	0	0	0	112	L326 G327 E328 N333 M334	L326-G330 WeakPolarHBondContact O-CA 3.31Å; L326-G330 PolarHBondContact O-N 3.42Å; G327-G330 PolarHBondContact O-N 3.02Å; E328-G330 PolarHBondContact O-N 2.86Å; G330-N333 PolarHBondContact O-N 3.08Å; G330-M334 VanDerWaalsContact O-CB 3.31Å; G330-M334 WeakPolarHBondContact O-CB 3.43Å; G330-M334 VanDerWaalsContact O-CG 3.31Å; G330-M334 WeakPolarHBondContact O-CG 3.31Å; G330-M334 PolarHBondContact O-N 3Å
331	F	96.2	Very high	96	Very high	61 Å²	61	62.2 Å²	62.2	27%	0.268	33%	0.325	S	S	.	.	H	α-helix	trans	-64.3	-50.6	177.9	-165.4	-86.3	0	0	0	110.7	Q323 G327 E328 N333 M334 D335 F337	Q323-F331 HydrophobicContact CB-CD2 4.42Å; G327-F331 VanDerWaalsContact O-CB 3.23Å; G327-F331 WeakPolarHBondContact O-CB 3.41Å; G327-F331 PolarHBondContact O-N 3.38Å; E328-F331 PolarHBondContact O-N 2.81Å; F331-N333 VanDerWaalsContact C-N 3.27Å; F331-N333 PolarHBondContact O-N 3.4Å; F331-M334 CarbonylContact O-C 3.48Å; F331-M334 PolarHBondContact O-N 2.72Å; F331-D335 HydrophobicContact CE1-CB 4.5Å; F331-D335 WeakPolarHBondContact O-CB 3.48Å; F331-D335 PolarHBondContact O-N 3.22Å; F331-F337 HydrophobicContact CD2-CE1 4.06Å; F331-F337 HydrophobicContact CD2-CZ 4.28Å; F331-F337 AromaticContact CE2-CE1 3.79Å; F331-F337 HydrophobicContact CE2-CE1 3.79Å; F331-F337 AromaticContact CE2-CZ 3.85Å; F331-F337 HydrophobicContact CE2-CZ 3.85Å; F331-F337 HydrophobicContact CZ-CE1 4.24Å
332	D	95.6	Very high	96.1	Very high	117 Å²	117	59 Å²	59	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-60.4	-35.1	179.3	-64.8	-14	0	0	0	112.8	E328	E328-D332 WeakPolarHBondContact O-CB 3.49Å; E328-D332 PolarHBondContact O-N 3.13Å
333	N	94.8	Very high	96.2	Very high	75 Å²	75	61.6 Å²	61.6	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-76.7	-29.1	177.8	-82.7	-89.5	0	0	0	112.8	R118 W266 R329 G330 F331	R118-N333 PolarHBondContact NH1-O 3.36Å; W266-N333 HydrophobicContact CZ2-CB 3.97Å; R329-N333 WeakPolarHBondContact O-CB 3.12Å; R329-N333 PolarHBondContact O-N 2.94Å; R329-N333 PolarHBondContact O-ND2 3.42Å; G330-N333 PolarHBondContact O-N 3.08Å; F331-N333 VanDerWaalsContact C-N 3.27Å; F331-N333 PolarHBondContact O-N 3.4Å
334	M	95	Very high	96.3	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-91.9	-16.6	-179.1	-73.2	-66.4	-71.7	0	0	113.2	R118 V120 W266 M294 T305 L326 G330 F331 P336 F337	R118-M334 PolarHBondContact NE-O 2.66Å; R118-M334 VanDerWaalsContact NE-O 3.14Å; R118-M334 PolarHBondContact NH1-O 2.7Å; R118-M334 PolarHBondContact NH2-O 3.37Å; V120-M334 HydrophobicContact CG2-CE 3.91Å; W266-M334 HydrophobicContact CH2-CG 3.52Å; W266-M334 HydrophobicContact CH2-SD 3.5Å; W266-M334 VanDerWaalsContact CH2-SD 3.5Å; W266-M334 HydrophobicContact CZ2-CG 4.26Å; W266-M334 HydrophobicContact CZ2-SD 4.37Å; W266-M334 HydrophobicContact CZ3-CG 3.74Å; W266-M334 HydrophobicContact CZ3-SD 4.12Å; M294-M334 HydrophobicContact CB-SD 3.98Å; T305-M334 HydrophobicContact CG2-CE 4.47Å; L326-M334 HydrophobicContact CD1-CB 4.5Å; G330-M334 VanDerWaalsContact O-CB 3.31Å; G330-M334 WeakPolarHBondContact O-CB 3.43Å; G330-M334 VanDerWaalsContact O-CG 3.31Å; G330-M334 WeakPolarHBondContact O-CG 3.31Å; G330-M334 PolarHBondContact O-N 3Å; F331-M334 CarbonylContact O-C 3.48Å; F331-M334 PolarHBondContact O-N 2.72Å; M334-P336 CarbonylContact O-C 3.46Å; M334-P336 VanDerWaalsContact O-O 3.11Å; M334-F337 HydrophobicContact CB-CD1 4Å; M334-F337 HydrophobicContact CB-CE1 4.43Å; M334-F337 WeakPolarHBondContact O-CB 3.39Å; M334-F337 WeakPolarHBondContact O-CD1 3.39Å
335	D	93.1	Very high	96.4	Very high	91 Å²	91	55 Å²	55	49%	0.487	29%	0.292	S	S	.	.			trans	-73.1	134.1	178.4	-168.5	41.7	0	0	0	111.3	R118 F331	R118-D335 PolarHBondContact NH2-O 3.43Å; F331-D335 HydrophobicContact CE1-CB 4.5Å; F331-D335 WeakPolarHBondContact O-CB 3.48Å; F331-D335 PolarHBondContact O-N 3.22Å
336	P	95.4	Very high	96.5	Very high	90 Å²	90	57.4 Å²	57.4	58%	0.584	31%	0.31	S	S	*	.	S	Bend	cis	-76.2	143.4	-9.6	32.5	-35.3	0	0	0	113.9	R118 M334	R118-P336 PolarHBondContact NE-O 3.37Å; R118-P336 VanDerWaalsContact NH2-N 3.11Å; R118-P336 PolarHBondContact NH2-O 2.87Å; M334-P336 CarbonylContact O-C 3.46Å; M334-P336 VanDerWaalsContact O-O 3.11Å
337	F	97	Very high	96.5	Very high	32 Å²	32	65 Å²	65	14%	0.14	35%	0.345	C	S	.	.			trans	-140.7	161.5	170.5	66.9	-88.5	0	0	0	111.7	R118 V120 P322 F331 M334 P339	R118-F337 HydrophobicContact CB-CB 3.9Å; R118-F337 CarbonylContact O-C 3.23Å; R118-F337 WeakPolarHBondContact O-CA 3.33Å; V120-F337 HydrophobicContact CB-CD2 3.64Å; V120-F337 HydrophobicContact CB-CE2 3.86Å; V120-F337 HydrophobicContact CG1-CE2 4.34Å; V120-F337 HydrophobicContact CG2-CB 3.99Å; V120-F337 HydrophobicContact CG2-CD2 3.27Å; V120-F337 HydrophobicContact CG2-CE2 3.82Å; V120-F337 HydrophobicContact CG2-CG 3.73Å; P322-F337 HydrophobicContact CB-CE2 4.25Å; P322-F337 HydrophobicContact CB-CZ 3.82Å; P322-F337 HydrophobicContact CG-CE2 4.42Å; P322-F337 HydrophobicContact CG-CZ 4.42Å; F331-F337 HydrophobicContact CD2-CE1 4.06Å; F331-F337 HydrophobicContact CD2-CZ 4.28Å; F331-F337 AromaticContact CE2-CE1 3.79Å; F331-F337 HydrophobicContact CE2-CE1 3.79Å; F331-F337 AromaticContact CE2-CZ 3.85Å; F331-F337 HydrophobicContact CE2-CZ 3.85Å; F331-F337 HydrophobicContact CZ-CE1 4.24Å; M334-F337 HydrophobicContact CB-CD1 4Å; M334-F337 HydrophobicContact CB-CE1 4.43Å; M334-F337 WeakPolarHBondContact O-CB 3.39Å; M334-F337 WeakPolarHBondContact O-CD1 3.39Å; F337-P339 HydrophobicContact CD2-CB 4.36Å; F337-P339 HydrophobicContact CE2-CB 3.91Å; F337-P339 VanDerWaalsContact O-CD 3.26Å; F337-P339 WeakPolarHBondContact O-CD 3.32Å
338	I	98.1	Very high	96.6	Very high	54 Å²	54	68.6 Å²	68.6	28%	0.277	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	105.5	176.7	-60.1	167.6	0	0	0	108.3	Y106 R118 Y119 V120 V340	Y106-I338 HydrophobicContact CD2-CG2 4.5Å; Y106-I338 HydrophobicContact CE2-CG2 4.15Å; R118-I338 PolarHBondContact O-N 3.01Å; Y119-I338 HydrophobicContact CD1-CB 3.95Å; Y119-I338 HydrophobicContact CD1-CD1 3.94Å; Y119-I338 HydrophobicContact CD1-CG2 4.16Å; Y119-I338 HydrophobicContact CE1-CB 4.38Å; Y119-I338 HydrophobicContact CE1-CD1 3.48Å; Y119-I338 VanDerWaalsContact CE1-CD1 3.48Å; Y119-I338 HydrophobicContact CE1-CG1 4.5Å; V120-I338 PolarHBondContact N-O 3.25Å; I338-V340 HydrophobicContact CG2-CG2 4.23Å
339	P	97.9	Very high	96.7	Very high	68 Å²	68	61.3 Å²	61.3	44%	0.442	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127	176.3	30.2	-33.5	0	0	0	110.4	Y122 F337	Y122-P339 HydrophobicContact CD1-CB 4.13Å; Y122-P339 HydrophobicContact CE1-CB 3.78Å; F337-P339 HydrophobicContact CD2-CB 4.36Å; F337-P339 HydrophobicContact CE2-CB 3.91Å; F337-P339 VanDerWaalsContact O-CD 3.26Å; F337-P339 WeakPolarHBondContact O-CD 3.32Å
340	V	98.5	Very high	96.9	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	112.4	178.2	-175.6	0	0	0	0	109.5	P99 V103 V120 F121 Y122 I338	P99-V340 HydrophobicContact CB-CG1 3.94Å; V103-V340 HydrophobicContact CG2-CB 4.36Å; V103-V340 HydrophobicContact CG2-CG1 4.2Å; V103-V340 HydrophobicContact CG2-CG2 3.73Å; V120-V340 PolarHBondContact O-N 2.9Å; F121-V340 WeakPolarHBondContact CA-O 3.37Å; F121-V340 HydrophobicContact CD1-CB 3.87Å; F121-V340 HydrophobicContact CD1-CG1 3.79Å; F121-V340 HydrophobicContact CE1-CB 4.15Å; F121-V340 HydrophobicContact CE1-CG1 3.76Å; Y122-V340 WeakPolarHBondContact CD1-O 3.5Å; Y122-V340 PolarHBondContact N-O 3.13Å; I338-V340 HydrophobicContact CG2-CG2 4.23Å
341	S	98.4	Very high	97	Very high	58 Å²	58	56.5 Å²	56.5	41%	0.406	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.1	-178.9	-174.7	0	0	0	0	110.9	P99 P343	P99-S341 WeakPolarHBondContact CG-O 3.36Å; S341-P343 WeakPolarHBondContact O-CD 3.5Å
342	V	98.6	Very high	97	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	29%	0.293	C	S	.	.			trans	-112.3	95.4	176	-173.9	0	0	0	0	109.1	P99 F121 Y122 T127 K129	P99-V342 HydrophobicContact CB-CG2 3.94Å; P99-V342 HydrophobicContact CG-CB 4.45Å; P99-V342 HydrophobicContact CG-CG1 4.37Å; P99-V342 HydrophobicContact CG-CG2 4.24Å; F121-V342 HydrophobicContact CB-CG2 4.05Å; F121-V342 HydrophobicContact CD1-CG2 3.66Å; F121-V342 HydrophobicContact CG-CG2 4.27Å; Y122-V342 PolarHBondContact O-N 3.05Å; T127-V342 WeakPolarHBondContact CB-O 3.22Å; T127-V342 WeakPolarHBondContact CG2-O 3.34Å; T127-V342 WeakPolarHBondContact O-CG1 3.48Å; T127-V342 PolarHBondContact OG1-O 3.45Å; K129-V342 HydrophobicContact CG-CB 3.8Å; K129-V342 HydrophobicContact CG-CG1 4.21Å; K129-V342 HydrophobicContact CG-CG2 3.85Å
343	P	98.1	Very high	97.1	Very high	70 Å²	70	48.4 Å²	48.4	46%	0.455	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-77.4	173.6	-178.5	32.7	-36	0	0	0	112.4	R97 S341	R97-P343 PolarHBondContact NH1-O 2.9Å; R97-P343 PolarHBondContact NH2-O 3.25Å; R97-P343 VanDerWaalsContact NH2-O 3.09Å; S341-P343 WeakPolarHBondContact O-CD 3.5Å
344	N	98.4	Very high	97.2	Very high	38 Å²	38	45.3 Å²	45.3	20%	0.203	25%	0.247	C	C	.	.	S	Bend	trans	-57.3	171.9	162.3	-75.4	-12	0	0	0	110.7	R97 T127 N382 M383 N384	R97-N344 PolarHBondContact NH2-O 2.86Å; T127-N344 WeakPolarHBondContact CG2-OD1 3.42Å; N344-N382 PolarHBondContact ND2-O 3.35Å; N344-M383 HydrophobicContact CB-CB 4.19Å; N344-M383 WeakPolarHBondContact CB-O 3.48Å; N344-N384 PolarHBondContact OD1-ND2 2.63Å; N344-N384 VanDerWaalsContact OD1-ND2 3.08Å
345	Y	98.4	Very high	97.3	Very high	36 Å²	36	48.2 Å²	48.2	14%	0.141	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-62.6	141	177.9	-68.2	-33.7	0	0	0	112.1	M95 E349 F350 C353 M383 P385	M95-Y345 HydrophobicContact CE-CD1 3.61Å; M95-Y345 HydrophobicContact CE-CE1 3.07Å; Y345-E349 WeakPolarHBondContact CA-OE2 3.48Å; Y345-E349 HydrophobicContact CD1-CB 3.91Å; Y345-E349 HydrophobicContact CG-CB 4.08Å; Y345-F350 HydrophobicContact CD2-CD2 4.42Å; Y345-C353 HydrophobicContact CE2-CB 4.2Å; Y345-M383 PolarHBondContact N-O 3.27Å; Y345-M383 WeakPolarHBondContact O-CB 3.34Å; Y345-P385 HydrophobicContact CD1-CG 3.77Å; Y345-P385 HydrophobicContact CD2-CB 4.46Å; Y345-P385 HydrophobicContact CD2-CG 4.12Å; Y345-P385 HydrophobicContact CE1-CB 3.88Å; Y345-P385 HydrophobicContact CE1-CG 3.42Å; Y345-P385 VanDerWaalsContact CE1-CG 3.42Å; Y345-P385 HydrophobicContact CE2-CB 3.78Å; Y345-P385 HydrophobicContact CE2-CG 3.86Å; Y345-P385 HydrophobicContact CG-CG 4.1Å; Y345-P385 VanDerWaalsContact CZ-CB 3.46Å
346	S	97.8	Very high	97.4	Very high	55 Å²	55	44 Å²	44	39%	0.385	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-69.1	166.1	158.2	66.1	0	0	0	0	110.5	K348 E349 F350	S346-K348 VanDerWaalsContact C-N 3.26Å; S346-K348 PolarHBondContact O-N 2.95Å; S346-E349 PolarHBondContact N-OE2 2.93Å; S346-E349 PolarHBondContact O-N 3.15Å; S346-E349 WeakPolarHBondContact OG-CG 3.32Å; S346-E349 PolarHBondContact OG-N 3.32Å; S346-F350 WeakPolarHBondContact O-CB 3.37Å; S346-F350 PolarHBondContact O-N 3.5Å
347	E	96.5	Very high	97.4	Very high	163 Å²	163	40.2 Å²	40.2	76%	0.762	21%	0.213	S	C	*	.	H	α-helix	trans	-56	-42	176.1	-63.9	-178.6	175.7	0	0	112	F350 E351 M383	E347-F350 PolarHBondContact O-N 3.03Å; E347-E351 WeakPolarHBondContact O-CB 3.3Å; E347-E351 PolarHBondContact O-N 3.39Å; E347-M383 HydrophobicContact CG-CE 4.35Å
348	K	96	Very high	97.3	Very high	103 Å²	103	41.1 Å²	41.1	45%	0.448	22%	0.218	S	C	.	.	H	α-helix	trans	-63.9	-44.6	177.2	-173.5	-171.9	-178.9	-163.2	0	112.6	V59 S346 E351 S352	V59-K348 WeakPolarHBondContact O-CE 3.46Å; V59-K348 PolarHBondContact O-NZ 3.05Å; S346-K348 VanDerWaalsContact C-N 3.26Å; S346-K348 PolarHBondContact O-N 2.95Å; K348-E351 PolarHBondContact O-N 2.88Å; K348-S352 WeakPolarHBondContact O-CB 3.45Å; K348-S352 PolarHBondContact O-N 3.21Å; K348-S352 PolarHBondContact O-OG 3.47Å
349	E	97.9	Very high	97.1	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-42.6	177.9	-74.4	176.6	143.7	0	0	111.1	M95 R97 Y345 S346 S352 C353	M95-E349 HydrophobicContact CE-CB 3.86Å; M95-E349 HydrophobicContact CE-CG 4.05Å; M95-E349 HydrophobicContact SD-CB 4.09Å; M95-E349 HydrophobicContact SD-CG 4.27Å; R97-E349 WeakPolarHBondContact CG-OE1 3.42Å; R97-E349 IonicContact CZ-OE1 3.37Å; R97-E349 IonicContact CZ-OE2 3.83Å; R97-E349 IonicContact NE-OE1 2.88Å; R97-E349 PolarHBondContact NE-OE1 3.43Å; R97-E349 IonicContact NE-OE2 2.93Å; R97-E349 PolarHBondContact NE-OE2 3.48Å; R97-E349 IonicContact NH2-OE1 2.84Å; R97-E349 PolarHBondContact NH2-OE1 2.9Å; R97-E349 IonicContact NH2-OE2 2.73Å; R97-E349 PolarHBondContact NH2-OE2 3.44Å; Y345-E349 WeakPolarHBondContact CA-OE2 3.48Å; Y345-E349 HydrophobicContact CD1-CB 3.91Å; Y345-E349 HydrophobicContact CG-CB 4.08Å; S346-E349 PolarHBondContact N-OE2 2.93Å; S346-E349 PolarHBondContact O-N 3.15Å; S346-E349 WeakPolarHBondContact OG-CG 3.32Å; S346-E349 PolarHBondContact OG-N 3.32Å; E349-S352 PolarHBondContact O-N 3.38Å; E349-C353 WeakPolarHBondContact O-CB 3.46Å; E349-C353 PolarHBondContact O-N 3.23Å
350	F	97.9	Very high	96.9	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-46.6	176.2	-178.1	-87.9	0	0	0	111.1	Y345 S346 E347 S352 C353 Y354 K374 L377 I378 M383 F388	Y345-F350 HydrophobicContact CD2-CD2 4.42Å; S346-F350 WeakPolarHBondContact O-CB 3.37Å; S346-F350 PolarHBondContact O-N 3.5Å; E347-F350 PolarHBondContact O-N 3.03Å; F350-S352 VanDerWaalsContact C-N 3.29Å; F350-S352 PolarHBondContact O-N 3.48Å; F350-C353 PolarHBondContact O-N 3.01Å; F350-Y354 WeakPolarHBondContact O-CB 3.47Å; F350-Y354 PolarHBondContact O-N 3.24Å; F350-K374 HydrophobicContact CE1-CG 4.25Å; F350-L377 HydrophobicContact CZ-CB 4.47Å; F350-I378 HydrophobicContact CD1-CD1 4.01Å; F350-I378 HydrophobicContact CD1-CG1 3.76Å; F350-I378 HydrophobicContact CE1-CD1 3.69Å; F350-I378 HydrophobicContact CE1-CG1 3.21Å; F350-I378 HydrophobicContact CE2-CG1 4.06Å; F350-I378 HydrophobicContact CG-CG1 4.39Å; F350-I378 HydrophobicContact CZ-CB 4.46Å; F350-I378 HydrophobicContact CZ-CD1 4.35Å; F350-I378 HydrophobicContact CZ-CG1 3.39Å; F350-M383 HydrophobicContact CB-CE 4.22Å; F350-M383 HydrophobicContact CB-SD 3.56Å; F350-M383 VanDerWaalsContact CB-SD 3.56Å; F350-M383 HydrophobicContact CD1-CE 4.45Å; F350-M383 HydrophobicContact CD1-SD 4.08Å; F350-M383 HydrophobicContact CD2-SD 3.38Å; F350-M383 WeakPolarHBondContact CD2-SD 3.46Å; F350-M383 HydrophobicContact CE2-SD 4.09Å; F350-M383 HydrophobicContact CG-CE 4.19Å; F350-M383 HydrophobicContact CG-SD 3.37Å; F350-M383 WeakPolarHBondContact CG-SD 3.41Å; F350-F388 HydrophobicContact CE2-CD1 4.29Å; F350-F388 AromaticContact CE2-CD2 3.51Å; F350-F388 HydrophobicContact CE2-CD2 3.51Å; F350-F388 HydrophobicContact CE2-CE1 4.37Å; F350-F388 AromaticContact CE2-CE2 3.6Å; F350-F388 HydrophobicContact CE2-CE2 3.6Å; F350-F388 AromaticContact CE2-CG 3.88Å; F350-F388 HydrophobicContact CE2-CG 3.88Å; F350-F388 HydrophobicContact CE2-CZ 4.05Å; F350-F388 AromaticContact CZ-CD2 3.9Å; F350-F388 HydrophobicContact CZ-CD2 3.9Å; F350-F388 AromaticContact CZ-CE2 3.53Å; F350-F388 HydrophobicContact CZ-CE2 3.53Å; F350-F388 AromaticContact CZ-CZ 3.99Å; F350-F388 HydrophobicContact CZ-CZ 3.99Å
351	E	96.9	Very high	96.7	Very high	63 Å²	63	47.2 Å²	47.2	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-54.8	-49.5	177.5	-168.3	62.1	-154.5	0	0	111.4	E347 K348 C353 Y354 L355 K374	E347-E351 WeakPolarHBondContact O-CB 3.3Å; E347-E351 PolarHBondContact O-N 3.39Å; K348-E351 PolarHBondContact O-N 2.88Å; E351-C353 VanDerWaalsContact C-N 3.32Å; E351-C353 PolarHBondContact O-N 3.48Å; E351-Y354 PolarHBondContact O-N 3.44Å; E351-L355 HydrophobicContact CG-CD1 4.07Å; E351-L355 HydrophobicContact CG-CG 4.45Å; E351-L355 WeakPolarHBondContact O-CB 3.42Å; E351-L355 VanDerWaalsContact O-CG 3.31Å; E351-L355 WeakPolarHBondContact O-CG 3.38Å; E351-L355 PolarHBondContact O-N 3.04Å; E351-K374 IonicContact OE1-NZ 3.48Å; E351-K374 PolarHBondContact OE1-NZ 3.33Å; E351-K374 WeakPolarHBondContact OE2-CE 3.34Å; E351-K374 IonicContact OE2-NZ 3.47Å; E351-K374 PolarHBondContact OE2-NZ 2.96Å
352	S	97	Very high	96.6	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-39.7	-177.2	-55.5	0	0	0	0	111.1	F44 G60 K348 E349 F350 L355 Y356	F44-S352 WeakPolarHBondContact CB-O 3.49Å; G60-S352 WeakPolarHBondContact O-CB 3.33Å; G60-S352 PolarHBondContact O-OG 3.24Å; K348-S352 WeakPolarHBondContact O-CB 3.45Å; K348-S352 PolarHBondContact O-N 3.21Å; K348-S352 PolarHBondContact O-OG 3.47Å; E349-S352 PolarHBondContact O-N 3.38Å; F350-S352 VanDerWaalsContact C-N 3.29Å; F350-S352 PolarHBondContact O-N 3.48Å; S352-L355 PolarHBondContact O-N 2.98Å; S352-Y356 VanDerWaalsContact O-CB 3.32Å; S352-Y356 WeakPolarHBondContact O-CB 3.42Å; S352-Y356 PolarHBondContact O-N 2.91Å
353	C	97.3	Very high	96.4	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-39.9	175.7	-169.8	0	0	0	0	112.5	F62 Y345 E349 F350 E351 Y356 Y357 F388	F62-C353 HydrophobicContact CE2-CB 4.34Å; F62-C353 HydrophobicContact CZ-CB 4.19Å; Y345-C353 HydrophobicContact CE2-CB 4.2Å; E349-C353 WeakPolarHBondContact O-CB 3.46Å; E349-C353 PolarHBondContact O-N 3.23Å; F350-C353 PolarHBondContact O-N 3.01Å; E351-C353 VanDerWaalsContact C-N 3.32Å; E351-C353 PolarHBondContact O-N 3.48Å; C353-Y356 PolarHBondContact O-N 2.95Å; C353-Y357 PolarHBondContact O-N 3.22Å; C353-F388 HydrophobicContact CB-CE1 4.26Å
354	Y	96.9	Very high	96.2	Very high	11 Å²	11	50.1 Å²	50.1	4%	0.043	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-47.8	174.2	175.6	-97.6	0	0	0	111.5	F350 E351 Y356 Y357 M358 L363 S368 R369 K374 L377 F388	F350-Y354 WeakPolarHBondContact O-CB 3.47Å; F350-Y354 PolarHBondContact O-N 3.24Å; E351-Y354 PolarHBondContact O-N 3.44Å; Y354-Y356 VanDerWaalsContact C-N 3.32Å; Y354-Y356 PolarHBondContact O-N 3.47Å; Y354-Y357 PolarHBondContact O-N 2.88Å; Y354-Y357 VanDerWaalsContact O-N 3.15Å; Y354-M358 HydrophobicContact CD1-CG 4.24Å; Y354-M358 HydrophobicContact CE1-CE 4.48Å; Y354-M358 HydrophobicContact CE1-CG 3.86Å; Y354-M358 HydrophobicContact CE1-SD 4.49Å; Y354-M358 HydrophobicContact CE2-CG 4.48Å; Y354-M358 WeakPolarHBondContact O-CG 3.32Å; Y354-M358 PolarHBondContact O-N 3.12Å; Y354-L363 HydrophobicContact CD2-CD1 3.81Å; Y354-L363 HydrophobicContact CE2-CD1 3.46Å; Y354-L363 VanDerWaalsContact CE2-CD1 3.46Å; Y354-S368 WeakPolarHBondContact CE2-O 3.49Å; Y354-S368 PolarHBondContact OH-O 3.17Å; Y354-R369 WeakPolarHBondContact OH-CA 3.4Å; Y354-K374 HydrophobicContact CD1-CD 4.09Å; Y354-K374 HydrophobicContact CD2-CG 4.46Å; Y354-K374 HydrophobicContact CE1-CD 3.97Å; Y354-K374 HydrophobicContact CE2-CB 4.32Å; Y354-K374 HydrophobicContact CE2-CG 4.34Å; Y354-K374 HydrophobicContact CG-CD 4.49Å; Y354-L377 HydrophobicContact CE2-CD1 4.21Å; Y354-F388 HydrophobicContact CD2-CZ 4.18Å
355	L	96.2	Very high	96.1	Very high	60 Å²	60	52 Å²	52	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-38.3	176.8	-68.4	175.5	0	0	0	112.2	F44 E351 S352 Y357 M358 D359	F44-L355 HydrophobicContact CB-CB 4.26Å; F44-L355 HydrophobicContact CD1-CB 3.55Å; F44-L355 HydrophobicContact CD1-CD1 4.47Å; F44-L355 HydrophobicContact CE1-CB 4.2Å; F44-L355 HydrophobicContact CG-CB 4.08Å; E351-L355 HydrophobicContact CG-CD1 4.07Å; E351-L355 HydrophobicContact CG-CG 4.45Å; E351-L355 WeakPolarHBondContact O-CB 3.42Å; E351-L355 VanDerWaalsContact O-CG 3.31Å; E351-L355 WeakPolarHBondContact O-CG 3.38Å; E351-L355 PolarHBondContact O-N 3.04Å; S352-L355 PolarHBondContact O-N 2.98Å; L355-Y357 VanDerWaalsContact C-N 3.34Å; L355-Y357 PolarHBondContact O-N 2.83Å; L355-M358 WeakPolarHBondContact O-CB 3.38Å; L355-M358 PolarHBondContact O-N 2.97Å; L355-D359 WeakPolarHBondContact O-CB 3.37Å; L355-D359 PolarHBondContact O-N 3.22Å
356	Y	95.9	Very high	95.9	Very high	4 Å²	4	55 Å²	55	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-43.7	172.5	177	-110.5	0	0	0	111.7	F44 F62 F89 E91 C93 S352 C353 Y354 M358 D359 R360	F44-Y356 AromaticContact CD2-CD2 3.97Å; F44-Y356 HydrophobicContact CD2-CD2 3.97Å; F44-Y356 HydrophobicContact CD2-CG 4.35Å; F44-Y356 AromaticContact CE2-CD2 3.75Å; F44-Y356 HydrophobicContact CE2-CD2 3.75Å; F44-Y356 HydrophobicContact CE2-CG 4.41Å; F62-Y356 HydrophobicContact CD2-CD2 4.44Å; F62-Y356 HydrophobicContact CD2-CG 4.23Å; F62-Y356 HydrophobicContact CE1-CD1 4.28Å; F62-Y356 HydrophobicContact CE1-CE1 4.46Å; F62-Y356 HydrophobicContact CE2-CD1 4.42Å; F62-Y356 HydrophobicContact CE2-CG 4.15Å; F62-Y356 HydrophobicContact CG-CD2 4.46Å; F62-Y356 HydrophobicContact CZ-CD1 4.16Å; F62-Y356 HydrophobicContact CZ-CG 4.35Å; F89-Y356 AromaticContact CD2-CE1 3.9Å; F89-Y356 HydrophobicContact CD2-CE1 3.9Å; F89-Y356 AromaticContact CD2-CZ 3.96Å; F89-Y356 HydrophobicContact CE2-CD1 4.47Å; F89-Y356 AromaticContact CE2-CE1 3.7Å; F89-Y356 HydrophobicContact CE2-CE1 3.7Å; E91-Y356 VanDerWaalsContact OE1-CE2 3.29Å; E91-Y356 WeakPolarHBondContact OE1-CE2 3.29Å; E91-Y356 PolarHBondContact OE1-OH 3.38Å; E91-Y356 VanDerWaalsContact OE1-OH 3.08Å; C93-Y356 HydrophobicContact CB-CE2 4.28Å; S352-Y356 VanDerWaalsContact O-CB 3.32Å; S352-Y356 WeakPolarHBondContact O-CB 3.42Å; S352-Y356 PolarHBondContact O-N 2.91Å; C353-Y356 PolarHBondContact O-N 2.95Å; Y354-Y356 VanDerWaalsContact C-N 3.32Å; Y354-Y356 PolarHBondContact O-N 3.47Å; Y356-M358 VanDerWaalsContact C-N 3.34Å; Y356-M358 PolarHBondContact O-N 3.15Å; Y356-D359 PolarHBondContact O-N 3Å; Y356-R360 HydrophobicContact CD2-CG 4.44Å; Y356-R360 HydrophobicContact CE2-CG 4.16Å; Y356-R360 VanDerWaalsContact O-CG 3.3Å; Y356-R360 WeakPolarHBondContact O-CG 3.01Å; Y356-R360 PolarHBondContact O-N 3.12Å
357	Y	95.9	Very high	95.7	Very high	9 Å²	9	58.4 Å²	58.4	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-68.6	-31.7	176	-69.6	-7.6	0	0	0	113.2	Q85 F89 C353 Y354 L355 N361 W362 F388 C392	Q85-Y357 PolarHBondContact NE2-OH 2.96Å; F89-Y357 HydrophobicContact CE2-CD1 4.14Å; F89-Y357 HydrophobicContact CE2-CE1 4.13Å; F89-Y357 HydrophobicContact CZ-CD1 4.23Å; F89-Y357 HydrophobicContact CZ-CE1 4.41Å; C353-Y357 PolarHBondContact O-N 3.22Å; Y354-Y357 PolarHBondContact O-N 2.88Å; Y354-Y357 VanDerWaalsContact O-N 3.15Å; L355-Y357 VanDerWaalsContact C-N 3.34Å; L355-Y357 PolarHBondContact O-N 2.83Å; Y357-N361 PolarHBondContact O-N 2.87Å; Y357-W362 HydrophobicContact CG-CB 4.49Å; Y357-W362 WeakPolarHBondContact O-CB 3.18Å; Y357-W362 PolarHBondContact O-N 3Å; Y357-F388 HydrophobicContact CD2-CD1 4.4Å; Y357-F388 AromaticContact CD2-CE1 3.63Å; Y357-F388 HydrophobicContact CD2-CE1 3.63Å; Y357-F388 HydrophobicContact CD2-CZ 4.01Å; Y357-F388 AromaticContact CE2-CD1 3.85Å; Y357-F388 HydrophobicContact CE2-CD1 3.85Å; Y357-F388 AromaticContact CE2-CE1 3.53Å; Y357-F388 HydrophobicContact CE2-CE1 3.53Å; Y357-F388 HydrophobicContact CE2-CZ 4.28Å; Y357-C392 HydrophobicContact CD2-CB 3.96Å; Y357-C392 HydrophobicContact CE2-CB 4.05Å
358	M	94.6	Very high	95.5	Very high	51 Å²	51	50.9 Å²	50.9	25%	0.251	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-47.2	173.1	-70	-74.1	-87.6	0	0	111.6	Y354 L355 Y356 R360 N361 L363 R369	Y354-M358 HydrophobicContact CD1-CG 4.24Å; Y354-M358 HydrophobicContact CE1-CE 4.48Å; Y354-M358 HydrophobicContact CE1-CG 3.86Å; Y354-M358 HydrophobicContact CE1-SD 4.49Å; Y354-M358 HydrophobicContact CE2-CG 4.48Å; Y354-M358 WeakPolarHBondContact O-CG 3.32Å; Y354-M358 PolarHBondContact O-N 3.12Å; L355-M358 WeakPolarHBondContact O-CB 3.38Å; L355-M358 PolarHBondContact O-N 2.97Å; Y356-M358 VanDerWaalsContact C-N 3.34Å; Y356-M358 PolarHBondContact O-N 3.15Å; M358-R360 VanDerWaalsContact C-N 3.29Å; M358-R360 PolarHBondContact O-N 2.65Å; M358-N361 WeakPolarHBondContact O-CA 3.42Å; M358-N361 PolarHBondContact O-N 3.08Å; M358-L363 HydrophobicContact CG-CD1 4.12Å; M358-L363 HydrophobicContact SD-CB 4.2Å; M358-L363 HydrophobicContact SD-CD1 3.88Å; M358-R369 HydrophobicContact CE-CB 3.67Å; M358-R369 HydrophobicContact CE-CG 3.76Å; M358-R369 HydrophobicContact SD-CB 4.23Å; M358-R369 HydrophobicContact SD-CG 3.72Å
359	D	94.2	Very high	95.3	Very high	80 Å²	80	50.9 Å²	50.9	43%	0.428	24%	0.244	S	C	.	.	H	α-helix	trans	-55.3	-44.3	174.8	174.3	65.8	0	0	0	111.8	F44 R45 L355 Y356 N361	F44-D359 HydrophobicContact CE1-CB 4.06Å; F44-D359 HydrophobicContact CE2-CB 4.14Å; F44-D359 HydrophobicContact CZ-CB 3.4Å; F44-D359 VanDerWaalsContact CZ-CB 3.4Å; R45-D359 IonicContact CZ-OD2 3.43Å; R45-D359 IonicContact NE-OD2 2.75Å; R45-D359 IonicContact NH2-OD2 3.22Å; R45-D359 PolarHBondContact NH2-OD2 3.21Å; R45-D359 VanDerWaalsContact NH2-OD2 3.08Å; L355-D359 WeakPolarHBondContact O-CB 3.37Å; L355-D359 PolarHBondContact O-N 3.22Å; Y356-D359 PolarHBondContact O-N 3Å; D359-N361 PolarHBondContact O-N 3.33Å; D359-N361 VanDerWaalsContact O-N 3.12Å
360	R	94	Very high	95.2	Very high	79 Å²	79	53.4 Å²	53.4	30%	0.298	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	2.1	177.6	-63	-45	-56.1	-145.7	7.2	114.6	F89 E91 Y356 M358 W362	F89-R360 HydrophobicContact CD1-CB 4.22Å; F89-R360 HydrophobicContact CD2-CB 4.41Å; F89-R360 HydrophobicContact CD2-CG 3.97Å; F89-R360 HydrophobicContact CE1-CB 4.05Å; F89-R360 HydrophobicContact CE2-CB 4.23Å; F89-R360 HydrophobicContact CE2-CG 4.09Å; F89-R360 HydrophobicContact CG-CB 4.42Å; F89-R360 HydrophobicContact CG-CG 4.2Å; F89-R360 HydrophobicContact CZ-CB 4.06Å; F89-R360 HydrophobicContact CZ-CG 4.42Å; F89-R360 PolarHBondContact O-NH1 2.52Å; F89-R360 PolarHBondContact O-NH2 2.73Å; E91-R360 WeakPolarHBondContact OE1-CD 3.23Å; E91-R360 IonicContact OE1-CZ 3.58Å; E91-R360 IonicContact OE1-NE 2.86Å; E91-R360 IonicContact OE1-NH1 2.52Å; E91-R360 PolarHBondContact OE1-NH1 3.42Å; E91-R360 IonicContact OE2-NH1 3.65Å; E91-R360 PolarHBondContact OE2-NH1 3.31Å; Y356-R360 HydrophobicContact CD2-CG 4.44Å; Y356-R360 HydrophobicContact CE2-CG 4.16Å; Y356-R360 VanDerWaalsContact O-CG 3.3Å; Y356-R360 WeakPolarHBondContact O-CG 3.01Å; Y356-R360 PolarHBondContact O-N 3.12Å; M358-R360 VanDerWaalsContact C-N 3.29Å; M358-R360 PolarHBondContact O-N 2.65Å; R360-W362 HydrophobicContact CB-CB 4.48Å; R360-W362 PolarHBondContact O-N 3.21Å; R360-W362 VanDerWaalsContact O-N 3.17Å
361	N	94.1	Very high	95.1	Very high	93 Å²	93	56.9 Å²	56.9	50%	0.497	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	39.5	-170	-69.8	-66.2	0	0	0	111	Y357 M358 D359 Q364 R369	Y357-N361 PolarHBondContact O-N 2.87Å; M358-N361 WeakPolarHBondContact O-CA 3.42Å; M358-N361 PolarHBondContact O-N 3.08Å; D359-N361 PolarHBondContact O-N 3.33Å; D359-N361 VanDerWaalsContact O-N 3.12Å; N361-Q364 PolarHBondContact O-NE2 3.24Å; N361-R369 PolarHBondContact OD1-NH2 2.85Å
362	W	95.6	Very high	95	Very high	69 Å²	69	60.9 Å²	60.9	26%	0.261	31%	0.307	S	S	.	.			trans	-79.8	-32.5	179.6	-171.4	-121.4	0	0	0	111.6	T88 F89 Y357 R360 Q364	T88-W362 HydrophobicContact CG2-CE3 4.34Å; T88-W362 HydrophobicContact CG2-CH2 4.09Å; T88-W362 HydrophobicContact CG2-CZ3 3.54Å; F89-W362 HydrophobicContact CE1-CB 3.94Å; F89-W362 AromaticContact CE1-CD2 3.58Å; F89-W362 HydrophobicContact CE1-CD2 3.58Å; F89-W362 AromaticContact CE1-CE3 3.5Å; F89-W362 HydrophobicContact CE1-CE3 3.5Å; F89-W362 VanDerWaalsContact CE1-CE3 3.5Å; F89-W362 AromaticContact CE1-CG 3.81Å; F89-W362 HydrophobicContact CE1-CG 3.81Å; F89-W362 HydrophobicContact CE1-CZ3 4.19Å; F89-W362 HydrophobicContact CZ-CB 3.77Å; F89-W362 AromaticContact CZ-CD2 3.76Å; F89-W362 HydrophobicContact CZ-CD2 3.76Å; F89-W362 HydrophobicContact CZ-CE3 4.18Å; F89-W362 AromaticContact CZ-CG 3.59Å; F89-W362 HydrophobicContact CZ-CG 3.59Å; Y357-W362 HydrophobicContact CG-CB 4.49Å; Y357-W362 WeakPolarHBondContact O-CB 3.18Å; Y357-W362 PolarHBondContact O-N 3Å; R360-W362 HydrophobicContact CB-CB 4.48Å; R360-W362 PolarHBondContact O-N 3.21Å; R360-W362 VanDerWaalsContact O-N 3.17Å; W362-Q364 PolarHBondContact O-N 3.18Å
363	L	95.1	Very high	94.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.308	C	S	.	.			trans	-86.7	101.3	176.1	-58.6	-176	0	0	0	109.9	Y354 M358 S368 R369 C392	Y354-L363 HydrophobicContact CD2-CD1 3.81Å; Y354-L363 HydrophobicContact CE2-CD1 3.46Å; Y354-L363 VanDerWaalsContact CE2-CD1 3.46Å; M358-L363 HydrophobicContact CG-CD1 4.12Å; M358-L363 HydrophobicContact SD-CB 4.2Å; M358-L363 HydrophobicContact SD-CD1 3.88Å; L363-S368 WeakPolarHBondContact CB-OG 3.32Å; L363-R369 VanDerWaalsContact O-CZ 3.3Å; L363-R369 PolarHBondContact O-NE 2.94Å; L363-R369 PolarHBondContact O-NH2 3.08Å; L363-C392 HydrophobicContact CD2-CB 3.63Å
364	Q	94.6	Very high	94.9	Very high	120 Å²	120	62.8 Å²	62.8	56%	0.561	32%	0.316	S	S	*	.			trans	-91.5	-33	-176	-68.9	-66.8	-39.1	0	0	112.7	N361 W362 L395	N361-Q364 PolarHBondContact O-NE2 3.24Å; W362-Q364 PolarHBondContact O-N 3.18Å; Q364-L395 PolarHBondContact N-O 3.32Å
365	H	95.6	Very high	94.9	Very high	79 Å²	79	69.5 Å²	69.5	37%	0.366	35%	0.345	S	S	.	.	S	Bend	trans	-61.6	126.7	179.3	-163.7	-96.8	0	0	0	112.2	Q367 S368 L395	H365-Q367 VanDerWaalsContact C-N 3.3Å; H365-Q367 PolarHBondContact CE1-OE1 3.44Å; H365-Q367 VanDerWaalsContact CE1-OE1 3.28Å; H365-Q367 WeakPolarHBondContact ND1-CB 3.48Å; H365-Q367 PolarHBondContact ND1-N 2.87Å; H365-Q367 PolarHBondContact O-N 3.02Å; H365-S368 WeakPolarHBondContact O-CB 3.35Å; H365-S368 PolarHBondContact O-N 2.95Å; H365-S368 PolarHBondContact O-OG 3.38Å; H365-L395 WeakPolarHBondContact CA-OXT 3.42Å; H365-L395 HydrophobicContact CB-CB 4.4Å; H365-L395 WeakPolarHBondContact CB-OXT 3.42Å; H365-L395 PolarHBondContact N-OXT 3.06Å
366	P	93.3	Very high	94.9	Very high	97 Å²	97	72.3 Å²	72.3	63%	0.63	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-57.3	-38.7	-176.8	-27.8	35.2	0	0	0	114.1	S368 R369	P366-S368 VanDerWaalsContact C-N 3.27Å; P366-S368 PolarHBondContact O-N 3.44Å; P366-R369 WeakPolarHBondContact O-CB 3.16Å; P366-R369 PolarHBondContact O-N 3.12Å
367	Q	93.9	Very high	95	Very high	128 Å²	128	72.7 Å²	72.7	60%	0.598	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-68.4	-26.6	179.2	-62.1	179.3	-38.8	0	0	112.6	H365 R369 T370 G373	H365-Q367 VanDerWaalsContact C-N 3.3Å; H365-Q367 PolarHBondContact CE1-OE1 3.44Å; H365-Q367 VanDerWaalsContact CE1-OE1 3.28Å; H365-Q367 WeakPolarHBondContact ND1-CB 3.48Å; H365-Q367 PolarHBondContact ND1-N 2.87Å; H365-Q367 PolarHBondContact O-N 3.02Å; Q367-R369 PolarHBondContact O-N 3.46Å; Q367-R369 VanDerWaalsContact O-N 3.16Å; Q367-T370 PolarHBondContact O-N 2.78Å; Q367-T370 VanDerWaalsContact O-N 3.16Å; Q367-T370 PolarHBondContact O-OG1 2.97Å; Q367-G373 WeakPolarHBondContact O-CA 3.27Å
368	S	92.1	Very high	95	Very high	5 Å²	5	74.6 Å²	74.6	4%	0.035	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-67	-17.1	177.7	71.8	0	0	0	0	112.7	Y354 L363 H365 P366	Y354-S368 WeakPolarHBondContact CE2-O 3.49Å; Y354-S368 PolarHBondContact OH-O 3.17Å; L363-S368 WeakPolarHBondContact CB-OG 3.32Å; H365-S368 WeakPolarHBondContact O-CB 3.35Å; H365-S368 PolarHBondContact O-N 2.95Å; H365-S368 PolarHBondContact O-OG 3.38Å; P366-S368 VanDerWaalsContact C-N 3.27Å; P366-S368 PolarHBondContact O-N 3.44Å
369	R	93.2	Very high	95.1	Very high	103 Å²	103	80.5 Å²	80.5	39%	0.389	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-90.8	-5.2	179.1	-56.3	-167.1	174.3	-166.2	-6.5	113.5	Y354 M358 N361 L363 P366 Q367	Y354-R369 WeakPolarHBondContact OH-CA 3.4Å; M358-R369 HydrophobicContact CE-CB 3.67Å; M358-R369 HydrophobicContact CE-CG 3.76Å; M358-R369 HydrophobicContact SD-CB 4.23Å; M358-R369 HydrophobicContact SD-CG 3.72Å; N361-R369 PolarHBondContact OD1-NH2 2.85Å; L363-R369 VanDerWaalsContact O-CZ 3.3Å; L363-R369 PolarHBondContact O-NE 2.94Å; L363-R369 PolarHBondContact O-NH2 3.08Å; P366-R369 WeakPolarHBondContact O-CB 3.16Å; P366-R369 PolarHBondContact O-N 3.12Å; Q367-R369 PolarHBondContact O-N 3.46Å; Q367-R369 VanDerWaalsContact O-N 3.16Å
370	T	95.4	Very high	95.3	Very high	62 Å²	62	81.8 Å²	81.8	38%	0.38	40%	0.4	S	S	.	.	S	Bend	trans	-93.2	160.1	-179.3	73.7	0	0	0	0	111.5	Q367 E372 G373 K374	Q367-T370 PolarHBondContact O-N 2.78Å; Q367-T370 VanDerWaalsContact O-N 3.16Å; Q367-T370 PolarHBondContact O-OG1 2.97Å; T370-E372 PolarHBondContact O-N 3.39Å; T370-G373 PolarHBondContact O-N 3.43Å; T370-G373 PolarHBondContact OG1-N 3.49Å; T370-G373 VanDerWaalsContact OG1-N 3.14Å; T370-K374 WeakPolarHBondContact O-CB 3.49Å; T370-K374 PolarHBondContact O-N 2.68Å
371	A	95.1	Very high	95.4	Very high	74 Å²	74	78.1 Å²	78.1	61%	0.612	39%	0.387	S	S	*	.	H	α-helix	trans	-61.4	-31.6	175.7	0	0	0	0	0	112.7	K375	A371-K375 WeakPolarHBondContact O-CG 3.49Å; A371-K375 PolarHBondContact O-N 2.82Å
372	E	96.1	Very high	95.5	Very high	147 Å²	147	79.2 Å²	79.2	69%	0.687	39%	0.393	S	S	*	.	H	α-helix	trans	-70.8	-49.9	176.2	-68.1	176	175.9	0	0	111.1	T370 K374 K375 E376	T370-E372 PolarHBondContact O-N 3.39Å; E372-K374 PolarHBondContact O-N 3.31Å; E372-K375 WeakPolarHBondContact O-CA 3.38Å; E372-K375 WeakPolarHBondContact O-CB 3.3Å; E372-K375 PolarHBondContact O-N 3.05Å; E372-E376 PolarHBondContact O-N 2.95Å
373	G	95.3	Very high	95.6	Very high	5 Å²	5	77.4 Å²	77.4	5%	0.052	39%	0.388	C	S	.	.	H	α-helix	trans	-62	-33.9	178.1	0	0	0	0	0	112.6	Q367 T370 E376 L377	Q367-G373 WeakPolarHBondContact O-CA 3.27Å; T370-G373 PolarHBondContact O-N 3.43Å; T370-G373 PolarHBondContact OG1-N 3.49Å; T370-G373 VanDerWaalsContact OG1-N 3.14Å; G373-E376 PolarHBondContact O-N 3.28Å; G373-L377 VanDerWaalsContact O-CG 3.3Å; G373-L377 WeakPolarHBondContact O-CG 3.42Å; G373-L377 PolarHBondContact O-N 2.66Å
374	K	96.4	Very high	95.8	Very high	43 Å²	43	78.2 Å²	78.2	19%	0.187	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-41.7	171.3	-179	-180	165.8	-167.6	0	112.7	F350 E351 Y354 T370 E372 E376 L377 I378	F350-K374 HydrophobicContact CE1-CG 4.25Å; E351-K374 IonicContact OE1-NZ 3.48Å; E351-K374 PolarHBondContact OE1-NZ 3.33Å; E351-K374 WeakPolarHBondContact OE2-CE 3.34Å; E351-K374 IonicContact OE2-NZ 3.47Å; E351-K374 PolarHBondContact OE2-NZ 2.96Å; Y354-K374 HydrophobicContact CD1-CD 4.09Å; Y354-K374 HydrophobicContact CD2-CG 4.46Å; Y354-K374 HydrophobicContact CE1-CD 3.97Å; Y354-K374 HydrophobicContact CE2-CB 4.32Å; Y354-K374 HydrophobicContact CE2-CG 4.34Å; Y354-K374 HydrophobicContact CG-CD 4.49Å; T370-K374 WeakPolarHBondContact O-CB 3.49Å; T370-K374 PolarHBondContact O-N 2.68Å; E372-K374 PolarHBondContact O-N 3.31Å; K374-E376 VanDerWaalsContact C-N 3.34Å; K374-L377 PolarHBondContact O-N 3.35Å; K374-I378 HydrophobicContact CG-CD1 4.23Å; K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.33Å; K374-I378 PolarHBondContact O-N 2.87Å
375	K	96.9	Very high	95.9	Very high	151 Å²	151	73.1 Å²	73.1	66%	0.657	37%	0.369	S	S	*	.	H	α-helix	trans	-64	-39.8	175.1	-72.7	174.2	-178.3	178.2	0	111.5	A371 E372 I378 F379	A371-K375 WeakPolarHBondContact O-CG 3.49Å; A371-K375 PolarHBondContact O-N 2.82Å; E372-K375 WeakPolarHBondContact O-CA 3.38Å; E372-K375 WeakPolarHBondContact O-CB 3.3Å; E372-K375 PolarHBondContact O-N 3.05Å; K375-I378 PolarHBondContact O-N 3.44Å; K375-F379 WeakPolarHBondContact O-CB 3.3Å; K375-F379 PolarHBondContact O-N 2.95Å
376	E	96.4	Very high	96	Very high	120 Å²	120	70.8 Å²	70.8	56%	0.561	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-45.2	173.9	-68.1	-178.5	-166.7	0	0	111.7	E372 G373 K374 I378 F379 L380	E372-E376 PolarHBondContact O-N 2.95Å; G373-E376 PolarHBondContact O-N 3.28Å; K374-E376 VanDerWaalsContact C-N 3.34Å; E376-I378 PolarHBondContact O-N 2.97Å; E376-F379 PolarHBondContact O-N 3.27Å; E376-L380 WeakPolarHBondContact O-CB 3.4Å; E376-L380 VanDerWaalsContact O-CG 3.28Å; E376-L380 WeakPolarHBondContact O-CG 3.37Å; E376-L380 PolarHBondContact O-N 3.21Å
377	L	96.6	Very high	96.1	Very high	12 Å²	12	70 Å²	70	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-45.6	175.7	-74.1	172.1	0	0	0	112	F350 Y354 G373 K374 F379 L380 C381 F388 L391 L395	F350-L377 HydrophobicContact CZ-CB 4.47Å; Y354-L377 HydrophobicContact CE2-CD1 4.21Å; G373-L377 VanDerWaalsContact O-CG 3.3Å; G373-L377 WeakPolarHBondContact O-CG 3.42Å; G373-L377 PolarHBondContact O-N 2.66Å; K374-L377 PolarHBondContact O-N 3.35Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 2.89Å; L377-L380 PolarHBondContact O-N 2.59Å; L377-C381 WeakPolarHBondContact O-CB 3.33Å; L377-C381 PolarHBondContact O-N 3.15Å; L377-C381 PolarHBondContact O-SG 2.85Å; L377-F388 HydrophobicContact CB-CE2 4.31Å; L377-F388 HydrophobicContact CD1-CE2 4.27Å; L377-L391 HydrophobicContact CD2-CB 4.36Å; L377-L395 HydrophobicContact CD2-CD1 3.69Å
378	I	97.1	Very high	96.3	Very high	49 Å²	49	63.9 Å²	63.9	25%	0.251	32%	0.322	S	S	.	.	H	α-helix	trans	-57.2	-49	174.9	-71.2	167.2	0	0	0	110.3	F350 K374 K375 E376 N382 M383	F350-I378 HydrophobicContact CD1-CD1 4.01Å; F350-I378 HydrophobicContact CD1-CG1 3.76Å; F350-I378 HydrophobicContact CE1-CD1 3.69Å; F350-I378 HydrophobicContact CE1-CG1 3.21Å; F350-I378 HydrophobicContact CE2-CG1 4.06Å; F350-I378 HydrophobicContact CG-CG1 4.39Å; F350-I378 HydrophobicContact CZ-CB 4.46Å; F350-I378 HydrophobicContact CZ-CD1 4.35Å; F350-I378 HydrophobicContact CZ-CG1 3.39Å; K374-I378 HydrophobicContact CG-CD1 4.23Å; K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.33Å; K374-I378 PolarHBondContact O-N 2.87Å; K375-I378 PolarHBondContact O-N 3.44Å; E376-I378 PolarHBondContact O-N 2.97Å; I378-N382 VanDerWaalsContact O-CA 3.3Å; I378-N382 WeakPolarHBondContact O-CA 3.45Å; I378-N382 PolarHBondContact O-N 3.32Å; I378-M383 HydrophobicContact CB-CE 4.34Å; I378-M383 HydrophobicContact CB-SD 4.45Å; I378-M383 HydrophobicContact CD1-CE 4.05Å; I378-M383 HydrophobicContact CG1-CE 3.93Å; I378-M383 HydrophobicContact CG1-SD 4.08Å; I378-M383 HydrophobicContact CG2-CE 3.49Å; I378-M383 VanDerWaalsContact CG2-CE 3.49Å; I378-M383 HydrophobicContact CG2-SD 3.89Å
379	F	97.3	Very high	96.5	Very high	175 Å²	175	65.3 Å²	65.3	77%	0.768	33%	0.328	S	S	*	.	H	α-helix	trans	-62	-46.5	-179.6	-177.6	-96.5	0	0	0	112.2	K375 E376 L377	K375-F379 WeakPolarHBondContact O-CB 3.3Å; K375-F379 PolarHBondContact O-N 2.95Å; E376-F379 PolarHBondContact O-N 3.27Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 2.89Å
380	L	96.9	Very high	96.6	Very high	106 Å²	106	64.9 Å²	64.9	56%	0.555	33%	0.327	S	S	*	.	H	α-helix	trans	-69.8	-39.9	-177.4	-69.8	174.1	0	0	0	113.1	E376 L377 L391	E376-L380 WeakPolarHBondContact O-CB 3.4Å; E376-L380 VanDerWaalsContact O-CG 3.28Å; E376-L380 WeakPolarHBondContact O-CG 3.37Å; E376-L380 PolarHBondContact O-N 3.21Å; L377-L380 PolarHBondContact O-N 2.59Å; L380-L391 HydrophobicContact CB-CD1 3.72Å
381	C	96.6	Very high	96.6	Very high	3 Å²	3	64.5 Å²	64.5	2%	0.02	32%	0.322	C	S	.	.	H	α-helix	trans	-85.8	-18.5	179.6	76.1	0	0	0	0	113.4	L377 M383 N384 M387 F388 L391	L377-C381 WeakPolarHBondContact O-CB 3.33Å; L377-C381 PolarHBondContact O-N 3.15Å; L377-C381 PolarHBondContact O-SG 2.85Å; C381-M383 PolarHBondContact O-N 3.26Å; C381-M383 PolarHBondContact SG-N 3.08Å; C381-N384 WeakPolarHBondContact O-CB 3.47Å; C381-N384 PolarHBondContact O-N 3.32Å; C381-M387 HydrophobicContact CB-CB 4.01Å; C381-F388 HydrophobicContact CB-CB 4.02Å; C381-L391 HydrophobicContact CB-CD1 3.95Å
382	N	97.1	Very high	96.6	Very high	116 Å²	116	61 Å²	61	62%	0.62	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	45.5	-171.6	-170.9	24.5	0	0	0	112.5	N344 I378 N384	N344-N382 PolarHBondContact ND2-O 3.35Å; I378-N382 VanDerWaalsContact O-CA 3.3Å; I378-N382 WeakPolarHBondContact O-CA 3.45Å; I378-N382 PolarHBondContact O-N 3.32Å; N382-N384 PolarHBondContact O-N 3.19Å
383	M	97.1	Very high	96.4	Very high	30 Å²	30	55.4 Å²	55.4	15%	0.148	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	15.1	-174.3	-55.3	-59.9	-161.6	0	0	115	N344 Y345 E347 F350 I378 C381 P385	N344-M383 HydrophobicContact CB-CB 4.19Å; N344-M383 WeakPolarHBondContact CB-O 3.48Å; Y345-M383 PolarHBondContact N-O 3.27Å; Y345-M383 WeakPolarHBondContact O-CB 3.34Å; E347-M383 HydrophobicContact CG-CE 4.35Å; F350-M383 HydrophobicContact CB-CE 4.22Å; F350-M383 HydrophobicContact CB-SD 3.56Å; F350-M383 VanDerWaalsContact CB-SD 3.56Å; F350-M383 HydrophobicContact CD1-CE 4.45Å; F350-M383 HydrophobicContact CD1-SD 4.08Å; F350-M383 HydrophobicContact CD2-SD 3.38Å; F350-M383 WeakPolarHBondContact CD2-SD 3.46Å; F350-M383 HydrophobicContact CE2-SD 4.09Å; F350-M383 HydrophobicContact CG-CE 4.19Å; F350-M383 HydrophobicContact CG-SD 3.37Å; F350-M383 WeakPolarHBondContact CG-SD 3.41Å; I378-M383 HydrophobicContact CB-CE 4.34Å; I378-M383 HydrophobicContact CB-SD 4.45Å; I378-M383 HydrophobicContact CD1-CE 4.05Å; I378-M383 HydrophobicContact CG1-CE 3.93Å; I378-M383 HydrophobicContact CG1-SD 4.08Å; I378-M383 HydrophobicContact CG2-CE 3.49Å; I378-M383 VanDerWaalsContact CG2-CE 3.49Å; I378-M383 HydrophobicContact CG2-SD 3.89Å; C381-M383 PolarHBondContact O-N 3.26Å; C381-M383 PolarHBondContact SG-N 3.08Å; M383-P385 WeakPolarHBondContact O-CD 3.38Å
384	N	98.2	Very high	96.2	Very high	17 Å²	17	63.3 Å²	63.3	9%	0.091	31%	0.31	C	S	.	.			trans	-78.8	122.8	-179.9	-177.1	-86.1	0	0	0	110.8	K125 G126 N344 C381 N382 S386 M387 F388	K125-N384 PolarHBondContact O-ND2 2.96Å; G126-N384 PolarHBondContact O-OD1 2.85Å; N344-N384 PolarHBondContact OD1-ND2 2.63Å; N344-N384 VanDerWaalsContact OD1-ND2 3.08Å; C381-N384 WeakPolarHBondContact O-CB 3.47Å; C381-N384 PolarHBondContact O-N 3.32Å; N382-N384 PolarHBondContact O-N 3.19Å; N384-S386 PolarHBondContact O-N 3.32Å; N384-S386 PolarHBondContact OD1-N 3.25Å; N384-M387 HydrophobicContact CB-CB 4.01Å; N384-M387 HydrophobicContact CB-CG 4.04Å; N384-M387 PolarHBondContact O-N 3.32Å; N384-M387 WeakPolarHBondContact OD1-CG 3.4Å; N384-M387 PolarHBondContact OD1-N 2.99Å; N384-M387 VanDerWaalsContact OD1-N 3.08Å; N384-F388 WeakPolarHBondContact O-CB 3.43Å; N384-F388 PolarHBondContact O-N 3.4Å
385	P	97.8	Very high	95.8	Very high	13 Å²	13	64.7 Å²	64.7	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-54.8	-48.2	-175.8	-27	33.1	0	0	0	114.1	G126 Y345 M383 F388 E389	G126-P385 WeakPolarHBondContact O-CB 3.42Å; G126-P385 VanDerWaalsContact O-CD 3.29Å; G126-P385 WeakPolarHBondContact O-CD 3.41Å; Y345-P385 HydrophobicContact CD1-CG 3.77Å; Y345-P385 HydrophobicContact CD2-CB 4.46Å; Y345-P385 HydrophobicContact CD2-CG 4.12Å; Y345-P385 HydrophobicContact CE1-CB 3.88Å; Y345-P385 HydrophobicContact CE1-CG 3.42Å; Y345-P385 VanDerWaalsContact CE1-CG 3.42Å; Y345-P385 HydrophobicContact CE2-CB 3.78Å; Y345-P385 HydrophobicContact CE2-CG 3.86Å; Y345-P385 HydrophobicContact CG-CG 4.1Å; Y345-P385 VanDerWaalsContact CZ-CB 3.46Å; M383-P385 WeakPolarHBondContact O-CD 3.38Å; P385-F388 PolarHBondContact O-N 3.43Å; P385-E389 PolarHBondContact O-N 3.2Å
386	S	96.8	Very high	95.7	Very high	30 Å²	30	60.4 Å²	60.4	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-70.7	-34.4	-178.4	-177	0	0	0	0	112.5	G126 N384 R390	G126-S386 VanDerWaalsContact CA-CB 3.48Å; G126-S386 PolarHBondContact O-N 3.49Å; N384-S386 PolarHBondContact O-N 3.32Å; N384-S386 PolarHBondContact OD1-N 3.25Å; S386-R390 WeakPolarHBondContact O-CB 3.45Å; S386-R390 WeakPolarHBondContact O-CD 3.5Å; S386-R390 WeakPolarHBondContact O-CG 3.41Å; S386-R390 PolarHBondContact O-N 3.36Å; S386-R390 VanDerWaalsContact O-N 3.12Å; S386-R390 PolarHBondContact OG-NE 2.89Å
387	M	97.1	Very high	95.7	Very high	80 Å²	80	57.2 Å²	57.2	39%	0.394	29%	0.289	S	S	.	.	H	α-helix	trans	-70.9	-39.5	176	-66.9	-60.2	-64	0	0	111	C381 N384 R390 L391	C381-M387 HydrophobicContact CB-CB 4.01Å; N384-M387 HydrophobicContact CB-CB 4.01Å; N384-M387 HydrophobicContact CB-CG 4.04Å; N384-M387 PolarHBondContact O-N 3.32Å; N384-M387 WeakPolarHBondContact OD1-CG 3.4Å; N384-M387 PolarHBondContact OD1-N 2.99Å; N384-M387 VanDerWaalsContact OD1-N 3.08Å; M387-R390 WeakPolarHBondContact O-CB 3.3Å; M387-R390 PolarHBondContact O-N 2.99Å; M387-L391 WeakPolarHBondContact O-CG 3.28Å; M387-L391 PolarHBondContact O-N 3.27Å
388	F	97.1	Very high	95.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-47.9	176.2	-177.2	-120.8	0	0	0	111.7	F350 C353 Y354 Y357 L377 C381 N384 P385 R390 L391 C392	F350-F388 HydrophobicContact CE2-CD1 4.29Å; F350-F388 AromaticContact CE2-CD2 3.51Å; F350-F388 HydrophobicContact CE2-CD2 3.51Å; F350-F388 HydrophobicContact CE2-CE1 4.37Å; F350-F388 AromaticContact CE2-CE2 3.6Å; F350-F388 HydrophobicContact CE2-CE2 3.6Å; F350-F388 AromaticContact CE2-CG 3.88Å; F350-F388 HydrophobicContact CE2-CG 3.88Å; F350-F388 HydrophobicContact CE2-CZ 4.05Å; F350-F388 AromaticContact CZ-CD2 3.9Å; F350-F388 HydrophobicContact CZ-CD2 3.9Å; F350-F388 AromaticContact CZ-CE2 3.53Å; F350-F388 HydrophobicContact CZ-CE2 3.53Å; F350-F388 AromaticContact CZ-CZ 3.99Å; F350-F388 HydrophobicContact CZ-CZ 3.99Å; C353-F388 HydrophobicContact CB-CE1 4.26Å; Y354-F388 HydrophobicContact CD2-CZ 4.18Å; Y357-F388 HydrophobicContact CD2-CD1 4.4Å; Y357-F388 AromaticContact CD2-CE1 3.63Å; Y357-F388 HydrophobicContact CD2-CE1 3.63Å; Y357-F388 HydrophobicContact CD2-CZ 4.01Å; Y357-F388 AromaticContact CE2-CD1 3.85Å; Y357-F388 HydrophobicContact CE2-CD1 3.85Å; Y357-F388 AromaticContact CE2-CE1 3.53Å; Y357-F388 HydrophobicContact CE2-CE1 3.53Å; Y357-F388 HydrophobicContact CE2-CZ 4.28Å; L377-F388 HydrophobicContact CB-CE2 4.31Å; L377-F388 HydrophobicContact CD1-CE2 4.27Å; C381-F388 HydrophobicContact CB-CB 4.02Å; N384-F388 WeakPolarHBondContact O-CB 3.43Å; N384-F388 PolarHBondContact O-N 3.4Å; P385-F388 PolarHBondContact O-N 3.43Å; F388-R390 VanDerWaalsContact C-N 3.31Å; F388-R390 PolarHBondContact O-N 2.98Å; F388-L391 PolarHBondContact O-N 3.16Å; F388-C392 WeakPolarHBondContact CE2-SG 3.37Å; F388-C392 VanDerWaalsContact CZ-SG 3.58Å; F388-C392 WeakPolarHBondContact O-CB 3.47Å; F388-C392 PolarHBondContact O-N 3.29Å; F388-C392 PolarHBondContact O-SG 3.37Å
389	E	96.4	Very high	95.5	Very high	35 Å²	35	60.4 Å²	60.4	16%	0.164	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-41.8	173.8	179.9	-86.9	160	0	0	112.3	R81 P385 G393	R81-E389 WeakPolarHBondContact CD-OE2 3.47Å; R81-E389 IonicContact CZ-OE2 2.78Å; R81-E389 IonicContact NH1-OE1 3.42Å; R81-E389 IonicContact NH1-OE2 3.74Å; R81-E389 PolarHBondContact NH1-OE2 3.14Å; P385-E389 PolarHBondContact O-N 3.2Å; E389-G393 PolarHBondContact O-N 3.01Å
390	R	95.8	Very high	95.4	Very high	94 Å²	94	53.2 Å²	53.2	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-48.4	176.8	-81.4	166.4	-173.7	-137.7	-1.6	113.2	S386 M387 F388 H394	S386-R390 WeakPolarHBondContact O-CB 3.45Å; S386-R390 WeakPolarHBondContact O-CD 3.5Å; S386-R390 WeakPolarHBondContact O-CG 3.41Å; S386-R390 PolarHBondContact O-N 3.36Å; S386-R390 VanDerWaalsContact O-N 3.12Å; S386-R390 PolarHBondContact OG-NE 2.89Å; M387-R390 WeakPolarHBondContact O-CB 3.3Å; M387-R390 PolarHBondContact O-N 2.99Å; F388-R390 VanDerWaalsContact C-N 3.31Å; F388-R390 PolarHBondContact O-N 2.98Å; R390-H394 PolarHBondContact O-CD2 3.16Å; R390-H394 VanDerWaalsContact O-CD2 3.27Å
391	L	95.8	Very high	95.3	Very high	54 Å²	54	49.7 Å²	49.7	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-48.6	-179.1	-70.1	170.3	0	0	0	109.6	L377 L380 C381 M387 F388 G393 H394 L395	L377-L391 HydrophobicContact CD2-CB 4.36Å; L380-L391 HydrophobicContact CB-CD1 3.72Å; C381-L391 HydrophobicContact CB-CD1 3.95Å; M387-L391 WeakPolarHBondContact O-CG 3.28Å; M387-L391 PolarHBondContact O-N 3.27Å; F388-L391 PolarHBondContact O-N 3.16Å; L391-G393 VanDerWaalsContact C-N 3.29Å; L391-G393 PolarHBondContact O-N 2.99Å; L391-H394 PolarHBondContact O-N 2.79Å; L391-L395 WeakPolarHBondContact O-CG 3.19Å
392	C	94.8	Very high	95.2	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-28.7	-178.9	-61.5	0	0	0	0	113.6	Y357 L363 F388 H394 L395	Y357-C392 HydrophobicContact CD2-CB 3.96Å; Y357-C392 HydrophobicContact CE2-CB 4.05Å; L363-C392 HydrophobicContact CD2-CB 3.63Å; F388-C392 WeakPolarHBondContact CE2-SG 3.37Å; F388-C392 VanDerWaalsContact CZ-SG 3.58Å; F388-C392 WeakPolarHBondContact O-CB 3.47Å; F388-C392 PolarHBondContact O-N 3.29Å; F388-C392 PolarHBondContact O-SG 3.37Å; C392-H394 PolarHBondContact O-N 3.2Å; C392-H394 VanDerWaalsContact O-N 3.08Å; C392-L395 PolarHBondContact O-N 3.28Å
393	G	91.4	Very high	95.1	Very high	31 Å²	31	48.2 Å²	48.2	32%	0.32	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-6.7	178.2	0	0	0	0	0	115.2	E389 L391	E389-G393 PolarHBondContact O-N 3.01Å; L391-G393 VanDerWaalsContact C-N 3.29Å; L391-G393 PolarHBondContact O-N 2.99Å
394	H	89.7	Confident	94.9	Very high	170 Å²	170	49.7 Å²	49.7	79%	0.787	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	6.5	178.6	-58.7	-52.6	0	0	0	113.5	R390 L391 C392	R390-H394 PolarHBondContact O-CD2 3.16Å; R390-H394 VanDerWaalsContact O-CD2 3.27Å; L391-H394 PolarHBondContact O-N 2.79Å; C392-H394 PolarHBondContact O-N 3.2Å; C392-H394 VanDerWaalsContact O-N 3.08Å
395	L	88.1	Confident	94.6	Very high	72 Å²	72	52.6 Å²	52.6	38%	0.377	27%	0.27	S	S	.	.			trans	-102.2	0	-174.5	-69.5	176	0	0	0	113.7	Q364 H365 L377 L391 C392	Q364-L395 PolarHBondContact N-O 3.32Å; H365-L395 WeakPolarHBondContact CA-OXT 3.42Å; H365-L395 HydrophobicContact CB-CB 4.4Å; H365-L395 WeakPolarHBondContact CB-OXT 3.42Å; H365-L395 PolarHBondContact N-OXT 3.06Å; L377-L395 HydrophobicContact CD2-CD1 3.69Å; L391-L395 WeakPolarHBondContact O-CG 3.19Å; C392-L395 PolarHBondContact O-N 3.28Å

Retrieved 395 of 395 residues in 933.7 ms (Link to these results)

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