A0A096LQ33_POEFO Loading...

Proline and arginine rich end leucine rich repeat protein

AlphaFold DB , UniProt , Accession A0A096LQ33, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 379 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	39.4	Very low	34.9	Very low	240 Å²	240	143.4 Å²	143.4	100%	1.182	85%	0.848	S	S	*	*				0	90.3	0	-70	164.1	169.5	0	0	105.8
2	K	32.2	Very low	34.6	Very low	213 Å²	213	145 Å²	145	93%	0.926	85%	0.848	S	S	*	*				50	125.4	94.2	-72.7	-170.7	178	-177.6	0	111.2
3	A	34.6	Very low	34.3	Very low	99 Å²	99	142.3 Å²	142.3	82%	0.818	83%	0.828	S	S	*	*			cis	-162.3	148.7	9.6	0	0	0	0	0	107.6
4	G	35.1	Very low	34.1	Very low	73 Å²	73	144.3 Å²	144.3	75%	0.753	82%	0.822	S	S	*	*				88.3	137.8	97.4	0	0	0	0	0	111
5	V	37.9	Very low	33.8	Very low	156 Å²	156	143.1 Å²	143.1	95%	0.945	81%	0.811	S	S	*	*			cis	-170.9	152.7	27.7	173.1	0	0	0	0	105.1
6	G	31.3	Very low	33.6	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	81%	0.806	S	S	*	*			cis	-174.4	158.7	4.8	0	0	0	0	0	111.5
7	L	38.9	Very low	33.6	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	81%	0.808	S	S	*	*			trans	-104.9	142.7	167.1	-110.6	102.7	0	0	0	108.1
8	I	35.8	Very low	33.4	Very low	168 Å²	168	140.6 Å²	140.6	86%	0.862	81%	0.805	S	S	*	*			trans	-143.4	99.4	157.4	-59.1	-176.9	0	0	0	106.3
9	S	32	Very low	33.3	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	80%	0.801	S	S	*	*				75.8	104.6	94	-166	0	0	0	0	113.1
10	S	33.7	Very low	33.3	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	81%	0.806	S	S	*	*				68.3	107.2	75.2	172.5	0	0	0	0	114.8
11	F	33.5	Very low	33.3	Very low	187 Å²	187	139.7 Å²	139.7	82%	0.82	80%	0.803	S	S	*	*			trans	40.6	117.6	134.7	-104	-92.4	0	0	0	120.1
12	L	30.2	Very low	33	Very low	163 Å²	163	132.8 Å²	132.8	85%	0.853	78%	0.784	S	S	*	*			trans	176.2	146.6	140.5	-103	127.7	0	0	0	107.8
13	L	31.4	Very low	33.1	Very low	110 Å²	110	130.8 Å²	130.8	58%	0.576	78%	0.778	S	S	*	*			cis	175	138.3	-19.8	-152.4	75.8	0	0	0	105.6
14	F	31.3	Very low	33.2	Very low	170 Å²	170	137.8 Å²	137.8	75%	0.746	78%	0.783	S	S	*	*			trans	65.3	148.3	151.4	-79.5	-48	0	0	0	119.8
15	L	29.7	Very low	33.4	Very low	126 Å²	126	140.4 Å²	140.4	66%	0.66	79%	0.787	S	S	*	*			cis	-173.6	158.7	24.8	-118.4	156.1	0	0	0	110
16	L	30.7	Very low	33.4	Very low	139 Å²	139	144.3 Å²	144.3	73%	0.728	78%	0.784	S	S	*	*			trans	74.6	137.1	149.4	-62.1	156.8	0	0	0	119.3
17	M	34.1	Very low	33.8	Very low	171 Å²	171	147.1 Å²	147.1	84%	0.842	79%	0.79	S	S	*	*			cis	-161.4	140.8	1.1	-88.5	-88.4	-92	0	0	105.9
18	G	29.5	Very low	34	Very low	74 Å²	74	148.7 Å²	148.7	76%	0.763	79%	0.789	S	S	*	*				149.9	139.8	89.8	0	0	0	0	0	110.2
19	A	31.9	Very low	34.3	Very low	88 Å²	88	150.1 Å²	150.1	73%	0.727	79%	0.789	S	S	*	*			trans	-81.2	149.9	-165.7	0	0	0	0	0	114.7
20	V	32.8	Very low	34.8	Very low	148 Å²	148	151.7 Å²	151.7	90%	0.897	80%	0.797	S	S	*	*			trans	-141.1	126.4	136.6	-177.5	0	0	0	0	109.8
21	F	32.5	Very low	35.3	Very low	168 Å²	168	153.3 Å²	153.3	74%	0.737	80%	0.803	S	S	*	*			trans	-59.1	138.5	174.6	-98.2	-111.8	0	0	0	113.5
22	A	33.3	Very low	35.9	Very low	95 Å²	95	156.4 Å²	156.4	79%	0.785	81%	0.809	S	S	*	*			trans	-158.4	104.5	139	0	0	0	0	0	110
23	Q	35	Very low	36.4	Very low	171 Å²	171	160 Å²	160	80%	0.799	81%	0.811	S	S	*	*			trans	-63.1	134.1	172.5	-68.3	169.8	-25.2	0	0	110.3
24	R	37.3	Very low	36.9	Very low	246 Å²	246	160.5 Å²	160.5	93%	0.928	82%	0.821	S	S	*	*			trans	-129.5	133	157.2	-81.2	-170.7	177.8	-178	0.8	111.7
25	P	38.1	Very low	37.6	Very low	128 Å²	128	157.4 Å²	157.4	83%	0.831	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-93.1	163.3	-169	7.2	15.1	0	0	0	112.7
26	R	38.3	Very low	38.2	Very low	238 Å²	238	157.7 Å²	157.7	90%	0.898	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-54.3	152.5	177.4	-72.5	177.1	176.5	176.6	-1.8	114
27	P	39.3	Very low	39	Very low	131 Å²	131	157.7 Å²	157.7	85%	0.851	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-75	137.3	-172.6	30.3	-33.8	0	0	0	113
28	K	44.3	Very low	39.7	Very low	204 Å²	204	161.3 Å²	161.3	89%	0.887	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-93.4	143.2	170.8	-75	-176.6	176.6	179.1	0	110.8
29	K	41.8	Very low	40.6	Very low	197 Å²	197	167 Å²	167	86%	0.857	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-53.4	144.4	173.6	-78.1	175.9	174.3	176.9	0	111.9
30	P	41.2	Very low	41.2	Very low	131 Å²	131	168.5 Å²	168.5	85%	0.851	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-76.4	127.8	-176	28.5	-31.6	0	0	0	112.7
31	T	44.4	Very low	42	Very low	135 Å²	135	170.3 Å²	170.3	83%	0.828	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-77.4	139.6	168.8	27.8	0	0	0	0	111.7
32	R	46.9	Very low	43	Very low	252 Å²	252	168.2 Å²	168.2	95%	0.951	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-53	133.5	176.1	-88.4	176.5	166	174.2	-4.7	112.4
33	R	39.9	Very low	43.7	Very low	237 Å²	237	168.3 Å²	168.3	89%	0.894	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-86.8	154.7	164.5	-83.5	-177.3	175.3	-177	-1.5	111.2
34	P	41.8	Very low	44.5	Very low	121 Å²	121	169.4 Å²	169.4	79%	0.786	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-75.6	156.2	-173.4	-6.3	24.2	0	0	0	112.7	T36	P34-T36 PolarHBondContact O-N 3.31Å
35	A	46.3	Very low	44.8	Very low	105 Å²	105	168.8 Å²	168.8	87%	0.868	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-62.9	120.3	-179.2	0	0	0	0	0	112.1
36	T	43.9	Very low	45.6	Very low	132 Å²	132	169 Å²	169	81%	0.81	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-84	126.4	163	40	0	0	0	0	109.2	P34 R38	P34-T36 PolarHBondContact O-N 3.31Å; T36-R38 PolarHBondContact O-N 3.12Å
37	T	47.1	Very low	46.3	Very low	140 Å²	140	165.8 Å²	165.8	86%	0.859	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-51.9	120.2	175.6	38.8	0	0	0	0	111.4	K39	T37-K39 PolarHBondContact O-N 3.4Å
38	R	47.2	Very low	46.7	Very low	247 Å²	247	164.7 Å²	164.7	93%	0.932	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-59.6	121.2	172.8	-79.2	178.7	170.9	179	-3.8	109.6	T36	T36-R38 PolarHBondContact O-N 3.12Å
39	K	49.6	Very low	47.1	Very low	194 Å²	194	159.6 Å²	159.6	84%	0.843	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-63.8	141.1	158.1	-80.2	-179	173.9	-179.3	0	108.6	T37 F41	T37-K39 PolarHBondContact O-N 3.4Å; K39-F41 PolarHBondContact O-N 3.29Å
40	P	44.7	Very low	47.6	Very low	119 Å²	119	156.9 Å²	156.9	77%	0.773	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-61.1	133.4	175.7	-16.7	29.1	0	0	0	110.1	V42	P40-V42 PolarHBondContact O-N 3.12Å; P40-V42 VanDerWaalsContact O-N 3.12Å
41	F	48.3	Very low	48	Very low	186 Å²	186	154.3 Å²	154.3	82%	0.816	81%	0.812	S	S	*	*			trans	-69.1	104.1	171.5	-173.1	-96.1	0	0	0	108	K39 P43	K39-F41 PolarHBondContact O-N 3.29Å; F41-P43 HydrophobicContact CE1-CB 4.42Å; F41-P43 WeakPolarHBondContact O-CD 3.48Å
42	V	55.1	Low	48.1	Very low	123 Å²	123	156.1 Å²	156.1	75%	0.745	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.1	118.9	164.1	-176.3	0	0	0	0	106.1	P40 K44	P40-V42 PolarHBondContact O-N 3.12Å; P40-V42 VanDerWaalsContact O-N 3.12Å; V42-K44 PolarHBondContact O-N 3.15Å; V42-K44 VanDerWaalsContact O-N 3.15Å
43	P	47.5	Very low	47.7	Very low	97 Å²	97	150.3 Å²	150.3	63%	0.63	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-61.9	122.3	178.1	24	-30.1	0	0	0	108.5	F41 R45	F41-P43 HydrophobicContact CE1-CB 4.42Å; F41-P43 WeakPolarHBondContact O-CD 3.48Å; P43-R45 PolarHBondContact O-N 3.35Å; P43-R45 VanDerWaalsContact O-N 3.12Å
44	K	51.8	Low	48.3	Very low	195 Å²	195	146.7 Å²	146.7	85%	0.848	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-57.5	119	165.5	-96.1	-177.5	172.6	-176.1	0	106.9	V42 V46	V42-K44 PolarHBondContact O-N 3.15Å; V42-K44 VanDerWaalsContact O-N 3.15Å; K44-V46 PolarHBondContact O-N 3.09Å; K44-V46 VanDerWaalsContact O-N 3.09Å
45	R	44.3	Very low	48.7	Very low	233 Å²	233	147.6 Å²	147.6	88%	0.879	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-53.1	117.2	169.1	-163.6	176.6	-168	-179.1	2.5	106.6	P43 E47	P43-R45 PolarHBondContact O-N 3.35Å; P43-R45 VanDerWaalsContact O-N 3.12Å; R45-E47 VanDerWaalsContact C-N 3.34Å; R45-E47 PolarHBondContact O-N 2.99Å
46	V	54.3	Low	49	Very low	133 Å²	133	148.4 Å²	148.4	81%	0.806	79%	0.789	S	S	*	*			trans	-64.3	103.8	168.2	178.4	0	0	0	0	104.9	K44	K44-V46 PolarHBondContact O-N 3.09Å; K44-V46 VanDerWaalsContact O-N 3.09Å
47	E	52.2	Low	49.8	Very low	169 Å²	169	147 Å²	147	79%	0.79	78%	0.781	S	S	*	*			trans	-59.6	129.8	165.1	-79.6	176.8	160.3	0	0	106.6	R45 A49	R45-E47 VanDerWaalsContact C-N 3.34Å; R45-E47 PolarHBondContact O-N 2.99Å; E47-A49 PolarHBondContact O-N 3.3Å
48	P	49.2	Very low	50.9	Low	108 Å²	108	147.1 Å²	147.1	70%	0.701	78%	0.776	S	S	*	*			trans	-54.1	135.6	170.4	-9.6	19.9	0	0	0	107.2	V50	P48-V50 PolarHBondContact O-N 2.91Å
49	A	52.7	Low	52.1	Low	97 Å²	97	138.3 Å²	138.3	80%	0.802	74%	0.744	S	S	*	*			trans	-47.6	115	169	0	0	0	0	0	107.5	E47 A51	E47-A49 PolarHBondContact O-N 3.3Å; A49-A51 PolarHBondContact O-N 2.93Å
50	V	51.4	Low	53.8	Low	140 Å²	140	131.7 Å²	131.7	85%	0.848	72%	0.721	S	S	*	*			trans	-58	111.1	170.7	177.1	0	0	0	0	104.3	P48 E52	P48-V50 PolarHBondContact O-N 2.91Å; V50-E52 PolarHBondContact O-N 2.8Å
51	A	50	Low	55.8	Low	77 Å²	77	130.7 Å²	130.7	64%	0.636	72%	0.715	S	S	*	*			trans	-51.2	127	174.4	0	0	0	0	0	106.8	A49	A49-A51 PolarHBondContact O-N 2.93Å
52	E	46.4	Very low	57.9	Low	173 Å²	173	124.7 Å²	124.7	81%	0.808	70%	0.695	S	S	*	*			trans	-46	139.6	166.1	-85.1	179.4	150	0	0	108	V50 Q54	V50-E52 PolarHBondContact O-N 2.8Å; E52-Q54 PolarHBondContact O-N 3.17Å
53	P	37.9	Very low	59.6	Low	130 Å²	130	123 Å²	123	84%	0.844	68%	0.68	S	S	*	*			trans	-54.6	107.3	177.2	-18.2	28.6	0	0	0	108	E55	P53-E55 PolarHBondContact O-N 3.49Å
54	Q	52.6	Low	61.8	Low	162 Å²	162	123.7 Å²	123.7	76%	0.757	68%	0.678	S	S	*	*			trans	-62.2	128	169.7	-71.9	-171.3	-21	0	0	106.1	E52	E52-Q54 PolarHBondContact O-N 3.17Å
55	E	50.1	Low	63.3	Low	140 Å²	140	115.4 Å²	115.4	65%	0.654	65%	0.648	S	S	*	*			trans	-45.8	141.8	167.5	-83.3	-170.9	161	0	0	108.6	P53 T57 R137	P53-E55 PolarHBondContact O-N 3.49Å; E55-T57 PolarHBondContact O-N 3.29Å; E55-R137 IonicContact OE2-NH1 3.59Å
56	P	52.3	Low	65.3	Low	121 Å²	121	108.4 Å²	108.4	79%	0.786	63%	0.633	S	S	*	*			trans	-49.9	116.2	178.1	-21.4	30.3	0	0	0	109.5	D58	P56-D58 PolarHBondContact O-N 2.76Å
57	T	61.3	Low	66.9	Low	104 Å²	104	108.3 Å²	108.3	64%	0.638	64%	0.635	S	S	*	*	S	Bend	trans	-72.2	-5.2	-171.5	33.3	0	0	0	0	113.8	E55 F59	E55-T57 PolarHBondContact O-N 3.29Å; T57-F59 PolarHBondContact O-N 2.95Å
58	D	69.9	Low	68.7	Low	142 Å²	142	102.4 Å²	102.4	76%	0.759	61%	0.612	S	S	*	*			trans	-100.2	85.5	177.4	-71.8	-30.9	0	0	0	110.6	P56	P56-D58 PolarHBondContact O-N 2.76Å
59	F	73.3	Confident	70.8	Confident	61 Å²	61	103.5 Å²	103.5	27%	0.268	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-54.1	144.8	160.3	-62.5	-96.6	0	0	0	109	T57 R95 Y113 R137	T57-F59 PolarHBondContact O-N 2.95Å; F59-R95 PolarHBondContact O-NH2 3.17Å; F59-Y113 HydrophobicContact CB-CD2 4.37Å; F59-Y113 AromaticContact CD1-CD1 3.55Å; F59-Y113 HydrophobicContact CD1-CD1 3.55Å; F59-Y113 AromaticContact CD1-CD2 3.81Å; F59-Y113 HydrophobicContact CD1-CD2 3.81Å; F59-Y113 AromaticContact CD1-CE1 3.93Å; F59-Y113 HydrophobicContact CD1-CE1 3.93Å; F59-Y113 HydrophobicContact CD1-CE2 4.18Å; F59-Y113 AromaticContact CD1-CG 3.48Å; F59-Y113 HydrophobicContact CD1-CG 3.48Å; F59-Y113 VanDerWaalsContact CD1-CG 3.48Å; F59-Y113 AromaticContact CE1-CD1 3.55Å; F59-Y113 HydrophobicContact CE1-CD1 3.55Å; F59-Y113 HydrophobicContact CE1-CE1 4.14Å; F59-Y113 AromaticContact CE1-CG 3.78Å; F59-Y113 HydrophobicContact CE1-CG 3.78Å; F59-Y113 HydrophobicContact CG-CD2 4.49Å; F59-Y113 HydrophobicContact CG-CG 4.42Å; F59-R137 VanDerWaalsContact CE1-NH1 3.32Å; F59-R137 VanDerWaalsContact CZ-NH1 3.28Å
60	P	84.9	Confident	72.7	Confident	55 Å²	55	101.5 Å²	101.5	36%	0.357	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-55.9	146.3	175.4	24.6	-34.1	0	0	0	110.6	N93 Y113	P60-N93 WeakPolarHBondContact CB-ND2 3.12Å; P60-N93 HydrophobicContact CG-CB 4.19Å; P60-Y113 HydrophobicContact CG-CE2 3.88Å
61	P	87.1	Confident	74.7	Confident	98 Å²	98	101.1 Å²	101.1	64%	0.636	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-61.7	155	179.1	26.3	-34.3	0	0	0	110.9	I63 N93	P61-I63 PolarHBondContact O-N 3.16Å; P61-N93 WeakPolarHBondContact O-CB 3.01Å; P61-N93 PolarHBondContact O-ND2 3.42Å; P61-N93 VanDerWaalsContact O-ND2 3.16Å
62	P	91.3	Very high	76.8	Confident	61 Å²	61	100.1 Å²	100.1	40%	0.396	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-55.7	136.8	172.8	-25.6	35	0	0	0	111.8	R92	P62-R92 CarbonylContact C-O 3.26Å; P62-R92 WeakPolarHBondContact CA-O 3.41Å
63	I	91.8	Very high	79.1	Confident	86 Å²	86	92.6 Å²	92.6	44%	0.441	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-84.9	117.6	177.5	-62	165.6	0	0	0	107.8	P61 R92	P61-I63 PolarHBondContact O-N 3.16Å; I63-R92 HydrophobicContact CB-CB 4.23Å; I63-R92 HydrophobicContact CB-CG 4.16Å; I63-R92 PolarHBondContact N-O 3.45Å
64	L	92.4	Very high	81.9	Confident	113 Å²	113	87.2 Å²	87.2	59%	0.592	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-77.1	139.9	178.5	-58.7	-178.3	0	0	0	111.1	R75	L64-R75 HydrophobicContact CD2-CB 4.24Å
65	G	83.7	Confident	83.9	Confident	21 Å²	21	88.4 Å²	88.4	22%	0.216	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-80	169.4	172	0	0	0	0	0	112.8	R75	G65-R75 PolarHBondContact N-O 2.84Å
66	P	86.6	Confident	86	Confident	85 Å²	85	84.2 Å²	84.2	55%	0.552	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-64	159	170.9	29.9	-35.2	0	0	0	111.1	S68 L78	P66-S68 PolarHBondContact O-N 3.01Å; P66-L78 HydrophobicContact CG-CD1 3.77Å
67	P	88	Confident	88.2	Confident	132 Å²	132	78.6 Å²	78.6	86%	0.857	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-54.2	132.2	173.3	-24	33.8	0	0	0	111.7
68	S	90.8	Very high	89.8	Confident	44 Å²	44	76 Å²	76	31%	0.308	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-92.8	147.3	176.8	178.9	0	0	0	0	110.7	P66 Y70 C73	P66-S68 PolarHBondContact O-N 3.01Å; S68-Y70 PolarHBondContact O-N 2.95Å; S68-Y70 PolarHBondContact OG-N 3.11Å; S68-Y70 PolarHBondContact OG-O 2.94Å; S68-C73 VanDerWaalsContact OG-CB 3.27Å; S68-C73 WeakPolarHBondContact OG-CB 3.5Å
69	I	92.1	Very high	91	Very high	131 Å²	131	69.6 Å²	69.6	67%	0.672	39%	0.392	S	S	*	.	S	Bend	trans	-70.7	-20.4	168.1	64.7	165.2	0	0	0	112.1	P81	I69-P81 HydrophobicContact CD1-CB 4Å; I69-P81 HydrophobicContact CD1-CG 3.56Å; I69-P81 HydrophobicContact CG1-CG 4.13Å
70	Y	93.3	Very high	91.9	Very high	56 Å²	56	70 Å²	70	22%	0.22	40%	0.396	C	S	.	.	S	Bend	trans	-90.6	119.6	176.8	-56.2	-77.8	0	0	0	109.4	S68 D72 C73 C79 P84	S68-Y70 PolarHBondContact O-N 2.95Å; S68-Y70 PolarHBondContact OG-N 3.11Å; S68-Y70 PolarHBondContact OG-O 2.94Å; Y70-D72 PolarHBondContact O-N 3.35Å; Y70-C73 WeakPolarHBondContact O-CB 3.46Å; Y70-C73 PolarHBondContact O-N 3.48Å; Y70-C79 HydrophobicContact CD2-CB 3.78Å; Y70-C79 HydrophobicContact CE2-CB 4.35Å; Y70-P84 WeakPolarHBondContact OH-CB 3.21Å
71	S	92.9	Very high	92.3	Very high	132 Å²	132	71 Å²	71	92%	0.923	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.2	-177	53.1	0	0	0	0	114.3
72	D	93.8	Very high	92.7	Very high	55 Å²	55	71.1 Å²	71.1	29%	0.294	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	0.5	179.2	65	-12.1	0	0	0	113.3	Y70 P74 P101 R103	Y70-D72 PolarHBondContact O-N 3.35Å; D72-P74 WeakPolarHBondContact O-CD 3.4Å; D72-P101 WeakPolarHBondContact O-CG 3.43Å; D72-R103 IonicContact OD1-CZ 3.68Å; D72-R103 IonicContact OD1-NH1 2.9Å; D72-R103 PolarHBondContact OD1-NH1 3.01Å; D72-R103 IonicContact OD1-NH2 2.79Å; D72-R103 PolarHBondContact OD1-NH2 3.19Å; D72-R103 IonicContact OD2-CZ 2.73Å; D72-R103 IonicContact OD2-NH1 3.21Å; D72-R103 PolarHBondContact OD2-NH1 3Å; D72-R103 IonicContact OD2-NH2 3.89Å
73	C	96.1	Very high	92.9	Very high	15 Å²	15	75.6 Å²	75.6	10%	0.101	42%	0.416	C	S	.	.	S	Bend	trans	-72.2	125.3	177.4	-168.5	0	0	0	0	110.6	S68 Y70 C79	S68-C73 VanDerWaalsContact OG-CB 3.27Å; S68-C73 WeakPolarHBondContact OG-CB 3.5Å; Y70-C73 WeakPolarHBondContact O-CB 3.46Å; Y70-C73 PolarHBondContact O-N 3.48Å; C73-C79 HydrophobicContact CB-CB 3.91Å; C73-C79 WeakPolarHBondContact CB-SG 3.27Å; C73-C79 WeakPolarHBondContact SG-CB 3.1Å; C73-C79 PolarHBondContact SG-N 3.01Å; C73-C79 CovalentContact SG-SG 2.04Å; C73-C79 PolarHBondContact SG-SG 2.84Å
74	P	96.1	Very high	93	Very high	17 Å²	17	73.9 Å²	73.9	11%	0.11	41%	0.411	C	S	.	.			trans	-58	141.8	175.5	-23.6	33.3	0	0	0	112.1	D72 E76 C77 L87 P98 V99	D72-P74 WeakPolarHBondContact O-CD 3.4Å; P74-E76 VanDerWaalsContact C-N 3.25Å; P74-E76 HydrophobicContact CB-CG 4.38Å; P74-E76 PolarHBondContact O-N 2.79Å; P74-C77 HydrophobicContact CB-CB 4.13Å; P74-C77 PolarHBondContact O-N 3.34Å; P74-L87 HydrophobicContact CG-CD1 4.37Å; P74-L87 HydrophobicContact CG-CD2 4.43Å; P74-P98 HydrophobicContact CB-CB 3.64Å; P74-P98 HydrophobicContact CB-CG 3.99Å; P74-P98 HydrophobicContact CG-CB 3.74Å; P74-P98 HydrophobicContact CG-CG 3.99Å; P74-V99 WeakPolarHBondContact CG-O 2.8Å
75	R	94.6	Very high	93.2	Very high	188 Å²	188	71.4 Å²	71.4	71%	0.709	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-26.7	-174.4	-63.7	-162.8	74.1	166.8	3.9	112.7	L64 G65 C77	L64-R75 HydrophobicContact CD2-CB 4.24Å; G65-R75 PolarHBondContact N-O 2.84Å; R75-C77 PolarHBondContact O-N 3.47Å
76	E	94.8	Very high	93.8	Very high	52 Å²	52	71.2 Å²	71.2	24%	0.243	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	8.8	173.5	63	-92.7	-127.3	0	0	112.6	P74 R92 I94 P98	P74-E76 VanDerWaalsContact C-N 3.25Å; P74-E76 HydrophobicContact CB-CG 4.38Å; P74-E76 PolarHBondContact O-N 2.79Å; E76-R92 WeakPolarHBondContact O-CD 3.28Å; E76-I94 HydrophobicContact CB-CD1 4.19Å; E76-I94 HydrophobicContact CB-CG1 4.28Å; E76-I94 HydrophobicContact CG-CD1 3.89Å; E76-I94 HydrophobicContact CG-CG1 4.24Å; E76-P98 HydrophobicContact CG-CB 4.43Å; E76-P98 HydrophobicContact CG-CG 4.35Å
77	C	96.7	Very high	94.3	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.014	37%	0.367	C	S	.	.	S	Bend	trans	-132.3	172	-179.7	-58.5	0	0	0	0	111.7	P74 R75 L87 N88 C89	P74-C77 HydrophobicContact CB-CB 4.13Å; P74-C77 PolarHBondContact O-N 3.34Å; R75-C77 PolarHBondContact O-N 3.47Å; C77-L87 HydrophobicContact CB-CD1 3.5Å; C77-L87 VanDerWaalsContact CB-CD1 3.5Å; C77-L87 HydrophobicContact CB-CG 4.36Å; C77-N88 CarbonylContact C-O 3.5Å; C77-N88 WeakPolarHBondContact CA-O 3.38Å; C77-C89 HydrophobicContact CB-CB 4.11Å; C77-C89 WeakPolarHBondContact CB-SG 3.37Å; C77-C89 WeakPolarHBondContact SG-CB 3.36Å; C77-C89 CovalentContact SG-SG 2.03Å; C77-C89 PolarHBondContact SG-SG 2.7Å
78	L	96.1	Very high	94.8	Very high	50 Å²	50	62 Å²	62	26%	0.262	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-123.2	122.8	176.6	179.7	70.3	0	0	0	110.5	P66 L80 N88	P66-L78 HydrophobicContact CG-CD1 3.77Å; L78-L80 HydrophobicContact CD1-CD2 4.32Å; L78-L80 HydrophobicContact CD2-CD2 4.01Å; L78-L80 HydrophobicContact CD2-CG 4.18Å; L78-L80 HydrophobicContact CG-CD2 4.14Å; L78-L80 HydrophobicContact CG-CG 4.19Å; L78-N88 HydrophobicContact CB-CB 4.32Å; L78-N88 PolarHBondContact N-O 3.19Å; L78-N88 WeakPolarHBondContact O-CB 3.49Å; L78-N88 PolarHBondContact O-N 3.13Å; L78-N88 VanDerWaalsContact O-N 3.09Å; L78-N88 PolarHBondContact O-ND2 3.32Å
79	C	95.1	Very high	95.1	Very high	8 Å²	8	60 Å²	60	5%	0.054	32%	0.318	C	S	.	.			trans	-111.6	109.2	174	-53.9	0	0	0	0	109.2	Y70 C73	Y70-C79 HydrophobicContact CD2-CB 3.78Å; Y70-C79 HydrophobicContact CE2-CB 4.35Å; C73-C79 HydrophobicContact CB-CB 3.91Å; C73-C79 WeakPolarHBondContact CB-SG 3.27Å; C73-C79 WeakPolarHBondContact SG-CB 3.1Å; C73-C79 PolarHBondContact SG-N 3.01Å; C73-C79 CovalentContact SG-SG 2.04Å; C73-C79 PolarHBondContact SG-SG 2.84Å
80	L	92.9	Very high	95.4	Very high	68 Å²	68	56 Å²	56	36%	0.356	30%	0.297	S	S	.	.			trans	-88.4	132.6	-176.9	-69.6	172.1	0	0	0	111	L78 S82 Y83	L78-L80 HydrophobicContact CD1-CD2 4.32Å; L78-L80 HydrophobicContact CD2-CD2 4.01Å; L78-L80 HydrophobicContact CD2-CG 4.18Å; L78-L80 HydrophobicContact CG-CD2 4.14Å; L78-L80 HydrophobicContact CG-CG 4.19Å; L80-S82 PolarHBondContact O-N 3.44Å; L80-Y83 HydrophobicContact CD1-CD2 4.41Å; L80-Y83 CarbonylContact O-C 3.1Å; L80-Y83 PolarHBondContact O-N 3.34Å
81	P	92.9	Very high	95.6	Very high	76 Å²	76	57.7 Å²	57.7	49%	0.494	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.1	177.3	-24	34.3	0	0	0	114	I69 Y83	I69-P81 HydrophobicContact CD1-CB 4Å; I69-P81 HydrophobicContact CD1-CG 3.56Å; I69-P81 HydrophobicContact CG1-CG 4.13Å; P81-Y83 PolarHBondContact O-N 3.18Å
82	S	94.8	Very high	95.8	Very high	102 Å²	102	52.8 Å²	52.8	71%	0.713	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.7	175.6	-51.1	0	0	0	0	113.3	L80	L80-S82 PolarHBondContact O-N 3.44Å
83	Y	95	Very high	95.9	Very high	154 Å²	154	51.6 Å²	51.6	60%	0.604	26%	0.264	S	S	*	.	S	Bend	trans	-137	66.1	-179.8	-59.2	-76.6	0	0	0	109.7	L80 P81 N85 S86	L80-Y83 HydrophobicContact CD1-CD2 4.41Å; L80-Y83 CarbonylContact O-C 3.1Å; L80-Y83 PolarHBondContact O-N 3.34Å; P81-Y83 PolarHBondContact O-N 3.18Å; Y83-N85 PolarHBondContact O-N 3.27Å; Y83-S86 PolarHBondContact O-N 3.25Å
84	P	93.6	Very high	95.9	Very high	51 Å²	51	51 Å²	51	33%	0.331	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.1	-166.1	25.9	-35.7	0	0	0	113.8	Y70 R103	Y70-P84 WeakPolarHBondContact OH-CB 3.21Å; P84-R103 WeakPolarHBondContact O-CD 3.36Å; P84-R103 PolarHBondContact O-NE 3.17Å
85	N	96.6	Very high	95.8	Very high	60 Å²	60	54.7 Å²	54.7	32%	0.321	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	3.6	-177.7	-61.6	-7.3	0	0	0	113.2	Y83 R103 H105 Y106	Y83-N85 PolarHBondContact O-N 3.27Å; N85-R103 WeakPolarHBondContact CA-O 3.02Å; N85-R103 WeakPolarHBondContact CB-O 3.43Å; N85-R103 PolarHBondContact OD1-O 3.37Å; N85-H105 HydrophobicContact CB-CB 4.12Å; N85-H105 WeakPolarHBondContact CB-ND1 3.47Å; N85-H105 PolarHBondContact ND2-ND1 3.08Å; N85-H105 PolarHBondContact O-N 2.93Å; N85-Y106 PolarHBondContact O-N 3.36Å
86	S	97.6	Very high	95.9	Very high	18 Å²	18	50.6 Å²	50.6	13%	0.126	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.1	176.8	-61.7	0	0	0	0	110.7	Y83 Y106	Y83-S86 PolarHBondContact O-N 3.25Å; S86-Y106 WeakPolarHBondContact CA-O 3.26Å
87	L	97.7	Very high	96	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	107.6	174.2	178.5	61.7	0	0	0	109.1	P74 C77 C89 I100 T104 Y106 L107 Y108	P74-L87 HydrophobicContact CG-CD1 4.37Å; P74-L87 HydrophobicContact CG-CD2 4.43Å; C77-L87 HydrophobicContact CB-CD1 3.5Å; C77-L87 VanDerWaalsContact CB-CD1 3.5Å; C77-L87 HydrophobicContact CB-CG 4.36Å; L87-C89 VanDerWaalsContact CG-SG 3.56Å; L87-I100 HydrophobicContact CD2-CD1 3.7Å; L87-I100 HydrophobicContact CD2-CG2 4.38Å; L87-T104 HydrophobicContact CB-CG2 3.69Å; L87-Y106 PolarHBondContact N-O 3.17Å; L87-L107 HydrophobicContact CB-CD1 4.06Å; L87-L107 HydrophobicContact CD2-CD1 3.63Å; L87-L107 HydrophobicContact CG-CD1 3.93Å; L87-Y108 PolarHBondContact O-N 3.3Å
88	N	97.6	Very high	96	Very high	23 Å²	23	49 Å²	49	12%	0.123	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	106.8	-174.8	-54.2	-77.7	0	0	0	110.2	C77 L78 E90 R92 Y108	C77-N88 CarbonylContact C-O 3.5Å; C77-N88 WeakPolarHBondContact CA-O 3.38Å; L78-N88 HydrophobicContact CB-CB 4.32Å; L78-N88 PolarHBondContact N-O 3.19Å; L78-N88 WeakPolarHBondContact O-CB 3.49Å; L78-N88 PolarHBondContact O-N 3.13Å; L78-N88 VanDerWaalsContact O-N 3.09Å; L78-N88 PolarHBondContact O-ND2 3.32Å; N88-E90 VanDerWaalsContact C-OE2 3.24Å; N88-E90 VanDerWaalsContact CA-OE2 3.28Å; N88-E90 WeakPolarHBondContact CA-OE2 3.42Å; N88-E90 WeakPolarHBondContact CB-OE2 3.31Å; N88-R92 VanDerWaalsContact O-CZ 3.28Å; N88-R92 PolarHBondContact O-NH1 2.9Å; N88-R92 PolarHBondContact O-NH2 2.83Å; N88-Y108 VanDerWaalsContact OD1-CD2 3.32Å; N88-Y108 WeakPolarHBondContact OD1-CD2 3.5Å
89	C	97.8	Very high	96.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.			trans	-125.3	10.7	-176.4	-53.5	0	0	0	0	112.3	C77 L87 R92 I94 Y108 L109 N112	C77-C89 HydrophobicContact CB-CB 4.11Å; C77-C89 WeakPolarHBondContact CB-SG 3.37Å; C77-C89 WeakPolarHBondContact SG-CB 3.36Å; C77-C89 CovalentContact SG-SG 2.03Å; C77-C89 PolarHBondContact SG-SG 2.7Å; L87-C89 VanDerWaalsContact CG-SG 3.56Å; C89-R92 VanDerWaalsContact CA-NH1 3.26Å; C89-I94 HydrophobicContact CB-CD1 3.63Å; C89-I94 VanDerWaalsContact O-CD1 3.3Å; C89-I94 WeakPolarHBondContact O-CD1 3.36Å; C89-Y108 CarbonylContact C-O 3.49Å; C89-Y108 VanDerWaalsContact C-O 3.31Å; C89-Y108 VanDerWaalsContact CA-O 3.25Å; C89-Y108 WeakPolarHBondContact CA-O 3.28Å; C89-Y108 VanDerWaalsContact CB-O 3.27Å; C89-Y108 WeakPolarHBondContact CB-O 3.46Å; C89-Y108 PolarHBondContact N-O 2.91Å; C89-L109 HydrophobicContact CB-CD2 3.44Å; C89-L109 VanDerWaalsContact CB-CD2 3.44Å; C89-L109 HydrophobicContact CB-CG 4.18Å; C89-N112 PolarHBondContact O-ND2 3.09Å
90	E	97.6	Very high	96.2	Very high	48 Å²	48	50.7 Å²	50.7	22%	0.224	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	150.1	-178.8	71.3	-77.5	-174.2	0	0	113.1	N88 R92 Y108 Q110	N88-E90 VanDerWaalsContact C-OE2 3.24Å; N88-E90 VanDerWaalsContact CA-OE2 3.28Å; N88-E90 WeakPolarHBondContact CA-OE2 3.42Å; N88-E90 WeakPolarHBondContact CB-OE2 3.31Å; E90-R92 VanDerWaalsContact C-N 3.35Å; E90-R92 WeakPolarHBondContact O-CG 3.44Å; E90-R92 PolarHBondContact O-N 3.45Å; E90-R92 PolarHBondContact O-NH1 3.22Å; E90-R92 IonicContact OE2-NH1 3.73Å; E90-Y108 PolarHBondContact N-O 3.32Å; E90-Q110 VanDerWaalsContact CA-O 3.25Å; E90-Q110 WeakPolarHBondContact CA-O 3.35Å; E90-Q110 HydrophobicContact CB-CG 3.95Å; E90-Q110 WeakPolarHBondContact CB-O 3.25Å
91	N	97.4	Very high	96.4	Very high	91 Å²	91	47.8 Å²	47.8	49%	0.487	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	38.1	174.8	-48	-77.8	0	0	0	115	Q110 N111	N91-Q110 PolarHBondContact N-O 3.28Å; N91-Q110 VanDerWaalsContact N-O 3.17Å; N91-N111 WeakPolarHBondContact CA-O 3.05Å; N91-N111 PolarHBondContact N-O 3.42Å; N91-N111 WeakPolarHBondContact OD1-CB 3.49Å; N91-N111 PolarHBondContact OD1-ND2 3.36Å
92	R	96.6	Very high	96.5	Very high	30 Å²	30	50.4 Å²	50.4	11%	0.113	26%	0.262	C	S	.	.	S	Bend	trans	-122.3	17.8	-174	-75.4	-177.2	-173.9	90.8	-16.7	114.4	P62 I63 E76 N88 C89 E90 I94 N112	P62-R92 CarbonylContact C-O 3.26Å; P62-R92 WeakPolarHBondContact CA-O 3.41Å; I63-R92 HydrophobicContact CB-CB 4.23Å; I63-R92 HydrophobicContact CB-CG 4.16Å; I63-R92 PolarHBondContact N-O 3.45Å; E76-R92 WeakPolarHBondContact O-CD 3.28Å; N88-R92 VanDerWaalsContact O-CZ 3.28Å; N88-R92 PolarHBondContact O-NH1 2.9Å; N88-R92 PolarHBondContact O-NH2 2.83Å; C89-R92 VanDerWaalsContact CA-NH1 3.26Å; E90-R92 VanDerWaalsContact C-N 3.35Å; E90-R92 WeakPolarHBondContact O-CG 3.44Å; E90-R92 PolarHBondContact O-N 3.45Å; E90-R92 PolarHBondContact O-NH1 3.22Å; E90-R92 IonicContact OE2-NH1 3.73Å; R92-I94 HydrophobicContact CB-CD1 4.09Å; R92-I94 HydrophobicContact CB-CG1 3.9Å; R92-I94 PolarHBondContact O-N 3.37Å; R92-I94 VanDerWaalsContact O-N 3.11Å; R92-N112 PolarHBondContact N-OD1 3.17Å
93	N	96.6	Very high	96.6	Very high	29 Å²	29	47.1 Å²	47.1	16%	0.155	23%	0.234	C	C	.	.			trans	54.4	27.6	-178.9	-50.8	-35.2	0	0	0	113.4	P60 P61 N112 Y113	P60-N93 WeakPolarHBondContact CB-ND2 3.12Å; P60-N93 HydrophobicContact CG-CB 4.19Å; P61-N93 WeakPolarHBondContact O-CB 3.01Å; P61-N93 PolarHBondContact O-ND2 3.42Å; P61-N93 VanDerWaalsContact O-ND2 3.16Å; N93-N112 PolarHBondContact N-OD1 2.95Å; N93-Y113 HydrophobicContact CB-CD2 3.96Å; N93-Y113 HydrophobicContact CB-CE2 3.85Å; N93-Y113 WeakPolarHBondContact OD1-CE2 3.32Å
94	I	96.3	Very high	96.7	Very high	3 Å²	3	40 Å²	40	2%	0.015	21%	0.206	C	C	.	.			trans	-67.3	138.3	-178.8	-63.2	176.3	0	0	0	109.1	E76 C89 R92 V96 L109 N112 Y113 I114	E76-I94 HydrophobicContact CB-CD1 4.19Å; E76-I94 HydrophobicContact CB-CG1 4.28Å; E76-I94 HydrophobicContact CG-CD1 3.89Å; E76-I94 HydrophobicContact CG-CG1 4.24Å; C89-I94 HydrophobicContact CB-CD1 3.63Å; C89-I94 VanDerWaalsContact O-CD1 3.3Å; C89-I94 WeakPolarHBondContact O-CD1 3.36Å; R92-I94 HydrophobicContact CB-CD1 4.09Å; R92-I94 HydrophobicContact CB-CG1 3.9Å; R92-I94 PolarHBondContact O-N 3.37Å; R92-I94 VanDerWaalsContact O-N 3.11Å; I94-V96 WeakPolarHBondContact CG2-O 3.35Å; I94-L109 HydrophobicContact CD1-CD2 4.42Å; I94-N112 HydrophobicContact CB-CB 4.19Å; I94-N112 PolarHBondContact N-OD1 2.03Å; I94-N112 WeakPolarHBondContact O-CB 3.31Å; I94-Y113 CarbonylContact O-C 3.52Å; I94-Y113 VanDerWaalsContact O-C 3.32Å; I94-Y113 WeakPolarHBondContact O-CA 3.32Å; I94-Y113 PolarHBondContact O-N 2.04Å; I94-I114 HydrophobicContact CG2-CD1 4.43Å; I94-I114 HydrophobicContact CG2-CG1 4.22Å; I94-I114 PolarHBondContact O-N 2.73Å
95	R	94.7	Very high	96.9	Very high	95 Å²	95	39.8 Å²	39.8	36%	0.358	20%	0.201	S	C	.	.			trans	-110.7	-28.3	-179.5	-54.3	-173.1	-167.2	-171	9.9	113.1	F59 I114	F59-R95 PolarHBondContact O-NH2 3.17Å; R95-I114 WeakPolarHBondContact O-CA 3.08Å
96	V	95.8	Very high	97	Very high	101 Å²	101	42 Å²	42	61%	0.612	21%	0.206	S	C	*	.	S	Bend	trans	-129.3	135.6	-179.8	-179.1	0	0	0	0	107.3	I94	I94-V96 WeakPolarHBondContact CG2-O 3.35Å
97	V	97.4	Very high	97.1	Very high	10 Å²	10	41.1 Å²	41.1	6%	0.061	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-63	125.4	177.8	-177.2	0	0	0	0	108.7	I100 L109 I114 L117 A121 F122	V97-I100 HydrophobicContact CG1-CD1 3.92Å; V97-I100 HydrophobicContact CG1-CG1 4.39Å; V97-L109 HydrophobicContact CG1-CD1 3.87Å; V97-L109 HydrophobicContact CG2-CD1 4.28Å; V97-I114 HydrophobicContact CG2-CD1 4.17Å; V97-I114 HydrophobicContact CG2-CG2 3.94Å; V97-L117 HydrophobicContact CG2-CD1 4.41Å; V97-L117 HydrophobicContact CG2-CG 4.4Å; V97-A121 HydrophobicContact CB-CB 4.05Å; V97-A121 HydrophobicContact CG1-CB 3.91Å; V97-F122 HydrophobicContact CG1-CE2 4.32Å; V97-F122 HydrophobicContact CG1-CZ 4.18Å
98	P	96.6	Very high	97.1	Very high	11 Å²	11	44 Å²	44	7%	0.071	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-68.2	165.4	176.5	27.5	-33.3	0	0	0	111.3	P74 E76 I100	P74-P98 HydrophobicContact CB-CB 3.64Å; P74-P98 HydrophobicContact CB-CG 3.99Å; P74-P98 HydrophobicContact CG-CB 3.74Å; P74-P98 HydrophobicContact CG-CG 3.99Å; E76-P98 HydrophobicContact CG-CB 4.43Å; E76-P98 HydrophobicContact CG-CG 4.35Å; P98-I100 VanDerWaalsContact O-CD1 3.31Å; P98-I100 WeakPolarHBondContact O-CD1 3.34Å; P98-I100 PolarHBondContact O-N 3.01Å
99	V	97.2	Very high	97.2	Very high	94 Å²	94	43 Å²	43	57%	0.57	21%	0.205	S	C	*	.	P	Polyproline II helix	trans	-60.5	123.3	171.7	180	0	0	0	0	109.3	P74 P101	P74-V99 WeakPolarHBondContact CG-O 2.8Å; V99-P101 WeakPolarHBondContact O-CD 3.29Å
100	I	97.8	Very high	97.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-84.2	124.5	-175.2	-54.7	-56.2	0	0	0	109.8	L87 V97 P98 T104 L107 A121 F122 A125 V128	L87-I100 HydrophobicContact CD2-CD1 3.7Å; L87-I100 HydrophobicContact CD2-CG2 4.38Å; V97-I100 HydrophobicContact CG1-CD1 3.92Å; V97-I100 HydrophobicContact CG1-CG1 4.39Å; P98-I100 VanDerWaalsContact O-CD1 3.31Å; P98-I100 WeakPolarHBondContact O-CD1 3.34Å; P98-I100 PolarHBondContact O-N 3.01Å; I100-T104 HydrophobicContact CG2-CG2 3.96Å; I100-L107 HydrophobicContact CD1-CD1 3.75Å; I100-L107 HydrophobicContact CD1-CD2 3.7Å; I100-L107 HydrophobicContact CD1-CG 4.39Å; I100-L107 HydrophobicContact CG1-CD2 4.14Å; I100-A121 WeakPolarHBondContact CB-O 3.38Å; I100-A121 WeakPolarHBondContact CG1-O 3.25Å; I100-A121 PolarHBondContact N-O 3.31Å; I100-F122 HydrophobicContact CG1-CD1 4.22Å; I100-F122 HydrophobicContact CG1-CE1 4.24Å; I100-A125 HydrophobicContact CB-CB 3.88Å; I100-A125 HydrophobicContact CG2-CB 3.73Å; I100-V128 HydrophobicContact CG2-CG2 4.28Å
101	P	96.8	Very high	97.3	Very high	7 Å²	7	45.1 Å²	45.1	5%	0.045	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-60.4	145.5	176	-25.3	35.2	0	0	0	112.6	D72 V99 R103 T104	D72-P101 WeakPolarHBondContact O-CG 3.43Å; V99-P101 WeakPolarHBondContact O-CD 3.29Å; P101-R103 HydrophobicContact CB-CG 4.42Å; P101-R103 PolarHBondContact O-N 3.42Å; P101-R103 VanDerWaalsContact O-N 3.17Å; P101-T104 WeakPolarHBondContact CD-OG1 3.3Å; P101-T104 VanDerWaalsContact O-CB 3.25Å; P101-T104 WeakPolarHBondContact O-CB 3.04Å; P101-T104 PolarHBondContact O-N 2.83Å; P101-T104 PolarHBondContact O-OG1 2.8Å
102	F	96.2	Very high	97.3	Very high	130 Å²	130	41 Å²	41	57%	0.57	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.4	-174.3	73.7	-84.9	0	0	0	114.8	T104 N124	F102-T104 VanDerWaalsContact C-N 3.25Å; F102-T104 PolarHBondContact O-N 3.27Å; F102-N124 VanDerWaalsContact CA-O 3.22Å; F102-N124 WeakPolarHBondContact CA-O 3.3Å; F102-N124 HydrophobicContact CB-CB 4.29Å; F102-N124 WeakPolarHBondContact CB-O 3.26Å
103	R	95.3	Very high	97.3	Very high	34 Å²	34	42.9 Å²	42.9	13%	0.128	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-7.3	178.5	66	175.2	176.3	-77.6	-10.8	114	D72 P84 N85 P101 H105	D72-R103 IonicContact OD1-CZ 3.68Å; D72-R103 IonicContact OD1-NH1 2.9Å; D72-R103 PolarHBondContact OD1-NH1 3.01Å; D72-R103 IonicContact OD1-NH2 2.79Å; D72-R103 PolarHBondContact OD1-NH2 3.19Å; D72-R103 IonicContact OD2-CZ 2.73Å; D72-R103 IonicContact OD2-NH1 3.21Å; D72-R103 PolarHBondContact OD2-NH1 3Å; D72-R103 IonicContact OD2-NH2 3.89Å; P84-R103 WeakPolarHBondContact O-CD 3.36Å; P84-R103 PolarHBondContact O-NE 3.17Å; N85-R103 WeakPolarHBondContact CA-O 3.02Å; N85-R103 WeakPolarHBondContact CB-O 3.43Å; N85-R103 PolarHBondContact OD1-O 3.37Å; P101-R103 HydrophobicContact CB-CG 4.42Å; P101-R103 PolarHBondContact O-N 3.42Å; P101-R103 VanDerWaalsContact O-N 3.17Å; R103-H105 PolarHBondContact O-N 2.79Å; R103-H105 PolarHBondContact O-ND1 3.48Å
104	T	97.9	Very high	97.4	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	20%	0.196	C	C	.	.			trans	-68.7	122.5	-172	-52.4	0	0	0	0	110.3	L87 I100 P101 F102 L107 E127 V128	L87-T104 HydrophobicContact CB-CG2 3.69Å; I100-T104 HydrophobicContact CG2-CG2 3.96Å; P101-T104 WeakPolarHBondContact CD-OG1 3.3Å; P101-T104 VanDerWaalsContact O-CB 3.25Å; P101-T104 WeakPolarHBondContact O-CB 3.04Å; P101-T104 PolarHBondContact O-N 2.83Å; P101-T104 PolarHBondContact O-OG1 2.8Å; F102-T104 VanDerWaalsContact C-N 3.25Å; F102-T104 PolarHBondContact O-N 3.27Å; T104-L107 HydrophobicContact CG2-CB 4.35Å; T104-E127 CarbonylContact O-C 3.56Å; T104-V128 HydrophobicContact CG2-CG2 4.31Å; T104-V128 WeakPolarHBondContact O-CA 3.5Å; T104-V128 VanDerWaalsContact O-CG2 3.23Å; T104-V128 WeakPolarHBondContact O-CG2 3.27Å; T104-V128 PolarHBondContact O-N 2.97Å
105	H	98.5	Very high	97.4	Very high	47 Å²	47	44.1 Å²	44.1	22%	0.218	21%	0.214	C	C	.	.	S	Bend	trans	-105.9	-35.5	171.1	-69.3	66	0	0	0	111.3	N85 R103 R129 W130	N85-H105 HydrophobicContact CB-CB 4.12Å; N85-H105 WeakPolarHBondContact CB-ND1 3.47Å; N85-H105 PolarHBondContact ND2-ND1 3.08Å; N85-H105 PolarHBondContact O-N 2.93Å; R103-H105 PolarHBondContact O-N 2.79Å; R103-H105 PolarHBondContact O-ND1 3.48Å; H105-R129 PolarHBondContact O-N 3.26Å; H105-W130 PolarHBondContact O-N 2.96Å; H105-W130 VanDerWaalsContact O-N 3.08Å
106	Y	98.7	Very high	97.6	Very high	106 Å²	106	44.2 Å²	44.2	42%	0.416	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.7	-176.5	-52.5	-85.9	0	0	0	110	N85 S86 L87 W130	N85-Y106 PolarHBondContact O-N 3.36Å; S86-Y106 WeakPolarHBondContact CA-O 3.26Å; L87-Y106 PolarHBondContact N-O 3.17Å; Y106-W130 HydrophobicContact CD1-CB 3.72Å; Y106-W130 HydrophobicContact CD1-CG 4.21Å; Y106-W130 HydrophobicContact CE1-CB 4.31Å
107	L	98.4	Very high	97.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.8	-177	179.7	57.3	0	0	0	111.1	L87 I100 T104 L109 F122 W130 I131 N132	L87-L107 HydrophobicContact CB-CD1 4.06Å; L87-L107 HydrophobicContact CD2-CD1 3.63Å; L87-L107 HydrophobicContact CG-CD1 3.93Å; I100-L107 HydrophobicContact CD1-CD1 3.75Å; I100-L107 HydrophobicContact CD1-CD2 3.7Å; I100-L107 HydrophobicContact CD1-CG 4.39Å; I100-L107 HydrophobicContact CG1-CD2 4.14Å; T104-L107 HydrophobicContact CG2-CB 4.35Å; L107-L109 HydrophobicContact CD1-CD1 3.8Å; L107-L109 HydrophobicContact CD1-CG 3.93Å; L107-L109 HydrophobicContact CD2-CD1 3.58Å; L107-L109 HydrophobicContact CG-CD1 3.58Å; L107-L109 HydrophobicContact CG-CG 4.01Å; L107-F122 HydrophobicContact CD2-CE1 3.9Å; L107-F122 HydrophobicContact CD2-CZ 4.4Å; L107-W130 PolarHBondContact N-O 3.09Å; L107-W130 WeakPolarHBondContact O-CZ3 3.05Å; L107-I131 HydrophobicContact CB-CG1 4.22Å; L107-I131 HydrophobicContact CD2-CG1 4.26Å; L107-I131 HydrophobicContact CD2-CG2 4.31Å; L107-N132 PolarHBondContact O-N 3.03Å
108	Y	98.7	Very high	97.7	Very high	63 Å²	63	41.1 Å²	41.1	25%	0.247	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	107.9	179.5	-57.6	-91.8	0	0	0	109.8	L87 N88 C89 E90 W130	L87-Y108 PolarHBondContact O-N 3.3Å; N88-Y108 VanDerWaalsContact OD1-CD2 3.32Å; N88-Y108 WeakPolarHBondContact OD1-CD2 3.5Å; C89-Y108 CarbonylContact C-O 3.49Å; C89-Y108 VanDerWaalsContact C-O 3.31Å; C89-Y108 VanDerWaalsContact CA-O 3.25Å; C89-Y108 WeakPolarHBondContact CA-O 3.28Å; C89-Y108 VanDerWaalsContact CB-O 3.27Å; C89-Y108 WeakPolarHBondContact CB-O 3.46Å; C89-Y108 PolarHBondContact N-O 2.91Å; E90-Y108 PolarHBondContact N-O 3.32Å; Y108-W130 HydrophobicContact CD1-CE3 4.48Å; Y108-W130 AromaticContact CD1-CH2 3.43Å; Y108-W130 HydrophobicContact CD1-CH2 3.43Å; Y108-W130 VanDerWaalsContact CD1-CH2 3.43Å; Y108-W130 AromaticContact CD1-CZ3 3.31Å; Y108-W130 HydrophobicContact CD1-CZ3 3.31Å; Y108-W130 HydrophobicContact CD2-CZ3 4.39Å; Y108-W130 HydrophobicContact CE1-CE3 4.24Å; Y108-W130 AromaticContact CE1-CH2 3.26Å; Y108-W130 HydrophobicContact CE1-CH2 3.26Å; Y108-W130 HydrophobicContact CE1-CZ2 4.25Å; Y108-W130 AromaticContact CE1-CZ3 3.3Å; Y108-W130 HydrophobicContact CE1-CZ3 3.3Å; Y108-W130 HydrophobicContact CE2-CZ3 4.39Å; Y108-W130 HydrophobicContact CG-CH2 4.42Å; Y108-W130 AromaticContact CG-CZ3 3.89Å; Y108-W130 HydrophobicContact CG-CZ3 3.89Å; Y108-W130 AromaticContact CZ-CZ3 3.87Å
109	L	98.6	Very high	97.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.198	C	C	.	.			trans	-127	11	-178.4	-76.6	162.5	0	0	0	112.1	C89 I94 V97 L107 N112 I114 N132 L133 N136	C89-L109 HydrophobicContact CB-CD2 3.44Å; C89-L109 VanDerWaalsContact CB-CD2 3.44Å; C89-L109 HydrophobicContact CB-CG 4.18Å; I94-L109 HydrophobicContact CD1-CD2 4.42Å; V97-L109 HydrophobicContact CG1-CD1 3.87Å; V97-L109 HydrophobicContact CG2-CD1 4.28Å; L107-L109 HydrophobicContact CD1-CD1 3.8Å; L107-L109 HydrophobicContact CD1-CG 3.93Å; L107-L109 HydrophobicContact CD2-CD1 3.58Å; L107-L109 HydrophobicContact CG-CD1 3.58Å; L107-L109 HydrophobicContact CG-CG 4.01Å; L109-N112 PolarHBondContact O-ND2 3.37Å; L109-I114 HydrophobicContact CB-CD1 4Å; L109-I114 HydrophobicContact CD2-CD1 3.94Å; L109-I114 HydrophobicContact CG-CD1 4.4Å; L109-N132 CarbonylContact C-O 3.52Å; L109-N132 WeakPolarHBondContact CA-O 3.37Å; L109-N132 PolarHBondContact N-O 3.28Å; L109-L133 HydrophobicContact CB-CD2 3.59Å; L109-L133 HydrophobicContact CB-CG 4.31Å; L109-L133 HydrophobicContact CD1-CD2 3.75Å; L109-L133 HydrophobicContact CG-CD2 4.32Å; L109-N136 PolarHBondContact O-ND2 3.35Å
110	Q	98.7	Very high	97.7	Very high	31 Å²	31	41.9 Å²	41.9	15%	0.145	20%	0.197	C	C	.	.			trans	-64.1	155.7	-178.9	68.1	-81.5	4	0	0	113	E90 N91 N112 N132 A134	E90-Q110 VanDerWaalsContact CA-O 3.25Å; E90-Q110 WeakPolarHBondContact CA-O 3.35Å; E90-Q110 HydrophobicContact CB-CG 3.95Å; E90-Q110 WeakPolarHBondContact CB-O 3.25Å; N91-Q110 PolarHBondContact N-O 3.28Å; N91-Q110 VanDerWaalsContact N-O 3.17Å; Q110-N112 PolarHBondContact O-ND2 3.42Å; Q110-N132 PolarHBondContact N-O 3.39Å; Q110-N132 VanDerWaalsContact N-O 3.17Å; Q110-N132 PolarHBondContact OE1-ND2 3.47Å; Q110-A134 CarbonylContact C-O 3.43Å; Q110-A134 WeakPolarHBondContact CA-O 3.13Å; Q110-A134 HydrophobicContact CB-CB 4.18Å; Q110-A134 VanDerWaalsContact CB-O 3.26Å; Q110-A134 WeakPolarHBondContact CB-O 3.24Å
111	N	98.4	Very high	97.6	Very high	63 Å²	63	42.1 Å²	42.1	34%	0.337	20%	0.199	S	C	.	.	S	Bend	trans	58.6	52.4	178	-51.7	-33.5	0	0	0	112.9	N91 A134 N135	N91-N111 WeakPolarHBondContact CA-O 3.05Å; N91-N111 PolarHBondContact N-O 3.42Å; N91-N111 WeakPolarHBondContact OD1-CB 3.49Å; N91-N111 PolarHBondContact OD1-ND2 3.36Å; N111-A134 PolarHBondContact N-O 3.39Å; N111-N135 VanDerWaalsContact CA-O 3.29Å; N111-N135 WeakPolarHBondContact CA-O 3.27Å; N111-N135 PolarHBondContact N-O 2.94Å; N111-N135 WeakPolarHBondContact OD1-CB 3.08Å; N111-N135 PolarHBondContact OD1-ND2 3.44Å
112	N	98.3	Very high	97.7	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.027	20%	0.197	C	C	.	.	S	Bend	trans	-128.4	-169.3	175.4	-79.2	-60.2	0	0	0	109.5	C89 R92 N93 I94 L109 Q110 I114 N135 N136	C89-N112 PolarHBondContact O-ND2 3.09Å; R92-N112 PolarHBondContact N-OD1 3.17Å; N93-N112 PolarHBondContact N-OD1 2.95Å; I94-N112 HydrophobicContact CB-CB 4.19Å; I94-N112 PolarHBondContact N-OD1 2.03Å; I94-N112 WeakPolarHBondContact O-CB 3.31Å; L109-N112 PolarHBondContact O-ND2 3.37Å; Q110-N112 PolarHBondContact O-ND2 3.42Å; N112-I114 HydrophobicContact CB-CD1 4.15Å; N112-I114 HydrophobicContact CB-CG1 4.12Å; N112-N135 PolarHBondContact N-O 3.26Å; N112-N136 VanDerWaalsContact CA-OD1 3.27Å; N112-N136 WeakPolarHBondContact CA-OD1 3.03Å; N112-N136 WeakPolarHBondContact CB-OD1 3.26Å; N112-N136 PolarHBondContact N-OD1 3.48Å; N112-N136 PolarHBondContact O-OD1 2.98Å; N112-N136 VanDerWaalsContact O-OD1 3.13Å
113	Y	97.4	Very high	97.7	Very high	69 Å²	69	39.3 Å²	39.3	27%	0.271	19%	0.19	S	C	.	.			trans	-114	31	178.4	-57.7	-64.8	0	0	0	111.9	F59 P60 N93 I94 S115 N136	F59-Y113 HydrophobicContact CB-CD2 4.37Å; F59-Y113 AromaticContact CD1-CD1 3.55Å; F59-Y113 HydrophobicContact CD1-CD1 3.55Å; F59-Y113 AromaticContact CD1-CD2 3.81Å; F59-Y113 HydrophobicContact CD1-CD2 3.81Å; F59-Y113 AromaticContact CD1-CE1 3.93Å; F59-Y113 HydrophobicContact CD1-CE1 3.93Å; F59-Y113 HydrophobicContact CD1-CE2 4.18Å; F59-Y113 AromaticContact CD1-CG 3.48Å; F59-Y113 HydrophobicContact CD1-CG 3.48Å; F59-Y113 VanDerWaalsContact CD1-CG 3.48Å; F59-Y113 AromaticContact CE1-CD1 3.55Å; F59-Y113 HydrophobicContact CE1-CD1 3.55Å; F59-Y113 HydrophobicContact CE1-CE1 4.14Å; F59-Y113 AromaticContact CE1-CG 3.78Å; F59-Y113 HydrophobicContact CE1-CG 3.78Å; F59-Y113 HydrophobicContact CG-CD2 4.49Å; F59-Y113 HydrophobicContact CG-CG 4.42Å; P60-Y113 HydrophobicContact CG-CE2 3.88Å; N93-Y113 HydrophobicContact CB-CD2 3.96Å; N93-Y113 HydrophobicContact CB-CE2 3.85Å; N93-Y113 WeakPolarHBondContact OD1-CE2 3.32Å; I94-Y113 CarbonylContact O-C 3.52Å; I94-Y113 VanDerWaalsContact O-C 3.32Å; I94-Y113 WeakPolarHBondContact O-CA 3.32Å; I94-Y113 PolarHBondContact O-N 2.04Å; Y113-S115 PolarHBondContact O-N 3.31Å; Y113-N136 PolarHBondContact N-OD1 2.79Å
114	I	98.1	Very high	97.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.			trans	-67.4	126.9	-177.7	-58.8	162.5	0	0	0	109.1	I94 R95 V97 L109 N112 E116 L117 L133 N136 R137 I138	I94-I114 HydrophobicContact CG2-CD1 4.43Å; I94-I114 HydrophobicContact CG2-CG1 4.22Å; I94-I114 PolarHBondContact O-N 2.73Å; R95-I114 WeakPolarHBondContact O-CA 3.08Å; V97-I114 HydrophobicContact CG2-CD1 4.17Å; V97-I114 HydrophobicContact CG2-CG2 3.94Å; L109-I114 HydrophobicContact CB-CD1 4Å; L109-I114 HydrophobicContact CD2-CD1 3.94Å; L109-I114 HydrophobicContact CG-CD1 4.4Å; N112-I114 HydrophobicContact CB-CD1 4.15Å; N112-I114 HydrophobicContact CB-CG1 4.12Å; I114-E116 WeakPolarHBondContact CG2-O 3.35Å; I114-L117 HydrophobicContact CG2-CD1 4.2Å; I114-L133 HydrophobicContact CD1-CD2 3.99Å; I114-N136 HydrophobicContact CB-CB 4.36Å; I114-N136 WeakPolarHBondContact CB-OD1 3.26Å; I114-N136 WeakPolarHBondContact CG1-OD1 3.32Å; I114-N136 PolarHBondContact N-OD1 3.24Å; I114-R137 CarbonylContact O-C 3.35Å; I114-R137 WeakPolarHBondContact O-CA 3.49Å; I114-R137 PolarHBondContact O-N 3.01Å; I114-I138 HydrophobicContact CB-CG1 4.36Å; I114-I138 HydrophobicContact CG2-CG1 4.11Å; I114-I138 WeakPolarHBondContact O-CG1 3.35Å; I114-I138 PolarHBondContact O-N 2.9Å; I114-I138 VanDerWaalsContact O-N 3.08Å
115	S	97	Very high	97.5	Very high	57 Å²	57	42.2 Å²	42.2	40%	0.399	21%	0.208	S	C	.	.			trans	-101.9	-24	-177.9	53.9	0	0	0	0	113.9	Y113 R137 I138 Q139	Y113-S115 PolarHBondContact O-N 3.31Å; S115-R137 WeakPolarHBondContact CA-O 3.18Å; S115-I138 WeakPolarHBondContact O-CA 3.21Å; S115-Q139 PolarHBondContact O-N 2.91Å
116	E	97.5	Very high	97.4	Very high	98 Å²	98	43.6 Å²	43.6	46%	0.458	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	156.9	-178.7	64	-177	173	0	0	112.5	I114 T118 K140	I114-E116 WeakPolarHBondContact CG2-O 3.35Å; E116-T118 HydrophobicContact CG-CG2 4.26Å; E116-K140 VanDerWaalsContact CA-O 3.28Å; E116-K140 WeakPolarHBondContact CA-O 3.45Å
117	L	97.9	Very high	97.3	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.4	169.5	-88.8	65.6	0	0	0	109.5	V97 I114 F122 L133 I138 K140 I141 D142 V145 F155	V97-L117 HydrophobicContact CG2-CD1 4.41Å; V97-L117 HydrophobicContact CG2-CG 4.4Å; I114-L117 HydrophobicContact CG2-CD1 4.2Å; L117-F122 HydrophobicContact CD2-CE2 4.36Å; L117-F122 HydrophobicContact CD2-CZ 4.32Å; L117-F122 HydrophobicContact CG-CE2 4.34Å; L117-L133 HydrophobicContact CD1-CD1 4.05Å; L117-L133 HydrophobicContact CD1-CD2 4.23Å; L117-L133 HydrophobicContact CD2-CD1 3.57Å; L117-L133 HydrophobicContact CG-CD1 4.32Å; L117-I138 HydrophobicContact CD1-CD1 3.62Å; L117-I138 HydrophobicContact CD1-CG1 4.03Å; L117-I138 HydrophobicContact CD1-CG2 4.12Å; L117-K140 PolarHBondContact N-O 3.44Å; L117-K140 VanDerWaalsContact N-O 3.09Å; L117-I141 HydrophobicContact CB-CB 4.36Å; L117-I141 HydrophobicContact CB-CG1 4.23Å; L117-I141 HydrophobicContact CB-CG2 4Å; L117-I141 HydrophobicContact CD2-CD1 4.35Å; L117-I141 HydrophobicContact CD2-CG1 4.36Å; L117-I141 HydrophobicContact CD2-CG2 4.15Å; L117-D142 PolarHBondContact O-N 3.28Å; L117-V145 HydrophobicContact CB-CG2 4.23Å; L117-F155 HydrophobicContact CD2-CZ 4.45Å
118	T	96.9	Very high	97.3	Very high	43 Å²	43	42.2 Å²	42.2	26%	0.264	22%	0.216	S	C	.	.			trans	-113.8	154	176.7	79.7	0	0	0	0	110.5	E116 E120 F122	E116-T118 HydrophobicContact CG-CG2 4.26Å; T118-E120 VanDerWaalsContact C-N 3.27Å; T118-E120 WeakPolarHBondContact CB-OE2 3.49Å; T118-E120 PolarHBondContact O-N 2.9Å; T118-E120 PolarHBondContact OG1-OE2 3.46Å; T118-F122 WeakPolarHBondContact O-CD2 3.47Å
119	A	97.1	Very high	97.3	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.033	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-68.6	-26.6	-174.4	0	0	0	0	0	113.1	A121 F122 N123 Q144 V145	A119-A121 VanDerWaalsContact C-N 3.3Å; A119-A121 PolarHBondContact O-N 2.7Å; A119-F122 PolarHBondContact O-N 3.13Å; A119-N123 PolarHBondContact O-N 3.11Å; A119-Q144 HydrophobicContact CB-CB 3.76Å; A119-V145 HydrophobicContact CB-CG2 4.5Å
120	E	96.7	Very high	97.3	Very high	116 Å²	116	45 Å²	45	54%	0.542	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-60.7	-39.3	-174.9	-62.3	76.5	-166.4	0	0	112.3	T118 F122 N123	T118-E120 VanDerWaalsContact C-N 3.27Å; T118-E120 WeakPolarHBondContact CB-OE2 3.49Å; T118-E120 PolarHBondContact O-N 2.9Å; T118-E120 PolarHBondContact OG1-OE2 3.46Å; E120-F122 PolarHBondContact O-N 3.02Å; E120-N123 PolarHBondContact O-N 2.95Å; E120-N123 PolarHBondContact O-ND2 2.89Å
121	A	96.9	Very high	97.3	Very high	5 Å²	5	43.6 Å²	43.6	4%	0.041	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-61.1	-28.1	178	0	0	0	0	0	112.4	V97 I100 A119	V97-A121 HydrophobicContact CB-CB 4.05Å; V97-A121 HydrophobicContact CG1-CB 3.91Å; I100-A121 WeakPolarHBondContact CB-O 3.38Å; I100-A121 WeakPolarHBondContact CG1-O 3.25Å; I100-A121 PolarHBondContact N-O 3.31Å; A119-A121 VanDerWaalsContact C-N 3.3Å; A119-A121 PolarHBondContact O-N 2.7Å
122	F	97.8	Very high	97.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-101.7	3.2	-174.1	-63.7	-88.6	0	0	0	113.9	V97 I100 L107 L117 T118 A119 E120 N124 A125 I131 V145 K148 I149	V97-F122 HydrophobicContact CG1-CE2 4.32Å; V97-F122 HydrophobicContact CG1-CZ 4.18Å; I100-F122 HydrophobicContact CG1-CD1 4.22Å; I100-F122 HydrophobicContact CG1-CE1 4.24Å; L107-F122 HydrophobicContact CD2-CE1 3.9Å; L107-F122 HydrophobicContact CD2-CZ 4.4Å; L117-F122 HydrophobicContact CD2-CE2 4.36Å; L117-F122 HydrophobicContact CD2-CZ 4.32Å; L117-F122 HydrophobicContact CG-CE2 4.34Å; T118-F122 WeakPolarHBondContact O-CD2 3.47Å; A119-F122 PolarHBondContact O-N 3.13Å; E120-F122 PolarHBondContact O-N 3.02Å; F122-N124 PolarHBondContact O-N 3.47Å; F122-A125 HydrophobicContact CB-CB 4.19Å; F122-A125 HydrophobicContact CD1-CB 4.16Å; F122-A125 VanDerWaalsContact O-CB 3.3Å; F122-A125 WeakPolarHBondContact O-CB 3.21Å; F122-A125 PolarHBondContact O-N 3.2Å; F122-I131 HydrophobicContact CE1-CD1 3.87Å; F122-V145 HydrophobicContact CD2-CG1 3.7Å; F122-V145 HydrophobicContact CD2-CG2 4.28Å; F122-V145 HydrophobicContact CE2-CG1 3.87Å; F122-V145 HydrophobicContact CG-CG1 4.07Å; F122-V145 HydrophobicContact CZ-CG1 4.37Å; F122-K148 HydrophobicContact CB-CB 3.87Å; F122-K148 HydrophobicContact CB-CG 4.4Å; F122-K148 WeakPolarHBondContact O-CB 3.29Å; F122-I149 HydrophobicContact CB-CG2 4.28Å; F122-I149 HydrophobicContact CD1-CD1 4.47Å; F122-I149 HydrophobicContact CD1-CG2 3.89Å; F122-I149 HydrophobicContact CG-CG2 4.45Å
123	N	96.1	Very high	97.4	Very high	79 Å²	79	41.4 Å²	41.4	42%	0.422	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-34.8	-173.1	-87.1	-29.1	0	0	0	114.9	A119 E120 K148	A119-N123 PolarHBondContact O-N 3.11Å; E120-N123 PolarHBondContact O-N 2.95Å; E120-N123 PolarHBondContact O-ND2 2.89Å; N123-K148 WeakPolarHBondContact OD1-CE 3.41Å; N123-K148 PolarHBondContact OD1-NZ 2.9Å
124	N	94.4	Very high	97.4	Very high	98 Å²	98	38.7 Å²	38.7	52%	0.524	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-0.9	179.6	-63.9	-25.6	0	0	0	113.1	F102 F122 T126	F102-N124 VanDerWaalsContact CA-O 3.22Å; F102-N124 WeakPolarHBondContact CA-O 3.3Å; F102-N124 HydrophobicContact CB-CB 4.29Å; F102-N124 WeakPolarHBondContact CB-O 3.26Å; F122-N124 PolarHBondContact O-N 3.47Å; N124-T126 PolarHBondContact O-N 3.06Å
125	A	95.8	Very high	97.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.			trans	-86.7	35.7	-164.4	0	0	0	0	0	113.9	I100 F122 E127 V128 I149	I100-A125 HydrophobicContact CB-CB 3.88Å; I100-A125 HydrophobicContact CG2-CB 3.73Å; F122-A125 HydrophobicContact CB-CB 4.19Å; F122-A125 HydrophobicContact CD1-CB 4.16Å; F122-A125 VanDerWaalsContact O-CB 3.3Å; F122-A125 WeakPolarHBondContact O-CB 3.21Å; F122-A125 PolarHBondContact O-N 3.2Å; A125-E127 PolarHBondContact O-N 3.03Å; A125-E127 VanDerWaalsContact O-N 3.11Å; A125-V128 HydrophobicContact CB-CG2 3.76Å; A125-V128 WeakPolarHBondContact O-CB 3.35Å; A125-V128 WeakPolarHBondContact O-CG2 3.45Å; A125-V128 PolarHBondContact O-N 3.19Å; A125-V128 VanDerWaalsContact O-N 3.14Å; A125-I149 HydrophobicContact CB-CG2 4.11Å; A125-I149 WeakPolarHBondContact O-CG2 3.35Å
126	T	95.8	Very high	97.6	Very high	75 Å²	75	40.1 Å²	40.1	46%	0.46	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.7	-167.7	55.8	0	0	0	0	114.4	N124	N124-T126 PolarHBondContact O-N 3.06Å
127	E	97.3	Very high	97.6	Very high	77 Å²	77	39.1 Å²	39.1	36%	0.36	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	2.2	-179.1	-65.6	-58.7	155.5	0	0	114.4	T104 A125 R129	T104-E127 CarbonylContact O-C 3.56Å; A125-E127 PolarHBondContact O-N 3.03Å; A125-E127 VanDerWaalsContact O-N 3.11Å; E127-R129 WeakPolarHBondContact O-CG 3.32Å; E127-R129 PolarHBondContact O-N 3.49Å; E127-R129 PolarHBondContact O-NE 3Å; E127-R129 IonicContact OE2-CZ 3.59Å; E127-R129 IonicContact OE2-NH2 3.56Å; E127-R129 PolarHBondContact OE2-NH2 3.48Å
128	V	98.6	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.			trans	-64	123.8	-179.4	174.9	0	0	0	0	110.5	I100 T104 A125 I131 I149 G151 L152	I100-V128 HydrophobicContact CG2-CG2 4.28Å; T104-V128 HydrophobicContact CG2-CG2 4.31Å; T104-V128 WeakPolarHBondContact O-CA 3.5Å; T104-V128 VanDerWaalsContact O-CG2 3.23Å; T104-V128 WeakPolarHBondContact O-CG2 3.27Å; T104-V128 PolarHBondContact O-N 2.97Å; A125-V128 HydrophobicContact CB-CG2 3.76Å; A125-V128 WeakPolarHBondContact O-CB 3.35Å; A125-V128 WeakPolarHBondContact O-CG2 3.45Å; A125-V128 PolarHBondContact O-N 3.19Å; A125-V128 VanDerWaalsContact O-N 3.14Å; V128-I131 HydrophobicContact CG1-CD1 3.74Å; V128-I131 HydrophobicContact CG1-CG1 3.4Å; V128-I131 VanDerWaalsContact CG1-CG1 3.4Å; V128-I149 HydrophobicContact CB-CG2 4.11Å; V128-G151 CarbonylContact O-C 3.16Å; V128-L152 HydrophobicContact CG1-CD1 4.09Å; V128-L152 PolarHBondContact O-N 3.41Å
129	R	98.6	Very high	97.6	Very high	85 Å²	85	42.3 Å²	42.3	32%	0.321	21%	0.207	S	C	.	.			trans	-110.2	-25.6	178.8	-54	-54.7	173.6	169.2	-5.9	112.5	H105 E127 G151 L153 Y154	H105-R129 PolarHBondContact O-N 3.26Å; E127-R129 WeakPolarHBondContact O-CG 3.32Å; E127-R129 PolarHBondContact O-N 3.49Å; E127-R129 PolarHBondContact O-NE 3Å; E127-R129 IonicContact OE2-CZ 3.59Å; E127-R129 IonicContact OE2-NH2 3.56Å; E127-R129 PolarHBondContact OE2-NH2 3.48Å; R129-G151 WeakPolarHBondContact CD-O 3.48Å; R129-G151 PolarHBondContact NH1-O 3.03Å; R129-L153 HydrophobicContact CB-CD1 4.33Å; R129-L153 HydrophobicContact CB-CG 4.37Å; R129-L153 WeakPolarHBondContact O-CA 3.33Å; R129-L153 WeakPolarHBondContact O-CB 3.28Å; R129-L153 PolarHBondContact O-N 3.35Å; R129-Y154 PolarHBondContact O-N 3.03Å
130	W	98.8	Very high	97.6	Very high	38 Å²	38	48.5 Å²	48.5	14%	0.144	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	127.3	-172.8	-171.7	104.6	0	0	0	110.4	H105 Y106 L107 Y108 N132 Y154 Y156	H105-W130 PolarHBondContact O-N 2.96Å; H105-W130 VanDerWaalsContact O-N 3.08Å; Y106-W130 HydrophobicContact CD1-CB 3.72Å; Y106-W130 HydrophobicContact CD1-CG 4.21Å; Y106-W130 HydrophobicContact CE1-CB 4.31Å; L107-W130 PolarHBondContact N-O 3.09Å; L107-W130 WeakPolarHBondContact O-CZ3 3.05Å; Y108-W130 HydrophobicContact CD1-CE3 4.48Å; Y108-W130 AromaticContact CD1-CH2 3.43Å; Y108-W130 HydrophobicContact CD1-CH2 3.43Å; Y108-W130 VanDerWaalsContact CD1-CH2 3.43Å; Y108-W130 AromaticContact CD1-CZ3 3.31Å; Y108-W130 HydrophobicContact CD1-CZ3 3.31Å; Y108-W130 HydrophobicContact CD2-CZ3 4.39Å; Y108-W130 HydrophobicContact CE1-CE3 4.24Å; Y108-W130 AromaticContact CE1-CH2 3.26Å; Y108-W130 HydrophobicContact CE1-CH2 3.26Å; Y108-W130 HydrophobicContact CE1-CZ2 4.25Å; Y108-W130 AromaticContact CE1-CZ3 3.3Å; Y108-W130 HydrophobicContact CE1-CZ3 3.3Å; Y108-W130 HydrophobicContact CE2-CZ3 4.39Å; Y108-W130 HydrophobicContact CG-CH2 4.42Å; Y108-W130 AromaticContact CG-CZ3 3.89Å; Y108-W130 HydrophobicContact CG-CZ3 3.89Å; Y108-W130 AromaticContact CZ-CZ3 3.87Å; W130-N132 HydrophobicContact CE3-CB 4.12Å; W130-N132 HydrophobicContact CH2-CB 3.04Å; W130-N132 HydrophobicContact CZ2-CB 3.73Å; W130-N132 HydrophobicContact CZ3-CB 3.24Å; W130-Y154 AromaticContact CD1-CD2 3.75Å; W130-Y154 AromaticContact CD1-CG 3.6Å; W130-Y156 AromaticContact CE2-CD2 3.84Å; W130-Y156 AromaticContact CE2-CE2 3.59Å; W130-Y156 AromaticContact CZ2-CD2 3.67Å; W130-Y156 HydrophobicContact CZ2-CD2 3.67Å; W130-Y156 AromaticContact CZ2-CE2 3.66Å; W130-Y156 HydrophobicContact CZ2-CE2 3.66Å; W130-Y156 AromaticContact NE1-CD2 3.91Å; W130-Y156 AromaticContact NE1-CE2 3.23Å; W130-Y156 AromaticContact NE1-CZ 3.87Å
131	I	98.8	Very high	97.7	Very high	1 Å²	1	44 Å²	44	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.6	176.2	-60	173.6	0	0	0	109.3	L107 F122 V128 L133 I149 L152 Y154 F155 Y156	L107-I131 HydrophobicContact CB-CG1 4.22Å; L107-I131 HydrophobicContact CD2-CG1 4.26Å; L107-I131 HydrophobicContact CD2-CG2 4.31Å; F122-I131 HydrophobicContact CE1-CD1 3.87Å; V128-I131 HydrophobicContact CG1-CD1 3.74Å; V128-I131 HydrophobicContact CG1-CG1 3.4Å; V128-I131 VanDerWaalsContact CG1-CG1 3.4Å; I131-L133 HydrophobicContact CG2-CD1 3.49Å; I131-L133 VanDerWaalsContact CG2-CD1 3.49Å; I131-L133 HydrophobicContact CG2-CG 3.75Å; I131-I149 HydrophobicContact CD1-CD1 3.5Å; I131-I149 VanDerWaalsContact CD1-CD1 3.5Å; I131-L152 HydrophobicContact CB-CD1 4.23Å; I131-L152 HydrophobicContact CD1-CD1 3.73Å; I131-L152 HydrophobicContact CD1-CD2 4.38Å; I131-L152 HydrophobicContact CG1-CD1 3.65Å; I131-Y154 PolarHBondContact N-O 3.4Å; I131-F155 HydrophobicContact CB-CD2 4.11Å; I131-F155 HydrophobicContact CB-CE2 4.42Å; I131-F155 HydrophobicContact CG2-CD2 4.35Å; I131-F155 HydrophobicContact CG2-CE2 4.21Å; I131-Y156 PolarHBondContact O-N 3.11Å
132	N	98.9	Very high	97.6	Very high	22 Å²	22	46.2 Å²	46.2	12%	0.118	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.8	170.3	-176	2.8	0	0	0	111.9	L107 L109 Q110 W130 A134 Y156	L107-N132 PolarHBondContact O-N 3.03Å; L109-N132 CarbonylContact C-O 3.52Å; L109-N132 WeakPolarHBondContact CA-O 3.37Å; L109-N132 PolarHBondContact N-O 3.28Å; Q110-N132 PolarHBondContact N-O 3.39Å; Q110-N132 VanDerWaalsContact N-O 3.17Å; Q110-N132 PolarHBondContact OE1-ND2 3.47Å; W130-N132 HydrophobicContact CE3-CB 4.12Å; W130-N132 HydrophobicContact CH2-CB 3.04Å; W130-N132 HydrophobicContact CZ2-CB 3.73Å; W130-N132 HydrophobicContact CZ3-CB 3.24Å; N132-A134 WeakPolarHBondContact OD1-CB 3.48Å; N132-A134 PolarHBondContact OD1-N 3Å; N132-Y156 HydrophobicContact CB-CD2 4.36Å
133	L	98.8	Very high	97.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.25	C	C	.	.			trans	-118.6	19.1	179.4	-73.8	154.8	0	0	0	111.1	L109 I114 L117 I131 N136 I138 F155 Y156 V157 N160	L109-L133 HydrophobicContact CB-CD2 3.59Å; L109-L133 HydrophobicContact CB-CG 4.31Å; L109-L133 HydrophobicContact CD1-CD2 3.75Å; L109-L133 HydrophobicContact CG-CD2 4.32Å; I114-L133 HydrophobicContact CD1-CD2 3.99Å; L117-L133 HydrophobicContact CD1-CD1 4.05Å; L117-L133 HydrophobicContact CD1-CD2 4.23Å; L117-L133 HydrophobicContact CD2-CD1 3.57Å; L117-L133 HydrophobicContact CG-CD1 4.32Å; I131-L133 HydrophobicContact CG2-CD1 3.49Å; I131-L133 VanDerWaalsContact CG2-CD1 3.49Å; I131-L133 HydrophobicContact CG2-CG 3.75Å; L133-N136 PolarHBondContact O-ND2 2.99Å; L133-I138 HydrophobicContact CB-CD1 3.77Å; L133-I138 HydrophobicContact CD1-CD1 4.31Å; L133-I138 HydrophobicContact CD2-CD1 4Å; L133-I138 HydrophobicContact CG-CD1 4.25Å; L133-F155 HydrophobicContact CD1-CE2 3.84Å; L133-F155 HydrophobicContact CD1-CZ 4.38Å; L133-Y156 PolarHBondContact N-O 3.06Å; L133-V157 HydrophobicContact CB-CG1 3.73Å; L133-V157 HydrophobicContact CD1-CG1 3.89Å; L133-V157 HydrophobicContact CG-CG1 4.48Å; L133-N160 PolarHBondContact O-ND2 3.01Å
134	A	98.8	Very high	97.4	Very high	11 Å²	11	52.7 Å²	52.7	9%	0.091	25%	0.25	C	C	.	.			trans	-57.8	147.7	-177.5	0	0	0	0	0	112	Q110 N111 N132 N136 Q158	Q110-A134 CarbonylContact C-O 3.43Å; Q110-A134 WeakPolarHBondContact CA-O 3.13Å; Q110-A134 HydrophobicContact CB-CB 4.18Å; Q110-A134 VanDerWaalsContact CB-O 3.26Å; Q110-A134 WeakPolarHBondContact CB-O 3.24Å; N111-A134 PolarHBondContact N-O 3.39Å; N132-A134 WeakPolarHBondContact OD1-CB 3.48Å; N132-A134 PolarHBondContact OD1-N 3Å; A134-N136 PolarHBondContact O-ND2 2.8Å; A134-Q158 CarbonylContact C-O 3.31Å; A134-Q158 VanDerWaalsContact CA-O 3.22Å; A134-Q158 WeakPolarHBondContact CA-O 3.36Å; A134-Q158 HydrophobicContact CB-CG 3.88Å; A134-Q158 VanDerWaalsContact CB-NE2 3.29Å
135	N	98.7	Very high	97.5	Very high	76 Å²	76	48.1 Å²	48.1	41%	0.406	23%	0.225	S	C	.	.	S	Bend	trans	56.3	58.7	175.6	-167.8	46.4	0	0	0	112.3	N111 N112 Q158 R159	N111-N135 VanDerWaalsContact CA-O 3.29Å; N111-N135 WeakPolarHBondContact CA-O 3.27Å; N111-N135 PolarHBondContact N-O 2.94Å; N111-N135 WeakPolarHBondContact OD1-CB 3.08Å; N111-N135 PolarHBondContact OD1-ND2 3.44Å; N112-N135 PolarHBondContact N-O 3.26Å; N135-Q158 PolarHBondContact N-O 2.94Å; N135-R159 VanDerWaalsContact CA-O 3.26Å; N135-R159 WeakPolarHBondContact CA-O 3.3Å; N135-R159 HydrophobicContact CB-CB 4.4Å; N135-R159 PolarHBondContact N-O 3.32Å
136	N	98.7	Very high	97.6	Very high	11 Å²	11	48.3 Å²	48.3	6%	0.059	23%	0.226	C	C	.	.	S	Bend	trans	-124.3	-164.4	172.4	-87.6	-80.1	0	0	0	108.9	L109 N112 Y113 I114 L133 A134 I138 R159 N160	L109-N136 PolarHBondContact O-ND2 3.35Å; N112-N136 VanDerWaalsContact CA-OD1 3.27Å; N112-N136 WeakPolarHBondContact CA-OD1 3.03Å; N112-N136 WeakPolarHBondContact CB-OD1 3.26Å; N112-N136 PolarHBondContact N-OD1 3.48Å; N112-N136 PolarHBondContact O-OD1 2.98Å; N112-N136 VanDerWaalsContact O-OD1 3.13Å; Y113-N136 PolarHBondContact N-OD1 2.79Å; I114-N136 HydrophobicContact CB-CB 4.36Å; I114-N136 WeakPolarHBondContact CB-OD1 3.26Å; I114-N136 WeakPolarHBondContact CG1-OD1 3.32Å; I114-N136 PolarHBondContact N-OD1 3.24Å; L133-N136 PolarHBondContact O-ND2 2.99Å; A134-N136 PolarHBondContact O-ND2 2.8Å; N136-I138 HydrophobicContact CB-CD1 4.06Å; N136-I138 HydrophobicContact CB-CG1 3.96Å; N136-R159 PolarHBondContact N-O 3.41Å; N136-N160 VanDerWaalsContact CA-OD1 3.28Å; N136-N160 WeakPolarHBondContact CA-OD1 3.22Å; N136-N160 WeakPolarHBondContact CB-OD1 3.11Å; N136-N160 PolarHBondContact N-OD1 2.89Å; N136-N160 PolarHBondContact O-OD1 2.98Å
137	R	97.9	Very high	97.7	Very high	78 Å²	78	51 Å²	51	29%	0.294	23%	0.233	S	C	.	.			trans	-117.8	30.5	176.8	-59.6	-172.8	179.8	-159.1	3.8	111.5	E55 F59 I114 S115 Q139 N160	E55-R137 IonicContact OE2-NH1 3.59Å; F59-R137 VanDerWaalsContact CE1-NH1 3.32Å; F59-R137 VanDerWaalsContact CZ-NH1 3.28Å; I114-R137 CarbonylContact O-C 3.35Å; I114-R137 WeakPolarHBondContact O-CA 3.49Å; I114-R137 PolarHBondContact O-N 3.01Å; S115-R137 WeakPolarHBondContact CA-O 3.18Å; R137-Q139 PolarHBondContact O-N 2.93Å; R137-N160 PolarHBondContact N-OD1 2.94Å
138	I	98.6	Very high	97.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.231	C	C	.	.			trans	-68	120.9	-170.8	-59	162.6	0	0	0	109.7	I114 S115 L117 L133 N136 I141 V157 N160 Q161 L162	I114-I138 HydrophobicContact CB-CG1 4.36Å; I114-I138 HydrophobicContact CG2-CG1 4.11Å; I114-I138 WeakPolarHBondContact O-CG1 3.35Å; I114-I138 PolarHBondContact O-N 2.9Å; I114-I138 VanDerWaalsContact O-N 3.08Å; S115-I138 WeakPolarHBondContact O-CA 3.21Å; L117-I138 HydrophobicContact CD1-CD1 3.62Å; L117-I138 HydrophobicContact CD1-CG1 4.03Å; L117-I138 HydrophobicContact CD1-CG2 4.12Å; L133-I138 HydrophobicContact CB-CD1 3.77Å; L133-I138 HydrophobicContact CD1-CD1 4.31Å; L133-I138 HydrophobicContact CD2-CD1 4Å; L133-I138 HydrophobicContact CG-CD1 4.25Å; N136-I138 HydrophobicContact CB-CD1 4.06Å; N136-I138 HydrophobicContact CB-CG1 3.96Å; I138-I141 HydrophobicContact CG2-CD1 4.25Å; I138-I141 HydrophobicContact CG2-CG1 3.8Å; I138-V157 HydrophobicContact CD1-CG1 4.43Å; I138-N160 HydrophobicContact CB-CB 4.2Å; I138-N160 WeakPolarHBondContact CB-OD1 3.29Å; I138-N160 WeakPolarHBondContact CG1-OD1 3.43Å; I138-N160 PolarHBondContact N-OD1 3.39Å; I138-Q161 CarbonylContact O-C 3.57Å; I138-Q161 VanDerWaalsContact O-CA 3.31Å; I138-Q161 WeakPolarHBondContact O-CA 3.27Å; I138-Q161 PolarHBondContact O-N 3.43Å; I138-L162 HydrophobicContact CG2-CD2 3.94Å; I138-L162 PolarHBondContact O-N 3.36Å
139	Q	97.8	Very high	97.6	Very high	112 Å²	112	50.7 Å²	50.7	52%	0.523	23%	0.231	S	C	.	.			trans	-106	-27.9	176.4	-67.1	174.9	27.6	0	0	112.1	S115 R137 Q161	S115-Q139 PolarHBondContact O-N 2.91Å; R137-Q139 PolarHBondContact O-N 2.93Å; Q139-Q161 HydrophobicContact CG-CB 3.72Å
140	K	96.1	Very high	97.6	Very high	135 Å²	135	50.3 Å²	50.3	59%	0.587	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.7	-174	-171.6	-178.1	175.4	-167.1	0	111.4	E116 L117	E116-K140 VanDerWaalsContact CA-O 3.28Å; E116-K140 WeakPolarHBondContact CA-O 3.45Å; L117-K140 PolarHBondContact N-O 3.44Å; L117-K140 VanDerWaalsContact N-O 3.09Å
141	I	97.9	Very high	97.5	Very high	21 Å²	21	48.9 Å²	48.9	11%	0.108	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.7	171.6	-57.9	-179.6	0	0	0	106.5	L117 I138 K143 F146 F155 V157 L162 P166	L117-I141 HydrophobicContact CB-CB 4.36Å; L117-I141 HydrophobicContact CB-CG1 4.23Å; L117-I141 HydrophobicContact CB-CG2 4Å; L117-I141 HydrophobicContact CD2-CD1 4.35Å; L117-I141 HydrophobicContact CD2-CG1 4.36Å; L117-I141 HydrophobicContact CD2-CG2 4.15Å; I138-I141 HydrophobicContact CG2-CD1 4.25Å; I138-I141 HydrophobicContact CG2-CG1 3.8Å; I141-K143 PolarHBondContact O-N 3.05Å; I141-F146 HydrophobicContact CG2-CE2 3.88Å; I141-F146 HydrophobicContact CG2-CZ 3.87Å; I141-F155 HydrophobicContact CD1-CE1 4.18Å; I141-F155 HydrophobicContact CD1-CZ 3.89Å; I141-V157 HydrophobicContact CD1-CG1 4.31Å; I141-L162 HydrophobicContact CD1-CD1 4.27Å; I141-L162 HydrophobicContact CD1-CD2 4.12Å; I141-L162 HydrophobicContact CG1-CD2 4.08Å; I141-P166 HydrophobicContact CB-CB 4.49Å; I141-P166 HydrophobicContact CD1-CG 3.87Å
142	D	95.6	Very high	97.5	Very high	52 Å²	52	48.8 Å²	48.8	28%	0.278	24%	0.236	S	C	.	.			trans	-66.4	131.9	173.8	-164.8	-29.6	0	0	0	110	L117 Q144 V145	L117-D142 PolarHBondContact O-N 3.28Å; D142-Q144 PolarHBondContact O-N 3.39Å; D142-Q144 PolarHBondContact OD1-N 3Å; D142-V145 HydrophobicContact CB-CG2 4.19Å; D142-V145 VanDerWaalsContact O-CB 3.26Å; D142-V145 WeakPolarHBondContact O-CB 3.4Å; D142-V145 VanDerWaalsContact O-CG2 3.3Å; D142-V145 WeakPolarHBondContact O-CG2 3.16Å; D142-V145 PolarHBondContact O-N 3.35Å
143	K	93	Very high	97.5	Very high	125 Å²	125	49.7 Å²	49.7	54%	0.543	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.7	176	66.2	177	-175.7	174.6	0	112.3	I141 V145 F146	I141-K143 PolarHBondContact O-N 3.05Å; K143-V145 PolarHBondContact O-N 2.97Å; K143-F146 PolarHBondContact O-N 3.31Å
144	Q	96.3	Very high	97.5	Very high	90 Å²	90	52.7 Å²	52.7	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-67.6	-17.5	179.6	-69.3	-175.6	-19.8	0	0	112.8	A119 D142 F146 E147	A119-Q144 HydrophobicContact CB-CB 3.76Å; D142-Q144 PolarHBondContact O-N 3.39Å; D142-Q144 PolarHBondContact OD1-N 3Å; Q144-F146 VanDerWaalsContact C-N 3.29Å; Q144-F146 PolarHBondContact O-N 2.91Å; Q144-E147 WeakPolarHBondContact O-CB 3.29Å; Q144-E147 PolarHBondContact O-N 3.41Å
145	V	97.9	Very high	97.5	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-56.6	-47.1	173.9	170.9	0	0	0	0	110.2	L117 A119 F122 D142 K143 E147 K148 I149	L117-V145 HydrophobicContact CB-CG2 4.23Å; A119-V145 HydrophobicContact CB-CG2 4.5Å; F122-V145 HydrophobicContact CD2-CG1 3.7Å; F122-V145 HydrophobicContact CD2-CG2 4.28Å; F122-V145 HydrophobicContact CE2-CG1 3.87Å; F122-V145 HydrophobicContact CG-CG1 4.07Å; F122-V145 HydrophobicContact CZ-CG1 4.37Å; D142-V145 HydrophobicContact CB-CG2 4.19Å; D142-V145 VanDerWaalsContact O-CB 3.26Å; D142-V145 WeakPolarHBondContact O-CB 3.4Å; D142-V145 VanDerWaalsContact O-CG2 3.3Å; D142-V145 WeakPolarHBondContact O-CG2 3.16Å; D142-V145 PolarHBondContact O-N 3.35Å; K143-V145 PolarHBondContact O-N 2.97Å; V145-E147 VanDerWaalsContact C-N 3.26Å; V145-E147 PolarHBondContact O-N 3.04Å; V145-K148 WeakPolarHBondContact O-CB 3.28Å; V145-K148 PolarHBondContact O-N 3.45Å; V145-I149 HydrophobicContact CG1-CD1 4.08Å; V145-I149 WeakPolarHBondContact O-CG1 3.25Å; V145-I149 PolarHBondContact O-N 3.35Å
146	F	97.4	Very high	97.5	Very high	5 Å²	5	50 Å²	50	2%	0.022	23%	0.234	C	C	.	.	H	α-helix	trans	-71.1	-21.5	-175.5	-58.2	-63.1	0	0	0	113.4	I141 K143 Q144 K148 I149 L152 F155 P166 S167 G168 L169	I141-F146 HydrophobicContact CG2-CE2 3.88Å; I141-F146 HydrophobicContact CG2-CZ 3.87Å; K143-F146 PolarHBondContact O-N 3.31Å; Q144-F146 VanDerWaalsContact C-N 3.29Å; Q144-F146 PolarHBondContact O-N 2.91Å; F146-K148 PolarHBondContact O-N 2.8Å; F146-I149 HydrophobicContact CD1-CD1 4.24Å; F146-I149 HydrophobicContact CD1-CG1 4.41Å; F146-I149 CarbonylContact O-C 3.39Å; F146-I149 PolarHBondContact O-N 2.76Å; F146-L152 HydrophobicContact CD1-CD2 4.46Å; F146-L152 HydrophobicContact CE1-CD2 4.41Å; F146-F155 HydrophobicContact CE1-CD1 4.16Å; F146-F155 AromaticContact CE1-CE1 3.79Å; F146-F155 HydrophobicContact CE1-CE1 3.79Å; F146-F155 AromaticContact CE1-CZ 3.98Å; F146-F155 HydrophobicContact CE1-CZ 3.98Å; F146-F155 HydrophobicContact CZ-CD1 4.35Å; F146-F155 AromaticContact CZ-CE1 3.66Å; F146-F155 HydrophobicContact CZ-CE1 3.66Å; F146-F155 HydrophobicContact CZ-CZ 4Å; F146-P166 HydrophobicContact CE2-CB 3.7Å; F146-P166 HydrophobicContact CZ-CB 3.92Å; F146-S167 WeakPolarHBondContact CD2-O 3.44Å; F146-G168 WeakPolarHBondContact CB-O 3.12Å; F146-L169 HydrophobicContact CD1-CD2 4.39Å; F146-L169 HydrophobicContact CE1-CD2 3.84Å; F146-L169 HydrophobicContact CE2-CD2 4.07Å; F146-L169 HydrophobicContact CZ-CD2 3.66Å
147	E	96.5	Very high	97.5	Very high	130 Å²	130	49.4 Å²	49.4	61%	0.607	23%	0.231	S	C	*	.	H	α-helix	trans	-66.1	-26.3	169.9	-60.2	176.6	-164.2	0	0	111.7	Q144 V145	Q144-E147 WeakPolarHBondContact O-CB 3.29Å; Q144-E147 PolarHBondContact O-N 3.41Å; V145-E147 VanDerWaalsContact C-N 3.26Å; V145-E147 PolarHBondContact O-N 3.04Å
148	K	97.8	Very high	97.6	Very high	72 Å²	72	47.1 Å²	47.1	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-86.4	-20	178.6	-53	-55.9	-179.5	176.3	0	113.9	F122 N123 V145 F146 P150	F122-K148 HydrophobicContact CB-CB 3.87Å; F122-K148 HydrophobicContact CB-CG 4.4Å; F122-K148 WeakPolarHBondContact O-CB 3.29Å; N123-K148 WeakPolarHBondContact OD1-CE 3.41Å; N123-K148 PolarHBondContact OD1-NZ 2.9Å; V145-K148 WeakPolarHBondContact O-CB 3.28Å; V145-K148 PolarHBondContact O-N 3.45Å; F146-K148 PolarHBondContact O-N 2.8Å; K148-P150 WeakPolarHBondContact O-CD 3.23Å
149	I	97.9	Very high	97.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.248	C	C	.	.			trans	-123.3	57.4	-178.1	58.3	179.4	0	0	0	111.8	F122 A125 V128 I131 V145 F146 G151 L152	F122-I149 HydrophobicContact CB-CG2 4.28Å; F122-I149 HydrophobicContact CD1-CD1 4.47Å; F122-I149 HydrophobicContact CD1-CG2 3.89Å; F122-I149 HydrophobicContact CG-CG2 4.45Å; A125-I149 HydrophobicContact CB-CG2 4.11Å; A125-I149 WeakPolarHBondContact O-CG2 3.35Å; V128-I149 HydrophobicContact CB-CG2 4.11Å; I131-I149 HydrophobicContact CD1-CD1 3.5Å; I131-I149 VanDerWaalsContact CD1-CD1 3.5Å; V145-I149 HydrophobicContact CG1-CD1 4.08Å; V145-I149 WeakPolarHBondContact O-CG1 3.25Å; V145-I149 PolarHBondContact O-N 3.35Å; F146-I149 HydrophobicContact CD1-CD1 4.24Å; F146-I149 HydrophobicContact CD1-CG1 4.41Å; F146-I149 CarbonylContact O-C 3.39Å; F146-I149 PolarHBondContact O-N 2.76Å; I149-G151 PolarHBondContact O-N 3.3Å; I149-L152 HydrophobicContact CD1-CB 4.45Å; I149-L152 HydrophobicContact CD1-CD1 4.5Å; I149-L152 HydrophobicContact CD1-CD2 3.87Å; I149-L152 HydrophobicContact CG1-CB 4.44Å; I149-L152 WeakPolarHBondContact O-CB 3.29Å; I149-L152 PolarHBondContact O-N 3.17Å
150	P	97	Very high	97.6	Very high	77 Å²	77	48.7 Å²	48.7	50%	0.5	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.9	-174.2	29.1	-37.2	0	0	0	113.4	K148 S172	K148-P150 WeakPolarHBondContact O-CD 3.23Å; P150-S172 PolarHBondContact O-OG 3.41Å
151	G	97.8	Very high	97.8	Very high	7 Å²	7	44.4 Å²	44.4	7%	0.072	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	4.8	-179.3	0	0	0	0	0	116.1	V128 R129 I149 L153	V128-G151 CarbonylContact O-C 3.16Å; R129-G151 WeakPolarHBondContact CD-O 3.48Å; R129-G151 PolarHBondContact NH1-O 3.03Å; I149-G151 PolarHBondContact O-N 3.3Å; G151-L153 PolarHBondContact O-N 2.92Å
152	L	98.7	Very high	97.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.204	C	C	.	.			trans	-65.4	122.6	-174.6	-175.5	72.3	0	0	0	112.1	V128 I131 F146 I149 F155 P170 S172 L173	V128-L152 HydrophobicContact CG1-CD1 4.09Å; V128-L152 PolarHBondContact O-N 3.41Å; I131-L152 HydrophobicContact CB-CD1 4.23Å; I131-L152 HydrophobicContact CD1-CD1 3.73Å; I131-L152 HydrophobicContact CD1-CD2 4.38Å; I131-L152 HydrophobicContact CG1-CD1 3.65Å; F146-L152 HydrophobicContact CD1-CD2 4.46Å; F146-L152 HydrophobicContact CE1-CD2 4.41Å; I149-L152 HydrophobicContact CD1-CB 4.45Å; I149-L152 HydrophobicContact CD1-CD1 4.5Å; I149-L152 HydrophobicContact CD1-CD2 3.87Å; I149-L152 HydrophobicContact CG1-CB 4.44Å; I149-L152 WeakPolarHBondContact O-CB 3.29Å; I149-L152 PolarHBondContact O-N 3.17Å; L152-F155 HydrophobicContact CD2-CB 3.84Å; L152-F155 HydrophobicContact CD2-CD2 3.93Å; L152-F155 HydrophobicContact CD2-CG 3.96Å; L152-P170 HydrophobicContact CB-CG 3.78Å; L152-P170 HydrophobicContact CD2-CG 4.33Å; L152-S172 PolarHBondContact N-OG 3.34Å; L152-S172 CarbonylContact O-C 3.58Å; L152-S172 PolarHBondContact O-OG 2.85Å; L152-S172 VanDerWaalsContact O-OG 3.08Å; L152-L173 HydrophobicContact CD2-CD1 4.11Å; L152-L173 HydrophobicContact CG-CD1 4.07Å; L152-L173 WeakPolarHBondContact O-CA 3.37Å; L152-L173 PolarHBondContact O-N 3.25Å
153	L	98.9	Very high	97.9	Very high	41 Å²	41	45.3 Å²	45.3	22%	0.215	21%	0.212	C	C	.	.			trans	-100.5	-38.7	-179.8	-55.8	179.2	0	0	0	112.1	R129 G151 S172 L173 E174 Q175	R129-L153 HydrophobicContact CB-CD1 4.33Å; R129-L153 HydrophobicContact CB-CG 4.37Å; R129-L153 WeakPolarHBondContact O-CA 3.33Å; R129-L153 WeakPolarHBondContact O-CB 3.28Å; R129-L153 PolarHBondContact O-N 3.35Å; G151-L153 PolarHBondContact O-N 2.92Å; L153-S172 VanDerWaalsContact CD2-O 3.26Å; L153-S172 WeakPolarHBondContact CD2-O 3.35Å; L153-L173 WeakPolarHBondContact O-CD1 3.38Å; L153-E174 HydrophobicContact CB-CG 4.48Å; L153-E174 HydrophobicContact CD2-CG 4.36Å; L153-E174 PolarHBondContact O-N 2.96Å; L153-Q175 PolarHBondContact O-N 2.81Å
154	Y	98.9	Very high	98.2	Very high	62 Å²	62	43.9 Å²	43.9	24%	0.243	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.1	-174.2	-57.6	-88.9	0	0	0	110.7	R129 W130 I131 Y156 E174 Q175	R129-Y154 PolarHBondContact O-N 3.03Å; W130-Y154 AromaticContact CD1-CD2 3.75Å; W130-Y154 AromaticContact CD1-CG 3.6Å; I131-Y154 PolarHBondContact N-O 3.4Å; Y154-Y156 HydrophobicContact CD1-CE1 4.44Å; Y154-Y156 WeakPolarHBondContact CD1-OH 3.43Å; Y154-E174 PolarHBondContact OH-OE2 3.21Å; Y154-Q175 HydrophobicContact CD1-CB 3.78Å; Y154-Q175 HydrophobicContact CD1-CG 3.7Å; Y154-Q175 HydrophobicContact CE1-CB 4.27Å; Y154-Q175 VanDerWaalsContact CE1-CD 3.48Å; Y154-Q175 HydrophobicContact CE1-CG 3.66Å
155	F	98.9	Very high	98.3	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	106.8	179	-166.9	-137	0	0	0	111.7	L117 I131 L133 I141 F146 L152 V157 L169 L173 Q175 L176 R177	L117-F155 HydrophobicContact CD2-CZ 4.45Å; I131-F155 HydrophobicContact CB-CD2 4.11Å; I131-F155 HydrophobicContact CB-CE2 4.42Å; I131-F155 HydrophobicContact CG2-CD2 4.35Å; I131-F155 HydrophobicContact CG2-CE2 4.21Å; L133-F155 HydrophobicContact CD1-CE2 3.84Å; L133-F155 HydrophobicContact CD1-CZ 4.38Å; I141-F155 HydrophobicContact CD1-CE1 4.18Å; I141-F155 HydrophobicContact CD1-CZ 3.89Å; F146-F155 HydrophobicContact CE1-CD1 4.16Å; F146-F155 AromaticContact CE1-CE1 3.79Å; F146-F155 HydrophobicContact CE1-CE1 3.79Å; F146-F155 AromaticContact CE1-CZ 3.98Å; F146-F155 HydrophobicContact CE1-CZ 3.98Å; F146-F155 HydrophobicContact CZ-CD1 4.35Å; F146-F155 AromaticContact CZ-CE1 3.66Å; F146-F155 HydrophobicContact CZ-CE1 3.66Å; F146-F155 HydrophobicContact CZ-CZ 4Å; L152-F155 HydrophobicContact CD2-CB 3.84Å; L152-F155 HydrophobicContact CD2-CD2 3.93Å; L152-F155 HydrophobicContact CD2-CG 3.96Å; F155-V157 HydrophobicContact CD1-CG2 3.78Å; F155-V157 HydrophobicContact CE1-CG1 4.08Å; F155-V157 HydrophobicContact CE1-CG2 3.59Å; F155-V157 HydrophobicContact CE2-CG1 3.92Å; F155-V157 HydrophobicContact CG-CG2 4.32Å; F155-V157 HydrophobicContact CZ-CG1 3.61Å; F155-V157 HydrophobicContact CZ-CG2 4.01Å; F155-L169 HydrophobicContact CD1-CD2 4.19Å; F155-L173 HydrophobicContact CB-CD1 3.78Å; F155-Q175 PolarHBondContact N-O 3.14Å; F155-L176 HydrophobicContact CB-CD1 4.14Å; F155-L176 HydrophobicContact CD1-CD1 3.7Å; F155-L176 HydrophobicContact CG-CD1 4.36Å; F155-R177 PolarHBondContact O-N 3.37Å
156	Y	98.9	Very high	98.2	Very high	29 Å²	29	40 Å²	40	11%	0.114	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	107.8	-175.9	-59	-22	0	0	0	110.1	W130 I131 N132 L133 Y154 Q175 R177	W130-Y156 AromaticContact CE2-CD2 3.84Å; W130-Y156 AromaticContact CE2-CE2 3.59Å; W130-Y156 AromaticContact CZ2-CD2 3.67Å; W130-Y156 HydrophobicContact CZ2-CD2 3.67Å; W130-Y156 AromaticContact CZ2-CE2 3.66Å; W130-Y156 HydrophobicContact CZ2-CE2 3.66Å; W130-Y156 AromaticContact NE1-CD2 3.91Å; W130-Y156 AromaticContact NE1-CE2 3.23Å; W130-Y156 AromaticContact NE1-CZ 3.87Å; I131-Y156 PolarHBondContact O-N 3.11Å; N132-Y156 HydrophobicContact CB-CD2 4.36Å; L133-Y156 PolarHBondContact N-O 3.06Å; Y154-Y156 HydrophobicContact CD1-CE1 4.44Å; Y154-Y156 WeakPolarHBondContact CD1-OH 3.43Å; Y156-Q175 HydrophobicContact CE1-CB 4.19Å; Y156-Q175 PolarHBondContact OH-OE1 2.89Å; Y156-R177 HydrophobicContact CD1-CB 3.95Å; Y156-R177 HydrophobicContact CD1-CG 3.79Å; Y156-R177 HydrophobicContact CE1-CG 4.03Å
157	V	98.6	Very high	98.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.			trans	-131.1	24.1	-176	-94.3	0	0	0	0	111.3	L133 I138 I141 F155 N160 L162 R177 L178 N181	L133-V157 HydrophobicContact CB-CG1 3.73Å; L133-V157 HydrophobicContact CD1-CG1 3.89Å; L133-V157 HydrophobicContact CG-CG1 4.48Å; I138-V157 HydrophobicContact CD1-CG1 4.43Å; I141-V157 HydrophobicContact CD1-CG1 4.31Å; F155-V157 HydrophobicContact CD1-CG2 3.78Å; F155-V157 HydrophobicContact CE1-CG1 4.08Å; F155-V157 HydrophobicContact CE1-CG2 3.59Å; F155-V157 HydrophobicContact CE2-CG1 3.92Å; F155-V157 HydrophobicContact CG-CG2 4.32Å; F155-V157 HydrophobicContact CZ-CG1 3.61Å; F155-V157 HydrophobicContact CZ-CG2 4.01Å; V157-N160 PolarHBondContact O-ND2 3.03Å; V157-L162 HydrophobicContact CB-CD1 4.4Å; V157-R177 CarbonylContact C-O 3.48Å; V157-R177 WeakPolarHBondContact CG2-O 3.37Å; V157-R177 PolarHBondContact N-O 3.4Å; V157-L178 HydrophobicContact CB-CD2 4.38Å; V157-L178 HydrophobicContact CG2-CD2 3.47Å; V157-L178 VanDerWaalsContact CG2-CD2 3.47Å; V157-L178 HydrophobicContact CG2-CG 4.27Å; V157-N181 PolarHBondContact O-ND2 2.97Å
158	Q	98.8	Very high	98	Very high	29 Å²	29	38 Å²	38	14%	0.136	20%	0.199	C	C	.	.			trans	-65	154.6	177.5	67.9	-83.9	10.2	0	0	113.5	A134 N135 N160 R177 D179	A134-Q158 CarbonylContact C-O 3.31Å; A134-Q158 VanDerWaalsContact CA-O 3.22Å; A134-Q158 WeakPolarHBondContact CA-O 3.36Å; A134-Q158 HydrophobicContact CB-CG 3.88Å; A134-Q158 VanDerWaalsContact CB-NE2 3.29Å; N135-Q158 PolarHBondContact N-O 2.94Å; Q158-N160 PolarHBondContact O-ND2 3.2Å; Q158-R177 PolarHBondContact N-O 3.49Å; Q158-D179 CarbonylContact C-O 3.53Å; Q158-D179 WeakPolarHBondContact CA-O 3.13Å; Q158-D179 HydrophobicContact CB-CB 4.49Å; Q158-D179 VanDerWaalsContact CB-CG 3.45Å; Q158-D179 VanDerWaalsContact CB-O 3.28Å; Q158-D179 WeakPolarHBondContact CB-O 3.49Å; Q158-D179 WeakPolarHBondContact CB-OD1 3.45Å
159	R	98.8	Very high	98	Very high	136 Å²	136	35.2 Å²	35.2	51%	0.513	19%	0.187	S	C	.	.	S	Bend	trans	56.3	54.4	-177.7	-58.8	178.4	-179.8	170.8	-1.2	112	N135 N136 D179 R180	N135-R159 VanDerWaalsContact CA-O 3.26Å; N135-R159 WeakPolarHBondContact CA-O 3.3Å; N135-R159 HydrophobicContact CB-CB 4.4Å; N135-R159 PolarHBondContact N-O 3.32Å; N136-R159 PolarHBondContact N-O 3.41Å; R159-D179 PolarHBondContact N-O 3.39Å; R159-R180 VanDerWaalsContact CA-O 3.24Å; R159-R180 WeakPolarHBondContact CA-O 3.49Å; R159-R180 HydrophobicContact CG-CB 3.84Å; R159-R180 HydrophobicContact CG-CG 4.41Å; R159-R180 PolarHBondContact N-O 3.4Å
160	N	98.8	Very high	98	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.048	19%	0.191	C	C	.	.	S	Bend	trans	-125.9	-162	174.2	-86.4	-74.2	0	0	0	109.9	L133 N136 R137 I138 V157 Q158 R180 N181	L133-N160 PolarHBondContact O-ND2 3.01Å; N136-N160 VanDerWaalsContact CA-OD1 3.28Å; N136-N160 WeakPolarHBondContact CA-OD1 3.22Å; N136-N160 WeakPolarHBondContact CB-OD1 3.11Å; N136-N160 PolarHBondContact N-OD1 2.89Å; N136-N160 PolarHBondContact O-OD1 2.98Å; R137-N160 PolarHBondContact N-OD1 2.94Å; I138-N160 HydrophobicContact CB-CB 4.2Å; I138-N160 WeakPolarHBondContact CB-OD1 3.29Å; I138-N160 WeakPolarHBondContact CG1-OD1 3.43Å; I138-N160 PolarHBondContact N-OD1 3.39Å; V157-N160 PolarHBondContact O-ND2 3.03Å; Q158-N160 PolarHBondContact O-ND2 3.2Å; N160-R180 PolarHBondContact N-O 3.32Å; N160-N181 VanDerWaalsContact CA-OD1 3.26Å; N160-N181 WeakPolarHBondContact CA-OD1 3.49Å; N160-N181 WeakPolarHBondContact CB-OD1 3.22Å; N160-N181 PolarHBondContact N-OD1 3.44Å; N160-N181 PolarHBondContact O-OD1 2.98Å
161	Q	98.7	Very high	98	Very high	46 Å²	46	36 Å²	36	22%	0.215	19%	0.191	C	C	.	.			trans	-123.1	27.7	-175.6	-58.7	178.3	3.6	0	0	111.8	I138 Q139 N163 N181	I138-Q161 CarbonylContact O-C 3.57Å; I138-Q161 VanDerWaalsContact O-CA 3.31Å; I138-Q161 WeakPolarHBondContact O-CA 3.27Å; I138-Q161 PolarHBondContact O-N 3.43Å; Q139-Q161 HydrophobicContact CG-CB 3.72Å; Q161-N163 PolarHBondContact O-N 3.41Å; Q161-N181 PolarHBondContact N-OD1 3.46Å
162	L	98.7	Very high	98.1	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	19%	0.194	C	C	.	.			trans	-66.4	131.6	179.3	-64.1	173.2	0	0	0	110.4	I138 I141 V157 P166 L178 N181 R182 I183	I138-L162 HydrophobicContact CG2-CD2 3.94Å; I138-L162 PolarHBondContact O-N 3.36Å; I141-L162 HydrophobicContact CD1-CD1 4.27Å; I141-L162 HydrophobicContact CD1-CD2 4.12Å; I141-L162 HydrophobicContact CG1-CD2 4.08Å; V157-L162 HydrophobicContact CB-CD1 4.4Å; L162-P166 HydrophobicContact CD1-CG 4.43Å; L162-L178 HydrophobicContact CD1-CD2 3.65Å; L162-N181 HydrophobicContact CB-CB 4.23Å; L162-N181 WeakPolarHBondContact CB-OD1 3.41Å; L162-N181 PolarHBondContact N-OD1 2.81Å; L162-R182 CarbonylContact O-C 3.32Å; L162-R182 VanDerWaalsContact O-CA 3.29Å; L162-R182 WeakPolarHBondContact O-CA 3.3Å; L162-R182 PolarHBondContact O-N 2.83Å; L162-I183 HydrophobicContact CB-CG1 4.16Å; L162-I183 WeakPolarHBondContact O-CG1 3.29Å; L162-I183 PolarHBondContact O-N 3.2Å; L162-I183 VanDerWaalsContact O-N 3.11Å
163	N	98.3	Very high	98.1	Very high	86 Å²	86	36.5 Å²	36.5	46%	0.46	19%	0.194	S	C	.	.	S	Bend	trans	-94.3	-16.9	177.3	-63.7	-49.2	0	0	0	113.1	Q161 I183 S184	Q161-N163 PolarHBondContact O-N 3.41Å; N163-I183 WeakPolarHBondContact O-CA 3.09Å; N163-S184 PolarHBondContact O-N 3.23Å; N163-S184 PolarHBondContact O-OG 2.85Å
164	E	98.2	Very high	98.1	Very high	96 Å²	96	37.4 Å²	37.4	45%	0.449	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-144.8	160.8	177.2	62.2	-179.9	-163.3	0	0	111.3	K185 P187	E164-K185 VanDerWaalsContact CA-O 3.27Å; E164-K185 WeakPolarHBondContact CA-O 3.01Å; E164-K185 WeakPolarHBondContact CB-O 3.41Å; E164-P187 HydrophobicContact CB-CG 4.33Å; E164-P187 HydrophobicContact CG-CG 4.42Å
165	V	98.3	Very high	98.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-66.3	133.3	171.6	175.9	0	0	0	0	109.5	L169 L178 I183 K185 I186 P187 A190 F191 L202	V165-L169 HydrophobicContact CG1-CD1 4.31Å; V165-L178 HydrophobicContact CG1-CD1 4.12Å; V165-L178 HydrophobicContact CG2-CD1 4.12Å; V165-I183 HydrophobicContact CG2-CD1 4.38Å; V165-I183 HydrophobicContact CG2-CG2 4Å; V165-K185 PolarHBondContact N-O 3.29Å; V165-I186 HydrophobicContact CB-CG2 4.07Å; V165-I186 HydrophobicContact CG1-CG2 4.44Å; V165-I186 HydrophobicContact CG2-CB 4.2Å; V165-I186 HydrophobicContact CG2-CD1 4.12Å; V165-I186 HydrophobicContact CG2-CG1 3.76Å; V165-I186 HydrophobicContact CG2-CG2 4Å; V165-P187 VanDerWaalsContact O-CD 3.29Å; V165-P187 WeakPolarHBondContact O-CD 3.41Å; V165-P187 WeakPolarHBondContact O-CG 3.4Å; V165-A190 HydrophobicContact CG1-CB 4.12Å; V165-F191 HydrophobicContact CG1-CD1 4.48Å; V165-F191 HydrophobicContact CG1-CE1 3.56Å; V165-F191 HydrophobicContact CG1-CZ 3.85Å; V165-F191 HydrophobicContact CG2-CZ 4.2Å; V165-L202 HydrophobicContact CG2-CD2 4.17Å
166	P	96.9	Very high	98.1	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.052	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-58.8	139	177	-23.3	34	0	0	0	112.2	I141 F146 L162 L169	I141-P166 HydrophobicContact CB-CB 4.49Å; I141-P166 HydrophobicContact CD1-CG 3.87Å; F146-P166 HydrophobicContact CE2-CB 3.7Å; F146-P166 HydrophobicContact CZ-CB 3.92Å; L162-P166 HydrophobicContact CD1-CG 4.43Å; P166-L169 HydrophobicContact CB-CD2 4.45Å
167	S	95.1	Very high	98.1	Very high	45 Å²	45	39.1 Å²	39.1	32%	0.315	20%	0.204	S	C	.	.	S	Bend	trans	-89.3	153.6	175.6	-64.2	0	0	0	0	111.2	F146	F146-S167 WeakPolarHBondContact CD2-O 3.44Å
168	G	95.3	Very high	98.1	Very high	49 Å²	49	39.1 Å²	39.1	51%	0.505	20%	0.204	S	C	.	.	S	Bend	trans	80.4	19	175.7	0	0	0	0	0	114.5	F146	F146-G168 WeakPolarHBondContact CB-O 3.12Å
169	L	97.8	Very high	98.1	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.068	20%	0.203	C	C	.	.			trans	-51.8	139.4	175.8	-67.6	167	0	0	0	111.1	F146 F155 V165 P166 L173 L176 F191 L194	F146-L169 HydrophobicContact CD1-CD2 4.39Å; F146-L169 HydrophobicContact CE1-CD2 3.84Å; F146-L169 HydrophobicContact CE2-CD2 4.07Å; F146-L169 HydrophobicContact CZ-CD2 3.66Å; F155-L169 HydrophobicContact CD1-CD2 4.19Å; V165-L169 HydrophobicContact CG1-CD1 4.31Å; P166-L169 HydrophobicContact CB-CD2 4.45Å; L169-L173 HydrophobicContact CB-CD2 4.45Å; L169-L173 HydrophobicContact CD2-CD2 4.22Å; L169-L176 HydrophobicContact CD1-CD2 3.63Å; L169-F191 HydrophobicContact CD1-CD1 4.21Å; L169-F191 HydrophobicContact CD1-CE1 4.15Å; L169-L194 HydrophobicContact CB-CD1 4.04Å; L169-L194 HydrophobicContact CB-CD2 4.25Å; L169-L194 HydrophobicContact CD1-CD1 4.04Å
170	P	97.3	Very high	98.1	Very high	11 Å²	11	37.2 Å²	37.2	7%	0.071	20%	0.197	C	C	.	.			trans	-73	143.4	-175.6	27.2	-29.2	0	0	0	111.1	L152 S172 L173 L194	L152-P170 HydrophobicContact CB-CG 3.78Å; L152-P170 HydrophobicContact CD2-CG 4.33Å; P170-S172 PolarHBondContact O-N 3.46Å; P170-S172 VanDerWaalsContact O-N 3.15Å; P170-L173 WeakPolarHBondContact O-CB 3.49Å; P170-L173 PolarHBondContact O-N 3.12Å; P170-L173 VanDerWaalsContact O-N 3.09Å; P170-L194 VanDerWaalsContact O-CD2 3.25Å; P170-L194 WeakPolarHBondContact O-CD2 3.19Å
171	T	97.6	Very high	98.1	Very high	82 Å²	82	37.2 Å²	37.2	50%	0.503	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.3	-177.2	56.5	0	0	0	0	114	K193	T171-K193 HydrophobicContact CG2-CB 3.94Å
172	S	98.3	Very high	98.1	Very high	19 Å²	19	41 Å²	41	13%	0.133	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.9	174.3	52.2	0	0	0	0	113.2	P150 L152 L153 P170 E174	P150-S172 PolarHBondContact O-OG 3.41Å; L152-S172 PolarHBondContact N-OG 3.34Å; L152-S172 CarbonylContact O-C 3.58Å; L152-S172 PolarHBondContact O-OG 2.85Å; L152-S172 VanDerWaalsContact O-OG 3.08Å; L153-S172 VanDerWaalsContact CD2-O 3.26Å; L153-S172 WeakPolarHBondContact CD2-O 3.35Å; P170-S172 PolarHBondContact O-N 3.46Å; P170-S172 VanDerWaalsContact O-N 3.15Å; S172-E174 PolarHBondContact O-N 3.44Å
173	L	98.7	Very high	98.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.			trans	-62.3	126.4	-172.2	-162.8	72.2	0	0	0	112.4	L152 L153 F155 L169 P170 L176 N196 L197	L152-L173 HydrophobicContact CD2-CD1 4.11Å; L152-L173 HydrophobicContact CG-CD1 4.07Å; L152-L173 WeakPolarHBondContact O-CA 3.37Å; L152-L173 PolarHBondContact O-N 3.25Å; L153-L173 WeakPolarHBondContact O-CD1 3.38Å; F155-L173 HydrophobicContact CB-CD1 3.78Å; L169-L173 HydrophobicContact CB-CD2 4.45Å; L169-L173 HydrophobicContact CD2-CD2 4.22Å; P170-L173 WeakPolarHBondContact O-CB 3.49Å; P170-L173 PolarHBondContact O-N 3.12Å; P170-L173 VanDerWaalsContact O-N 3.09Å; L173-L176 HydrophobicContact CD2-CB 3.97Å; L173-L176 HydrophobicContact CD2-CD1 4.29Å; L173-L176 HydrophobicContact CD2-CD2 4.3Å; L173-L176 HydrophobicContact CD2-CG 4.43Å; L173-N196 CarbonylContact O-C 3.48Å; L173-L197 HydrophobicContact CB-CD1 4.36Å; L173-L197 HydrophobicContact CD2-CD1 4.01Å; L173-L197 HydrophobicContact CG-CD1 3.96Å; L173-L197 VanDerWaalsContact O-CA 3.3Å; L173-L197 WeakPolarHBondContact O-CA 2.99Å; L173-L197 PolarHBondContact O-N 3.35Å
174	E	98.8	Very high	98.1	Very high	60 Å²	60	39.3 Å²	39.3	28%	0.28	21%	0.205	S	C	.	.			trans	-103.6	-36.5	-179.9	-65.6	178	-176	0	0	111.9	L153 Y154 S172 T198 L199	L153-E174 HydrophobicContact CB-CG 4.48Å; L153-E174 HydrophobicContact CD2-CG 4.36Å; L153-E174 PolarHBondContact O-N 2.96Å; Y154-E174 PolarHBondContact OH-OE2 3.21Å; S172-E174 PolarHBondContact O-N 3.44Å; E174-T198 PolarHBondContact O-N 3Å; E174-T198 PolarHBondContact O-OG1 3.05Å; E174-T198 VanDerWaalsContact O-OG1 3.08Å; E174-L199 PolarHBondContact O-N 3.14Å
175	Q	98.9	Very high	98.1	Very high	40 Å²	40	40.2 Å²	40.2	19%	0.187	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	130.5	178.9	-56.9	-170.1	3.7	0	0	112.4	L153 Y154 F155 Y156 L199	L153-Q175 PolarHBondContact O-N 2.81Å; Y154-Q175 HydrophobicContact CD1-CB 3.78Å; Y154-Q175 HydrophobicContact CD1-CG 3.7Å; Y154-Q175 HydrophobicContact CE1-CB 4.27Å; Y154-Q175 VanDerWaalsContact CE1-CD 3.48Å; Y154-Q175 HydrophobicContact CE1-CG 3.66Å; F155-Q175 PolarHBondContact N-O 3.14Å; Y156-Q175 HydrophobicContact CE1-CB 4.19Å; Y156-Q175 PolarHBondContact OH-OE1 2.89Å; Q175-L199 HydrophobicContact CB-CB 4.39Å; Q175-L199 HydrophobicContact CG-CB 4.08Å
176	L	98.9	Very high	98.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.3	176.1	-178.6	55.7	0	0	0	110.2	F155 L169 L173 L178 F191 L197 L199 L200 D201	F155-L176 HydrophobicContact CB-CD1 4.14Å; F155-L176 HydrophobicContact CD1-CD1 3.7Å; F155-L176 HydrophobicContact CG-CD1 4.36Å; L169-L176 HydrophobicContact CD1-CD2 3.63Å; L173-L176 HydrophobicContact CD2-CB 3.97Å; L173-L176 HydrophobicContact CD2-CD1 4.29Å; L173-L176 HydrophobicContact CD2-CD2 4.3Å; L173-L176 HydrophobicContact CD2-CG 4.43Å; L176-L178 HydrophobicContact CD1-CD1 3.98Å; L176-L178 HydrophobicContact CD1-CD2 4.44Å; L176-L178 HydrophobicContact CD1-CG 3.89Å; L176-L178 HydrophobicContact CD2-CD1 3.71Å; L176-L178 HydrophobicContact CD2-CG 4.48Å; L176-L178 HydrophobicContact CG-CD1 3.74Å; L176-L178 HydrophobicContact CG-CG 3.98Å; L176-F191 HydrophobicContact CD2-CE1 3.9Å; L176-L197 HydrophobicContact CB-CD1 3.97Å; L176-L199 PolarHBondContact N-O 3.46Å; L176-L200 HydrophobicContact CB-CD1 4.12Å; L176-L200 HydrophobicContact CD2-CD1 3.86Å; L176-L200 HydrophobicContact CG-CD1 4.05Å; L176-D201 PolarHBondContact O-N 3.06Å
177	R	98.9	Very high	98	Very high	87 Å²	87	40.9 Å²	40.9	33%	0.328	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	109.8	175.9	-63.2	-172.5	-179	-169.1	0.9	110.7	F155 Y156 V157 Q158 L199 D201	F155-R177 PolarHBondContact O-N 3.37Å; Y156-R177 HydrophobicContact CD1-CB 3.95Å; Y156-R177 HydrophobicContact CD1-CG 3.79Å; Y156-R177 HydrophobicContact CE1-CG 4.03Å; V157-R177 CarbonylContact C-O 3.48Å; V157-R177 WeakPolarHBondContact CG2-O 3.37Å; V157-R177 PolarHBondContact N-O 3.4Å; Q158-R177 PolarHBondContact N-O 3.49Å; R177-L199 HydrophobicContact CG-CD2 4.03Å; R177-D201 HydrophobicContact CG-CB 4.3Å
178	L	98.9	Very high	97.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.237	C	C	.	.			trans	-120.3	15.4	-179.2	-72.1	165.2	0	0	0	111.3	V157 L162 V165 L176 N181 I183 D201 L202 N205	V157-L178 HydrophobicContact CB-CD2 4.38Å; V157-L178 HydrophobicContact CG2-CD2 3.47Å; V157-L178 VanDerWaalsContact CG2-CD2 3.47Å; V157-L178 HydrophobicContact CG2-CG 4.27Å; L162-L178 HydrophobicContact CD1-CD2 3.65Å; V165-L178 HydrophobicContact CG1-CD1 4.12Å; V165-L178 HydrophobicContact CG2-CD1 4.12Å; L176-L178 HydrophobicContact CD1-CD1 3.98Å; L176-L178 HydrophobicContact CD1-CD2 4.44Å; L176-L178 HydrophobicContact CD1-CG 3.89Å; L176-L178 HydrophobicContact CD2-CD1 3.71Å; L176-L178 HydrophobicContact CD2-CG 4.48Å; L176-L178 HydrophobicContact CG-CD1 3.74Å; L176-L178 HydrophobicContact CG-CG 3.98Å; L178-N181 PolarHBondContact O-ND2 3Å; L178-I183 HydrophobicContact CB-CD1 3.78Å; L178-I183 HydrophobicContact CD1-CD1 4.18Å; L178-I183 HydrophobicContact CD2-CD1 4.09Å; L178-I183 HydrophobicContact CG-CD1 4.25Å; L178-D201 CarbonylContact C-O 3.32Å; L178-D201 WeakPolarHBondContact CA-O 3.15Å; L178-D201 PolarHBondContact N-O 2.95Å; L178-L202 HydrophobicContact CB-CD2 3.82Å; L178-L202 HydrophobicContact CD1-CD2 3.95Å; L178-N205 PolarHBondContact O-ND2 3.33Å
179	D	98.9	Very high	97.8	Very high	20 Å²	20	43.5 Å²	43.5	11%	0.107	24%	0.235	C	C	.	.			trans	-63.7	151.6	-176.8	69.9	-82.6	0	0	0	112.4	Q158 R159 N181 D201 H203	Q158-D179 CarbonylContact C-O 3.53Å; Q158-D179 WeakPolarHBondContact CA-O 3.13Å; Q158-D179 HydrophobicContact CB-CB 4.49Å; Q158-D179 VanDerWaalsContact CB-CG 3.45Å; Q158-D179 VanDerWaalsContact CB-O 3.28Å; Q158-D179 WeakPolarHBondContact CB-O 3.49Å; Q158-D179 WeakPolarHBondContact CB-OD1 3.45Å; R159-D179 PolarHBondContact N-O 3.39Å; D179-N181 PolarHBondContact O-N 2.82Å; D179-N181 PolarHBondContact O-ND2 3.04Å; D179-D201 PolarHBondContact N-O 3.03Å; D179-H203 CarbonylContact C-O 3.06Å; D179-H203 WeakPolarHBondContact CA-O 3.35Å; D179-H203 HydrophobicContact CB-CB 4.03Å; D179-H203 VanDerWaalsContact CB-O 3.3Å; D179-H203 WeakPolarHBondContact CB-O 3.02Å
180	R	98.8	Very high	97.7	Very high	105 Å²	105	43.1 Å²	43.1	40%	0.396	23%	0.234	S	C	.	.	S	Bend	trans	57.3	47.8	179.6	-59.3	171.1	175.9	-94.7	-0.7	112.9	R159 N160 H203 Y204	R159-R180 VanDerWaalsContact CA-O 3.24Å; R159-R180 WeakPolarHBondContact CA-O 3.49Å; R159-R180 HydrophobicContact CG-CB 3.84Å; R159-R180 HydrophobicContact CG-CG 4.41Å; R159-R180 PolarHBondContact N-O 3.4Å; N160-R180 PolarHBondContact N-O 3.32Å; R180-H203 PolarHBondContact N-O 3.33Å; R180-Y204 WeakPolarHBondContact CA-O 3.47Å; R180-Y204 HydrophobicContact CB-CD1 4.38Å; R180-Y204 HydrophobicContact CG-CD1 4.16Å; R180-Y204 HydrophobicContact CG-CG 4.11Å; R180-Y204 PolarHBondContact N-O 3.43Å
181	N	98.9	Very high	97.7	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.048	23%	0.231	C	C	.	.	S	Bend	trans	-111.4	-160	169.4	-85.2	-82.4	0	0	0	109.7	V157 N160 Q161 L162 L178 D179 I183 Y204 N205	V157-N181 PolarHBondContact O-ND2 2.97Å; N160-N181 VanDerWaalsContact CA-OD1 3.26Å; N160-N181 WeakPolarHBondContact CA-OD1 3.49Å; N160-N181 WeakPolarHBondContact CB-OD1 3.22Å; N160-N181 PolarHBondContact N-OD1 3.44Å; N160-N181 PolarHBondContact O-OD1 2.98Å; Q161-N181 PolarHBondContact N-OD1 3.46Å; L162-N181 HydrophobicContact CB-CB 4.23Å; L162-N181 WeakPolarHBondContact CB-OD1 3.41Å; L162-N181 PolarHBondContact N-OD1 2.81Å; L178-N181 PolarHBondContact O-ND2 3Å; D179-N181 PolarHBondContact O-N 2.82Å; D179-N181 PolarHBondContact O-ND2 3.04Å; N181-I183 HydrophobicContact CB-CD1 4.08Å; N181-I183 HydrophobicContact CB-CG1 3.91Å; N181-Y204 PolarHBondContact N-O 3.42Å; N181-N205 VanDerWaalsContact CA-OD1 3.29Å; N181-N205 WeakPolarHBondContact CA-OD1 3.49Å; N181-N205 WeakPolarHBondContact CB-OD1 3.21Å; N181-N205 PolarHBondContact N-OD1 3.01Å; N181-N205 PolarHBondContact O-OD1 2.99Å
182	R	98.7	Very high	97.6	Very high	127 Å²	127	42.1 Å²	42.1	48%	0.479	23%	0.227	S	C	.	.			trans	-118.7	29.7	174.9	-58.6	178.9	-175.1	-179.1	1.1	110.8	L162 S184 N205	L162-R182 CarbonylContact O-C 3.32Å; L162-R182 VanDerWaalsContact O-CA 3.29Å; L162-R182 WeakPolarHBondContact O-CA 3.3Å; L162-R182 PolarHBondContact O-N 2.83Å; R182-S184 PolarHBondContact O-N 3.08Å; R182-S184 VanDerWaalsContact O-N 3.13Å; R182-N205 PolarHBondContact N-OD1 2.78Å
183	I	98.8	Very high	97.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.			trans	-67.2	115.7	-171.6	-64.1	170.6	0	0	0	109	L162 N163 V165 L178 N181 L202 N205 Q206 L207	L162-I183 HydrophobicContact CB-CG1 4.16Å; L162-I183 WeakPolarHBondContact O-CG1 3.29Å; L162-I183 PolarHBondContact O-N 3.2Å; L162-I183 VanDerWaalsContact O-N 3.11Å; N163-I183 WeakPolarHBondContact O-CA 3.09Å; V165-I183 HydrophobicContact CG2-CD1 4.38Å; V165-I183 HydrophobicContact CG2-CG2 4Å; L178-I183 HydrophobicContact CB-CD1 3.78Å; L178-I183 HydrophobicContact CD1-CD1 4.18Å; L178-I183 HydrophobicContact CD2-CD1 4.09Å; L178-I183 HydrophobicContact CG-CD1 4.25Å; N181-I183 HydrophobicContact CB-CD1 4.08Å; N181-I183 HydrophobicContact CB-CG1 3.91Å; I183-L202 HydrophobicContact CD1-CD2 3.94Å; I183-N205 HydrophobicContact CB-CB 4.17Å; I183-N205 VanDerWaalsContact CB-OD1 3.29Å; I183-N205 WeakPolarHBondContact CB-OD1 3.25Å; I183-N205 WeakPolarHBondContact CG1-OD1 3.17Å; I183-N205 PolarHBondContact N-OD1 3.39Å; I183-Q206 CarbonylContact O-C 3.28Å; I183-Q206 WeakPolarHBondContact O-CA 3.16Å; I183-Q206 PolarHBondContact O-N 3Å; I183-L207 HydrophobicContact CG2-CD2 4.01Å; I183-L207 HydrophobicContact CG2-CG 4.25Å; I183-L207 PolarHBondContact O-N 2.9Å
184	S	98.4	Very high	97.3	Very high	55 Å²	55	48 Å²	48	39%	0.385	25%	0.25	S	S	.	.			trans	-109.6	-10.1	176.3	59.7	0	0	0	0	112.7	N163 R182 G211	N163-S184 PolarHBondContact O-N 3.23Å; N163-S184 PolarHBondContact O-OG 2.85Å; R182-S184 PolarHBondContact O-N 3.08Å; R182-S184 VanDerWaalsContact O-N 3.13Å; S184-G211 VanDerWaalsContact O-CA 3.29Å; S184-G211 WeakPolarHBondContact O-CA 3.23Å
185	K	97.6	Very high	97.3	Very high	115 Å²	115	48.6 Å²	48.6	50%	0.5	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-145.9	143	-177.4	-173.6	-179.8	176.6	-171.1	0	112.3	E164 V165	E164-K185 VanDerWaalsContact CA-O 3.27Å; E164-K185 WeakPolarHBondContact CA-O 3.01Å; E164-K185 WeakPolarHBondContact CB-O 3.41Å; V165-K185 PolarHBondContact N-O 3.29Å
186	I	97.9	Very high	97.2	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.036	27%	0.265	C	S	.	.			trans	-105.2	114.6	164.2	-47.7	-163.8	0	0	0	107.4	V165 A190 F191 L202 L207 G211 L212 T216	V165-I186 HydrophobicContact CB-CG2 4.07Å; V165-I186 HydrophobicContact CG1-CG2 4.44Å; V165-I186 HydrophobicContact CG2-CB 4.2Å; V165-I186 HydrophobicContact CG2-CD1 4.12Å; V165-I186 HydrophobicContact CG2-CG1 3.76Å; V165-I186 HydrophobicContact CG2-CG2 4Å; I186-A190 HydrophobicContact CG2-CB 3.9Å; I186-F191 HydrophobicContact CD1-CE2 3.66Å; I186-F191 HydrophobicContact CD1-CZ 4.1Å; I186-F191 HydrophobicContact CG2-CD2 4.21Å; I186-F191 HydrophobicContact CG2-CE2 3.8Å; I186-F191 HydrophobicContact CG2-CZ 4.09Å; I186-L202 HydrophobicContact CD1-CD1 3.96Å; I186-L207 HydrophobicContact CD1-CD1 4.34Å; I186-L207 HydrophobicContact CD1-CD2 4.43Å; I186-L207 HydrophobicContact CG1-CD2 3.82Å; I186-G211 PolarHBondContact N-O 3.37Å; I186-L212 HydrophobicContact CD1-CD1 3.57Å; I186-L212 HydrophobicContact CG1-CD1 4.46Å; I186-T216 HydrophobicContact CB-CG2 4.02Å; I186-T216 HydrophobicContact CD1-CG2 4.47Å; I186-T216 HydrophobicContact CG2-CG2 3.5Å; I186-T216 VanDerWaalsContact CG2-CG2 3.5Å
187	P	95.7	Very high	97.2	Very high	15 Å²	15	50.5 Å²	50.5	10%	0.097	27%	0.265	C	S	.	.			trans	-57.5	148.1	177.3	-25.9	35.9	0	0	0	112.1	E164 V165 G189 A190	E164-P187 HydrophobicContact CB-CG 4.33Å; E164-P187 HydrophobicContact CG-CG 4.42Å; V165-P187 VanDerWaalsContact O-CD 3.29Å; V165-P187 WeakPolarHBondContact O-CD 3.41Å; V165-P187 WeakPolarHBondContact O-CG 3.4Å; P187-G189 PolarHBondContact O-N 3.03Å; P187-A190 HydrophobicContact CB-CB 4.35Å; P187-A190 VanDerWaalsContact O-CB 3.27Å; P187-A190 WeakPolarHBondContact O-CB 3.46Å; P187-A190 PolarHBondContact O-N 3.4Å
188	A	93.2	Very high	97.2	Very high	104 Å²	104	48.4 Å²	48.4	86%	0.86	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	124.6	178.9	0	0	0	0	0	110.1	A190	A188-A190 VanDerWaalsContact C-N 3.31Å; A188-A190 PolarHBondContact O-N 3.28Å
189	G	93.2	Very high	97.2	Very high	45 Å²	45	49.2 Å²	49.2	46%	0.464	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	11	-179.6	0	0	0	0	0	115.7	P187 F191 T192	P187-G189 PolarHBondContact O-N 3.03Å; G189-F191 PolarHBondContact O-N 2.92Å; G189-F191 VanDerWaalsContact O-N 3.14Å; G189-T192 WeakPolarHBondContact CA-OG1 3.5Å; G189-T192 WeakPolarHBondContact O-CB 3.48Å; G189-T192 PolarHBondContact O-N 3.35Å; G189-T192 VanDerWaalsContact O-N 3.08Å; G189-T192 PolarHBondContact O-OG1 2.96Å
190	A	96.1	Very high	97.2	Very high	5 Å²	5	48.2 Å²	48.2	4%	0.041	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.7	175	0	0	0	0	0	113.3	V165 I186 P187 A188	V165-A190 HydrophobicContact CG1-CB 4.12Å; I186-A190 HydrophobicContact CG2-CB 3.9Å; P187-A190 HydrophobicContact CB-CB 4.35Å; P187-A190 VanDerWaalsContact O-CB 3.27Å; P187-A190 WeakPolarHBondContact O-CB 3.46Å; P187-A190 PolarHBondContact O-N 3.4Å; A188-A190 VanDerWaalsContact C-N 3.31Å; A188-A190 PolarHBondContact O-N 3.28Å
191	F	97.1	Very high	97.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	12.3	178.6	-60.3	-32.4	0	0	0	114.2	V165 L169 L176 I186 G189 K193 L194 L200 T216 L217 L220	V165-F191 HydrophobicContact CG1-CD1 4.48Å; V165-F191 HydrophobicContact CG1-CE1 3.56Å; V165-F191 HydrophobicContact CG1-CZ 3.85Å; V165-F191 HydrophobicContact CG2-CZ 4.2Å; L169-F191 HydrophobicContact CD1-CD1 4.21Å; L169-F191 HydrophobicContact CD1-CE1 4.15Å; L176-F191 HydrophobicContact CD2-CE1 3.9Å; I186-F191 HydrophobicContact CD1-CE2 3.66Å; I186-F191 HydrophobicContact CD1-CZ 4.1Å; I186-F191 HydrophobicContact CG2-CD2 4.21Å; I186-F191 HydrophobicContact CG2-CE2 3.8Å; I186-F191 HydrophobicContact CG2-CZ 4.09Å; G189-F191 PolarHBondContact O-N 2.92Å; G189-F191 VanDerWaalsContact O-N 3.14Å; F191-K193 PolarHBondContact O-N 3.07Å; F191-L194 HydrophobicContact CB-CD1 4.3Å; F191-L194 HydrophobicContact CD1-CD1 3.82Å; F191-L194 HydrophobicContact CG-CD1 4.49Å; F191-L194 PolarHBondContact O-N 2.98Å; F191-L200 HydrophobicContact CD2-CD2 4.44Å; F191-L200 HydrophobicContact CE1-CD1 4.4Å; F191-L200 HydrophobicContact CE2-CD2 3.7Å; F191-L200 HydrophobicContact CZ-CD1 4.03Å; F191-L200 HydrophobicContact CZ-CD2 3.75Å; F191-T216 HydrophobicContact CD2-CG2 3.86Å; F191-T216 HydrophobicContact CE2-CG2 4.3Å; F191-L217 HydrophobicContact CD2-CD2 4.09Å; F191-L217 HydrophobicContact CE2-CD2 4.04Å; F191-L220 HydrophobicContact CB-CD2 3.92Å; F191-L220 HydrophobicContact CB-CG 4.4Å; F191-L220 HydrophobicContact CD2-CD1 4.25Å; F191-L220 HydrophobicContact CG-CD2 4.39Å
192	T	94.3	Very high	97.2	Very high	69 Å²	69	43.8 Å²	43.8	42%	0.423	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	129.6	179.5	-60	0	0	0	0	110.5	G189 L194	G189-T192 WeakPolarHBondContact CA-OG1 3.5Å; G189-T192 WeakPolarHBondContact O-CB 3.48Å; G189-T192 PolarHBondContact O-N 3.35Å; G189-T192 VanDerWaalsContact O-N 3.08Å; G189-T192 PolarHBondContact O-OG1 2.96Å; T192-L194 PolarHBondContact O-N 2.98Å; T192-L194 VanDerWaalsContact O-N 3.17Å
193	K	94.3	Very high	97.2	Very high	142 Å²	142	39.3 Å²	39.3	62%	0.617	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	17.7	177.5	-61.3	173.6	179.9	-175.6	0	115.6	T171 F191 E195	T171-K193 HydrophobicContact CG2-CB 3.94Å; F191-K193 PolarHBondContact O-N 3.07Å; K193-E195 PolarHBondContact O-N 3.44Å
194	L	97.9	Very high	97.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.252	C	S	.	.			trans	-78.2	56.3	171.1	-58.7	-169.8	0	0	0	110.8	L169 P170 F191 T192 N196 L197 L220	L169-L194 HydrophobicContact CB-CD1 4.04Å; L169-L194 HydrophobicContact CB-CD2 4.25Å; L169-L194 HydrophobicContact CD1-CD1 4.04Å; P170-L194 VanDerWaalsContact O-CD2 3.25Å; P170-L194 WeakPolarHBondContact O-CD2 3.19Å; F191-L194 HydrophobicContact CB-CD1 4.3Å; F191-L194 HydrophobicContact CD1-CD1 3.82Å; F191-L194 HydrophobicContact CG-CD1 4.49Å; F191-L194 PolarHBondContact O-N 2.98Å; T192-L194 PolarHBondContact O-N 2.98Å; T192-L194 VanDerWaalsContact O-N 3.17Å; L194-N196 PolarHBondContact O-N 3.41Å; L194-L197 HydrophobicContact CB-CB 4.23Å; L194-L197 WeakPolarHBondContact O-CB 3.17Å; L194-L197 PolarHBondContact O-N 3.06Å; L194-L220 HydrophobicContact CB-CD2 3.75Å
195	E	97.3	Very high	97.3	Very high	73 Å²	73	43.1 Å²	43.1	34%	0.341	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-25.9	-173.8	-59.9	-168.2	178.3	0	0	112	K193 L197 K221 N222	K193-E195 PolarHBondContact O-N 3.44Å; E195-L197 VanDerWaalsContact C-N 3.29Å; E195-L197 PolarHBondContact O-N 2.91Å; E195-K221 VanDerWaalsContact CD-NZ 3.34Å; E195-K221 HydrophobicContact CG-CD 4.19Å; E195-K221 WeakPolarHBondContact OE1-CE 3.32Å; E195-K221 IonicContact OE1-NZ 2.73Å; E195-K221 PolarHBondContact OE1-NZ 2.9Å; E195-K221 IonicContact OE2-NZ 3.62Å; E195-K221 PolarHBondContact OE2-NZ 3.42Å; E195-N222 VanDerWaalsContact O-CB 3.27Å; E195-N222 WeakPolarHBondContact O-CB 3.2Å; E195-N222 PolarHBondContact O-N 3.19Å; E195-N222 PolarHBondContact O-ND2 3.45Å
196	N	98.3	Very high	97.3	Very high	81 Å²	81	42.6 Å²	42.6	43%	0.433	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.4	178.5	-68.7	1.7	0	0	0	113.6	L173 L194 T198	L173-N196 CarbonylContact O-C 3.48Å; L194-N196 PolarHBondContact O-N 3.41Å; N196-T198 PolarHBondContact O-N 3.03Å
197	L	98.8	Very high	97.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.235	C	C	.	.			trans	-70.1	118.3	-175.4	-164.1	76.6	0	0	0	110.1	L173 L176 L194 E195 L200 L220 N222 L223	L173-L197 HydrophobicContact CB-CD1 4.36Å; L173-L197 HydrophobicContact CD2-CD1 4.01Å; L173-L197 HydrophobicContact CG-CD1 3.96Å; L173-L197 VanDerWaalsContact O-CA 3.3Å; L173-L197 WeakPolarHBondContact O-CA 2.99Å; L173-L197 PolarHBondContact O-N 3.35Å; L176-L197 HydrophobicContact CB-CD1 3.97Å; L194-L197 HydrophobicContact CB-CB 4.23Å; L194-L197 WeakPolarHBondContact O-CB 3.17Å; L194-L197 PolarHBondContact O-N 3.06Å; E195-L197 VanDerWaalsContact C-N 3.29Å; E195-L197 PolarHBondContact O-N 2.91Å; L197-L200 HydrophobicContact CD2-CB 4.11Å; L197-L220 HydrophobicContact CB-CD2 4.18Å; L197-L220 HydrophobicContact CD2-CD1 4.35Å; L197-L220 HydrophobicContact CD2-CD2 3.77Å; L197-N222 CarbonylContact O-C 3.55Å; L197-L223 HydrophobicContact CD2-CD1 4.17Å; L197-L223 HydrophobicContact CG-CD1 4.22Å; L197-L223 WeakPolarHBondContact O-CA 3.38Å; L197-L223 PolarHBondContact O-N 3.18Å
198	T	98.9	Very high	97.5	Very high	42 Å²	42	43.2 Å²	43.2	26%	0.258	24%	0.242	S	C	.	.			trans	-103.7	-26.2	-179.9	58.5	0	0	0	0	112.4	E174 N196 M224 Q225	E174-T198 PolarHBondContact O-N 3Å; E174-T198 PolarHBondContact O-OG1 3.05Å; E174-T198 VanDerWaalsContact O-OG1 3.08Å; N196-T198 PolarHBondContact O-N 3.03Å; T198-M224 HydrophobicContact CG2-SD 4.22Å; T198-M224 PolarHBondContact O-N 2.83Å; T198-Q225 PolarHBondContact O-N 3.19Å
199	L	98.9	Very high	97.6	Very high	17 Å²	17	41 Å²	41	9%	0.089	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.4	179.8	-174.7	156.4	0	0	0	111.2	E174 Q175 L176 R177 D201 Q225	E174-L199 PolarHBondContact O-N 3.14Å; Q175-L199 HydrophobicContact CB-CB 4.39Å; Q175-L199 HydrophobicContact CG-CB 4.08Å; L176-L199 PolarHBondContact N-O 3.46Å; R177-L199 HydrophobicContact CG-CD2 4.03Å; L199-D201 HydrophobicContact CD2-CB 4.09Å; L199-Q225 HydrophobicContact CG-CB 4.44Å
200	L	98.9	Very high	97.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	112	170.3	177.9	57.3	0	0	0	109.8	L176 F191 L197 L202 L217 L220 L223 Q225 L226 N227	L176-L200 HydrophobicContact CB-CD1 4.12Å; L176-L200 HydrophobicContact CD2-CD1 3.86Å; L176-L200 HydrophobicContact CG-CD1 4.05Å; F191-L200 HydrophobicContact CD2-CD2 4.44Å; F191-L200 HydrophobicContact CE1-CD1 4.4Å; F191-L200 HydrophobicContact CE2-CD2 3.7Å; F191-L200 HydrophobicContact CZ-CD1 4.03Å; F191-L200 HydrophobicContact CZ-CD2 3.75Å; L197-L200 HydrophobicContact CD2-CB 4.11Å; L200-L202 HydrophobicContact CD1-CD1 4.1Å; L200-L202 HydrophobicContact CD1-CG 4.1Å; L200-L202 HydrophobicContact CD2-CD1 3.96Å; L200-L202 HydrophobicContact CG-CD1 3.99Å; L200-L202 HydrophobicContact CG-CG 4.28Å; L200-L217 HydrophobicContact CD2-CD2 4Å; L200-L220 HydrophobicContact CD2-CD1 4.03Å; L200-L223 HydrophobicContact CB-CD1 3.87Å; L200-Q225 PolarHBondContact N-O 3.08Å; L200-L226 HydrophobicContact CB-CD1 4.18Å; L200-L226 HydrophobicContact CD2-CD1 3.92Å; L200-L226 HydrophobicContact CG-CD1 4.09Å; L200-N227 PolarHBondContact O-N 2.91Å
201	D	98.9	Very high	97.8	Very high	21 Å²	21	44 Å²	44	11%	0.112	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.5	175.8	-158.6	-18.9	0	0	0	111.6	L176 R177 L178 D179 L199 H203 N227	L176-D201 PolarHBondContact O-N 3.06Å; R177-D201 HydrophobicContact CG-CB 4.3Å; L178-D201 CarbonylContact C-O 3.32Å; L178-D201 WeakPolarHBondContact CA-O 3.15Å; L178-D201 PolarHBondContact N-O 2.95Å; D179-D201 PolarHBondContact N-O 3.03Å; L199-D201 HydrophobicContact CD2-CB 4.09Å; D201-H203 WeakPolarHBondContact OD1-CB 3.45Å; D201-H203 PolarHBondContact OD1-N 3.39Å; D201-N227 HydrophobicContact CB-CB 4.49Å; D201-N227 WeakPolarHBondContact OD1-CB 3.17Å; D201-N227 PolarHBondContact OD1-ND2 3.17Å; D201-N227 VanDerWaalsContact OD1-ND2 3.12Å; D201-N227 PolarHBondContact OD2-ND2 3.12Å
202	L	98.9	Very high	97.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.			trans	-121	19.9	176.7	-75.3	163.1	0	0	0	111	V165 L178 I183 I186 L200 N205 L207 N227 L228 N231	V165-L202 HydrophobicContact CG2-CD2 4.17Å; L178-L202 HydrophobicContact CB-CD2 3.82Å; L178-L202 HydrophobicContact CD1-CD2 3.95Å; I183-L202 HydrophobicContact CD1-CD2 3.94Å; I186-L202 HydrophobicContact CD1-CD1 3.96Å; L200-L202 HydrophobicContact CD1-CD1 4.1Å; L200-L202 HydrophobicContact CD1-CG 4.1Å; L200-L202 HydrophobicContact CD2-CD1 3.96Å; L200-L202 HydrophobicContact CG-CD1 3.99Å; L200-L202 HydrophobicContact CG-CG 4.28Å; L202-N205 PolarHBondContact O-ND2 3.47Å; L202-L207 HydrophobicContact CB-CD1 4.21Å; L202-L207 HydrophobicContact CD1-CD1 3.96Å; L202-L207 HydrophobicContact CD2-CD1 4.32Å; L202-L207 HydrophobicContact CG-CD1 4.41Å; L202-N227 CarbonylContact C-O 3.37Å; L202-N227 WeakPolarHBondContact CA-O 3.42Å; L202-N227 PolarHBondContact N-O 3.08Å; L202-L228 HydrophobicContact CB-CD2 3.91Å; L202-L228 HydrophobicContact CD1-CD2 3.93Å; L202-N231 PolarHBondContact O-ND2 3.29Å; L202-N231 VanDerWaalsContact O-ND2 3.07Å
203	H	98.8	Very high	97.5	Very high	32 Å²	32	42.3 Å²	42.3	15%	0.148	23%	0.225	C	C	.	.			trans	-57.9	143.5	179.4	157.1	-98.3	0	0	0	112.5	D179 R180 D201 N205 N227 A229 H230	D179-H203 CarbonylContact C-O 3.06Å; D179-H203 WeakPolarHBondContact CA-O 3.35Å; D179-H203 HydrophobicContact CB-CB 4.03Å; D179-H203 VanDerWaalsContact CB-O 3.3Å; D179-H203 WeakPolarHBondContact CB-O 3.02Å; R180-H203 PolarHBondContact N-O 3.33Å; D201-H203 WeakPolarHBondContact OD1-CB 3.45Å; D201-H203 PolarHBondContact OD1-N 3.39Å; H203-N205 PolarHBondContact O-ND2 3.46Å; H203-N227 WeakPolarHBondContact CB-ND2 3.27Å; H203-N227 PolarHBondContact N-O 3Å; H203-A229 CarbonylContact C-O 3.55Å; H203-A229 VanDerWaalsContact CA-O 3.23Å; H203-A229 WeakPolarHBondContact CA-O 3.47Å; H203-H230 AromaticContact CD2-CD2 3.7Å; H203-H230 AromaticContact NE2-CD2 3.36Å; H203-H230 PolarHBondContact NE2-CD2 3.15Å; H203-H230 AromaticContact NE2-CG 3.94Å
204	Y	98.8	Very high	97.1	Very high	123 Å²	123	44.5 Å²	44.5	48%	0.482	24%	0.235	S	C	.	.	S	Bend	trans	58.3	63.2	177.4	-155.2	-82.2	0	0	0	111.6	R180 N181 A229 H230	R180-Y204 WeakPolarHBondContact CA-O 3.47Å; R180-Y204 HydrophobicContact CB-CD1 4.38Å; R180-Y204 HydrophobicContact CG-CD1 4.16Å; R180-Y204 HydrophobicContact CG-CG 4.11Å; R180-Y204 PolarHBondContact N-O 3.43Å; N181-Y204 PolarHBondContact N-O 3.42Å; Y204-A229 PolarHBondContact N-O 3.44Å; Y204-H230 WeakPolarHBondContact CA-O 3.17Å; Y204-H230 HydrophobicContact CD2-CB 4.01Å; Y204-H230 AromaticContact CD2-ND1 3.95Å; Y204-H230 HydrophobicContact CG-CB 4.47Å; Y204-H230 PolarHBondContact N-O 3.09Å
205	N	98.9	Very high	96.6	Very high	12 Å²	12	49 Å²	49	6%	0.064	26%	0.258	C	S	.	.	S	Bend	trans	-132.5	-163.5	174.8	-85.4	-69.3	0	0	0	109	L178 N181 R182 I183 L202 H203 H230 N231	L178-N205 PolarHBondContact O-ND2 3.33Å; N181-N205 VanDerWaalsContact CA-OD1 3.29Å; N181-N205 WeakPolarHBondContact CA-OD1 3.49Å; N181-N205 WeakPolarHBondContact CB-OD1 3.21Å; N181-N205 PolarHBondContact N-OD1 3.01Å; N181-N205 PolarHBondContact O-OD1 2.99Å; R182-N205 PolarHBondContact N-OD1 2.78Å; I183-N205 HydrophobicContact CB-CB 4.17Å; I183-N205 VanDerWaalsContact CB-OD1 3.29Å; I183-N205 WeakPolarHBondContact CB-OD1 3.25Å; I183-N205 WeakPolarHBondContact CG1-OD1 3.17Å; I183-N205 PolarHBondContact N-OD1 3.39Å; L202-N205 PolarHBondContact O-ND2 3.47Å; H203-N205 PolarHBondContact O-ND2 3.46Å; N205-H230 PolarHBondContact N-O 2.68Å; N205-H230 VanDerWaalsContact N-O 3.12Å; N205-N231 WeakPolarHBondContact CA-OD1 3.4Å; N205-N231 WeakPolarHBondContact CB-OD1 3.45Å; N205-N231 PolarHBondContact O-OD1 2.82Å
206	Q	98.6	Very high	96.4	Very high	104 Å²	104	46.7 Å²	46.7	49%	0.486	25%	0.249	S	C	.	.			trans	-124.3	28.7	-175.3	-57.6	177	12.9	0	0	111.2	I183 S208 N231	I183-Q206 CarbonylContact O-C 3.28Å; I183-Q206 WeakPolarHBondContact O-CA 3.16Å; I183-Q206 PolarHBondContact O-N 3Å; Q206-S208 PolarHBondContact O-N 3.34Å; Q206-N231 PolarHBondContact N-OD1 3.02Å
207	L	98.5	Very high	96.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.229	C	C	.	.			trans	-69.3	126.9	-178.3	-74	168	0	0	0	110.9	I183 I186 L202 L228 N231 V232 L233	I183-L207 HydrophobicContact CG2-CD2 4.01Å; I183-L207 HydrophobicContact CG2-CG 4.25Å; I183-L207 PolarHBondContact O-N 2.9Å; I186-L207 HydrophobicContact CD1-CD1 4.34Å; I186-L207 HydrophobicContact CD1-CD2 4.43Å; I186-L207 HydrophobicContact CG1-CD2 3.82Å; L202-L207 HydrophobicContact CB-CD1 4.21Å; L202-L207 HydrophobicContact CD1-CD1 3.96Å; L202-L207 HydrophobicContact CD2-CD1 4.32Å; L202-L207 HydrophobicContact CG-CD1 4.41Å; L207-L228 HydrophobicContact CD1-CD2 3.95Å; L207-N231 HydrophobicContact CB-CB 4.32Å; L207-N231 WeakPolarHBondContact CB-OD1 3.38Å; L207-N231 PolarHBondContact N-OD1 3.22Å; L207-V232 CarbonylContact O-C 3.28Å; L207-V232 WeakPolarHBondContact O-CG2 3.5Å; L207-V232 PolarHBondContact O-N 3.17Å; L207-L233 HydrophobicContact CB-CD2 4.43Å; L207-L233 PolarHBondContact O-N 3.37Å
208	S	98.2	Very high	96.1	Very high	36 Å²	36	48.7 Å²	48.7	25%	0.252	25%	0.254	S	S	.	.			trans	-107	170.8	169	67.4	0	0	0	0	110.5	Q206 S210 G211 L212	Q206-S208 PolarHBondContact O-N 3.34Å; S208-S210 PolarHBondContact O-N 3.2Å; S208-S210 PolarHBondContact OG-OG 3.39Å; S208-S210 VanDerWaalsContact OG-OG 3.06Å; S208-G211 WeakPolarHBondContact O-CA 3.48Å; S208-G211 PolarHBondContact O-N 3.42Å; S208-G211 PolarHBondContact OG-N 2.97Å; S208-L212 PolarHBondContact O-N 3.12Å
209	D	97.1	Very high	95.9	Very high	58 Å²	58	48.7 Å²	48.7	31%	0.31	25%	0.253	S	S	.	.	H	α-helix	trans	-53.3	-39.6	178.4	-53.2	-18.8	0	0	0	112.5	K234 K235	D209-K234 PolarHBondContact OD1-N 2.92Å; D209-K234 WeakPolarHBondContact OD2-CB 3.33Å; D209-K235 PolarHBondContact OD1-N 3.41Å; D209-K235 VanDerWaalsContact OD1-N 3.12Å
210	S	96.1	Very high	95.8	Very high	107 Å²	107	47.9 Å²	47.9	75%	0.748	25%	0.249	S	C	*	.	H	α-helix	trans	-72.8	-31.1	176.9	55	0	0	0	0	112.9	S208	S208-S210 PolarHBondContact O-N 3.2Å; S208-S210 PolarHBondContact OG-OG 3.39Å; S208-S210 VanDerWaalsContact OG-OG 3.06Å
211	G	96.5	Very high	95.7	Very high	5 Å²	5	53 Å²	53	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-73.3	-35.8	-179.9	0	0	0	0	0	113.1	S184 I186 S208	S184-G211 VanDerWaalsContact O-CA 3.29Å; S184-G211 WeakPolarHBondContact O-CA 3.23Å; I186-G211 PolarHBondContact N-O 3.37Å; S208-G211 WeakPolarHBondContact O-CA 3.48Å; S208-G211 PolarHBondContact O-N 3.42Å; S208-G211 PolarHBondContact OG-N 2.97Å
212	L	95.4	Very high	95.7	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-69.8	-34	175.9	-175.6	60.6	0	0	0	112	I186 S208 T216 L217 L228 P237	I186-L212 HydrophobicContact CD1-CD1 3.57Å; I186-L212 HydrophobicContact CG1-CD1 4.46Å; S208-L212 PolarHBondContact O-N 3.12Å; L212-T216 WeakPolarHBondContact O-CB 3.23Å; L212-T216 PolarHBondContact O-OG1 3.39Å; L212-L217 HydrophobicContact CD1-CD1 4.34Å; L212-L217 HydrophobicContact CD1-CG 4.44Å; L212-L217 HydrophobicContact CD2-CD1 4.48Å; L212-L228 HydrophobicContact CD2-CD1 4.5Å; L212-P237 HydrophobicContact CD2-CB 3.38Å
213	G	89.3	Confident	95.7	Very high	29 Å²	29	56.1 Å²	56.1	30%	0.299	29%	0.288	S	S	.	.			trans	74.7	156.5	-179.3	0	0	0	0	0	113.3	T216	G213-T216 PolarHBondContact O-OG1 2.79Å
214	K	86.6	Confident	95.7	Very high	188 Å²	188	59 Å²	59	82%	0.817	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	132.3	176.3	-64.7	-178.2	-178.7	-179.8	0	109.2	T216	K214-T216 PolarHBondContact O-N 3.05Å
215	N	86.3	Confident	95.7	Very high	93 Å²	93	55.2 Å²	55.2	50%	0.497	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	15.3	174.3	-51.5	-38.8	0	0	0	115.7	L217 K218	N215-L217 PolarHBondContact O-N 2.86Å; N215-K218 HydrophobicContact CB-CB 4.49Å; N215-K218 HydrophobicContact CB-CD 4.06Å; N215-K218 HydrophobicContact CB-CG 4.41Å; N215-K218 VanDerWaalsContact O-CG 3.26Å; N215-K218 WeakPolarHBondContact O-CG 3.37Å; N215-K218 PolarHBondContact O-N 3.02Å
216	T	94.1	Very high	95.7	Very high	25 Å²	25	54.7 Å²	54.7	15%	0.153	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.3	179.5	-54.9	0	0	0	0	112.8	I186 F191 L212 G213 K214	I186-T216 HydrophobicContact CB-CG2 4.02Å; I186-T216 HydrophobicContact CD1-CG2 4.47Å; I186-T216 HydrophobicContact CG2-CG2 3.5Å; I186-T216 VanDerWaalsContact CG2-CG2 3.5Å; F191-T216 HydrophobicContact CD2-CG2 3.86Å; F191-T216 HydrophobicContact CE2-CG2 4.3Å; L212-T216 WeakPolarHBondContact O-CB 3.23Å; L212-T216 PolarHBondContact O-OG1 3.39Å; G213-T216 PolarHBondContact O-OG1 2.79Å; K214-T216 PolarHBondContact O-N 3.05Å
217	L	96.3	Very high	95.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-5.3	-177	-58.6	173.4	0	0	0	113.7	F191 L200 L212 N215 D219 L220 L226 P237 G239 V240	F191-L217 HydrophobicContact CD2-CD2 4.09Å; F191-L217 HydrophobicContact CE2-CD2 4.04Å; L200-L217 HydrophobicContact CD2-CD2 4Å; L212-L217 HydrophobicContact CD1-CD1 4.34Å; L212-L217 HydrophobicContact CD1-CG 4.44Å; L212-L217 HydrophobicContact CD2-CD1 4.48Å; N215-L217 PolarHBondContact O-N 2.86Å; L217-D219 VanDerWaalsContact C-N 3.27Å; L217-D219 PolarHBondContact O-N 2.94Å; L217-L220 HydrophobicContact CB-CD1 4.35Å; L217-L220 HydrophobicContact CD2-CD1 3.72Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.01Å; L217-L226 HydrophobicContact CD1-CD2 3.81Å; L217-P237 HydrophobicContact CD1-CB 4.39Å; L217-G239 CarbonylContact C-O 3.42Å; L217-G239 VanDerWaalsContact C-O 3.28Å; L217-G239 WeakPolarHBondContact CB-O 3.49Å; L217-V240 HydrophobicContact CD1-CG2 3.86Å
218	K	94.1	Very high	95.7	Very high	122 Å²	122	50.6 Å²	50.6	53%	0.53	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.2	-168.2	76	173	171.7	170	0	114	N215 L220 G239	N215-K218 HydrophobicContact CB-CB 4.49Å; N215-K218 HydrophobicContact CB-CD 4.06Å; N215-K218 HydrophobicContact CB-CG 4.41Å; N215-K218 VanDerWaalsContact O-CG 3.26Å; N215-K218 WeakPolarHBondContact O-CG 3.37Å; N215-K218 PolarHBondContact O-N 3.02Å; K218-L220 VanDerWaalsContact C-N 3.29Å; K218-G239 WeakPolarHBondContact CA-O 3.25Å; K218-G239 PolarHBondContact N-O 2.75Å
219	D	94.4	Very high	95.7	Very high	43 Å²	43	49.1 Å²	49.1	23%	0.23	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.9	-173.4	-68.9	-17.9	0	0	0	111.7	L217 K221	L217-D219 VanDerWaalsContact C-N 3.27Å; L217-D219 PolarHBondContact O-N 2.94Å; D219-K221 PolarHBondContact O-N 2.97Å
220	L	97.7	Very high	95.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.			trans	-80.2	57.6	179.4	-56.1	-179.9	0	0	0	111.3	F191 L194 L197 L200 L217 K218 N222 L223 P241	F191-L220 HydrophobicContact CB-CD2 3.92Å; F191-L220 HydrophobicContact CB-CG 4.4Å; F191-L220 HydrophobicContact CD2-CD1 4.25Å; F191-L220 HydrophobicContact CG-CD2 4.39Å; L194-L220 HydrophobicContact CB-CD2 3.75Å; L197-L220 HydrophobicContact CB-CD2 4.18Å; L197-L220 HydrophobicContact CD2-CD1 4.35Å; L197-L220 HydrophobicContact CD2-CD2 3.77Å; L200-L220 HydrophobicContact CD2-CD1 4.03Å; L217-L220 HydrophobicContact CB-CD1 4.35Å; L217-L220 HydrophobicContact CD2-CD1 3.72Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.01Å; K218-L220 VanDerWaalsContact C-N 3.29Å; L220-N222 VanDerWaalsContact C-N 3.26Å; L220-N222 PolarHBondContact O-N 3.06Å; L220-N222 VanDerWaalsContact O-N 3.13Å; L220-L223 HydrophobicContact CB-CB 3.95Å; L220-L223 HydrophobicContact CB-CD2 4.28Å; L220-L223 HydrophobicContact CD1-CD1 4.48Å; L220-L223 HydrophobicContact CD1-CD2 3.89Å; L220-L223 VanDerWaalsContact O-CB 3.3Å; L220-L223 WeakPolarHBondContact O-CB 3.39Å; L220-L223 PolarHBondContact O-N 3.36Å; L220-P241 HydrophobicContact CB-CG 4.31Å; L220-P241 WeakPolarHBondContact O-CB 3.13Å; L220-P241 VanDerWaalsContact O-CG 3.27Å; L220-P241 WeakPolarHBondContact O-CG 3.26Å
221	K	96.4	Very high	95.9	Very high	108 Å²	108	44.7 Å²	44.7	47%	0.47	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31	-166.5	-66.3	176.8	-175.2	161.7	0	114.7	E195 D219 S243	E195-K221 VanDerWaalsContact CD-NZ 3.34Å; E195-K221 HydrophobicContact CG-CD 4.19Å; E195-K221 WeakPolarHBondContact OE1-CE 3.32Å; E195-K221 IonicContact OE1-NZ 2.73Å; E195-K221 PolarHBondContact OE1-NZ 2.9Å; E195-K221 IonicContact OE2-NZ 3.62Å; E195-K221 PolarHBondContact OE2-NZ 3.42Å; D219-K221 PolarHBondContact O-N 2.97Å; K221-S243 WeakPolarHBondContact O-CB 3.46Å; K221-S243 PolarHBondContact O-OG 3.04Å
222	N	98.1	Very high	96	Very high	86 Å²	86	46.9 Å²	46.9	46%	0.46	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	18.3	179.4	-60.4	-61.1	0	0	0	113.5	E195 L197 L220 M224	E195-N222 VanDerWaalsContact O-CB 3.27Å; E195-N222 WeakPolarHBondContact O-CB 3.2Å; E195-N222 PolarHBondContact O-N 3.19Å; E195-N222 PolarHBondContact O-ND2 3.45Å; L197-N222 CarbonylContact O-C 3.55Å; L220-N222 VanDerWaalsContact C-N 3.26Å; L220-N222 PolarHBondContact O-N 3.06Å; L220-N222 VanDerWaalsContact O-N 3.13Å; N222-M224 PolarHBondContact O-N 3.38Å
223	L	98.7	Very high	96.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.			trans	-66.1	119.9	180	-164.3	72.2	0	0	0	110.5	L197 L200 L220 L226 P241 S243 L244	L197-L223 HydrophobicContact CD2-CD1 4.17Å; L197-L223 HydrophobicContact CG-CD1 4.22Å; L197-L223 WeakPolarHBondContact O-CA 3.38Å; L197-L223 PolarHBondContact O-N 3.18Å; L200-L223 HydrophobicContact CB-CD1 3.87Å; L220-L223 HydrophobicContact CB-CB 3.95Å; L220-L223 HydrophobicContact CB-CD2 4.28Å; L220-L223 HydrophobicContact CD1-CD1 4.48Å; L220-L223 HydrophobicContact CD1-CD2 3.89Å; L220-L223 VanDerWaalsContact O-CB 3.3Å; L220-L223 WeakPolarHBondContact O-CB 3.39Å; L220-L223 PolarHBondContact O-N 3.36Å; L223-L226 HydrophobicContact CD2-CB 3.99Å; L223-L226 HydrophobicContact CD2-CD1 4.37Å; L223-P241 HydrophobicContact CB-CG 3.75Å; L223-P241 HydrophobicContact CD2-CG 4.11Å; L223-S243 PolarHBondContact N-OG 3.32Å; L223-S243 CarbonylContact O-C 3.37Å; L223-S243 PolarHBondContact O-OG 2.8Å; L223-S243 VanDerWaalsContact O-OG 3.14Å; L223-L244 HydrophobicContact CB-CD2 4.33Å; L223-L244 HydrophobicContact CD2-CD2 4.01Å; L223-L244 HydrophobicContact CG-CD2 3.9Å; L223-L244 WeakPolarHBondContact O-CA 3.16Å; L223-L244 WeakPolarHBondContact O-CD2 3.43Å; L223-L244 PolarHBondContact O-N 2.81Å; L223-L244 VanDerWaalsContact O-N 3.16Å
224	M	98.8	Very high	96.6	Very high	91 Å²	91	50.8 Å²	50.8	45%	0.448	24%	0.244	S	C	.	.			trans	-99.9	-31.9	180	-61.5	172.7	70.8	0	0	111.7	T198 N222 L244 I245 Q246	T198-M224 HydrophobicContact CG2-SD 4.22Å; T198-M224 PolarHBondContact O-N 2.83Å; N222-M224 PolarHBondContact O-N 3.38Å; M224-L244 VanDerWaalsContact C-CD2 3.44Å; M224-L244 WeakPolarHBondContact O-CD2 3.09Å; M224-I245 HydrophobicContact CB-CD1 4.49Å; M224-I245 HydrophobicContact CE-CD1 3.48Å; M224-I245 VanDerWaalsContact CE-CD1 3.48Å; M224-I245 PolarHBondContact O-N 3.05Å; M224-Q246 PolarHBondContact O-N 3.38Å
225	Q	98.9	Very high	97.1	Very high	45 Å²	45	48.3 Å²	48.3	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124	-179.3	-179.6	177.2	-27.7	0	0	111.4	T198 L199 L200 Q246 F248	T198-Q225 PolarHBondContact O-N 3.19Å; L199-Q225 HydrophobicContact CG-CB 4.44Å; L200-Q225 PolarHBondContact N-O 3.08Å; Q225-Q246 HydrophobicContact CB-CB 4.27Å; Q225-Q246 HydrophobicContact CG-CB 4.01Å; Q225-F248 HydrophobicContact CG-CE2 4.44Å
226	L	98.9	Very high	97.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.8	172.5	177.9	59.3	0	0	0	109.9	L200 L217 L223 L228 V240 L244 Q246 L247 F248	L200-L226 HydrophobicContact CB-CD1 4.18Å; L200-L226 HydrophobicContact CD2-CD1 3.92Å; L200-L226 HydrophobicContact CG-CD1 4.09Å; L217-L226 HydrophobicContact CD1-CD2 3.81Å; L223-L226 HydrophobicContact CD2-CB 3.99Å; L223-L226 HydrophobicContact CD2-CD1 4.37Å; L226-L228 HydrophobicContact CD1-CD1 4.12Å; L226-L228 HydrophobicContact CD1-CG 3.97Å; L226-L228 HydrophobicContact CD2-CD1 3.82Å; L226-L228 HydrophobicContact CD2-CG 4.48Å; L226-L228 HydrophobicContact CG-CD1 3.97Å; L226-L228 HydrophobicContact CG-CG 4.08Å; L226-V240 HydrophobicContact CD2-CG1 4.3Å; L226-V240 HydrophobicContact CD2-CG2 4.07Å; L226-L244 HydrophobicContact CB-CD1 3.9Å; L226-L244 HydrophobicContact CB-CD2 3.83Å; L226-L244 HydrophobicContact CD2-CD1 4.39Å; L226-Q246 PolarHBondContact N-O 3.34Å; L226-L247 HydrophobicContact CB-CD1 4.2Å; L226-L247 HydrophobicContact CD2-CD1 3.97Å; L226-L247 HydrophobicContact CG-CD1 4.19Å; L226-F248 PolarHBondContact O-N 2.96Å
227	N	98.9	Very high	97.8	Very high	18 Å²	18	43.5 Å²	43.5	10%	0.096	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.4	176.1	-170.6	3.5	0	0	0	110.9	L200 D201 L202 H203 A229 F248	L200-N227 PolarHBondContact O-N 2.91Å; D201-N227 HydrophobicContact CB-CB 4.49Å; D201-N227 WeakPolarHBondContact OD1-CB 3.17Å; D201-N227 PolarHBondContact OD1-ND2 3.17Å; D201-N227 VanDerWaalsContact OD1-ND2 3.12Å; D201-N227 PolarHBondContact OD2-ND2 3.12Å; L202-N227 CarbonylContact C-O 3.37Å; L202-N227 WeakPolarHBondContact CA-O 3.42Å; L202-N227 PolarHBondContact N-O 3.08Å; H203-N227 WeakPolarHBondContact CB-ND2 3.27Å; H203-N227 PolarHBondContact N-O 3Å; N227-A229 WeakPolarHBondContact OD1-CB 3.4Å; N227-A229 PolarHBondContact OD1-N 3.42Å; N227-F248 HydrophobicContact CB-CB 4.44Å; N227-F248 HydrophobicContact CB-CD2 4.09Å; N227-F248 WeakPolarHBondContact OD1-CB 3.41Å
228	L	98.9	Very high	97.7	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.227	C	C	.	.			trans	-119.7	14.8	177.1	-72.9	168.3	0	0	0	111.4	L202 L207 L212 L226 N231 L233 P237 F248 L249 N252	L202-L228 HydrophobicContact CB-CD2 3.91Å; L202-L228 HydrophobicContact CD1-CD2 3.93Å; L207-L228 HydrophobicContact CD1-CD2 3.95Å; L212-L228 HydrophobicContact CD2-CD1 4.5Å; L226-L228 HydrophobicContact CD1-CD1 4.12Å; L226-L228 HydrophobicContact CD1-CG 3.97Å; L226-L228 HydrophobicContact CD2-CD1 3.82Å; L226-L228 HydrophobicContact CD2-CG 4.48Å; L226-L228 HydrophobicContact CG-CD1 3.97Å; L226-L228 HydrophobicContact CG-CG 4.08Å; L228-N231 PolarHBondContact O-ND2 3.31Å; L228-L233 HydrophobicContact CB-CD1 4.14Å; L228-L233 HydrophobicContact CD1-CD1 4.28Å; L228-P237 HydrophobicContact CD1-CB 4.21Å; L228-P237 HydrophobicContact CD1-CG 4.06Å; L228-F248 CarbonylContact C-O 3.22Å; L228-F248 WeakPolarHBondContact CA-O 3.19Å; L228-F248 PolarHBondContact N-O 3.05Å; L228-L249 HydrophobicContact CB-CD2 3.72Å; L228-L249 HydrophobicContact CD1-CD2 4.13Å; L228-N252 PolarHBondContact O-ND2 3.48Å
229	A	98.9	Very high	97.7	Very high	5 Å²	5	41.7 Å²	41.7	4%	0.041	22%	0.218	C	C	.	.			trans	-61.7	153.6	178.7	0	0	0	0	0	111.8	H203 Y204 N227 N231 F248 D250	H203-A229 CarbonylContact C-O 3.55Å; H203-A229 VanDerWaalsContact CA-O 3.23Å; H203-A229 WeakPolarHBondContact CA-O 3.47Å; Y204-A229 PolarHBondContact N-O 3.44Å; N227-A229 WeakPolarHBondContact OD1-CB 3.4Å; N227-A229 PolarHBondContact OD1-N 3.42Å; A229-N231 PolarHBondContact O-ND2 3.18Å; A229-F248 HydrophobicContact CB-CB 4.46Å; A229-F248 PolarHBondContact N-O 2.82Å; A229-D250 CarbonylContact C-O 3.05Å; A229-D250 WeakPolarHBondContact CA-O 3.26Å; A229-D250 HydrophobicContact CB-CB 3.96Å; A229-D250 WeakPolarHBondContact CB-O 3.17Å
230	H	98.8	Very high	97.8	Very high	62 Å²	62	40.4 Å²	40.4	29%	0.287	21%	0.212	S	C	.	.	S	Bend	trans	55	57.2	-177.1	-75.8	-98.5	0	0	0	112.6	H203 Y204 N205 D250 K251	H203-H230 AromaticContact CD2-CD2 3.7Å; H203-H230 AromaticContact NE2-CD2 3.36Å; H203-H230 PolarHBondContact NE2-CD2 3.15Å; H203-H230 AromaticContact NE2-CG 3.94Å; Y204-H230 WeakPolarHBondContact CA-O 3.17Å; Y204-H230 HydrophobicContact CD2-CB 4.01Å; Y204-H230 AromaticContact CD2-ND1 3.95Å; Y204-H230 HydrophobicContact CG-CB 4.47Å; Y204-H230 PolarHBondContact N-O 3.09Å; N205-H230 PolarHBondContact N-O 2.68Å; N205-H230 VanDerWaalsContact N-O 3.12Å; H230-D250 PolarHBondContact N-O 3.29Å; H230-K251 WeakPolarHBondContact CA-O 3.44Å; H230-K251 WeakPolarHBondContact CE1-CD 3.36Å; H230-K251 PolarHBondContact CE1-NZ 3.48Å; H230-K251 WeakPolarHBondContact NE2-CD 3.4Å; H230-K251 PolarHBondContact NE2-NZ 2.61Å
231	N	98.9	Very high	97.7	Very high	9 Å²	9	41 Å²	41	5%	0.048	22%	0.215	C	C	.	.	S	Bend	trans	-126.9	-162.2	170.8	-82.7	-78.8	0	0	0	109.4	L202 N205 Q206 L207 L228 A229 L233 N252	L202-N231 PolarHBondContact O-ND2 3.29Å; L202-N231 VanDerWaalsContact O-ND2 3.07Å; N205-N231 WeakPolarHBondContact CA-OD1 3.4Å; N205-N231 WeakPolarHBondContact CB-OD1 3.45Å; N205-N231 PolarHBondContact O-OD1 2.82Å; Q206-N231 PolarHBondContact N-OD1 3.02Å; L207-N231 HydrophobicContact CB-CB 4.32Å; L207-N231 WeakPolarHBondContact CB-OD1 3.38Å; L207-N231 PolarHBondContact N-OD1 3.22Å; L228-N231 PolarHBondContact O-ND2 3.31Å; A229-N231 PolarHBondContact O-ND2 3.18Å; N231-L233 HydrophobicContact CB-CG 4.3Å; N231-N252 VanDerWaalsContact CA-OD1 3.32Å; N231-N252 WeakPolarHBondContact CA-OD1 3.36Å; N231-N252 WeakPolarHBondContact CB-OD1 3.31Å; N231-N252 PolarHBondContact N-OD1 3.27Å; N231-N252 PolarHBondContact O-OD1 3.25Å
232	V	98.5	Very high	97.7	Very high	52 Å²	52	39.8 Å²	39.8	32%	0.315	21%	0.214	S	C	.	.			trans	-122.9	33.3	179.6	-65	0	0	0	0	112	L207 N252	L207-V232 CarbonylContact O-C 3.28Å; L207-V232 WeakPolarHBondContact O-CG2 3.5Å; L207-V232 PolarHBondContact O-N 3.17Å; V232-N252 PolarHBondContact N-OD1 3.28Å
233	L	98.6	Very high	97.6	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	20%	0.2	C	C	.	.			trans	-68.3	134.5	178	-57.9	175.1	0	0	0	110.3	L207 L228 N231 L249 N252 R253 I254	L207-L233 HydrophobicContact CB-CD2 4.43Å; L207-L233 PolarHBondContact O-N 3.37Å; L228-L233 HydrophobicContact CB-CD1 4.14Å; L228-L233 HydrophobicContact CD1-CD1 4.28Å; N231-L233 HydrophobicContact CB-CG 4.3Å; L233-L249 HydrophobicContact CD1-CD2 3.89Å; L233-N252 HydrophobicContact CB-CB 4.22Å; L233-N252 WeakPolarHBondContact CB-OD1 3.44Å; L233-N252 WeakPolarHBondContact CG-OD1 3.45Å; L233-N252 PolarHBondContact N-OD1 3.3Å; L233-R253 CarbonylContact O-C 3.47Å; L233-R253 VanDerWaalsContact O-C 3.26Å; L233-R253 VanDerWaalsContact O-CA 3.31Å; L233-R253 WeakPolarHBondContact O-CA 3.31Å; L233-R253 PolarHBondContact O-N 2.8Å; L233-I254 HydrophobicContact CB-CG1 4.37Å; L233-I254 PolarHBondContact O-N 2.99Å
234	K	98.1	Very high	97.6	Very high	116 Å²	116	36.8 Å²	36.8	50%	0.504	20%	0.2	S	C	.	.			trans	-103	-19	172	-63	-175.9	176.1	-173.2	0	112.5	D209 R253 I254 D255	D209-K234 PolarHBondContact OD1-N 2.92Å; D209-K234 WeakPolarHBondContact OD2-CB 3.33Å; K234-R253 WeakPolarHBondContact CA-O 3.36Å; K234-R253 HydrophobicContact CG-CB 4.25Å; K234-I254 WeakPolarHBondContact O-CA 3.14Å; K234-D255 PolarHBondContact O-N 2.86Å
235	K	97.9	Very high	97.6	Very high	135 Å²	135	34.9 Å²	34.9	59%	0.587	19%	0.191	S	C	*	.	B	Isolated β-bridge	trans	-122.7	156.7	-179.7	-63.2	-177.6	-178.8	-172.8	0	111	D209	D209-K235 PolarHBondContact OD1-N 3.41Å; D209-K235 VanDerWaalsContact OD1-N 3.12Å
236	M	97.9	Very high	97.6	Very high	14 Å²	14	35.4 Å²	35.4	7%	0.069	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-57.9	135.6	166	-66.6	-63.9	-71.4	0	0	110.5	A238 L247 L249 I254 D256 I257 Y261 F262 L273	M236-A238 PolarHBondContact O-N 2.83Å; M236-L247 HydrophobicContact CE-CD2 4.4Å; M236-L249 HydrophobicContact CE-CD1 3.69Å; M236-L249 HydrophobicContact SD-CD1 3.84Å; M236-I254 HydrophobicContact CG-CG2 4.19Å; M236-I254 HydrophobicContact SD-CD1 4.08Å; M236-I254 HydrophobicContact SD-CG2 3.99Å; M236-D256 WeakPolarHBondContact CG-O 3.25Å; M236-I257 HydrophobicContact CG-CB 4.18Å; M236-I257 HydrophobicContact CG-CG1 3.96Å; M236-I257 HydrophobicContact CG-CG2 4.13Å; M236-I257 HydrophobicContact SD-CG1 4.14Å; M236-Y261 HydrophobicContact CB-CD2 3.95Å; M236-Y261 HydrophobicContact CB-CE2 3.54Å; M236-Y261 HydrophobicContact CE-CD1 3.82Å; M236-Y261 HydrophobicContact CE-CE1 3.39Å; M236-Y261 HydrophobicContact CE-CE2 4.39Å; M236-Y261 HydrophobicContact CE-CG 4.5Å; M236-Y261 HydrophobicContact CG-CE2 4.49Å; M236-F262 HydrophobicContact CE-CE1 4.48Å; M236-F262 HydrophobicContact CE-CE2 4.44Å; M236-F262 HydrophobicContact CE-CZ 3.76Å; M236-L273 HydrophobicContact SD-CD2 4.02Å
237	P	96.8	Very high	97.6	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.026	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-64.3	129.4	-177.8	23.7	-31.9	0	0	0	111.9	L212 L217 L228 V240 L249 Y261	L212-P237 HydrophobicContact CD2-CB 3.38Å; L217-P237 HydrophobicContact CD1-CB 4.39Å; L228-P237 HydrophobicContact CD1-CB 4.21Å; L228-P237 HydrophobicContact CD1-CG 4.06Å; P237-V240 HydrophobicContact CB-CG2 3.87Å; P237-V240 HydrophobicContact CG-CG2 3.69Å; P237-V240 WeakPolarHBondContact O-CG2 3.3Å; P237-L249 HydrophobicContact CG-CD1 4.4Å; P237-L249 HydrophobicContact CG-CD2 4.18Å; P237-Y261 WeakPolarHBondContact CG-OH 3.07Å; P237-Y261 VanDerWaalsContact O-CE2 3.27Å; P237-Y261 WeakPolarHBondContact O-CE2 3.26Å; P237-Y261 PolarHBondContact O-OH 3.36Å
238	A	94.3	Very high	97.6	Very high	51 Å²	51	35.4 Å²	35.4	42%	0.421	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	145.6	-179.3	0	0	0	0	0	112.4	M236 V240	M236-A238 PolarHBondContact O-N 2.83Å; A238-V240 VanDerWaalsContact C-N 3.31Å
239	G	93.2	Very high	97.6	Very high	33 Å²	33	35.3 Å²	35.3	34%	0.34	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	26.6	175.5	0	0	0	0	0	113.7	L217 K218	L217-G239 CarbonylContact C-O 3.42Å; L217-G239 VanDerWaalsContact C-O 3.28Å; L217-G239 WeakPolarHBondContact CB-O 3.49Å; K218-G239 WeakPolarHBondContact CA-O 3.25Å; K218-G239 PolarHBondContact N-O 2.75Å
240	V	96	Very high	97.6	Very high	17 Å²	17	36.2 Å²	36.2	10%	0.103	20%	0.196	C	C	.	.			trans	-64.8	130.6	168.9	175	0	0	0	0	109	L217 L226 P237 A238 L244 Y261 F265	L217-V240 HydrophobicContact CD1-CG2 3.86Å; L226-V240 HydrophobicContact CD2-CG1 4.3Å; L226-V240 HydrophobicContact CD2-CG2 4.07Å; P237-V240 HydrophobicContact CB-CG2 3.87Å; P237-V240 HydrophobicContact CG-CG2 3.69Å; P237-V240 WeakPolarHBondContact O-CG2 3.3Å; A238-V240 VanDerWaalsContact C-N 3.31Å; V240-L244 HydrophobicContact CG1-CD1 3.21Å; V240-L244 HydrophobicContact CG1-CG 4.1Å; V240-Y261 WeakPolarHBondContact CG2-OH 3.22Å; V240-F265 HydrophobicContact CB-CZ 4.18Å; V240-F265 HydrophobicContact CG1-CE1 3.92Å; V240-F265 HydrophobicContact CG1-CZ 3.83Å
241	P	95.6	Very high	97.6	Very high	11 Å²	11	37.4 Å²	37.4	7%	0.071	20%	0.201	C	C	.	.			trans	-69.4	145.8	-179.1	30.1	-36.9	0	0	0	111.3	L220 L223 S243 F265	L220-P241 HydrophobicContact CB-CG 4.31Å; L220-P241 WeakPolarHBondContact O-CB 3.13Å; L220-P241 VanDerWaalsContact O-CG 3.27Å; L220-P241 WeakPolarHBondContact O-CG 3.26Å; L223-P241 HydrophobicContact CB-CG 3.75Å; L223-P241 HydrophobicContact CD2-CG 4.11Å; P241-S243 PolarHBondContact O-N 3.04Å; P241-F265 VanDerWaalsContact O-CE1 3.26Å; P241-F265 WeakPolarHBondContact O-CE1 3.43Å
242	N	96.2	Very high	97.6	Very high	83 Å²	83	37.5 Å²	37.5	44%	0.444	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-3.1	-177.8	63.7	-17	0	0	0	114.5	L244 D264	N242-L244 PolarHBondContact O-N 3.3Å; N242-D264 HydrophobicContact CB-CB 4.45Å; N242-D264 WeakPolarHBondContact CB-O 3.37Å; N242-D264 PolarHBondContact ND2-O 3.29Å
243	S	97.6	Very high	97.6	Very high	24 Å²	24	41 Å²	41	17%	0.168	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.3	171.6	44.8	0	0	0	0	113.9	K221 L223 P241 I245	K221-S243 WeakPolarHBondContact O-CB 3.46Å; K221-S243 PolarHBondContact O-OG 3.04Å; L223-S243 PolarHBondContact N-OG 3.32Å; L223-S243 CarbonylContact O-C 3.37Å; L223-S243 PolarHBondContact O-OG 2.8Å; L223-S243 VanDerWaalsContact O-OG 3.14Å; P241-S243 PolarHBondContact O-N 3.04Å; S243-I245 PolarHBondContact O-N 3.39Å
244	L	98.3	Very high	97.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.			trans	-59.3	137.9	-179.5	-82.4	-172.6	0	0	0	112.7	L223 M224 L226 V240 N242 L247 F265 H267 L268	L223-L244 HydrophobicContact CB-CD2 4.33Å; L223-L244 HydrophobicContact CD2-CD2 4.01Å; L223-L244 HydrophobicContact CG-CD2 3.9Å; L223-L244 WeakPolarHBondContact O-CA 3.16Å; L223-L244 WeakPolarHBondContact O-CD2 3.43Å; L223-L244 PolarHBondContact O-N 2.81Å; L223-L244 VanDerWaalsContact O-N 3.16Å; M224-L244 VanDerWaalsContact C-CD2 3.44Å; M224-L244 WeakPolarHBondContact O-CD2 3.09Å; L226-L244 HydrophobicContact CB-CD1 3.9Å; L226-L244 HydrophobicContact CB-CD2 3.83Å; L226-L244 HydrophobicContact CD2-CD1 4.39Å; V240-L244 HydrophobicContact CG1-CD1 3.21Å; V240-L244 HydrophobicContact CG1-CG 4.1Å; N242-L244 PolarHBondContact O-N 3.3Å; L244-L247 HydrophobicContact CD1-CB 4.27Å; L244-L247 HydrophobicContact CD1-CD1 4.12Å; L244-F265 HydrophobicContact CB-CD1 4.33Å; L244-F265 HydrophobicContact CB-CE1 4.13Å; L244-F265 HydrophobicContact CD1-CE1 4.34Å; L244-H267 CarbonylContact O-C 3.23Å; L244-L268 HydrophobicContact CB-CD1 4.19Å; L244-L268 VanDerWaalsContact O-CA 3.23Å; L244-L268 WeakPolarHBondContact O-CA 3.45Å; L244-L268 PolarHBondContact O-N 3.08Å
245	I	98.8	Very high	97.6	Very high	51 Å²	51	39 Å²	39	26%	0.262	20%	0.203	S	C	.	.	S	Bend	trans	-102.8	-34.7	167.8	-58.3	-179.3	0	0	0	110.2	M224 S243 H267 A269 F270	M224-I245 HydrophobicContact CB-CD1 4.49Å; M224-I245 HydrophobicContact CE-CD1 3.48Å; M224-I245 VanDerWaalsContact CE-CD1 3.48Å; M224-I245 PolarHBondContact O-N 3.05Å; S243-I245 PolarHBondContact O-N 3.39Å; I245-H267 WeakPolarHBondContact CA-O 3.4Å; I245-H267 HydrophobicContact CG1-CB 4.26Å; I245-A269 HydrophobicContact CG2-CB 4Å; I245-A269 PolarHBondContact O-N 2.8Å; I245-F270 HydrophobicContact CG2-CD2 4.42Å; I245-F270 PolarHBondContact O-N 3.48Å
246	Q	98.9	Very high	97.7	Very high	56 Å²	56	36.3 Å²	36.3	26%	0.262	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.7	-174.4	-59.1	179.8	27.4	0	0	111.3	M224 Q225 L226 F248 F270	M224-Q246 PolarHBondContact O-N 3.38Å; Q225-Q246 HydrophobicContact CB-CB 4.27Å; Q225-Q246 HydrophobicContact CG-CB 4.01Å; L226-Q246 PolarHBondContact N-O 3.34Å; Q246-F248 HydrophobicContact CB-CE1 4.14Å; Q246-F248 HydrophobicContact CB-CE2 4.4Å; Q246-F248 HydrophobicContact CB-CZ 3.87Å; Q246-F248 HydrophobicContact CG-CZ 4.31Å; Q246-F270 HydrophobicContact CB-CB 4.49Å; Q246-F270 HydrophobicContact CG-CB 4.14Å; Q246-F270 HydrophobicContact CG-CD2 3.83Å; Q246-F270 HydrophobicContact CG-CG 4.29Å
247	L	98.9	Very high	97.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	114.2	174.9	179.6	61	0	0	0	110.3	L226 M236 L244 L249 Y261 F262 L268 F270 R272	L226-L247 HydrophobicContact CB-CD1 4.2Å; L226-L247 HydrophobicContact CD2-CD1 3.97Å; L226-L247 HydrophobicContact CG-CD1 4.19Å; M236-L247 HydrophobicContact CE-CD2 4.4Å; L244-L247 HydrophobicContact CD1-CB 4.27Å; L244-L247 HydrophobicContact CD1-CD1 4.12Å; L247-L249 HydrophobicContact CD1-CD1 4.07Å; L247-L249 HydrophobicContact CD1-CG 4.13Å; L247-L249 HydrophobicContact CD2-CD1 3.84Å; L247-L249 HydrophobicContact CG-CD1 3.88Å; L247-L249 HydrophobicContact CG-CG 4.2Å; L247-Y261 HydrophobicContact CD2-CE1 4.44Å; L247-F262 HydrophobicContact CD2-CE1 3.88Å; L247-F262 HydrophobicContact CD2-CZ 4.31Å; L247-L268 HydrophobicContact CB-CD1 4.09Å; L247-F270 PolarHBondContact N-O 3.24Å; L247-R272 PolarHBondContact O-N 2.75Å
248	F	98.9	Very high	97.7	Very high	17 Å²	17	38.3 Å²	38.3	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.6	179	-51.8	-36.2	0	0	0	111	Q225 L226 N227 L228 A229 Q246 F270 R272	Q225-F248 HydrophobicContact CG-CE2 4.44Å; L226-F248 PolarHBondContact O-N 2.96Å; N227-F248 HydrophobicContact CB-CB 4.44Å; N227-F248 HydrophobicContact CB-CD2 4.09Å; N227-F248 WeakPolarHBondContact OD1-CB 3.41Å; L228-F248 CarbonylContact C-O 3.22Å; L228-F248 WeakPolarHBondContact CA-O 3.19Å; L228-F248 PolarHBondContact N-O 3.05Å; A229-F248 HydrophobicContact CB-CB 4.46Å; A229-F248 PolarHBondContact N-O 2.82Å; Q246-F248 HydrophobicContact CB-CE1 4.14Å; Q246-F248 HydrophobicContact CB-CE2 4.4Å; Q246-F248 HydrophobicContact CB-CZ 3.87Å; Q246-F248 HydrophobicContact CG-CZ 4.31Å; F248-F270 HydrophobicContact CE1-CB 4.33Å; F248-R272 HydrophobicContact CD1-CB 3.93Å; F248-R272 HydrophobicContact CD1-CG 3.68Å; F248-R272 HydrophobicContact CE1-CG 4Å
249	L	98.9	Very high	97.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.			trans	-132.1	17.4	-177	-72.9	165.7	0	0	0	111.6	L228 L233 M236 P237 L247 N252 I254 R272 L273 N276	L228-L249 HydrophobicContact CB-CD2 3.72Å; L228-L249 HydrophobicContact CD1-CD2 4.13Å; L233-L249 HydrophobicContact CD1-CD2 3.89Å; M236-L249 HydrophobicContact CE-CD1 3.69Å; M236-L249 HydrophobicContact SD-CD1 3.84Å; P237-L249 HydrophobicContact CG-CD1 4.4Å; P237-L249 HydrophobicContact CG-CD2 4.18Å; L247-L249 HydrophobicContact CD1-CD1 4.07Å; L247-L249 HydrophobicContact CD1-CG 4.13Å; L247-L249 HydrophobicContact CD2-CD1 3.84Å; L247-L249 HydrophobicContact CG-CD1 3.88Å; L247-L249 HydrophobicContact CG-CG 4.2Å; L249-N252 PolarHBondContact O-ND2 3.35Å; L249-I254 HydrophobicContact CB-CD1 4.04Å; L249-I254 HydrophobicContact CD1-CD1 4.19Å; L249-I254 HydrophobicContact CD2-CD1 4.13Å; L249-I254 HydrophobicContact CG-CD1 4.36Å; L249-R272 CarbonylContact C-O 3.44Å; L249-R272 WeakPolarHBondContact CA-O 3.22Å; L249-R272 PolarHBondContact N-O 3.47Å; L249-L273 HydrophobicContact CB-CD2 3.66Å; L249-L273 HydrophobicContact CB-CG 4.43Å; L249-L273 HydrophobicContact CD1-CD2 3.94Å; L249-L273 HydrophobicContact CG-CD2 4.47Å; L249-N276 PolarHBondContact O-ND2 3.34Å
250	D	98.8	Very high	97.8	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.123	23%	0.233	C	C	.	.			trans	-53.8	148.1	178.9	-57.9	-77.7	0	0	0	112.3	A229 H230 N252 R272 N274	A229-D250 CarbonylContact C-O 3.05Å; A229-D250 WeakPolarHBondContact CA-O 3.26Å; A229-D250 HydrophobicContact CB-CB 3.96Å; A229-D250 WeakPolarHBondContact CB-O 3.17Å; H230-D250 PolarHBondContact N-O 3.29Å; D250-N252 PolarHBondContact O-N 3.48Å; D250-N252 PolarHBondContact O-ND2 3.36Å; D250-R272 PolarHBondContact N-O 3.42Å; D250-R272 WeakPolarHBondContact OD1-CB 3.29Å; D250-R272 WeakPolarHBondContact OD2-CB 3.4Å; D250-N274 CarbonylContact C-O 3.19Å; D250-N274 VanDerWaalsContact CA-O 3.23Å; D250-N274 WeakPolarHBondContact CA-O 3.49Å; D250-N274 WeakPolarHBondContact OD1-CB 3.27Å; D250-N274 VanDerWaalsContact OD1-CG 3.31Å; D250-N274 PolarHBondContact OD1-N 2.98Å; D250-N274 PolarHBondContact OD1-ND2 3.21Å
251	K	98.8	Very high	97.8	Very high	88 Å²	88	47.6 Å²	47.6	38%	0.383	23%	0.234	S	C	.	.	S	Bend	trans	54.4	53.2	172.8	-67.4	173.7	177.3	178	0	112.5	H230 N274 Y275	H230-K251 WeakPolarHBondContact CA-O 3.44Å; H230-K251 WeakPolarHBondContact CE1-CD 3.36Å; H230-K251 PolarHBondContact CE1-NZ 3.48Å; H230-K251 WeakPolarHBondContact NE2-CD 3.4Å; H230-K251 PolarHBondContact NE2-NZ 2.61Å; K251-N274 PolarHBondContact N-O 3.49Å; K251-Y275 VanDerWaalsContact CA-O 3.25Å; K251-Y275 WeakPolarHBondContact CA-O 3.43Å; K251-Y275 VanDerWaalsContact CG-CB 3.41Å; K251-Y275 HydrophobicContact CG-CD2 4.03Å; K251-Y275 HydrophobicContact CG-CG 3.78Å; K251-Y275 PolarHBondContact N-O 2.72Å
252	N	98.9	Very high	97.9	Very high	10 Å²	10	47.1 Å²	47.1	5%	0.053	23%	0.23	C	C	.	.	S	Bend	trans	-114.6	-157.6	166.6	-82.6	-77.4	0	0	0	108.6	L228 N231 V232 L233 L249 D250 I254 Y275 N276	L228-N252 PolarHBondContact O-ND2 3.48Å; N231-N252 VanDerWaalsContact CA-OD1 3.32Å; N231-N252 WeakPolarHBondContact CA-OD1 3.36Å; N231-N252 WeakPolarHBondContact CB-OD1 3.31Å; N231-N252 PolarHBondContact N-OD1 3.27Å; N231-N252 PolarHBondContact O-OD1 3.25Å; V232-N252 PolarHBondContact N-OD1 3.28Å; L233-N252 HydrophobicContact CB-CB 4.22Å; L233-N252 WeakPolarHBondContact CB-OD1 3.44Å; L233-N252 WeakPolarHBondContact CG-OD1 3.45Å; L233-N252 PolarHBondContact N-OD1 3.3Å; L249-N252 PolarHBondContact O-ND2 3.35Å; D250-N252 PolarHBondContact O-N 3.48Å; D250-N252 PolarHBondContact O-ND2 3.36Å; N252-I254 HydrophobicContact CB-CD1 4.19Å; N252-I254 HydrophobicContact CB-CG1 4.01Å; N252-Y275 PolarHBondContact N-O 2.9Å; N252-N276 WeakPolarHBondContact CA-OD1 3.48Å; N252-N276 WeakPolarHBondContact CB-OD1 3.07Å; N252-N276 PolarHBondContact N-OD1 2.82Å
253	R	98.7	Very high	97.8	Very high	125 Å²	125	50.4 Å²	50.4	47%	0.472	24%	0.241	S	C	.	.			trans	-126.7	32.2	176.8	-58.3	179	-175.2	174.3	1.1	110.5	L233 K234 D255 N276	L233-R253 CarbonylContact O-C 3.47Å; L233-R253 VanDerWaalsContact O-C 3.26Å; L233-R253 VanDerWaalsContact O-CA 3.31Å; L233-R253 WeakPolarHBondContact O-CA 3.31Å; L233-R253 PolarHBondContact O-N 2.8Å; K234-R253 WeakPolarHBondContact CA-O 3.36Å; K234-R253 HydrophobicContact CG-CB 4.25Å; R253-D255 PolarHBondContact O-N 2.82Å; R253-N276 PolarHBondContact N-OD1 3.36Å
254	I	98.8	Very high	97.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.26	C	S	.	.			trans	-70.4	124.4	-174.8	-59.6	170.2	0	0	0	109	L233 K234 M236 L249 N252 L273 N276 Q277 L278	L233-I254 HydrophobicContact CB-CG1 4.37Å; L233-I254 PolarHBondContact O-N 2.99Å; K234-I254 WeakPolarHBondContact O-CA 3.14Å; M236-I254 HydrophobicContact CG-CG2 4.19Å; M236-I254 HydrophobicContact SD-CD1 4.08Å; M236-I254 HydrophobicContact SD-CG2 3.99Å; L249-I254 HydrophobicContact CB-CD1 4.04Å; L249-I254 HydrophobicContact CD1-CD1 4.19Å; L249-I254 HydrophobicContact CD2-CD1 4.13Å; L249-I254 HydrophobicContact CG-CD1 4.36Å; N252-I254 HydrophobicContact CB-CD1 4.19Å; N252-I254 HydrophobicContact CB-CG1 4.01Å; I254-L273 HydrophobicContact CD1-CD2 4.08Å; I254-N276 HydrophobicContact CB-CB 4.38Å; I254-N276 WeakPolarHBondContact CB-OD1 3.15Å; I254-N276 PolarHBondContact N-OD1 3.32Å; I254-Q277 CarbonylContact O-C 3.54Å; I254-Q277 VanDerWaalsContact O-C 3.28Å; I254-Q277 WeakPolarHBondContact O-CA 3.09Å; I254-Q277 PolarHBondContact O-N 2.91Å; I254-L278 HydrophobicContact CG2-CD2 4.01Å; I254-L278 PolarHBondContact O-N 2.86Å
255	D	98.4	Very high	97.7	Very high	77 Å²	77	54.9 Å²	54.9	41%	0.412	26%	0.262	S	S	.	.			trans	-114.5	-14.8	-179	61	-1.6	0	0	0	113.7	K234 R253 Q277 G282	K234-D255 PolarHBondContact O-N 2.86Å; R253-D255 PolarHBondContact O-N 2.82Å; D255-Q277 HydrophobicContact CB-CB 4.14Å; D255-G282 WeakPolarHBondContact O-CA 3.28Å
256	D	98.1	Very high	97.6	Very high	79 Å²	79	56.8 Å²	56.8	42%	0.422	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-141.5	139.7	-177.6	-178.3	73.4	0	0	0	113.1	M236 G282	M236-D256 WeakPolarHBondContact CG-O 3.25Å; D256-G282 CarbonylContact C-O 3.32Å; D256-G282 WeakPolarHBondContact CA-O 3.11Å
257	I	98.5	Very high	97.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.289	C	S	.	.			trans	-116.4	124.2	172.1	-53.4	178.9	0	0	0	108.5	M236 Y261 F262 L273 L278 G282 V283 P284 V287 F288	M236-I257 HydrophobicContact CG-CB 4.18Å; M236-I257 HydrophobicContact CG-CG1 3.96Å; M236-I257 HydrophobicContact CG-CG2 4.13Å; M236-I257 HydrophobicContact SD-CG1 4.14Å; I257-Y261 HydrophobicContact CG2-CG 4.41Å; I257-F262 HydrophobicContact CG2-CE2 4.31Å; I257-L273 HydrophobicContact CD1-CD1 4.04Å; I257-L278 HydrophobicContact CD1-CD1 4.24Å; I257-L278 HydrophobicContact CD1-CD2 4.15Å; I257-L278 HydrophobicContact CG1-CD2 3.88Å; I257-G282 PolarHBondContact N-O 2.84Å; I257-V283 HydrophobicContact CD1-CG2 4.39Å; I257-P284 WeakPolarHBondContact O-CD 3.44Å; I257-P284 WeakPolarHBondContact O-CG 3.47Å; I257-V287 HydrophobicContact CG2-CG1 4.49Å; I257-V287 HydrophobicContact CG2-CG2 3.63Å; I257-F288 HydrophobicContact CD1-CE1 4.23Å; I257-F288 HydrophobicContact CD1-CE2 4.3Å; I257-F288 HydrophobicContact CD1-CZ 3.53Å
258	P	97.2	Very high	97.5	Very high	59 Å²	59	59.6 Å²	59.6	38%	0.383	29%	0.289	S	S	.	.			trans	-60.3	143.7	176.3	-24.1	33.8	0	0	0	113.1	D260 Y261	P258-D260 VanDerWaalsContact C-N 3.32Å; P258-D260 PolarHBondContact O-N 3.28Å; P258-D260 VanDerWaalsContact O-N 3.15Å; P258-Y261 HydrophobicContact CB-CD2 4.44Å; P258-Y261 HydrophobicContact CG-CD2 4Å; P258-Y261 VanDerWaalsContact O-CB 3.22Å; P258-Y261 WeakPolarHBondContact O-CB 3.48Å; P258-Y261 PolarHBondContact O-N 2.71Å
259	K	94.4	Very high	97.5	Very high	159 Å²	159	59.2 Å²	59.2	69%	0.691	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-45.6	-174.1	-174.6	179.2	174	-175.7	0	115.2	P284	K259-P284 HydrophobicContact CB-CB 4.48Å; K259-P284 HydrophobicContact CB-CG 4.41Å; K259-P284 HydrophobicContact CG-CB 4.43Å
260	D	94.6	Very high	97.5	Very high	105 Å²	105	62.3 Å²	62.3	56%	0.561	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	20.9	-174.9	-59.9	-50.5	0	0	0	112.2	P258 F262 K263	P258-D260 VanDerWaalsContact C-N 3.32Å; P258-D260 PolarHBondContact O-N 3.28Å; P258-D260 VanDerWaalsContact O-N 3.15Å; D260-F262 VanDerWaalsContact C-N 3.3Å; D260-F262 PolarHBondContact O-N 3.4Å; D260-K263 HydrophobicContact CB-CB 4.21Å; D260-K263 HydrophobicContact CB-CD 4.31Å; D260-K263 WeakPolarHBondContact O-CB 3.09Å; D260-K263 PolarHBondContact O-N 3Å; D260-K263 VanDerWaalsContact O-N 3.14Å
261	Y	97.3	Very high	97.5	Very high	32 Å²	32	61.2 Å²	61.2	13%	0.125	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-41.2	-170.5	-174.1	-89.8	0	0	0	113.2	M236 P237 V240 L247 I257 P258 F265	M236-Y261 HydrophobicContact CB-CD2 3.95Å; M236-Y261 HydrophobicContact CB-CE2 3.54Å; M236-Y261 HydrophobicContact CE-CD1 3.82Å; M236-Y261 HydrophobicContact CE-CE1 3.39Å; M236-Y261 HydrophobicContact CE-CE2 4.39Å; M236-Y261 HydrophobicContact CE-CG 4.5Å; M236-Y261 HydrophobicContact CG-CE2 4.49Å; P237-Y261 WeakPolarHBondContact CG-OH 3.07Å; P237-Y261 VanDerWaalsContact O-CE2 3.27Å; P237-Y261 WeakPolarHBondContact O-CE2 3.26Å; P237-Y261 PolarHBondContact O-OH 3.36Å; V240-Y261 WeakPolarHBondContact CG2-OH 3.22Å; L247-Y261 HydrophobicContact CD2-CE1 4.44Å; I257-Y261 HydrophobicContact CG2-CG 4.41Å; P258-Y261 HydrophobicContact CB-CD2 4.44Å; P258-Y261 HydrophobicContact CG-CD2 4Å; P258-Y261 VanDerWaalsContact O-CB 3.22Å; P258-Y261 WeakPolarHBondContact O-CB 3.48Å; P258-Y261 PolarHBondContact O-N 2.71Å; Y261-F265 VanDerWaalsContact O-CE2 3.22Å; Y261-F265 WeakPolarHBondContact O-CE2 3.35Å
262	F	97.2	Very high	97.5	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	4.7	-178.8	-61.5	-66.1	0	0	0	114.7	M236 L247 I257 D260 D264 F265 L268 V271 V287 F288 L290	M236-F262 HydrophobicContact CE-CE1 4.48Å; M236-F262 HydrophobicContact CE-CE2 4.44Å; M236-F262 HydrophobicContact CE-CZ 3.76Å; L247-F262 HydrophobicContact CD2-CE1 3.88Å; L247-F262 HydrophobicContact CD2-CZ 4.31Å; I257-F262 HydrophobicContact CG2-CE2 4.31Å; D260-F262 VanDerWaalsContact C-N 3.3Å; D260-F262 PolarHBondContact O-N 3.4Å; F262-D264 PolarHBondContact O-N 2.84Å; F262-D264 VanDerWaalsContact O-N 3.09Å; F262-F265 HydrophobicContact CB-CD2 4.35Å; F262-F265 HydrophobicContact CD1-CD2 4.23Å; F262-F265 HydrophobicContact CD1-CE2 4.41Å; F262-F265 HydrophobicContact CD1-CG 4.34Å; F262-F265 WeakPolarHBondContact O-CB 3.48Å; F262-F265 PolarHBondContact O-N 2.83Å; F262-L268 HydrophobicContact CD1-CD2 3.39Å; F262-L268 HydrophobicContact CE1-CD2 3.6Å; F262-L268 HydrophobicContact CG-CD2 4.29Å; F262-V271 HydrophobicContact CZ-CG1 4.36Å; F262-V287 HydrophobicContact CD2-CG2 4.01Å; F262-V287 WeakPolarHBondContact CD2-O 3.36Å; F262-F288 HydrophobicContact CD2-CD1 4.38Å; F262-F288 HydrophobicContact CD2-CE1 4.45Å; F262-F288 HydrophobicContact CE2-CD1 4.1Å; F262-F288 AromaticContact CE2-CE1 3.75Å; F262-F288 HydrophobicContact CE2-CE1 3.75Å; F262-L290 HydrophobicContact CB-CD1 3.64Å; F262-L290 HydrophobicContact CB-CD2 3.79Å; F262-L290 HydrophobicContact CB-CG 4.19Å; F262-L290 HydrophobicContact CG-CD1 4.03Å; F262-L290 VanDerWaalsContact O-CD2 3.28Å; F262-L290 WeakPolarHBondContact O-CD2 3.46Å
263	K	94.6	Very high	97.5	Very high	152 Å²	152	60.8 Å²	60.8	66%	0.661	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-38.1	-169	-177.7	-178.6	174.8	-174.3	0	114	D260	D260-K263 HydrophobicContact CB-CB 4.21Å; D260-K263 HydrophobicContact CB-CD 4.31Å; D260-K263 WeakPolarHBondContact O-CB 3.09Å; D260-K263 PolarHBondContact O-N 3Å; D260-K263 VanDerWaalsContact O-N 3.14Å
264	D	95.4	Very high	97.5	Very high	105 Å²	105	55.5 Å²	55.5	56%	0.561	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	4.5	-174.7	-58.4	-37.5	0	0	0	113.6	N242 F262 T266	N242-D264 HydrophobicContact CB-CB 4.45Å; N242-D264 WeakPolarHBondContact CB-O 3.37Å; N242-D264 PolarHBondContact ND2-O 3.29Å; F262-D264 PolarHBondContact O-N 2.84Å; F262-D264 VanDerWaalsContact O-N 3.09Å; D264-T266 PolarHBondContact O-N 3Å
265	F	97.2	Very high	97.5	Very high	14 Å²	14	60.7 Å²	60.7	6%	0.061	29%	0.294	C	S	.	.			trans	-84.6	91.7	-176.9	-74.6	-106.6	0	0	0	111.7	V240 P241 L244 Y261 F262 L268 S292	V240-F265 HydrophobicContact CB-CZ 4.18Å; V240-F265 HydrophobicContact CG1-CE1 3.92Å; V240-F265 HydrophobicContact CG1-CZ 3.83Å; P241-F265 VanDerWaalsContact O-CE1 3.26Å; P241-F265 WeakPolarHBondContact O-CE1 3.43Å; L244-F265 HydrophobicContact CB-CD1 4.33Å; L244-F265 HydrophobicContact CB-CE1 4.13Å; L244-F265 HydrophobicContact CD1-CE1 4.34Å; Y261-F265 VanDerWaalsContact O-CE2 3.22Å; Y261-F265 WeakPolarHBondContact O-CE2 3.35Å; F262-F265 HydrophobicContact CB-CD2 4.35Å; F262-F265 HydrophobicContact CD1-CD2 4.23Å; F262-F265 HydrophobicContact CD1-CE2 4.41Å; F262-F265 HydrophobicContact CD1-CG 4.34Å; F262-F265 WeakPolarHBondContact O-CB 3.48Å; F262-F265 PolarHBondContact O-N 2.83Å; F265-L268 HydrophobicContact CB-CB 3.82Å; F265-L268 HydrophobicContact CB-CD2 4.17Å; F265-L268 HydrophobicContact CD1-CB 4.09Å; F265-L268 HydrophobicContact CD1-CD1 4.42Å; F265-L268 HydrophobicContact CD1-CD2 3.94Å; F265-L268 HydrophobicContact CD1-CG 4.4Å; F265-L268 HydrophobicContact CG-CB 4.39Å; F265-L268 HydrophobicContact CG-CD2 4.19Å; F265-S292 PolarHBondContact O-OG 2.94Å
266	T	96.1	Very high	97.5	Very high	90 Å²	90	57.5 Å²	57.5	55%	0.552	28%	0.277	S	S	*	.	S	Bend	trans	-83.1	-13.3	-176.1	54.1	0	0	0	0	114.6	D264 S292	D264-T266 PolarHBondContact O-N 3Å; T266-S292 WeakPolarHBondContact O-CB 3.39Å
267	H	97.8	Very high	97.5	Very high	115 Å²	115	57.8 Å²	57.8	53%	0.532	28%	0.276	S	S	.	.	S	Bend	trans	-121.3	-0.6	-175.3	-58.6	-55.1	0	0	0	114.2	L244 I245 A269	L244-H267 CarbonylContact O-C 3.23Å; I245-H267 WeakPolarHBondContact CA-O 3.4Å; I245-H267 HydrophobicContact CG1-CB 4.26Å; H267-A269 PolarHBondContact O-N 2.83Å; H267-A269 VanDerWaalsContact O-N 3.13Å
268	L	98.6	Very high	97.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.276	C	S	.	.			trans	-69.5	109.6	-175.7	-174.2	68.9	0	0	0	111.1	L244 L247 F262 F265 V271 L290 S292 L293	L244-L268 HydrophobicContact CB-CD1 4.19Å; L244-L268 VanDerWaalsContact O-CA 3.23Å; L244-L268 WeakPolarHBondContact O-CA 3.45Å; L244-L268 PolarHBondContact O-N 3.08Å; L247-L268 HydrophobicContact CB-CD1 4.09Å; F262-L268 HydrophobicContact CD1-CD2 3.39Å; F262-L268 HydrophobicContact CE1-CD2 3.6Å; F262-L268 HydrophobicContact CG-CD2 4.29Å; F265-L268 HydrophobicContact CB-CB 3.82Å; F265-L268 HydrophobicContact CB-CD2 4.17Å; F265-L268 HydrophobicContact CD1-CB 4.09Å; F265-L268 HydrophobicContact CD1-CD1 4.42Å; F265-L268 HydrophobicContact CD1-CD2 3.94Å; F265-L268 HydrophobicContact CD1-CG 4.4Å; F265-L268 HydrophobicContact CG-CB 4.39Å; F265-L268 HydrophobicContact CG-CD2 4.19Å; L268-V271 HydrophobicContact CD1-CG2 4.12Å; L268-V271 HydrophobicContact CD2-CG2 3.55Å; L268-V271 HydrophobicContact CG-CG2 3.79Å; L268-L290 HydrophobicContact CD2-CD1 4.16Å; L268-S292 CarbonylContact O-C 3.44Å; L268-S292 VanDerWaalsContact O-C 3.23Å; L268-S292 WeakPolarHBondContact O-CB 3.27Å; L268-S292 PolarHBondContact O-OG 3.22Å; L268-L293 WeakPolarHBondContact O-CA 3.34Å; L268-L293 PolarHBondContact O-N 3Å
269	A	98.6	Very high	97.6	Very high	10 Å²	10	56.7 Å²	56.7	8%	0.083	27%	0.269	C	S	.	.			trans	-106.3	-28.8	-175.1	0	0	0	0	0	113.2	I245 H267 S292 L294 D295	I245-A269 HydrophobicContact CG2-CB 4Å; I245-A269 PolarHBondContact O-N 2.8Å; H267-A269 PolarHBondContact O-N 2.83Å; H267-A269 VanDerWaalsContact O-N 3.13Å; A269-S292 WeakPolarHBondContact CA-O 3.3Å; A269-L294 HydrophobicContact CB-CD1 4.22Å; A269-L294 HydrophobicContact CB-CG 4.27Å; A269-L294 PolarHBondContact O-N 3.19Å; A269-D295 PolarHBondContact O-N 2.9Å
270	F	98.8	Very high	97.6	Very high	65 Å²	65	51.6 Å²	51.6	29%	0.285	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	119.2	-175	-57	-93.4	0	0	0	110.9	I245 Q246 L247 F248 D295	I245-F270 HydrophobicContact CG2-CD2 4.42Å; I245-F270 PolarHBondContact O-N 3.48Å; Q246-F270 HydrophobicContact CB-CB 4.49Å; Q246-F270 HydrophobicContact CG-CB 4.14Å; Q246-F270 HydrophobicContact CG-CD2 3.83Å; Q246-F270 HydrophobicContact CG-CG 4.29Å; L247-F270 PolarHBondContact N-O 3.24Å; F248-F270 HydrophobicContact CE1-CB 4.33Å; F270-D295 HydrophobicContact CD1-CB 3.54Å; F270-D295 HydrophobicContact CE1-CB 3.93Å; F270-D295 HydrophobicContact CG-CB 4.47Å
271	V	98.8	Very high	97.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.2	174.7	177.7	0	0	0	0	109.4	F262 L268 L273 L293 D295 L296 Q297	F262-V271 HydrophobicContact CZ-CG1 4.36Å; L268-V271 HydrophobicContact CD1-CG2 4.12Å; L268-V271 HydrophobicContact CD2-CG2 3.55Å; L268-V271 HydrophobicContact CG-CG2 3.79Å; V271-L273 HydrophobicContact CG1-CD1 3.81Å; V271-L273 HydrophobicContact CG1-CG 4.17Å; V271-L293 HydrophobicContact CB-CD1 4.13Å; V271-L293 HydrophobicContact CG2-CD1 3.66Å; V271-D295 PolarHBondContact N-O 3.34Å; V271-L296 HydrophobicContact CB-CD1 4.07Å; V271-L296 HydrophobicContact CG1-CD1 4.12Å; V271-Q297 PolarHBondContact O-N 3.04Å
272	R	98.9	Very high	97.7	Very high	88 Å²	88	54.9 Å²	54.9	33%	0.332	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.5	175	-58.7	-171.9	175.7	157.3	2	111.5	L247 F248 L249 D250 Q297	L247-R272 PolarHBondContact O-N 2.75Å; F248-R272 HydrophobicContact CD1-CB 3.93Å; F248-R272 HydrophobicContact CD1-CG 3.68Å; F248-R272 HydrophobicContact CE1-CG 4Å; L249-R272 CarbonylContact C-O 3.44Å; L249-R272 WeakPolarHBondContact CA-O 3.22Å; L249-R272 PolarHBondContact N-O 3.47Å; D250-R272 PolarHBondContact N-O 3.42Å; D250-R272 WeakPolarHBondContact OD1-CB 3.29Å; D250-R272 WeakPolarHBondContact OD2-CB 3.4Å; R272-Q297 HydrophobicContact CB-CB 4.45Å; R272-Q297 HydrophobicContact CG-CB 4.25Å; R272-Q297 HydrophobicContact CG-CG 4.02Å
273	L	98.8	Very high	97.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.			trans	-134.5	23.6	-177.1	-81	163.1	0	0	0	110.4	M236 L249 I254 I257 V271 N276 L278 F288 Q297 L298 N301	M236-L273 HydrophobicContact SD-CD2 4.02Å; L249-L273 HydrophobicContact CB-CD2 3.66Å; L249-L273 HydrophobicContact CB-CG 4.43Å; L249-L273 HydrophobicContact CD1-CD2 3.94Å; L249-L273 HydrophobicContact CG-CD2 4.47Å; I254-L273 HydrophobicContact CD1-CD2 4.08Å; I257-L273 HydrophobicContact CD1-CD1 4.04Å; V271-L273 HydrophobicContact CG1-CD1 3.81Å; V271-L273 HydrophobicContact CG1-CG 4.17Å; L273-N276 PolarHBondContact O-ND2 2.94Å; L273-L278 HydrophobicContact CB-CD1 4.18Å; L273-L278 HydrophobicContact CD1-CD1 4.28Å; L273-F288 HydrophobicContact CD1-CE1 4.17Å; L273-F288 HydrophobicContact CD1-CZ 4.08Å; L273-Q297 CarbonylContact C-O 3.19Å; L273-Q297 WeakPolarHBondContact CA-O 3.39Å; L273-Q297 PolarHBondContact N-O 3.28Å; L273-L298 HydrophobicContact CB-CD2 3.8Å; L273-L298 HydrophobicContact CD1-CD2 4.05Å; L273-N301 PolarHBondContact O-ND2 3.44Å
274	N	98.8	Very high	97.8	Very high	14 Å²	14	49.8 Å²	49.8	8%	0.075	24%	0.243	C	C	.	.			trans	-63.9	154.6	-178.4	-52.8	-64.8	0	0	0	110.8	D250 K251 N276 Q297 L298 A299	D250-N274 CarbonylContact C-O 3.19Å; D250-N274 VanDerWaalsContact CA-O 3.23Å; D250-N274 WeakPolarHBondContact CA-O 3.49Å; D250-N274 WeakPolarHBondContact OD1-CB 3.27Å; D250-N274 VanDerWaalsContact OD1-CG 3.31Å; D250-N274 PolarHBondContact OD1-N 2.98Å; D250-N274 PolarHBondContact OD1-ND2 3.21Å; K251-N274 PolarHBondContact N-O 3.49Å; N274-N276 PolarHBondContact O-N 2.73Å; N274-N276 PolarHBondContact O-ND2 3.35Å; N274-Q297 PolarHBondContact N-O 3.33Å; N274-Q297 VanDerWaalsContact ND2-CB 3.29Å; N274-Q297 WeakPolarHBondContact ND2-CB 3.43Å; N274-Q297 PolarHBondContact ND2-OE1 3.21Å; N274-Q297 VanDerWaalsContact OD1-C 3.26Å; N274-Q297 VanDerWaalsContact OD1-CB 3.26Å; N274-Q297 WeakPolarHBondContact OD1-CB 3.47Å; N274-L298 PolarHBondContact OD1-N 2.92Å; N274-A299 CarbonylContact C-O 3.51Å; N274-A299 WeakPolarHBondContact CA-O 3.35Å; N274-A299 HydrophobicContact CB-CB 4.37Å; N274-A299 WeakPolarHBondContact CB-O 3.14Å; N274-A299 WeakPolarHBondContact OD1-CA 3.45Å; N274-A299 WeakPolarHBondContact OD1-CB 3.45Å; N274-A299 PolarHBondContact OD1-N 2.88Å
275	Y	98.8	Very high	97.4	Very high	109 Å²	109	53.1 Å²	53.1	43%	0.427	25%	0.252	S	S	.	.	S	Bend	trans	54.9	52.9	177.7	-61.7	-94	0	0	0	112.2	K251 N252 A299 H300	K251-Y275 VanDerWaalsContact CA-O 3.25Å; K251-Y275 WeakPolarHBondContact CA-O 3.43Å; K251-Y275 VanDerWaalsContact CG-CB 3.41Å; K251-Y275 HydrophobicContact CG-CD2 4.03Å; K251-Y275 HydrophobicContact CG-CG 3.78Å; K251-Y275 PolarHBondContact N-O 2.72Å; N252-Y275 PolarHBondContact N-O 2.9Å; Y275-A299 PolarHBondContact N-O 3.49Å; Y275-H300 WeakPolarHBondContact CA-O 3.43Å; Y275-H300 HydrophobicContact CD1-CB 3.6Å; Y275-H300 AromaticContact CD1-CG 3.8Å; Y275-H300 HydrophobicContact CD2-CB 4.13Å; Y275-H300 HydrophobicContact CE1-CB 3.84Å; Y275-H300 AromaticContact CE1-CD2 3.72Å; Y275-H300 AromaticContact CE1-CE1 3.95Å; Y275-H300 AromaticContact CE1-CG 3.46Å; Y275-H300 VanDerWaalsContact CE1-CG 3.46Å; Y275-H300 AromaticContact CE1-ND1 3.62Å; Y275-H300 HydrophobicContact CE2-CB 4.3Å; Y275-H300 AromaticContact CE2-CD2 3.47Å; Y275-H300 VanDerWaalsContact CE2-CD2 3.47Å; Y275-H300 WeakPolarHBondContact CE2-CD2 3.18Å; Y275-H300 AromaticContact CE2-CG 3.94Å; Y275-H300 HydrophobicContact CG-CB 3.76Å; Y275-H300 AromaticContact CZ-CD2 3.24Å; Y275-H300 AromaticContact CZ-CE1 3.83Å; Y275-H300 AromaticContact CZ-CG 3.52Å; Y275-H300 AromaticContact CZ-ND1 3.88Å; Y275-H300 AromaticContact CZ-NE2 3.46Å; Y275-H300 PolarHBondContact N-O 3.2Å; Y275-H300 PolarHBondContact OH-CD2 2.96Å; Y275-H300 PolarHBondContact OH-CE1 3.46Å; Y275-H300 PolarHBondContact OH-NE2 2.79Å
276	N	98.9	Very high	97	Very high	11 Å²	11	55.1 Å²	55.1	6%	0.059	27%	0.272	C	S	.	.	S	Bend	trans	-119	-163.8	172.3	-85.4	-71.5	0	0	0	109.6	L249 N252 R253 I254 L273 N274 L278 H300 N301	L249-N276 PolarHBondContact O-ND2 3.34Å; N252-N276 WeakPolarHBondContact CA-OD1 3.48Å; N252-N276 WeakPolarHBondContact CB-OD1 3.07Å; N252-N276 PolarHBondContact N-OD1 2.82Å; R253-N276 PolarHBondContact N-OD1 3.36Å; I254-N276 HydrophobicContact CB-CB 4.38Å; I254-N276 WeakPolarHBondContact CB-OD1 3.15Å; I254-N276 PolarHBondContact N-OD1 3.32Å; L273-N276 PolarHBondContact O-ND2 2.94Å; N274-N276 PolarHBondContact O-N 2.73Å; N274-N276 PolarHBondContact O-ND2 3.35Å; N276-L278 HydrophobicContact CB-CG 4.3Å; N276-H300 PolarHBondContact N-O 3.14Å; N276-N301 VanDerWaalsContact CA-OD1 3.28Å; N276-N301 WeakPolarHBondContact CA-OD1 3.49Å; N276-N301 WeakPolarHBondContact CB-OD1 3.48Å; N276-N301 PolarHBondContact N-OD1 3.04Å; N276-N301 PolarHBondContact O-OD1 2.75Å
277	Q	98.6	Very high	97	Very high	84 Å²	84	51.2 Å²	51.2	39%	0.393	25%	0.248	S	C	.	.			trans	-118.6	26.2	-178	-60.7	-179.2	1.2	0	0	111.1	I254 D255 S279 N301	I254-Q277 CarbonylContact O-C 3.54Å; I254-Q277 VanDerWaalsContact O-C 3.28Å; I254-Q277 WeakPolarHBondContact O-CA 3.09Å; I254-Q277 PolarHBondContact O-N 2.91Å; D255-Q277 HydrophobicContact CB-CB 4.14Å; Q277-S279 PolarHBondContact O-N 3.27Å; Q277-N301 PolarHBondContact N-OD1 3.13Å
278	L	98.6	Very high	96.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.			trans	-67.7	129.1	-177.1	-62.4	171.4	0	0	0	110	I254 I257 L273 N276 V283 L298 N301 Q302 L303	I254-L278 HydrophobicContact CG2-CD2 4.01Å; I254-L278 PolarHBondContact O-N 2.86Å; I257-L278 HydrophobicContact CD1-CD1 4.24Å; I257-L278 HydrophobicContact CD1-CD2 4.15Å; I257-L278 HydrophobicContact CG1-CD2 3.88Å; L273-L278 HydrophobicContact CB-CD1 4.18Å; L273-L278 HydrophobicContact CD1-CD1 4.28Å; N276-L278 HydrophobicContact CB-CG 4.3Å; L278-V283 HydrophobicContact CB-CG2 3.99Å; L278-V283 HydrophobicContact CD1-CG2 4.47Å; L278-V283 HydrophobicContact CD2-CG2 4.21Å; L278-V283 HydrophobicContact CG-CG2 4.46Å; L278-L298 HydrophobicContact CD1-CD2 3.84Å; L278-N301 HydrophobicContact CB-CB 4.18Å; L278-N301 WeakPolarHBondContact CB-OD1 3.32Å; L278-N301 PolarHBondContact N-OD1 3.49Å; L278-Q302 CarbonylContact O-C 3.37Å; L278-Q302 VanDerWaalsContact O-CA 3.31Å; L278-Q302 WeakPolarHBondContact O-CA 3.45Å; L278-Q302 WeakPolarHBondContact O-CB 3.46Å; L278-Q302 PolarHBondContact O-N 2.77Å; L278-L303 HydrophobicContact CB-CD2 4.41Å
279	S	97.9	Very high	96.7	Very high	36 Å²	36	49.4 Å²	49.4	25%	0.252	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-122.5	169.6	170.4	65.1	0	0	0	0	109.5	Q277 K281 G282 V283	Q277-S279 PolarHBondContact O-N 3.27Å; S279-K281 PolarHBondContact O-N 2.93Å; S279-G282 PolarHBondContact O-N 3Å; S279-V283 PolarHBondContact O-N 3.32Å; S279-V283 VanDerWaalsContact O-N 3.16Å
280	D	96	Very high	96.5	Very high	53 Å²	53	49.7 Å²	49.7	28%	0.283	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.2	-176.8	-42	-57.3	0	0	0	113.1	T304 V305	D280-T304 PolarHBondContact OD1-N 3.37Å; D280-T304 WeakPolarHBondContact OD2-CB 3.33Å; D280-T304 WeakPolarHBondContact OD2-CG2 3.04Å; D280-T304 PolarHBondContact OD2-N 2.95Å; D280-T304 PolarHBondContact OD2-OG1 3.34Å; D280-V305 HydrophobicContact CB-CG2 4.25Å; D280-V305 WeakPolarHBondContact OD1-CG2 3.09Å; D280-V305 PolarHBondContact OD1-N 3.12Å; D280-V305 VanDerWaalsContact OD1-N 3.17Å
281	K	96.3	Very high	96.2	Very high	202 Å²	202	51.3 Å²	51.3	88%	0.878	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-33.3	174.3	-67.4	-177.3	-177.9	175.8	0	113	S279	S279-K281 PolarHBondContact O-N 2.93Å
282	G	96.4	Very high	96.1	Very high	4 Å²	4	52.5 Å²	52.5	4%	0.041	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-3.1	-178.9	0	0	0	0	0	113.7	D255 D256 I257 S279	D255-G282 WeakPolarHBondContact O-CA 3.28Å; D256-G282 CarbonylContact C-O 3.32Å; D256-G282 WeakPolarHBondContact CA-O 3.11Å; I257-G282 PolarHBondContact N-O 2.84Å; S279-G282 PolarHBondContact O-N 3Å
283	V	97.5	Very high	96	Very high	12 Å²	12	48.4 Å²	48.4	7%	0.073	25%	0.25	C	S	.	.	S	Bend	trans	-114.4	102.8	176.3	-179	0	0	0	0	109.1	I257 L278 S279 K285 V287 F288 L303 P307	I257-V283 HydrophobicContact CD1-CG2 4.39Å; L278-V283 HydrophobicContact CB-CG2 3.99Å; L278-V283 HydrophobicContact CD1-CG2 4.47Å; L278-V283 HydrophobicContact CD2-CG2 4.21Å; L278-V283 HydrophobicContact CG-CG2 4.46Å; S279-V283 PolarHBondContact O-N 3.32Å; S279-V283 VanDerWaalsContact O-N 3.16Å; V283-K285 PolarHBondContact O-N 2.92Å; V283-V287 HydrophobicContact CG1-CG1 3.97Å; V283-F288 HydrophobicContact CG1-CD2 4.29Å; V283-F288 HydrophobicContact CG1-CE2 3.69Å; V283-L303 HydrophobicContact CB-CD2 4.49Å; V283-L303 HydrophobicContact CG2-CD2 3.9Å; V283-P307 HydrophobicContact CG1-CB 4.18Å
284	P	96.1	Very high	96	Very high	33 Å²	33	51.3 Å²	51.3	21%	0.214	27%	0.266	C	S	.	.			trans	-59.8	135.3	174.4	-17.9	27.5	0	0	0	110.6	I257 K259 A286 V287	I257-P284 WeakPolarHBondContact O-CD 3.44Å; I257-P284 WeakPolarHBondContact O-CG 3.47Å; K259-P284 HydrophobicContact CB-CB 4.48Å; K259-P284 HydrophobicContact CB-CG 4.41Å; K259-P284 HydrophobicContact CG-CB 4.43Å; P284-A286 VanDerWaalsContact C-N 3.27Å; P284-A286 PolarHBondContact O-N 2.86Å; P284-V287 HydrophobicContact CB-CB 4.12Å; P284-V287 HydrophobicContact CG-CB 4.29Å; P284-V287 HydrophobicContact CG-CG2 4.44Å; P284-V287 WeakPolarHBondContact O-CB 3.33Å; P284-V287 VanDerWaalsContact O-CG1 3.3Å; P284-V287 WeakPolarHBondContact O-CG1 3.2Å; P284-V287 PolarHBondContact O-N 2.97Å
285	K	87.2	Confident	96	Very high	175 Å²	175	51.4 Å²	51.4	76%	0.761	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-44.6	-167.9	-69.8	-167.9	175.2	-165	0	115.1	V283 L308	V283-K285 PolarHBondContact O-N 2.92Å; K285-L308 WeakPolarHBondContact O-CB 3.26Å; K285-L308 PolarHBondContact O-N 2.94Å; K285-L308 VanDerWaalsContact O-N 3.16Å
286	A	89.6	Confident	96	Very high	57 Å²	57	46.2 Å²	46.2	47%	0.471	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	14.4	-173.4	0	0	0	0	0	113.9	P284 F288 N289 L308	P284-A286 VanDerWaalsContact C-N 3.27Å; P284-A286 PolarHBondContact O-N 2.86Å; A286-F288 PolarHBondContact O-N 3.21Å; A286-N289 HydrophobicContact CB-CB 4.42Å; A286-N289 WeakPolarHBondContact O-CB 3.12Å; A286-N289 PolarHBondContact O-N 3.07Å; A286-L308 HydrophobicContact CB-CD2 4.27Å
287	V	96.7	Very high	96	Very high	8 Å²	8	47 Å²	47	5%	0.048	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.2	-172.6	76.1	0	0	0	0	113.1	I257 F262 V283 P284	I257-V287 HydrophobicContact CG2-CG1 4.49Å; I257-V287 HydrophobicContact CG2-CG2 3.63Å; F262-V287 HydrophobicContact CD2-CG2 4.01Å; F262-V287 WeakPolarHBondContact CD2-O 3.36Å; V283-V287 HydrophobicContact CG1-CG1 3.97Å; P284-V287 HydrophobicContact CB-CB 4.12Å; P284-V287 HydrophobicContact CG-CB 4.29Å; P284-V287 HydrophobicContact CG-CG2 4.44Å; P284-V287 WeakPolarHBondContact O-CB 3.33Å; P284-V287 VanDerWaalsContact O-CG1 3.3Å; P284-V287 WeakPolarHBondContact O-CG1 3.2Å; P284-V287 PolarHBondContact O-N 2.97Å
288	F	95.8	Very high	96	Very high	1 Å²	1	43 Å²	43	0%	0.004	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-99.6	11.1	177.7	-58.2	-63.4	0	0	0	113.7	I257 F262 L273 V283 A286 L290 L293 L296 L298 P307	I257-F288 HydrophobicContact CD1-CE1 4.23Å; I257-F288 HydrophobicContact CD1-CE2 4.3Å; I257-F288 HydrophobicContact CD1-CZ 3.53Å; F262-F288 HydrophobicContact CD2-CD1 4.38Å; F262-F288 HydrophobicContact CD2-CE1 4.45Å; F262-F288 HydrophobicContact CE2-CD1 4.1Å; F262-F288 AromaticContact CE2-CE1 3.75Å; F262-F288 HydrophobicContact CE2-CE1 3.75Å; L273-F288 HydrophobicContact CD1-CE1 4.17Å; L273-F288 HydrophobicContact CD1-CZ 4.08Å; V283-F288 HydrophobicContact CG1-CD2 4.29Å; V283-F288 HydrophobicContact CG1-CE2 3.69Å; A286-F288 PolarHBondContact O-N 3.21Å; F288-L290 PolarHBondContact O-N 2.97Å; F288-L293 HydrophobicContact CB-CD2 4.41Å; F288-L296 HydrophobicContact CB-CD2 3.9Å; F288-L296 HydrophobicContact CD1-CD1 3.85Å; F288-L296 HydrophobicContact CD1-CD2 4.07Å; F288-L296 HydrophobicContact CD2-CD2 4Å; F288-L296 HydrophobicContact CE1-CD1 3.82Å; F288-L296 HydrophobicContact CG-CD1 4.35Å; F288-L296 HydrophobicContact CG-CD2 3.73Å; F288-L296 HydrophobicContact CZ-CD1 4.3Å; F288-L298 HydrophobicContact CD2-CD1 4.39Å; F288-L298 HydrophobicContact CE2-CD1 3.85Å; F288-L298 HydrophobicContact CE2-CD2 4.29Å; F288-L298 HydrophobicContact CZ-CD1 4.25Å; F288-L298 HydrophobicContact CZ-CD2 3.96Å; F288-P307 HydrophobicContact CD2-CB 4.12Å; F288-P307 HydrophobicContact CD2-CG 4.2Å; F288-P307 HydrophobicContact CE2-CG 4.49Å
289	N	93.3	Very high	96	Very high	76 Å²	76	43.2 Å²	43.2	41%	0.406	23%	0.232	S	C	.	.			trans	-79.5	72.5	176.2	-171.3	8.6	0	0	0	110.9	A286 N310	A286-N289 HydrophobicContact CB-CB 4.42Å; A286-N289 WeakPolarHBondContact O-CB 3.12Å; A286-N289 PolarHBondContact O-N 3.07Å; N289-N310 WeakPolarHBondContact OD1-CB 3.27Å; N289-N310 PolarHBondContact OD1-ND2 3.27Å
290	L	94.1	Very high	96	Very high	15 Å²	15	43.8 Å²	43.8	8%	0.079	23%	0.231	C	C	.	.			trans	-116.6	127.5	-178.1	-58.8	168.4	0	0	0	109.7	F262 L268 F288 S292 L293 N310	F262-L290 HydrophobicContact CB-CD1 3.64Å; F262-L290 HydrophobicContact CB-CD2 3.79Å; F262-L290 HydrophobicContact CB-CG 4.19Å; F262-L290 HydrophobicContact CG-CD1 4.03Å; F262-L290 VanDerWaalsContact O-CD2 3.28Å; F262-L290 WeakPolarHBondContact O-CD2 3.46Å; L268-L290 HydrophobicContact CD2-CD1 4.16Å; F288-L290 PolarHBondContact O-N 2.97Å; L290-S292 PolarHBondContact O-N 3.01Å; L290-L293 HydrophobicContact CB-CB 3.88Å; L290-L293 HydrophobicContact CD1-CB 4.42Å; L290-L293 HydrophobicContact CD1-CD2 4.47Å; L290-L293 PolarHBondContact O-N 3.16Å; L290-N310 WeakPolarHBondContact O-CB 3.28Å
291	T	93	Very high	96.1	Very high	100 Å²	100	41.9 Å²	41.9	61%	0.613	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.8	178.5	52.1	0	0	0	0	113.4
292	S	96.8	Very high	96.2	Very high	24 Å²	24	37.2 Å²	37.2	17%	0.168	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-19.1	179	46.9	0	0	0	0	113.8	F265 T266 L268 A269 L290	F265-S292 PolarHBondContact O-OG 2.94Å; T266-S292 WeakPolarHBondContact O-CB 3.39Å; L268-S292 CarbonylContact O-C 3.44Å; L268-S292 VanDerWaalsContact O-C 3.23Å; L268-S292 WeakPolarHBondContact O-CB 3.27Å; L268-S292 PolarHBondContact O-OG 3.22Å; A269-S292 WeakPolarHBondContact CA-O 3.3Å; L290-S292 PolarHBondContact O-N 3.01Å
293	L	97.8	Very high	96.3	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	20%	0.2	C	C	.	.			trans	-77.9	126.7	-170.1	-171.4	69.6	0	0	0	111.3	L268 V271 F288 L290 L296 L313	L268-L293 WeakPolarHBondContact O-CA 3.34Å; L268-L293 PolarHBondContact O-N 3Å; V271-L293 HydrophobicContact CB-CD1 4.13Å; V271-L293 HydrophobicContact CG2-CD1 3.66Å; F288-L293 HydrophobicContact CB-CD2 4.41Å; L290-L293 HydrophobicContact CB-CB 3.88Å; L290-L293 HydrophobicContact CD1-CB 4.42Å; L290-L293 HydrophobicContact CD1-CD2 4.47Å; L290-L293 PolarHBondContact O-N 3.16Å; L293-L296 HydrophobicContact CD2-CB 4.15Å; L293-L296 HydrophobicContact CD2-CD1 4.46Å; L293-L296 HydrophobicContact CD2-CD2 4.32Å; L293-L313 HydrophobicContact CB-CD1 4.38Å; L293-L313 HydrophobicContact CD2-CD1 3.98Å; L293-L313 HydrophobicContact CG-CD1 3.76Å; L293-L313 WeakPolarHBondContact O-CA 3.23Å
294	L	97.8	Very high	96.2	Very high	62 Å²	62	39.3 Å²	39.3	33%	0.325	21%	0.214	S	C	.	.			trans	-111.9	-36.9	-177.6	-58.2	179.6	0	0	0	112.3	A269 E314 H315	A269-L294 HydrophobicContact CB-CD1 4.22Å; A269-L294 HydrophobicContact CB-CG 4.27Å; A269-L294 PolarHBondContact O-N 3.19Å; L294-E314 HydrophobicContact CD2-CG 4.35Å; L294-E314 WeakPolarHBondContact O-CA 3.39Å; L294-E314 PolarHBondContact O-N 3.17Å; L294-H315 PolarHBondContact O-N 2.89Å
295	D	98.6	Very high	96	Very high	16 Å²	16	41.1 Å²	41.1	9%	0.086	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	117.7	-175.7	-167	-56.3	0	0	0	110.1	A269 F270 V271 Q297 H315	A269-D295 PolarHBondContact O-N 2.9Å; F270-D295 HydrophobicContact CD1-CB 3.54Å; F270-D295 HydrophobicContact CE1-CB 3.93Å; F270-D295 HydrophobicContact CG-CB 4.47Å; V271-D295 PolarHBondContact N-O 3.34Å; D295-Q297 WeakPolarHBondContact OD1-CG 3.35Å; D295-Q297 PolarHBondContact OD1-NE2 2.8Å; D295-H315 HydrophobicContact CB-CB 4.41Å; D295-H315 IonicContact OD2-CG 3.84Å; D295-H315 IonicContact OD2-ND1 2.9Å; D295-H315 PolarHBondContact OD2-ND1 2.89Å
296	L	98.6	Very high	96.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.3	178.9	179.6	58.4	0	0	0	110.4	V271 F288 L293 L298 L313 H315 L316 H317	V271-L296 HydrophobicContact CB-CD1 4.07Å; V271-L296 HydrophobicContact CG1-CD1 4.12Å; F288-L296 HydrophobicContact CB-CD2 3.9Å; F288-L296 HydrophobicContact CD1-CD1 3.85Å; F288-L296 HydrophobicContact CD1-CD2 4.07Å; F288-L296 HydrophobicContact CD2-CD2 4Å; F288-L296 HydrophobicContact CE1-CD1 3.82Å; F288-L296 HydrophobicContact CG-CD1 4.35Å; F288-L296 HydrophobicContact CG-CD2 3.73Å; F288-L296 HydrophobicContact CZ-CD1 4.3Å; L293-L296 HydrophobicContact CD2-CB 4.15Å; L293-L296 HydrophobicContact CD2-CD1 4.46Å; L293-L296 HydrophobicContact CD2-CD2 4.32Å; L296-L298 HydrophobicContact CD1-CD1 4.15Å; L296-L298 HydrophobicContact CD1-CD2 4.44Å; L296-L298 HydrophobicContact CD1-CG 4.02Å; L296-L298 HydrophobicContact CD2-CD1 3.84Å; L296-L298 HydrophobicContact CG-CD1 3.91Å; L296-L298 HydrophobicContact CG-CG 4.07Å; L296-L313 HydrophobicContact CB-CD1 3.95Å; L296-L313 HydrophobicContact CB-CD2 4.21Å; L296-H315 PolarHBondContact N-O 3.13Å; L296-L316 HydrophobicContact CB-CD1 4.13Å; L296-L316 HydrophobicContact CD2-CD1 4Å; L296-L316 HydrophobicContact CG-CD1 4.09Å; L296-H317 PolarHBondContact O-N 3.19Å
297	Q	98.8	Very high	96.4	Very high	27 Å²	27	31.4 Å²	31.4	13%	0.126	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	112.9	-178.9	-42.9	-170.4	3.7	0	0	111.6	V271 R272 L273 N274 D295 H317	V271-Q297 PolarHBondContact O-N 3.04Å; R272-Q297 HydrophobicContact CB-CB 4.45Å; R272-Q297 HydrophobicContact CG-CB 4.25Å; R272-Q297 HydrophobicContact CG-CG 4.02Å; L273-Q297 CarbonylContact C-O 3.19Å; L273-Q297 WeakPolarHBondContact CA-O 3.39Å; L273-Q297 PolarHBondContact N-O 3.28Å; N274-Q297 PolarHBondContact N-O 3.33Å; N274-Q297 VanDerWaalsContact ND2-CB 3.29Å; N274-Q297 WeakPolarHBondContact ND2-CB 3.43Å; N274-Q297 PolarHBondContact ND2-OE1 3.21Å; N274-Q297 VanDerWaalsContact OD1-C 3.26Å; N274-Q297 VanDerWaalsContact OD1-CB 3.26Å; N274-Q297 WeakPolarHBondContact OD1-CB 3.47Å; D295-Q297 WeakPolarHBondContact OD1-CG 3.35Å; D295-Q297 PolarHBondContact OD1-NE2 2.8Å; Q297-H317 HydrophobicContact CB-CB 4.26Å; Q297-H317 HydrophobicContact CG-CB 4.45Å
298	L	98.7	Very high	96.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.			trans	-127.9	20.2	-176.2	-67.8	169	0	0	0	111.5	L273 N274 L278 F288 L296 N301 L303 P307 H317 L318 N321	L273-L298 HydrophobicContact CB-CD2 3.8Å; L273-L298 HydrophobicContact CD1-CD2 4.05Å; N274-L298 PolarHBondContact OD1-N 2.92Å; L278-L298 HydrophobicContact CD1-CD2 3.84Å; F288-L298 HydrophobicContact CD2-CD1 4.39Å; F288-L298 HydrophobicContact CE2-CD1 3.85Å; F288-L298 HydrophobicContact CE2-CD2 4.29Å; F288-L298 HydrophobicContact CZ-CD1 4.25Å; F288-L298 HydrophobicContact CZ-CD2 3.96Å; L296-L298 HydrophobicContact CD1-CD1 4.15Å; L296-L298 HydrophobicContact CD1-CD2 4.44Å; L296-L298 HydrophobicContact CD1-CG 4.02Å; L296-L298 HydrophobicContact CD2-CD1 3.84Å; L296-L298 HydrophobicContact CG-CD1 3.91Å; L296-L298 HydrophobicContact CG-CG 4.07Å; L298-N301 PolarHBondContact O-ND2 2.65Å; L298-L303 HydrophobicContact CB-CD1 4.19Å; L298-L303 HydrophobicContact CD1-CD1 4.25Å; L298-P307 HydrophobicContact CD1-CG 3.95Å; L298-H317 CarbonylContact C-O 3.48Å; L298-H317 WeakPolarHBondContact CA-O 3.4Å; L298-H317 PolarHBondContact N-O 3.2Å; L298-L318 HydrophobicContact CB-CD2 3.8Å; L298-L318 HydrophobicContact CD1-CD2 4.09Å; L298-N321 PolarHBondContact O-ND2 3.14Å
299	A	98.6	Very high	95.9	Very high	4 Å²	4	35.1 Å²	35.1	3%	0.033	19%	0.191	C	C	.	.			trans	-63.3	152.5	-179.4	0	0	0	0	0	112.1	N274 Y275 N301 H317 N319	N274-A299 CarbonylContact C-O 3.51Å; N274-A299 WeakPolarHBondContact CA-O 3.35Å; N274-A299 HydrophobicContact CB-CB 4.37Å; N274-A299 WeakPolarHBondContact CB-O 3.14Å; N274-A299 WeakPolarHBondContact OD1-CA 3.45Å; N274-A299 WeakPolarHBondContact OD1-CB 3.45Å; N274-A299 PolarHBondContact OD1-N 2.88Å; Y275-A299 PolarHBondContact N-O 3.49Å; A299-N301 PolarHBondContact O-ND2 3.42Å; A299-H317 PolarHBondContact N-O 3.18Å; A299-N319 CarbonylContact C-O 3.32Å; A299-N319 WeakPolarHBondContact CA-O 3.39Å; A299-N319 WeakPolarHBondContact CB-O 3.44Å; A299-N319 WeakPolarHBondContact CB-OD1 3.44Å
300	H	98.6	Very high	95.8	Very high	49 Å²	49	32.4 Å²	32.4	23%	0.227	18%	0.177	C	C	.	.	S	Bend	trans	56	54	-179.5	-58.8	-91.8	0	0	0	112.5	Y275 N276 N319 H320	Y275-H300 WeakPolarHBondContact CA-O 3.43Å; Y275-H300 HydrophobicContact CD1-CB 3.6Å; Y275-H300 AromaticContact CD1-CG 3.8Å; Y275-H300 HydrophobicContact CD2-CB 4.13Å; Y275-H300 HydrophobicContact CE1-CB 3.84Å; Y275-H300 AromaticContact CE1-CD2 3.72Å; Y275-H300 AromaticContact CE1-CE1 3.95Å; Y275-H300 AromaticContact CE1-CG 3.46Å; Y275-H300 VanDerWaalsContact CE1-CG 3.46Å; Y275-H300 AromaticContact CE1-ND1 3.62Å; Y275-H300 HydrophobicContact CE2-CB 4.3Å; Y275-H300 AromaticContact CE2-CD2 3.47Å; Y275-H300 VanDerWaalsContact CE2-CD2 3.47Å; Y275-H300 WeakPolarHBondContact CE2-CD2 3.18Å; Y275-H300 AromaticContact CE2-CG 3.94Å; Y275-H300 HydrophobicContact CG-CB 3.76Å; Y275-H300 AromaticContact CZ-CD2 3.24Å; Y275-H300 AromaticContact CZ-CE1 3.83Å; Y275-H300 AromaticContact CZ-CG 3.52Å; Y275-H300 AromaticContact CZ-ND1 3.88Å; Y275-H300 AromaticContact CZ-NE2 3.46Å; Y275-H300 PolarHBondContact N-O 3.2Å; Y275-H300 PolarHBondContact OH-CD2 2.96Å; Y275-H300 PolarHBondContact OH-CE1 3.46Å; Y275-H300 PolarHBondContact OH-NE2 2.79Å; N276-H300 PolarHBondContact N-O 3.14Å; H300-N319 PolarHBondContact N-O 3.16Å; H300-H320 WeakPolarHBondContact CA-O 3.23Å; H300-H320 AromaticContact CE1-CD2 3.37Å; H300-H320 PolarHBondContact CE1-CD2 3.02Å; H300-H320 AromaticContact CE1-CG 3.36Å; H300-H320 PolarHBondContact N-O 3.41Å; H300-H320 WeakPolarHBondContact ND1-CB 3.47Å; H300-H320 AromaticContact ND1-CD2 3.98Å; H300-H320 AromaticContact ND1-CG 3.83Å; H300-H320 AromaticContact NE2-CG 3.78Å
301	N	98.8	Very high	95.5	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.064	18%	0.181	C	C	.	.	S	Bend	trans	-123.2	-161.3	169.9	-81.3	-76.4	0	0	0	109.2	L273 N276 Q277 L278 L298 A299 L303 N321	L273-N301 PolarHBondContact O-ND2 3.44Å; N276-N301 VanDerWaalsContact CA-OD1 3.28Å; N276-N301 WeakPolarHBondContact CA-OD1 3.49Å; N276-N301 WeakPolarHBondContact CB-OD1 3.48Å; N276-N301 PolarHBondContact N-OD1 3.04Å; N276-N301 PolarHBondContact O-OD1 2.75Å; Q277-N301 PolarHBondContact N-OD1 3.13Å; L278-N301 HydrophobicContact CB-CB 4.18Å; L278-N301 WeakPolarHBondContact CB-OD1 3.32Å; L278-N301 PolarHBondContact N-OD1 3.49Å; L298-N301 PolarHBondContact O-ND2 2.65Å; A299-N301 PolarHBondContact O-ND2 3.42Å; N301-L303 HydrophobicContact CB-CG 4.34Å; N301-N321 VanDerWaalsContact CA-OD1 3.25Å; N301-N321 WeakPolarHBondContact CA-OD1 3.46Å; N301-N321 WeakPolarHBondContact CB-OD1 3.07Å; N301-N321 PolarHBondContact N-OD1 2.77Å; N301-N321 PolarHBondContact O-OD1 3.36Å
302	Q	98.1	Very high	95.4	Very high	105 Å²	105	30.5 Å²	30.5	49%	0.491	16%	0.161	S	C	.	.	B	Isolated β-bridge	trans	-123.3	34.2	-177.3	-58.6	167.8	38.6	0	0	111	L278 N321	L278-Q302 CarbonylContact O-C 3.37Å; L278-Q302 VanDerWaalsContact O-CA 3.31Å; L278-Q302 WeakPolarHBondContact O-CA 3.45Å; L278-Q302 WeakPolarHBondContact O-CB 3.46Å; L278-Q302 PolarHBondContact O-N 2.77Å; Q302-N321 PolarHBondContact N-OD1 3.23Å
303	L	97.4	Very high	95.2	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.154	C	C	.	.			trans	-75.3	135.6	179.9	-58.8	174.2	0	0	0	110.4	L278 V283 L298 N301 L318 N321 S322 I323	L278-L303 HydrophobicContact CB-CD2 4.41Å; V283-L303 HydrophobicContact CB-CD2 4.49Å; V283-L303 HydrophobicContact CG2-CD2 3.9Å; L298-L303 HydrophobicContact CB-CD1 4.19Å; L298-L303 HydrophobicContact CD1-CD1 4.25Å; N301-L303 HydrophobicContact CB-CG 4.34Å; L303-L318 HydrophobicContact CD1-CD2 3.78Å; L303-N321 HydrophobicContact CB-CB 4.28Å; L303-N321 WeakPolarHBondContact CB-OD1 3.45Å; L303-N321 PolarHBondContact N-OD1 3.08Å; L303-N321 VanDerWaalsContact N-OD1 3.07Å; L303-S322 CarbonylContact O-C 3.39Å; L303-S322 WeakPolarHBondContact O-CA 3.47Å; L303-S322 PolarHBondContact O-N 3.06Å; L303-I323 PolarHBondContact O-N 3.09Å
304	T	95.4	Very high	95.1	Very high	58 Å²	58	31.1 Å²	31.1	36%	0.356	16%	0.162	S	C	.	.	S	Bend	trans	-104.2	-17.1	172.5	75.1	0	0	0	0	112.3	D280 S322 I323	D280-T304 PolarHBondContact OD1-N 3.37Å; D280-T304 WeakPolarHBondContact OD2-CB 3.33Å; D280-T304 WeakPolarHBondContact OD2-CG2 3.04Å; D280-T304 PolarHBondContact OD2-N 2.95Å; D280-T304 PolarHBondContact OD2-OG1 3.34Å; T304-S322 WeakPolarHBondContact CA-O 3.3Å; T304-I323 WeakPolarHBondContact O-CA 3.38Å
305	V	92.7	Very high	95	Very high	71 Å²	71	31.3 Å²	31.3	43%	0.43	16%	0.161	S	C	.	.	S	Bend	trans	-126.8	156.1	175.3	-58.5	0	0	0	0	111.6	D280	D280-V305 HydrophobicContact CB-CG2 4.25Å; D280-V305 WeakPolarHBondContact OD1-CG2 3.09Å; D280-V305 PolarHBondContact OD1-N 3.12Å; D280-V305 VanDerWaalsContact OD1-N 3.17Å
306	I	92.1	Very high	94.9	Very high	15 Å²	15	30.6 Å²	30.6	8%	0.077	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-77.6	123.3	173.8	-62.1	-180	0	0	0	108	F309 L316 L318 I323 I326 I331 L354	I306-F309 HydrophobicContact CG2-CE1 4.08Å; I306-L316 HydrophobicContact CG2-CD2 4.4Å; I306-L318 HydrophobicContact CB-CD1 4.37Å; I306-L318 HydrophobicContact CD1-CD1 4.41Å; I306-L318 HydrophobicContact CG1-CD1 3.96Å; I306-L318 HydrophobicContact CG2-CD1 3.89Å; I306-I323 HydrophobicContact CG1-CD1 4.01Å; I306-I323 HydrophobicContact CG1-CG2 4.18Å; I306-I326 HydrophobicContact CD1-CG1 4.17Å; I306-I326 HydrophobicContact CD1-CG2 4.26Å; I306-I331 HydrophobicContact CB-CD1 3.93Å; I306-I331 HydrophobicContact CB-CG1 4.26Å; I306-I331 HydrophobicContact CD1-CD1 3.43Å; I306-I331 VanDerWaalsContact CD1-CD1 3.43Å; I306-I331 HydrophobicContact CG1-CD1 4.18Å; I306-I331 HydrophobicContact CG2-CD1 3.87Å; I306-I331 HydrophobicContact CG2-CG1 3.92Å; I306-L354 HydrophobicContact CD1-CD2 4.12Å
307	P	92.3	Very high	94.9	Very high	12 Å²	12	32.1 Å²	32.1	8%	0.078	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-68.5	155.6	179.1	28.8	-34.7	0	0	0	111.3	V283 F288 L298 F309	V283-P307 HydrophobicContact CG1-CB 4.18Å; F288-P307 HydrophobicContact CD2-CB 4.12Å; F288-P307 HydrophobicContact CD2-CG 4.2Å; F288-P307 HydrophobicContact CE2-CG 4.49Å; L298-P307 HydrophobicContact CD1-CG 3.95Å; P307-F309 WeakPolarHBondContact O-CD1 3.22Å; P307-F309 PolarHBondContact O-N 2.81Å
308	L	91.1	Very high	94.8	Very high	68 Å²	68	30.9 Å²	30.9	36%	0.356	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-70.7	132.6	174.9	-172.2	72.9	0	0	0	109.7	K285 A286 E330	K285-L308 WeakPolarHBondContact O-CB 3.26Å; K285-L308 PolarHBondContact O-N 2.94Å; K285-L308 VanDerWaalsContact O-N 3.16Å; A286-L308 HydrophobicContact CB-CD2 4.27Å; L308-E330 WeakPolarHBondContact CD1-O 3.34Å
309	F	91.7	Very high	94.8	Very high	19 Å²	19	31.3 Å²	31.3	8%	0.083	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-131.9	164.5	176.5	57.5	-93.6	0	0	0	110.7	I306 P307 L313 L316 I331 L349 F371	I306-F309 HydrophobicContact CG2-CE1 4.08Å; P307-F309 WeakPolarHBondContact O-CD1 3.22Å; P307-F309 PolarHBondContact O-N 2.81Å; F309-L313 HydrophobicContact CB-CD2 3.98Å; F309-L313 HydrophobicContact CD1-CD2 4.43Å; F309-L313 HydrophobicContact CD2-CB 3.85Å; F309-L313 HydrophobicContact CD2-CD2 3.62Å; F309-L313 HydrophobicContact CD2-CG 4.38Å; F309-L313 HydrophobicContact CE2-CB 4.44Å; F309-L313 HydrophobicContact CE2-CD2 4.18Å; F309-L313 HydrophobicContact CG-CD2 3.76Å; F309-L316 HydrophobicContact CD1-CD2 3.86Å; F309-L316 HydrophobicContact CE1-CD2 3.45Å; F309-L316 VanDerWaalsContact CE1-CD2 3.45Å; F309-L316 HydrophobicContact CZ-CD2 3.95Å; F309-I331 HydrophobicContact CE1-CG2 4.18Å; F309-I331 HydrophobicContact CZ-CG2 3.84Å; F309-L349 HydrophobicContact CZ-CD2 4.39Å; F309-F371 HydrophobicContact CE2-CE1 4.4Å; F309-F371 HydrophobicContact CE2-CZ 4.27Å; F309-F371 HydrophobicContact CZ-CZ 4.01Å
310	N	91.3	Very high	94.7	Very high	19 Å²	19	35 Å²	35	10%	0.102	18%	0.177	C	C	.	.			trans	-77.5	149.2	-179.6	-168.9	-88.4	0	0	0	111.8	N289 L290 H312 L313	N289-N310 WeakPolarHBondContact OD1-CB 3.27Å; N289-N310 PolarHBondContact OD1-ND2 3.27Å; L290-N310 WeakPolarHBondContact O-CB 3.28Å; N310-H312 PolarHBondContact O-N 2.97Å; N310-H312 VanDerWaalsContact O-N 3.09Å; N310-H312 WeakPolarHBondContact OD1-CB 3.4Å; N310-H312 PolarHBondContact OD1-CD2 3.41Å; N310-H312 PolarHBondContact OD1-N 2.97Å; N310-L313 WeakPolarHBondContact O-CB 3.42Å; N310-L313 PolarHBondContact O-N 3.03Å; N310-L313 VanDerWaalsContact O-N 3.07Å
311	N	87.9	Confident	94.7	Very high	30 Å²	30	33 Å²	33	16%	0.16	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.3	-179.6	70.1	-27.5	0	0	0	114.2	L313 F334 R344 L345 P347 R348	N311-L313 VanDerWaalsContact C-N 3.34Å; N311-F334 HydrophobicContact CB-CE2 3.88Å; N311-F334 HydrophobicContact CB-CZ 4.27Å; N311-R344 PolarHBondContact ND2-O 3.32Å; N311-L345 PolarHBondContact ND2-O 3.08Å; N311-L345 VanDerWaalsContact ND2-O 3.15Å; N311-P347 WeakPolarHBondContact O-CA 3.21Å; N311-R348 PolarHBondContact O-N 3.07Å
312	H	90.4	Very high	94.6	Very high	45 Å²	45	34.5 Å²	34.5	21%	0.208	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.5	172	-75.1	-74.8	0	0	0	115	N310 E314	N310-H312 PolarHBondContact O-N 2.97Å; N310-H312 VanDerWaalsContact O-N 3.09Å; N310-H312 WeakPolarHBondContact OD1-CB 3.4Å; N310-H312 PolarHBondContact OD1-CD2 3.41Å; N310-H312 PolarHBondContact OD1-N 2.97Å; H312-E314 PolarHBondContact O-N 3.02Å
313	L	93.4	Very high	94.5	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.156	C	C	.	.			trans	-62.1	132.9	-178.8	-169.2	73.4	0	0	0	111.2	L293 L296 F309 N310 N311 L316 R348 L349	L293-L313 HydrophobicContact CB-CD1 4.38Å; L293-L313 HydrophobicContact CD2-CD1 3.98Å; L293-L313 HydrophobicContact CG-CD1 3.76Å; L293-L313 WeakPolarHBondContact O-CA 3.23Å; L296-L313 HydrophobicContact CB-CD1 3.95Å; L296-L313 HydrophobicContact CB-CD2 4.21Å; F309-L313 HydrophobicContact CB-CD2 3.98Å; F309-L313 HydrophobicContact CD1-CD2 4.43Å; F309-L313 HydrophobicContact CD2-CB 3.85Å; F309-L313 HydrophobicContact CD2-CD2 3.62Å; F309-L313 HydrophobicContact CD2-CG 4.38Å; F309-L313 HydrophobicContact CE2-CB 4.44Å; F309-L313 HydrophobicContact CE2-CD2 4.18Å; F309-L313 HydrophobicContact CG-CD2 3.76Å; N310-L313 WeakPolarHBondContact O-CB 3.42Å; N310-L313 PolarHBondContact O-N 3.03Å; N310-L313 VanDerWaalsContact O-N 3.07Å; N311-L313 VanDerWaalsContact C-N 3.34Å; L313-L316 HydrophobicContact CD2-CB 4Å; L313-L316 HydrophobicContact CD2-CD1 4.23Å; L313-L316 HydrophobicContact CD2-CD2 4.45Å; L313-L316 HydrophobicContact CD2-CG 4.46Å; L313-R348 CarbonylContact O-C 3.42Å; L313-R348 VanDerWaalsContact O-C 3.29Å; L313-L349 HydrophobicContact CD2-CD1 4.22Å; L313-L349 HydrophobicContact CG-CD1 4.28Å; L313-L349 WeakPolarHBondContact O-CA 3.34Å; L313-L349 PolarHBondContact O-N 2.52Å; L313-L349 VanDerWaalsContact O-N 3.07Å
314	E	94.3	Very high	94.1	Very high	38 Å²	38	35.7 Å²	35.7	18%	0.178	19%	0.185	C	C	.	.			trans	-102.4	-40.5	-178.3	-60.6	-164.6	176.8	0	0	112.5	L294 H312 R348 R350 Y351	L294-E314 HydrophobicContact CD2-CG 4.35Å; L294-E314 WeakPolarHBondContact O-CA 3.39Å; L294-E314 PolarHBondContact O-N 3.17Å; H312-E314 PolarHBondContact O-N 3.02Å; E314-R348 HydrophobicContact CG-CB 4.47Å; E314-R350 VanDerWaalsContact CD-NH1 3.32Å; E314-R350 PolarHBondContact O-N 3.07Å; E314-R350 IonicContact OE1-CZ 3.55Å; E314-R350 IonicContact OE1-NH1 3.6Å; E314-R350 PolarHBondContact OE1-NH1 3.25Å; E314-R350 IonicContact OE2-CZ 3.89Å; E314-R350 IonicContact OE2-NH1 2.72Å; E314-R350 PolarHBondContact OE2-NH1 3.37Å; E314-Y351 PolarHBondContact O-N 3.36Å; E314-Y351 VanDerWaalsContact O-N 3.16Å
315	H	96.8	Very high	93.8	Very high	65 Å²	65	37 Å²	37	30%	0.301	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.4	-178.4	-56.2	154.5	0	0	0	111.8	L294 D295 L296	L294-H315 PolarHBondContact O-N 2.89Å; D295-H315 HydrophobicContact CB-CB 4.41Å; D295-H315 IonicContact OD2-CG 3.84Å; D295-H315 IonicContact OD2-ND1 2.9Å; D295-H315 PolarHBondContact OD2-ND1 2.89Å; L296-H315 PolarHBondContact N-O 3.13Å
316	L	96.3	Very high	93.4	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.7	176.6	-178.3	55.9	0	0	0	111	L296 I306 F309 L313 L318 L349 Y351 L352 R353	L296-L316 HydrophobicContact CB-CD1 4.13Å; L296-L316 HydrophobicContact CD2-CD1 4Å; L296-L316 HydrophobicContact CG-CD1 4.09Å; I306-L316 HydrophobicContact CG2-CD2 4.4Å; F309-L316 HydrophobicContact CD1-CD2 3.86Å; F309-L316 HydrophobicContact CE1-CD2 3.45Å; F309-L316 VanDerWaalsContact CE1-CD2 3.45Å; F309-L316 HydrophobicContact CZ-CD2 3.95Å; L313-L316 HydrophobicContact CD2-CB 4Å; L313-L316 HydrophobicContact CD2-CD1 4.23Å; L313-L316 HydrophobicContact CD2-CD2 4.45Å; L313-L316 HydrophobicContact CD2-CG 4.46Å; L316-L318 HydrophobicContact CD1-CD1 4.03Å; L316-L318 HydrophobicContact CD1-CG 3.97Å; L316-L318 HydrophobicContact CD2-CD1 3.71Å; L316-L318 HydrophobicContact CD2-CG 4.49Å; L316-L318 HydrophobicContact CG-CD1 3.76Å; L316-L318 HydrophobicContact CG-CG 4.02Å; L316-L349 HydrophobicContact CB-CD1 3.87Å; L316-Y351 PolarHBondContact N-O 3.09Å; L316-L352 HydrophobicContact CB-CD1 4.09Å; L316-L352 HydrophobicContact CD2-CD1 3.94Å; L316-L352 HydrophobicContact CG-CD1 4.03Å; L316-R353 PolarHBondContact O-N 3.41Å
317	H	98.1	Very high	92.9	Very high	33 Å²	33	37 Å²	37	15%	0.153	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.3	176.7	-58	-111.9	0	0	0	110.5	L296 Q297 L298 A299 Y351	L296-H317 PolarHBondContact O-N 3.19Å; Q297-H317 HydrophobicContact CB-CB 4.26Å; Q297-H317 HydrophobicContact CG-CB 4.45Å; L298-H317 CarbonylContact C-O 3.48Å; L298-H317 WeakPolarHBondContact CA-O 3.4Å; L298-H317 PolarHBondContact N-O 3.2Å; A299-H317 PolarHBondContact N-O 3.18Å; H317-Y351 AromaticContact CE1-CD1 3.79Å; H317-Y351 AromaticContact CE1-CE1 3.36Å; H317-Y351 WeakPolarHBondContact CE1-CE1 3.45Å; H317-Y351 AromaticContact ND1-CE1 3.75Å; H317-Y351 AromaticContact NE2-CD1 3.82Å; H317-Y351 AromaticContact NE2-CE1 3.88Å
318	L	97.3	Very high	92.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.			trans	-128.7	13.6	-179.7	-74.2	167.2	0	0	0	112.1	L298 L303 I306 L316 N321 I323 R353 L354 N357	L298-L318 HydrophobicContact CB-CD2 3.8Å; L298-L318 HydrophobicContact CD1-CD2 4.09Å; L303-L318 HydrophobicContact CD1-CD2 3.78Å; I306-L318 HydrophobicContact CB-CD1 4.37Å; I306-L318 HydrophobicContact CD1-CD1 4.41Å; I306-L318 HydrophobicContact CG1-CD1 3.96Å; I306-L318 HydrophobicContact CG2-CD1 3.89Å; L316-L318 HydrophobicContact CD1-CD1 4.03Å; L316-L318 HydrophobicContact CD1-CG 3.97Å; L316-L318 HydrophobicContact CD2-CD1 3.71Å; L316-L318 HydrophobicContact CD2-CG 4.49Å; L316-L318 HydrophobicContact CG-CD1 3.76Å; L316-L318 HydrophobicContact CG-CG 4.02Å; L318-N321 PolarHBondContact O-ND2 3.22Å; L318-I323 HydrophobicContact CB-CD1 3.98Å; L318-I323 HydrophobicContact CD1-CD1 4.25Å; L318-I323 HydrophobicContact CD2-CD1 4.38Å; L318-I323 HydrophobicContact CG-CD1 4.46Å; L318-R353 CarbonylContact C-O 3.51Å; L318-R353 WeakPolarHBondContact CA-O 3.31Å; L318-R353 PolarHBondContact N-O 2.75Å; L318-L354 HydrophobicContact CB-CD2 3.8Å; L318-L354 HydrophobicContact CD1-CD2 4.2Å; L318-N357 PolarHBondContact O-ND2 3.24Å
319	N	97.4	Very high	91.3	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.053	21%	0.205	C	C	.	.			trans	-59.7	146.9	179.5	62.5	-82.4	0	0	0	111.9	A299 H300 R353 D355	A299-N319 CarbonylContact C-O 3.32Å; A299-N319 WeakPolarHBondContact CA-O 3.39Å; A299-N319 WeakPolarHBondContact CB-O 3.44Å; A299-N319 WeakPolarHBondContact CB-OD1 3.44Å; H300-N319 PolarHBondContact N-O 3.16Å; N319-R353 HydrophobicContact CB-CG 4.03Å; N319-R353 PolarHBondContact N-O 3.36Å; N319-R353 VanDerWaalsContact N-O 3.12Å; N319-R353 WeakPolarHBondContact OD1-CD 3.03Å; N319-D355 CarbonylContact C-O 3.56Å; N319-D355 WeakPolarHBondContact CA-O 3.21Å; N319-D355 WeakPolarHBondContact CB-O 3.49Å; N319-D355 WeakPolarHBondContact CB-OD1 3.18Å
320	H	97.9	Very high	90.4	Very high	81 Å²	81	42.1 Å²	42.1	38%	0.375	22%	0.224	S	C	.	.	S	Bend	trans	58.4	51.8	179.2	-57.1	59.2	0	0	0	112.5	H300 D355 G356	H300-H320 WeakPolarHBondContact CA-O 3.23Å; H300-H320 AromaticContact CE1-CD2 3.37Å; H300-H320 PolarHBondContact CE1-CD2 3.02Å; H300-H320 AromaticContact CE1-CG 3.36Å; H300-H320 PolarHBondContact N-O 3.41Å; H300-H320 WeakPolarHBondContact ND1-CB 3.47Å; H300-H320 AromaticContact ND1-CD2 3.98Å; H300-H320 AromaticContact ND1-CG 3.83Å; H300-H320 AromaticContact NE2-CG 3.78Å; H320-D355 IonicContact CE1-OD2 3.49Å; H320-D355 PolarHBondContact N-O 3.44Å; H320-D355 PolarHBondContact ND1-O 3.01Å; H320-G356 WeakPolarHBondContact CA-O 3.4Å
321	N	98.1	Very high	89.6	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.037	22%	0.223	C	C	.	.	S	Bend	trans	-113.4	-157.4	166.4	-83.5	-81.7	0	0	0	108.7	L298 N301 Q302 L303 L318 I323 N357	L298-N321 PolarHBondContact O-ND2 3.14Å; N301-N321 VanDerWaalsContact CA-OD1 3.25Å; N301-N321 WeakPolarHBondContact CA-OD1 3.46Å; N301-N321 WeakPolarHBondContact CB-OD1 3.07Å; N301-N321 PolarHBondContact N-OD1 2.77Å; N301-N321 PolarHBondContact O-OD1 3.36Å; Q302-N321 PolarHBondContact N-OD1 3.23Å; L303-N321 HydrophobicContact CB-CB 4.28Å; L303-N321 WeakPolarHBondContact CB-OD1 3.45Å; L303-N321 PolarHBondContact N-OD1 3.08Å; L303-N321 VanDerWaalsContact N-OD1 3.07Å; L318-N321 PolarHBondContact O-ND2 3.22Å; N321-I323 HydrophobicContact CB-CD1 4.21Å; N321-I323 HydrophobicContact CB-CG1 4.11Å; N321-N357 VanDerWaalsContact CA-OD1 3.28Å; N321-N357 WeakPolarHBondContact CA-OD1 3.34Å; N321-N357 WeakPolarHBondContact CB-OD1 3.39Å; N321-N357 PolarHBondContact N-OD1 3.19Å; N321-N357 PolarHBondContact O-OD1 3.07Å
322	S	97.1	Very high	88.8	Confident	43 Å²	43	41.4 Å²	41.4	30%	0.301	22%	0.221	S	C	.	.			trans	-122	34.4	176.9	-58.1	0	0	0	0	111.4	L303 T304 E324 N357	L303-S322 CarbonylContact O-C 3.39Å; L303-S322 WeakPolarHBondContact O-CA 3.47Å; L303-S322 PolarHBondContact O-N 3.06Å; T304-S322 WeakPolarHBondContact CA-O 3.3Å; S322-E324 PolarHBondContact O-N 3.23Å; S322-N357 PolarHBondContact N-OD1 3.01Å
323	I	94.7	Very high	87.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.239	C	C	.	.			trans	-72.3	123.7	-176.6	-57.6	165.1	0	0	0	109.6	L303 T304 I306 L318 N321 S325 L354 N357 H358 L359	L303-I323 PolarHBondContact O-N 3.09Å; T304-I323 WeakPolarHBondContact O-CA 3.38Å; I306-I323 HydrophobicContact CG1-CD1 4.01Å; I306-I323 HydrophobicContact CG1-CG2 4.18Å; L318-I323 HydrophobicContact CB-CD1 3.98Å; L318-I323 HydrophobicContact CD1-CD1 4.25Å; L318-I323 HydrophobicContact CD2-CD1 4.38Å; L318-I323 HydrophobicContact CG-CD1 4.46Å; N321-I323 HydrophobicContact CB-CD1 4.21Å; N321-I323 HydrophobicContact CB-CG1 4.11Å; I323-S325 WeakPolarHBondContact CG2-O 3.47Å; I323-L354 HydrophobicContact CD1-CD2 4.11Å; I323-N357 HydrophobicContact CB-CB 4.19Å; I323-N357 WeakPolarHBondContact CB-OD1 3.36Å; I323-N357 WeakPolarHBondContact CG1-OD1 3.26Å; I323-N357 PolarHBondContact N-OD1 3.09Å; I323-H358 CarbonylContact O-C 3.29Å; I323-H358 VanDerWaalsContact O-C 3.32Å; I323-H358 WeakPolarHBondContact O-CA 3.46Å; I323-H358 PolarHBondContact O-N 3.16Å; I323-L359 HydrophobicContact CG2-CD2 3.93Å; I323-L359 PolarHBondContact O-N 2.98Å
324	E	91.1	Very high	86	Confident	133 Å²	133	46.7 Å²	46.7	62%	0.621	25%	0.252	S	S	*	.			trans	-97.4	-32.1	-176.4	-65.1	-177.3	-178	0	0	113	S322 H358	S322-E324 PolarHBondContact O-N 3.23Å; E324-H358 HydrophobicContact CG-CB 4.25Å
325	S	87.4	Confident	84	Confident	85 Å²	85	48.4 Å²	48.4	59%	0.594	27%	0.268	S	S	*	.			trans	-146.2	157.6	-177.4	64.4	0	0	0	0	112.2	I323	I323-S325 WeakPolarHBondContact CG2-O 3.47Å
326	I	85.8	Confident	81.9	Confident	18 Å²	18	51 Å²	51	9%	0.092	28%	0.284	C	S	.	.			trans	-110.6	116.6	177	-57	179.2	0	0	0	107.1	I306 G328 I331 L354 L359 I363 V367	I306-I326 HydrophobicContact CD1-CG1 4.17Å; I306-I326 HydrophobicContact CD1-CG2 4.26Å; I326-G328 PolarHBondContact O-N 3.43Å; I326-I331 HydrophobicContact CG2-CD1 3.39Å; I326-L354 HydrophobicContact CD1-CD1 3.7Å; I326-L359 HydrophobicContact CD1-CD1 4.16Å; I326-L359 HydrophobicContact CD1-CD2 4.29Å; I326-L359 HydrophobicContact CG1-CD1 4.43Å; I326-L359 HydrophobicContact CG1-CD2 3.75Å; I326-I363 HydrophobicContact CD1-CD1 4.24Å; I326-I363 HydrophobicContact CD1-CG1 4.13Å; I326-I363 HydrophobicContact CD1-CG2 4.36Å; I326-V367 HydrophobicContact CG2-CG1 4.5Å; I326-V367 HydrophobicContact CG2-CG2 3.73Å
327	N	80.6	Confident	79.8	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	32%	0.324	S	S	.	.			trans	-89.3	98.8	174.3	-172.2	-14.1	0	0	0	109.7	T329 E330 I331	N327-T329 PolarHBondContact O-N 3.4Å; N327-T329 PolarHBondContact OD1-N 3.06Å; N327-T329 PolarHBondContact OD1-OG1 3.13Å; N327-E330 HydrophobicContact CB-CB 4.18Å; N327-E330 HydrophobicContact CB-CG 4.27Å; N327-E330 WeakPolarHBondContact ND2-CG 3.22Å; N327-E330 PolarHBondContact ND2-OE2 2.77Å; N327-E330 PolarHBondContact O-N 3.16Å; N327-I331 PolarHBondContact O-N 3.15Å
328	G	75.6	Confident	77.8	Confident	4 Å²	4	58.9 Å²	58.9	4%	0.041	33%	0.332	C	S	.	.	H	α-helix	trans	-54.7	-39	-178.4	0	0	0	0	0	113.1	I326 E330 C332 D366	I326-G328 PolarHBondContact O-N 3.43Å; G328-E330 VanDerWaalsContact C-N 3.33Å; G328-E330 PolarHBondContact O-N 2.9Å; G328-C332 CarbonylContact O-C 3.48Å; G328-C332 VanDerWaalsContact O-CA 3.25Å; G328-C332 WeakPolarHBondContact O-CA 3.28Å; G328-C332 WeakPolarHBondContact O-CB 3.32Å; G328-C332 PolarHBondContact O-N 2.94Å; G328-D366 WeakPolarHBondContact CA-OD2 3.46Å
329	T	73.8	Confident	75.8	Confident	103 Å²	103	64.5 Å²	64.5	63%	0.632	36%	0.361	S	S	*	.	H	α-helix	trans	-65.5	-28.2	177.8	0.4	0	0	0	0	114.8	N327 C332 P333	N327-T329 PolarHBondContact O-N 3.4Å; N327-T329 PolarHBondContact OD1-N 3.06Å; N327-T329 PolarHBondContact OD1-OG1 3.13Å; T329-C332 CarbonylContact O-C 3.45Å; T329-P333 VanDerWaalsContact O-CA 3.23Å; T329-P333 WeakPolarHBondContact O-CA 3.49Å
330	E	72.8	Confident	74	Confident	101 Å²	101	68.5 Å²	68.5	47%	0.472	38%	0.382	S	S	.	.	H	α-helix	trans	-86.9	-36.6	-179.6	-74.4	-179.3	158.2	0	0	112	L308 N327 G328	L308-E330 WeakPolarHBondContact CD1-O 3.34Å; N327-E330 HydrophobicContact CB-CB 4.18Å; N327-E330 HydrophobicContact CB-CG 4.27Å; N327-E330 WeakPolarHBondContact ND2-CG 3.22Å; N327-E330 PolarHBondContact ND2-OE2 2.77Å; N327-E330 PolarHBondContact O-N 3.16Å; G328-E330 VanDerWaalsContact C-N 3.33Å; G328-E330 PolarHBondContact O-N 2.9Å
331	I	74.1	Confident	72.2	Confident	19 Å²	19	70 Å²	70	10%	0.097	40%	0.398	C	S	.	.	H	α-helix	trans	-80.1	-29.4	178.2	-65.2	169.9	0	0	0	110.6	I306 F309 I326 N327 F371	I306-I331 HydrophobicContact CB-CD1 3.93Å; I306-I331 HydrophobicContact CB-CG1 4.26Å; I306-I331 HydrophobicContact CD1-CD1 3.43Å; I306-I331 VanDerWaalsContact CD1-CD1 3.43Å; I306-I331 HydrophobicContact CG1-CD1 4.18Å; I306-I331 HydrophobicContact CG2-CD1 3.87Å; I306-I331 HydrophobicContact CG2-CG1 3.92Å; F309-I331 HydrophobicContact CE1-CG2 4.18Å; F309-I331 HydrophobicContact CZ-CG2 3.84Å; I326-I331 HydrophobicContact CG2-CD1 3.39Å; N327-I331 PolarHBondContact O-N 3.15Å; I331-F371 HydrophobicContact CG2-CE2 3.43Å; I331-F371 VanDerWaalsContact CG2-CE2 3.43Å; I331-F371 HydrophobicContact CG2-CZ 3.42Å; I331-F371 VanDerWaalsContact CG2-CZ 3.42Å
332	C	72.1	Confident	70.8	Confident	15 Å²	15	73 Å²	73	10%	0.101	41%	0.414	C	S	.	.			trans	-132.6	78.8	177.2	-169.1	0	0	0	0	110.8	G328 T329 F334 C370	G328-C332 CarbonylContact O-C 3.48Å; G328-C332 VanDerWaalsContact O-CA 3.25Å; G328-C332 WeakPolarHBondContact O-CA 3.28Å; G328-C332 WeakPolarHBondContact O-CB 3.32Å; G328-C332 PolarHBondContact O-N 2.94Å; T329-C332 CarbonylContact O-C 3.45Å; C332-F334 PolarHBondContact O-N 2.74Å; C332-F334 VanDerWaalsContact O-N 3.15Å; C332-C370 HydrophobicContact CB-CB 3.47Å; C332-C370 VanDerWaalsContact CB-CB 3.47Å; C332-C370 WeakPolarHBondContact CB-SG 3.29Å; C332-C370 WeakPolarHBondContact SG-CB 3.34Å; C332-C370 CovalentContact SG-SG 1.98Å; C332-C370 PolarHBondContact SG-SG 3.23Å
333	P	61.3	Low	69.3	Low	91 Å²	91	76.9 Å²	76.9	59%	0.591	43%	0.431	S	S	*	.			trans	-70	-5.4	174.1	29	-34.4	0	0	0	112.8	T329 S335	T329-P333 VanDerWaalsContact O-CA 3.23Å; T329-P333 WeakPolarHBondContact O-CA 3.49Å; P333-S335 PolarHBondContact O-N 3.41Å
334	F	62.7	Low	68	Low	66 Å²	66	85.9 Å²	85.9	29%	0.289	47%	0.465	S	S	.	.	S	Bend	trans	-75.3	114.5	177.7	-63.4	-77.4	0	0	0	110.3	N311 C332 L336 L345 P347	N311-F334 HydrophobicContact CB-CE2 3.88Å; N311-F334 HydrophobicContact CB-CZ 4.27Å; C332-F334 PolarHBondContact O-N 2.74Å; C332-F334 VanDerWaalsContact O-N 3.15Å; F334-L336 PolarHBondContact O-N 3.46Å; F334-L345 HydrophobicContact CD1-CB 4.36Å; F334-L345 HydrophobicContact CE1-CB 3.81Å; F334-L345 HydrophobicContact CE1-CD2 4.09Å; F334-L345 HydrophobicContact CE1-CG 4.45Å; F334-L345 WeakPolarHBondContact CE1-O 3.47Å; F334-L345 WeakPolarHBondContact CE2-O 3.33Å; F334-L345 HydrophobicContact CZ-CB 4.42Å; F334-L345 WeakPolarHBondContact CZ-O 3.38Å; F334-P347 HydrophobicContact CD2-CG 3.79Å; F334-P347 HydrophobicContact CE2-CG 4.09Å
335	S	53.7	Low	66.9	Low	74 Å²	74	83.1 Å²	83.1	52%	0.517	45%	0.454	S	S	.	.			trans	-57.3	136.9	167.7	-178	0	0	0	0	109.2	P333 L337 A338	P333-S335 PolarHBondContact O-N 3.41Å; S335-L337 PolarHBondContact O-N 2.94Å; S335-L337 PolarHBondContact OG-N 3.07Å; S335-A338 WeakPolarHBondContact O-CB 3.37Å; S335-A338 PolarHBondContact O-N 2.9Å
336	L	52.2	Low	66.4	Low	121 Å²	121	80.3 Å²	80.3	63%	0.634	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-9.8	170.9	-75.4	158	0	0	0	113.6	F334 M369	F334-L336 PolarHBondContact O-N 3.46Å; L336-M369 HydrophobicContact CD2-CB 4.13Å
337	L	53.2	Low	66.3	Low	161 Å²	161	80 Å²	80	84%	0.843	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-2.9	178.8	-61.7	169	0	0	0	114.4	S335	S335-L337 PolarHBondContact O-N 2.94Å; S335-L337 PolarHBondContact OG-N 3.07Å
338	A	56	Low	66.7	Low	38 Å²	38	81.4 Å²	81.4	31%	0.314	43%	0.432	S	S	.	.	S	Bend	trans	-65.9	137.4	175.1	0	0	0	0	0	109.5	S335 L340	S335-A338 WeakPolarHBondContact O-CB 3.37Å; S335-A338 PolarHBondContact O-N 2.9Å; A338-L340 WeakPolarHBondContact O-CG 3.37Å; A338-L340 PolarHBondContact O-N 3.29Å
339	D	55.3	Low	67.4	Low	117 Å²	117	81.2 Å²	81.2	63%	0.626	43%	0.431	S	S	*	.			trans	-55.9	102.7	-175.4	-163.1	-12.8	0	0	0	110.6	T341 D342	D339-T341 PolarHBondContact O-N 3.48Å; D339-T341 WeakPolarHBondContact OD1-CB 3.18Å; D339-T341 WeakPolarHBondContact OD1-CG2 3.14Å; D339-T341 PolarHBondContact OD1-N 3.34Å; D339-T341 PolarHBondContact OD1-OG1 3.36Å; D339-T341 PolarHBondContact OD2-OG1 3.16Å; D339-D342 PolarHBondContact O-N 3.32Å
340	L	57.8	Low	68.2	Low	94 Å²	94	81.3 Å²	81.3	49%	0.492	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	5.9	-175.1	-66	162.9	0	0	0	112.9	A338	A338-L340 WeakPolarHBondContact O-CG 3.37Å; A338-L340 PolarHBondContact O-N 3.29Å
341	T	61.5	Low	69.2	Low	113 Å²	113	79.1 Å²	79.1	69%	0.693	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-16.4	178.4	60.3	0	0	0	0	113	D339 D343	D339-T341 PolarHBondContact O-N 3.48Å; D339-T341 WeakPolarHBondContact OD1-CB 3.18Å; D339-T341 WeakPolarHBondContact OD1-CG2 3.14Å; D339-T341 PolarHBondContact OD1-N 3.34Å; D339-T341 PolarHBondContact OD1-OG1 3.36Å; D339-T341 PolarHBondContact OD2-OG1 3.16Å; T341-D343 PolarHBondContact O-N 3.31Å
342	D	67.2	Low	70	Confident	70 Å²	70	78.4 Å²	78.4	37%	0.374	40%	0.403	S	S	.	.			trans	-91.7	96.4	173	-168.7	-6.3	0	0	0	111.4	D339 R344 L345	D339-D342 PolarHBondContact O-N 3.32Å; D342-R344 PolarHBondContact O-N 2.91Å; D342-R344 WeakPolarHBondContact OD1-CB 3.36Å; D342-R344 WeakPolarHBondContact OD1-CG 3.49Å; D342-R344 PolarHBondContact OD1-N 2.87Å; D342-L345 HydrophobicContact CB-CD1 4.05Å; D342-L345 HydrophobicContact CB-CG 4.16Å; D342-L345 PolarHBondContact O-N 3.06Å
343	D	66.3	Low	71.1	Confident	124 Å²	124	81.5 Å²	81.5	66%	0.663	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-17	175.3	-80	-15.5	0	0	0	114.2	T341	T341-D343 PolarHBondContact O-N 3.31Å
344	R	67.3	Low	72.7	Confident	189 Å²	189	77.2 Å²	77.2	71%	0.713	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.4	177	-58.7	176.3	176.5	-167.3	-0.4	112.7	N311 D342	N311-R344 PolarHBondContact ND2-O 3.32Å; D342-R344 PolarHBondContact O-N 2.91Å; D342-R344 WeakPolarHBondContact OD1-CB 3.36Å; D342-R344 WeakPolarHBondContact OD1-CG 3.49Å; D342-R344 PolarHBondContact OD1-N 2.87Å
345	L	68.3	Low	74.1	Confident	76 Å²	76	75.2 Å²	75.2	40%	0.398	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-18.6	-178.6	-59.6	178.8	0	0	0	111.7	N311 F334 D342 P347	N311-L345 PolarHBondContact ND2-O 3.08Å; N311-L345 VanDerWaalsContact ND2-O 3.15Å; F334-L345 HydrophobicContact CD1-CB 4.36Å; F334-L345 HydrophobicContact CE1-CB 3.81Å; F334-L345 HydrophobicContact CE1-CD2 4.09Å; F334-L345 HydrophobicContact CE1-CG 4.45Å; F334-L345 WeakPolarHBondContact CE1-O 3.47Å; F334-L345 WeakPolarHBondContact CE2-O 3.33Å; F334-L345 HydrophobicContact CZ-CB 4.42Å; F334-L345 WeakPolarHBondContact CZ-O 3.38Å; D342-L345 HydrophobicContact CB-CD1 4.05Å; D342-L345 HydrophobicContact CB-CG 4.16Å; D342-L345 PolarHBondContact O-N 3.06Å; L345-P347 WeakPolarHBondContact O-CD 3.43Å
346	V	76	Confident	76.1	Confident	26 Å²	26	73.8 Å²	73.8	16%	0.158	38%	0.375	C	S	.	.	S	Bend	trans	-68.7	122.7	-178.4	-176	0	0	0	0	111.3	R348	V346-R348 PolarHBondContact O-N 3.27Å
347	P	84.8	Confident	78.1	Confident	10 Å²	10	69.1 Å²	69.1	7%	0.065	35%	0.35	C	S	.	.			trans	-60.6	131.5	173.7	-26.2	38	0	0	0	112.6	N311 F334 L345 F371	N311-P347 WeakPolarHBondContact O-CA 3.21Å; F334-P347 HydrophobicContact CD2-CG 3.79Å; F334-P347 HydrophobicContact CE2-CG 4.09Å; L345-P347 WeakPolarHBondContact O-CD 3.43Å; P347-F371 HydrophobicContact CB-CD1 3.46Å; P347-F371 VanDerWaalsContact CB-CD1 3.46Å; P347-F371 HydrophobicContact CB-CE1 3.53Å; P347-F371 HydrophobicContact CG-CE1 4.49Å
348	R	88.5	Confident	80	Confident	97 Å²	97	66.3 Å²	66.3	37%	0.366	33%	0.333	S	S	.	.			trans	-98.5	5.9	-173.4	-61.8	-168.8	176.9	-168.6	-4.2	114.7	N311 L313 E314 V346 R350	N311-R348 PolarHBondContact O-N 3.07Å; L313-R348 CarbonylContact O-C 3.42Å; L313-R348 VanDerWaalsContact O-C 3.29Å; E314-R348 HydrophobicContact CG-CB 4.47Å; V346-R348 PolarHBondContact O-N 3.27Å; R348-R350 WeakPolarHBondContact O-CG 2.84Å; R348-R350 PolarHBondContact O-N 3.5Å
349	L	90.3	Very high	81.6	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	33%	0.325	C	S	.	.			trans	-61.5	124.1	-177.1	-160.2	72.3	0	0	0	110.5	F309 L313 L316 L352 F371 H373 L374	F309-L349 HydrophobicContact CZ-CD2 4.39Å; L313-L349 HydrophobicContact CD2-CD1 4.22Å; L313-L349 HydrophobicContact CG-CD1 4.28Å; L313-L349 WeakPolarHBondContact O-CA 3.34Å; L313-L349 PolarHBondContact O-N 2.52Å; L313-L349 VanDerWaalsContact O-N 3.07Å; L316-L349 HydrophobicContact CB-CD1 3.87Å; L349-L352 HydrophobicContact CD2-CB 4.1Å; L349-L352 HydrophobicContact CD2-CD2 4.48Å; L349-F371 HydrophobicContact CB-CD1 3.26Å; L349-F371 HydrophobicContact CB-CE1 3.46Å; L349-F371 VanDerWaalsContact CB-CE1 3.46Å; L349-F371 HydrophobicContact CB-CG 3.96Å; L349-F371 HydrophobicContact CB-CZ 4.31Å; L349-F371 HydrophobicContact CD2-CD1 4.09Å; L349-F371 HydrophobicContact CD2-CD2 4.25Å; L349-F371 HydrophobicContact CD2-CE1 3.86Å; L349-F371 HydrophobicContact CD2-CE2 4.05Å; L349-F371 HydrophobicContact CD2-CG 4.27Å; L349-F371 HydrophobicContact CD2-CZ 3.85Å; L349-F371 HydrophobicContact CG-CD1 4.32Å; L349-F371 HydrophobicContact CG-CE1 4.3Å; L349-H373 CarbonylContact O-C 3.44Å; L349-L374 HydrophobicContact CD2-CD1 4.35Å; L349-L374 HydrophobicContact CG-CD1 4.33Å; L349-L374 WeakPolarHBondContact O-CA 3.33Å; L349-L374 PolarHBondContact O-N 3.32Å
350	R	91.1	Very high	82.8	Confident	104 Å²	104	68 Å²	68	39%	0.392	33%	0.33	S	S	.	.			trans	-109	-28.8	-179.4	-69.6	172.8	177	159.8	-1.6	112.5	E314 R348 H373 H375 S376	E314-R350 VanDerWaalsContact CD-NH1 3.32Å; E314-R350 PolarHBondContact O-N 3.07Å; E314-R350 IonicContact OE1-CZ 3.55Å; E314-R350 IonicContact OE1-NH1 3.6Å; E314-R350 PolarHBondContact OE1-NH1 3.25Å; E314-R350 IonicContact OE2-CZ 3.89Å; E314-R350 IonicContact OE2-NH1 2.72Å; E314-R350 PolarHBondContact OE2-NH1 3.37Å; R348-R350 WeakPolarHBondContact O-CG 2.84Å; R348-R350 PolarHBondContact O-N 3.5Å; R350-H373 WeakPolarHBondContact CA-O 3.4Å; R350-H373 HydrophobicContact CG-CB 4.35Å; R350-H375 PolarHBondContact O-N 3.36Å; R350-S376 PolarHBondContact O-N 3.39Å
351	Y	93.1	Very high	83.7	Confident	55 Å²	55	68.5 Å²	68.5	22%	0.216	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	121.9	-175.8	-173.5	-104.5	0	0	0	110.8	E314 L316 H317 R353 V378	E314-Y351 PolarHBondContact O-N 3.36Å; E314-Y351 VanDerWaalsContact O-N 3.16Å; L316-Y351 PolarHBondContact N-O 3.09Å; H317-Y351 AromaticContact CE1-CD1 3.79Å; H317-Y351 AromaticContact CE1-CE1 3.36Å; H317-Y351 WeakPolarHBondContact CE1-CE1 3.45Å; H317-Y351 AromaticContact ND1-CE1 3.75Å; H317-Y351 AromaticContact NE2-CD1 3.82Å; H317-Y351 AromaticContact NE2-CE1 3.88Å; Y351-R353 HydrophobicContact CD1-CB 4.42Å; Y351-R353 HydrophobicContact CE1-CB 3.6Å; Y351-R353 HydrophobicContact CE1-CG 4.24Å; Y351-R353 WeakPolarHBondContact OH-CD 3.5Å; Y351-V378 HydrophobicContact CE2-CG2 4.16Å
352	L	92.1	Very high	84.6	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118	175.1	178.2	57.6	0	0	0	109.8	L316 L349 L354 L374 S376 V377 V378	L316-L352 HydrophobicContact CB-CD1 4.09Å; L316-L352 HydrophobicContact CD2-CD1 3.94Å; L316-L352 HydrophobicContact CG-CD1 4.03Å; L349-L352 HydrophobicContact CD2-CB 4.1Å; L349-L352 HydrophobicContact CD2-CD2 4.48Å; L352-L354 HydrophobicContact CD1-CD1 4.19Å; L352-L354 HydrophobicContact CD1-CD2 4.43Å; L352-L354 HydrophobicContact CD1-CG 4.05Å; L352-L354 HydrophobicContact CD2-CD1 3.79Å; L352-L354 HydrophobicContact CG-CD1 3.83Å; L352-L354 HydrophobicContact CG-CG 4.02Å; L352-L374 HydrophobicContact CB-CD1 4Å; L352-S376 PolarHBondContact N-O 2.68Å; L352-S376 VanDerWaalsContact N-O 3.13Å; L352-V377 HydrophobicContact CB-CG2 4.48Å; L352-V377 HydrophobicContact CG-CG1 4.49Å; L352-V377 VanDerWaalsContact O-CA 3.29Å; L352-V377 WeakPolarHBondContact O-CA 3.5Å; L352-V378 PolarHBondContact O-N 3.42Å; L352-V378 VanDerWaalsContact O-N 3.08Å
353	R	94.8	Very high	85.1	Confident	81 Å²	81	66.7 Å²	66.7	31%	0.306	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.9	-178.6	-161.7	-174.3	171.6	159.8	-1.6	111.2	L316 L318 N319 Y351 D355 V378	L316-R353 PolarHBondContact O-N 3.41Å; L318-R353 CarbonylContact C-O 3.51Å; L318-R353 WeakPolarHBondContact CA-O 3.31Å; L318-R353 PolarHBondContact N-O 2.75Å; N319-R353 HydrophobicContact CB-CG 4.03Å; N319-R353 PolarHBondContact N-O 3.36Å; N319-R353 VanDerWaalsContact N-O 3.12Å; N319-R353 WeakPolarHBondContact OD1-CD 3.03Å; Y351-R353 HydrophobicContact CD1-CB 4.42Å; Y351-R353 HydrophobicContact CE1-CB 3.6Å; Y351-R353 HydrophobicContact CE1-CG 4.24Å; Y351-R353 WeakPolarHBondContact OH-CD 3.5Å; R353-D355 WeakPolarHBondContact CD-OD1 3.46Å; R353-D355 WeakPolarHBondContact CG-OD1 3.25Å; R353-D355 IonicContact CZ-OD1 2.7Å; R353-D355 IonicContact CZ-OD2 3.27Å; R353-D355 IonicContact NE-OD1 3.41Å; R353-D355 PolarHBondContact NE-OD1 3.07Å; R353-D355 IonicContact NE-OD2 3.93Å; R353-D355 IonicContact NH2-OD1 3.68Å; R353-D355 IonicContact NH2-OD2 2.74Å; R353-D355 PolarHBondContact NH2-OD2 2.81Å; R353-V378 HydrophobicContact CG-CB 4.03Å; R353-V378 HydrophobicContact CG-CG2 4.45Å
354	L	93.6	Very high	85.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.314	C	S	.	.			trans	-128.9	6.5	-173.1	-71.4	168	0	0	0	113.6	I306 L318 I323 I326 L352 N357 L359 V378	I306-L354 HydrophobicContact CD1-CD2 4.12Å; L318-L354 HydrophobicContact CB-CD2 3.8Å; L318-L354 HydrophobicContact CD1-CD2 4.2Å; I323-L354 HydrophobicContact CD1-CD2 4.11Å; I326-L354 HydrophobicContact CD1-CD1 3.7Å; L352-L354 HydrophobicContact CD1-CD1 4.19Å; L352-L354 HydrophobicContact CD1-CD2 4.43Å; L352-L354 HydrophobicContact CD1-CG 4.05Å; L352-L354 HydrophobicContact CD2-CD1 3.79Å; L352-L354 HydrophobicContact CG-CD1 3.83Å; L352-L354 HydrophobicContact CG-CG 4.02Å; L354-N357 WeakPolarHBondContact O-CB 3.49Å; L354-N357 PolarHBondContact O-N 3.29Å; L354-N357 PolarHBondContact O-ND2 2.83Å; L354-L359 HydrophobicContact CB-CD1 3.75Å; L354-L359 HydrophobicContact CD1-CD1 3.92Å; L354-L359 HydrophobicContact CD2-CD1 4.35Å; L354-L359 HydrophobicContact CG-CD1 4.23Å; L354-V378 CarbonylContact C-O 3.44Å; L354-V378 WeakPolarHBondContact CA-O 3.33Å; L354-V378 PolarHBondContact N-O 3.47Å
355	D	93.9	Very high	86.3	Confident	25 Å²	25	59.5 Å²	59.5	13%	0.134	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	143.1	-179.7	56.6	-60	0	0	0	113.9	N319 H320 R353 V378 I379	N319-D355 CarbonylContact C-O 3.56Å; N319-D355 WeakPolarHBondContact CA-O 3.21Å; N319-D355 WeakPolarHBondContact CB-O 3.49Å; N319-D355 WeakPolarHBondContact CB-OD1 3.18Å; H320-D355 IonicContact CE1-OD2 3.49Å; H320-D355 PolarHBondContact N-O 3.44Å; H320-D355 PolarHBondContact ND1-O 3.01Å; R353-D355 WeakPolarHBondContact CD-OD1 3.46Å; R353-D355 WeakPolarHBondContact CG-OD1 3.25Å; R353-D355 IonicContact CZ-OD1 2.7Å; R353-D355 IonicContact CZ-OD2 3.27Å; R353-D355 IonicContact NE-OD1 3.41Å; R353-D355 PolarHBondContact NE-OD1 3.07Å; R353-D355 IonicContact NE-OD2 3.93Å; R353-D355 IonicContact NH2-OD1 3.68Å; R353-D355 IonicContact NH2-OD2 2.74Å; R353-D355 PolarHBondContact NH2-OD2 2.81Å; D355-V378 HydrophobicContact CB-CG1 4.1Å; D355-V378 PolarHBondContact N-O 2.95Å; D355-I379 VanDerWaalsContact CA-OXT 3.23Å; D355-I379 WeakPolarHBondContact CA-OXT 3.47Å
356	G	94.4	Very high	86.6	Confident	44 Å²	44	59.1 Å²	59.1	45%	0.454	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	22.1	-178.3	0	0	0	0	0	114.3	H320	H320-G356 WeakPolarHBondContact CA-O 3.4Å
357	N	95.6	Very high	86.7	Confident	23 Å²	23	58 Å²	58	12%	0.123	30%	0.299	C	S	.	.	S	Bend	trans	-96.5	-178	166.2	-78.6	-76.1	0	0	0	111.5	L318 N321 S322 I323 L354 L359	L318-N357 PolarHBondContact O-ND2 3.24Å; N321-N357 VanDerWaalsContact CA-OD1 3.28Å; N321-N357 WeakPolarHBondContact CA-OD1 3.34Å; N321-N357 WeakPolarHBondContact CB-OD1 3.39Å; N321-N357 PolarHBondContact N-OD1 3.19Å; N321-N357 PolarHBondContact O-OD1 3.07Å; S322-N357 PolarHBondContact N-OD1 3.01Å; I323-N357 HydrophobicContact CB-CB 4.19Å; I323-N357 WeakPolarHBondContact CB-OD1 3.36Å; I323-N357 WeakPolarHBondContact CG1-OD1 3.26Å; I323-N357 PolarHBondContact N-OD1 3.09Å; L354-N357 WeakPolarHBondContact O-CB 3.49Å; L354-N357 PolarHBondContact O-N 3.29Å; L354-N357 PolarHBondContact O-ND2 2.83Å; N357-L359 VanDerWaalsContact C-N 3.31Å; N357-L359 HydrophobicContact CB-CD1 4.29Å; N357-L359 HydrophobicContact CB-CG 4.02Å
358	H	93	Very high	86.3	Confident	102 Å²	102	61.3 Å²	61.3	47%	0.472	32%	0.315	S	S	.	.			trans	-98.5	30.5	177.2	-58.8	-48.3	0	0	0	112.5	I323 E324 H360	I323-H358 CarbonylContact O-C 3.29Å; I323-H358 VanDerWaalsContact O-C 3.32Å; I323-H358 WeakPolarHBondContact O-CA 3.46Å; I323-H358 PolarHBondContact O-N 3.16Å; E324-H358 HydrophobicContact CG-CB 4.25Å; H358-H360 PolarHBondContact O-CE1 3.5Å; H358-H360 PolarHBondContact O-ND1 2.89Å
359	L	88.9	Confident	85.6	Confident	29 Å²	29	61.6 Å²	61.6	15%	0.152	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-69.8	132.7	-179.1	-67.1	174	0	0	0	110.5	I323 I326 L354 N357 I379	I323-L359 HydrophobicContact CG2-CD2 3.93Å; I323-L359 PolarHBondContact O-N 2.98Å; I326-L359 HydrophobicContact CD1-CD1 4.16Å; I326-L359 HydrophobicContact CD1-CD2 4.29Å; I326-L359 HydrophobicContact CG1-CD1 4.43Å; I326-L359 HydrophobicContact CG1-CD2 3.75Å; L354-L359 HydrophobicContact CB-CD1 3.75Å; L354-L359 HydrophobicContact CD1-CD1 3.92Å; L354-L359 HydrophobicContact CD2-CD1 4.35Å; L354-L359 HydrophobicContact CG-CD1 4.23Å; N357-L359 VanDerWaalsContact C-N 3.31Å; N357-L359 HydrophobicContact CB-CD1 4.29Å; N357-L359 HydrophobicContact CB-CG 4.02Å; L359-I379 HydrophobicContact CD1-CG2 4.4Å
360	H	81.3	Confident	85	Confident	160 Å²	160	62.2 Å²	62.2	74%	0.741	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-101.1	116.7	171.9	-64.8	65.8	0	0	0	108.1	H358	H358-H360 PolarHBondContact O-CE1 3.5Å; H358-H360 PolarHBondContact O-ND1 2.89Å
361	P	76.2	Confident	84.3	Confident	105 Å²	105	57.4 Å²	57.4	68%	0.682	31%	0.308	S	S	*	.	S	Bend	trans	-59.2	155.3	174.6	-24.1	34.3	0	0	0	112.1
362	P	79.3	Confident	83.3	Confident	116 Å²	116	62.1 Å²	62.1	75%	0.753	33%	0.325	S	S	*	.	P	Polyproline II helix	cis	-86.1	155.6	5.4	33.7	-34.6	0	0	0	113.8
363	I	78.9	Confident	82.6	Confident	29 Å²	29	66.1 Å²	66.1	15%	0.149	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61.6	133.5	164.7	-68.1	-170.9	0	0	0	108.3	I326 M365 V367 I368 V377 I379	I326-I363 HydrophobicContact CD1-CD1 4.24Å; I326-I363 HydrophobicContact CD1-CG1 4.13Å; I326-I363 HydrophobicContact CD1-CG2 4.36Å; I363-M365 PolarHBondContact O-N 2.88Å; I363-V367 HydrophobicContact CG2-CB 4.1Å; I363-V367 HydrophobicContact CG2-CG1 4.23Å; I363-I368 HydrophobicContact CG2-CD1 4.45Å; I363-I368 HydrophobicContact CG2-CG1 4.2Å; I363-V377 HydrophobicContact CD1-CG1 3.63Å; I363-I379 HydrophobicContact CD1-CD1 3.2Å; I363-I379 HydrophobicContact CD1-CG1 3.76Å; I363-I379 HydrophobicContact CG1-CD1 3.57Å; I363-I379 HydrophobicContact CG1-CG1 4.5Å
364	P	81.2	Confident	81.8	Confident	45 Å²	45	63.9 Å²	63.9	29%	0.292	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-53.9	130.3	176.1	-28.1	37	0	0	0	112.5	D366 V367 I368	P364-D366 VanDerWaalsContact C-OD1 3.24Å; P364-D366 WeakPolarHBondContact CB-OD1 3.2Å; P364-D366 PolarHBondContact O-N 3.4Å; P364-V367 HydrophobicContact CB-CG2 4.1Å; P364-V367 WeakPolarHBondContact O-CB 3.45Å; P364-V367 PolarHBondContact O-N 3.27Å; P364-V367 VanDerWaalsContact O-N 3.07Å; P364-I368 PolarHBondContact O-N 1.98Å
365	M	77.6	Confident	81.2	Confident	117 Å²	117	71.3 Å²	71.3	58%	0.576	37%	0.372	S	S	*	.	H	α-helix	trans	-63.8	-28.1	-175.4	-80.6	-62.3	-61.2	0	0	113.4	I363 V367 I368 M369	I363-M365 PolarHBondContact O-N 2.88Å; M365-V367 VanDerWaalsContact C-N 3.31Å; M365-I368 PolarHBondContact O-N 3.46Å; M365-I368 HydrophobicContact SD-CD1 3.84Å; M365-M369 HydrophobicContact CE-CE 4.02Å; M365-M369 WeakPolarHBondContact O-CB 2.87Å; M365-M369 VanDerWaalsContact O-CG 3.26Å; M365-M369 WeakPolarHBondContact O-CG 2.83Å; M365-M369 PolarHBondContact O-N 3.15Å
366	D	74.8	Confident	80.6	Confident	68 Å²	68	72.4 Å²	72.4	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-60.6	-38	172.6	57.8	-27.1	0	0	0	112.1	G328 P364 M369 C370	G328-D366 WeakPolarHBondContact CA-OD2 3.46Å; P364-D366 VanDerWaalsContact C-OD1 3.24Å; P364-D366 WeakPolarHBondContact CB-OD1 3.2Å; P364-D366 PolarHBondContact O-N 3.4Å; D366-M369 PolarHBondContact O-N 2.82Å; D366-C370 WeakPolarHBondContact O-CB 3.34Å; D366-C370 PolarHBondContact O-N 2.87Å
367	V	76.9	Confident	79.9	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.012	38%	0.375	C	S	.	.	H	α-helix	trans	-62.7	-44.9	173.3	177.8	0	0	0	0	110.7	I326 I363 P364 M365 C370 F371	I326-V367 HydrophobicContact CG2-CG1 4.5Å; I326-V367 HydrophobicContact CG2-CG2 3.73Å; I363-V367 HydrophobicContact CG2-CB 4.1Å; I363-V367 HydrophobicContact CG2-CG1 4.23Å; P364-V367 HydrophobicContact CB-CG2 4.1Å; P364-V367 WeakPolarHBondContact O-CB 3.45Å; P364-V367 PolarHBondContact O-N 3.27Å; P364-V367 VanDerWaalsContact O-N 3.07Å; M365-V367 VanDerWaalsContact C-N 3.31Å; V367-C370 WeakPolarHBondContact O-CB 3.23Å; V367-C370 PolarHBondContact O-N 3.15Å; V367-F371 HydrophobicContact CG1-CD2 4.19Å; V367-F371 HydrophobicContact CG1-CE2 4.18Å; V367-F371 VanDerWaalsContact O-CD2 3.31Å; V367-F371 WeakPolarHBondContact O-CD2 3.15Å; V367-F371 PolarHBondContact O-N 2.88Å
368	I	76.6	Confident	79.4	Confident	80 Å²	80	73.9 Å²	73.9	41%	0.41	38%	0.383	S	S	.	.	H	α-helix	trans	-64.2	-43.3	178.8	-63.2	169.7	0	0	0	110.6	I363 P364 M365 C370	I363-I368 HydrophobicContact CG2-CD1 4.45Å; I363-I368 HydrophobicContact CG2-CG1 4.2Å; P364-I368 PolarHBondContact O-N 1.98Å; M365-I368 PolarHBondContact O-N 3.46Å; M365-I368 HydrophobicContact SD-CD1 3.84Å; I368-C370 VanDerWaalsContact C-N 3.33Å; I368-C370 PolarHBondContact O-N 2.96Å
369	M	74.3	Confident	78.7	Confident	104 Å²	104	74.1 Å²	74.1	51%	0.512	39%	0.386	S	S	.	.	H	α-helix	trans	-70.7	-29.2	179.8	-70.9	-66.5	-174.8	0	0	113.1	L336 M365 D366 R372	L336-M369 HydrophobicContact CD2-CB 4.13Å; M365-M369 HydrophobicContact CE-CE 4.02Å; M365-M369 WeakPolarHBondContact O-CB 2.87Å; M365-M369 VanDerWaalsContact O-CG 3.26Å; M365-M369 WeakPolarHBondContact O-CG 2.83Å; M365-M369 PolarHBondContact O-N 3.15Å; D366-M369 PolarHBondContact O-N 2.82Å; M369-R372 WeakPolarHBondContact O-CG 3.42Å
370	C	77.4	Confident	78.2	Confident	13 Å²	13	76.4 Å²	76.4	9%	0.088	40%	0.398	C	S	.	.	H	α-helix	trans	-67.2	-46.7	179.3	-175.7	0	0	0	0	112.6	C332 D366 V367 I368 R372	C332-C370 HydrophobicContact CB-CB 3.47Å; C332-C370 VanDerWaalsContact CB-CB 3.47Å; C332-C370 WeakPolarHBondContact CB-SG 3.29Å; C332-C370 WeakPolarHBondContact SG-CB 3.34Å; C332-C370 CovalentContact SG-SG 1.98Å; C332-C370 PolarHBondContact SG-SG 3.23Å; D366-C370 WeakPolarHBondContact O-CB 3.34Å; D366-C370 PolarHBondContact O-N 2.87Å; V367-C370 WeakPolarHBondContact O-CB 3.23Å; V367-C370 PolarHBondContact O-N 3.15Å; I368-C370 VanDerWaalsContact C-N 3.33Å; I368-C370 PolarHBondContact O-N 2.96Å; C370-R372 PolarHBondContact O-N 3.46Å
371	F	76.3	Confident	78	Confident	4 Å²	4	72 Å²	72	2%	0.018	38%	0.38	C	S	.	.			trans	-95.7	74.3	-178.2	-59.3	-70.8	0	0	0	110.3	F309 I331 P347 L349 V367 H373 L374	F309-F371 HydrophobicContact CE2-CE1 4.4Å; F309-F371 HydrophobicContact CE2-CZ 4.27Å; F309-F371 HydrophobicContact CZ-CZ 4.01Å; I331-F371 HydrophobicContact CG2-CE2 3.43Å; I331-F371 VanDerWaalsContact CG2-CE2 3.43Å; I331-F371 HydrophobicContact CG2-CZ 3.42Å; I331-F371 VanDerWaalsContact CG2-CZ 3.42Å; P347-F371 HydrophobicContact CB-CD1 3.46Å; P347-F371 VanDerWaalsContact CB-CD1 3.46Å; P347-F371 HydrophobicContact CB-CE1 3.53Å; P347-F371 HydrophobicContact CG-CE1 4.49Å; L349-F371 HydrophobicContact CB-CD1 3.26Å; L349-F371 HydrophobicContact CB-CE1 3.46Å; L349-F371 VanDerWaalsContact CB-CE1 3.46Å; L349-F371 HydrophobicContact CB-CG 3.96Å; L349-F371 HydrophobicContact CB-CZ 4.31Å; L349-F371 HydrophobicContact CD2-CD1 4.09Å; L349-F371 HydrophobicContact CD2-CD2 4.25Å; L349-F371 HydrophobicContact CD2-CE1 3.86Å; L349-F371 HydrophobicContact CD2-CE2 4.05Å; L349-F371 HydrophobicContact CD2-CG 4.27Å; L349-F371 HydrophobicContact CD2-CZ 3.85Å; L349-F371 HydrophobicContact CG-CD1 4.32Å; L349-F371 HydrophobicContact CG-CE1 4.3Å; V367-F371 HydrophobicContact CG1-CD2 4.19Å; V367-F371 HydrophobicContact CG1-CE2 4.18Å; V367-F371 VanDerWaalsContact O-CD2 3.31Å; V367-F371 WeakPolarHBondContact O-CD2 3.15Å; V367-F371 PolarHBondContact O-N 2.88Å; F371-H373 PolarHBondContact O-N 2.96Å; F371-H373 VanDerWaalsContact O-N 3.09Å; F371-L374 HydrophobicContact CB-CB 3.7Å; F371-L374 HydrophobicContact CB-CD2 4.05Å; F371-L374 HydrophobicContact CB-CG 4.33Å; F371-L374 WeakPolarHBondContact O-CB 3.21Å; F371-L374 PolarHBondContact O-N 3Å
372	R	73.1	Confident	78.1	Confident	153 Å²	153	70.2 Å²	70.2	58%	0.577	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.3	179.9	-61.8	-179.2	-179.7	-178.4	-0.3	113.9	M369 C370	M369-R372 WeakPolarHBondContact O-CG 3.42Å; C370-R372 PolarHBondContact O-N 3.46Å
373	H	75.9	Confident	78	Confident	88 Å²	88	67.5 Å²	67.5	41%	0.407	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.3	175.3	-61.3	-56.2	0	0	0	113.5	L349 R350 F371 H375	L349-H373 CarbonylContact O-C 3.44Å; R350-H373 WeakPolarHBondContact CA-O 3.4Å; R350-H373 HydrophobicContact CG-CB 4.35Å; F371-H373 PolarHBondContact O-N 2.96Å; F371-H373 VanDerWaalsContact O-N 3.09Å; H373-H375 PolarHBondContact O-CD2 2.88Å; H373-H375 PolarHBondContact O-N 3.45Å; H373-H375 VanDerWaalsContact O-N 3.07Å
374	L	78.2	Confident	78	Confident	34 Å²	34	69.9 Å²	69.9	18%	0.178	35%	0.352	C	S	.	.			trans	-69.2	107.3	-179.1	-164.2	61	0	0	0	109.5	L349 L352 F371 V377	L349-L374 HydrophobicContact CD2-CD1 4.35Å; L349-L374 HydrophobicContact CG-CD1 4.33Å; L349-L374 WeakPolarHBondContact O-CA 3.33Å; L349-L374 PolarHBondContact O-N 3.32Å; L352-L374 HydrophobicContact CB-CD1 4Å; F371-L374 HydrophobicContact CB-CB 3.7Å; F371-L374 HydrophobicContact CB-CD2 4.05Å; F371-L374 HydrophobicContact CB-CG 4.33Å; F371-L374 WeakPolarHBondContact O-CB 3.21Å; F371-L374 PolarHBondContact O-N 3Å; L374-V377 HydrophobicContact CD1-CG2 4.28Å; L374-V377 HydrophobicContact CD2-CG2 3.26Å; L374-V377 HydrophobicContact CG-CG2 3.73Å
375	H	81.3	Confident	77.8	Confident	157 Å²	157	71.5 Å²	71.5	73%	0.727	36%	0.356	S	S	*	.			trans	-85.2	-30.9	179.8	-64.4	169.6	0	0	0	111.7	R350 H373	R350-H375 PolarHBondContact O-N 3.36Å; H373-H375 PolarHBondContact O-CD2 2.88Å; H373-H375 PolarHBondContact O-N 3.45Å; H373-H375 VanDerWaalsContact O-N 3.07Å
376	S	80.8	Confident	77.8	Confident	47 Å²	47	68.3 Å²	68.3	33%	0.329	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	132.7	-176.5	-178.8	0	0	0	0	111.6	R350 L352	R350-S376 PolarHBondContact O-N 3.39Å; L352-S376 PolarHBondContact N-O 2.68Å; L352-S376 VanDerWaalsContact N-O 3.13Å
377	V	81.4	Confident	78	Confident	53 Å²	53	68.3 Å²	68.3	32%	0.321	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.3	162.9	-170.3	0	0	0	0	107.9	L352 I363 L374 I379	L352-V377 HydrophobicContact CB-CG2 4.48Å; L352-V377 HydrophobicContact CG-CG1 4.49Å; L352-V377 VanDerWaalsContact O-CA 3.29Å; L352-V377 WeakPolarHBondContact O-CA 3.5Å; I363-V377 HydrophobicContact CD1-CG1 3.63Å; L374-V377 HydrophobicContact CD1-CG2 4.28Å; L374-V377 HydrophobicContact CD2-CG2 3.26Å; L374-V377 HydrophobicContact CG-CG2 3.73Å; V377-I379 HydrophobicContact CG1-CD1 4.43Å; V377-I379 HydrophobicContact CG1-CG1 3.87Å
378	V	83.3	Confident	78.1	Confident	45 Å²	45	73.8 Å²	73.8	27%	0.273	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.2	175.2	-170.9	0	0	0	0	107.5	Y351 L352 R353 L354 D355	Y351-V378 HydrophobicContact CE2-CG2 4.16Å; L352-V378 PolarHBondContact O-N 3.42Å; L352-V378 VanDerWaalsContact O-N 3.08Å; R353-V378 HydrophobicContact CG-CB 4.03Å; R353-V378 HydrophobicContact CG-CG2 4.45Å; L354-V378 CarbonylContact C-O 3.44Å; L354-V378 WeakPolarHBondContact CA-O 3.33Å; L354-V378 PolarHBondContact N-O 3.47Å; D355-V378 HydrophobicContact CB-CG1 4.1Å; D355-V378 PolarHBondContact N-O 2.95Å
379	I	78.9	Confident	78.2	Confident	108 Å²	108	73.3 Å²	73.3	55%	0.554	36%	0.362	S	S	*	.			trans	-124.1	0	-176.9	-43.4	169.1	0	0	0	109.1	D355 L359 I363 V377	D355-I379 VanDerWaalsContact CA-OXT 3.23Å; D355-I379 WeakPolarHBondContact CA-OXT 3.47Å; L359-I379 HydrophobicContact CD1-CG2 4.4Å; I363-I379 HydrophobicContact CD1-CD1 3.2Å; I363-I379 HydrophobicContact CD1-CG1 3.76Å; I363-I379 HydrophobicContact CG1-CD1 3.57Å; I363-I379 HydrophobicContact CG1-CG1 4.5Å; V377-I379 HydrophobicContact CG1-CD1 4.43Å; V377-I379 HydrophobicContact CG1-CG1 3.87Å

Retrieved 379 of 379 residues in 258.3 ms (Link to these results)

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