A0A096N3C6_PAPAN Loading...

DNA damage-binding protein 2

AlphaFold DB (A0A2K5YMA0), UniProt , Accession A0A096N3C6, Species PAPAN (Papio anubis, Olive baboon), Gene DDB2, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	31.9	Very low	254 Å²	254	175.6 Å²	175.6	100%	1.251	88%	0.876	S	S	*	*				0	139.7	0	-77.2	-175.3	-179.8	0	0	108.8
2	A	31.4	Very low	31.2	Very low	98 Å²	98	172.2 Å²	172.2	81%	0.81	87%	0.872	S	S	*	*			trans	-64.1	173.9	-162	0	0	0	0	0	115.6
3	P	36.9	Very low	30.9	Very low	119 Å²	119	167.1 Å²	167.1	77%	0.773	86%	0.862	S	S	*	*				-133.2	163.7	-70.1	34.8	-17.4	0	0	0	114.1
4	K	34.8	Very low	30.3	Very low	209 Å²	209	167.9 Å²	167.9	91%	0.909	86%	0.86	S	S	*	*			trans	-59.5	139.4	165.4	-73.5	170	172.9	171.9	0	111.7
5	K	31.6	Very low	30.1	Very low	210 Å²	210	165.5 Å²	165.5	91%	0.913	85%	0.848	S	S	*	*			trans	-124.6	122.1	154.2	-87.4	-172.4	174.6	-174.2	0	110.2
6	R	31.4	Very low	29.8	Very low	241 Å²	241	162.7 Å²	162.7	91%	0.909	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-96.8	171.5	165.2	-107.7	-166.6	-175.1	-178.6	2.4	108.6
7	P	35.5	Very low	29.5	Very low	113 Å²	113	161.9 Å²	161.9	73%	0.734	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-92.4	153.6	-137	37.3	-35.8	0	0	0	113.8
8	E	27	Very low	29.3	Very low	200 Å²	200	165.3 Å²	165.3	94%	0.935	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-97.7	117.7	166.3	-77.9	178.5	176.9	0	0	110.4
9	T	28	Very low	29.1	Very low	126 Å²	126	162.7 Å²	162.7	77%	0.773	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-90.2	128.6	157.6	40.5	0	0	0	0	109.1
10	Q	27.4	Very low	29.1	Very low	174 Å²	174	166.8 Å²	166.8	81%	0.813	84%	0.837	S	S	*	*				178.6	126.1	122.5	-97.2	177.6	18.4	0	0	112.4
11	K	27.2	Very low	29.1	Very low	188 Å²	188	164.3 Å²	164.3	82%	0.817	83%	0.826	S	S	*	*			trans	30.5	123.9	140	-64.6	174.5	177.8	176.4	0	117.1
12	T	23.7	Very low	28.8	Very low	134 Å²	134	161.1 Å²	161.1	82%	0.822	81%	0.805	S	S	*	*				-150.3	134.4	75.8	33.2	0	0	0	0	113.6	E14	T12-E14 PolarHBondContact O-N 3.24Å
13	S	27.1	Very low	28.5	Very low	106 Å²	106	166.8 Å²	166.8	74%	0.741	81%	0.806	S	S	*	*			trans	-74.1	102.7	168.9	50.1	0	0	0	0	110.6	I15	S13-I15 PolarHBondContact O-N 3.33Å; S13-I15 VanDerWaalsContact O-N 3.16Å
14	E	23.1	Very low	28.1	Very low	179 Å²	179	163.2 Å²	163.2	84%	0.836	78%	0.783	S	S	*	*			trans	-77.8	96.5	161.4	-83.1	-167.5	157.6	0	0	109.4	T12 V16	T12-E14 PolarHBondContact O-N 3.24Å; E14-V16 VanDerWaalsContact C-N 3.33Å; E14-V16 PolarHBondContact O-N 2.96Å
15	I	26.8	Very low	28.1	Very low	132 Å²	132	163 Å²	163	68%	0.677	78%	0.777	S	S	*	*			trans	-66.3	96.2	163.1	-59.9	168.6	0	0	0	106.4	S13 L17	S13-I15 PolarHBondContact O-N 3.33Å; S13-I15 VanDerWaalsContact O-N 3.16Å; I15-L17 HydrophobicContact CG2-CD2 4.24Å; I15-L17 HydrophobicContact CG2-CG 3.92Å; I15-L17 PolarHBondContact O-N 2.87Å
16	V	24.6	Very low	28.3	Very low	120 Å²	120	156.4 Å²	156.4	73%	0.727	76%	0.758	S	S	*	*			trans	-69.5	87.9	165.1	-179.9	0	0	0	0	107.6	E14 R18	E14-V16 VanDerWaalsContact C-N 3.33Å; E14-V16 PolarHBondContact O-N 2.96Å; V16-R18 VanDerWaalsContact C-N 3.32Å; V16-R18 PolarHBondContact O-N 2.88Å
17	L	25.4	Very low	28.5	Very low	150 Å²	150	148 Å²	148	79%	0.785	73%	0.734	S	S	*	*			trans	-60.9	93.8	167	-79.5	166.3	0	0	0	108.2	I15 P19	I15-L17 HydrophobicContact CG2-CD2 4.24Å; I15-L17 HydrophobicContact CG2-CG 3.92Å; I15-L17 PolarHBondContact O-N 2.87Å; L17-P19 VanDerWaalsContact O-CD 3.31Å; L17-P19 WeakPolarHBondContact O-CD 3.25Å
18	R	26.1	Very low	28.2	Very low	223 Å²	223	152.6 Å²	152.6	84%	0.842	74%	0.737	S	S	*	*			trans	-57	120	165	-72.4	-175.8	177.4	-174.1	-0.9	108.2	V16 R20	V16-R18 VanDerWaalsContact C-N 3.32Å; V16-R18 PolarHBondContact O-N 2.88Å; R18-R20 PolarHBondContact O-N 3.2Å; R18-R20 VanDerWaalsContact O-N 3.07Å
19	P	25.4	Very low	28.8	Very low	115 Å²	115	147.3 Å²	147.3	75%	0.747	71%	0.712	S	S	*	*			trans	-67.1	116	173.6	23.1	-25.7	0	0	0	108.2	L17 N21	L17-P19 VanDerWaalsContact O-CD 3.31Å; L17-P19 WeakPolarHBondContact O-CD 3.25Å; P19-N21 PolarHBondContact O-N 3.33Å
20	R	29.4	Very low	29.4	Very low	244 Å²	244	146.5 Å²	146.5	92%	0.921	70%	0.703	S	S	*	*			trans	-65.6	79.3	167.8	-83.9	-175.6	172.8	-178.3	-1.1	109.1	R18 K22	R18-R20 PolarHBondContact O-N 3.2Å; R18-R20 VanDerWaalsContact O-N 3.07Å; R20-K22 PolarHBondContact O-N 3.37Å; R20-K22 VanDerWaalsContact O-N 3.16Å
21	N	28.6	Very low	30.2	Very low	115 Å²	115	142.8 Å²	142.8	62%	0.615	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	49.5	171.8	-130.6	-2.1	0	0	0	110.4	P19 S24	P19-N21 PolarHBondContact O-N 3.33Å; N21-S24 VanDerWaalsContact CG-OG 3.25Å; N21-S24 WeakPolarHBondContact OD1-CB 3.36Å; N21-S24 PolarHBondContact OD1-OG 3.4Å
22	K	33.4	Very low	30.9	Very low	187 Å²	187	137.2 Å²	137.2	81%	0.813	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-3.1	173.4	-83.1	-168.4	174.9	-171.7	0	113.6	R20	R20-K22 PolarHBondContact O-N 3.37Å; R20-K22 VanDerWaalsContact O-N 3.16Å
23	R	25.7	Very low	31.7	Very low	218 Å²	218	136.8 Å²	136.8	82%	0.823	66%	0.657	S	S	*	*	S	Bend	trans	-100	-4.1	174.4	-77.7	-173.4	173.6	-176.5	-2.4	114.6
24	S	27.3	Very low	32.4	Very low	43 Å²	43	136.1 Å²	136.1	30%	0.301	66%	0.658	S	S	.	*	S	Bend	trans	-105.4	-8	-176.4	59.9	0	0	0	0	115.3	N21 S26	N21-S24 VanDerWaalsContact CG-OG 3.25Å; N21-S24 WeakPolarHBondContact OD1-CB 3.36Å; N21-S24 PolarHBondContact OD1-OG 3.4Å; S24-S26 PolarHBondContact O-N 3.39Å
25	R	34.3	Very low	33.4	Very low	204 Å²	204	136.1 Å²	136.1	77%	0.77	66%	0.655	S	S	*	*	S	Bend	trans	-89.5	39.6	176.2	-87.1	-173.1	174	179.2	-0.7	113.9
26	S	36.9	Very low	34	Very low	73 Å²	73	137 Å²	137	51%	0.51	65%	0.654	S	S	.	*	S	Bend	trans	-170.8	76.3	157.2	55	0	0	0	0	104.9	S24 K381	S24-S26 PolarHBondContact O-N 3.39Å; S26-K381 PolarHBondContact OG-NZ 2.9Å
27	P	34.5	Very low	34.3	Very low	64 Å²	64	138.2 Å²	138.2	42%	0.416	66%	0.655	S	S	.	*	S	Bend		-144.3	107.5	81.4	33.4	-13.1	0	0	0	112.2
28	R	30.8	Very low	34.7	Very low	210 Å²	210	136.3 Å²	136.3	79%	0.792	65%	0.654	S	S	*	*			trans	-136.1	92.9	165.9	-77.7	-171.1	174	-169.1	-4.2	107.6
29	E	38.8	Very low	35	Very low	88 Å²	88	130.2 Å²	130.2	41%	0.411	65%	0.651	S	S	.	*			trans	-72.1	117.7	147.2	-70.5	-176.3	175.3	0	0	104.7	E31 R67	E29-E31 PolarHBondContact O-N 3.35Å; E29-E31 VanDerWaalsContact O-N 3.08Å; E29-R67 PolarHBondContact OE1-N 2.63Å; E29-R67 WeakPolarHBondContact OE2-CD 3.44Å; E29-R67 WeakPolarHBondContact OE2-CG 3.49Å; E29-R67 IonicContact OE2-NE 3.7Å; E29-R67 PolarHBondContact OE2-NE 3.31Å
30	L	40.3	Very low	35.4	Very low	110 Å²	110	134.6 Å²	134.6	58%	0.576	66%	0.658	S	S	*	*			trans	-66.2	105	173.8	-78.6	154	0	0	0	107.8
31	E	45	Very low	35.5	Very low	96 Å²	96	126 Å²	126	45%	0.449	65%	0.646	S	S	.	*			trans	62	149.5	169.9	-64	-54.2	112.1	0	0	118.5	E29 E33	E29-E31 PolarHBondContact O-N 3.35Å; E29-E31 VanDerWaalsContact O-N 3.08Å; E31-E33 VanDerWaalsContact OE1-CG 3.24Å; E31-E33 WeakPolarHBondContact OE1-CG 3.05Å; E31-E33 WeakPolarHBondContact OE2-CB 3.12Å; E31-E33 VanDerWaalsContact OE2-CD 3.27Å; E31-E33 VanDerWaalsContact OE2-CG 3.25Å; E31-E33 WeakPolarHBondContact OE2-CG 3.44Å; E31-E33 PolarHBondContact OE2-N 3.47Å
32	P	41.2	Very low	35.8	Very low	71 Å²	71	126.2 Å²	126.2	46%	0.461	66%	0.656	S	S	.	*			cis	-89.7	136	7.2	34.7	-27.8	0	0	0	112.6	A34	P32-A34 PolarHBondContact O-N 2.91Å
33	E	41.9	Very low	35.7	Very low	124 Å²	124	120.1 Å²	120.1	58%	0.579	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-38.4	-7	178.5	-98.8	146.1	-164.5	0	0	118.4	E31 K35 L37	E31-E33 VanDerWaalsContact OE1-CG 3.24Å; E31-E33 WeakPolarHBondContact OE1-CG 3.05Å; E31-E33 WeakPolarHBondContact OE2-CB 3.12Å; E31-E33 VanDerWaalsContact OE2-CD 3.27Å; E31-E33 VanDerWaalsContact OE2-CG 3.25Å; E31-E33 WeakPolarHBondContact OE2-CG 3.44Å; E31-E33 PolarHBondContact OE2-N 3.47Å; E33-K35 VanDerWaalsContact C-N 3.31Å; E33-K35 PolarHBondContact O-N 2.75Å; E33-K35 VanDerWaalsContact O-N 3.14Å; E33-L37 HydrophobicContact CB-CD1 4.34Å
34	A	41.5	Very low	35.8	Very low	92 Å²	92	115.7 Å²	115.7	76%	0.76	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-73.7	-7.9	-167.2	0	0	0	0	0	116.1	P32	P32-A34 PolarHBondContact O-N 2.91Å
35	K	43	Very low	36.1	Very low	180 Å²	180	118.9 Å²	118.9	78%	0.783	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-119.9	4.5	-174.3	-73.6	-166	174.4	-170.5	0	116.3	E33	E33-K35 VanDerWaalsContact C-N 3.31Å; E33-K35 PolarHBondContact O-N 2.75Å; E33-K35 VanDerWaalsContact O-N 3.14Å
36	K	39	Very low	36.1	Very low	150 Å²	150	120.5 Å²	120.5	65%	0.652	68%	0.675	S	S	*	*			trans	-154.7	35.7	174	-129.4	174.1	-173	174.6	0	115.8	C38	K36-C38 PolarHBondContact O-N 2.79Å; K36-C38 VanDerWaalsContact O-N 3.14Å
37	L	32.1	Very low	36.3	Very low	145 Å²	145	129.5 Å²	129.5	76%	0.759	70%	0.698	S	S	*	*			trans	-81.5	51.6	155.5	-71.3	169.1	0	0	0	110.4	E33	E33-L37 HydrophobicContact CB-CD1 4.34Å
38	C	33.4	Very low	36.2	Very low	111 Å²	111	129.2 Å²	129.2	75%	0.75	71%	0.706	S	S	*	*			trans	-107.3	92.9	154.8	-68.4	0	0	0	0	105.2	K36 K40	K36-C38 PolarHBondContact O-N 2.79Å; K36-C38 VanDerWaalsContact O-N 3.14Å; C38-K40 PolarHBondContact O-N 2.76Å
39	A	32.3	Very low	36.3	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	71%	0.709	S	S	*	*			trans	-46	128.1	157	0	0	0	0	0	106.6	G41	A39-G41 PolarHBondContact O-N 3.17Å
40	K	34.5	Very low	36.1	Very low	206 Å²	206	127.7 Å²	127.7	90%	0.896	73%	0.725	S	S	*	*			trans	-30.4	108.5	-179.3	-79.8	175.8	170.6	178.5	0	110.2	C38 S42	C38-K40 PolarHBondContact O-N 2.76Å; K40-S42 PolarHBondContact O-N 2.98Å
41	G	31.6	Very low	36.2	Very low	65 Å²	65	130.7 Å²	130.7	67%	0.67	74%	0.742	S	S	*	*			trans	-49.2	131	161	0	0	0	0	0	106.7	A39 G43	A39-G41 PolarHBondContact O-N 3.17Å; G41-G43 PolarHBondContact O-N 3.28Å; G41-G43 VanDerWaalsContact O-N 3.12Å
42	S	33.6	Very low	35.5	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	76%	0.755	S	S	*	*			trans	-32.1	118.5	178.6	47.3	0	0	0	0	110.6	K40	K40-S42 PolarHBondContact O-N 2.98Å
43	G	31.1	Very low	35.2	Very low	60 Å²	60	134.3 Å²	134.3	62%	0.619	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-54.5	145.4	178.5	0	0	0	0	0	110.3	G41 S45	G41-G43 PolarHBondContact O-N 3.28Å; G41-G43 VanDerWaalsContact O-N 3.12Å; G43-S45 PolarHBondContact O-N 3.22Å; G43-S45 VanDerWaalsContact O-N 3.17Å
44	P	29.4	Very low	34.3	Very low	124 Å²	124	138.7 Å²	138.7	81%	0.805	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.9	178.5	23.5	-30	0	0	0	108.6
45	S	33.1	Very low	34.1	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	77%	0.774	S	S	*	*	S	Bend	trans	-58	135.4	177.4	36.1	0	0	0	0	110.2	G43	G43-S45 PolarHBondContact O-N 3.22Å; G43-S45 VanDerWaalsContact O-N 3.17Å
46	R	33.4	Very low	33.4	Very low	237 Å²	237	133 Å²	133	89%	0.894	77%	0.772	S	S	*	*			trans	70.4	122.2	166.3	-62.1	-175.5	173.3	-172.9	-1.9	116.6	G48	R46-G48 PolarHBondContact O-N 2.95Å
47	R	42.4	Very low	32.9	Very low	263 Å²	263	130.9 Å²	130.9	99%	0.992	77%	0.767	S	S	*	*	S	Bend	trans	-65.5	115.1	156.3	-71.7	179.3	-178.2	-167	0.4	107.2
48	G	32.1	Very low	32.9	Very low	58 Å²	58	126.2 Å²	126.2	60%	0.598	75%	0.749	S	S	*	*			trans	163.5	99.5	176.6	0	0	0	0	0	109.5	R46	R46-G48 PolarHBondContact O-N 2.95Å
49	D	32.2	Very low	32.7	Very low	158 Å²	158	123.8 Å²	123.8	85%	0.845	74%	0.743	S	S	*	*	S	Bend	trans	68.4	132.5	160.2	-51.9	-33.2	0	0	0	120.1
50	S	35.4	Very low	32.5	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	74%	0.74	S	S	*	*	S	Bend	trans	89	95.9	172.7	-28.8	0	0	0	0	115.9	C52	S50-C52 PolarHBondContact O-N 2.96Å
51	D	42.6	Very low	32.2	Very low	174 Å²	174	122.9 Å²	122.9	93%	0.93	74%	0.736	S	S	*	*			trans	35.3	67.2	154.3	-63.2	-21.8	0	0	0	117.8
52	C	29	Very low	32.4	Very low	108 Å²	108	125.2 Å²	125.2	73%	0.73	73%	0.731	S	S	*	*			trans	-90.8	125.9	163	-80.4	0	0	0	0	110.6	S50 W54	S50-C52 PolarHBondContact O-N 2.96Å; C52-W54 PolarHBondContact O-N 3.03Å
53	L	34.7	Very low	32.4	Very low	134 Å²	134	127.3 Å²	127.3	70%	0.702	73%	0.733	S	S	*	*			trans	-30.6	100.9	177.5	-74.4	158.6	0	0	0	113.4	L57	L53-L57 HydrophobicContact CD2-CB 3.74Å
54	W	24.4	Very low	32.9	Very low	216 Å²	216	127.7 Å²	127.7	82%	0.818	72%	0.724	S	S	*	*			trans	-56.9	149.5	166.6	-98.1	76.4	0	0	0	110	C52 G56 L57	C52-W54 PolarHBondContact O-N 3.03Å; W54-G56 PolarHBondContact O-N 3.26Å; W54-L57 PolarHBondContact O-N 3.11Å
55	A	37	Very low	33.7	Very low	82 Å²	82	127.2 Å²	127.2	68%	0.678	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-10.6	-177.6	0	0	0	0	0	114.7
56	G	29.2	Very low	34.6	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-11.8	172.8	0	0	0	0	0	115.7	W54	W54-G56 PolarHBondContact O-N 3.26Å
57	L	27.4	Very low	35.9	Very low	104 Å²	104	117.3 Å²	117.3	55%	0.545	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.1	17.1	178.3	-84.5	163	0	0	0	113.4	L53 W54 G59 P60	L53-L57 HydrophobicContact CD2-CB 3.74Å; W54-L57 PolarHBondContact O-N 3.11Å; L57-G59 PolarHBondContact O-N 3.01Å; L57-P60 VanDerWaalsContact O-CD 3.25Å; L57-P60 WeakPolarHBondContact O-CD 3.47Å
58	A	31.8	Very low	37.8	Very low	47 Å²	47	108.3 Å²	108.3	39%	0.388	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.3	-3.9	164.5	0	0	0	0	0	112.3	Q61 I62	A58-Q61 PolarHBondContact O-N 2.95Å; A58-I62 HydrophobicContact CB-CD1 3.75Å; A58-I62 HydrophobicContact CB-CG1 4.03Å; A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 WeakPolarHBondContact O-CG1 3.39Å; A58-I62 PolarHBondContact O-N 3.46Å
59	G	30.2	Very low	40.4	Very low	60 Å²	60	107.5 Å²	107.5	62%	0.619	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.2	-38.3	-179.3	0	0	0	0	0	116.8	L57	L57-G59 PolarHBondContact O-N 3.01Å
60	P	27.4	Very low	43.1	Very low	112 Å²	112	105 Å²	105	73%	0.727	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-7	-179.9	-4.2	23.9	0	0	0	114.9	L57	L57-P60 VanDerWaalsContact O-CD 3.25Å; L57-P60 WeakPolarHBondContact O-CD 3.47Å
61	Q	28.2	Very low	45.6	Very low	171 Å²	171	107.1 Å²	107.1	80%	0.799	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	12.3	179	-73.1	-159.6	7.5	0	0	113.8	A58	A58-Q61 PolarHBondContact O-N 2.95Å
62	I	35.8	Very low	47.7	Very low	113 Å²	113	99.5 Å²	99.5	58%	0.579	58%	0.577	S	S	*	*			trans	-82.4	-14.1	-178.9	-80.4	159.1	0	0	0	113.8	A58 P64	A58-I62 HydrophobicContact CB-CD1 3.75Å; A58-I62 HydrophobicContact CB-CG1 4.03Å; A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 WeakPolarHBondContact O-CG1 3.39Å; A58-I62 PolarHBondContact O-N 3.46Å; I62-P64 WeakPolarHBondContact O-CD 3.46Å
63	L	32.8	Very low	50.6	Low	163 Å²	163	97.8 Å²	97.8	85%	0.853	56%	0.561	S	S	*	*	S	Bend	trans	-65.8	105.5	163.5	-71.8	170.8	0	0	0	106.2
64	P	43.5	Very low	53.4	Low	68 Å²	68	96.5 Å²	96.5	44%	0.442	55%	0.551	S	S	.	*			trans	-58	163.2	167.7	-6.7	26.2	0	0	0	106.1	I62 C66	I62-P64 WeakPolarHBondContact O-CD 3.46Å; P64-C66 WeakPolarHBondContact CD-SG 3.43Å; P64-C66 VanDerWaalsContact CG-SG 3.52Å; P64-C66 PolarHBondContact O-N 3.23Å
65	P	45	Very low	56.5	Low	113 Å²	113	88 Å²	88	73%	0.734	52%	0.52	S	S	*	.			trans	-67	69.4	161.8	30.5	-32.5	0	0	0	108	R67	P65-R67 PolarHBondContact O-N 3.49Å; P65-R67 VanDerWaalsContact O-N 3.16Å
66	C	51.3	Low	59.1	Low	73 Å²	73	87.4 Å²	87.4	49%	0.493	50%	0.503	S	S	.	.			trans	-67.5	113.3	178.6	-78	0	0	0	0	106.1	P64 S68	P64-C66 WeakPolarHBondContact CD-SG 3.43Å; P64-C66 VanDerWaalsContact CG-SG 3.52Å; P64-C66 PolarHBondContact O-N 3.23Å; C66-S68 PolarHBondContact O-N 3.45Å
67	R	60.8	Low	62.2	Low	68 Å²	68	92.8 Å²	92.8	26%	0.257	51%	0.506	S	S	.	.			trans	-64.9	131.5	165.9	-64.5	-178.4	-174.8	-167.5	1.8	106.5	E29 P65 I69 T72	E29-R67 PolarHBondContact OE1-N 2.63Å; E29-R67 WeakPolarHBondContact OE2-CD 3.44Å; E29-R67 WeakPolarHBondContact OE2-CG 3.49Å; E29-R67 IonicContact OE2-NE 3.7Å; E29-R67 PolarHBondContact OE2-NE 3.31Å; P65-R67 PolarHBondContact O-N 3.49Å; P65-R67 VanDerWaalsContact O-N 3.16Å; R67-I69 PolarHBondContact O-N 2.89Å; R67-T72 HydrophobicContact CB-CG2 4.28Å
68	S	82.6	Confident	65.3	Low	74 Å²	74	92.2 Å²	92.2	52%	0.517	50%	0.503	S	S	.	.			trans	-47.5	137.8	172.1	168	0	0	0	0	109.9	C66 V70 R71 T72	C66-S68 PolarHBondContact O-N 3.45Å; S68-V70 PolarHBondContact O-N 3.44Å; S68-V70 VanDerWaalsContact O-N 3.15Å; S68-V70 PolarHBondContact OG-N 3.14Å; S68-R71 WeakPolarHBondContact O-CA 3.36Å; S68-R71 VanDerWaalsContact O-CB 3.23Å; S68-R71 WeakPolarHBondContact O-CB 3.32Å; S68-R71 PolarHBondContact O-N 2.95Å; S68-T72 PolarHBondContact O-N 3.2Å
69	I	87.4	Confident	68.2	Low	41 Å²	41	93.2 Å²	93.2	21%	0.21	52%	0.518	C	S	.	.	H	α-helix	trans	-57.2	-30.9	-179.7	-169.2	161	0	0	0	112.5	R67 R71 T72 L73 L90 S93	R67-I69 PolarHBondContact O-N 2.89Å; I69-R71 PolarHBondContact O-N 2.63Å; I69-T72 WeakPolarHBondContact CA-OG1 3.06Å; I69-T72 PolarHBondContact O-N 3.27Å; I69-T72 PolarHBondContact O-OG1 2.65Å; I69-L73 HydrophobicContact CG1-CD1 4.28Å; I69-L73 HydrophobicContact CG1-CG 4.36Å; I69-L73 WeakPolarHBondContact O-CB 3.19Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.41Å; I69-L73 PolarHBondContact O-N 3.03Å; I69-L90 HydrophobicContact CD1-CB 4.32Å; I69-L90 HydrophobicContact CD1-CD2 3.47Å; I69-L90 VanDerWaalsContact CD1-CD2 3.47Å; I69-L90 HydrophobicContact CD1-CG 3.84Å; I69-S93 WeakPolarHBondContact CD1-OG 3.36Å
70	V	89.3	Confident	71	Confident	104 Å²	104	99.2 Å²	99.2	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-60.9	-36.7	175.1	-177.7	0	0	0	0	110.8	S68 H74	S68-V70 PolarHBondContact O-N 3.44Å; S68-V70 VanDerWaalsContact O-N 3.15Å; S68-V70 PolarHBondContact OG-N 3.14Å; V70-H74 WeakPolarHBondContact O-CB 3.5Å; V70-H74 PolarHBondContact O-N 3.15Å
71	R	86.8	Confident	73.8	Confident	153 Å²	153	94.7 Å²	94.7	58%	0.577	49%	0.493	S	S	*	.	H	α-helix	trans	-70.1	-41.3	177.2	-167.4	177.1	-174.2	143	4	111.4	S68 I69 H74 Q75	S68-R71 WeakPolarHBondContact O-CA 3.36Å; S68-R71 VanDerWaalsContact O-CB 3.23Å; S68-R71 WeakPolarHBondContact O-CB 3.32Å; S68-R71 PolarHBondContact O-N 2.95Å; I69-R71 PolarHBondContact O-N 2.63Å; R71-H74 PolarHBondContact O-N 3.43Å; R71-Q75 VanDerWaalsContact O-CG 3.26Å; R71-Q75 WeakPolarHBondContact O-CG 3.37Å; R71-Q75 PolarHBondContact O-N 3.28Å
72	T	87.3	Confident	76.8	Confident	14 Å²	14	89.2 Å²	89.2	9%	0.086	47%	0.474	C	S	.	.	H	α-helix	trans	-67.5	-39.3	178.2	59.2	0	0	0	0	111.2	R67 S68 I69 Q75 H76	R67-T72 HydrophobicContact CB-CG2 4.28Å; S68-T72 PolarHBondContact O-N 3.2Å; I69-T72 WeakPolarHBondContact CA-OG1 3.06Å; I69-T72 PolarHBondContact O-N 3.27Å; I69-T72 PolarHBondContact O-OG1 2.65Å; T72-Q75 PolarHBondContact O-N 2.99Å; T72-H76 WeakPolarHBondContact O-CB 3.18Å; T72-H76 PolarHBondContact O-N 3.16Å
73	L	90.7	Very high	79.4	Confident	72 Å²	72	90.8 Å²	90.8	38%	0.377	47%	0.473	S	S	.	.	H	α-helix	trans	-61.3	-44.5	172.3	-70.1	170.8	0	0	0	112	I69 Q75 H76 K77 V86	I69-L73 HydrophobicContact CG1-CD1 4.28Å; I69-L73 HydrophobicContact CG1-CG 4.36Å; I69-L73 WeakPolarHBondContact O-CB 3.19Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.41Å; I69-L73 PolarHBondContact O-N 3.03Å; L73-Q75 PolarHBondContact O-N 2.63Å; L73-H76 WeakPolarHBondContact O-CB 3.45Å; L73-H76 PolarHBondContact O-N 3.16Å; L73-K77 WeakPolarHBondContact O-CG 3.43Å; L73-K77 PolarHBondContact O-N 2.77Å; L73-V86 HydrophobicContact CD2-CG1 3.67Å
74	H	92.1	Very high	82	Confident	106 Å²	106	86.6 Å²	86.6	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-60.9	-44.7	174.9	-176.2	-97.6	0	0	0	111.7	V70 R71 H76 K77 L78	V70-H74 WeakPolarHBondContact O-CB 3.5Å; V70-H74 PolarHBondContact O-N 3.15Å; R71-H74 PolarHBondContact O-N 3.43Å; H74-H76 VanDerWaalsContact C-N 3.29Å; H74-H76 PolarHBondContact O-N 3.36Å; H74-K77 PolarHBondContact O-N 3.12Å; H74-L78 WeakPolarHBondContact CE1-CD1 2.92Å; H74-L78 VanDerWaalsContact O-CG 3.31Å; H74-L78 WeakPolarHBondContact O-CG 2.98Å; H74-L78 PolarHBondContact O-N 3.23Å
75	Q	89.9	Confident	84.1	Confident	39 Å²	39	84.2 Å²	84.2	18%	0.182	44%	0.44	C	S	.	.	H	α-helix	trans	-63.1	-34.6	175.6	-66.1	-65.5	-36.4	0	0	112.4	R71 T72 L73 L78 G79 R80 A81	R71-Q75 VanDerWaalsContact O-CG 3.26Å; R71-Q75 WeakPolarHBondContact O-CG 3.37Å; R71-Q75 PolarHBondContact O-N 3.28Å; T72-Q75 PolarHBondContact O-N 2.99Å; L73-Q75 PolarHBondContact O-N 2.63Å; Q75-L78 CarbonylContact O-C 3.6Å; Q75-L78 PolarHBondContact O-N 3.33Å; Q75-G79 PolarHBondContact O-N 2.72Å; Q75-R80 HydrophobicContact CB-CB 4.41Å; Q75-R80 PolarHBondContact O-N 2.65Å; Q75-A81 HydrophobicContact CB-CB 3.87Å; Q75-A81 PolarHBondContact O-N 2.83Å
76	H	92.6	Very high	86.3	Confident	69 Å²	69	78.9 Å²	78.9	32%	0.319	41%	0.406	S	S	.	.	H	α-helix	trans	-67.7	-43.8	175.1	-174.4	58.9	0	0	0	112	T72 L73 H74 L78 G79 A81 W83 V86	T72-H76 WeakPolarHBondContact O-CB 3.18Å; T72-H76 PolarHBondContact O-N 3.16Å; L73-H76 WeakPolarHBondContact O-CB 3.45Å; L73-H76 PolarHBondContact O-N 3.16Å; H74-H76 VanDerWaalsContact C-N 3.29Å; H74-H76 PolarHBondContact O-N 3.36Å; H76-L78 PolarHBondContact O-N 2.82Å; H76-G79 PolarHBondContact O-N 3.31Å; H76-A81 HydrophobicContact CB-CB 4.33Å; H76-A81 PolarHBondContact ND1-O 2.84Å; H76-W83 AromaticContact NE2-CE3 3.87Å; H76-V86 HydrophobicContact CB-CG2 3.53Å
77	K	92.6	Very high	88.1	Confident	185 Å²	185	78.6 Å²	78.6	80%	0.804	40%	0.397	S	S	*	.	H	α-helix	trans	-60.2	-32.1	172.9	-70.4	-175.3	72.1	177.1	0	112.5	L73 H74 G79	L73-K77 WeakPolarHBondContact O-CG 3.43Å; L73-K77 PolarHBondContact O-N 2.77Å; H74-K77 PolarHBondContact O-N 3.12Å; K77-G79 PolarHBondContact O-N 3.33Å
78	L	93.7	Very high	89.4	Confident	92 Å²	92	79.5 Å²	79.5	48%	0.482	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	2	173.8	-66.7	178.8	0	0	0	113.9	H74 Q75 H76 R80	H74-L78 WeakPolarHBondContact CE1-CD1 2.92Å; H74-L78 VanDerWaalsContact O-CG 3.31Å; H74-L78 WeakPolarHBondContact O-CG 2.98Å; H74-L78 PolarHBondContact O-N 3.23Å; Q75-L78 CarbonylContact O-C 3.6Å; Q75-L78 PolarHBondContact O-N 3.33Å; H76-L78 PolarHBondContact O-N 2.82Å; L78-R80 HydrophobicContact CB-CG 4.33Å; L78-R80 PolarHBondContact O-N 3.46Å
79	G	91.8	Very high	89.7	Confident	67 Å²	67	77 Å²	77	69%	0.691	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	8.3	-177.4	0	0	0	0	0	115	Q75 H76 K77	Q75-G79 PolarHBondContact O-N 2.72Å; H76-G79 PolarHBondContact O-N 3.31Å; K77-G79 PolarHBondContact O-N 3.33Å
80	R	89.8	Confident	89.9	Confident	187 Å²	187	77.6 Å²	77.6	71%	0.706	39%	0.394	S	S	*	.			trans	-89.4	-16.8	-177.3	-67.1	-176.6	179	-168.3	3.6	114	Q75 L78	Q75-R80 HydrophobicContact CB-CB 4.41Å; Q75-R80 PolarHBondContact O-N 2.65Å; L78-R80 HydrophobicContact CB-CG 4.33Å; L78-R80 PolarHBondContact O-N 3.46Å
81	A	85.9	Confident	90	Very high	16 Å²	16	72.8 Å²	72.8	13%	0.132	36%	0.364	C	S	.	.	S	Bend	trans	-120.6	138.3	178.2	0	0	0	0	0	111.3	Q75 H76	Q75-A81 HydrophobicContact CB-CB 3.87Å; Q75-A81 PolarHBondContact O-N 2.83Å; H76-A81 HydrophobicContact CB-CB 4.33Å; H76-A81 PolarHBondContact ND1-O 2.84Å
82	S	92.3	Very high	90.2	Very high	56 Å²	56	69.8 Å²	69.8	39%	0.392	36%	0.357	S	S	.	.			trans	-79	155.8	177.5	64.8	0	0	0	0	112.1	S85 V86	S82-S85 WeakPolarHBondContact O-CB 3.49Å; S82-S85 PolarHBondContact O-N 2.84Å; S82-S85 VanDerWaalsContact O-N 3.1Å; S82-V86 PolarHBondContact O-N 2.89Å
83	W	89	Confident	90.3	Very high	147 Å²	147	71.4 Å²	71.4	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-55.2	-41.9	178.2	178	-110.6	0	0	0	114.3	H76 S85 V86 Q87	H76-W83 AromaticContact NE2-CE3 3.87Å; W83-S85 PolarHBondContact O-N 2.9Å; W83-V86 HydrophobicContact CE3-CB 4.3Å; W83-V86 HydrophobicContact CE3-CG1 4.43Å; W83-V86 HydrophobicContact CZ3-CG1 4.18Å; W83-V86 PolarHBondContact O-N 3.33Å; W83-V86 VanDerWaalsContact O-N 3.09Å; W83-Q87 PolarHBondContact O-N 2.81Å
84	P	88.1	Confident	90.4	Very high	75 Å²	75	68.9 Å²	68.9	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-32.6	176.5	-26.7	36.3	0	0	0	113.9	Q88	P84-Q88 WeakPolarHBondContact O-CB 3.41Å; P84-Q88 PolarHBondContact O-N 3.21Å
85	S	87.7	Confident	90.4	Very high	18 Å²	18	64.4 Å²	64.4	13%	0.126	33%	0.334	C	S	.	.	H	α-helix	trans	-66.8	-43.2	176	-171.4	0	0	0	0	111.2	S82 W83 Q88 G89	S82-S85 WeakPolarHBondContact O-CB 3.49Å; S82-S85 PolarHBondContact O-N 2.84Å; S82-S85 VanDerWaalsContact O-N 3.1Å; W83-S85 PolarHBondContact O-N 2.9Å; S85-Q88 PolarHBondContact O-N 3.11Å; S85-G89 PolarHBondContact O-N 3.39Å; S85-G89 VanDerWaalsContact O-N 3.08Å
86	V	91.3	Very high	90.3	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-46	175.5	-179.4	0	0	0	0	111.1	L73 H76 S82 W83 Q88 G89 L90	L73-V86 HydrophobicContact CD2-CG1 3.67Å; H76-V86 HydrophobicContact CB-CG2 3.53Å; S82-V86 PolarHBondContact O-N 2.89Å; W83-V86 HydrophobicContact CE3-CB 4.3Å; W83-V86 HydrophobicContact CE3-CG1 4.43Å; W83-V86 HydrophobicContact CZ3-CG1 4.18Å; W83-V86 PolarHBondContact O-N 3.33Å; W83-V86 VanDerWaalsContact O-N 3.09Å; V86-Q88 VanDerWaalsContact C-N 3.33Å; V86-Q88 PolarHBondContact O-N 3.37Å; V86-G89 PolarHBondContact O-N 3.19Å; V86-G89 VanDerWaalsContact O-N 3.15Å; V86-L90 HydrophobicContact CG1-CD1 4Å; V86-L90 HydrophobicContact CG1-CG 4.41Å; V86-L90 WeakPolarHBondContact O-CG 3.43Å; V86-L90 PolarHBondContact O-N 2.6Å
87	Q	89.5	Confident	90.2	Very high	66 Å²	66	68.2 Å²	68.2	31%	0.308	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-40.7	179.3	-171.1	-179.7	5.8	0	0	111.9	W83 L90 Q91 R347	W83-Q87 PolarHBondContact O-N 2.81Å; Q87-L90 PolarHBondContact O-N 3.31Å; Q87-Q91 WeakPolarHBondContact O-CB 3.45Å; Q87-Q91 PolarHBondContact O-N 3.05Å; Q87-R347 PolarHBondContact NE2-O 2.96Å
88	Q	87.9	Confident	90.2	Very high	87 Å²	87	59.4 Å²	59.4	41%	0.407	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-40.2	174.9	-173.4	66	38.9	0	0	111.8	P84 S85 V86 Q91 Q92	P84-Q88 WeakPolarHBondContact O-CB 3.41Å; P84-Q88 PolarHBondContact O-N 3.21Å; S85-Q88 PolarHBondContact O-N 3.11Å; V86-Q88 VanDerWaalsContact C-N 3.33Å; V86-Q88 PolarHBondContact O-N 3.37Å; Q88-Q91 PolarHBondContact O-N 3.24Å; Q88-Q92 PolarHBondContact O-N 3.01Å; Q88-Q92 VanDerWaalsContact O-N 3.08Å
89	G	87.9	Confident	90	Very high	22 Å²	22	61 Å²	61	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-45.7	174	0	0	0	0	0	112.4	S85 V86 Q92 S93	S85-G89 PolarHBondContact O-N 3.39Å; S85-G89 VanDerWaalsContact O-N 3.08Å; V86-G89 PolarHBondContact O-N 3.19Å; V86-G89 VanDerWaalsContact O-N 3.15Å; G89-Q92 PolarHBondContact O-N 3.27Å; G89-S93 PolarHBondContact O-N 2.89Å; G89-S93 PolarHBondContact O-OG 2.78Å
90	L	91.3	Very high	89.9	Confident	53 Å²	53	60.1 Å²	60.1	28%	0.277	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-41.6	175.9	-72.8	167.7	0	0	0	112.1	I69 V86 Q87 Q92 S93 F94 Y348	I69-L90 HydrophobicContact CD1-CB 4.32Å; I69-L90 HydrophobicContact CD1-CD2 3.47Å; I69-L90 VanDerWaalsContact CD1-CD2 3.47Å; I69-L90 HydrophobicContact CD1-CG 3.84Å; V86-L90 HydrophobicContact CG1-CD1 4Å; V86-L90 HydrophobicContact CG1-CG 4.41Å; V86-L90 WeakPolarHBondContact O-CG 3.43Å; V86-L90 PolarHBondContact O-N 2.6Å; Q87-L90 PolarHBondContact O-N 3.31Å; L90-Q92 VanDerWaalsContact C-N 3.29Å; L90-Q92 PolarHBondContact O-N 2.82Å; L90-S93 PolarHBondContact O-N 3.12Å; L90-F94 WeakPolarHBondContact O-CB 3.45Å; L90-F94 PolarHBondContact O-N 2.91Å; L90-Y348 HydrophobicContact CB-CE1 3.83Å
91	Q	92.3	Very high	90.1	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.019	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-41.5	174.4	179.5	176.6	-55	0	0	111.1	Q87 Q88 F94 L95 Y348 N349 L350 D376	Q87-Q91 WeakPolarHBondContact O-CB 3.45Å; Q87-Q91 PolarHBondContact O-N 3.05Å; Q88-Q91 PolarHBondContact O-N 3.24Å; Q91-F94 WeakPolarHBondContact O-CB 3.32Å; Q91-F94 PolarHBondContact O-N 2.93Å; Q91-L95 HydrophobicContact CG-CD1 4.48Å; Q91-L95 VanDerWaalsContact O-CG 3.32Å; Q91-L95 WeakPolarHBondContact O-CG 3.45Å; Q91-L95 PolarHBondContact O-N 2.82Å; Q91-Y348 HydrophobicContact CB-CD1 3.8Å; Q91-Y348 HydrophobicContact CB-CE1 4.41Å; Q91-Y348 HydrophobicContact CB-CG 4.15Å; Q91-Y348 HydrophobicContact CG-CD1 4.45Å; Q91-Y348 HydrophobicContact CG-CG 4.31Å; Q91-N349 VanDerWaalsContact OE1-N 3.15Å; Q91-L350 HydrophobicContact CG-CD1 4.24Å; Q91-L350 HydrophobicContact CG-CD2 4.12Å; Q91-L350 HydrophobicContact CG-CG 4.15Å; Q91-D376 PolarHBondContact NE2-OD1 2.99Å
92	Q	89.8	Confident	90.4	Very high	89 Å²	89	57.5 Å²	57.5	42%	0.416	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-40.2	177.4	-170.5	64.6	22.6	0	0	112.1	Q88 G89 L90 F94 L95 H96	Q88-Q92 PolarHBondContact O-N 3.01Å; Q88-Q92 VanDerWaalsContact O-N 3.08Å; G89-Q92 PolarHBondContact O-N 3.27Å; L90-Q92 VanDerWaalsContact C-N 3.29Å; L90-Q92 PolarHBondContact O-N 2.82Å; Q92-F94 VanDerWaalsContact C-N 3.33Å; Q92-L95 PolarHBondContact O-N 3.17Å; Q92-H96 PolarHBondContact O-N 3.4Å; Q92-H96 VanDerWaalsContact O-N 3.11Å
93	S	90	Very high	90.3	Very high	49 Å²	49	56 Å²	56	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-41.5	172.9	-64.9	0	0	0	0	111.8	I69 G89 L90 L95 H96 T97	I69-S93 WeakPolarHBondContact CD1-OG 3.36Å; G89-S93 PolarHBondContact O-N 2.89Å; G89-S93 PolarHBondContact O-OG 2.78Å; L90-S93 PolarHBondContact O-N 3.12Å; S93-L95 VanDerWaalsContact C-N 3.35Å; S93-L95 PolarHBondContact O-N 3.17Å; S93-H96 WeakPolarHBondContact O-CB 3.2Å; S93-H96 PolarHBondContact O-N 2.92Å; S93-T97 PolarHBondContact O-N 3.38Å; S93-T97 VanDerWaalsContact O-N 3.13Å; S93-T97 PolarHBondContact O-OG1 3.27Å
94	F	93.4	Very high	90.3	Very high	18 Å²	18	53.7 Å²	53.7	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-42.1	174.2	174.5	-102	0	0	0	112.2	L90 Q91 Q92 H96 T97 L98 H345 Y348 L350 F400 G404	L90-F94 WeakPolarHBondContact O-CB 3.45Å; L90-F94 PolarHBondContact O-N 2.91Å; Q91-F94 WeakPolarHBondContact O-CB 3.32Å; Q91-F94 PolarHBondContact O-N 2.93Å; Q92-F94 VanDerWaalsContact C-N 3.33Å; F94-H96 VanDerWaalsContact C-N 3.28Å; F94-H96 PolarHBondContact O-N 2.76Å; F94-T97 CarbonylContact O-C 3.56Å; F94-T97 WeakPolarHBondContact O-CB 3.32Å; F94-T97 PolarHBondContact O-N 2.97Å; F94-T97 VanDerWaalsContact O-N 3.12Å; F94-L98 HydrophobicContact CE1-CD1 4.31Å; F94-L98 HydrophobicContact CE1-CD2 4.32Å; F94-L98 HydrophobicContact CZ-CD1 4.08Å; F94-L98 WeakPolarHBondContact O-CB 3.24Å; F94-L98 PolarHBondContact O-N 3.49Å; F94-H345 AromaticContact CE1-CD2 3.64Å; F94-H345 AromaticContact CE1-NE2 3.49Å; F94-H345 WeakPolarHBondContact CE1-NE2 3.42Å; F94-H345 AromaticContact CE2-NE2 3.89Å; F94-H345 AromaticContact CZ-CD2 3.77Å; F94-H345 AromaticContact CZ-NE2 3.3Å; F94-H345 VanDerWaalsContact CZ-NE2 3.3Å; F94-H345 WeakPolarHBondContact CZ-NE2 3.41Å; F94-Y348 HydrophobicContact CB-CD2 4.14Å; F94-Y348 HydrophobicContact CB-CE2 3.7Å; F94-Y348 AromaticContact CD1-CD2 3.9Å; F94-Y348 HydrophobicContact CD1-CD2 3.9Å; F94-Y348 HydrophobicContact CD1-CE2 4.19Å; F94-Y348 HydrophobicContact CD2-CD2 4.49Å; F94-Y348 HydrophobicContact CD2-CE2 4.05Å; F94-Y348 HydrophobicContact CE1-CD2 4.45Å; F94-Y348 AromaticContact CG-CD2 3.9Å; F94-Y348 HydrophobicContact CG-CD2 3.9Å; F94-Y348 AromaticContact CG-CE2 3.7Å; F94-Y348 HydrophobicContact CG-CE2 3.7Å; F94-L350 HydrophobicContact CD1-CD1 3.65Å; F94-L350 HydrophobicContact CE1-CD1 3.69Å; F94-F400 HydrophobicContact CE1-CZ 4.3Å; F94-F400 AromaticContact CZ-CE1 3.83Å; F94-F400 HydrophobicContact CZ-CE1 3.83Å; F94-F400 AromaticContact CZ-CZ 3.96Å; F94-F400 HydrophobicContact CZ-CZ 3.96Å; F94-G404 WeakPolarHBondContact CE2-O 3.47Å
95	L	91.4	Very high	90.4	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-33.8	175.9	-71.5	170.6	0	0	0	112.9	Q91 Q92 S93 L98 D99 L350 V374 M383	Q91-L95 HydrophobicContact CG-CD1 4.48Å; Q91-L95 VanDerWaalsContact O-CG 3.32Å; Q91-L95 WeakPolarHBondContact O-CG 3.45Å; Q91-L95 PolarHBondContact O-N 2.82Å; Q92-L95 PolarHBondContact O-N 3.17Å; S93-L95 VanDerWaalsContact C-N 3.35Å; S93-L95 PolarHBondContact O-N 3.17Å; L95-L98 HydrophobicContact CD2-CD2 4.14Å; L95-L98 WeakPolarHBondContact O-CB 3.36Å; L95-L98 PolarHBondContact O-N 2.82Å; L95-D99 PolarHBondContact O-N 3.2Å; L95-L350 HydrophobicContact CD1-CD2 4.48Å; L95-L350 HydrophobicContact CD2-CD1 3.92Å; L95-L350 HydrophobicContact CD2-CD2 4.09Å; L95-L350 HydrophobicContact CG-CD1 4.4Å; L95-V374 HydrophobicContact CD2-CG1 4.31Å; L95-M383 HydrophobicContact CD1-CB 3.95Å; L95-M383 HydrophobicContact CD1-CE 3.5Å; L95-M383 VanDerWaalsContact CD1-CE 3.5Å; L95-M383 HydrophobicContact CD1-CG 4.05Å; L95-M383 HydrophobicContact CD2-CB 3.81Å
96	H	89.1	Confident	90.5	Very high	154 Å²	154	56.5 Å²	56.5	71%	0.713	28%	0.284	S	S	*	.	H	α-helix	trans	-65.9	-40.6	173.1	-176.4	-74.3	0	0	0	111.5	Q92 S93 F94 L98	Q92-H96 PolarHBondContact O-N 3.4Å; Q92-H96 VanDerWaalsContact O-N 3.11Å; S93-H96 WeakPolarHBondContact O-CB 3.2Å; S93-H96 PolarHBondContact O-N 2.92Å; F94-H96 VanDerWaalsContact C-N 3.28Å; F94-H96 PolarHBondContact O-N 2.76Å; H96-L98 VanDerWaalsContact C-N 3.31Å
97	T	90.4	Very high	90.3	Very high	35 Å²	35	57.5 Å²	57.5	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-38.9	172.5	-47.7	0	0	0	0	111.3	S93 F94 D99 S100 Y101 Q420	S93-T97 PolarHBondContact O-N 3.38Å; S93-T97 VanDerWaalsContact O-N 3.13Å; S93-T97 PolarHBondContact O-OG1 3.27Å; F94-T97 CarbonylContact O-C 3.56Å; F94-T97 WeakPolarHBondContact O-CB 3.32Å; F94-T97 PolarHBondContact O-N 2.97Å; F94-T97 VanDerWaalsContact O-N 3.12Å; T97-D99 PolarHBondContact O-N 2.81Å; T97-S100 PolarHBondContact O-N 3.05Å; T97-S100 PolarHBondContact O-OG 3.37Å; T97-Y101 HydrophobicContact CG2-CE2 3.94Å; T97-Y101 VanDerWaalsContact O-CD2 3.24Å; T97-Y101 WeakPolarHBondContact O-CD2 3.45Å; T97-Q420 HydrophobicContact CG2-CB 4.17Å; T97-Q420 HydrophobicContact CG2-CG 3.9Å; T97-Q420 VanDerWaalsContact CG2-OE1 3.26Å
98	L	91.9	Very high	90.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-32.8	-176.3	-163.2	67.2	0	0	0	112.7	F94 L95 H96 S100 Y101 V374 C384 L386 F400	F94-L98 HydrophobicContact CE1-CD1 4.31Å; F94-L98 HydrophobicContact CE1-CD2 4.32Å; F94-L98 HydrophobicContact CZ-CD1 4.08Å; F94-L98 WeakPolarHBondContact O-CB 3.24Å; F94-L98 PolarHBondContact O-N 3.49Å; L95-L98 HydrophobicContact CD2-CD2 4.14Å; L95-L98 WeakPolarHBondContact O-CB 3.36Å; L95-L98 PolarHBondContact O-N 2.82Å; H96-L98 VanDerWaalsContact C-N 3.31Å; L98-S100 PolarHBondContact O-N 3.45Å; L98-Y101 VanDerWaalsContact CA-CD2 3.47Å; L98-Y101 HydrophobicContact CD1-CD1 3.91Å; L98-Y101 HydrophobicContact CD1-CD2 4.06Å; L98-Y101 HydrophobicContact CD1-CE1 3.96Å; L98-Y101 HydrophobicContact CD1-CE2 4.06Å; L98-Y101 HydrophobicContact CD1-CG 3.96Å; L98-Y101 WeakPolarHBondContact O-CB 3.35Å; L98-Y101 PolarHBondContact O-N 2.81Å; L98-V374 HydrophobicContact CD2-CB 4.13Å; L98-V374 HydrophobicContact CD2-CG1 4.01Å; L98-V374 HydrophobicContact CD2-CG2 3.65Å; L98-C384 HydrophobicContact CD2-CB 4.09Å; L98-L386 HydrophobicContact CD1-CD1 4.4Å; L98-L386 HydrophobicContact CG-CD2 4.33Å; L98-L386 WeakPolarHBondContact O-CD2 3.26Å; L98-F400 HydrophobicContact CD1-CE1 4.38Å; L98-F400 HydrophobicContact CD1-CZ 4.11Å
99	D	89.4	Confident	90	Very high	124 Å²	124	55 Å²	55	66%	0.663	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.8	176	-157.6	47.4	0	0	0	112.9	L95 T97	L95-D99 PolarHBondContact O-N 3.2Å; T97-D99 PolarHBondContact O-N 2.81Å
100	S	90.5	Very high	90	Very high	50 Å²	50	54.6 Å²	54.6	35%	0.35	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	11.7	174.4	81.1	0	0	0	0	113.5	T97 L98	T97-S100 PolarHBondContact O-N 3.05Å; T97-S100 PolarHBondContact O-OG 3.37Å; L98-S100 PolarHBondContact O-N 3.45Å
101	Y	93.4	Very high	89.8	Confident	13 Å²	13	58.6 Å²	58.6	5%	0.051	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137	177.7	-88.2	-135.7	0	0	0	110.3	T97 L98 D405 W418 Q420	T97-Y101 HydrophobicContact CG2-CE2 3.94Å; T97-Y101 VanDerWaalsContact O-CD2 3.24Å; T97-Y101 WeakPolarHBondContact O-CD2 3.45Å; L98-Y101 VanDerWaalsContact CA-CD2 3.47Å; L98-Y101 HydrophobicContact CD1-CD1 3.91Å; L98-Y101 HydrophobicContact CD1-CD2 4.06Å; L98-Y101 HydrophobicContact CD1-CE1 3.96Å; L98-Y101 HydrophobicContact CD1-CE2 4.06Å; L98-Y101 HydrophobicContact CD1-CG 3.96Å; L98-Y101 WeakPolarHBondContact O-CB 3.35Å; L98-Y101 PolarHBondContact O-N 2.81Å; Y101-D405 VanDerWaalsContact CE1-O 3.26Å; Y101-D405 WeakPolarHBondContact CE1-O 3.46Å; Y101-D405 PolarHBondContact OH-O 2.94Å; Y101-W418 HydrophobicContact CD1-CB 3.98Å; Y101-Q420 HydrophobicContact CD2-CB 4.42Å; Y101-Q420 HydrophobicContact CE2-CB 4.13Å
102	R	91.3	Very high	89.8	Confident	134 Å²	134	62.9 Å²	62.9	51%	0.506	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	163.7	174.6	-61.2	-66.1	-179.3	175.7	-3.6	109	L104 W418 S419	R102-L104 PolarHBondContact O-N 3.22Å; R102-W418 WeakPolarHBondContact O-CA 3.1Å; R102-S419 PolarHBondContact N-O 2.89Å; R102-S419 VanDerWaalsContact N-O 3.16Å; R102-S419 PolarHBondContact O-N 3.01Å; R102-S419 VanDerWaalsContact O-N 3.17Å
103	I	91.4	Very high	90	Very high	25 Å²	25	60.8 Å²	60.8	13%	0.128	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	112.5	174.9	-57.1	179.6	0	0	0	108.4	Q105 K106 D388 S391 L416 W418	I103-Q105 WeakPolarHBondContact CG2-O 3.16Å; I103-K106 HydrophobicContact CG2-CD 4.12Å; I103-K106 VanDerWaalsContact CG2-CE 3.46Å; I103-K106 HydrophobicContact CG2-CG 3.48Å; I103-K106 VanDerWaalsContact CG2-CG 3.48Å; I103-D388 HydrophobicContact CD1-CB 3.41Å; I103-D388 VanDerWaalsContact CD1-CB 3.41Å; I103-D388 WeakPolarHBondContact CD1-OD2 3.41Å; I103-D388 HydrophobicContact CG1-CB 4.02Å; I103-D388 WeakPolarHBondContact CG1-OD2 3.35Å; I103-S391 WeakPolarHBondContact CD1-OG 3.49Å; I103-L416 HydrophobicContact CD1-CD1 4.23Å; I103-L416 HydrophobicContact CD1-CD2 4.35Å; I103-L416 HydrophobicContact CG2-CB 4.41Å; I103-W418 HydrophobicContact CD1-CH2 3.78Å; I103-W418 HydrophobicContact CD1-CZ2 3.71Å; I103-W418 HydrophobicContact CD1-CZ3 4.28Å; I103-W418 HydrophobicContact CG1-CD2 3.77Å; I103-W418 HydrophobicContact CG1-CE3 3.71Å; I103-W418 HydrophobicContact CG1-CH2 3.67Å; I103-W418 HydrophobicContact CG1-CZ2 3.73Å; I103-W418 HydrophobicContact CG1-CZ3 3.66Å
104	L	88.6	Confident	90.3	Very high	98 Å²	98	58.6 Å²	58.6	51%	0.513	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-44.9	178.8	-176.3	70	0	0	0	111	R102 I417	R102-L104 PolarHBondContact O-N 3.22Å; L104-I417 PolarHBondContact N-O 3.47Å
105	Q	89.2	Confident	90.4	Very high	70 Å²	70	58.4 Å²	58.4	33%	0.327	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.9	-179.1	-67.1	-171.9	12.7	0	0	111.5	I103 W139 F141 I417	I103-Q105 WeakPolarHBondContact CG2-O 3.16Å; Q105-W139 HydrophobicContact CB-CH2 3.85Å; Q105-W139 HydrophobicContact CB-CZ2 4.04Å; Q105-W139 VanDerWaalsContact OE1-CZ2 3.23Å; Q105-F141 PolarHBondContact NE2-O 3.16Å; Q105-F141 PolarHBondContact OE1-O 2.94Å; Q105-I417 PolarHBondContact N-O 3.22Å; Q105-I417 PolarHBondContact O-N 3.18Å
106	K	89.8	Confident	90.6	Very high	83 Å²	83	58.1 Å²	58.1	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133	177.5	-59.9	-178.8	-179.4	170.4	0	108.2	I103 D388 E390 L416	I103-K106 HydrophobicContact CG2-CD 4.12Å; I103-K106 VanDerWaalsContact CG2-CE 3.46Å; I103-K106 HydrophobicContact CG2-CG 3.48Å; I103-K106 VanDerWaalsContact CG2-CG 3.48Å; K106-D388 IonicContact NZ-OD1 3.94Å; K106-E390 IonicContact NZ-OE2 3.33Å; K106-E390 PolarHBondContact NZ-OE2 3.14Å; K106-L416 HydrophobicContact CB-CD2 4.21Å; K106-L416 HydrophobicContact CD-CD2 4.16Å; K106-L416 HydrophobicContact CG-CD2 3.71Å
107	A	89	Confident	91	Very high	21 Å²	21	51.9 Å²	51.9	17%	0.174	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139	173.8	0	0	0	0	0	110.2	P109 W139 H414 I415	A107-P109 VanDerWaalsContact C-CD 3.5Å; A107-W139 HydrophobicContact CB-CE3 4.37Å; A107-W139 HydrophobicContact CB-CH2 3.8Å; A107-W139 HydrophobicContact CB-CZ2 3.99Å; A107-W139 HydrophobicContact CB-CZ3 3.99Å; A107-H414 CarbonylContact O-C 3.56Å; A107-H414 WeakPolarHBondContact O-CA 3.34Å; A107-I415 PolarHBondContact N-O 2.84Å; A107-I415 PolarHBondContact O-N 3.06Å
108	A	87.4	Confident	91.2	Very high	60 Å²	60	50.5 Å²	50.5	50%	0.496	26%	0.26	S	S	.	.			trans	-126.1	74.2	169.9	0	0	0	0	0	109.6	H414	A108-H414 WeakPolarHBondContact CB-ND1 3.36Å
109	P	82.4	Confident	91.5	Very high	41 Å²	41	51.4 Å²	51.4	27%	0.266	26%	0.264	S	S	.	.			trans	-81.9	-15.4	-171.4	35.6	-40.1	0	0	0	113.3	A107 M137 I415	A107-P109 VanDerWaalsContact C-CD 3.5Å; P109-M137 HydrophobicContact CB-CE 4.25Å; P109-M137 HydrophobicContact CB-CG 4.49Å; P109-M137 HydrophobicContact CB-SD 3.34Å; P109-M137 WeakPolarHBondContact CB-SD 3.18Å; P109-M137 HydrophobicContact CG-CE 3.62Å; P109-M137 HydrophobicContact CG-SD 3.41Å; P109-M137 WeakPolarHBondContact CG-SD 3.37Å; P109-I415 HydrophobicContact CG-CD1 3.81Å
110	F	87.6	Confident	91.8	Very high	13 Å²	13	46.1 Å²	46.1	6%	0.057	24%	0.235	C	C	.	.			trans	-108.6	143.9	-169.6	-54.5	-58.4	0	0	0	112.1	R112 V129 D135 M137 F149 I415	F110-R112 WeakPolarHBondContact CB-O 3.33Å; F110-R112 PolarHBondContact O-N 3.33Å; F110-V129 HydrophobicContact CE2-CB 3.96Å; F110-V129 HydrophobicContact CE2-CG1 3.64Å; F110-V129 HydrophobicContact CZ-CB 4.08Å; F110-V129 HydrophobicContact CZ-CG1 4.19Å; F110-V129 WeakPolarHBondContact CZ-O 3.29Å; F110-D135 HydrophobicContact CD1-CB 3.77Å; F110-D135 HydrophobicContact CE1-CB 3.9Å; F110-M137 HydrophobicContact CE1-CB 3.73Å; F110-M137 HydrophobicContact CZ-CB 3.53Å; F110-F149 AromaticContact CD1-CE2 3.68Å; F110-F149 HydrophobicContact CD1-CE2 3.68Å; F110-F149 HydrophobicContact CD1-CZ 4.2Å; F110-F149 HydrophobicContact CE1-CD2 4.44Å; F110-F149 AromaticContact CE1-CE2 3.71Å; F110-F149 HydrophobicContact CE1-CE2 3.71Å; F110-F149 HydrophobicContact CE1-CZ 4.48Å; F110-I415 HydrophobicContact CE2-CD1 3.92Å
111	D	87.4	Confident	91.8	Very high	137 Å²	137	46.6 Å²	46.6	73%	0.733	24%	0.237	S	C	*	.	S	Bend	trans	-72	-17.6	167.6	-177.9	49.9	0	0	0	112.3	Y413	D111-Y413 VanDerWaalsContact O-CE1 3.29Å; D111-Y413 WeakPolarHBondContact O-CE1 3.31Å
112	R	92.5	Very high	91.7	Very high	94 Å²	94	50.2 Å²	50.2	36%	0.355	26%	0.261	S	S	.	.	S	Bend	trans	-127	159.9	179.7	-61.9	-171.3	176.2	-147.5	-4.4	111.8	F110 K132	F110-R112 WeakPolarHBondContact CB-O 3.33Å; F110-R112 PolarHBondContact O-N 3.33Å; R112-K132 HydrophobicContact CB-CB 4.11Å
113	R	94.6	Very high	91.7	Very high	46 Å²	46	49 Å²	49	17%	0.174	26%	0.261	C	S	.	.			trans	-56.3	146.9	-179.4	72.5	-179.3	-174.7	-108.8	14	113.4	T115 K132 Q335 H336 G412	R113-T115 HydrophobicContact CG-CG2 4.29Å; R113-K132 HydrophobicContact CG-CB 3.98Å; R113-K132 PolarHBondContact O-N 3.17Å; R113-Q335 PolarHBondContact NH2-O 2.86Å; R113-Q335 VanDerWaalsContact NH2-O 3.14Å; R113-H336 WeakPolarHBondContact CD-O 3.4Å; R113-H336 PolarHBondContact NE-O 2.75Å; R113-H336 PolarHBondContact NH1-O 3.32Å; R113-G412 CarbonylContact C-O 3.47Å; R113-G412 WeakPolarHBondContact CA-O 3.14Å; R113-G412 WeakPolarHBondContact CB-O 3.41Å
114	A	95.8	Very high	91.8	Very high	3 Å²	3	50 Å²	50	3%	0.025	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	134.2	170	0	0	0	0	0	110.8	V129 G130 T338 A410 G412	A114-V129 HydrophobicContact CB-CG1 3.84Å; A114-G130 WeakPolarHBondContact CA-O 3.35Å; A114-T338 PolarHBondContact O-OG1 3.22Å; A114-A410 HydrophobicContact CB-CB 3.7Å; A114-G412 PolarHBondContact N-O 3.21Å
115	T	96.1	Very high	92	Very high	13 Å²	13	47.4 Å²	47.4	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	-23.2	-174.2	47.8	0	0	0	0	113.5	R113 G130 S131 K132 I159	R113-T115 HydrophobicContact CG-CG2 4.29Å; T115-G130 PolarHBondContact N-O 2.84Å; T115-G130 PolarHBondContact OG1-O 3.45Å; T115-S131 PolarHBondContact OG1-O 3.15Å; T115-K132 HydrophobicContact CG2-CB 3.78Å; T115-K132 HydrophobicContact CG2-CD 3.99Å; T115-K132 HydrophobicContact CG2-CG 4.5Å; T115-K132 PolarHBondContact OG1-N 3.24Å; T115-I159 WeakPolarHBondContact CB-O 3.41Å; T115-I159 PolarHBondContact OG1-O 2.53Å
116	S	95.6	Very high	92.2	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.042	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.5	177.1	58	0	0	0	0	110.5	V129 G130 I159	S116-V129 WeakPolarHBondContact O-CA 3.05Å; S116-V129 WeakPolarHBondContact O-CG1 3.42Å; S116-G130 PolarHBondContact N-O 2.75Å; S116-G130 PolarHBondContact O-N 3.25Å; S116-G130 WeakPolarHBondContact OG-CA 3.3Å; S116-G130 PolarHBondContact OG-N 2.84Å; S116-I159 WeakPolarHBondContact OG-CG2 3.46Å
117	L	95.9	Very high	92.5	Very high	23 Å²	23	40.6 Å²	40.6	12%	0.12	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.9	178.8	104.5	87.5	0	0	0	107	L397 E399	L117-L397 HydrophobicContact CB-CD1 4.34Å; L117-L397 HydrophobicContact CD2-CB 3.59Å; L117-L397 HydrophobicContact CD2-CD1 4.5Å; L117-L397 HydrophobicContact CD2-CG 4.47Å; L117-E399 HydrophobicContact CD1-CB 3.65Å; L117-E399 HydrophobicContact CD1-CG 4.43Å; L117-E399 VanDerWaalsContact CD1-OE2 3.26Å; L117-E399 WeakPolarHBondContact CD1-OE2 3.48Å; L117-E399 HydrophobicContact CD2-CB 3.74Å; L117-E399 HydrophobicContact CG-CB 4.11Å; L117-E399 WeakPolarHBondContact CG-OE2 3.34Å
118	A	96.6	Very high	92.9	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	126.7	174.3	0	0	0	0	0	109.2	A128 L162 F164	A118-A128 PolarHBondContact N-O 2.71Å; A118-A128 PolarHBondContact O-N 3.45Å; A118-L162 HydrophobicContact CB-CB 4.35Å; A118-L162 HydrophobicContact CB-CD2 4.11Å; A118-L162 HydrophobicContact CB-CG 4Å; A118-F164 HydrophobicContact CB-CD2 4.06Å; A118-F164 HydrophobicContact CB-CE2 4.13Å
119	W	96.9	Very high	93.3	Very high	19 Å²	19	36.9 Å²	36.9	7%	0.072	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	145.4	170.7	-78.8	102.3	0	0	0	111.5	P124 V127 F141 F164 E399 F400 N401 P402 T406 A408 I417	W119-P124 WeakPolarHBondContact CZ3-O 3.23Å; W119-V127 HydrophobicContact CD2-CB 4.43Å; W119-V127 HydrophobicContact CD2-CG2 4.33Å; W119-V127 HydrophobicContact CE3-CB 4.05Å; W119-V127 HydrophobicContact CE3-CG2 4.44Å; W119-V127 HydrophobicContact CZ3-CB 4.11Å; W119-F141 AromaticContact CH2-CE1 3.73Å; W119-F141 HydrophobicContact CH2-CE1 3.73Å; W119-F141 AromaticContact CH2-CZ 3.97Å; W119-F141 HydrophobicContact CH2-CZ 3.97Å; W119-F141 AromaticContact CZ3-CE1 3.72Å; W119-F141 HydrophobicContact CZ3-CE1 3.72Å; W119-F141 HydrophobicContact CZ3-CZ 4.09Å; W119-F164 WeakPolarHBondContact O-CD2 3.31Å; W119-F164 WeakPolarHBondContact O-CE2 3.48Å; W119-E399 PolarHBondContact NE1-O 2.94Å; W119-F400 VanDerWaalsContact CD1-O 3.28Å; W119-F400 PolarHBondContact NE1-O 2.95Å; W119-N401 HydrophobicContact CD2-CB 3.66Å; W119-N401 HydrophobicContact CE3-CB 3.66Å; W119-N401 HydrophobicContact CG-CB 4.31Å; W119-N401 HydrophobicContact CH2-CB 3.79Å; W119-N401 HydrophobicContact CZ2-CB 3.75Å; W119-N401 HydrophobicContact CZ3-CB 3.74Å; W119-P402 HydrophobicContact CB-CG 4.25Å; W119-T406 HydrophobicContact CH2-CG2 4Å; W119-T406 HydrophobicContact CZ2-CG2 4.48Å; W119-A408 HydrophobicContact CH2-CB 4.06Å; W119-A408 HydrophobicContact CZ2-CB 3.23Å; W119-I417 HydrophobicContact CH2-CD1 4.47Å
120	H	95.9	Very high	94	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.065	19%	0.185	C	C	.	.			trans	-64.7	134	169	-171.9	-71.3	0	0	0	109.4	T122 H123 T126 F164 T169 P402	H120-T122 VanDerWaalsContact C-N 3.35Å; H120-T122 PolarHBondContact CE1-OG1 3.16Å; H120-T122 PolarHBondContact ND1-N 2.6Å; H120-T122 VanDerWaalsContact ND1-N 3.15Å; H120-T122 PolarHBondContact ND1-OG1 3.26Å; H120-T122 PolarHBondContact O-N 2.92Å; H120-H123 HydrophobicContact CB-CB 4.33Å; H120-H123 AromaticContact CE1-CD2 3.23Å; H120-H123 PolarHBondContact CE1-CD2 2.85Å; H120-H123 AromaticContact CE1-CG 3.89Å; H120-H123 AromaticContact ND1-CD2 3.8Å; H120-H123 PolarHBondContact ND1-N 3.26Å; H120-H123 AromaticContact NE2-CD2 3.46Å; H120-H123 PolarHBondContact NE2-CD2 2.85Å; H120-T126 HydrophobicContact CB-CG2 3.96Å; H120-T126 WeakPolarHBondContact CB-O 3.4Å; H120-T126 PolarHBondContact N-O 3.02Å; H120-F164 HydrophobicContact CB-CE1 4.5Å; H120-F164 HydrophobicContact CB-CE2 4.31Å; H120-F164 HydrophobicContact CB-CZ 4.09Å; H120-F164 AromaticContact CD2-CE1 3.8Å; H120-T169 VanDerWaalsContact CD2-CG2 3.42Å; H120-T169 WeakPolarHBondContact CD2-CG2 3.46Å; H120-T169 WeakPolarHBondContact CE1-CG2 3.34Å; H120-T169 WeakPolarHBondContact NE2-CB 3.36Å; H120-T169 WeakPolarHBondContact NE2-CG2 3.46Å; H120-P402 WeakPolarHBondContact O-CG 3.48Å
121	P	91.6	Very high	94.4	Very high	60 Å²	60	34.3 Å²	34.3	39%	0.39	18%	0.182	S	C	.	.	S	Bend	trans	-63.9	-33.9	-173.4	22.5	-34.6	0	0	0	114	T169	P121-T169 VanDerWaalsContact CD-CG2 3.44Å; P121-T169 HydrophobicContact CG-CG2 3.5Å
122	T	90.2	Very high	94.8	Very high	89 Å²	89	30.3 Å²	30.3	55%	0.546	16%	0.159	S	C	.	.	S	Bend	trans	-110.3	-47.4	-178	63.7	0	0	0	0	114.7	H120 P124	H120-T122 VanDerWaalsContact C-N 3.35Å; H120-T122 PolarHBondContact CE1-OG1 3.16Å; H120-T122 PolarHBondContact ND1-N 2.6Å; H120-T122 VanDerWaalsContact ND1-N 3.15Å; H120-T122 PolarHBondContact ND1-OG1 3.26Å; H120-T122 PolarHBondContact O-N 2.92Å; T122-P124 VanDerWaalsContact O-CD 3.27Å; T122-P124 WeakPolarHBondContact O-CD 3.42Å
123	H	92.3	Very high	94.9	Very high	109 Å²	109	25.9 Å²	25.9	51%	0.505	14%	0.142	S	C	.	.			trans	-71.7	114.5	178	-70.2	-64.5	0	0	0	113	H120 S125 T126	H120-H123 HydrophobicContact CB-CB 4.33Å; H120-H123 AromaticContact CE1-CD2 3.23Å; H120-H123 PolarHBondContact CE1-CD2 2.85Å; H120-H123 AromaticContact CE1-CG 3.89Å; H120-H123 AromaticContact ND1-CD2 3.8Å; H120-H123 PolarHBondContact ND1-N 3.26Å; H120-H123 AromaticContact NE2-CD2 3.46Å; H120-H123 PolarHBondContact NE2-CD2 2.85Å; H123-S125 VanDerWaalsContact C-N 3.28Å; H123-S125 PolarHBondContact O-N 3.32Å; H123-T126 PolarHBondContact O-N 3Å
124	P	92.1	Very high	94.8	Very high	45 Å²	45	23.8 Å²	23.8	29%	0.292	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.6	-175.7	-20.7	34.1	0	0	0	114.2	W119 T122 N401 M403	W119-P124 WeakPolarHBondContact CZ3-O 3.23Å; T122-P124 VanDerWaalsContact O-CD 3.27Å; T122-P124 WeakPolarHBondContact O-CD 3.42Å; P124-N401 PolarHBondContact O-ND2 3.15Å; P124-M403 HydrophobicContact CB-CG 4Å; P124-M403 HydrophobicContact CG-CE 4.17Å; P124-M403 HydrophobicContact CG-CG 3.77Å
125	S	92.4	Very high	94.8	Very high	43 Å²	43	24.3 Å²	24.3	30%	0.301	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	7	-175.3	-46.8	0	0	0	0	114.1	H123 N140 F141	H123-S125 VanDerWaalsContact C-N 3.28Å; H123-S125 PolarHBondContact O-N 3.32Å; S125-N140 VanDerWaalsContact O-CA 3.31Å; S125-N140 WeakPolarHBondContact O-CA 3.38Å; S125-N140 PolarHBondContact O-OD1 3.25Å; S125-F141 VanDerWaalsContact C-CE1 3.41Å; S125-F141 WeakPolarHBondContact O-CD1 3.24Å; S125-F141 WeakPolarHBondContact O-CE1 3.43Å; S125-F141 PolarHBondContact O-N 3.24Å; S125-F141 VanDerWaalsContact O-N 3.12Å
126	T	95.1	Very high	94.8	Very high	11 Å²	11	23.8 Å²	23.8	7%	0.067	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.2	-174.8	-57.4	0	0	0	0	111.2	H120 H123 L138 W139	H120-T126 HydrophobicContact CB-CG2 3.96Å; H120-T126 WeakPolarHBondContact CB-O 3.4Å; H120-T126 PolarHBondContact N-O 3.02Å; H123-T126 PolarHBondContact O-N 3Å; T126-L138 HydrophobicContact CG2-CD1 3.59Å; T126-L138 HydrophobicContact CG2-CG 4.1Å; T126-W139 WeakPolarHBondContact CA-O 3.42Å
127	V	95.6	Very high	94.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.5	178	65.8	0	0	0	0	110.1	W119 V129 W139 A408 I417	W119-V127 HydrophobicContact CD2-CB 4.43Å; W119-V127 HydrophobicContact CD2-CG2 4.33Å; W119-V127 HydrophobicContact CE3-CB 4.05Å; W119-V127 HydrophobicContact CE3-CG2 4.44Å; W119-V127 HydrophobicContact CZ3-CB 4.11Å; V127-V129 HydrophobicContact CG2-CG2 4.11Å; V127-W139 HydrophobicContact CG1-CB 4.35Å; V127-W139 HydrophobicContact CG1-CE3 3.99Å; V127-W139 PolarHBondContact N-O 3.13Å; V127-W139 PolarHBondContact O-N 3.16Å; V127-A408 HydrophobicContact CG2-CB 4.38Å; V127-I417 HydrophobicContact CG1-CD1 4.39Å
128	A	96.3	Very high	94.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.9	169.8	0	0	0	0	0	109.7	A118 M137 L138 L162 F164 F186	A118-A128 PolarHBondContact N-O 2.71Å; A118-A128 PolarHBondContact O-N 3.45Å; A128-M137 CarbonylContact C-O 3.52Å; A128-M137 VanDerWaalsContact CA-O 3.29Å; A128-M137 WeakPolarHBondContact CA-O 3.33Å; A128-L138 HydrophobicContact CB-CD1 4.03Å; A128-L162 HydrophobicContact CB-CD2 3.82Å; A128-F164 HydrophobicContact CB-CE2 3.61Å; A128-F164 HydrophobicContact CB-CZ 3.59Å; A128-F186 HydrophobicContact CB-CE1 4.29Å; A128-F186 HydrophobicContact CB-CZ 4.29Å
129	V	96.8	Very high	94.6	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.012	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.8	179.6	-172.4	0	0	0	0	109.2	F110 A114 S116 V127 I136 M137 I415	F110-V129 HydrophobicContact CE2-CB 3.96Å; F110-V129 HydrophobicContact CE2-CG1 3.64Å; F110-V129 HydrophobicContact CZ-CB 4.08Å; F110-V129 HydrophobicContact CZ-CG1 4.19Å; F110-V129 WeakPolarHBondContact CZ-O 3.29Å; A114-V129 HydrophobicContact CB-CG1 3.84Å; S116-V129 WeakPolarHBondContact O-CA 3.05Å; S116-V129 WeakPolarHBondContact O-CG1 3.42Å; V127-V129 HydrophobicContact CG2-CG2 4.11Å; V129-I136 WeakPolarHBondContact O-CA 3.21Å; V129-M137 PolarHBondContact N-O 3.22Å; V129-M137 PolarHBondContact O-N 3.33Å; V129-I415 HydrophobicContact CB-CD1 3.78Å; V129-I415 HydrophobicContact CB-CG1 4.42Å; V129-I415 HydrophobicContact CG1-CD1 3.92Å; V129-I415 HydrophobicContact CG1-CG1 4.12Å; V129-I415 HydrophobicContact CG2-CD1 3.63Å; V129-I415 HydrophobicContact CG2-CG1 4.08Å; V129-I415 HydrophobicContact CG2-CG2 4.28Å
130	G	96.4	Very high	94.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.7	176.5	0	0	0	0	0	111.9	A114 T115 S116 D135	A114-G130 WeakPolarHBondContact CA-O 3.35Å; T115-G130 PolarHBondContact N-O 2.84Å; T115-G130 PolarHBondContact OG1-O 3.45Å; S116-G130 PolarHBondContact N-O 2.75Å; S116-G130 PolarHBondContact O-N 3.25Å; S116-G130 WeakPolarHBondContact OG-CA 3.3Å; S116-G130 PolarHBondContact OG-N 2.84Å; G130-D135 CarbonylContact C-O 3.56Å; G130-D135 WeakPolarHBondContact CA-O 3.32Å
131	S	96.4	Very high	94.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	162.6	-178	93.1	0	0	0	0	112.7	T115 G133 G134 D135 I159	T115-S131 PolarHBondContact OG1-O 3.15Å; S131-G133 PolarHBondContact O-N 3Å; S131-G133 WeakPolarHBondContact OG-CA 3.48Å; S131-G133 PolarHBondContact OG-N 3.09Å; S131-G134 PolarHBondContact O-N 2.86Å; S131-G134 PolarHBondContact OG-N 3.36Å; S131-D135 PolarHBondContact N-O 3.3Å; S131-D135 WeakPolarHBondContact OG-CB 3.36Å; S131-D135 PolarHBondContact OG-N 3.38Å; S131-D135 VanDerWaalsContact OG-N 3.07Å; S131-D135 PolarHBondContact OG-OD2 3.3Å; S131-I159 PolarHBondContact O-N 3.14Å; S131-I159 VanDerWaalsContact O-N 3.17Å
132	K	96	Very high	93.7	Very high	54 Å²	54	26 Å²	26	24%	0.235	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.1	168.7	-173.4	69.6	-158.6	166.1	0	112.6	R112 R113 T115 S158	R112-K132 HydrophobicContact CB-CB 4.11Å; R113-K132 HydrophobicContact CG-CB 3.98Å; R113-K132 PolarHBondContact O-N 3.17Å; T115-K132 HydrophobicContact CG2-CB 3.78Å; T115-K132 HydrophobicContact CG2-CD 3.99Å; T115-K132 HydrophobicContact CG2-CG 4.5Å; T115-K132 PolarHBondContact OG1-N 3.24Å; K132-S158 WeakPolarHBondContact CD-OG 3.41Å; K132-S158 PolarHBondContact NZ-OG 2.97Å; K132-S158 WeakPolarHBondContact O-CA 3.43Å; K132-S158 WeakPolarHBondContact O-CB 3.4Å; K132-S158 PolarHBondContact O-N 2.84Å
133	G	93.8	Very high	93.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-9	178.7	0	0	0	0	0	115.1	S131 G154	S131-G133 PolarHBondContact O-N 3Å; S131-G133 WeakPolarHBondContact OG-CA 3.48Å; S131-G133 PolarHBondContact OG-N 3.09Å; G133-G154 CarbonylContact C-O 3.27Å; G133-G154 VanDerWaalsContact CA-O 3.31Å; G133-G154 WeakPolarHBondContact CA-O 3.17Å; G133-G154 WeakPolarHBondContact O-CA 3.39Å; G133-G154 PolarHBondContact O-N 3.36Å
134	G	94.2	Very high	92.8	Very high	2 Å²	2	32 Å²	32	2%	0.021	18%	0.175	C	C	.	.	S	Bend	trans	91.8	3.8	-171.1	0	0	0	0	0	113.7	S131 G152 G157	S131-G134 PolarHBondContact O-N 2.86Å; S131-G134 PolarHBondContact OG-N 3.36Å; G134-G152 VanDerWaalsContact C-CA 3.47Å; G134-G152 WeakPolarHBondContact O-CA 3.3Å; G134-G157 WeakPolarHBondContact CA-O 3.36Å; G134-G157 PolarHBondContact N-O 2.86Å
135	D	95.6	Very high	92.4	Very high	15 Å²	15	35.7 Å²	35.7	8%	0.08	19%	0.193	C	C	.	.			trans	-77.3	143.7	177.4	-42.8	-59.5	0	0	0	110	F110 G130 S131 F149 I150 G152 I159	F110-D135 HydrophobicContact CD1-CB 3.77Å; F110-D135 HydrophobicContact CE1-CB 3.9Å; G130-D135 CarbonylContact C-O 3.56Å; G130-D135 WeakPolarHBondContact CA-O 3.32Å; S131-D135 PolarHBondContact N-O 3.3Å; S131-D135 WeakPolarHBondContact OG-CB 3.36Å; S131-D135 PolarHBondContact OG-N 3.38Å; S131-D135 VanDerWaalsContact OG-N 3.07Å; S131-D135 PolarHBondContact OG-OD2 3.3Å; D135-F149 HydrophobicContact CB-CE1 4.32Å; D135-F149 HydrophobicContact CB-CE2 4.18Å; D135-F149 HydrophobicContact CB-CZ 3.66Å; D135-I150 CarbonylContact C-O 3.58Å; D135-I150 VanDerWaalsContact CA-O 3.23Å; D135-I150 WeakPolarHBondContact CA-O 3.45Å; D135-G152 PolarHBondContact OD1-N 3.48Å; D135-I159 WeakPolarHBondContact O-CD1 3.3Å
136	I	95.8	Very high	91.9	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.4	175.5	-60.4	178.3	0	0	0	107.8	V129 I150 I159 L162 F172 A174 F186	V129-I136 WeakPolarHBondContact O-CA 3.21Å; I136-I150 HydrophobicContact CB-CB 4.36Å; I136-I150 PolarHBondContact N-O 2.95Å; I136-I150 PolarHBondContact O-N 3.14Å; I136-I159 HydrophobicContact CD1-CD1 3.55Å; I136-I159 HydrophobicContact CG1-CD1 3.14Å; I136-L162 HydrophobicContact CD1-CD1 4.39Å; I136-F172 HydrophobicContact CD1-CD2 4Å; I136-F172 HydrophobicContact CD1-CE1 4.42Å; I136-F172 HydrophobicContact CD1-CE2 3.07Å; I136-F172 HydrophobicContact CD1-CZ 3.32Å; I136-F172 HydrophobicContact CG1-CE2 4.48Å; I136-F172 HydrophobicContact CG2-CZ 4.36Å; I136-A174 HydrophobicContact CD1-CB 4.37Å; I136-F186 HydrophobicContact CG2-CE1 4.28Å
137	M	95.1	Very high	91.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.9	172	-175.1	-169.9	61	0	0	109.2	P109 F110 A128 V129 W139 P147 T148 F149 I415	P109-M137 HydrophobicContact CB-CE 4.25Å; P109-M137 HydrophobicContact CB-CG 4.49Å; P109-M137 HydrophobicContact CB-SD 3.34Å; P109-M137 WeakPolarHBondContact CB-SD 3.18Å; P109-M137 HydrophobicContact CG-CE 3.62Å; P109-M137 HydrophobicContact CG-SD 3.41Å; P109-M137 WeakPolarHBondContact CG-SD 3.37Å; F110-M137 HydrophobicContact CE1-CB 3.73Å; F110-M137 HydrophobicContact CZ-CB 3.53Å; A128-M137 CarbonylContact C-O 3.52Å; A128-M137 VanDerWaalsContact CA-O 3.29Å; A128-M137 WeakPolarHBondContact CA-O 3.33Å; V129-M137 PolarHBondContact N-O 3.22Å; V129-M137 PolarHBondContact O-N 3.33Å; M137-W139 HydrophobicContact CE-CB 3.57Å; M137-W139 HydrophobicContact CE-CD2 4.37Å; M137-W139 HydrophobicContact CE-CE3 4.31Å; M137-W139 HydrophobicContact CE-CG 4.12Å; M137-W139 HydrophobicContact CG-CB 4.35Å; M137-W139 HydrophobicContact SD-CB 4.07Å; M137-P147 HydrophobicContact CG-CB 3.68Å; M137-P147 HydrophobicContact CG-CG 4.13Å; M137-P147 HydrophobicContact SD-CB 3.81Å; M137-P147 HydrophobicContact SD-CG 3.8Å; M137-T148 WeakPolarHBondContact CA-O 3.49Å; M137-F149 HydrophobicContact CB-CD2 4.21Å; M137-F149 HydrophobicContact CG-CD2 4.47Å; M137-I415 HydrophobicContact CE-CD1 3.17Å
138	L	95.1	Very high	91.4	Very high	32 Å²	32	47.8 Å²	47.8	17%	0.168	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.2	164	-174.5	69.7	0	0	0	108.2	T126 A128 P147 T148 F164 F186	T126-L138 HydrophobicContact CG2-CD1 3.59Å; T126-L138 HydrophobicContact CG2-CG 4.1Å; A128-L138 HydrophobicContact CB-CD1 4.03Å; L138-P147 WeakPolarHBondContact O-CA 3.26Å; L138-P147 WeakPolarHBondContact O-CB 3.1Å; L138-T148 PolarHBondContact N-O 2.86Å; L138-T148 PolarHBondContact O-N 3.39Å; L138-T148 VanDerWaalsContact O-N 3.08Å; L138-F164 HydrophobicContact CD1-CE1 4.06Å; L138-F164 HydrophobicContact CD1-CZ 3.68Å; L138-F186 HydrophobicContact CB-CD1 3.81Å; L138-F186 HydrophobicContact CB-CE1 3.92Å; L138-F186 HydrophobicContact CB-CG 4.44Å; L138-F186 HydrophobicContact CD1-CD1 4.41Å; L138-F186 HydrophobicContact CD1-CE1 3.89Å; L138-F186 HydrophobicContact CD1-CE2 4.25Å; L138-F186 HydrophobicContact CD1-CZ 3.81Å; L138-F186 HydrophobicContact CD2-CB 4.34Å; L138-F186 HydrophobicContact CD2-CD1 4Å; L138-F186 HydrophobicContact CD2-CD2 3.89Å; L138-F186 HydrophobicContact CD2-CE1 4.29Å; L138-F186 HydrophobicContact CD2-CE2 4.23Å; L138-F186 HydrophobicContact CD2-CG 3.81Å; L138-F186 HydrophobicContact CD2-CZ 4.41Å; L138-F186 HydrophobicContact CG-CD1 4.3Å; L138-F186 HydrophobicContact CG-CE1 4.26Å
139	W	94	Very high	91.2	Very high	20 Å²	20	52.1 Å²	52.1	8%	0.076	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	122	-174.6	-178.3	38.3	0	0	0	111	Q105 A107 T126 V127 M137 F141 P147 I415 I417	Q105-W139 HydrophobicContact CB-CH2 3.85Å; Q105-W139 HydrophobicContact CB-CZ2 4.04Å; Q105-W139 VanDerWaalsContact OE1-CZ2 3.23Å; A107-W139 HydrophobicContact CB-CE3 4.37Å; A107-W139 HydrophobicContact CB-CH2 3.8Å; A107-W139 HydrophobicContact CB-CZ2 3.99Å; A107-W139 HydrophobicContact CB-CZ3 3.99Å; T126-W139 WeakPolarHBondContact CA-O 3.42Å; V127-W139 HydrophobicContact CG1-CB 4.35Å; V127-W139 HydrophobicContact CG1-CE3 3.99Å; V127-W139 PolarHBondContact N-O 3.13Å; V127-W139 PolarHBondContact O-N 3.16Å; M137-W139 HydrophobicContact CE-CB 3.57Å; M137-W139 HydrophobicContact CE-CD2 4.37Å; M137-W139 HydrophobicContact CE-CE3 4.31Å; M137-W139 HydrophobicContact CE-CG 4.12Å; M137-W139 HydrophobicContact CG-CB 4.35Å; M137-W139 HydrophobicContact SD-CB 4.07Å; W139-F141 HydrophobicContact CD2-CB 4.31Å; W139-F141 HydrophobicContact CH2-CB 4.23Å; W139-F141 HydrophobicContact CZ2-CB 3.79Å; W139-P147 HydrophobicContact CB-CB 4.17Å; W139-P147 HydrophobicContact CG-CB 4.44Å; W139-I415 HydrophobicContact CE3-CG2 4.17Å; W139-I415 HydrophobicContact CZ3-CB 4.35Å; W139-I415 HydrophobicContact CZ3-CG2 3.88Å; W139-I417 HydrophobicContact CE3-CD1 4.43Å; W139-I417 HydrophobicContact CE3-CG1 4.32Å; W139-I417 HydrophobicContact CH2-CG1 3.69Å; W139-I417 HydrophobicContact CZ3-CD1 3.86Å; W139-I417 HydrophobicContact CZ3-CG1 3.42Å; W139-I417 VanDerWaalsContact CZ3-CG1 3.42Å
140	N	92.6	Very high	91.1	Very high	49 Å²	49	53.2 Å²	53.2	26%	0.262	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	107.3	166.5	-174.3	-17.1	0	0	0	108.4	S125 G142 I143	S125-N140 VanDerWaalsContact O-CA 3.31Å; S125-N140 WeakPolarHBondContact O-CA 3.38Å; S125-N140 PolarHBondContact O-OD1 3.25Å; N140-G142 VanDerWaalsContact C-N 3.3Å; N140-G142 PolarHBondContact O-N 3.02Å; N140-G142 PolarHBondContact OD1-N 3.41Å; N140-I143 VanDerWaalsContact ND2-CD1 3.34Å; N140-I143 WeakPolarHBondContact ND2-CD1 3.37Å; N140-I143 VanDerWaalsContact O-O 3.08Å
141	F	88.8	Confident	91	Very high	14 Å²	14	61.3 Å²	61.3	6%	0.061	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.2	-176.8	52.9	-98.2	0	0	0	113.5	Q105 W119 S125 W139 I143 T406 I417	Q105-F141 PolarHBondContact NE2-O 3.16Å; Q105-F141 PolarHBondContact OE1-O 2.94Å; W119-F141 AromaticContact CH2-CE1 3.73Å; W119-F141 HydrophobicContact CH2-CE1 3.73Å; W119-F141 AromaticContact CH2-CZ 3.97Å; W119-F141 HydrophobicContact CH2-CZ 3.97Å; W119-F141 AromaticContact CZ3-CE1 3.72Å; W119-F141 HydrophobicContact CZ3-CE1 3.72Å; W119-F141 HydrophobicContact CZ3-CZ 4.09Å; S125-F141 VanDerWaalsContact C-CE1 3.41Å; S125-F141 WeakPolarHBondContact O-CD1 3.24Å; S125-F141 WeakPolarHBondContact O-CE1 3.43Å; S125-F141 PolarHBondContact O-N 3.24Å; S125-F141 VanDerWaalsContact O-N 3.12Å; W139-F141 HydrophobicContact CD2-CB 4.31Å; W139-F141 HydrophobicContact CH2-CB 4.23Å; W139-F141 HydrophobicContact CZ2-CB 3.79Å; F141-I143 VanDerWaalsContact C-N 3.3Å; F141-T406 HydrophobicContact CE2-CG2 4.4Å; F141-T406 HydrophobicContact CZ-CG2 3.89Å; F141-I417 HydrophobicContact CD1-CD1 4.01Å; F141-I417 HydrophobicContact CD1-CG1 3.91Å; F141-I417 HydrophobicContact CD1-CG2 4.33Å; F141-I417 HydrophobicContact CD2-CG2 4.19Å; F141-I417 HydrophobicContact CE1-CD1 3.98Å; F141-I417 HydrophobicContact CE1-CG1 4.21Å; F141-I417 HydrophobicContact CE1-CG2 4.06Å; F141-I417 HydrophobicContact CE2-CG2 3.92Å; F141-I417 HydrophobicContact CG-CG1 4.24Å; F141-I417 HydrophobicContact CG-CG2 4.37Å; F141-I417 HydrophobicContact CZ-CG2 3.83Å
142	G	82.8	Confident	90.7	Very high	59 Å²	59	62.1 Å²	62.1	61%	0.608	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-18.4	174.2	0	0	0	0	0	113.4	N140	N140-G142 VanDerWaalsContact C-N 3.3Å; N140-G142 PolarHBondContact O-N 3.02Å; N140-G142 PolarHBondContact OD1-N 3.41Å
143	I	85.1	Confident	90.5	Very high	101 Å²	101	65.7 Å²	65.7	52%	0.518	34%	0.339	S	S	.	.	S	Bend	trans	-115.4	138.2	-177.2	-51.1	178.5	0	0	0	107.9	N140 F141 D145	N140-I143 VanDerWaalsContact ND2-CD1 3.34Å; N140-I143 WeakPolarHBondContact ND2-CD1 3.37Å; N140-I143 VanDerWaalsContact O-O 3.08Å; F141-I143 VanDerWaalsContact C-N 3.3Å; I143-D145 HydrophobicContact CG2-CB 3.81Å; I143-D145 PolarHBondContact O-N 3.2Å; I143-D145 VanDerWaalsContact O-N 3.15Å
144	K	78.6	Confident	90.4	Very high	221 Å²	221	66.6 Å²	66.6	96%	0.961	35%	0.349	S	S	*	.			trans	-76.2	9.8	176.6	-66.7	-174.4	177.7	-179.7	0	113.7
145	D	83.8	Confident	90.2	Very high	123 Å²	123	70.1 Å²	70.1	66%	0.658	38%	0.377	S	S	*	.	S	Bend	trans	-74.5	156.5	-177.9	-161.4	11	0	0	0	110.7	I143	I143-D145 HydrophobicContact CG2-CB 3.81Å; I143-D145 PolarHBondContact O-N 3.2Å; I143-D145 VanDerWaalsContact O-N 3.15Å
146	K	82.7	Confident	89.9	Confident	183 Å²	183	71.6 Å²	71.6	80%	0.796	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-65.6	133.4	177.7	-71.7	-176.1	178.9	178.6	0	109.2
147	P	88.4	Confident	89.7	Confident	54 Å²	54	71.5 Å²	71.5	35%	0.351	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-63.6	146.6	176.4	27.4	-33.8	0	0	0	110.4	M137 L138 W139 F149	M137-P147 HydrophobicContact CG-CB 3.68Å; M137-P147 HydrophobicContact CG-CG 4.13Å; M137-P147 HydrophobicContact SD-CB 3.81Å; M137-P147 HydrophobicContact SD-CG 3.8Å; L138-P147 WeakPolarHBondContact O-CA 3.26Å; L138-P147 WeakPolarHBondContact O-CB 3.1Å; W139-P147 HydrophobicContact CB-CB 4.17Å; W139-P147 HydrophobicContact CG-CB 4.44Å; P147-F149 PolarHBondContact O-N 3.43Å
148	T	90.8	Very high	89.8	Confident	71 Å²	71	71.6 Å²	71.6	44%	0.436	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	126.4	171.7	-52.5	0	0	0	0	108.6	M137 L138 F186	M137-T148 WeakPolarHBondContact CA-O 3.49Å; L138-T148 PolarHBondContact N-O 2.86Å; L138-T148 PolarHBondContact O-N 3.39Å; L138-T148 VanDerWaalsContact O-N 3.08Å; T148-F186 WeakPolarHBondContact CG2-O 3.26Å
149	F	93.6	Very high	89.9	Confident	91 Å²	91	70.2 Å²	70.2	40%	0.399	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.6	-174.9	-169.4	-90.1	0	0	0	110.8	F110 D135 M137 P147 K151	F110-F149 AromaticContact CD1-CE2 3.68Å; F110-F149 HydrophobicContact CD1-CE2 3.68Å; F110-F149 HydrophobicContact CD1-CZ 4.2Å; F110-F149 HydrophobicContact CE1-CD2 4.44Å; F110-F149 AromaticContact CE1-CE2 3.71Å; F110-F149 HydrophobicContact CE1-CE2 3.71Å; F110-F149 HydrophobicContact CE1-CZ 4.48Å; D135-F149 HydrophobicContact CB-CE1 4.32Å; D135-F149 HydrophobicContact CB-CE2 4.18Å; D135-F149 HydrophobicContact CB-CZ 3.66Å; M137-F149 HydrophobicContact CB-CD2 4.21Å; M137-F149 HydrophobicContact CG-CD2 4.47Å; P147-F149 PolarHBondContact O-N 3.43Å; F149-K151 HydrophobicContact CE1-CB 4.04Å; F149-K151 HydrophobicContact CE1-CG 4.4Å
150	I	94.1	Very high	90	Very high	25 Å²	25	70.1 Å²	70.1	13%	0.128	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.1	173	-59.1	166.1	0	0	0	106.9	D135 I136 F172	D135-I150 CarbonylContact C-O 3.58Å; D135-I150 VanDerWaalsContact CA-O 3.23Å; D135-I150 WeakPolarHBondContact CA-O 3.45Å; I136-I150 HydrophobicContact CB-CB 4.36Å; I136-I150 PolarHBondContact N-O 2.95Å; I136-I150 PolarHBondContact O-N 3.14Å; I150-F172 HydrophobicContact CD1-CE1 3.91Å; I150-F172 HydrophobicContact CD1-CZ 3.95Å
151	K	93.1	Very high	90.1	Very high	170 Å²	170	68.3 Å²	68.3	74%	0.739	38%	0.383	S	S	*	.			trans	-82.8	130.6	178.9	-166.8	176.3	-179.8	178.9	0	110.3	F149	F149-K151 HydrophobicContact CE1-CB 4.04Å; F149-K151 HydrophobicContact CE1-CG 4.4Å
152	G	91.2	Very high	90.5	Very high	18 Å²	18	68 Å²	68	19%	0.186	38%	0.382	C	S	.	.			trans	-85	177.9	175	0	0	0	0	0	113.2	G134 D135 G154	G134-G152 VanDerWaalsContact C-CA 3.47Å; G134-G152 WeakPolarHBondContact O-CA 3.3Å; D135-G152 PolarHBondContact OD1-N 3.48Å; G152-G154 PolarHBondContact O-N 3.46Å
153	I	91.7	Very high	91.2	Very high	129 Å²	129	68.4 Å²	68.4	66%	0.662	37%	0.367	S	S	*	.			trans	-70.3	-17.9	176.6	-165.4	162.4	0	0	0	113.3	E178	I153-E178 HydrophobicContact CG2-CG 4.06Å; I153-E178 WeakPolarHBondContact CG2-OE1 3.48Å
154	G	92.3	Very high	91.7	Very high	19 Å²	19	64.3 Å²	64.3	20%	0.196	35%	0.346	C	S	.	.	S	Bend	trans	93.5	-109.6	-179.3	0	0	0	0	0	112.7	G133 G152 G156 G157	G133-G154 CarbonylContact C-O 3.27Å; G133-G154 VanDerWaalsContact CA-O 3.31Å; G133-G154 WeakPolarHBondContact CA-O 3.17Å; G133-G154 WeakPolarHBondContact O-CA 3.39Å; G133-G154 PolarHBondContact O-N 3.36Å; G152-G154 PolarHBondContact O-N 3.46Å; G154-G156 PolarHBondContact O-N 3.06Å; G154-G157 PolarHBondContact O-N 2.73Å; G154-G157 VanDerWaalsContact O-N 3.1Å
155	A	89.4	Confident	92.5	Very high	76 Å²	76	54.1 Å²	54.1	63%	0.628	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	131.4	-178.6	0	0	0	0	0	110.8	G157	A155-G157 PolarHBondContact O-N 2.71Å
156	G	88.8	Confident	92.9	Very high	46 Å²	46	50.9 Å²	50.9	47%	0.474	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-12.2	-174.8	0	0	0	0	0	115	G154 S158 M177 E178	G154-G156 PolarHBondContact O-N 3.06Å; G156-S158 VanDerWaalsContact C-N 3.25Å; G156-S158 PolarHBondContact O-N 3.02Å; G156-S158 VanDerWaalsContact O-N 3.13Å; G156-M177 CarbonylContact O-C 3.56Å; G156-M177 VanDerWaalsContact O-CB 3.29Å; G156-M177 WeakPolarHBondContact O-CB 3.43Å; G156-E178 PolarHBondContact O-N 3.03Å
157	G	92.6	Very high	93.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.278	C	S	.	.			trans	-75.3	7.8	-176.6	0	0	0	0	0	117.1	G134 G154 A155 I159 S176	G134-G157 WeakPolarHBondContact CA-O 3.36Å; G134-G157 PolarHBondContact N-O 2.86Å; G154-G157 PolarHBondContact O-N 2.73Å; G154-G157 VanDerWaalsContact O-N 3.1Å; A155-G157 PolarHBondContact O-N 2.71Å; G157-I159 PolarHBondContact O-N 2.82Å; G157-S176 PolarHBondContact O-OG 2.82Å
158	S	95.9	Very high	93.5	Very high	3 Å²	3	48 Å²	48	2%	0.021	28%	0.277	C	S	.	.			trans	-57.4	119.8	-165.2	172.2	0	0	0	0	114.3	K132 G156 T160 M177	K132-S158 WeakPolarHBondContact CD-OG 3.41Å; K132-S158 PolarHBondContact NZ-OG 2.97Å; K132-S158 WeakPolarHBondContact O-CA 3.43Å; K132-S158 WeakPolarHBondContact O-CB 3.4Å; K132-S158 PolarHBondContact O-N 2.84Å; G156-S158 VanDerWaalsContact C-N 3.25Å; G156-S158 PolarHBondContact O-N 3.02Å; G156-S158 VanDerWaalsContact O-N 3.13Å; S158-T160 PolarHBondContact O-N 2.89Å; S158-M177 WeakPolarHBondContact O-CB 3.35Å; S158-M177 PolarHBondContact O-N 2.73Å
159	I	97	Very high	93.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.1	174.3	-51.9	-178.8	0	0	0	109.1	T115 S116 S131 D135 I136 G157 A174 S175	T115-I159 WeakPolarHBondContact CB-O 3.41Å; T115-I159 PolarHBondContact OG1-O 2.53Å; S116-I159 WeakPolarHBondContact OG-CG2 3.46Å; S131-I159 PolarHBondContact O-N 3.14Å; S131-I159 VanDerWaalsContact O-N 3.17Å; D135-I159 WeakPolarHBondContact O-CD1 3.3Å; I136-I159 HydrophobicContact CD1-CD1 3.55Å; I136-I159 HydrophobicContact CG1-CD1 3.14Å; G157-I159 PolarHBondContact O-N 2.82Å; I159-A174 HydrophobicContact CG2-CB 4.42Å; I159-S175 WeakPolarHBondContact CA-O 3.06Å
160	T	96	Very high	93.5	Very high	19 Å²	19	47 Å²	47	12%	0.117	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-23	-176.2	54.4	0	0	0	0	113.2	S158 S175 F204 C205	S158-T160 PolarHBondContact O-N 2.89Å; T160-S175 PolarHBondContact N-O 3.48Å; T160-S175 PolarHBondContact OG1-O 2.77Å; T160-S175 PolarHBondContact OG1-OG 3.07Å; T160-F204 PolarHBondContact OG1-O 3.25Å; T160-C205 VanDerWaalsContact CB-O 3.29Å; T160-C205 WeakPolarHBondContact CB-O 3.39Å; T160-C205 VanDerWaalsContact OG1-C 3.29Å; T160-C205 VanDerWaalsContact OG1-CA 3.23Å; T160-C205 WeakPolarHBondContact OG1-CA 3.26Å; T160-C205 PolarHBondContact OG1-O 2.97Å
161	G	95.4	Very high	93.6	Very high	10 Å²	10	47.6 Å²	47.6	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	138.5	176.3	0	0	0	0	0	110.4	A174 S175	G161-A174 WeakPolarHBondContact O-CA 3.34Å; G161-S175 PolarHBondContact O-N 3.4Å
162	L	96.9	Very high	93.8	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.4	179.8	-176.2	66.4	0	0	0	107.8	A118 A128 I136 F172 Y173 A174	A118-L162 HydrophobicContact CB-CB 4.35Å; A118-L162 HydrophobicContact CB-CD2 4.11Å; A118-L162 HydrophobicContact CB-CG 4Å; A128-L162 HydrophobicContact CB-CD2 3.82Å; I136-L162 HydrophobicContact CD1-CD1 4.39Å; L162-F172 HydrophobicContact CD1-CB 4.26Å; L162-F172 HydrophobicContact CD1-CD2 3.48Å; L162-F172 VanDerWaalsContact CD1-CD2 3.48Å; L162-F172 HydrophobicContact CD1-CE2 4.18Å; L162-F172 HydrophobicContact CD1-CG 4.1Å; L162-Y173 WeakPolarHBondContact CA-O 3.06Å; L162-A174 HydrophobicContact CD1-CB 4.23Å
163	K	97	Very high	94	Very high	68 Å²	68	39 Å²	39	30%	0.296	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	136.8	174.6	-72.3	-64.1	-174.4	176.8	0	109.1	F172 Y173 D208 V209	K163-F172 CarbonylContact O-C 3.6Å; K163-F172 WeakPolarHBondContact O-CA 3.22Å; K163-Y173 PolarHBondContact N-O 3.14Å; K163-Y173 PolarHBondContact O-N 3.21Å; K163-D208 WeakPolarHBondContact CE-OD1 3.35Å; K163-V209 HydrophobicContact CB-CG2 4.37Å
164	F	96.7	Very high	94.3	Very high	16 Å²	16	32.9 Å²	32.9	7%	0.07	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	150.4	170.4	-81	-92.4	0	0	0	110.3	A118 W119 H120 A128 L138 P166 T169 F186	A118-F164 HydrophobicContact CB-CD2 4.06Å; A118-F164 HydrophobicContact CB-CE2 4.13Å; W119-F164 WeakPolarHBondContact O-CD2 3.31Å; W119-F164 WeakPolarHBondContact O-CE2 3.48Å; H120-F164 HydrophobicContact CB-CE1 4.5Å; H120-F164 HydrophobicContact CB-CE2 4.31Å; H120-F164 HydrophobicContact CB-CZ 4.09Å; H120-F164 AromaticContact CD2-CE1 3.8Å; A128-F164 HydrophobicContact CB-CE2 3.61Å; A128-F164 HydrophobicContact CB-CZ 3.59Å; L138-F164 HydrophobicContact CD1-CE1 4.06Å; L138-F164 HydrophobicContact CD1-CZ 3.68Å; F164-P166 VanDerWaalsContact O-CD 3.26Å; F164-P166 WeakPolarHBondContact O-CD 3.39Å; F164-T169 HydrophobicContact CB-CG2 4.31Å; F164-T169 HydrophobicContact CD1-CG2 3.54Å; F164-T169 WeakPolarHBondContact CD1-O 3.45Å; F164-T169 HydrophobicContact CE1-CG2 4.13Å; F164-T169 HydrophobicContact CG-CG2 4.17Å; F164-F186 AromaticContact CD1-CE2 3.9Å; F164-F186 HydrophobicContact CD1-CE2 3.9Å; F164-F186 HydrophobicContact CD1-CZ 4.03Å; F164-F186 AromaticContact CE1-CE2 3.39Å; F164-F186 HydrophobicContact CE1-CE2 3.39Å; F164-F186 AromaticContact CE1-CZ 3.37Å; F164-F186 HydrophobicContact CE1-CZ 3.37Å; F164-F186 HydrophobicContact CZ-CE2 4.26Å; F164-F186 AromaticContact CZ-CZ 3.82Å; F164-F186 HydrophobicContact CZ-CZ 3.82Å
165	N	95.6	Very high	94.5	Very high	7 Å²	7	32 Å²	32	4%	0.037	19%	0.194	C	C	.	.			trans	-72.8	118.1	166.1	178.9	-1.9	0	0	0	108.6	L167 N168 Q171 Y173 L183	N165-L167 PolarHBondContact O-N 3.12Å; N165-L167 WeakPolarHBondContact OD1-CB 3.48Å; N165-L167 PolarHBondContact OD1-N 3.49Å; N165-N168 WeakPolarHBondContact CB-O 3.48Å; N165-N168 CarbonylContact O-C 3.58Å; N165-N168 PolarHBondContact O-N 3.15Å; N165-Q171 HydrophobicContact CB-CB 3.89Å; N165-Q171 WeakPolarHBondContact CB-O 3.25Å; N165-Q171 PolarHBondContact N-O 2.78Å; N165-Q171 PolarHBondContact ND2-OE1 3.04Å; N165-Y173 HydrophobicContact CB-CD2 4.18Å; N165-Y173 HydrophobicContact CB-CE2 3.68Å; N165-L183 HydrophobicContact CB-CD1 4.21Å
166	P	91.2	Very high	94.8	Very high	54 Å²	54	28.4 Å²	28.4	35%	0.351	16%	0.164	S	C	.	.	S	Bend	trans	-65.1	-23	-178.4	-21.2	34.2	0	0	0	113.8	F164 V209 A211	F164-P166 VanDerWaalsContact O-CD 3.26Å; F164-P166 WeakPolarHBondContact O-CD 3.39Å; P166-V209 HydrophobicContact CG-CG1 4.46Å; P166-A211 HydrophobicContact CB-CB 3.47Å; P166-A211 VanDerWaalsContact CB-CB 3.47Å; P166-A211 HydrophobicContact CG-CB 3.85Å
167	L	90.8	Very high	95	Very high	113 Å²	113	28.9 Å²	28.9	59%	0.592	16%	0.155	S	C	*	.	S	Bend	trans	-84.1	-37.3	-177.9	-63.8	157.7	0	0	0	112.1	N165 M230	N165-L167 PolarHBondContact O-N 3.12Å; N165-L167 WeakPolarHBondContact OD1-CB 3.48Å; N165-L167 PolarHBondContact OD1-N 3.49Å; L167-M230 HydrophobicContact CD1-CE 4.43Å; L167-M230 HydrophobicContact CD1-SD 3.56Å; L167-M230 VanDerWaalsContact CD1-SD 3.56Å
168	N	92.6	Very high	94.9	Very high	64 Å²	64	32 Å²	32	34%	0.342	17%	0.169	S	C	.	.			trans	-141.4	106.9	179.4	180	-0.9	0	0	0	109.7	N165 N170 Q171	N165-N168 WeakPolarHBondContact CB-O 3.48Å; N165-N168 CarbonylContact O-C 3.58Å; N165-N168 PolarHBondContact O-N 3.15Å; N168-N170 PolarHBondContact O-N 3.16Å; N168-N170 PolarHBondContact OD1-N 3.07Å; N168-N170 VanDerWaalsContact OD1-N 3.15Å; N168-Q171 HydrophobicContact CB-CG 4.49Å; N168-Q171 PolarHBondContact ND2-NE2 2.66Å; N168-Q171 PolarHBondContact O-N 2.84Å
169	T	93.1	Very high	94.8	Very high	34 Å²	34	31.9 Å²	31.9	21%	0.209	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-6.8	-171.6	-20.6	0	0	0	0	115.1	H120 P121 F164 Q171 F186	H120-T169 VanDerWaalsContact CD2-CG2 3.42Å; H120-T169 WeakPolarHBondContact CD2-CG2 3.46Å; H120-T169 WeakPolarHBondContact CE1-CG2 3.34Å; H120-T169 WeakPolarHBondContact NE2-CB 3.36Å; H120-T169 WeakPolarHBondContact NE2-CG2 3.46Å; P121-T169 VanDerWaalsContact CD-CG2 3.44Å; P121-T169 HydrophobicContact CG-CG2 3.5Å; F164-T169 HydrophobicContact CB-CG2 4.31Å; F164-T169 HydrophobicContact CD1-CG2 3.54Å; F164-T169 WeakPolarHBondContact CD1-O 3.45Å; F164-T169 HydrophobicContact CE1-CG2 4.13Å; F164-T169 HydrophobicContact CG-CG2 4.17Å; T169-Q171 PolarHBondContact O-N 2.89Å; T169-F186 WeakPolarHBondContact O-CE2 3.42Å
170	N	93.1	Very high	94.6	Very high	106 Å²	106	32.9 Å²	32.9	57%	0.567	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-8.6	167.3	-69.1	-32.1	0	0	0	112.4	N168 F186	N168-N170 PolarHBondContact O-N 3.16Å; N168-N170 PolarHBondContact OD1-N 3.07Å; N168-N170 VanDerWaalsContact OD1-N 3.15Å; N170-F186 WeakPolarHBondContact O-CD2 3.26Å; N170-F186 PolarHBondContact O-N 3.07Å
171	Q	95.3	Very high	94.6	Very high	38 Å²	38	32.1 Å²	32.1	18%	0.178	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.3	-179.8	-54.8	171.9	-1.3	0	0	111.1	N165 N168 T169 L183 Q184 L191	N165-Q171 HydrophobicContact CB-CB 3.89Å; N165-Q171 WeakPolarHBondContact CB-O 3.25Å; N165-Q171 PolarHBondContact N-O 2.78Å; N165-Q171 PolarHBondContact ND2-OE1 3.04Å; N168-Q171 HydrophobicContact CB-CG 4.49Å; N168-Q171 PolarHBondContact ND2-NE2 2.66Å; N168-Q171 PolarHBondContact O-N 2.84Å; T169-Q171 PolarHBondContact O-N 2.89Å; Q171-L183 HydrophobicContact CB-CD1 3.76Å; Q171-Q184 CarbonylContact C-O 3.55Å; Q171-Q184 WeakPolarHBondContact CA-O 3.26Å; Q171-L191 HydrophobicContact CG-CD1 3.69Å; Q171-L191 VanDerWaalsContact NE2-CD1 3.3Å
172	F	96.4	Very high	94.6	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.1	175.5	64.6	-88.5	0	0	0	111	I136 I150 L162 K163 A174 L183 Q184 F186	I136-F172 HydrophobicContact CD1-CD2 4Å; I136-F172 HydrophobicContact CD1-CE1 4.42Å; I136-F172 HydrophobicContact CD1-CE2 3.07Å; I136-F172 HydrophobicContact CD1-CZ 3.32Å; I136-F172 HydrophobicContact CG1-CE2 4.48Å; I136-F172 HydrophobicContact CG2-CZ 4.36Å; I150-F172 HydrophobicContact CD1-CE1 3.91Å; I150-F172 HydrophobicContact CD1-CZ 3.95Å; L162-F172 HydrophobicContact CD1-CB 4.26Å; L162-F172 HydrophobicContact CD1-CD2 3.48Å; L162-F172 VanDerWaalsContact CD1-CD2 3.48Å; L162-F172 HydrophobicContact CD1-CE2 4.18Å; L162-F172 HydrophobicContact CD1-CG 4.1Å; K163-F172 CarbonylContact O-C 3.6Å; K163-F172 WeakPolarHBondContact O-CA 3.22Å; F172-A174 HydrophobicContact CD2-CB 3.99Å; F172-A174 HydrophobicContact CE2-CB 3.85Å; F172-L183 WeakPolarHBondContact O-CA 3.16Å; F172-Q184 HydrophobicContact CE1-CB 3.87Å; F172-Q184 HydrophobicContact CE2-CB 3.85Å; F172-Q184 HydrophobicContact CE2-CG 4.46Å; F172-Q184 HydrophobicContact CZ-CB 3.46Å; F172-Q184 VanDerWaalsContact CZ-CB 3.46Å; F172-Q184 HydrophobicContact CZ-CG 4.3Å; F172-Q184 PolarHBondContact N-O 3.14Å; F172-Q184 PolarHBondContact O-N 2.84Å; F172-F186 HydrophobicContact CB-CE2 4.39Å; F172-F186 HydrophobicContact CB-CZ 3.94Å; F172-F186 AromaticContact CD1-CD1 3.64Å; F172-F186 HydrophobicContact CD1-CD1 3.64Å; F172-F186 HydrophobicContact CD1-CD2 4.14Å; F172-F186 AromaticContact CD1-CE1 3.33Å; F172-F186 HydrophobicContact CD1-CE1 3.33Å; F172-F186 AromaticContact CD1-CE2 3.83Å; F172-F186 HydrophobicContact CD1-CE2 3.83Å; F172-F186 HydrophobicContact CD1-CG 4.03Å; F172-F186 AromaticContact CD1-CZ 3.41Å; F172-F186 HydrophobicContact CD1-CZ 3.41Å; F172-F186 VanDerWaalsContact CD1-CZ 3.41Å; F172-F186 AromaticContact CE1-CD1 3.68Å; F172-F186 HydrophobicContact CE1-CD1 3.68Å; F172-F186 AromaticContact CE1-CE1 3.75Å; F172-F186 HydrophobicContact CE1-CE1 3.75Å; F172-F186 HydrophobicContact CE1-CG 4.19Å; F172-F186 HydrophobicContact CE1-CZ 4.28Å; F172-F186 HydrophobicContact CG-CE1 4.09Å; F172-F186 AromaticContact CG-CZ 3.96Å; F172-F186 HydrophobicContact CG-CZ 3.96Å
173	Y	96.9	Very high	94.6	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.024	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.9	168.9	-61.8	-88	0	0	0	108.7	L162 K163 N165 R182 L183 F194 L207 V209 V216	L162-Y173 WeakPolarHBondContact CA-O 3.06Å; K163-Y173 PolarHBondContact N-O 3.14Å; K163-Y173 PolarHBondContact O-N 3.21Å; N165-Y173 HydrophobicContact CB-CD2 4.18Å; N165-Y173 HydrophobicContact CB-CE2 3.68Å; Y173-R182 WeakPolarHBondContact CA-O 3.17Å; Y173-L183 HydrophobicContact CD1-CB 4.05Å; Y173-L183 HydrophobicContact CD1-CD1 3.98Å; Y173-L183 HydrophobicContact CD2-CD1 4.17Å; Y173-L183 HydrophobicContact CE1-CB 4Å; Y173-L183 HydrophobicContact CE1-CD1 3.83Å; Y173-L183 HydrophobicContact CE1-CD2 4.24Å; Y173-L183 HydrophobicContact CE1-CG 4.25Å; Y173-L183 HydrophobicContact CE2-CD1 4.03Å; Y173-L183 HydrophobicContact CG-CD1 4.15Å; Y173-F194 HydrophobicContact CD1-CD2 4.49Å; Y173-F194 HydrophobicContact CD1-CE2 4.08Å; Y173-F194 HydrophobicContact CD1-CZ 4.48Å; Y173-F194 HydrophobicContact CE1-CD2 4.4Å; Y173-F194 HydrophobicContact CE1-CE1 4.46Å; Y173-F194 AromaticContact CE1-CE2 3.62Å; Y173-F194 HydrophobicContact CE1-CE2 3.62Å; Y173-F194 AromaticContact CE1-CZ 3.65Å; Y173-F194 HydrophobicContact CE1-CZ 3.65Å; Y173-L207 VanDerWaalsContact C-CD2 3.49Å; Y173-L207 VanDerWaalsContact O-CD2 3.3Å; Y173-L207 WeakPolarHBondContact O-CD2 2.88Å; Y173-V209 HydrophobicContact CD1-CG2 4.42Å; Y173-V209 HydrophobicContact CD2-CB 4.38Å; Y173-V209 HydrophobicContact CD2-CG1 4.22Å; Y173-V209 HydrophobicContact CD2-CG2 3.67Å; Y173-V209 HydrophobicContact CE2-CG1 3.87Å; Y173-V209 HydrophobicContact CE2-CG2 4.12Å; Y173-V209 HydrophobicContact CG-CG2 3.83Å; Y173-V216 HydrophobicContact CD1-CG2 4.31Å; Y173-V216 HydrophobicContact CE1-CG2 3.83Å
174	A	96.9	Very high	94.5	Very high	2 Å²	2	30.3 Å²	30.3	2%	0.017	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.5	175.6	0	0	0	0	0	110.3	I136 I159 G161 L162 F172 T181 R182	I136-A174 HydrophobicContact CD1-CB 4.37Å; I159-A174 HydrophobicContact CG2-CB 4.42Å; G161-A174 WeakPolarHBondContact O-CA 3.34Å; L162-A174 HydrophobicContact CD1-CB 4.23Å; F172-A174 HydrophobicContact CD2-CB 3.99Å; F172-A174 HydrophobicContact CE2-CB 3.85Å; A174-T181 WeakPolarHBondContact O-CA 3.45Å; A174-R182 PolarHBondContact N-O 2.78Å; A174-R182 PolarHBondContact O-N 3.24Å
175	S	96.4	Very high	94.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.3	169.3	169.7	0	0	0	0	108.3	I159 T160 G161 F204	I159-S175 WeakPolarHBondContact CA-O 3.06Å; T160-S175 PolarHBondContact N-O 3.48Å; T160-S175 PolarHBondContact OG1-O 2.77Å; T160-S175 PolarHBondContact OG1-OG 3.07Å; G161-S175 PolarHBondContact O-N 3.4Å; S175-F204 WeakPolarHBondContact OG-CB 3.5Å; S175-F204 PolarHBondContact OG-O 3.05Å
176	S	95.2	Very high	94.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.9	-173.3	-175.3	0	0	0	0	111.7	G157 E178 G179 T180	G157-S176 PolarHBondContact O-OG 2.82Å; S176-E178 PolarHBondContact O-N 3.4Å; S176-E178 WeakPolarHBondContact OG-CB 3.41Å; S176-E178 WeakPolarHBondContact OG-CG 3.43Å; S176-E178 PolarHBondContact OG-N 3.08Å; S176-E178 VanDerWaalsContact OG-N 3.15Å; S176-G179 PolarHBondContact O-N 3.01Å; S176-T180 PolarHBondContact N-O 2.82Å
177	M	94.2	Very high	94.3	Very high	56 Å²	56	37 Å²	37	28%	0.276	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-6.5	170	-171.6	157	178.6	0	0	112.9	G156 S158 G179 W203	G156-M177 CarbonylContact O-C 3.56Å; G156-M177 VanDerWaalsContact O-CB 3.29Å; G156-M177 WeakPolarHBondContact O-CB 3.43Å; S158-M177 WeakPolarHBondContact O-CB 3.35Å; S158-M177 PolarHBondContact O-N 2.73Å; M177-G179 PolarHBondContact O-N 3.09Å; M177-G179 VanDerWaalsContact O-N 3.09Å; M177-W203 HydrophobicContact CB-CG 4.29Å; M177-W203 HydrophobicContact CE-CD2 3.81Å; M177-W203 HydrophobicContact CE-CE3 4.03Å; M177-W203 HydrophobicContact CE-CG 4.47Å; M177-W203 HydrophobicContact CE-CH2 3.9Å; M177-W203 HydrophobicContact CE-CZ2 3.65Å; M177-W203 HydrophobicContact CE-CZ3 4.07Å; M177-W203 HydrophobicContact CG-CB 4.17Å; M177-W203 HydrophobicContact CG-CD2 3.98Å; M177-W203 HydrophobicContact CG-CG 3.68Å; M177-W203 HydrophobicContact SD-CD2 4.35Å; M177-W203 HydrophobicContact SD-CG 4.46Å
178	E	91.2	Very high	94.2	Very high	65 Å²	65	33 Å²	33	30%	0.304	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-9.1	165	-69.6	167.5	-150.3	0	0	112.9	I153 G156 S176 R182	I153-E178 HydrophobicContact CG2-CG 4.06Å; I153-E178 WeakPolarHBondContact CG2-OE1 3.48Å; G156-E178 PolarHBondContact O-N 3.03Å; S176-E178 PolarHBondContact O-N 3.4Å; S176-E178 WeakPolarHBondContact OG-CB 3.41Å; S176-E178 WeakPolarHBondContact OG-CG 3.43Å; S176-E178 PolarHBondContact OG-N 3.08Å; S176-E178 VanDerWaalsContact OG-N 3.15Å; E178-R182 IonicContact OE1-NH2 3.16Å; E178-R182 IonicContact OE2-CZ 3.47Å; E178-R182 IonicContact OE2-NH1 2.87Å; E178-R182 PolarHBondContact OE2-NH1 3.08Å; E178-R182 IonicContact OE2-NH2 3.86Å
179	G	91.9	Very high	94.2	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	23.7	-175.4	0	0	0	0	0	112.4	S176 M177 S196 S197 F204	S176-G179 PolarHBondContact O-N 3.01Å; M177-G179 PolarHBondContact O-N 3.09Å; M177-G179 VanDerWaalsContact O-N 3.09Å; G179-S196 WeakPolarHBondContact O-CA 3.38Å; G179-S197 VanDerWaalsContact CA-OG 3.28Å; G179-S197 WeakPolarHBondContact CA-OG 3.19Å; G179-S197 PolarHBondContact O-N 2.85Å; G179-S197 PolarHBondContact O-OG 2.85Å; G179-F204 VanDerWaalsContact O-CE2 3.28Å; G179-F204 WeakPolarHBondContact O-CE2 3.14Å
180	T	94.4	Very high	94.3	Very high	23 Å²	23	37.5 Å²	37.5	14%	0.141	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143.4	177.8	63.7	0	0	0	0	112.5	S176 V193 A195	S176-T180 PolarHBondContact N-O 2.82Å; T180-V193 HydrophobicContact CG2-CG1 4.46Å; T180-A195 WeakPolarHBondContact CA-O 3.37Å
181	T	95.9	Very high	94.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.4	158.4	61.1	0	0	0	0	109	A174 F194 A195 F204 T218	A174-T181 WeakPolarHBondContact O-CA 3.45Å; T181-F194 PolarHBondContact O-N 3.08Å; T181-A195 PolarHBondContact N-O 2.86Å; T181-A195 WeakPolarHBondContact OG1-CB 3.42Å; T181-A195 PolarHBondContact OG1-N 3.15Å; T181-A195 VanDerWaalsContact OG1-N 3.16Å; T181-F204 HydrophobicContact CG2-CB 3.62Å; T181-F204 HydrophobicContact CG2-CD1 4.11Å; T181-F204 HydrophobicContact CG2-CD2 3.71Å; T181-F204 HydrophobicContact CG2-CE2 4.46Å; T181-F204 HydrophobicContact CG2-CG 3.52Å; T181-T218 HydrophobicContact CG2-CG2 3.89Å; T181-T218 WeakPolarHBondContact CG2-OG1 3.42Å
182	R	95.6	Very high	94.2	Very high	31 Å²	31	39.9 Å²	39.9	12%	0.117	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150	-170.6	56.3	178.9	-173.1	-139	-4.1	112.1	Y173 A174 E178 Q184 I190 R192 V193	Y173-R182 WeakPolarHBondContact CA-O 3.17Å; A174-R182 PolarHBondContact N-O 2.78Å; A174-R182 PolarHBondContact O-N 3.24Å; E178-R182 IonicContact OE1-NH2 3.16Å; E178-R182 IonicContact OE2-CZ 3.47Å; E178-R182 IonicContact OE2-NH1 2.87Å; E178-R182 PolarHBondContact OE2-NH1 3.08Å; E178-R182 IonicContact OE2-NH2 3.86Å; R182-Q184 HydrophobicContact CG-CG 4.07Å; R182-I190 HydrophobicContact CB-CG2 4.23Å; R182-R192 CarbonylContact C-O 3.58Å; R182-R192 VanDerWaalsContact CA-O 3.3Å; R182-R192 WeakPolarHBondContact CA-O 3.44Å; R182-R192 WeakPolarHBondContact CB-O 3.48Å; R182-V193 HydrophobicContact CB-CG2 4.41Å
183	L	96.7	Very high	94.1	Very high	12 Å²	12	43.3 Å²	43.3	6%	0.063	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.5	166.6	175.7	66.8	0	0	0	108.3	N165 Q171 F172 Y173 L191 R192 F194	N165-L183 HydrophobicContact CB-CD1 4.21Å; Q171-L183 HydrophobicContact CB-CD1 3.76Å; F172-L183 WeakPolarHBondContact O-CA 3.16Å; Y173-L183 HydrophobicContact CD1-CB 4.05Å; Y173-L183 HydrophobicContact CD1-CD1 3.98Å; Y173-L183 HydrophobicContact CD2-CD1 4.17Å; Y173-L183 HydrophobicContact CE1-CB 4Å; Y173-L183 HydrophobicContact CE1-CD1 3.83Å; Y173-L183 HydrophobicContact CE1-CD2 4.24Å; Y173-L183 HydrophobicContact CE1-CG 4.25Å; Y173-L183 HydrophobicContact CE2-CD1 4.03Å; Y173-L183 HydrophobicContact CG-CD1 4.15Å; L183-L191 HydrophobicContact CG-CB 4.42Å; L183-L191 HydrophobicContact CG-CD1 4.29Å; L183-L191 PolarHBondContact O-N 3.39Å; L183-R192 HydrophobicContact CB-CB 4.45Å; L183-R192 PolarHBondContact N-O 3.45Å; L183-R192 PolarHBondContact O-N 3.37Å; L183-F194 HydrophobicContact CB-CD2 4.42Å; L183-F194 HydrophobicContact CB-CE2 3.65Å; L183-F194 HydrophobicContact CD2-CE2 4.45Å
184	Q	95	Very high	93.9	Very high	5 Å²	5	43.9 Å²	43.9	2%	0.023	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	152.3	-176.7	-71	166.6	87.8	0	0	110.1	Q171 F172 R182 N189 I190	Q171-Q184 CarbonylContact C-O 3.55Å; Q171-Q184 WeakPolarHBondContact CA-O 3.26Å; F172-Q184 HydrophobicContact CE1-CB 3.87Å; F172-Q184 HydrophobicContact CE2-CB 3.85Å; F172-Q184 HydrophobicContact CE2-CG 4.46Å; F172-Q184 HydrophobicContact CZ-CB 3.46Å; F172-Q184 VanDerWaalsContact CZ-CB 3.46Å; F172-Q184 HydrophobicContact CZ-CG 4.3Å; F172-Q184 PolarHBondContact N-O 3.14Å; F172-Q184 PolarHBondContact O-N 2.84Å; R182-Q184 HydrophobicContact CG-CG 4.07Å; Q184-N189 WeakPolarHBondContact CA-O 3.48Å; Q184-I190 HydrophobicContact CG-CB 4.39Å; Q184-I190 HydrophobicContact CG-CG1 4.01Å; Q184-I190 HydrophobicContact CG-CG2 4.48Å
185	D	94.9	Very high	93.7	Very high	30 Å²	30	44.1 Å²	44.1	16%	0.16	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	152.9	165.4	-173.4	14.3	0	0	0	110	K187 G188 N189 L191	D185-K187 PolarHBondContact O-N 3.38Å; D185-K187 VanDerWaalsContact O-N 3.07Å; D185-K187 WeakPolarHBondContact OD2-CD 3.42Å; D185-G188 PolarHBondContact O-N 2.85Å; D185-N189 PolarHBondContact N-O 2.88Å; D185-L191 HydrophobicContact CB-CD1 4.46Å
186	F	92	Very high	93.5	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.057	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-9.3	175	-75.8	-69.1	0	0	0	113.7	A128 I136 L138 T148 F164 T169 N170 F172 G188	A128-F186 HydrophobicContact CB-CE1 4.29Å; A128-F186 HydrophobicContact CB-CZ 4.29Å; I136-F186 HydrophobicContact CG2-CE1 4.28Å; L138-F186 HydrophobicContact CB-CD1 3.81Å; L138-F186 HydrophobicContact CB-CE1 3.92Å; L138-F186 HydrophobicContact CB-CG 4.44Å; L138-F186 HydrophobicContact CD1-CD1 4.41Å; L138-F186 HydrophobicContact CD1-CE1 3.89Å; L138-F186 HydrophobicContact CD1-CE2 4.25Å; L138-F186 HydrophobicContact CD1-CZ 3.81Å; L138-F186 HydrophobicContact CD2-CB 4.34Å; L138-F186 HydrophobicContact CD2-CD1 4Å; L138-F186 HydrophobicContact CD2-CD2 3.89Å; L138-F186 HydrophobicContact CD2-CE1 4.29Å; L138-F186 HydrophobicContact CD2-CE2 4.23Å; L138-F186 HydrophobicContact CD2-CG 3.81Å; L138-F186 HydrophobicContact CD2-CZ 4.41Å; L138-F186 HydrophobicContact CG-CD1 4.3Å; L138-F186 HydrophobicContact CG-CE1 4.26Å; T148-F186 WeakPolarHBondContact CG2-O 3.26Å; F164-F186 AromaticContact CD1-CE2 3.9Å; F164-F186 HydrophobicContact CD1-CE2 3.9Å; F164-F186 HydrophobicContact CD1-CZ 4.03Å; F164-F186 AromaticContact CE1-CE2 3.39Å; F164-F186 HydrophobicContact CE1-CE2 3.39Å; F164-F186 AromaticContact CE1-CZ 3.37Å; F164-F186 HydrophobicContact CE1-CZ 3.37Å; F164-F186 HydrophobicContact CZ-CE2 4.26Å; F164-F186 AromaticContact CZ-CZ 3.82Å; F164-F186 HydrophobicContact CZ-CZ 3.82Å; T169-F186 WeakPolarHBondContact O-CE2 3.42Å; N170-F186 WeakPolarHBondContact O-CD2 3.26Å; N170-F186 PolarHBondContact O-N 3.07Å; F172-F186 HydrophobicContact CB-CE2 4.39Å; F172-F186 HydrophobicContact CB-CZ 3.94Å; F172-F186 AromaticContact CD1-CD1 3.64Å; F172-F186 HydrophobicContact CD1-CD1 3.64Å; F172-F186 HydrophobicContact CD1-CD2 4.14Å; F172-F186 AromaticContact CD1-CE1 3.33Å; F172-F186 HydrophobicContact CD1-CE1 3.33Å; F172-F186 AromaticContact CD1-CE2 3.83Å; F172-F186 HydrophobicContact CD1-CE2 3.83Å; F172-F186 HydrophobicContact CD1-CG 4.03Å; F172-F186 AromaticContact CD1-CZ 3.41Å; F172-F186 HydrophobicContact CD1-CZ 3.41Å; F172-F186 VanDerWaalsContact CD1-CZ 3.41Å; F172-F186 AromaticContact CE1-CD1 3.68Å; F172-F186 HydrophobicContact CE1-CD1 3.68Å; F172-F186 AromaticContact CE1-CE1 3.75Å; F172-F186 HydrophobicContact CE1-CE1 3.75Å; F172-F186 HydrophobicContact CE1-CG 4.19Å; F172-F186 HydrophobicContact CE1-CZ 4.28Å; F172-F186 HydrophobicContact CG-CE1 4.09Å; F172-F186 AromaticContact CG-CZ 3.96Å; F172-F186 HydrophobicContact CG-CZ 3.96Å; F186-G188 VanDerWaalsContact C-N 3.25Å; F186-G188 PolarHBondContact O-N 2.87Å
187	K	91.4	Very high	93.1	Very high	174 Å²	174	49 Å²	49	76%	0.757	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.1	167.9	-62.8	-178.4	-177.4	177.2	0	114	D185	D185-K187 PolarHBondContact O-N 3.38Å; D185-K187 VanDerWaalsContact O-N 3.07Å; D185-K187 WeakPolarHBondContact OD2-CD 3.42Å
188	G	89.2	Confident	92.4	Very high	29 Å²	29	54 Å²	54	30%	0.299	29%	0.285	S	S	.	.	S	Bend	trans	95.5	0.4	-179.1	0	0	0	0	0	114.8	D185 F186	D185-G188 PolarHBondContact O-N 2.85Å; F186-G188 VanDerWaalsContact C-N 3.25Å; F186-G188 PolarHBondContact O-N 2.87Å
189	N	93.4	Very high	92.1	Very high	97 Å²	97	54.7 Å²	54.7	52%	0.519	29%	0.293	S	S	.	.			trans	-78.4	126	178.5	-62.1	-19.9	0	0	0	110.5	Q184 D185 L191	Q184-N189 WeakPolarHBondContact CA-O 3.48Å; D185-N189 PolarHBondContact N-O 2.88Å; N189-L191 PolarHBondContact O-N 3.23Å
190	I	94	Very high	91.6	Very high	95 Å²	95	62.6 Å²	62.6	49%	0.487	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114.4	173	-53.8	172	0	0	0	108	R182 Q184 V193	R182-I190 HydrophobicContact CB-CG2 4.23Å; Q184-I190 HydrophobicContact CG-CB 4.39Å; Q184-I190 HydrophobicContact CG-CG1 4.01Å; Q184-I190 HydrophobicContact CG-CG2 4.48Å; I190-V193 HydrophobicContact CG2-CG2 4.2Å
191	L	93.4	Very high	91.4	Very high	90 Å²	90	67.7 Å²	67.7	47%	0.471	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-41	-178.6	-61.7	172.3	0	0	0	111.2	Q171 L183 D185 N189	Q171-L191 HydrophobicContact CG-CD1 3.69Å; Q171-L191 VanDerWaalsContact NE2-CD1 3.3Å; L183-L191 HydrophobicContact CG-CB 4.42Å; L183-L191 HydrophobicContact CG-CD1 4.29Å; L183-L191 PolarHBondContact O-N 3.39Å; D185-L191 HydrophobicContact CB-CD1 4.46Å; N189-L191 PolarHBondContact O-N 3.23Å
192	R	92.9	Very high	91.2	Very high	104 Å²	104	69.8 Å²	69.8	39%	0.392	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	142.9	-177.1	-166	174.1	-66.3	165.5	-4.9	111.6	R182 L183 F194 M230 D231	R182-R192 CarbonylContact C-O 3.58Å; R182-R192 VanDerWaalsContact CA-O 3.3Å; R182-R192 WeakPolarHBondContact CA-O 3.44Å; R182-R192 WeakPolarHBondContact CB-O 3.48Å; L183-R192 HydrophobicContact CB-CB 4.45Å; L183-R192 PolarHBondContact N-O 3.45Å; L183-R192 PolarHBondContact O-N 3.37Å; R192-F194 HydrophobicContact CB-CE2 4.08Å; R192-F194 HydrophobicContact CG-CD2 4.48Å; R192-F194 HydrophobicContact CG-CE2 4.14Å; R192-F194 HydrophobicContact CG-CZ 4.49Å; R192-M230 PolarHBondContact NH1-O 2.94Å; R192-D231 VanDerWaalsContact NH1-CA 3.3Å; R192-D231 PolarHBondContact NH1-O 3.08Å
193	V	94.4	Very high	91.1	Very high	73 Å²	73	71.1 Å²	71.1	44%	0.442	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.4	166.8	-177.5	0	0	0	0	107.7	T180 R182 I190	T180-V193 HydrophobicContact CG2-CG1 4.46Å; R182-V193 HydrophobicContact CB-CG2 4.41Å; I190-V193 HydrophobicContact CG2-CG2 4.2Å
194	F	93.6	Very high	91.1	Very high	18 Å²	18	70.7 Å²	70.7	8%	0.079	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-52.2	-177.3	-78.9	-95.7	0	0	0	111.2	Y173 T181 L183 R192 V216 L228 N229 M230	Y173-F194 HydrophobicContact CD1-CD2 4.49Å; Y173-F194 HydrophobicContact CD1-CE2 4.08Å; Y173-F194 HydrophobicContact CD1-CZ 4.48Å; Y173-F194 HydrophobicContact CE1-CD2 4.4Å; Y173-F194 HydrophobicContact CE1-CE1 4.46Å; Y173-F194 AromaticContact CE1-CE2 3.62Å; Y173-F194 HydrophobicContact CE1-CE2 3.62Å; Y173-F194 AromaticContact CE1-CZ 3.65Å; Y173-F194 HydrophobicContact CE1-CZ 3.65Å; T181-F194 PolarHBondContact O-N 3.08Å; L183-F194 HydrophobicContact CB-CD2 4.42Å; L183-F194 HydrophobicContact CB-CE2 3.65Å; L183-F194 HydrophobicContact CD2-CE2 4.45Å; R192-F194 HydrophobicContact CB-CE2 4.08Å; R192-F194 HydrophobicContact CG-CD2 4.48Å; R192-F194 HydrophobicContact CG-CE2 4.14Å; R192-F194 HydrophobicContact CG-CZ 4.49Å; F194-V216 HydrophobicContact CD1-CB 4.49Å; F194-V216 HydrophobicContact CD1-CG2 4.45Å; F194-V216 HydrophobicContact CE1-CG2 4.12Å; F194-L228 HydrophobicContact CB-CD1 4.41Å; F194-L228 HydrophobicContact CB-CD2 4.04Å; F194-L228 HydrophobicContact CD1-CB 4.15Å; F194-L228 HydrophobicContact CD1-CD2 4.38Å; F194-L228 WeakPolarHBondContact O-CD2 3.46Å; F194-N229 WeakPolarHBondContact CE1-O 3.48Å; F194-M230 WeakPolarHBondContact CE1-O 3.29Å; F194-M230 VanDerWaalsContact CZ-O 3.31Å; F194-M230 WeakPolarHBondContact CZ-O 3.48Å
195	A	91.6	Very high	91.1	Very high	8 Å²	8	70.6 Å²	70.6	7%	0.066	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.4	177.5	0	0	0	0	0	108.2	T180 T181 F204 T218 I226	T180-A195 WeakPolarHBondContact CA-O 3.37Å; T181-A195 PolarHBondContact N-O 2.86Å; T181-A195 WeakPolarHBondContact OG1-CB 3.42Å; T181-A195 PolarHBondContact OG1-N 3.15Å; T181-A195 VanDerWaalsContact OG1-N 3.16Å; A195-F204 HydrophobicContact CB-CE1 3.86Å; A195-F204 HydrophobicContact CB-CE2 3.84Å; A195-F204 HydrophobicContact CB-CZ 3.4Å; A195-T218 HydrophobicContact CB-CG2 4.14Å; A195-I226 HydrophobicContact CB-CD1 4.1Å
196	S	92.4	Very high	91.1	Very high	77 Å²	77	69.3 Å²	69.3	54%	0.538	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.1	177.3	-173.2	0	0	0	0	107.7	G179	G179-S196 WeakPolarHBondContact O-CA 3.38Å
197	S	87.9	Confident	91.3	Very high	26 Å²	26	69 Å²	69	18%	0.182	37%	0.366	C	S	.	.			trans	-102	123.7	170.2	55.5	0	0	0	0	109.5	G179 T199 I202	G179-S197 VanDerWaalsContact CA-OG 3.28Å; G179-S197 WeakPolarHBondContact CA-OG 3.19Å; G179-S197 PolarHBondContact O-N 2.85Å; G179-S197 PolarHBondContact O-OG 2.85Å; S197-T199 PolarHBondContact O-N 3.19Å; S197-I202 PolarHBondContact OG-O 3.41Å; S197-I202 VanDerWaalsContact OG-O 3.05Å
198	D	79.2	Confident	91.6	Very high	161 Å²	161	61.6 Å²	61.6	86%	0.861	33%	0.334	S	S	*	.	S	Bend	trans	-72	-10.8	177.1	-55.7	-38	0	0	0	112.7
199	T	85.2	Confident	91.9	Very high	79 Å²	79	61 Å²	61	49%	0.485	33%	0.325	S	S	.	.	S	Bend	trans	-110.7	131.9	-179.9	30.8	0	0	0	0	111.8	S197 N201 I202	S197-T199 PolarHBondContact O-N 3.19Å; T199-N201 PolarHBondContact O-N 2.92Å; T199-N201 VanDerWaalsContact O-N 3.13Å; T199-I202 PolarHBondContact O-N 2.96Å
200	I	80.6	Confident	91.9	Very high	167 Å²	167	56.9 Å²	56.9	86%	0.856	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.2	-177.7	-56.1	163.8	0	0	0	112.5	I202	I200-I202 VanDerWaalsContact C-N 3.32Å; I200-I202 PolarHBondContact O-N 3.38Å
201	N	89.3	Confident	91.6	Very high	131 Å²	131	54.8 Å²	54.8	70%	0.701	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.4	-177.4	-67.2	-22.7	0	0	0	113.9	T199 W203 N221	T199-N201 PolarHBondContact O-N 2.92Å; T199-N201 VanDerWaalsContact O-N 3.13Å; N201-W203 WeakPolarHBondContact O-CZ3 3.5Å; N201-N221 PolarHBondContact O-ND2 3.38Å
202	I	92.3	Very high	91.3	Very high	46 Å²	46	54 Å²	54	24%	0.236	30%	0.303	C	S	.	.			trans	-109	135.9	179.3	-58.6	178.6	0	0	0	107.9	S197 T199 I200 D220 N221 V222	S197-I202 PolarHBondContact OG-O 3.41Å; S197-I202 VanDerWaalsContact OG-O 3.05Å; T199-I202 PolarHBondContact O-N 2.96Å; I200-I202 VanDerWaalsContact C-N 3.32Å; I200-I202 PolarHBondContact O-N 3.38Å; I202-D220 HydrophobicContact CG2-CB 4.33Å; I202-N221 WeakPolarHBondContact CA-OD1 3.25Å; I202-V222 HydrophobicContact CD1-CG2 4.39Å; I202-V222 HydrophobicContact CG1-CG2 4.06Å
203	W	94.7	Very high	91	Very high	58 Å²	58	50.1 Å²	50.1	22%	0.22	29%	0.292	C	S	.	.			trans	-150.9	155.4	172.6	66.8	86.9	0	0	0	111.8	M177 N201 C205 D220 N221	M177-W203 HydrophobicContact CB-CG 4.29Å; M177-W203 HydrophobicContact CE-CD2 3.81Å; M177-W203 HydrophobicContact CE-CE3 4.03Å; M177-W203 HydrophobicContact CE-CG 4.47Å; M177-W203 HydrophobicContact CE-CH2 3.9Å; M177-W203 HydrophobicContact CE-CZ2 3.65Å; M177-W203 HydrophobicContact CE-CZ3 4.07Å; M177-W203 HydrophobicContact CG-CB 4.17Å; M177-W203 HydrophobicContact CG-CD2 3.98Å; M177-W203 HydrophobicContact CG-CG 3.68Å; M177-W203 HydrophobicContact SD-CD2 4.35Å; M177-W203 HydrophobicContact SD-CG 4.46Å; N201-W203 WeakPolarHBondContact O-CZ3 3.5Å; W203-C205 PolarHBondContact NE1-SG 2.88Å; W203-D220 WeakPolarHBondContact O-CA 3.29Å; W203-N221 HydrophobicContact CD2-CB 4.04Å; W203-N221 HydrophobicContact CG-CB 4.49Å; W203-N221 HydrophobicContact CH2-CB 4.33Å; W203-N221 VanDerWaalsContact CH2-ND2 3.28Å; W203-N221 WeakPolarHBondContact CH2-ND2 3.31Å; W203-N221 HydrophobicContact CZ2-CB 3.82Å; W203-N221 WeakPolarHBondContact CZ3-ND2 3.34Å; W203-N221 PolarHBondContact N-OD1 3.25Å; W203-N221 PolarHBondContact O-N 2.83Å
204	F	96	Very high	90.8	Very high	3 Å²	3	53.6 Å²	53.6	1%	0.013	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	138.5	-179.4	-57.2	-71.5	0	0	0	110.4	T160 S175 G179 T181 A195 T218 G219 D220 I226	T160-F204 PolarHBondContact OG1-O 3.25Å; S175-F204 WeakPolarHBondContact OG-CB 3.5Å; S175-F204 PolarHBondContact OG-O 3.05Å; G179-F204 VanDerWaalsContact O-CE2 3.28Å; G179-F204 WeakPolarHBondContact O-CE2 3.14Å; T181-F204 HydrophobicContact CG2-CB 3.62Å; T181-F204 HydrophobicContact CG2-CD1 4.11Å; T181-F204 HydrophobicContact CG2-CD2 3.71Å; T181-F204 HydrophobicContact CG2-CE2 4.46Å; T181-F204 HydrophobicContact CG2-CG 3.52Å; A195-F204 HydrophobicContact CB-CE1 3.86Å; A195-F204 HydrophobicContact CB-CE2 3.84Å; A195-F204 HydrophobicContact CB-CZ 3.4Å; F204-T218 HydrophobicContact CD1-CG2 3.69Å; F204-T218 WeakPolarHBondContact CD1-OG1 3.47Å; F204-T218 HydrophobicContact CE1-CG2 3.92Å; F204-T218 HydrophobicContact CG-CG2 4.47Å; F204-G219 CarbonylContact C-O 3.55Å; F204-G219 WeakPolarHBondContact CA-O 3.48Å; F204-D220 WeakPolarHBondContact CD1-OD1 3.43Å; F204-D220 WeakPolarHBondContact CE1-OD1 3.38Å; F204-I226 HydrophobicContact CE1-CD1 3.65Å; F204-I226 HydrophobicContact CZ-CD1 4.11Å
205	C	95.4	Very high	90.8	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-18.1	-169.5	-71.1	0	0	0	0	113.3	T160 W203 G219 K244 V245	T160-C205 VanDerWaalsContact CB-O 3.29Å; T160-C205 WeakPolarHBondContact CB-O 3.39Å; T160-C205 VanDerWaalsContact OG1-C 3.29Å; T160-C205 VanDerWaalsContact OG1-CA 3.23Å; T160-C205 WeakPolarHBondContact OG1-CA 3.26Å; T160-C205 PolarHBondContact OG1-O 2.97Å; W203-C205 PolarHBondContact NE1-SG 2.88Å; C205-G219 PolarHBondContact N-O 3.04Å; C205-K244 HydrophobicContact CB-CD 4.34Å; C205-K244 HydrophobicContact CB-CG 4.19Å; C205-K244 WeakPolarHBondContact SG-CE 3.31Å; C205-K244 PolarHBondContact SG-NZ 2.89Å; C205-V245 WeakPolarHBondContact CB-O 3.38Å
206	S	94.7	Very high	91	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.014	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	148.7	-175.5	49.3	0	0	0	0	110	T218 G219 V248	S206-T218 VanDerWaalsContact O-CA 3.26Å; S206-T218 WeakPolarHBondContact O-CA 3.46Å; S206-T218 PolarHBondContact O-OG1 2.97Å; S206-G219 PolarHBondContact N-O 2.85Å; S206-G219 PolarHBondContact O-N 3.43Å; S206-G219 VanDerWaalsContact O-N 3.16Å; S206-G219 WeakPolarHBondContact OG-CA 3.44Å; S206-G219 PolarHBondContact OG-N 2.88Å; S206-V248 VanDerWaalsContact OG-CG2 3.29Å; S206-V248 WeakPolarHBondContact OG-CG2 3.46Å
207	L	96.8	Very high	91.2	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	134.6	-178	174.6	68.2	0	0	0	108.8	Y173 V209 V216 V217	Y173-L207 VanDerWaalsContact C-CD2 3.49Å; Y173-L207 VanDerWaalsContact O-CD2 3.3Å; Y173-L207 WeakPolarHBondContact O-CD2 2.88Å; L207-V209 HydrophobicContact CD1-CG2 4.4Å; L207-V216 HydrophobicContact CD1-CG1 3.81Å; L207-V217 WeakPolarHBondContact CA-O 3.14Å
208	D	96.8	Very high	91.6	Very high	19 Å²	19	49.5 Å²	49.5	10%	0.102	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155	164.8	-157.7	18.5	0	0	0	111.3	K163 V217 V248 A249 L250	K163-D208 WeakPolarHBondContact CE-OD1 3.35Å; D208-V217 PolarHBondContact N-O 3.38Å; D208-V217 PolarHBondContact O-N 2.83Å; D208-V248 WeakPolarHBondContact CB-O 3.32Å; D208-A249 WeakPolarHBondContact OD2-CA 3.32Å; D208-L250 PolarHBondContact OD2-N 2.84Å
209	V	95.5	Very high	92.4	Very high	17 Å²	17	41.9 Å²	41.9	10%	0.103	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	131.5	-174.1	-176.9	0	0	0	0	109.2	K163 P166 Y173 L207 M215 V216 M230	K163-V209 HydrophobicContact CB-CG2 4.37Å; P166-V209 HydrophobicContact CG-CG1 4.46Å; Y173-V209 HydrophobicContact CD1-CG2 4.42Å; Y173-V209 HydrophobicContact CD2-CB 4.38Å; Y173-V209 HydrophobicContact CD2-CG1 4.22Å; Y173-V209 HydrophobicContact CD2-CG2 3.67Å; Y173-V209 HydrophobicContact CE2-CG1 3.87Å; Y173-V209 HydrophobicContact CE2-CG2 4.12Å; Y173-V209 HydrophobicContact CG-CG2 3.83Å; L207-V209 HydrophobicContact CD1-CG2 4.4Å; V209-M215 WeakPolarHBondContact CA-O 3.36Å; V209-V216 HydrophobicContact CG1-CG2 4.25Å; V209-V216 HydrophobicContact CG2-CG1 4.26Å; V209-V216 HydrophobicContact CG2-CG2 4.17Å; V209-M230 HydrophobicContact CG1-CE 3.37Å
210	S	92.9	Very high	92.9	Very high	11 Å²	11	38.4 Å²	38.4	8%	0.077	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.9	173.7	172.4	0	0	0	0	111	S212 S213 R214 M215 M230	S210-S212 PolarHBondContact OG-N 2.93Å; S210-S212 PolarHBondContact OG-OG 3.3Å; S210-S213 VanDerWaalsContact CB-OG 3.24Å; S210-S213 WeakPolarHBondContact CB-OG 3.47Å; S210-S213 PolarHBondContact OG-N 2.97Å; S210-S213 PolarHBondContact OG-OG 3.06Å; S210-R214 WeakPolarHBondContact O-CA 3.2Å; S210-R214 PolarHBondContact O-N 3.14Å; S210-R214 VanDerWaalsContact O-N 3.14Å; S210-M215 PolarHBondContact N-O 2.88Å; S210-M215 PolarHBondContact O-N 2.63Å; S210-M230 WeakPolarHBondContact O-CE 3.35Å
211	A	87.8	Confident	93.6	Very high	51 Å²	51	31.7 Å²	31.7	42%	0.421	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-40.5	177.4	0	0	0	0	0	112.3	P166	P166-A211 HydrophobicContact CB-CB 3.47Å; P166-A211 VanDerWaalsContact CB-CB 3.47Å; P166-A211 HydrophobicContact CG-CB 3.85Å
212	S	88.1	Confident	93.9	Very high	74 Å²	74	27.5 Å²	27.5	52%	0.517	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-49.4	-177	43	0	0	0	0	111.4	S210 R214 D255	S210-S212 PolarHBondContact OG-N 2.93Å; S210-S212 PolarHBondContact OG-OG 3.3Å; S212-R214 VanDerWaalsContact C-N 3.33Å; S212-D255 WeakPolarHBondContact CB-OD1 3.49Å; S212-D255 PolarHBondContact OG-OD1 3.37Å
213	S	85.4	Confident	94	Very high	22 Å²	22	25.3 Å²	25.3	15%	0.154	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9	-178.4	71	0	0	0	0	114	S210 M215	S210-S213 VanDerWaalsContact CB-OG 3.24Å; S210-S213 WeakPolarHBondContact CB-OG 3.47Å; S210-S213 PolarHBondContact OG-N 2.97Å; S210-S213 PolarHBondContact OG-OG 3.06Å; S213-M215 WeakPolarHBondContact O-CG 3.44Å; S213-M215 PolarHBondContact O-N 3.35Å; S213-M215 WeakPolarHBondContact OG-CB 3.21Å; S213-M215 WeakPolarHBondContact OG-CG 3.23Å
214	R	91.2	Very high	94	Very high	145 Å²	145	23.8 Å²	23.8	55%	0.547	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	36.4	-173.3	-59	-175.2	178.8	-163	0.1	113.1	S210 S212 N229 M230	S210-R214 WeakPolarHBondContact O-CA 3.2Å; S210-R214 PolarHBondContact O-N 3.14Å; S210-R214 VanDerWaalsContact O-N 3.14Å; S212-R214 VanDerWaalsContact C-N 3.33Å; R214-N229 PolarHBondContact O-OD1 3.13Å; R214-M230 VanDerWaalsContact CA-SD 3.57Å; R214-M230 HydrophobicContact CB-CB 4.35Å; R214-M230 HydrophobicContact CB-CG 4.17Å; R214-M230 HydrophobicContact CB-SD 3.76Å; R214-M230 HydrophobicContact CG-SD 4.03Å; R214-M230 WeakPolarHBondContact O-CG 3.31Å; R214-M230 PolarHBondContact O-N 2.93Å
215	M	93.3	Very high	94	Very high	43 Å²	43	23.6 Å²	23.6	21%	0.212	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	143.8	-179	-67	178.5	-177.6	0	0	111.7	V209 S210 S213 L227 L272	V209-M215 WeakPolarHBondContact CA-O 3.36Å; S210-M215 PolarHBondContact N-O 2.88Å; S210-M215 PolarHBondContact O-N 2.63Å; S213-M215 WeakPolarHBondContact O-CG 3.44Å; S213-M215 PolarHBondContact O-N 3.35Å; S213-M215 WeakPolarHBondContact OG-CB 3.21Å; S213-M215 WeakPolarHBondContact OG-CG 3.23Å; M215-L227 HydrophobicContact CB-CD1 4.03Å; M215-L227 HydrophobicContact CG-CD1 4.31Å; M215-L227 HydrophobicContact SD-CD1 4.06Å; M215-L227 HydrophobicContact SD-CD2 4.18Å; M215-L272 HydrophobicContact SD-CD1 3.76Å
216	V	95.7	Very high	93.9	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.5	169.4	179.7	0	0	0	0	107.1	Y173 F194 L207 V209 L228 M230	Y173-V216 HydrophobicContact CD1-CG2 4.31Å; Y173-V216 HydrophobicContact CE1-CG2 3.83Å; F194-V216 HydrophobicContact CD1-CB 4.49Å; F194-V216 HydrophobicContact CD1-CG2 4.45Å; F194-V216 HydrophobicContact CE1-CG2 4.12Å; L207-V216 HydrophobicContact CD1-CG1 3.81Å; V209-V216 HydrophobicContact CG1-CG2 4.25Å; V209-V216 HydrophobicContact CG2-CG1 4.26Å; V209-V216 HydrophobicContact CG2-CG2 4.17Å; V216-L228 PolarHBondContact N-O 3.1Å; V216-L228 PolarHBondContact O-N 3.17Å; V216-L228 VanDerWaalsContact O-O 3.13Å; V216-M230 HydrophobicContact CG2-CG 4.13Å
217	V	96.2	Very high	94	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.7	176.6	-167.2	0	0	0	0	108.6	L207 D208 V225 I226 L227 V248 L250 L258	L207-V217 WeakPolarHBondContact CA-O 3.14Å; D208-V217 PolarHBondContact N-O 3.38Å; D208-V217 PolarHBondContact O-N 2.83Å; V217-V225 HydrophobicContact CG1-CG1 3.46Å; V217-V225 VanDerWaalsContact CG1-CG1 3.46Å; V217-I226 WeakPolarHBondContact CA-O 3.34Å; V217-L227 HydrophobicContact CB-CD1 4.41Å; V217-L227 HydrophobicContact CG2-CD1 3.42Å; V217-L227 VanDerWaalsContact CG2-CD1 3.42Å; V217-V248 HydrophobicContact CB-CG1 3.76Å; V217-V248 HydrophobicContact CG1-CG1 3.48Å; V217-V248 VanDerWaalsContact CG1-CG1 3.48Å; V217-V248 HydrophobicContact CG2-CG1 4.44Å; V217-L250 HydrophobicContact CG2-CD1 3.92Å; V217-L250 HydrophobicContact CG2-CD2 3.87Å; V217-L250 HydrophobicContact CG2-CG 4.01Å; V217-L258 HydrophobicContact CG1-CD2 4.28Å; V217-L258 HydrophobicContact CG2-CD1 4.37Å
218	T	96.8	Very high	93.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.5	169.5	-168.3	0	0	0	0	111.7	T181 A195 F204 S206 V225 I226 L228	T181-T218 HydrophobicContact CG2-CG2 3.89Å; T181-T218 WeakPolarHBondContact CG2-OG1 3.42Å; A195-T218 HydrophobicContact CB-CG2 4.14Å; F204-T218 HydrophobicContact CD1-CG2 3.69Å; F204-T218 WeakPolarHBondContact CD1-OG1 3.47Å; F204-T218 HydrophobicContact CE1-CG2 3.92Å; F204-T218 HydrophobicContact CG-CG2 4.47Å; S206-T218 VanDerWaalsContact O-CA 3.26Å; S206-T218 WeakPolarHBondContact O-CA 3.46Å; S206-T218 PolarHBondContact O-OG1 2.97Å; T218-V225 CarbonylContact O-C 3.45Å; T218-V225 VanDerWaalsContact O-CA 3.31Å; T218-V225 WeakPolarHBondContact O-CA 3.49Å; T218-V225 WeakPolarHBondContact O-CG1 3.36Å; T218-I226 HydrophobicContact CG2-CB 3.9Å; T218-I226 HydrophobicContact CG2-CG1 4.38Å; T218-I226 PolarHBondContact N-O 3.42Å; T218-I226 PolarHBondContact O-N 2.84Å; T218-L228 HydrophobicContact CG2-CD1 4.28Å
219	G	96.2	Very high	93.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.3	179.1	0	0	0	0	0	112.2	F204 C205 S206 N224	F204-G219 CarbonylContact C-O 3.55Å; F204-G219 WeakPolarHBondContact CA-O 3.48Å; C205-G219 PolarHBondContact N-O 3.04Å; S206-G219 PolarHBondContact N-O 2.85Å; S206-G219 PolarHBondContact O-N 3.43Å; S206-G219 VanDerWaalsContact O-N 3.16Å; S206-G219 WeakPolarHBondContact OG-CA 3.44Å; S206-G219 PolarHBondContact OG-N 2.88Å; G219-N224 CarbonylContact C-O 3.54Å; G219-N224 VanDerWaalsContact CA-O 3.31Å; G219-N224 WeakPolarHBondContact CA-O 3.24Å
220	D	95.9	Very high	93.5	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.032	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	165.7	-163.3	-57.6	8.7	0	0	0	111.7	I202 W203 F204 V222 G223 N224 K244 V245	I202-D220 HydrophobicContact CG2-CB 4.33Å; W203-D220 WeakPolarHBondContact O-CA 3.29Å; F204-D220 WeakPolarHBondContact CD1-OD1 3.43Å; F204-D220 WeakPolarHBondContact CE1-OD1 3.38Å; D220-V222 PolarHBondContact O-N 3.13Å; D220-G223 PolarHBondContact O-N 3.4Å; D220-N224 HydrophobicContact CB-CB 4.3Å; D220-N224 PolarHBondContact N-O 3.03Å; D220-K244 WeakPolarHBondContact O-CA 3.48Å; D220-V245 PolarHBondContact O-N 2.91Å
221	N	95.7	Very high	93.3	Very high	27 Å²	27	29 Å²	29	14%	0.144	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.1	171.1	70.6	-24	0	0	0	114.3	N201 I202 W203 K244	N201-N221 PolarHBondContact O-ND2 3.38Å; I202-N221 WeakPolarHBondContact CA-OD1 3.25Å; W203-N221 HydrophobicContact CD2-CB 4.04Å; W203-N221 HydrophobicContact CG-CB 4.49Å; W203-N221 HydrophobicContact CH2-CB 4.33Å; W203-N221 VanDerWaalsContact CH2-ND2 3.28Å; W203-N221 WeakPolarHBondContact CH2-ND2 3.31Å; W203-N221 HydrophobicContact CZ2-CB 3.82Å; W203-N221 WeakPolarHBondContact CZ3-ND2 3.34Å; W203-N221 PolarHBondContact N-OD1 3.25Å; W203-N221 PolarHBondContact O-N 2.83Å; N221-K244 HydrophobicContact CB-CB 4.46Å; N221-K244 HydrophobicContact CB-CD 4.49Å; N221-K244 WeakPolarHBondContact O-CA 3.22Å; N221-K244 WeakPolarHBondContact O-CB 3.35Å; N221-K244 PolarHBondContact O-N 3.2Å
222	V	95	Very high	93.3	Very high	43 Å²	43	27.7 Å²	27.7	26%	0.261	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-21	177.6	179.5	0	0	0	0	112.3	I202 D220	I202-V222 HydrophobicContact CD1-CG2 4.39Å; I202-V222 HydrophobicContact CG1-CG2 4.06Å; D220-V222 PolarHBondContact O-N 3.13Å
223	G	93.8	Very high	93.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	106.6	7.6	-175.2	0	0	0	0	0	114.7	D220 M240 H241 K243	D220-G223 PolarHBondContact O-N 3.4Å; G223-M240 PolarHBondContact O-N 2.82Å; G223-M240 VanDerWaalsContact O-N 3.09Å; G223-H241 PolarHBondContact O-N 2.94Å; G223-K243 WeakPolarHBondContact CA-O 3.34Å
224	N	94.5	Very high	93.8	Very high	25 Å²	25	35.2 Å²	35.2	13%	0.134	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	150.3	170.6	-60.6	-13	0	0	0	110.2	G219 D220 L238 R239	G219-N224 CarbonylContact C-O 3.54Å; G219-N224 VanDerWaalsContact CA-O 3.31Å; G219-N224 WeakPolarHBondContact CA-O 3.24Å; D220-N224 HydrophobicContact CB-CB 4.3Å; D220-N224 PolarHBondContact N-O 3.03Å; N224-L238 WeakPolarHBondContact CA-O 3.31Å; N224-R239 WeakPolarHBondContact OD1-CA 3.36Å; N224-R239 WeakPolarHBondContact OD1-CB 3.34Å; N224-R239 WeakPolarHBondContact OD1-CG 3.28Å; N224-R239 PolarHBondContact OD1-NE 2.69Å
225	V	95.5	Very high	93.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.2	170.8	177.5	0	0	0	0	106.6	V217 T218 W236 L238 M240 V245 T260	V217-V225 HydrophobicContact CG1-CG1 3.46Å; V217-V225 VanDerWaalsContact CG1-CG1 3.46Å; T218-V225 CarbonylContact O-C 3.45Å; T218-V225 VanDerWaalsContact O-CA 3.31Å; T218-V225 WeakPolarHBondContact O-CA 3.49Å; T218-V225 WeakPolarHBondContact O-CG1 3.36Å; V225-W236 HydrophobicContact CB-CZ3 4.17Å; V225-W236 HydrophobicContact CG1-CH2 4.08Å; V225-W236 HydrophobicContact CG1-CZ3 3.94Å; V225-W236 VanDerWaalsContact O-CZ3 3.29Å; V225-W236 WeakPolarHBondContact O-CZ3 3.42Å; V225-L238 PolarHBondContact N-O 3.4Å; V225-L238 PolarHBondContact O-N 2.86Å; V225-M240 HydrophobicContact CB-CE 4.4Å; V225-M240 HydrophobicContact CB-CG 4.1Å; V225-M240 HydrophobicContact CB-SD 3.62Å; V225-M240 HydrophobicContact CG1-SD 4.02Å; V225-M240 HydrophobicContact CG2-CB 4.04Å; V225-M240 HydrophobicContact CG2-CG 4.08Å; V225-M240 HydrophobicContact CG2-SD 3.64Å; V225-V245 HydrophobicContact CG2-CG1 4.33Å; V225-V245 HydrophobicContact CG2-CG2 3.92Å; V225-T260 HydrophobicContact CG2-CG2 4.33Å
226	I	95.1	Very high	93.7	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.041	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.5	179.9	-46.7	-175.4	0	0	0	107.4	A195 F204 V217 T218 L228 E234 W236 N237	A195-I226 HydrophobicContact CB-CD1 4.1Å; F204-I226 HydrophobicContact CE1-CD1 3.65Å; F204-I226 HydrophobicContact CZ-CD1 4.11Å; V217-I226 WeakPolarHBondContact CA-O 3.34Å; T218-I226 HydrophobicContact CG2-CB 3.9Å; T218-I226 HydrophobicContact CG2-CG1 4.38Å; T218-I226 PolarHBondContact N-O 3.42Å; T218-I226 PolarHBondContact O-N 2.84Å; I226-L228 HydrophobicContact CB-CD1 4.21Å; I226-L228 HydrophobicContact CG2-CD1 3.72Å; I226-L228 HydrophobicContact CG2-CD2 4.41Å; I226-L228 HydrophobicContact CG2-CG 3.96Å; I226-E234 HydrophobicContact CG2-CG 3.89Å; I226-W236 WeakPolarHBondContact CA-O 3.35Å; I226-N237 HydrophobicContact CG1-CB 4.16Å; I226-N237 HydrophobicContact CG2-CB 4.33Å
227	L	95.1	Very high	93.6	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.5	172.5	-177.8	75.2	0	0	0	109	M215 V217 L235 W236 L272	M215-L227 HydrophobicContact CB-CD1 4.03Å; M215-L227 HydrophobicContact CG-CD1 4.31Å; M215-L227 HydrophobicContact SD-CD1 4.06Å; M215-L227 HydrophobicContact SD-CD2 4.18Å; V217-L227 HydrophobicContact CB-CD1 4.41Å; V217-L227 HydrophobicContact CG2-CD1 3.42Å; V217-L227 VanDerWaalsContact CG2-CD1 3.42Å; L227-L235 HydrophobicContact CD2-CB 4.17Å; L227-L235 HydrophobicContact CD2-CD1 3.7Å; L227-L235 HydrophobicContact CG-CB 4.37Å; L227-L235 HydrophobicContact CG-CD1 4.05Å; L227-L235 PolarHBondContact O-N 3Å; L227-W236 HydrophobicContact CB-CD2 3.68Å; L227-W236 HydrophobicContact CB-CE3 3.99Å; L227-W236 HydrophobicContact CB-CG 4.32Å; L227-W236 HydrophobicContact CB-CH2 3.71Å; L227-W236 HydrophobicContact CB-CZ2 3.41Å; L227-W236 VanDerWaalsContact CB-CZ2 3.41Å; L227-W236 HydrophobicContact CB-CZ3 3.99Å; L227-W236 HydrophobicContact CD2-CZ2 3.65Å; L227-W236 HydrophobicContact CG-CZ2 4.03Å; L227-W236 PolarHBondContact N-O 2.88Å; L227-W236 PolarHBondContact O-N 3.49Å; L227-L272 HydrophobicContact CD2-CD2 4.35Å
228	L	94.8	Very high	93.5	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	149.1	178.6	-52	104.1	0	0	0	109.8	F194 V216 T218 I226 K233 E234	F194-L228 HydrophobicContact CB-CD1 4.41Å; F194-L228 HydrophobicContact CB-CD2 4.04Å; F194-L228 HydrophobicContact CD1-CB 4.15Å; F194-L228 HydrophobicContact CD1-CD2 4.38Å; F194-L228 WeakPolarHBondContact O-CD2 3.46Å; V216-L228 PolarHBondContact N-O 3.1Å; V216-L228 PolarHBondContact O-N 3.17Å; V216-L228 VanDerWaalsContact O-O 3.13Å; T218-L228 HydrophobicContact CG2-CD1 4.28Å; I226-L228 HydrophobicContact CB-CD1 4.21Å; I226-L228 HydrophobicContact CG2-CD1 3.72Å; I226-L228 HydrophobicContact CG2-CD2 4.41Å; I226-L228 HydrophobicContact CG2-CG 3.96Å; L228-K233 WeakPolarHBondContact CA-O 3.4Å; L228-E234 HydrophobicContact CD2-CB 4.28Å
229	N	93.7	Very high	93.3	Very high	41 Å²	41	43.7 Å²	43.7	22%	0.219	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	154.7	163.5	-173.1	10.8	0	0	0	109.2	F194 R214 D231 G232 K233	F194-N229 WeakPolarHBondContact CE1-O 3.48Å; R214-N229 PolarHBondContact O-OD1 3.13Å; N229-D231 PolarHBondContact ND2-OD2 3.27Å; N229-D231 PolarHBondContact O-N 3.17Å; N229-G232 PolarHBondContact O-N 3.18Å; N229-K233 PolarHBondContact N-O 3.31Å
230	M	91.4	Very high	93	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.049	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.1	172.9	-80.9	178.3	176.6	0	0	113	L167 R192 F194 V209 S210 R214 V216 G232	L167-M230 HydrophobicContact CD1-CE 4.43Å; L167-M230 HydrophobicContact CD1-SD 3.56Å; L167-M230 VanDerWaalsContact CD1-SD 3.56Å; R192-M230 PolarHBondContact NH1-O 2.94Å; F194-M230 WeakPolarHBondContact CE1-O 3.29Å; F194-M230 VanDerWaalsContact CZ-O 3.31Å; F194-M230 WeakPolarHBondContact CZ-O 3.48Å; V209-M230 HydrophobicContact CG1-CE 3.37Å; S210-M230 WeakPolarHBondContact O-CE 3.35Å; R214-M230 VanDerWaalsContact CA-SD 3.57Å; R214-M230 HydrophobicContact CB-CB 4.35Å; R214-M230 HydrophobicContact CB-CG 4.17Å; R214-M230 HydrophobicContact CB-SD 3.76Å; R214-M230 HydrophobicContact CG-SD 4.03Å; R214-M230 WeakPolarHBondContact O-CG 3.31Å; R214-M230 PolarHBondContact O-N 2.93Å; V216-M230 HydrophobicContact CG2-CG 4.13Å; M230-G232 PolarHBondContact O-N 3.21Å
231	D	87.9	Confident	93	Very high	107 Å²	107	43.5 Å²	43.5	57%	0.572	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.3	174.2	-59.2	-39.8	0	0	0	113.9	R192 N229	R192-D231 VanDerWaalsContact NH1-CA 3.3Å; R192-D231 PolarHBondContact NH1-O 3.08Å; N229-D231 PolarHBondContact ND2-OD2 3.27Å; N229-D231 PolarHBondContact O-N 3.17Å
232	G	86.9	Confident	92.9	Very high	25 Å²	25	50 Å²	50	26%	0.258	24%	0.243	S	C	.	.	S	Bend	trans	92.6	-4.8	-179.9	0	0	0	0	0	114.1	N229 M230 E234	N229-G232 PolarHBondContact O-N 3.18Å; M230-G232 PolarHBondContact O-N 3.21Å; G232-E234 PolarHBondContact O-N 3.3Å
233	K	91	Very high	92.9	Very high	153 Å²	153	53.3 Å²	53.3	67%	0.665	25%	0.254	S	S	*	.			trans	-70.3	120	174.6	-171.6	176.7	-179.4	-179.8	0	110	L228 N229 L235	L228-K233 WeakPolarHBondContact CA-O 3.4Å; N229-K233 PolarHBondContact N-O 3.31Å; K233-L235 PolarHBondContact O-N 2.85Å
234	E	93.5	Very high	93	Very high	101 Å²	101	56.7 Å²	56.7	47%	0.472	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.8	170.1	-171.9	-177.2	139	0	0	109.6	I226 L228 G232 N237	I226-E234 HydrophobicContact CG2-CG 3.89Å; L228-E234 HydrophobicContact CD2-CB 4.28Å; G232-E234 PolarHBondContact O-N 3.3Å; E234-N237 WeakPolarHBondContact OE1-CB 3.31Å; E234-N237 PolarHBondContact OE1-N 2.91Å
235	L	91.1	Very high	93.2	Very high	87 Å²	87	55.5 Å²	55.5	46%	0.455	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-43.3	173.8	-63.5	178.8	0	0	0	110.2	L227 K233	L227-L235 HydrophobicContact CD2-CB 4.17Å; L227-L235 HydrophobicContact CD2-CD1 3.7Å; L227-L235 HydrophobicContact CG-CB 4.37Å; L227-L235 HydrophobicContact CG-CD1 4.05Å; L227-L235 PolarHBondContact O-N 3Å; K233-L235 PolarHBondContact O-N 2.85Å
236	W	92.3	Very high	93.3	Very high	39 Å²	39	56.1 Å²	56.1	15%	0.148	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	157.3	173.2	47.2	-100.6	0	0	0	112.3	V225 I226 L227 L238 M240 L272	V225-W236 HydrophobicContact CB-CZ3 4.17Å; V225-W236 HydrophobicContact CG1-CH2 4.08Å; V225-W236 HydrophobicContact CG1-CZ3 3.94Å; V225-W236 VanDerWaalsContact O-CZ3 3.29Å; V225-W236 WeakPolarHBondContact O-CZ3 3.42Å; I226-W236 WeakPolarHBondContact CA-O 3.35Å; L227-W236 HydrophobicContact CB-CD2 3.68Å; L227-W236 HydrophobicContact CB-CE3 3.99Å; L227-W236 HydrophobicContact CB-CG 4.32Å; L227-W236 HydrophobicContact CB-CH2 3.71Å; L227-W236 HydrophobicContact CB-CZ2 3.41Å; L227-W236 VanDerWaalsContact CB-CZ2 3.41Å; L227-W236 HydrophobicContact CB-CZ3 3.99Å; L227-W236 HydrophobicContact CD2-CZ2 3.65Å; L227-W236 HydrophobicContact CG-CZ2 4.03Å; L227-W236 PolarHBondContact N-O 2.88Å; L227-W236 PolarHBondContact O-N 3.49Å; W236-L238 HydrophobicContact CB-CD1 4.39Å; W236-L238 HydrophobicContact CB-CG 4.31Å; W236-L238 HydrophobicContact CD2-CD1 4.13Å; W236-L238 HydrophobicContact CD2-CG 4.44Å; W236-L238 HydrophobicContact CE3-CB 4.12Å; W236-L238 HydrophobicContact CE3-CD1 4Å; W236-L238 HydrophobicContact CE3-CG 3.98Å; W236-L238 HydrophobicContact CG-CD1 4.33Å; W236-M240 HydrophobicContact CE3-CE 4.49Å; W236-M240 HydrophobicContact CH2-CE 3.25Å; W236-M240 HydrophobicContact CZ2-CE 4.13Å; W236-M240 HydrophobicContact CZ3-CE 3.46Å; W236-M240 VanDerWaalsContact CZ3-CE 3.46Å; W236-L272 HydrophobicContact CH2-CD2 4.39Å; W236-L272 HydrophobicContact CZ2-CD2 3.75Å
237	N	92.9	Very high	93.4	Very high	69 Å²	69	57.1 Å²	57.1	37%	0.369	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	111.4	169.6	176.7	-5.5	0	0	0	108.9	I226 E234	I226-N237 HydrophobicContact CG1-CB 4.16Å; I226-N237 HydrophobicContact CG2-CB 4.33Å; E234-N237 WeakPolarHBondContact OE1-CB 3.31Å; E234-N237 PolarHBondContact OE1-N 2.91Å
238	L	93.6	Very high	93.5	Very high	41 Å²	41	57 Å²	57	22%	0.215	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.2	-172.2	-64.6	174.1	0	0	0	111.4	N224 V225 W236 M240 V275	N224-L238 WeakPolarHBondContact CA-O 3.31Å; V225-L238 PolarHBondContact N-O 3.4Å; V225-L238 PolarHBondContact O-N 2.86Å; W236-L238 HydrophobicContact CB-CD1 4.39Å; W236-L238 HydrophobicContact CB-CG 4.31Å; W236-L238 HydrophobicContact CD2-CD1 4.13Å; W236-L238 HydrophobicContact CD2-CG 4.44Å; W236-L238 HydrophobicContact CE3-CB 4.12Å; W236-L238 HydrophobicContact CE3-CD1 4Å; W236-L238 HydrophobicContact CE3-CG 3.98Å; W236-L238 HydrophobicContact CG-CD1 4.33Å; L238-M240 PolarHBondContact O-N 3.36Å; L238-V275 HydrophobicContact CD1-CB 4.47Å; L238-V275 HydrophobicContact CD1-CG1 3.44Å; L238-V275 VanDerWaalsContact CD1-CG1 3.44Å
239	R	93.1	Very high	93.5	Very high	131 Å²	131	57.1 Å²	57.1	49%	0.494	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	93.7	172.5	-170.7	172.9	-77.3	-175.1	-1	110.9	N224 H241 K278	N224-R239 WeakPolarHBondContact OD1-CA 3.36Å; N224-R239 WeakPolarHBondContact OD1-CB 3.34Å; N224-R239 WeakPolarHBondContact OD1-CG 3.28Å; N224-R239 PolarHBondContact OD1-NE 2.69Å; R239-H241 WeakPolarHBondContact CG-O 3.17Å; R239-K278 WeakPolarHBondContact O-CB 3.42Å; R239-K278 VanDerWaalsContact O-CG 3.26Å; R239-K278 WeakPolarHBondContact O-CG 2.98Å
240	M	91.1	Very high	93.6	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	26%	0.264	C	S	.	.			trans	-82.7	-36.6	-179	-73.5	-167.6	170.5	0	0	113.3	G223 V225 W236 L238 T260 K268 W270 V275	G223-M240 PolarHBondContact O-N 2.82Å; G223-M240 VanDerWaalsContact O-N 3.09Å; V225-M240 HydrophobicContact CB-CE 4.4Å; V225-M240 HydrophobicContact CB-CG 4.1Å; V225-M240 HydrophobicContact CB-SD 3.62Å; V225-M240 HydrophobicContact CG1-SD 4.02Å; V225-M240 HydrophobicContact CG2-CB 4.04Å; V225-M240 HydrophobicContact CG2-CG 4.08Å; V225-M240 HydrophobicContact CG2-SD 3.64Å; W236-M240 HydrophobicContact CE3-CE 4.49Å; W236-M240 HydrophobicContact CH2-CE 3.25Å; W236-M240 HydrophobicContact CZ2-CE 4.13Å; W236-M240 HydrophobicContact CZ3-CE 3.46Å; W236-M240 VanDerWaalsContact CZ3-CE 3.46Å; L238-M240 PolarHBondContact O-N 3.36Å; M240-T260 HydrophobicContact SD-CG2 4.19Å; M240-K268 PolarHBondContact O-NZ 2.82Å; M240-W270 HydrophobicContact CB-CH2 3.92Å; M240-W270 HydrophobicContact CB-CZ2 3.53Å; M240-W270 HydrophobicContact CE-CD2 3.96Å; M240-W270 HydrophobicContact CE-CE3 4.12Å; M240-W270 HydrophobicContact CE-CG 4.31Å; M240-W270 HydrophobicContact CE-CZ3 4.48Å; M240-W270 HydrophobicContact CG-CH2 3.81Å; M240-W270 HydrophobicContact CG-CZ2 3.64Å; M240-W270 HydrophobicContact CG-CZ3 4.37Å; M240-W270 HydrophobicContact SD-CD2 3.92Å; M240-W270 VanDerWaalsContact SD-CE2 3.52Å; M240-W270 HydrophobicContact SD-CE3 4.45Å; M240-W270 HydrophobicContact SD-CG 4.34Å; M240-W270 HydrophobicContact SD-CH2 4.3Å; M240-W270 HydrophobicContact SD-CZ2 3.74Å; M240-V275 HydrophobicContact CE-CG1 3.92Å
241	H	94.3	Very high	93.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.264	C	S	.	.			trans	-122.7	165.6	-175.9	-75.7	-85.8	0	0	0	112.1	G223 R239 V245 T260 S262 D264 T266	G223-H241 PolarHBondContact O-N 2.94Å; R239-H241 WeakPolarHBondContact CG-O 3.17Å; H241-V245 HydrophobicContact CB-CG2 4.47Å; H241-T260 PolarHBondContact NE2-OG1 2.91Å; H241-S262 VanDerWaalsContact CG-CB 3.46Å; H241-S262 VanDerWaalsContact ND1-CB 3.26Å; H241-S262 WeakPolarHBondContact ND1-CB 3.06Å; H241-D264 WeakPolarHBondContact CB-OD2 3.01Å; H241-D264 IonicContact CE1-OD1 3.59Å; H241-D264 IonicContact CG-OD2 3.67Å; H241-D264 VanDerWaalsContact ND1-CG 3.35Å; H241-D264 IonicContact ND1-OD1 3.47Å; H241-D264 PolarHBondContact ND1-OD1 2.74Å; H241-D264 VanDerWaalsContact ND1-OD1 3.16Å; H241-D264 IonicContact ND1-OD2 2.84Å; H241-D264 PolarHBondContact ND1-OD2 3.11Å; H241-T266 PolarHBondContact CE1-OG1 3Å; H241-T266 VanDerWaalsContact CE1-OG1 3.24Å; H241-T266 PolarHBondContact ND1-OG1 3.36Å
242	K	94.2	Very high	93.9	Very high	164 Å²	164	54.2 Å²	54.2	71%	0.713	26%	0.26	S	S	*	.	S	Bend	trans	-88.2	-17	177.3	-66.8	-178.3	-178.5	177.4	0	113.2	D264	K242-D264 HydrophobicContact CB-CB 4.31Å; K242-D264 PolarHBondContact N-OD2 3.28Å; K242-D264 VanDerWaalsContact N-OD2 3.12Å
243	K	95.9	Very high	94.2	Very high	113 Å²	113	57.1 Å²	57.1	49%	0.491	28%	0.275	S	S	.	.	S	Bend	trans	-138.4	172.9	-177.5	-62.4	-172.7	178.1	-178.6	0	109.3	G223 V245 S262 V263 D264	G223-K243 WeakPolarHBondContact CA-O 3.34Å; K243-V245 PolarHBondContact O-N 2.87Å; K243-S262 PolarHBondContact O-OG 3.21Å; K243-V263 HydrophobicContact CB-CB 4.08Å; K243-V263 HydrophobicContact CD-CB 4.35Å; K243-V263 HydrophobicContact CD-CG1 4.08Å; K243-D264 HydrophobicContact CB-CB 4.15Å; K243-D264 HydrophobicContact CD-CB 4.48Å; K243-D264 HydrophobicContact CG-CB 4.2Å
244	K	96.1	Very high	94.2	Very high	70 Å²	70	51.1 Å²	51.1	30%	0.304	25%	0.252	S	S	.	.			trans	-35.2	123.6	175.7	172.5	167	169	159.7	0	113.8	C205 D220 N221 T246 S262 V263	C205-K244 HydrophobicContact CB-CD 4.34Å; C205-K244 HydrophobicContact CB-CG 4.19Å; C205-K244 WeakPolarHBondContact SG-CE 3.31Å; C205-K244 PolarHBondContact SG-NZ 2.89Å; D220-K244 WeakPolarHBondContact O-CA 3.48Å; N221-K244 HydrophobicContact CB-CB 4.46Å; N221-K244 HydrophobicContact CB-CD 4.49Å; N221-K244 WeakPolarHBondContact O-CA 3.22Å; N221-K244 WeakPolarHBondContact O-CB 3.35Å; N221-K244 PolarHBondContact O-N 3.2Å; K244-T246 HydrophobicContact CG-CG2 4.42Å; K244-S262 VanDerWaalsContact O-CA 3.3Å; K244-S262 WeakPolarHBondContact O-CA 3.29Å; K244-S262 WeakPolarHBondContact O-CB 3.23Å; K244-S262 PolarHBondContact O-OG 3.49Å; K244-V263 HydrophobicContact CB-CG2 4.07Å; K244-V263 HydrophobicContact CG-CG2 4.4Å; K244-V263 PolarHBondContact O-N 3Å
245	V	97.5	Very high	94	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	117.8	168.1	-169.4	0	0	0	0	107.5	C205 D220 V225 H241 K243 V248 A261	C205-V245 WeakPolarHBondContact CB-O 3.38Å; D220-V245 PolarHBondContact O-N 2.91Å; V225-V245 HydrophobicContact CG2-CG1 4.33Å; V225-V245 HydrophobicContact CG2-CG2 3.92Å; H241-V245 HydrophobicContact CB-CG2 4.47Å; K243-V245 PolarHBondContact O-N 2.87Å; V245-V248 HydrophobicContact CG1-CG2 3.7Å; V245-A261 CarbonylContact C-O 3.35Å; V245-A261 WeakPolarHBondContact CA-O 3.04Å; V245-A261 WeakPolarHBondContact CG1-O 3.23Å
246	T	97.2	Very high	93.9	Very high	13 Å²	13	49.8 Å²	49.8	8%	0.08	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-30.7	-175.2	50.3	0	0	0	0	112	K244 A261 V263 V291 N292	K244-T246 HydrophobicContact CG-CG2 4.42Å; T246-A261 PolarHBondContact N-O 3.43Å; T246-A261 PolarHBondContact OG1-O 3.35Å; T246-V263 HydrophobicContact CG2-CG2 3.61Å; T246-V291 WeakPolarHBondContact CB-O 3.35Å; T246-V291 WeakPolarHBondContact CG2-O 3.33Å; T246-V291 PolarHBondContact OG1-O 3.35Å; T246-N292 PolarHBondContact OG1-O 3.29Å
247	H	97.3	Very high	94	Very high	30 Å²	30	48.5 Å²	48.5	14%	0.139	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	151.2	178	-158.2	55.4	0	0	0	111.2	A261 A294	H247-A261 HydrophobicContact CB-CB 4.21Å; H247-A261 PolarHBondContact O-N 2.77Å; H247-A294 PolarHBondContact CD2-O 3.24Å
248	V	97.1	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.4	175.9	173.7	0	0	0	0	104.8	S206 D208 V217 V245 L258 A259 T260	S206-V248 VanDerWaalsContact OG-CG2 3.29Å; S206-V248 WeakPolarHBondContact OG-CG2 3.46Å; D208-V248 WeakPolarHBondContact CB-O 3.32Å; V217-V248 HydrophobicContact CB-CG1 3.76Å; V217-V248 HydrophobicContact CG1-CG1 3.48Å; V217-V248 VanDerWaalsContact CG1-CG1 3.48Å; V217-V248 HydrophobicContact CG2-CG1 4.44Å; V245-V248 HydrophobicContact CG1-CG2 3.7Å; V248-L258 HydrophobicContact CG1-CD1 3.33Å; V248-L258 HydrophobicContact CG1-CD2 4.42Å; V248-L258 HydrophobicContact CG1-CG 4.32Å; V248-A259 WeakPolarHBondContact CA-O 3.28Å; V248-T260 HydrophobicContact CG2-CG2 4.2Å
249	A	96.4	Very high	94.2	Very high	5 Å²	5	43.3 Å²	43.3	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	122.4	177.2	0	0	0	0	0	109.7	D208 L258 A259 A294 F296	D208-A249 WeakPolarHBondContact OD2-CA 3.32Å; A249-L258 VanDerWaalsContact O-CD1 3.25Å; A249-L258 WeakPolarHBondContact O-CD1 3.47Å; A249-A259 PolarHBondContact N-O 2.76Å; A249-A259 PolarHBondContact O-N 2.73Å; A249-A294 WeakPolarHBondContact CB-O 3.26Å; A249-F296 HydrophobicContact CB-CD2 3.97Å; A249-F296 HydrophobicContact CB-CE2 4.44Å; A249-F296 WeakPolarHBondContact O-CE2 3.49Å
250	L	95.5	Very high	94.4	Very high	12 Å²	12	37 Å²	37	6%	0.063	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	140.8	165.9	-69.9	166.3	0	0	0	108.4	D208 V217 L258 L272	D208-L250 PolarHBondContact OD2-N 2.84Å; V217-L250 HydrophobicContact CG2-CD1 3.92Å; V217-L250 HydrophobicContact CG2-CD2 3.87Å; V217-L250 HydrophobicContact CG2-CG 4.01Å; L250-L258 HydrophobicContact CD2-CB 4.49Å; L250-L258 HydrophobicContact CD2-CD1 3.83Å; L250-L258 HydrophobicContact CG-CD1 4.15Å; L250-L272 HydrophobicContact CD2-CD1 3.88Å
251	N	95	Very high	94.7	Very high	11 Å²	11	37 Å²	37	6%	0.059	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.9	175.8	-175.5	-20.9	0	0	0	109.6	C253 C254 F257 F296 G300	N251-C253 PolarHBondContact O-N 3.08Å; N251-C253 PolarHBondContact OD1-N 3.33Å; N251-C254 HydrophobicContact CB-CB 4.08Å; N251-C254 CarbonylContact O-C 3.51Å; N251-C254 PolarHBondContact O-N 3.01Å; N251-F257 HydrophobicContact CB-CB 3.89Å; N251-F257 HydrophobicContact CB-CD1 4.08Å; N251-F257 HydrophobicContact CB-CG 4.5Å; N251-F257 PolarHBondContact N-O 3.38Å; N251-F296 HydrophobicContact CB-CD2 3.97Å; N251-F296 HydrophobicContact CB-CE2 4Å; N251-F296 HydrophobicContact CB-CG 4.25Å; N251-F296 HydrophobicContact CB-CZ 4.34Å; N251-G300 PolarHBondContact ND2-O 3.32Å; N251-G300 WeakPolarHBondContact OD1-CA 3.37Å
252	P	91.2	Very high	94.8	Very high	74 Å²	74	37 Å²	37	48%	0.481	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.3	-178.4	26.8	-36.3	0	0	0	113.7
253	C	91.7	Very high	95	Very high	86 Å²	86	30.8 Å²	30.8	58%	0.581	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-9.7	179.9	-61.7	0	0	0	0	113.1	N251 D299	N251-C253 PolarHBondContact O-N 3.08Å; N251-C253 PolarHBondContact OD1-N 3.33Å; C253-D299 PolarHBondContact SG-O 3.49Å; C253-D299 VanDerWaalsContact SG-O 3.38Å
254	C	92	Very high	94.9	Very high	26 Å²	26	26.7 Å²	26.7	18%	0.176	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	97.8	-172.3	-168.4	0	0	0	0	111.3	N251 W256 F257	N251-C254 HydrophobicContact CB-CB 4.08Å; N251-C254 CarbonylContact O-C 3.51Å; N251-C254 PolarHBondContact O-N 3.01Å; C254-W256 PolarHBondContact O-N 3.41Å; C254-W256 VanDerWaalsContact O-N 3.1Å; C254-W256 VanDerWaalsContact SG-CZ2 3.52Å; C254-W256 PolarHBondContact SG-NE1 2.72Å; C254-F257 HydrophobicContact CB-CB 4Å; C254-F257 PolarHBondContact O-N 3.4Å
255	D	89.3	Confident	95	Very high	68 Å²	68	27.3 Å²	27.3	36%	0.364	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	-31.8	-172.3	-73.1	-21.4	0	0	0	115.2	S212 L272	S212-D255 WeakPolarHBondContact CB-OD1 3.49Å; S212-D255 PolarHBondContact OG-OD1 3.37Å; D255-L272 WeakPolarHBondContact O-CD1 3.49Å
256	W	89.1	Confident	94.9	Very high	92 Å²	92	28.6 Å²	28.6	35%	0.348	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-3.2	-177.1	53.9	-94.9	0	0	0	113.3	C254 D271 L272 R273 L282	C254-W256 PolarHBondContact O-N 3.41Å; C254-W256 VanDerWaalsContact O-N 3.1Å; C254-W256 VanDerWaalsContact SG-CZ2 3.52Å; C254-W256 PolarHBondContact SG-NE1 2.72Å; W256-D271 HydrophobicContact CE3-CB 3.85Å; W256-D271 HydrophobicContact CZ3-CB 4.08Å; W256-D271 CarbonylContact O-C 3.55Å; W256-D271 WeakPolarHBondContact O-CA 3.45Å; W256-L272 WeakPolarHBondContact O-CG 3.46Å; W256-L272 PolarHBondContact O-N 3.41Å; W256-R273 HydrophobicContact CB-CG 3.93Å; W256-R273 VanDerWaalsContact CD2-NH2 3.33Å; W256-L282 HydrophobicContact CZ3-CD1 4.47Å
257	F	92.8	Very high	94.9	Very high	13 Å²	13	28 Å²	28	6%	0.057	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.6	-175.6	-159.1	-109.8	0	0	0	111.1	N251 C254 I269 L282 F296 W320	N251-F257 HydrophobicContact CB-CB 3.89Å; N251-F257 HydrophobicContact CB-CD1 4.08Å; N251-F257 HydrophobicContact CB-CG 4.5Å; N251-F257 PolarHBondContact N-O 3.38Å; C254-F257 HydrophobicContact CB-CB 4Å; C254-F257 PolarHBondContact O-N 3.4Å; F257-I269 HydrophobicContact CD1-CG2 4.41Å; F257-I269 HydrophobicContact CD2-CG2 4.05Å; F257-I269 HydrophobicContact CE1-CD1 4.49Å; F257-I269 HydrophobicContact CE1-CG2 3.67Å; F257-I269 HydrophobicContact CE2-CG2 3.23Å; F257-I269 HydrophobicContact CZ-CB 4.38Å; F257-I269 HydrophobicContact CZ-CD1 4.23Å; F257-I269 HydrophobicContact CZ-CG2 3.04Å; F257-L282 HydrophobicContact CD2-CD1 4.26Å; F257-L282 HydrophobicContact CE2-CD1 3.86Å; F257-F296 AromaticContact CD1-CE1 3.77Å; F257-F296 HydrophobicContact CD1-CE1 3.77Å; F257-F296 HydrophobicContact CD1-CE2 4.16Å; F257-F296 AromaticContact CD1-CZ 3.34Å; F257-F296 HydrophobicContact CD1-CZ 3.34Å; F257-F296 AromaticContact CE1-CE1 3.6Å; F257-F296 HydrophobicContact CE1-CE1 3.6Å; F257-F296 AromaticContact CE1-CZ 3.44Å; F257-F296 HydrophobicContact CE1-CZ 3.44Å; F257-F296 VanDerWaalsContact CE1-CZ 3.44Å; F257-W320 HydrophobicContact CE1-CH2 4.45Å; F257-W320 AromaticContact CE1-CZ2 3.76Å; F257-W320 HydrophobicContact CE1-CZ2 3.76Å; F257-W320 AromaticContact CZ-CE2 3.79Å; F257-W320 AromaticContact CZ-CZ2 3.9Å; F257-W320 HydrophobicContact CZ-CZ2 3.9Å; F257-W320 AromaticContact CZ-NE1 3.68Å
258	L	94.9	Very high	94.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.8	-177.7	176.5	69	0	0	0	110.8	V217 V248 A249 L250 T260 I269 W270 L272	V217-L258 HydrophobicContact CG1-CD2 4.28Å; V217-L258 HydrophobicContact CG2-CD1 4.37Å; V248-L258 HydrophobicContact CG1-CD1 3.33Å; V248-L258 HydrophobicContact CG1-CD2 4.42Å; V248-L258 HydrophobicContact CG1-CG 4.32Å; A249-L258 VanDerWaalsContact O-CD1 3.25Å; A249-L258 WeakPolarHBondContact O-CD1 3.47Å; L250-L258 HydrophobicContact CD2-CB 4.49Å; L250-L258 HydrophobicContact CD2-CD1 3.83Å; L250-L258 HydrophobicContact CG-CD1 4.15Å; L258-T260 HydrophobicContact CD2-CG2 3.88Å; L258-T260 HydrophobicContact CG-CG2 4.05Å; L258-I269 CarbonylContact O-C 3.52Å; L258-I269 WeakPolarHBondContact O-CA 3.49Å; L258-W270 HydrophobicContact CB-CB 4.29Å; L258-W270 PolarHBondContact N-O 3.42Å; L258-W270 PolarHBondContact O-N 2.87Å; L258-L272 HydrophobicContact CB-CD2 3.87Å; L258-L272 HydrophobicContact CB-CG 4.21Å; L258-L272 HydrophobicContact CD2-CD2 3.86Å; L258-L272 HydrophobicContact CG-CD2 4.45Å
259	A	96.6	Very high	94.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.7	168.2	0	0	0	0	0	110.6	V248 A249 K268 A294 F296 L303	V248-A259 WeakPolarHBondContact CA-O 3.28Å; A249-A259 PolarHBondContact N-O 2.76Å; A249-A259 PolarHBondContact O-N 2.73Å; A259-K268 CarbonylContact C-O 3.5Å; A259-K268 WeakPolarHBondContact CA-O 3.37Å; A259-A294 HydrophobicContact CB-CB 4.5Å; A259-F296 HydrophobicContact CB-CD2 4.39Å; A259-F296 HydrophobicContact CB-CE2 3.46Å; A259-F296 VanDerWaalsContact CB-CE2 3.46Å; A259-F296 HydrophobicContact CB-CZ 3.59Å; A259-L303 HydrophobicContact CB-CD1 3.8Å; A259-L303 HydrophobicContact CB-CD2 4.17Å
260	T	96.9	Very high	94.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.7	177.3	61.3	0	0	0	0	110.3	V225 M240 H241 V248 L258 V267 K268 W270	V225-T260 HydrophobicContact CG2-CG2 4.33Å; M240-T260 HydrophobicContact SD-CG2 4.19Å; H241-T260 PolarHBondContact NE2-OG1 2.91Å; V248-T260 HydrophobicContact CG2-CG2 4.2Å; L258-T260 HydrophobicContact CD2-CG2 3.88Å; L258-T260 HydrophobicContact CG-CG2 4.05Å; T260-V267 CarbonylContact O-C 3.08Å; T260-V267 VanDerWaalsContact O-CA 3.26Å; T260-V267 WeakPolarHBondContact O-CA 3.41Å; T260-V267 WeakPolarHBondContact O-CG1 3.48Å; T260-K268 PolarHBondContact N-O 2.86Å; T260-K268 PolarHBondContact O-N 3.37Å; T260-K268 PolarHBondContact OG1-O 2.82Å; T260-W270 PolarHBondContact OG1-NE1 3.49Å
261	A	97.3	Very high	94.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.1	176.1	0	0	0	0	0	110.6	V245 T246 H247 V267 V291 A294	V245-A261 CarbonylContact C-O 3.35Å; V245-A261 WeakPolarHBondContact CA-O 3.04Å; V245-A261 WeakPolarHBondContact CG1-O 3.23Å; T246-A261 PolarHBondContact N-O 3.43Å; T246-A261 PolarHBondContact OG1-O 3.35Å; H247-A261 HydrophobicContact CB-CB 4.21Å; H247-A261 PolarHBondContact O-N 2.77Å; A261-V267 HydrophobicContact CB-CG2 4.28Å; A261-V291 HydrophobicContact CB-CB 4.21Å; A261-V291 HydrophobicContact CB-CG1 3.88Å; A261-A294 HydrophobicContact CB-CB 3.84Å
262	S	97.4	Very high	94.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160.5	-178.8	176.9	0	0	0	0	113.6	H241 K243 K244 D264 Q265 T266 V291	H241-S262 VanDerWaalsContact CG-CB 3.46Å; H241-S262 VanDerWaalsContact ND1-CB 3.26Å; H241-S262 WeakPolarHBondContact ND1-CB 3.06Å; K243-S262 PolarHBondContact O-OG 3.21Å; K244-S262 VanDerWaalsContact O-CA 3.3Å; K244-S262 WeakPolarHBondContact O-CA 3.29Å; K244-S262 WeakPolarHBondContact O-CB 3.23Å; K244-S262 PolarHBondContact O-OG 3.49Å; S262-D264 VanDerWaalsContact CB-OD1 3.27Å; S262-D264 WeakPolarHBondContact CB-OD1 3.11Å; S262-D264 PolarHBondContact O-N 3.21Å; S262-D264 PolarHBondContact OG-N 3.13Å; S262-D264 VanDerWaalsContact OG-N 3.11Å; S262-D264 PolarHBondContact OG-OD1 2.98Å; S262-Q265 PolarHBondContact O-N 3.11Å; S262-T266 PolarHBondContact N-O 3.08Å; S262-V291 PolarHBondContact O-N 2.8Å; S262-V291 VanDerWaalsContact O-N 3.08Å
263	V	97.1	Very high	94.1	Very high	33 Å²	33	31.2 Å²	31.2	20%	0.2	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.5	168.9	-176.9	0	0	0	0	112.3	K243 K244 T246 Q265 P290	K243-V263 HydrophobicContact CB-CB 4.08Å; K243-V263 HydrophobicContact CD-CB 4.35Å; K243-V263 HydrophobicContact CD-CG1 4.08Å; K244-V263 HydrophobicContact CB-CG2 4.07Å; K244-V263 HydrophobicContact CG-CG2 4.4Å; K244-V263 PolarHBondContact O-N 3Å; T246-V263 HydrophobicContact CG2-CG2 3.61Å; V263-Q265 PolarHBondContact O-N 2.85Å; V263-Q265 VanDerWaalsContact O-N 3.11Å; V263-P290 HydrophobicContact CB-CB 4.33Å; V263-P290 HydrophobicContact CG1-CB 3.97Å; V263-P290 HydrophobicContact CG1-CG 3.96Å
264	D	95.6	Very high	93.7	Very high	28 Å²	28	32.8 Å²	32.8	15%	0.15	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	9.2	172.1	74.5	6.5	0	0	0	114.4	H241 K242 K243 S262 T266	H241-D264 WeakPolarHBondContact CB-OD2 3.01Å; H241-D264 IonicContact CE1-OD1 3.59Å; H241-D264 IonicContact CG-OD2 3.67Å; H241-D264 VanDerWaalsContact ND1-CG 3.35Å; H241-D264 IonicContact ND1-OD1 3.47Å; H241-D264 PolarHBondContact ND1-OD1 2.74Å; H241-D264 VanDerWaalsContact ND1-OD1 3.16Å; H241-D264 IonicContact ND1-OD2 2.84Å; H241-D264 PolarHBondContact ND1-OD2 3.11Å; K242-D264 HydrophobicContact CB-CB 4.31Å; K242-D264 PolarHBondContact N-OD2 3.28Å; K242-D264 VanDerWaalsContact N-OD2 3.12Å; K243-D264 HydrophobicContact CB-CB 4.15Å; K243-D264 HydrophobicContact CD-CB 4.48Å; K243-D264 HydrophobicContact CG-CB 4.2Å; S262-D264 VanDerWaalsContact CB-OD1 3.27Å; S262-D264 WeakPolarHBondContact CB-OD1 3.11Å; S262-D264 PolarHBondContact O-N 3.21Å; S262-D264 PolarHBondContact OG-N 3.13Å; S262-D264 VanDerWaalsContact OG-N 3.11Å; S262-D264 PolarHBondContact OG-OD1 2.98Å; D264-T266 PolarHBondContact O-N 2.73Å; D264-T266 WeakPolarHBondContact OD1-CB 3.29Å; D264-T266 PolarHBondContact OD1-N 3.03Å; D264-T266 PolarHBondContact OD1-OG1 3.19Å
265	Q	96.8	Very high	93.3	Very high	83 Å²	83	32.3 Å²	32.3	39%	0.388	15%	0.149	S	C	.	.	S	Bend	trans	68.5	17.9	177.5	-41.3	177.3	-7.3	0	0	113	S262 V263 H287 P290	S262-Q265 PolarHBondContact O-N 3.11Å; V263-Q265 PolarHBondContact O-N 2.85Å; V263-Q265 VanDerWaalsContact O-N 3.11Å; Q265-H287 WeakPolarHBondContact O-CA 3.33Å; Q265-H287 WeakPolarHBondContact O-CB 3.15Å; Q265-H287 PolarHBondContact O-N 3.01Å; Q265-P290 HydrophobicContact CG-CG 4.41Å
266	T	96.3	Very high	92.7	Very high	27 Å²	27	40.1 Å²	40.1	17%	0.166	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.3	175.9	69	0	0	0	0	111.2	H241 S262 D264 L285	H241-T266 PolarHBondContact CE1-OG1 3Å; H241-T266 VanDerWaalsContact CE1-OG1 3.24Å; H241-T266 PolarHBondContact ND1-OG1 3.36Å; S262-T266 PolarHBondContact N-O 3.08Å; D264-T266 PolarHBondContact O-N 2.73Å; D264-T266 WeakPolarHBondContact OD1-CB 3.29Å; D264-T266 PolarHBondContact OD1-N 3.03Å; D264-T266 PolarHBondContact OD1-OG1 3.19Å; T266-L285 WeakPolarHBondContact CA-O 3.47Å
267	V	97.1	Very high	91.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.3	158	179.8	0	0	0	0	106.8	T260 A261 L285 V291 A294 L303 T305	T260-V267 CarbonylContact O-C 3.08Å; T260-V267 VanDerWaalsContact O-CA 3.26Å; T260-V267 WeakPolarHBondContact O-CA 3.41Å; T260-V267 WeakPolarHBondContact O-CG1 3.48Å; A261-V267 HydrophobicContact CB-CG2 4.28Å; V267-L285 HydrophobicContact CB-CB 4.16Å; V267-L285 HydrophobicContact CB-CD1 4.3Å; V267-L285 HydrophobicContact CG1-CD1 4.27Å; V267-L285 PolarHBondContact N-O 3.31Å; V267-L285 PolarHBondContact O-N 3.31Å; V267-V291 HydrophobicContact CG2-CB 4.11Å; V267-V291 HydrophobicContact CG2-CG1 3.7Å; V267-V291 HydrophobicContact CG2-CG2 4Å; V267-A294 HydrophobicContact CG1-CB 3.78Å; V267-A294 HydrophobicContact CG2-CB 4.32Å; V267-L303 HydrophobicContact CG1-CD2 3.87Å; V267-T305 HydrophobicContact CB-CG2 4.49Å; V267-T305 HydrophobicContact CG1-CG2 4.38Å; V267-T305 HydrophobicContact CG2-CG2 3.87Å
268	K	95.6	Very high	90.8	Very high	20 Å²	20	41.1 Å²	41.1	9%	0.087	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.3	178.4	-69.5	-179.8	-179.1	-173.9	0	109.9	M240 A259 T260 W270 F281 Y283	M240-K268 PolarHBondContact O-NZ 2.82Å; A259-K268 CarbonylContact C-O 3.5Å; A259-K268 WeakPolarHBondContact CA-O 3.37Å; T260-K268 PolarHBondContact N-O 2.86Å; T260-K268 PolarHBondContact O-N 3.37Å; T260-K268 PolarHBondContact OG1-O 2.82Å; K268-W270 HydrophobicContact CB-CZ2 3.68Å; K268-W270 HydrophobicContact CD-CH2 3.99Å; K268-W270 HydrophobicContact CD-CZ2 3.41Å; K268-W270 VanDerWaalsContact CD-CZ2 3.41Å; K268-W270 HydrophobicContact CG-CZ2 4.21Å; K268-F281 HydrophobicContact CB-CB 4.4Å; K268-F281 HydrophobicContact CD-CD1 4.22Å; K268-F281 HydrophobicContact CD-CG 4.43Å; K268-Y283 WeakPolarHBondContact CA-O 3.05Å
269	I	95.6	Very high	89.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.2	177.5	-66.2	-179.3	0	0	0	108	F257 L258 F281 L282 Y283 L285 L303 W320	F257-I269 HydrophobicContact CD1-CG2 4.41Å; F257-I269 HydrophobicContact CD2-CG2 4.05Å; F257-I269 HydrophobicContact CE1-CD1 4.49Å; F257-I269 HydrophobicContact CE1-CG2 3.67Å; F257-I269 HydrophobicContact CE2-CG2 3.23Å; F257-I269 HydrophobicContact CZ-CB 4.38Å; F257-I269 HydrophobicContact CZ-CD1 4.23Å; F257-I269 HydrophobicContact CZ-CG2 3.04Å; L258-I269 CarbonylContact O-C 3.52Å; L258-I269 WeakPolarHBondContact O-CA 3.49Å; I269-F281 CarbonylContact O-C 3.55Å; I269-F281 WeakPolarHBondContact O-CA 3.37Å; I269-F281 WeakPolarHBondContact O-CB 3.27Å; I269-L282 HydrophobicContact CG2-CB 4.42Å; I269-L282 HydrophobicContact CG2-CD1 4.47Å; I269-L282 PolarHBondContact O-N 3.15Å; I269-Y283 HydrophobicContact CB-CD2 4.38Å; I269-Y283 HydrophobicContact CG2-CD2 4.2Å; I269-Y283 PolarHBondContact N-O 3.07Å; I269-L285 HydrophobicContact CD1-CD1 4.2Å; I269-L303 HydrophobicContact CD1-CD2 4.36Å; I269-W320 HydrophobicContact CD1-CB 4.19Å; I269-W320 HydrophobicContact CD1-CD2 3.54Å; I269-W320 HydrophobicContact CD1-CE3 3.59Å; I269-W320 HydrophobicContact CD1-CG 3.83Å; I269-W320 HydrophobicContact CD1-CZ3 4.25Å
270	W	94.4	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.9	-172	-50.3	88.5	0	0	0	111	M240 L258 T260 K268 V275 F281	M240-W270 HydrophobicContact CB-CH2 3.92Å; M240-W270 HydrophobicContact CB-CZ2 3.53Å; M240-W270 HydrophobicContact CE-CD2 3.96Å; M240-W270 HydrophobicContact CE-CE3 4.12Å; M240-W270 HydrophobicContact CE-CG 4.31Å; M240-W270 HydrophobicContact CE-CZ3 4.48Å; M240-W270 HydrophobicContact CG-CH2 3.81Å; M240-W270 HydrophobicContact CG-CZ2 3.64Å; M240-W270 HydrophobicContact CG-CZ3 4.37Å; M240-W270 HydrophobicContact SD-CD2 3.92Å; M240-W270 VanDerWaalsContact SD-CE2 3.52Å; M240-W270 HydrophobicContact SD-CE3 4.45Å; M240-W270 HydrophobicContact SD-CG 4.34Å; M240-W270 HydrophobicContact SD-CH2 4.3Å; M240-W270 HydrophobicContact SD-CZ2 3.74Å; L258-W270 HydrophobicContact CB-CB 4.29Å; L258-W270 PolarHBondContact N-O 3.42Å; L258-W270 PolarHBondContact O-N 2.87Å; T260-W270 PolarHBondContact OG1-NE1 3.49Å; K268-W270 HydrophobicContact CB-CZ2 3.68Å; K268-W270 HydrophobicContact CD-CH2 3.99Å; K268-W270 HydrophobicContact CD-CZ2 3.41Å; K268-W270 VanDerWaalsContact CD-CZ2 3.41Å; K268-W270 HydrophobicContact CG-CZ2 4.21Å; W270-V275 HydrophobicContact CB-CG2 4.3Å; W270-V275 HydrophobicContact CE3-CG1 4.46Å; W270-V275 HydrophobicContact CE3-CG2 4.47Å; W270-F281 HydrophobicContact CD2-CB 4.02Å; W270-F281 HydrophobicContact CE3-CB 3.73Å; W270-F281 HydrophobicContact CH2-CB 3.87Å; W270-F281 HydrophobicContact CH2-CD1 4.28Å; W270-F281 HydrophobicContact CZ2-CB 4.13Å; W270-F281 HydrophobicContact CZ3-CB 3.66Å; W270-F281 HydrophobicContact CZ3-CD1 4.49Å
271	D	92.8	Very high	88.9	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.027	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.6	161	-178.6	-12.9	0	0	0	108.3	W256 R273 Q274 V275 L282	W256-D271 HydrophobicContact CE3-CB 3.85Å; W256-D271 HydrophobicContact CZ3-CB 4.08Å; W256-D271 CarbonylContact O-C 3.55Å; W256-D271 WeakPolarHBondContact O-CA 3.45Å; D271-R273 PolarHBondContact O-N 3.36Å; D271-R273 WeakPolarHBondContact OD1-CB 3.47Å; D271-R273 IonicContact OD1-CZ 3.15Å; D271-R273 PolarHBondContact OD1-N 3.22Å; D271-R273 IonicContact OD1-NE 3.77Å; D271-R273 PolarHBondContact OD1-NE 3.1Å; D271-R273 IonicContact OD1-NH2 2.65Å; D271-R273 IonicContact OD2-CZ 3.8Å; D271-R273 IonicContact OD2-NE 3.01Å; D271-R273 PolarHBondContact OD2-NE 2.99Å; D271-R273 IonicContact OD2-NH2 3.33Å; D271-R273 PolarHBondContact OD2-NH2 2.89Å; D271-Q274 HydrophobicContact CB-CB 4.41Å; D271-Q274 PolarHBondContact O-N 2.88Å; D271-Q274 PolarHBondContact OD2-NE2 3.09Å; D271-V275 WeakPolarHBondContact O-CG2 3.22Å; D271-V275 PolarHBondContact O-N 3.29Å; D271-L282 HydrophobicContact CB-CD1 3.89Å; D271-L282 HydrophobicContact CB-CD2 4.39Å; D271-L282 HydrophobicContact CB-CG 4.2Å
272	L	89.2	Confident	88.6	Confident	17 Å²	17	54 Å²	54	9%	0.089	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-25.6	-178.2	-64.6	179	0	0	0	113.2	M215 L227 W236 L250 D255 W256 L258	M215-L272 HydrophobicContact SD-CD1 3.76Å; L227-L272 HydrophobicContact CD2-CD2 4.35Å; W236-L272 HydrophobicContact CH2-CD2 4.39Å; W236-L272 HydrophobicContact CZ2-CD2 3.75Å; L250-L272 HydrophobicContact CD2-CD1 3.88Å; D255-L272 WeakPolarHBondContact O-CD1 3.49Å; W256-L272 WeakPolarHBondContact O-CG 3.46Å; W256-L272 PolarHBondContact O-N 3.41Å; L258-L272 HydrophobicContact CB-CD2 3.87Å; L258-L272 HydrophobicContact CB-CG 4.21Å; L258-L272 HydrophobicContact CD2-CD2 3.86Å; L258-L272 HydrophobicContact CG-CD2 4.45Å
273	R	87.4	Confident	88.4	Confident	157 Å²	157	58 Å²	58	59%	0.592	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-23.7	179.9	-57.2	169.1	-62.5	176.9	4.9	112.9	W256 D271	W256-R273 HydrophobicContact CB-CG 3.93Å; W256-R273 VanDerWaalsContact CD2-NH2 3.33Å; D271-R273 PolarHBondContact O-N 3.36Å; D271-R273 WeakPolarHBondContact OD1-CB 3.47Å; D271-R273 IonicContact OD1-CZ 3.15Å; D271-R273 PolarHBondContact OD1-N 3.22Å; D271-R273 IonicContact OD1-NE 3.77Å; D271-R273 PolarHBondContact OD1-NE 3.1Å; D271-R273 IonicContact OD1-NH2 2.65Å; D271-R273 IonicContact OD2-CZ 3.8Å; D271-R273 IonicContact OD2-NE 3.01Å; D271-R273 PolarHBondContact OD2-NE 2.99Å; D271-R273 IonicContact OD2-NH2 3.33Å; D271-R273 PolarHBondContact OD2-NH2 2.89Å
274	Q	83.8	Confident	88.3	Confident	120 Å²	120	58.4 Å²	58.4	56%	0.561	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	1.8	-173.7	-59.8	-172.7	41.1	0	0	113.1	D271 R276	D271-Q274 HydrophobicContact CB-CB 4.41Å; D271-Q274 PolarHBondContact O-N 2.88Å; D271-Q274 PolarHBondContact OD2-NE2 3.09Å; Q274-R276 PolarHBondContact O-N 3.39Å
275	V	83.1	Confident	88.3	Confident	16 Å²	16	57.1 Å²	57.1	10%	0.097	28%	0.278	C	S	.	.			trans	-68.6	109.7	178.6	-168.2	0	0	0	0	109.7	L238 M240 W270 D271	L238-V275 HydrophobicContact CD1-CB 4.47Å; L238-V275 HydrophobicContact CD1-CG1 3.44Å; L238-V275 VanDerWaalsContact CD1-CG1 3.44Å; M240-V275 HydrophobicContact CE-CG1 3.92Å; W270-V275 HydrophobicContact CB-CG2 4.3Å; W270-V275 HydrophobicContact CE3-CG1 4.46Å; W270-V275 HydrophobicContact CE3-CG2 4.47Å; D271-V275 WeakPolarHBondContact O-CG2 3.22Å; D271-V275 PolarHBondContact O-N 3.29Å
276	R	76.4	Confident	88.3	Confident	232 Å²	232	57.5 Å²	57.5	88%	0.875	29%	0.288	S	S	*	.			trans	-119.7	-2.2	174	-64.2	-172.3	-179	-170.7	0.8	113.2	Q274 S280	Q274-R276 PolarHBondContact O-N 3.39Å; R276-S280 PolarHBondContact N-OG 3.47Å
277	G	73.4	Confident	88.2	Confident	20 Å²	20	56.7 Å²	56.7	21%	0.206	28%	0.282	C	S	.	.	S	Bend	trans	169.8	-169.9	178.1	0	0	0	0	0	114.4	A279 S280	G277-A279 PolarHBondContact O-N 2.59Å; G277-A279 VanDerWaalsContact O-N 3.14Å; G277-S280 PolarHBondContact N-OG 2.84Å; G277-S280 WeakPolarHBondContact O-CB 3.44Å; G277-S280 PolarHBondContact O-N 3.2Å; G277-S280 VanDerWaalsContact O-N 3.15Å; G277-S280 PolarHBondContact O-OG 3.49Å
278	K	70.1	Confident	88.1	Confident	106 Å²	106	65 Å²	65	46%	0.461	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	-171.3	-176.4	170.9	-176.6	-175	0	115.3	R239	R239-K278 WeakPolarHBondContact O-CB 3.42Å; R239-K278 VanDerWaalsContact O-CG 3.26Å; R239-K278 WeakPolarHBondContact O-CG 2.98Å
279	A	73.4	Confident	88.1	Confident	83 Å²	83	66.7 Å²	66.7	69%	0.686	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	3.1	-178.4	0	0	0	0	0	113.7	G277 F281	G277-A279 PolarHBondContact O-N 2.59Å; G277-A279 VanDerWaalsContact O-N 3.14Å; A279-F281 PolarHBondContact O-N 3.16Å
280	S	85.8	Confident	88.2	Confident	40 Å²	40	67.8 Å²	67.8	28%	0.28	33%	0.329	S	S	.	.			trans	-80.2	26.2	-178.1	-53.8	0	0	0	0	113.9	R276 G277	R276-S280 PolarHBondContact N-OG 3.47Å; G277-S280 PolarHBondContact N-OG 2.84Å; G277-S280 WeakPolarHBondContact O-CB 3.44Å; G277-S280 PolarHBondContact O-N 3.2Å; G277-S280 VanDerWaalsContact O-N 3.15Å; G277-S280 PolarHBondContact O-OG 3.49Å
281	F	89.4	Confident	88.3	Confident	77 Å²	77	67.8 Å²	67.8	34%	0.338	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	145.4	175.9	60.4	-95.2	0	0	0	109.7	K268 I269 W270 A279 S284	K268-F281 HydrophobicContact CB-CB 4.4Å; K268-F281 HydrophobicContact CD-CD1 4.22Å; K268-F281 HydrophobicContact CD-CG 4.43Å; I269-F281 CarbonylContact O-C 3.55Å; I269-F281 WeakPolarHBondContact O-CA 3.37Å; I269-F281 WeakPolarHBondContact O-CB 3.27Å; W270-F281 HydrophobicContact CD2-CB 4.02Å; W270-F281 HydrophobicContact CE3-CB 3.73Å; W270-F281 HydrophobicContact CH2-CB 3.87Å; W270-F281 HydrophobicContact CH2-CD1 4.28Å; W270-F281 HydrophobicContact CZ2-CB 4.13Å; W270-F281 HydrophobicContact CZ3-CB 3.66Å; W270-F281 HydrophobicContact CZ3-CD1 4.49Å; A279-F281 PolarHBondContact O-N 3.16Å; F281-S284 VanDerWaalsContact CE2-CB 3.47Å
282	L	90.8	Very high	88.5	Confident	71 Å²	71	67.7 Å²	67.7	37%	0.372	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-46.6	174.3	-66.9	177.1	0	0	0	110.9	W256 F257 I269 D271	W256-L282 HydrophobicContact CZ3-CD1 4.47Å; F257-L282 HydrophobicContact CD2-CD1 4.26Å; F257-L282 HydrophobicContact CE2-CD1 3.86Å; I269-L282 HydrophobicContact CG2-CB 4.42Å; I269-L282 HydrophobicContact CG2-CD1 4.47Å; I269-L282 PolarHBondContact O-N 3.15Å; D271-L282 HydrophobicContact CB-CD1 3.89Å; D271-L282 HydrophobicContact CB-CD2 4.39Å; D271-L282 HydrophobicContact CB-CG 4.2Å
283	Y	93.3	Very high	88.9	Confident	83 Å²	83	66.9 Å²	66.9	33%	0.325	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.1	-178.4	-56	-81.9	0	0	0	110.1	K268 I269 W320 D321	K268-Y283 WeakPolarHBondContact CA-O 3.05Å; I269-Y283 HydrophobicContact CB-CD2 4.38Å; I269-Y283 HydrophobicContact CG2-CD2 4.2Å; I269-Y283 PolarHBondContact N-O 3.07Å; Y283-W320 HydrophobicContact CD1-CB 3.92Å; Y283-W320 HydrophobicContact CD2-CB 3.88Å; Y283-W320 AromaticContact CD2-CD1 3.67Å; Y283-W320 AromaticContact CD2-CG 3.95Å; Y283-W320 HydrophobicContact CD2-CG 3.95Å; Y283-W320 HydrophobicContact CE1-CB 4.29Å; Y283-W320 HydrophobicContact CE2-CB 4.28Å; Y283-W320 AromaticContact CE2-CD1 3.46Å; Y283-W320 VanDerWaalsContact CE2-CD1 3.46Å; Y283-W320 HydrophobicContact CE2-CG 4.15Å; Y283-W320 HydrophobicContact CG-CB 3.7Å; Y283-W320 HydrophobicContact CG-CG 4.28Å; Y283-W320 AromaticContact CZ-CD1 3.99Å; Y283-D321 WeakPolarHBondContact CD1-OD1 3.34Å
284	S	94.8	Very high	89.3	Confident	41 Å²	41	59.4 Å²	59.4	29%	0.287	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	119.6	170.9	-173.6	0	0	0	0	109.2	F281 P286	F281-S284 VanDerWaalsContact CE2-CB 3.47Å; S284-P286 WeakPolarHBondContact O-CD 3.18Å
285	L	95.4	Very high	89.9	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	106.1	-175.2	-48.7	178.5	0	0	0	108.3	T266 V267 I269 H287 L303 Y315 W320	T266-L285 WeakPolarHBondContact CA-O 3.47Å; V267-L285 HydrophobicContact CB-CB 4.16Å; V267-L285 HydrophobicContact CB-CD1 4.3Å; V267-L285 HydrophobicContact CG1-CD1 4.27Å; V267-L285 PolarHBondContact N-O 3.31Å; V267-L285 PolarHBondContact O-N 3.31Å; I269-L285 HydrophobicContact CD1-CD1 4.2Å; L285-H287 PolarHBondContact O-CD2 3.29Å; L285-L303 HydrophobicContact CD1-CD2 4.04Å; L285-Y315 HydrophobicContact CB-CE1 4.3Å; L285-Y315 HydrophobicContact CD1-CD1 3.97Å; L285-Y315 HydrophobicContact CD1-CD2 3.89Å; L285-Y315 HydrophobicContact CD1-CE1 3.94Å; L285-Y315 HydrophobicContact CD1-CE2 3.88Å; L285-Y315 HydrophobicContact CD1-CG 3.94Å; L285-Y315 HydrophobicContact CD2-CD1 4.15Å; L285-Y315 HydrophobicContact CD2-CE1 3.87Å; L285-Y315 HydrophobicContact CG-CE1 4.25Å; L285-W320 WeakPolarHBondContact CD2-O 3.26Å
286	P	95.4	Very high	90.5	Very high	91 Å²	91	55 Å²	55	59%	0.591	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	130.5	-178.3	30.8	-34	0	0	0	111.1	S284 R313	S284-P286 WeakPolarHBondContact O-CD 3.18Å; P286-R313 PolarHBondContact O-NH1 3.16Å
287	H	95.6	Very high	91.4	Very high	11 Å²	11	44.2 Å²	44.2	5%	0.051	24%	0.236	C	C	.	.			trans	-107.8	160.5	171.9	-74.9	-111.2	0	0	0	111	Q265 L285 H289 V291 T305 R313	Q265-H287 WeakPolarHBondContact O-CA 3.33Å; Q265-H287 WeakPolarHBondContact O-CB 3.15Å; Q265-H287 PolarHBondContact O-N 3.01Å; L285-H287 PolarHBondContact O-CD2 3.29Å; H287-H289 VanDerWaalsContact C-N 3.32Å; H287-H289 WeakPolarHBondContact CB-O 3.46Å; H287-V291 HydrophobicContact CB-CG2 3.71Å; H287-V291 VanDerWaalsContact CG-CG2 3.47Å; H287-T305 PolarHBondContact CE1-OG1 2.92Å; H287-R313 VanDerWaalsContact CE1-CD 3.48Å; H287-R313 WeakPolarHBondContact CE1-CD 2.98Å
288	R	94.4	Very high	92.3	Very high	174 Å²	174	46.4 Å²	46.4	66%	0.657	25%	0.247	S	C	*	.	S	Bend	trans	-78.3	-23	175.4	-70.1	-178.1	174.3	160	-9.3	112.9	E311	R288-E311 WeakPolarHBondContact CD-OE1 3.46Å; R288-E311 IonicContact CZ-OE1 2.72Å; R288-E311 IonicContact NE-OE1 3.58Å; R288-E311 IonicContact NH1-OE1 3.51Å; R288-E311 PolarHBondContact NH1-OE1 2.99Å
289	H	95.9	Very high	93.3	Very high	55 Å²	55	45.6 Å²	45.6	26%	0.255	25%	0.248	S	C	.	.	S	Bend	trans	-134	160.3	-175.7	-65.4	-55.4	0	0	0	109.5	H287 D307 K309	H287-H289 VanDerWaalsContact C-N 3.32Å; H287-H289 WeakPolarHBondContact CB-O 3.46Å; H289-D307 HydrophobicContact CB-CB 4.29Å; H289-D307 IonicContact CD2-OD2 2.72Å; H289-D307 IonicContact CG-OD2 3.31Å; H289-K309 HydrophobicContact CB-CB 4.46Å; H289-K309 VanDerWaalsContact NE2-CD 3.35Å; H289-K309 WeakPolarHBondContact NE2-CD 3.13Å
290	P	97.1	Very high	94.1	Very high	23 Å²	23	42 Å²	42	15%	0.149	22%	0.219	C	C	.	.			trans	-47.9	144.5	169.9	-34.5	41.5	0	0	0	112.3	V263 Q265 D307 Q308	V263-P290 HydrophobicContact CB-CB 4.33Å; V263-P290 HydrophobicContact CG1-CB 3.97Å; V263-P290 HydrophobicContact CG1-CG 3.96Å; Q265-P290 HydrophobicContact CG-CG 4.41Å; P290-D307 CarbonylContact O-C 3.46Å; P290-D307 WeakPolarHBondContact O-CA 3.19Å; P290-Q308 HydrophobicContact CB-CB 4.09Å; P290-Q308 HydrophobicContact CB-CG 3.82Å; P290-Q308 WeakPolarHBondContact O-CB 3.46Å; P290-Q308 WeakPolarHBondContact O-CG 3.17Å; P290-Q308 PolarHBondContact O-N 2.72Å
291	V	97.8	Very high	94.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.7	-177.7	-173.4	0	0	0	0	109.4	T246 A261 S262 V267 H287 A293 T306	T246-V291 WeakPolarHBondContact CB-O 3.35Å; T246-V291 WeakPolarHBondContact CG2-O 3.33Å; T246-V291 PolarHBondContact OG1-O 3.35Å; A261-V291 HydrophobicContact CB-CB 4.21Å; A261-V291 HydrophobicContact CB-CG1 3.88Å; S262-V291 PolarHBondContact O-N 2.8Å; S262-V291 VanDerWaalsContact O-N 3.08Å; V267-V291 HydrophobicContact CG2-CB 4.11Å; V267-V291 HydrophobicContact CG2-CG1 3.7Å; V267-V291 HydrophobicContact CG2-CG2 4Å; H287-V291 HydrophobicContact CB-CG2 3.71Å; H287-V291 VanDerWaalsContact CG-CG2 3.47Å; V291-A293 VanDerWaalsContact CG1-O 3.31Å; V291-A293 WeakPolarHBondContact CG1-O 3.27Å; V291-T306 WeakPolarHBondContact CG1-O 3.04Å
292	N	96.6	Very high	94.7	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-31.8	-179.3	-71.2	-31.5	0	0	0	113.4	T246 T306 D307 Q308 P339	T246-N292 PolarHBondContact OG1-O 3.29Å; N292-T306 PolarHBondContact N-O 2.82Å; N292-D307 PolarHBondContact ND2-O 3.34Å; N292-Q308 WeakPolarHBondContact ND2-CG 3.38Å; N292-Q308 WeakPolarHBondContact OD1-CG 3.36Å; N292-Q308 PolarHBondContact OD1-NE2 3.46Å; N292-P339 HydrophobicContact CB-CB 4.19Å
293	A	96.2	Very high	95	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	146.5	-176.2	0	0	0	0	0	111.2	V291 T305 T306 K341	V291-A293 VanDerWaalsContact CG1-O 3.31Å; V291-A293 WeakPolarHBondContact CG1-O 3.27Å; A293-T305 VanDerWaalsContact O-CA 3.31Å; A293-T305 WeakPolarHBondContact O-CA 3.16Å; A293-T306 PolarHBondContact O-N 3.04Å; A293-T306 VanDerWaalsContact O-N 3.07Å; A293-K341 HydrophobicContact CB-CB 3.98Å; A293-K341 HydrophobicContact CB-CD 4.19Å; A293-K341 HydrophobicContact CB-CG 3.92Å
294	A	96.7	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	95.9	170.2	0	0	0	0	0	107.6	H247 A249 A259 A261 V267 L303 L304 T305	H247-A294 PolarHBondContact CD2-O 3.24Å; A249-A294 WeakPolarHBondContact CB-O 3.26Å; A259-A294 HydrophobicContact CB-CB 4.5Å; A261-A294 HydrophobicContact CB-CB 3.84Å; V267-A294 HydrophobicContact CG1-CB 3.78Å; V267-A294 HydrophobicContact CG2-CB 4.32Å; A294-L303 HydrophobicContact CB-CD1 4.2Å; A294-L304 CarbonylContact C-O 3.5Å; A294-L304 VanDerWaalsContact CA-O 3.28Å; A294-L304 WeakPolarHBondContact CA-O 3.32Å; A294-T305 HydrophobicContact CB-CG2 4.22Å
295	C	95.9	Very high	95.3	Very high	25 Å²	25	31 Å²	31	17%	0.169	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.4	-171.4	-56.7	0	0	0	0	110	L304 W344	C295-L304 PolarHBondContact N-O 2.91Å; C295-L304 PolarHBondContact O-N 2.83Å; C295-W344 PolarHBondContact O-NE1 2.94Å; C295-W344 VanDerWaalsContact O-NE1 3.15Å
296	F	96.6	Very high	95.4	Very high	20 Å²	20	31 Å²	31	9%	0.088	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	145.1	170	-76.9	-69.1	0	0	0	110.5	A249 N251 F257 A259 R302 L303 W320 W344	A249-F296 HydrophobicContact CB-CD2 3.97Å; A249-F296 HydrophobicContact CB-CE2 4.44Å; A249-F296 WeakPolarHBondContact O-CE2 3.49Å; N251-F296 HydrophobicContact CB-CD2 3.97Å; N251-F296 HydrophobicContact CB-CE2 4Å; N251-F296 HydrophobicContact CB-CG 4.25Å; N251-F296 HydrophobicContact CB-CZ 4.34Å; F257-F296 AromaticContact CD1-CE1 3.77Å; F257-F296 HydrophobicContact CD1-CE1 3.77Å; F257-F296 HydrophobicContact CD1-CE2 4.16Å; F257-F296 AromaticContact CD1-CZ 3.34Å; F257-F296 HydrophobicContact CD1-CZ 3.34Å; F257-F296 AromaticContact CE1-CE1 3.6Å; F257-F296 HydrophobicContact CE1-CE1 3.6Å; F257-F296 AromaticContact CE1-CZ 3.44Å; F257-F296 HydrophobicContact CE1-CZ 3.44Å; F257-F296 VanDerWaalsContact CE1-CZ 3.44Å; A259-F296 HydrophobicContact CB-CD2 4.39Å; A259-F296 HydrophobicContact CB-CE2 3.46Å; A259-F296 VanDerWaalsContact CB-CE2 3.46Å; A259-F296 HydrophobicContact CB-CZ 3.59Å; F296-R302 WeakPolarHBondContact CA-O 3.39Å; F296-R302 WeakPolarHBondContact CD1-O 3.43Å; F296-L303 HydrophobicContact CD1-CB 4.48Å; F296-L303 HydrophobicContact CD1-CD1 3.91Å; F296-L303 HydrophobicContact CD2-CD1 4.31Å; F296-L303 HydrophobicContact CE1-CB 4.35Å; F296-L303 HydrophobicContact CE1-CD1 3.85Å; F296-L303 HydrophobicContact CE2-CD1 4.28Å; F296-L303 HydrophobicContact CG-CD1 4.12Å; F296-L303 HydrophobicContact CZ-CD1 4.03Å; F296-W320 AromaticContact CE1-CH2 3.99Å; F296-W320 HydrophobicContact CE1-CH2 3.99Å; F296-W320 HydrophobicContact CE1-CZ2 4.44Å; F296-W344 VanDerWaalsContact O-CD1 3.25Å
297	S	94.8	Very high	95.5	Very high	4 Å²	4	26.6 Å²	26.6	3%	0.028	14%	0.136	C	C	.	.			trans	-66.4	156.7	166.3	46.6	0	0	0	0	110.3	D299 G300 R302	S297-D299 WeakPolarHBondContact CB-OD1 3.49Å; S297-D299 PolarHBondContact O-N 3.48Å; S297-D299 VanDerWaalsContact O-N 3.15Å; S297-D299 PolarHBondContact OG-OD1 3.01Å; S297-G300 WeakPolarHBondContact O-CA 3.3Å; S297-G300 PolarHBondContact O-N 3.35Å; S297-R302 PolarHBondContact N-O 3.09Å; S297-R302 WeakPolarHBondContact OG-CA 3.26Å; S297-R302 WeakPolarHBondContact OG-CB 3.46Å; S297-R302 PolarHBondContact OG-N 3.39Å; S297-R302 PolarHBondContact OG-O 3.15Å; S297-R302 VanDerWaalsContact OG-O 3.12Å
298	P	92.1	Very high	95.4	Very high	67 Å²	67	27.8 Å²	27.8	44%	0.435	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.9	178.3	-24.5	33.2	0	0	0	114.1	G300	P298-G300 VanDerWaalsContact C-N 3.27Å
299	D	90.3	Very high	95.3	Very high	89 Å²	89	24.2 Å²	24.2	48%	0.476	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.7	174	69.1	-2.7	0	0	0	113.6	C253 S297 A301	C253-D299 PolarHBondContact SG-O 3.49Å; C253-D299 VanDerWaalsContact SG-O 3.38Å; S297-D299 WeakPolarHBondContact CB-OD1 3.49Å; S297-D299 PolarHBondContact O-N 3.48Å; S297-D299 VanDerWaalsContact O-N 3.15Å; S297-D299 PolarHBondContact OG-OD1 3.01Å; D299-A301 PolarHBondContact O-N 2.88Å; D299-A301 PolarHBondContact OD1-N 3.28Å
300	G	91.2	Very high	95.2	Very high	7 Å²	7	23 Å²	23	7%	0.072	13%	0.129	C	C	.	.	S	Bend	trans	68	-0.3	-179.5	0	0	0	0	0	115.5	N251 S297 P298	N251-G300 PolarHBondContact ND2-O 3.32Å; N251-G300 WeakPolarHBondContact OD1-CA 3.37Å; S297-G300 WeakPolarHBondContact O-CA 3.3Å; S297-G300 PolarHBondContact O-N 3.35Å; P298-G300 VanDerWaalsContact C-N 3.27Å
301	A	93.1	Very high	95	Very high	36 Å²	36	22.6 Å²	22.6	30%	0.298	13%	0.125	S	C	.	.	S	Bend	trans	-95.4	-7.9	-170.3	0	0	0	0	0	113.6	D299 A317	D299-A301 PolarHBondContact O-N 2.88Å; D299-A301 PolarHBondContact OD1-N 3.28Å; A301-A317 WeakPolarHBondContact O-CB 3.12Å; A301-A317 PolarHBondContact O-N 3.25Å
302	R	94.9	Very high	95	Very high	45 Å²	45	22.6 Å²	22.6	17%	0.17	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.3	-179.9	-53	179.7	-176.9	-154.5	-3.1	111.3	F296 S297 Y315 W344 N349 G377 N378	F296-R302 WeakPolarHBondContact CA-O 3.39Å; F296-R302 WeakPolarHBondContact CD1-O 3.43Å; S297-R302 PolarHBondContact N-O 3.09Å; S297-R302 WeakPolarHBondContact OG-CA 3.26Å; S297-R302 WeakPolarHBondContact OG-CB 3.46Å; S297-R302 PolarHBondContact OG-N 3.39Å; S297-R302 PolarHBondContact OG-O 3.15Å; S297-R302 VanDerWaalsContact OG-O 3.12Å; R302-Y315 WeakPolarHBondContact CA-O 3.48Å; R302-Y315 WeakPolarHBondContact CB-O 3.37Å; R302-W344 HydrophobicContact CB-CZ2 4.08Å; R302-N349 PolarHBondContact NH1-ND2 3.28Å; R302-N349 VanDerWaalsContact NH1-ND2 3.13Å; R302-G377 PolarHBondContact NH1-O 3.16Å; R302-N378 PolarHBondContact NH1-OD1 3.28Å; R302-N378 PolarHBondContact NH2-OD1 2.92Å
303	L	96.8	Very high	94.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.1	173.5	-172.4	70.2	0	0	0	109.3	A259 V267 I269 L285 A294 F296 T305 I314 Y315 W320	A259-L303 HydrophobicContact CB-CD1 3.8Å; A259-L303 HydrophobicContact CB-CD2 4.17Å; V267-L303 HydrophobicContact CG1-CD2 3.87Å; I269-L303 HydrophobicContact CD1-CD2 4.36Å; L285-L303 HydrophobicContact CD1-CD2 4.04Å; A294-L303 HydrophobicContact CB-CD1 4.2Å; F296-L303 HydrophobicContact CD1-CB 4.48Å; F296-L303 HydrophobicContact CD1-CD1 3.91Å; F296-L303 HydrophobicContact CD2-CD1 4.31Å; F296-L303 HydrophobicContact CE1-CB 4.35Å; F296-L303 HydrophobicContact CE1-CD1 3.85Å; F296-L303 HydrophobicContact CE2-CD1 4.28Å; F296-L303 HydrophobicContact CG-CD1 4.12Å; F296-L303 HydrophobicContact CZ-CD1 4.03Å; L303-T305 HydrophobicContact CD2-CG2 4.18Å; L303-T305 HydrophobicContact CG-CG2 4.15Å; L303-I314 CarbonylContact O-C 3.55Å; L303-I314 WeakPolarHBondContact O-CA 3.35Å; L303-Y315 PolarHBondContact N-O 3.24Å; L303-Y315 PolarHBondContact O-N 2.98Å; L303-W320 HydrophobicContact CB-CE3 4.45Å; L303-W320 HydrophobicContact CB-CH2 4.05Å; L303-W320 HydrophobicContact CB-CZ3 3.48Å; L303-W320 VanDerWaalsContact CB-CZ3 3.48Å
304	L	97.4	Very high	94.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.3	173.9	177.7	66.7	0	0	0	109.1	A294 C295 I312 I314 A342 W344 I351	A294-L304 CarbonylContact C-O 3.5Å; A294-L304 VanDerWaalsContact CA-O 3.28Å; A294-L304 WeakPolarHBondContact CA-O 3.32Å; C295-L304 PolarHBondContact N-O 2.91Å; C295-L304 PolarHBondContact O-N 2.83Å; L304-I312 HydrophobicContact CD1-CG2 3.36Å; L304-I312 HydrophobicContact CG-CG2 4.48Å; L304-I314 HydrophobicContact CD1-CG1 4.17Å; L304-A342 HydrophobicContact CD1-CB 4.44Å; L304-A342 HydrophobicContact CD2-CB 3.64Å; L304-A342 HydrophobicContact CG-CB 4.04Å; L304-W344 HydrophobicContact CB-CD2 4.45Å; L304-W344 VanDerWaalsContact CB-CE2 3.49Å; L304-W344 HydrophobicContact CB-CZ2 3.68Å; L304-W344 HydrophobicContact CD2-CD2 4.28Å; L304-W344 HydrophobicContact CD2-CG 4.35Å; L304-I351 HydrophobicContact CD1-CD1 3.73Å; L304-I351 HydrophobicContact CD1-CG1 4.15Å; L304-I351 HydrophobicContact CD1-CG2 4.12Å; L304-I351 HydrophobicContact CD2-CG1 4.13Å; L304-I351 HydrophobicContact CD2-CG2 3.78Å
305	T	97.6	Very high	94.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.2	-179	55.9	0	0	0	0	110	V267 H287 A293 A294 L303 I312 R313 Y315	V267-T305 HydrophobicContact CB-CG2 4.49Å; V267-T305 HydrophobicContact CG1-CG2 4.38Å; V267-T305 HydrophobicContact CG2-CG2 3.87Å; H287-T305 PolarHBondContact CE1-OG1 2.92Å; A293-T305 VanDerWaalsContact O-CA 3.31Å; A293-T305 WeakPolarHBondContact O-CA 3.16Å; A294-T305 HydrophobicContact CB-CG2 4.22Å; L303-T305 HydrophobicContact CD2-CG2 4.18Å; L303-T305 HydrophobicContact CG-CG2 4.15Å; T305-I312 WeakPolarHBondContact O-CA 3.44Å; T305-R313 PolarHBondContact N-O 3.4Å; T305-R313 PolarHBondContact O-N 2.87Å; T305-R313 WeakPolarHBondContact OG1-CB 3.47Å; T305-R313 PolarHBondContact OG1-O 2.61Å; T305-Y315 HydrophobicContact CG2-CD2 4.16Å; T305-Y315 HydrophobicContact CG2-CE2 4.03Å
306	T	97.3	Very high	94.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.1	-179.1	-26.4	0	0	0	0	108.9	V291 N292 A293 I312 A342	V291-T306 WeakPolarHBondContact CG1-O 3.04Å; N292-T306 PolarHBondContact N-O 2.82Å; A293-T306 PolarHBondContact O-N 3.04Å; A293-T306 VanDerWaalsContact O-N 3.07Å; T306-I312 HydrophobicContact CG2-CG1 4.3Å; T306-A342 HydrophobicContact CG2-CB 3.95Å; T306-A342 VanDerWaalsContact OG1-CB 3.26Å; T306-A342 WeakPolarHBondContact OG1-CB 3.45Å; T306-A342 PolarHBondContact OG1-N 3.25Å
307	D	96.3	Very high	94.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-179.3	177.2	88.7	-10.7	0	0	0	112.1	H289 P290 N292 K309 S310 E311 H331	H289-D307 HydrophobicContact CB-CB 4.29Å; H289-D307 IonicContact CD2-OD2 2.72Å; H289-D307 IonicContact CG-OD2 3.31Å; P290-D307 CarbonylContact O-C 3.46Å; P290-D307 WeakPolarHBondContact O-CA 3.19Å; N292-D307 PolarHBondContact ND2-O 3.34Å; D307-K309 PolarHBondContact OD1-N 3.23Å; D307-S310 PolarHBondContact OD1-N 2.97Å; D307-E311 HydrophobicContact CB-CB 4.47Å; D307-E311 VanDerWaalsContact CG-N 3.26Å; D307-E311 PolarHBondContact N-O 3.05Å; D307-E311 VanDerWaalsContact N-O 3.08Å; D307-E311 PolarHBondContact OD1-N 3.41Å; D307-E311 WeakPolarHBondContact OD2-CB 3.49Å; D307-E311 PolarHBondContact OD2-N 3.5Å; D307-H331 PolarHBondContact O-CD2 2.85Å; D307-H331 VanDerWaalsContact O-CD2 3.22Å; D307-H331 PolarHBondContact O-NE2 3.29Å; D307-H331 IonicContact OD1-CD2 3.65Å; D307-H331 IonicContact OD1-CE1 3.1Å; D307-H331 IonicContact OD1-NE2 3.49Å; D307-H331 PolarHBondContact OD1-NE2 3.34Å; D307-H331 VanDerWaalsContact OD1-NE2 3.15Å
308	Q	95.2	Very high	94.3	Very high	35 Å²	35	30.6 Å²	30.6	16%	0.164	18%	0.183	C	C	.	.	S	Bend	trans	-90.4	7.3	178	-84.2	-173.4	8.1	0	0	114.1	P290 N292 R332 H333	P290-Q308 HydrophobicContact CB-CB 4.09Å; P290-Q308 HydrophobicContact CB-CG 3.82Å; P290-Q308 WeakPolarHBondContact O-CB 3.46Å; P290-Q308 WeakPolarHBondContact O-CG 3.17Å; P290-Q308 PolarHBondContact O-N 2.72Å; N292-Q308 WeakPolarHBondContact ND2-CG 3.38Å; N292-Q308 WeakPolarHBondContact OD1-CG 3.36Å; N292-Q308 PolarHBondContact OD1-NE2 3.46Å; Q308-R332 CarbonylContact O-C 3.59Å; Q308-R332 WeakPolarHBondContact O-CA 3.47Å; Q308-H333 HydrophobicContact CB-CB 4.12Å; Q308-H333 HydrophobicContact CG-CB 4.3Å; Q308-H333 PolarHBondContact O-N 2.96Å
309	K	92.3	Very high	94.3	Very high	100 Å²	100	32.8 Å²	32.8	44%	0.435	19%	0.187	S	C	.	.	S	Bend	trans	-134.2	-71.4	-173.6	-161	172.7	-172.7	176.2	0	112.8	H289 D307 H331 R332	H289-K309 HydrophobicContact CB-CB 4.46Å; H289-K309 VanDerWaalsContact NE2-CD 3.35Å; H289-K309 WeakPolarHBondContact NE2-CD 3.13Å; D307-K309 PolarHBondContact OD1-N 3.23Å; K309-H331 CarbonylContact O-C 3.49Å; K309-H331 PolarHBondContact O-N 2.93Å; K309-H331 VanDerWaalsContact O-N 3.16Å; K309-R332 PolarHBondContact O-N 3.34Å
310	S	92.3	Very high	94.3	Very high	30 Å²	30	29.2 Å²	29.2	21%	0.21	17%	0.167	C	C	.	.	S	Bend	trans	-155.6	6.4	-169.9	63.1	0	0	0	0	117.4	D307 P328 H329 H331	D307-S310 PolarHBondContact OD1-N 2.97Å; S310-P328 WeakPolarHBondContact O-CA 3.37Å; S310-H329 CarbonylContact C-O 3.4Å; S310-H329 VanDerWaalsContact C-O 3.27Å; S310-H329 WeakPolarHBondContact CA-O 3.45Å; S310-H329 PolarHBondContact O-N 3.26Å; S310-H329 VanDerWaalsContact O-O 3.12Å; S310-H331 VanDerWaalsContact C-CE1 3.48Å
311	E	94.4	Very high	94.2	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.061	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120.7	-174.4	-61.2	-175.2	175.8	0	0	111.1	R288 D307 R313 L326 H331	R288-E311 WeakPolarHBondContact CD-OE1 3.46Å; R288-E311 IonicContact CZ-OE1 2.72Å; R288-E311 IonicContact NE-OE1 3.58Å; R288-E311 IonicContact NH1-OE1 3.51Å; R288-E311 PolarHBondContact NH1-OE1 2.99Å; D307-E311 HydrophobicContact CB-CB 4.47Å; D307-E311 VanDerWaalsContact CG-N 3.26Å; D307-E311 PolarHBondContact N-O 3.05Å; D307-E311 VanDerWaalsContact N-O 3.08Å; D307-E311 PolarHBondContact OD1-N 3.41Å; D307-E311 WeakPolarHBondContact OD2-CB 3.49Å; D307-E311 PolarHBondContact OD2-N 3.5Å; E311-R313 IonicContact OE2-CZ 3.5Å; E311-R313 IonicContact OE2-NE 3.37Å; E311-R313 PolarHBondContact OE2-NE 2.77Å; E311-R313 VanDerWaalsContact OE2-NE 3.09Å; E311-R313 IonicContact OE2-NH2 3.99Å; E311-R313 PolarHBondContact OE2-NH2 3.04Å; E311-L326 HydrophobicContact CG-CD1 4.33Å; E311-H331 PolarHBondContact N-CE1 3.16Å
312	I	96.3	Very high	94	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128	162.2	-58.4	155.5	0	0	0	107	L304 T305 T306 L326 I327 H329 V353	L304-I312 HydrophobicContact CD1-CG2 3.36Å; L304-I312 HydrophobicContact CG-CG2 4.48Å; T305-I312 WeakPolarHBondContact O-CA 3.44Å; T306-I312 HydrophobicContact CG2-CG1 4.3Å; I312-L326 WeakPolarHBondContact O-CA 3.42Å; I312-I327 HydrophobicContact CB-CB 4.16Å; I312-I327 HydrophobicContact CD1-CG2 4.46Å; I312-I327 PolarHBondContact N-O 2.85Å; I312-I327 PolarHBondContact O-N 3.12Å; I312-H329 HydrophobicContact CD1-CB 3.52Å; I312-H329 HydrophobicContact CG1-CB 4.31Å; I312-V353 HydrophobicContact CD1-CB 4.27Å; I312-V353 HydrophobicContact CD1-CG1 4.34Å; I312-V353 HydrophobicContact CD1-CG2 3.57Å; I312-V353 HydrophobicContact CG1-CG2 4.42Å
313	R	96	Very high	93.8	Very high	22 Å²	22	35.4 Å²	35.4	8%	0.083	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142	177.8	-47.8	-177.9	-176.1	173.8	-6.5	111.4	P286 H287 T305 E311 Y315 P323 L326	P286-R313 PolarHBondContact O-NH1 3.16Å; H287-R313 VanDerWaalsContact CE1-CD 3.48Å; H287-R313 WeakPolarHBondContact CE1-CD 2.98Å; T305-R313 PolarHBondContact N-O 3.4Å; T305-R313 PolarHBondContact O-N 2.87Å; T305-R313 WeakPolarHBondContact OG1-CB 3.47Å; T305-R313 PolarHBondContact OG1-O 2.61Å; E311-R313 IonicContact OE2-CZ 3.5Å; E311-R313 IonicContact OE2-NE 3.37Å; E311-R313 PolarHBondContact OE2-NE 2.77Å; E311-R313 VanDerWaalsContact OE2-NE 3.09Å; E311-R313 IonicContact OE2-NH2 3.99Å; E311-R313 PolarHBondContact OE2-NH2 3.04Å; R313-Y315 HydrophobicContact CB-CD2 4.47Å; R313-Y315 HydrophobicContact CB-CE2 3.81Å; R313-Y315 PolarHBondContact NH1-OH 2.88Å; R313-P323 HydrophobicContact CB-CB 4.25Å; R313-L326 HydrophobicContact CG-CD1 4.48Å; R313-L326 HydrophobicContact CG-CG 4.45Å
314	I	96.4	Very high	93.5	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.8	177.9	-54.1	173.7	0	0	0	107.3	L303 L304 P323 L324 G325 I327 W344 I351 G377	L303-I314 CarbonylContact O-C 3.55Å; L303-I314 WeakPolarHBondContact O-CA 3.35Å; L304-I314 HydrophobicContact CD1-CG1 4.17Å; I314-P323 CarbonylContact O-C 3.58Å; I314-P323 WeakPolarHBondContact O-CA 3.28Å; I314-L324 WeakPolarHBondContact O-CB 3.37Å; I314-L324 PolarHBondContact O-N 2.46Å; I314-G325 PolarHBondContact N-O 3.24Å; I314-G325 PolarHBondContact O-N 2.84Å; I314-I327 HydrophobicContact CD1-CD1 4.05Å; I314-W344 HydrophobicContact CG2-CH2 4.19Å; I314-W344 HydrophobicContact CG2-CZ2 4.37Å; I314-I351 HydrophobicContact CD1-CD1 3.5Å; I314-I351 VanDerWaalsContact CD1-CD1 3.5Å; I314-I351 HydrophobicContact CG1-CD1 4.03Å; I314-G377 VanDerWaalsContact CD1-O 3.26Å; I314-G377 WeakPolarHBondContact CD1-O 3.29Å
315	Y	95.5	Very high	93.1	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	156.2	174.2	-63.4	-91.4	0	0	0	110.1	L285 R302 L303 T305 R313 W320 P323	L285-Y315 HydrophobicContact CB-CE1 4.3Å; L285-Y315 HydrophobicContact CD1-CD1 3.97Å; L285-Y315 HydrophobicContact CD1-CD2 3.89Å; L285-Y315 HydrophobicContact CD1-CE1 3.94Å; L285-Y315 HydrophobicContact CD1-CE2 3.88Å; L285-Y315 HydrophobicContact CD1-CG 3.94Å; L285-Y315 HydrophobicContact CD2-CD1 4.15Å; L285-Y315 HydrophobicContact CD2-CE1 3.87Å; L285-Y315 HydrophobicContact CG-CE1 4.25Å; R302-Y315 WeakPolarHBondContact CA-O 3.48Å; R302-Y315 WeakPolarHBondContact CB-O 3.37Å; L303-Y315 PolarHBondContact N-O 3.24Å; L303-Y315 PolarHBondContact O-N 2.98Å; T305-Y315 HydrophobicContact CG2-CD2 4.16Å; T305-Y315 HydrophobicContact CG2-CE2 4.03Å; R313-Y315 HydrophobicContact CB-CD2 4.47Å; R313-Y315 HydrophobicContact CB-CE2 3.81Å; R313-Y315 PolarHBondContact NH1-OH 2.88Å; Y315-W320 WeakPolarHBondContact CD1-O 3.33Å; Y315-P323 HydrophobicContact CD1-CB 4.09Å; Y315-P323 HydrophobicContact CE1-CB 3.76Å; Y315-P323 HydrophobicContact CE1-CG 4.29Å
316	S	93.8	Very high	92.9	Very high	26 Å²	26	45.2 Å²	45.2	18%	0.182	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.9	-179.3	179.5	0	0	0	0	110.5	S318 Q319 W320	S316-S318 PolarHBondContact O-N 3.24Å; S316-Q319 CarbonylContact O-C 3.38Å; S316-Q319 PolarHBondContact O-N 2.89Å; S316-Q319 VanDerWaalsContact O-O 3.04Å; S316-W320 PolarHBondContact O-N 3.12Å
317	A	91.2	Very high	92.8	Very high	49 Å²	49	45.4 Å²	45.4	41%	0.405	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.6	176.4	0	0	0	0	0	114.2	A301 Q319 W320	A301-A317 WeakPolarHBondContact O-CB 3.12Å; A301-A317 PolarHBondContact O-N 3.25Å; A317-Q319 VanDerWaalsContact C-N 3.28Å; A317-Q319 PolarHBondContact O-N 2.94Å; A317-W320 VanDerWaalsContact CA-CE2 3.47Å; A317-W320 VanDerWaalsContact CA-CZ2 3.44Å; A317-W320 HydrophobicContact CB-CH2 4.38Å; A317-W320 HydrophobicContact CB-CZ2 3.69Å
318	S	89.9	Confident	92.6	Very high	118 Å²	118	49.1 Å²	49.1	83%	0.825	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.6	174.9	-55.1	0	0	0	0	112.6	S316	S316-S318 PolarHBondContact O-N 3.24Å
319	Q	91.4	Very high	92.5	Very high	113 Å²	113	47.4 Å²	47.4	53%	0.528	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-155.7	102.8	177.6	-173.3	172	34.8	0	0	109.8	S316 A317 C322	S316-Q319 CarbonylContact O-C 3.38Å; S316-Q319 PolarHBondContact O-N 2.89Å; S316-Q319 VanDerWaalsContact O-O 3.04Å; A317-Q319 VanDerWaalsContact C-N 3.28Å; A317-Q319 PolarHBondContact O-N 2.94Å; Q319-C322 HydrophobicContact CG-CB 4.45Å
320	W	91.6	Very high	92.6	Very high	13 Å²	13	42.7 Å²	42.7	5%	0.049	26%	0.259	C	S	.	.	S	Bend	trans	-75.3	-31.4	180	-69.5	111.8	0	0	0	112.8	F257 I269 Y283 L285 F296 L303 Y315 S316 A317 C322	F257-W320 HydrophobicContact CE1-CH2 4.45Å; F257-W320 AromaticContact CE1-CZ2 3.76Å; F257-W320 HydrophobicContact CE1-CZ2 3.76Å; F257-W320 AromaticContact CZ-CE2 3.79Å; F257-W320 AromaticContact CZ-CZ2 3.9Å; F257-W320 HydrophobicContact CZ-CZ2 3.9Å; F257-W320 AromaticContact CZ-NE1 3.68Å; I269-W320 HydrophobicContact CD1-CB 4.19Å; I269-W320 HydrophobicContact CD1-CD2 3.54Å; I269-W320 HydrophobicContact CD1-CE3 3.59Å; I269-W320 HydrophobicContact CD1-CG 3.83Å; I269-W320 HydrophobicContact CD1-CZ3 4.25Å; Y283-W320 HydrophobicContact CD1-CB 3.92Å; Y283-W320 HydrophobicContact CD2-CB 3.88Å; Y283-W320 AromaticContact CD2-CD1 3.67Å; Y283-W320 AromaticContact CD2-CG 3.95Å; Y283-W320 HydrophobicContact CD2-CG 3.95Å; Y283-W320 HydrophobicContact CE1-CB 4.29Å; Y283-W320 HydrophobicContact CE2-CB 4.28Å; Y283-W320 AromaticContact CE2-CD1 3.46Å; Y283-W320 VanDerWaalsContact CE2-CD1 3.46Å; Y283-W320 HydrophobicContact CE2-CG 4.15Å; Y283-W320 HydrophobicContact CG-CB 3.7Å; Y283-W320 HydrophobicContact CG-CG 4.28Å; Y283-W320 AromaticContact CZ-CD1 3.99Å; L285-W320 WeakPolarHBondContact CD2-O 3.26Å; F296-W320 AromaticContact CE1-CH2 3.99Å; F296-W320 HydrophobicContact CE1-CH2 3.99Å; F296-W320 HydrophobicContact CE1-CZ2 4.44Å; L303-W320 HydrophobicContact CB-CE3 4.45Å; L303-W320 HydrophobicContact CB-CH2 4.05Å; L303-W320 HydrophobicContact CB-CZ3 3.48Å; L303-W320 VanDerWaalsContact CB-CZ3 3.48Å; Y315-W320 WeakPolarHBondContact CD1-O 3.33Å; S316-W320 PolarHBondContact O-N 3.12Å; A317-W320 VanDerWaalsContact CA-CE2 3.47Å; A317-W320 VanDerWaalsContact CA-CZ2 3.44Å; A317-W320 HydrophobicContact CB-CH2 4.38Å; A317-W320 HydrophobicContact CB-CZ2 3.69Å; W320-C322 PolarHBondContact O-N 2.95Å; W320-C322 VanDerWaalsContact O-N 3.16Å
321	D	88.9	Confident	92.7	Very high	99 Å²	99	41.3 Å²	41.3	53%	0.529	25%	0.249	S	C	.	.	S	Bend	trans	-61.9	-29	-174.3	-60.1	-45.8	0	0	0	114	Y283	Y283-D321 WeakPolarHBondContact CD1-OD1 3.34Å
322	C	89.2	Confident	92.6	Very high	64 Å²	64	44.6 Å²	44.6	43%	0.432	26%	0.261	S	S	.	.	S	Bend	trans	-117.1	129.6	-176.4	-69.3	0	0	0	0	110.5	Q319 W320 L324	Q319-C322 HydrophobicContact CG-CB 4.45Å; W320-C322 PolarHBondContact O-N 2.95Å; W320-C322 VanDerWaalsContact O-N 3.16Å; C322-L324 PolarHBondContact O-N 3.04Å
323	P	90.2	Very high	92.4	Very high	56 Å²	56	49 Å²	49	36%	0.364	28%	0.281	S	S	.	.			trans	-67.3	132.2	172.6	28.1	-32.4	0	0	0	109.9	R313 I314 Y315 G325	R313-P323 HydrophobicContact CB-CB 4.25Å; I314-P323 CarbonylContact O-C 3.58Å; I314-P323 WeakPolarHBondContact O-CA 3.28Å; Y315-P323 HydrophobicContact CD1-CB 4.09Å; Y315-P323 HydrophobicContact CE1-CB 3.76Å; Y315-P323 HydrophobicContact CE1-CG 4.29Å; P323-G325 PolarHBondContact O-N 3.27Å
324	L	90.5	Very high	92.3	Very high	94 Å²	94	52.4 Å²	52.4	49%	0.492	30%	0.297	S	S	.	.	S	Bend	trans	-59.8	-37.9	172.5	-175.2	69.7	0	0	0	111.2	I314 C322	I314-L324 WeakPolarHBondContact O-CB 3.37Å; I314-L324 PolarHBondContact O-N 2.46Å; C322-L324 PolarHBondContact O-N 3.04Å
325	G	89.3	Confident	92	Very high	26 Å²	26	59.3 Å²	59.3	27%	0.268	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150.1	-179	0	0	0	0	0	112.4	I314 P323	I314-G325 PolarHBondContact N-O 3.24Å; I314-G325 PolarHBondContact O-N 2.84Å; P323-G325 PolarHBondContact O-N 3.27Å
326	L	93.5	Very high	91.8	Very high	85 Å²	85	64.9 Å²	64.9	45%	0.445	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.2	171.2	-174.6	155.2	0	0	0	107.9	E311 I312 R313	E311-L326 HydrophobicContact CG-CD1 4.33Å; I312-L326 WeakPolarHBondContact O-CA 3.42Å; R313-L326 HydrophobicContact CG-CD1 4.48Å; R313-L326 HydrophobicContact CG-CG 4.45Å
327	I	94.1	Very high	91.8	Very high	4 Å²	4	64.7 Å²	64.7	2%	0.021	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.2	176.9	-54.2	168.9	0	0	0	107.1	I312 I314 H329 I351 F375	I312-I327 HydrophobicContact CB-CB 4.16Å; I312-I327 HydrophobicContact CD1-CG2 4.46Å; I312-I327 PolarHBondContact N-O 2.85Å; I312-I327 PolarHBondContact O-N 3.12Å; I314-I327 HydrophobicContact CD1-CD1 4.05Å; I327-H329 PolarHBondContact O-N 3.46Å; I327-I351 HydrophobicContact CD1-CD1 4.12Å; I327-F375 HydrophobicContact CD1-CB 4.05Å; I327-F375 HydrophobicContact CD1-CD1 4.44Å; I327-F375 HydrophobicContact CD1-CG 4.26Å; I327-F375 HydrophobicContact CG2-CD1 3.58Å; I327-F375 HydrophobicContact CG2-CE1 3.48Å; I327-F375 VanDerWaalsContact CG2-CE1 3.48Å; I327-F375 HydrophobicContact CG2-CE2 4.42Å; I327-F375 HydrophobicContact CG2-CG 4.13Å; I327-F375 HydrophobicContact CG2-CZ 3.94Å
328	P	93.3	Very high	92	Very high	78 Å²	78	62.7 Å²	62.7	51%	0.506	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.6	173.5	32.4	-32.6	0	0	0	108.4	S310 F361	S310-P328 WeakPolarHBondContact O-CA 3.37Å; P328-F361 HydrophobicContact CB-CE2 4.24Å; P328-F361 HydrophobicContact CB-CZ 3.89Å
329	H	93.6	Very high	92.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.31	C	S	.	.			trans	-147.9	134.1	-176.2	172.2	-96.3	0	0	0	109.2	S310 I312 I327 H331 V353 G354 D373 F375	S310-H329 CarbonylContact C-O 3.4Å; S310-H329 VanDerWaalsContact C-O 3.27Å; S310-H329 WeakPolarHBondContact CA-O 3.45Å; S310-H329 PolarHBondContact O-N 3.26Å; S310-H329 VanDerWaalsContact O-O 3.12Å; I312-H329 HydrophobicContact CD1-CB 3.52Å; I312-H329 HydrophobicContact CG1-CB 4.31Å; I327-H329 PolarHBondContact O-N 3.46Å; H329-H331 AromaticContact CG-ND1 3.81Å; H329-H331 AromaticContact ND1-CE1 3.95Å; H329-H331 AromaticContact ND1-CG 3.66Å; H329-H331 AromaticContact ND1-ND1 3Å; H329-H331 PolarHBondContact ND1-ND1 3.15Å; H329-H331 PolarHBondContact O-CE1 2.84Å; H329-H331 VanDerWaalsContact O-CE1 3.25Å; H329-H331 PolarHBondContact O-N 3.29Å; H329-H331 PolarHBondContact O-ND1 3.38Å; H329-V353 VanDerWaalsContact CE1-CG1 3.46Å; H329-V353 WeakPolarHBondContact CE1-CG1 3.3Å; H329-G354 PolarHBondContact CE1-O 3.34Å; H329-G354 VanDerWaalsContact CE1-O 3.25Å; H329-D373 IonicContact CD2-OD2 3.22Å; H329-D373 PolarHBondContact CD2-OD2 2.91Å; H329-D373 IonicContact NE2-OD2 2.63Å; H329-D373 PolarHBondContact NE2-OD2 2.92Å; H329-F375 HydrophobicContact CB-CZ 4.46Å; H329-F375 AromaticContact CD2-CE2 3.81Å; H329-F375 AromaticContact CD2-CZ 3.8Å
330	P	93.4	Very high	92.6	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	29%	0.285	C	S	.	.			trans	-82.6	114.4	-176	32.6	-31.3	0	0	0	110.8	R355 Y356 F361	P330-R355 VanDerWaalsContact CD-NH1 3.29Å; P330-R355 HydrophobicContact CG-CG 3.87Å; P330-R355 VanDerWaalsContact CG-NH1 3.29Å; P330-Y356 CarbonylContact C-O 3.59Å; P330-Y356 WeakPolarHBondContact CB-O 3.36Å; P330-Y356 PolarHBondContact O-N 3.32Å; P330-F361 HydrophobicContact CB-CB 4.43Å; P330-F361 HydrophobicContact CB-CD1 4.08Å; P330-F361 HydrophobicContact CB-CD2 4.44Å; P330-F361 HydrophobicContact CB-CE1 4.38Å; P330-F361 HydrophobicContact CB-CG 4.09Å; P330-F361 HydrophobicContact CG-CD1 4.17Å; P330-F361 HydrophobicContact CG-CE1 4.22Å
331	H	93.8	Very high	92.8	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-151.6	54	-177.8	55.2	-83.2	0	0	0	112.1	D307 K309 S310 E311 H329 I340	D307-H331 PolarHBondContact O-CD2 2.85Å; D307-H331 VanDerWaalsContact O-CD2 3.22Å; D307-H331 PolarHBondContact O-NE2 3.29Å; D307-H331 IonicContact OD1-CD2 3.65Å; D307-H331 IonicContact OD1-CE1 3.1Å; D307-H331 IonicContact OD1-NE2 3.49Å; D307-H331 PolarHBondContact OD1-NE2 3.34Å; D307-H331 VanDerWaalsContact OD1-NE2 3.15Å; K309-H331 CarbonylContact O-C 3.49Å; K309-H331 PolarHBondContact O-N 2.93Å; K309-H331 VanDerWaalsContact O-N 3.16Å; S310-H331 VanDerWaalsContact C-CE1 3.48Å; E311-H331 PolarHBondContact N-CE1 3.16Å; H329-H331 AromaticContact CG-ND1 3.81Å; H329-H331 AromaticContact ND1-CE1 3.95Å; H329-H331 AromaticContact ND1-CG 3.66Å; H329-H331 AromaticContact ND1-ND1 3Å; H329-H331 PolarHBondContact ND1-ND1 3.15Å; H329-H331 PolarHBondContact O-CE1 2.84Å; H329-H331 VanDerWaalsContact O-CE1 3.25Å; H329-H331 PolarHBondContact O-N 3.29Å; H329-H331 PolarHBondContact O-ND1 3.38Å; H331-I340 HydrophobicContact CB-CB 4.17Å; H331-I340 HydrophobicContact CB-CD1 3.72Å; H331-I340 HydrophobicContact CB-CG2 4.06Å
332	R	92.6	Very high	93.2	Very high	82 Å²	82	50.9 Å²	50.9	31%	0.309	27%	0.267	S	S	.	.			trans	-63.9	150.9	-174.9	66.3	177.3	165.5	111.7	-6.6	113.6	Q308 K309 Y356	Q308-R332 CarbonylContact O-C 3.59Å; Q308-R332 WeakPolarHBondContact O-CA 3.47Å; K309-R332 PolarHBondContact O-N 3.34Å; R332-Y356 HydrophobicContact CB-CD1 4.33Å; R332-Y356 HydrophobicContact CG-CD1 3.19Å; R332-Y356 HydrophobicContact CG-CE1 3.25Å; R332-Y356 HydrophobicContact CG-CG 4.37Å; R332-Y356 PolarHBondContact NH1-OH 2.9Å; R332-Y356 PolarHBondContact NH2-OH 3.36Å; R332-Y356 WeakPolarHBondContact O-CD1 3.26Å
333	H	93.3	Very high	93.6	Very high	91 Å²	91	48.5 Å²	48.5	42%	0.421	25%	0.252	S	S	.	.			trans	-67	140.8	172.1	179.9	70.8	0	0	0	112.2	Q308	Q308-H333 HydrophobicContact CB-CB 4.12Å; Q308-H333 HydrophobicContact CG-CB 4.3Å; Q308-H333 PolarHBondContact O-N 2.96Å
334	F	93.4	Very high	93.9	Very high	95 Å²	95	46.8 Å²	46.8	42%	0.417	24%	0.238	S	C	.	.			trans	-145.2	135.9	169.2	-174.2	-104.9	0	0	0	109.4	H336 L337 Y356	F334-H336 VanDerWaalsContact C-N 3.31Å; F334-H336 HydrophobicContact CD1-CB 4.2Å; F334-H336 HydrophobicContact CE1-CB 3.88Å; F334-H336 PolarHBondContact O-N 3.38Å; F334-L337 HydrophobicContact CB-CB 3.84Å; F334-L337 HydrophobicContact CD1-CB 4.11Å; F334-L337 HydrophobicContact CG-CB 4.49Å; F334-L337 PolarHBondContact O-N 3.13Å; F334-L337 VanDerWaalsContact O-O 3.11Å; F334-Y356 HydrophobicContact CB-CE1 4.5Å
335	Q	90.8	Very high	94.2	Very high	147 Å²	147	42.3 Å²	42.3	69%	0.687	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-38.1	-169.5	-179.4	176.1	-8.3	0	0	114	R113	R113-Q335 PolarHBondContact NH2-O 2.86Å; R113-Q335 VanDerWaalsContact NH2-O 3.14Å
336	H	90	Very high	94.5	Very high	121 Å²	121	43 Å²	43	56%	0.56	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-0.7	179.4	-55.4	-75.2	0	0	0	113.5	R113 F334	R113-H336 WeakPolarHBondContact CD-O 3.4Å; R113-H336 PolarHBondContact NE-O 2.75Å; R113-H336 PolarHBondContact NH1-O 3.32Å; F334-H336 VanDerWaalsContact C-N 3.31Å; F334-H336 HydrophobicContact CD1-CB 4.2Å; F334-H336 HydrophobicContact CE1-CB 3.88Å; F334-H336 PolarHBondContact O-N 3.38Å
337	L	93.6	Very high	94.4	Very high	22 Å²	22	46.2 Å²	46.2	12%	0.115	22%	0.221	C	C	.	.	S	Bend	trans	-93.2	140.1	172.2	-170.2	65.7	0	0	0	108.9	F334 I340 Y356 I394 S396	F334-L337 HydrophobicContact CB-CB 3.84Å; F334-L337 HydrophobicContact CD1-CB 4.11Å; F334-L337 HydrophobicContact CG-CB 4.49Å; F334-L337 PolarHBondContact O-N 3.13Å; F334-L337 VanDerWaalsContact O-O 3.11Å; L337-I340 HydrophobicContact CD2-CD1 4.17Å; L337-I340 HydrophobicContact CD2-CG1 4.32Å; L337-Y356 HydrophobicContact CD2-CD1 4.32Å; L337-Y356 HydrophobicContact CD2-CE1 4.45Å; L337-I394 HydrophobicContact CD1-CB 4.22Å; L337-I394 HydrophobicContact CD1-CD1 4.5Å; L337-I394 HydrophobicContact CD1-CG2 4.2Å; L337-I394 HydrophobicContact CD2-CG2 4.17Å; L337-S396 WeakPolarHBondContact CD1-OG 3.49Å
338	T	95.4	Very high	94.4	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.037	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-66.4	132.6	168.8	-65	0	0	0	0	108	A114 I340 S396 L397	A114-T338 PolarHBondContact O-OG1 3.22Å; T338-I340 PolarHBondContact O-N 3.05Å; T338-S396 WeakPolarHBondContact O-CB 3.38Å; T338-S396 PolarHBondContact O-OG 3.1Å; T338-L397 HydrophobicContact CG2-CD1 4.12Å; T338-L397 HydrophobicContact CG2-CG 4.13Å
339	P	96.4	Very high	94.4	Very high	48 Å²	48	45.7 Å²	45.7	31%	0.312	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-54	127.3	-178.2	-25.4	33.7	0	0	0	110.9	N292 K341	N292-P339 HydrophobicContact CB-CB 4.19Å; P339-K341 PolarHBondContact O-N 2.8Å
340	I	97.2	Very high	94.5	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.015	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-67.2	129.8	-179.6	-61.1	168.7	0	0	0	108.2	H331 L337 T338 V353 I394 S396	H331-I340 HydrophobicContact CB-CB 4.17Å; H331-I340 HydrophobicContact CB-CD1 3.72Å; H331-I340 HydrophobicContact CB-CG2 4.06Å; L337-I340 HydrophobicContact CD2-CD1 4.17Å; L337-I340 HydrophobicContact CD2-CG1 4.32Å; T338-I340 PolarHBondContact O-N 3.05Å; I340-V353 HydrophobicContact CG2-CG1 3.7Å; I340-I394 HydrophobicContact CD1-CG2 4.4Å; I340-S396 WeakPolarHBondContact CA-O 3.45Å
341	K	96.9	Very high	94.7	Very high	44 Å²	44	45.7 Å²	45.7	19%	0.191	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-122.3	131.7	178.8	-60.4	-175.4	178.1	178	0	109.3	A293 P339 S396 L397	A293-K341 HydrophobicContact CB-CB 3.98Å; A293-K341 HydrophobicContact CB-CD 4.19Å; A293-K341 HydrophobicContact CB-CG 3.92Å; P339-K341 PolarHBondContact O-N 2.8Å; K341-S396 PolarHBondContact N-O 3Å; K341-L397 HydrophobicContact CB-CD2 4.24Å; K341-L397 HydrophobicContact CD-CD2 4.06Å; K341-L397 HydrophobicContact CG-CD2 4.19Å
342	A	96.9	Very high	94.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.008	21%	0.21	C	C	.	.			trans	-80.8	138.6	170.3	0	0	0	0	0	109.6	L304 T306 I351 V352 V353	L304-A342 HydrophobicContact CD1-CB 4.44Å; L304-A342 HydrophobicContact CD2-CB 3.64Å; L304-A342 HydrophobicContact CG-CB 4.04Å; T306-A342 HydrophobicContact CG2-CB 3.95Å; T306-A342 VanDerWaalsContact OG1-CB 3.26Å; T306-A342 WeakPolarHBondContact OG1-CB 3.45Å; T306-A342 PolarHBondContact OG1-N 3.25Å; A342-I351 HydrophobicContact CB-CG2 4.15Å; A342-V352 WeakPolarHBondContact CA-O 3.49Å; A342-V353 HydrophobicContact CB-CB 4.47Å; A342-V353 HydrophobicContact CB-CG1 4.44Å; A342-V353 HydrophobicContact CB-CG2 3.37Å
343	A	97.3	Very high	95.1	Very high	14 Å²	14	41.7 Å²	41.7	12%	0.116	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150.3	176.7	0	0	0	0	0	111.1	I351 V352 N398	A343-I351 WeakPolarHBondContact O-CA 3.22Å; A343-V352 HydrophobicContact CB-CG2 4.09Å; A343-V352 PolarHBondContact N-O 3.15Å; A343-V352 VanDerWaalsContact N-O 3.09Å; A343-V352 PolarHBondContact O-N 2.76Å; A343-N398 WeakPolarHBondContact CB-O 3.47Å
344	W	97.4	Very high	95.2	Very high	20 Å²	20	37.4 Å²	37.4	8%	0.076	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	148.5	170.2	-71.3	107.9	0	0	0	110.7	C295 F296 R302 L304 I314 N349 I351	C295-W344 PolarHBondContact O-NE1 2.94Å; C295-W344 VanDerWaalsContact O-NE1 3.15Å; F296-W344 VanDerWaalsContact O-CD1 3.25Å; R302-W344 HydrophobicContact CB-CZ2 4.08Å; L304-W344 HydrophobicContact CB-CD2 4.45Å; L304-W344 VanDerWaalsContact CB-CE2 3.49Å; L304-W344 HydrophobicContact CB-CZ2 3.68Å; L304-W344 HydrophobicContact CD2-CD2 4.28Å; L304-W344 HydrophobicContact CD2-CG 4.35Å; I314-W344 HydrophobicContact CG2-CH2 4.19Å; I314-W344 HydrophobicContact CG2-CZ2 4.37Å; W344-N349 WeakPolarHBondContact CZ3-OD1 3.39Å; W344-I351 HydrophobicContact CD2-CG1 4.36Å; W344-I351 HydrophobicContact CE3-CG1 3.69Å; W344-I351 HydrophobicContact CH2-CD1 3.91Å; W344-I351 HydrophobicContact CH2-CG1 3.97Å; W344-I351 HydrophobicContact CZ3-CD1 3.84Å; W344-I351 HydrophobicContact CZ3-CG1 3.46Å; W344-I351 VanDerWaalsContact CZ3-CG1 3.46Å
345	H	96.9	Very high	95.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.157	C	C	.	.			trans	-71.9	137.6	161.5	-172.4	-58.3	0	0	0	109.6	F94 R347 Y348 L350 F400 G404	F94-H345 AromaticContact CE1-CD2 3.64Å; F94-H345 AromaticContact CE1-NE2 3.49Å; F94-H345 WeakPolarHBondContact CE1-NE2 3.42Å; F94-H345 AromaticContact CE2-NE2 3.89Å; F94-H345 AromaticContact CZ-CD2 3.77Å; F94-H345 AromaticContact CZ-NE2 3.3Å; F94-H345 VanDerWaalsContact CZ-NE2 3.3Å; F94-H345 WeakPolarHBondContact CZ-NE2 3.41Å; H345-R347 PolarHBondContact ND1-N 3.25Å; H345-R347 VanDerWaalsContact ND1-N 3.13Å; H345-R347 PolarHBondContact O-N 2.97Å; H345-Y348 AromaticContact CE1-CD2 3.5Å; H345-Y348 VanDerWaalsContact CE1-CD2 3.5Å; H345-Y348 WeakPolarHBondContact CE1-CD2 3.48Å; H345-Y348 PolarHBondContact ND1-N 2.95Å; H345-Y348 AromaticContact NE2-CD2 3.66Å; H345-L350 HydrophobicContact CB-CB 3.88Å; H345-L350 PolarHBondContact N-O 2.97Å; H345-F400 HydrophobicContact CB-CD2 4.13Å; H345-F400 HydrophobicContact CB-CE2 4.47Å; H345-F400 AromaticContact CD2-CD2 3.57Å; H345-F400 AromaticContact CD2-CE2 3.59Å; H345-F400 AromaticContact CD2-CG 3.88Å; H345-F400 AromaticContact CD2-CZ 3.97Å; H345-G404 VanDerWaalsContact CE1-CA 3.47Å; H345-G404 WeakPolarHBondContact CE1-CA 3.31Å; H345-G404 PolarHBondContact NE2-O 3.42Å; H345-G404 VanDerWaalsContact NE2-O 3.14Å
346	P	94.2	Very high	95.4	Very high	40 Å²	40	27.4 Å²	27.4	26%	0.26	13%	0.129	S	C	.	.	S	Bend	trans	-71.4	-2.8	-173.7	21.4	-29.5	0	0	0	115.7	F400 N401	P346-F400 HydrophobicContact CG-CB 4.23Å; P346-N401 WeakPolarHBondContact CG-O 3.49Å
347	R	92.6	Very high	95.4	Very high	153 Å²	153	23 Å²	23	58%	0.577	11%	0.111	S	C	*	.	S	Bend	trans	-139.3	-43.3	-169.6	-61.7	-167.6	69.8	161.9	4.4	112.8	Q87 H345 M403	Q87-R347 PolarHBondContact NE2-O 2.96Å; H345-R347 PolarHBondContact ND1-N 3.25Å; H345-R347 VanDerWaalsContact ND1-N 3.13Å; H345-R347 PolarHBondContact O-N 2.97Å; R347-M403 WeakPolarHBondContact CD-O 3.34Å
348	Y	93.1	Very high	95	Very high	44 Å²	44	23.1 Å²	23.1	17%	0.173	11%	0.112	C	C	.	.	S	Bend	trans	-101.9	162.1	176.3	-57.2	-60.3	0	0	0	111	L90 Q91 F94 H345 L350	L90-Y348 HydrophobicContact CB-CE1 3.83Å; Q91-Y348 HydrophobicContact CB-CD1 3.8Å; Q91-Y348 HydrophobicContact CB-CE1 4.41Å; Q91-Y348 HydrophobicContact CB-CG 4.15Å; Q91-Y348 HydrophobicContact CG-CD1 4.45Å; Q91-Y348 HydrophobicContact CG-CG 4.31Å; F94-Y348 HydrophobicContact CB-CD2 4.14Å; F94-Y348 HydrophobicContact CB-CE2 3.7Å; F94-Y348 AromaticContact CD1-CD2 3.9Å; F94-Y348 HydrophobicContact CD1-CD2 3.9Å; F94-Y348 HydrophobicContact CD1-CE2 4.19Å; F94-Y348 HydrophobicContact CD2-CD2 4.49Å; F94-Y348 HydrophobicContact CD2-CE2 4.05Å; F94-Y348 HydrophobicContact CE1-CD2 4.45Å; F94-Y348 AromaticContact CG-CD2 3.9Å; F94-Y348 HydrophobicContact CG-CD2 3.9Å; F94-Y348 AromaticContact CG-CE2 3.7Å; F94-Y348 HydrophobicContact CG-CE2 3.7Å; H345-Y348 AromaticContact CE1-CD2 3.5Å; H345-Y348 VanDerWaalsContact CE1-CD2 3.5Å; H345-Y348 WeakPolarHBondContact CE1-CD2 3.48Å; H345-Y348 PolarHBondContact ND1-N 2.95Å; H345-Y348 AromaticContact NE2-CD2 3.66Å; Y348-L350 PolarHBondContact O-N 2.92Å
349	N	93.3	Very high	94.4	Very high	27 Å²	27	28.7 Å²	28.7	14%	0.144	15%	0.148	C	C	.	.	S	Bend	trans	-85.6	61.7	178.8	-174.2	25.7	0	0	0	110.4	Q91 R302 W344 G377 N378	Q91-N349 VanDerWaalsContact OE1-N 3.15Å; R302-N349 PolarHBondContact NH1-ND2 3.28Å; R302-N349 VanDerWaalsContact NH1-ND2 3.13Å; W344-N349 WeakPolarHBondContact CZ3-OD1 3.39Å; N349-G377 PolarHBondContact O-N 3.38Å; N349-N378 PolarHBondContact ND2-N 2.82Å; N349-N378 PolarHBondContact ND2-ND2 3.25Å; N349-N378 VanDerWaalsContact ND2-ND2 3.19Å; N349-N378 PolarHBondContact ND2-OD1 2.9Å
350	L	95.8	Very high	93.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	149.5	-179.1	-63.6	175.2	0	0	0	110.4	Q91 F94 L95 H345 Y348 V374 F375	Q91-L350 HydrophobicContact CG-CD1 4.24Å; Q91-L350 HydrophobicContact CG-CD2 4.12Å; Q91-L350 HydrophobicContact CG-CG 4.15Å; F94-L350 HydrophobicContact CD1-CD1 3.65Å; F94-L350 HydrophobicContact CE1-CD1 3.69Å; L95-L350 HydrophobicContact CD1-CD2 4.48Å; L95-L350 HydrophobicContact CD2-CD1 3.92Å; L95-L350 HydrophobicContact CD2-CD2 4.09Å; L95-L350 HydrophobicContact CG-CD1 4.4Å; H345-L350 HydrophobicContact CB-CB 3.88Å; H345-L350 PolarHBondContact N-O 2.97Å; Y348-L350 PolarHBondContact O-N 2.92Å; L350-V374 HydrophobicContact CB-CG1 4.25Å; L350-V374 HydrophobicContact CD1-CG1 4.35Å; L350-V374 HydrophobicContact CD2-CG1 4.29Å; L350-F375 WeakPolarHBondContact CA-O 3.5Å
351	I	97.4	Very high	93.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.5	178.7	-62.6	161.4	0	0	0	108.1	L304 I314 I327 A342 A343 W344 V353 V374 F375	L304-I351 HydrophobicContact CD1-CD1 3.73Å; L304-I351 HydrophobicContact CD1-CG1 4.15Å; L304-I351 HydrophobicContact CD1-CG2 4.12Å; L304-I351 HydrophobicContact CD2-CG1 4.13Å; L304-I351 HydrophobicContact CD2-CG2 3.78Å; I314-I351 HydrophobicContact CD1-CD1 3.5Å; I314-I351 VanDerWaalsContact CD1-CD1 3.5Å; I314-I351 HydrophobicContact CG1-CD1 4.03Å; I327-I351 HydrophobicContact CD1-CD1 4.12Å; A342-I351 HydrophobicContact CB-CG2 4.15Å; A343-I351 WeakPolarHBondContact O-CA 3.22Å; W344-I351 HydrophobicContact CD2-CG1 4.36Å; W344-I351 HydrophobicContact CE3-CG1 3.69Å; W344-I351 HydrophobicContact CH2-CD1 3.91Å; W344-I351 HydrophobicContact CH2-CG1 3.97Å; W344-I351 HydrophobicContact CZ3-CD1 3.84Å; W344-I351 HydrophobicContact CZ3-CG1 3.46Å; W344-I351 VanDerWaalsContact CZ3-CG1 3.46Å; I351-V353 HydrophobicContact CG2-CG2 3.84Å; I351-V374 CarbonylContact O-C 3.15Å; I351-V374 VanDerWaalsContact O-CA 3.3Å; I351-V374 WeakPolarHBondContact O-CA 3.28Å; I351-F375 HydrophobicContact CB-CB 4.32Å; I351-F375 PolarHBondContact N-O 3.01Å; I351-F375 PolarHBondContact O-N 2.89Å
352	V	97.3	Very high	92.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.9	174.1	-69.1	0	0	0	0	111.4	A342 A343 D373 V374 N398 F400 L407	A342-V352 WeakPolarHBondContact CA-O 3.49Å; A343-V352 HydrophobicContact CB-CG2 4.09Å; A343-V352 PolarHBondContact N-O 3.15Å; A343-V352 VanDerWaalsContact N-O 3.09Å; A343-V352 PolarHBondContact O-N 2.76Å; V352-D373 WeakPolarHBondContact CA-O 3.31Å; V352-V374 HydrophobicContact CG1-CG1 4.42Å; V352-V374 HydrophobicContact CG1-CG2 3.79Å; V352-N398 HydrophobicContact CB-CB 4.32Å; V352-N398 HydrophobicContact CG2-CB 4.01Å; V352-F400 HydrophobicContact CG1-CD2 4.12Å; V352-F400 HydrophobicContact CG1-CE2 3.39Å; V352-F400 HydrophobicContact CG1-CZ 4.2Å; V352-F400 HydrophobicContact CG2-CD2 4.36Å; V352-F400 HydrophobicContact CG2-CE2 4.42Å; V352-L407 HydrophobicContact CG2-CD1 4.43Å
353	V	97.3	Very high	90.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	140.5	178.4	-163.5	0	0	0	0	109.6	I312 H329 I340 A342 I351 D373	I312-V353 HydrophobicContact CD1-CB 4.27Å; I312-V353 HydrophobicContact CD1-CG1 4.34Å; I312-V353 HydrophobicContact CD1-CG2 3.57Å; I312-V353 HydrophobicContact CG1-CG2 4.42Å; H329-V353 VanDerWaalsContact CE1-CG1 3.46Å; H329-V353 WeakPolarHBondContact CE1-CG1 3.3Å; I340-V353 HydrophobicContact CG2-CG1 3.7Å; A342-V353 HydrophobicContact CB-CB 4.47Å; A342-V353 HydrophobicContact CB-CG1 4.44Å; A342-V353 HydrophobicContact CB-CG2 3.37Å; I351-V353 HydrophobicContact CG2-CG2 3.84Å; V353-D373 PolarHBondContact N-O 3.02Å; V353-D373 PolarHBondContact O-N 3.09Å
354	G	95.9	Very high	89.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.5	174.3	0	0	0	0	0	111.7	H329 S395 N398	H329-G354 PolarHBondContact CE1-O 3.34Å; H329-G354 VanDerWaalsContact CE1-O 3.25Å; G354-S395 WeakPolarHBondContact CA-O 3.35Å; G354-N398 PolarHBondContact N-ND2 2.99Å
355	R	94.1	Very high	88	Confident	9 Å²	9	50.3 Å²	50.3	3%	0.034	26%	0.262	C	S	.	.			trans	-79.1	130.3	-178.1	-176.5	169.9	-75.5	-97.5	-8.8	111.2	P330 P357 E368 T371 D373	P330-R355 VanDerWaalsContact CD-NH1 3.29Å; P330-R355 HydrophobicContact CG-CG 3.87Å; P330-R355 VanDerWaalsContact CG-NH1 3.29Å; R355-P357 HydrophobicContact CG-CG 4.36Å; R355-E368 WeakPolarHBondContact CD-OE1 3.25Å; R355-E368 IonicContact CZ-OE1 3.86Å; R355-E368 IonicContact NE-OE1 3.03Å; R355-E368 PolarHBondContact NE-OE1 2.93Å; R355-E368 VanDerWaalsContact NH1-CD 3.25Å; R355-E368 IonicContact NH1-OE1 3.09Å; R355-E368 PolarHBondContact NH1-OE1 2.77Å; R355-E368 IonicContact NH1-OE2 2.73Å; R355-E368 PolarHBondContact NH1-OE2 2.77Å; R355-T371 WeakPolarHBondContact CB-O 3.31Å; R355-T371 PolarHBondContact N-O 3.48Å; R355-D373 IonicContact CZ-OD2 3.61Å; R355-D373 IonicContact NE-OD1 2.75Å; R355-D373 IonicContact NE-OD2 3.23Å; R355-D373 PolarHBondContact NE-OD2 2.91Å; R355-D373 IonicContact NH2-OD2 3.99Å; R355-D373 PolarHBondContact NH2-OD2 2.88Å
356	Y	93.8	Very high	86.6	Confident	24 Å²	24	55.6 Å²	55.6	9%	0.094	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-121.4	94.6	169.2	-174.3	-141.6	0	0	0	110.4	P330 R332 F334 L337 D358 I394	P330-Y356 CarbonylContact C-O 3.59Å; P330-Y356 WeakPolarHBondContact CB-O 3.36Å; P330-Y356 PolarHBondContact O-N 3.32Å; R332-Y356 HydrophobicContact CB-CD1 4.33Å; R332-Y356 HydrophobicContact CG-CD1 3.19Å; R332-Y356 HydrophobicContact CG-CE1 3.25Å; R332-Y356 HydrophobicContact CG-CG 4.37Å; R332-Y356 PolarHBondContact NH1-OH 2.9Å; R332-Y356 PolarHBondContact NH2-OH 3.36Å; R332-Y356 WeakPolarHBondContact O-CD1 3.26Å; F334-Y356 HydrophobicContact CB-CE1 4.5Å; L337-Y356 HydrophobicContact CD2-CD1 4.32Å; L337-Y356 HydrophobicContact CD2-CE1 4.45Å; Y356-D358 PolarHBondContact O-N 3.06Å; Y356-I394 HydrophobicContact CD2-CD1 3.32Å; Y356-I394 HydrophobicContact CD2-CG1 3.78Å; Y356-I394 HydrophobicContact CD2-CG2 4.2Å; Y356-I394 HydrophobicContact CE2-CD1 3.19Å; Y356-I394 HydrophobicContact CE2-CG1 4.13Å; Y356-I394 HydrophobicContact CG-CD1 4.37Å; Y356-I394 HydrophobicContact CG-CG2 4.4Å
357	P	90.3	Very high	85.7	Confident	27 Å²	27	64.8 Å²	64.8	18%	0.175	33%	0.328	C	S	.	.			trans	-54.9	135.4	-175.2	-26.7	34.8	0	0	0	113	R355 E368 R370	R355-P357 HydrophobicContact CG-CG 4.36Å; P357-E368 HydrophobicContact CB-CB 4.28Å; P357-E368 HydrophobicContact CG-CB 4.24Å; P357-E368 WeakPolarHBondContact CG-O 3.38Å; P357-R370 HydrophobicContact CG-CG 4.25Å
358	D	85.4	Confident	85.3	Confident	26 Å²	26	59.5 Å²	59.5	14%	0.139	31%	0.309	C	S	.	.			trans	-129.3	121.5	176.6	-174.4	-16.4	0	0	0	108.6	Y356 N360 F361 C364	Y356-D358 PolarHBondContact O-N 3.06Å; D358-N360 PolarHBondContact O-N 2.98Å; D358-N360 WeakPolarHBondContact OD1-CB 3.35Å; D358-N360 PolarHBondContact OD1-N 3.4Å; D358-N360 PolarHBondContact OD1-ND2 2.91Å; D358-F361 HydrophobicContact CB-CB 4.36Å; D358-F361 WeakPolarHBondContact O-CB 3.41Å; D358-F361 PolarHBondContact O-N 3.07Å; D358-C364 WeakPolarHBondContact O-CB 3.41Å; D358-C364 PolarHBondContact O-SG 3.47Å
359	P	83.5	Confident	85	Confident	123 Å²	123	62.3 Å²	62.3	80%	0.799	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-25.2	177	-26.3	34.9	0	0	0	114.2	F361	P359-F361 VanDerWaalsContact C-N 3.31Å
360	N	83.4	Confident	84.9	Confident	140 Å²	140	66.4 Å²	66.4	75%	0.749	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.9	-178.2	-56	-62	0	0	0	113.8	D358	D358-N360 PolarHBondContact O-N 2.98Å; D358-N360 WeakPolarHBondContact OD1-CB 3.35Å; D358-N360 PolarHBondContact OD1-N 3.4Å; D358-N360 PolarHBondContact OD1-ND2 2.91Å
361	F	83.7	Confident	84.8	Confident	30 Å²	30	66.6 Å²	66.6	13%	0.132	34%	0.34	C	S	.	.	S	Bend	trans	-83.2	129.1	-177	-174.6	-108	0	0	0	110.9	P328 P330 D358 P359 S363 C364	P328-F361 HydrophobicContact CB-CE2 4.24Å; P328-F361 HydrophobicContact CB-CZ 3.89Å; P330-F361 HydrophobicContact CB-CB 4.43Å; P330-F361 HydrophobicContact CB-CD1 4.08Å; P330-F361 HydrophobicContact CB-CD2 4.44Å; P330-F361 HydrophobicContact CB-CE1 4.38Å; P330-F361 HydrophobicContact CB-CG 4.09Å; P330-F361 HydrophobicContact CG-CD1 4.17Å; P330-F361 HydrophobicContact CG-CE1 4.22Å; D358-F361 HydrophobicContact CB-CB 4.36Å; D358-F361 WeakPolarHBondContact O-CB 3.41Å; D358-F361 PolarHBondContact O-N 3.07Å; P359-F361 VanDerWaalsContact C-N 3.31Å; F361-S363 WeakPolarHBondContact CE1-OG 3.21Å; F361-S363 PolarHBondContact O-N 3.15Å; F361-C364 HydrophobicContact CB-CB 4.22Å; F361-C364 HydrophobicContact CD1-CB 4.43Å; F361-C364 WeakPolarHBondContact O-CB 3.41Å; F361-C364 PolarHBondContact O-N 3.05Å
362	K	73.9	Confident	84.7	Confident	219 Å²	219	66.8 Å²	66.8	95%	0.952	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.9	-167.3	-66.4	-175.3	178.3	-175.9	0	115.6
363	S	69.7	Low	84.7	Confident	78 Å²	78	66.8 Å²	66.8	55%	0.545	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	13.8	178.7	65.2	0	0	0	0	112.9	F361 T365	F361-S363 WeakPolarHBondContact CE1-OG 3.21Å; F361-S363 PolarHBondContact O-N 3.15Å; S363-T365 PolarHBondContact O-N 3.04Å
364	C	65.3	Low	84.6	Confident	29 Å²	29	66.8 Å²	66.8	20%	0.196	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-73.7	121	171.8	-86.5	0	0	0	0	109	D358 F361 E368	D358-C364 WeakPolarHBondContact O-CB 3.41Å; D358-C364 PolarHBondContact O-SG 3.47Å; F361-C364 HydrophobicContact CB-CB 4.22Å; F361-C364 HydrophobicContact CD1-CB 4.43Å; F361-C364 WeakPolarHBondContact O-CB 3.41Å; F361-C364 PolarHBondContact O-N 3.05Å; C364-E368 PolarHBondContact SG-OE2 3.45Å
365	T	70.2	Confident	84.6	Confident	88 Å²	88	67.1 Å²	67.1	54%	0.54	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-74.1	147.5	163.6	48.3	0	0	0	0	109	S363 Y367 E368	S363-T365 PolarHBondContact O-N 3.04Å; T365-Y367 PolarHBondContact O-N 2.93Å; T365-E368 PolarHBondContact O-N 2.81Å
366	P	68.3	Low	84.6	Confident	111 Å²	111	67.3 Å²	67.3	72%	0.721	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	135.5	171.6	25.5	-32.2	0	0	0	109.1
367	Y	74.5	Confident	84.4	Confident	232 Å²	232	66.2 Å²	66.2	91%	0.91	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	34.4	-177.5	-51.8	-82.8	0	0	0	115.7	T365 M369	T365-Y367 PolarHBondContact O-N 2.93Å; Y367-M369 PolarHBondContact O-N 3.18Å
368	E	84.4	Confident	84.3	Confident	42 Å²	42	68.7 Å²	68.7	20%	0.196	35%	0.352	C	S	.	.			trans	-58.5	133.6	173.7	-164.1	171.8	-161.7	0	0	112.2	R355 P357 C364 T365	R355-E368 WeakPolarHBondContact CD-OE1 3.25Å; R355-E368 IonicContact CZ-OE1 3.86Å; R355-E368 IonicContact NE-OE1 3.03Å; R355-E368 PolarHBondContact NE-OE1 2.93Å; R355-E368 VanDerWaalsContact NH1-CD 3.25Å; R355-E368 IonicContact NH1-OE1 3.09Å; R355-E368 PolarHBondContact NH1-OE1 2.77Å; R355-E368 IonicContact NH1-OE2 2.73Å; R355-E368 PolarHBondContact NH1-OE2 2.77Å; P357-E368 HydrophobicContact CB-CB 4.28Å; P357-E368 HydrophobicContact CG-CB 4.24Å; P357-E368 WeakPolarHBondContact CG-O 3.38Å; C364-E368 PolarHBondContact SG-OE2 3.45Å; T365-E368 PolarHBondContact O-N 2.81Å
369	M	86.6	Confident	84.4	Confident	104 Å²	104	69.9 Å²	69.9	51%	0.512	36%	0.362	S	S	.	.			trans	-70.8	150.7	-180	-65.8	-178.2	-77.5	0	0	111.3	Y367 T371 Y387	Y367-M369 PolarHBondContact O-N 3.18Å; M369-T371 HydrophobicContact CB-CG2 3.9Å; M369-T371 PolarHBondContact O-N 2.86Å; M369-T371 VanDerWaalsContact O-N 3.14Å; M369-Y387 HydrophobicContact CB-CD2 4.21Å; M369-Y387 HydrophobicContact CB-CE2 4.19Å; M369-Y387 HydrophobicContact SD-CD1 3.67Å; M369-Y387 HydrophobicContact SD-CE1 3.54Å; M369-Y387 VanDerWaalsContact SD-CE1 3.54Å; M369-Y387 HydrophobicContact SD-CE2 4.47Å; M369-Y387 HydrophobicContact SD-CG 4.2Å
370	R	92	Very high	84.6	Confident	112 Å²	112	65.2 Å²	65.2	42%	0.423	34%	0.337	S	S	.	.			trans	-86.4	82.4	177.5	-66	163.5	-179.7	-179.4	4.3	109.3	P357 S392 I394	P357-R370 HydrophobicContact CG-CG 4.25Å; R370-S392 WeakPolarHBondContact CD-O 3.4Å; R370-S392 PolarHBondContact NH1-O 2.85Å; R370-S392 VanDerWaalsContact NH1-O 3.15Å; R370-I394 HydrophobicContact CG-CG1 4.28Å
371	T	93.7	Very high	84.9	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.031	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-95.1	164.6	-174.2	56.3	0	0	0	0	112.5	R355 M369 D373 Q385 L386 Y387	R355-T371 WeakPolarHBondContact CB-O 3.31Å; R355-T371 PolarHBondContact N-O 3.48Å; M369-T371 HydrophobicContact CB-CG2 3.9Å; M369-T371 PolarHBondContact O-N 2.86Å; M369-T371 VanDerWaalsContact O-N 3.14Å; T371-D373 PolarHBondContact OG1-OD1 3Å; T371-Q385 HydrophobicContact CG2-CB 4.29Å; T371-Q385 PolarHBondContact OG1-NE2 2.99Å; T371-L386 WeakPolarHBondContact CA-O 3.08Å; T371-Y387 HydrophobicContact CG2-CD2 4.31Å; T371-Y387 HydrophobicContact CG2-CG 4.37Å
372	I	96.3	Very high	85.3	Confident	4 Å²	4	65 Å²	65	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.6	159.7	-56.7	158.1	0	0	0	106.7	Q385 L386 N398 L407 S409 W418	I372-Q385 CarbonylContact O-C 3.58Å; I372-Q385 WeakPolarHBondContact O-CA 2.96Å; I372-L386 HydrophobicContact CB-CB 4.21Å; I372-L386 PolarHBondContact N-O 3.05Å; I372-L386 PolarHBondContact O-N 3.25Å; I372-N398 WeakPolarHBondContact CD1-OD1 2.91Å; I372-N398 HydrophobicContact CG2-CB 4.31Å; I372-L407 HydrophobicContact CD1-CD2 4.32Å; I372-L407 HydrophobicContact CG2-CD2 4.28Å; I372-S409 WeakPolarHBondContact CD1-OG 3.39Å; I372-W418 HydrophobicContact CD1-CZ2 3.68Å
373	D	95.6	Very high	86.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137	-175.9	-70.1	-8.9	0	0	0	111.1	H329 V352 V353 R355 T371 F375 M382 Q385	H329-D373 IonicContact CD2-OD2 3.22Å; H329-D373 PolarHBondContact CD2-OD2 2.91Å; H329-D373 IonicContact NE2-OD2 2.63Å; H329-D373 PolarHBondContact NE2-OD2 2.92Å; V352-D373 WeakPolarHBondContact CA-O 3.31Å; V353-D373 PolarHBondContact N-O 3.02Å; V353-D373 PolarHBondContact O-N 3.09Å; R355-D373 IonicContact CZ-OD2 3.61Å; R355-D373 IonicContact NE-OD1 2.75Å; R355-D373 IonicContact NE-OD2 3.23Å; R355-D373 PolarHBondContact NE-OD2 2.91Å; R355-D373 IonicContact NH2-OD2 3.99Å; R355-D373 PolarHBondContact NH2-OD2 2.88Å; T371-D373 PolarHBondContact OG1-OD1 3Å; D373-F375 HydrophobicContact CB-CD2 4.28Å; D373-F375 HydrophobicContact CB-CE2 3.51Å; D373-F375 HydrophobicContact CB-CZ 4Å; D373-M382 HydrophobicContact CB-CE 4.48Å; D373-M382 WeakPolarHBondContact OD2-CE 3.44Å; D373-Q385 WeakPolarHBondContact OD1-CG 3.4Å; D373-Q385 PolarHBondContact OD1-NE2 3.44Å
374	V	96.8	Very high	87.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.4	176.2	-175.6	0	0	0	0	109.5	L95 L98 L350 I351 V352 M383 C384	L95-V374 HydrophobicContact CD2-CG1 4.31Å; L98-V374 HydrophobicContact CD2-CB 4.13Å; L98-V374 HydrophobicContact CD2-CG1 4.01Å; L98-V374 HydrophobicContact CD2-CG2 3.65Å; L350-V374 HydrophobicContact CB-CG1 4.25Å; L350-V374 HydrophobicContact CD1-CG1 4.35Å; L350-V374 HydrophobicContact CD2-CG1 4.29Å; I351-V374 CarbonylContact O-C 3.15Å; I351-V374 VanDerWaalsContact O-CA 3.3Å; I351-V374 WeakPolarHBondContact O-CA 3.28Å; V352-V374 HydrophobicContact CG1-CG1 4.42Å; V352-V374 HydrophobicContact CG1-CG2 3.79Å; V374-M383 PolarHBondContact O-N 3Å; V374-C384 HydrophobicContact CB-CB 4.32Å; V374-C384 PolarHBondContact N-O 3.17Å; V374-C384 PolarHBondContact O-N 2.92Å
375	F	95.8	Very high	88.6	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	148.2	179.4	-62.5	-90.3	0	0	0	111.5	I327 H329 L350 I351 D373 K381 M382	I327-F375 HydrophobicContact CD1-CB 4.05Å; I327-F375 HydrophobicContact CD1-CD1 4.44Å; I327-F375 HydrophobicContact CD1-CG 4.26Å; I327-F375 HydrophobicContact CG2-CD1 3.58Å; I327-F375 HydrophobicContact CG2-CE1 3.48Å; I327-F375 VanDerWaalsContact CG2-CE1 3.48Å; I327-F375 HydrophobicContact CG2-CE2 4.42Å; I327-F375 HydrophobicContact CG2-CG 4.13Å; I327-F375 HydrophobicContact CG2-CZ 3.94Å; H329-F375 HydrophobicContact CB-CZ 4.46Å; H329-F375 AromaticContact CD2-CE2 3.81Å; H329-F375 AromaticContact CD2-CZ 3.8Å; L350-F375 WeakPolarHBondContact CA-O 3.5Å; I351-F375 HydrophobicContact CB-CB 4.32Å; I351-F375 PolarHBondContact N-O 3.01Å; I351-F375 PolarHBondContact O-N 2.89Å; D373-F375 HydrophobicContact CB-CD2 4.28Å; D373-F375 HydrophobicContact CB-CE2 3.51Å; D373-F375 HydrophobicContact CB-CZ 4Å; F375-K381 WeakPolarHBondContact CA-O 3.3Å; F375-M382 HydrophobicContact CD1-CB 3.92Å; F375-M382 HydrophobicContact CE1-CB 3.7Å; F375-M382 HydrophobicContact CE1-CE 4.02Å; F375-M382 HydrophobicContact CE1-CG 4.19Å; F375-M382 HydrophobicContact CZ-CB 4.48Å; F375-M382 HydrophobicContact CZ-CE 3.85Å
376	D	93.6	Very high	89.6	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.07	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.3	167.2	171.2	48.8	0	0	0	110.5	Q91 N378 S379 G380 K381 M383	Q91-D376 PolarHBondContact NE2-OD1 2.99Å; D376-N378 PolarHBondContact O-N 2.78Å; D376-S379 WeakPolarHBondContact CB-OG 3.48Å; D376-S379 WeakPolarHBondContact OD2-CB 3.18Å; D376-S379 PolarHBondContact OD2-N 3.01Å; D376-S379 PolarHBondContact OD2-OG 3.16Å; D376-G380 VanDerWaalsContact O-CA 3.25Å; D376-G380 WeakPolarHBondContact O-CA 3.4Å; D376-G380 PolarHBondContact O-N 2.83Å; D376-K381 PolarHBondContact N-O 3.25Å; D376-M383 HydrophobicContact CB-CG 3.88Å; D376-M383 HydrophobicContact CB-SD 4.1Å
377	G	89.1	Confident	90.8	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.01	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.3	-175.6	0	0	0	0	0	114.7	R302 I314 N349	R302-G377 PolarHBondContact NH1-O 3.16Å; I314-G377 VanDerWaalsContact CD1-O 3.26Å; I314-G377 WeakPolarHBondContact CD1-O 3.29Å; N349-G377 PolarHBondContact O-N 3.38Å
378	N	88.1	Confident	91.6	Very high	79 Å²	79	41.7 Å²	41.7	42%	0.422	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-51.1	174.5	-80.8	-27.6	0	0	0	112.6	R302 N349 D376	R302-N378 PolarHBondContact NH1-OD1 3.28Å; R302-N378 PolarHBondContact NH2-OD1 2.92Å; N349-N378 PolarHBondContact ND2-N 2.82Å; N349-N378 PolarHBondContact ND2-ND2 3.25Å; N349-N378 VanDerWaalsContact ND2-ND2 3.19Å; N349-N378 PolarHBondContact ND2-OD1 2.9Å; D376-N378 PolarHBondContact O-N 2.78Å
379	S	87.2	Confident	91.7	Very high	51 Å²	51	44.1 Å²	44.1	36%	0.357	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-23.9	-174.5	66.7	0	0	0	0	113.3	D376 K381	D376-S379 WeakPolarHBondContact CB-OG 3.48Å; D376-S379 WeakPolarHBondContact OD2-CB 3.18Å; D376-S379 PolarHBondContact OD2-N 3.01Å; D376-S379 PolarHBondContact OD2-OG 3.16Å; S379-K381 PolarHBondContact O-N 3.24Å; S379-K381 WeakPolarHBondContact OG-CB 3.37Å; S379-K381 PolarHBondContact OG-N 2.83Å
380	G	88.3	Confident	91.7	Very high	25 Å²	25	47 Å²	47	26%	0.258	24%	0.239	S	C	.	.			trans	69	14.2	-171	0	0	0	0	0	113.5	D376	D376-G380 VanDerWaalsContact O-CA 3.25Å; D376-G380 WeakPolarHBondContact O-CA 3.4Å; D376-G380 PolarHBondContact O-N 2.83Å
381	K	90.3	Very high	91.4	Very high	89 Å²	89	42.5 Å²	42.5	39%	0.387	22%	0.224	S	C	.	.			trans	-81.4	143.3	175.4	-65.7	-180	-179.4	-178.8	0	109.8	S26 F375 D376 S379 M383	S26-K381 PolarHBondContact OG-NZ 2.9Å; F375-K381 WeakPolarHBondContact CA-O 3.3Å; D376-K381 PolarHBondContact N-O 3.25Å; S379-K381 PolarHBondContact O-N 3.24Å; S379-K381 WeakPolarHBondContact OG-CB 3.37Å; S379-K381 PolarHBondContact OG-N 2.83Å; K381-M383 HydrophobicContact CB-SD 4.48Å
382	M	91.5	Very high	91	Very high	76 Å²	76	45.1 Å²	45.1	37%	0.374	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	132.9	169.1	-172	-173	-71.7	0	0	108.8	D373 F375 Q385	D373-M382 HydrophobicContact CB-CE 4.48Å; D373-M382 WeakPolarHBondContact OD2-CE 3.44Å; F375-M382 HydrophobicContact CD1-CB 3.92Å; F375-M382 HydrophobicContact CE1-CB 3.7Å; F375-M382 HydrophobicContact CE1-CE 4.02Å; F375-M382 HydrophobicContact CE1-CG 4.19Å; F375-M382 HydrophobicContact CZ-CB 4.48Å; F375-M382 HydrophobicContact CZ-CE 3.85Å; M382-Q385 HydrophobicContact CG-CG 4.28Å; M382-Q385 HydrophobicContact SD-CG 3.49Å; M382-Q385 WeakPolarHBondContact SD-CG 3.5Å; M382-Q385 PolarHBondContact SD-NE2 3.24Å; M382-Q385 VanDerWaalsContact SD-NE2 3.44Å
383	M	92.4	Very high	90.6	Very high	76 Å²	76	46 Å²	46	37%	0.374	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-38	-176.6	-59.5	-57.8	-67.9	0	0	112.2	L95 V374 D376 K381	L95-M383 HydrophobicContact CD1-CB 3.95Å; L95-M383 HydrophobicContact CD1-CE 3.5Å; L95-M383 VanDerWaalsContact CD1-CE 3.5Å; L95-M383 HydrophobicContact CD1-CG 4.05Å; L95-M383 HydrophobicContact CD2-CB 3.81Å; V374-M383 PolarHBondContact O-N 3Å; D376-M383 HydrophobicContact CB-CG 3.88Å; D376-M383 HydrophobicContact CB-SD 4.1Å; K381-M383 HydrophobicContact CB-SD 4.48Å
384	C	92.1	Very high	90.4	Very high	10 Å²	10	47.3 Å²	47.3	7%	0.068	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	155	-177.1	-179.6	0	0	0	0	109.9	L98 V374	L98-C384 HydrophobicContact CD2-CB 4.09Å; V374-C384 HydrophobicContact CB-CB 4.32Å; V374-C384 PolarHBondContact N-O 3.17Å; V374-C384 PolarHBondContact O-N 2.92Å
385	Q	93.1	Very high	90.3	Very high	83 Å²	83	47.5 Å²	47.5	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.3	172.7	-59.5	-171.7	-67.9	0	0	108.9	T371 I372 D373 M382	T371-Q385 HydrophobicContact CG2-CB 4.29Å; T371-Q385 PolarHBondContact OG1-NE2 2.99Å; I372-Q385 CarbonylContact O-C 3.58Å; I372-Q385 WeakPolarHBondContact O-CA 2.96Å; D373-Q385 WeakPolarHBondContact OD1-CG 3.4Å; D373-Q385 PolarHBondContact OD1-NE2 3.44Å; M382-Q385 HydrophobicContact CG-CG 4.28Å; M382-Q385 HydrophobicContact SD-CG 3.49Å; M382-Q385 WeakPolarHBondContact SD-CG 3.5Å; M382-Q385 PolarHBondContact SD-NE2 3.24Å; M382-Q385 VanDerWaalsContact SD-NE2 3.44Å
386	L	93	Very high	90.2	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.2	176	-57.5	171.3	0	0	0	109.4	L98 T371 I372 L407 W418	L98-L386 HydrophobicContact CD1-CD1 4.4Å; L98-L386 HydrophobicContact CG-CD2 4.33Å; L98-L386 WeakPolarHBondContact O-CD2 3.26Å; T371-L386 WeakPolarHBondContact CA-O 3.08Å; I372-L386 HydrophobicContact CB-CB 4.21Å; I372-L386 PolarHBondContact N-O 3.05Å; I372-L386 PolarHBondContact O-N 3.25Å; L386-L407 HydrophobicContact CD1-CD2 3.6Å; L386-W418 HydrophobicContact CB-CE3 4.29Å; L386-W418 HydrophobicContact CB-CH2 4.26Å; L386-W418 HydrophobicContact CB-CZ3 4.02Å
387	Y	92.9	Very high	90.3	Very high	72 Å²	72	47.2 Å²	47.2	28%	0.282	26%	0.26	S	S	.	.			trans	-146	139.7	179.6	-179.9	-112.5	0	0	0	110.5	M369 T371 P389	M369-Y387 HydrophobicContact CB-CD2 4.21Å; M369-Y387 HydrophobicContact CB-CE2 4.19Å; M369-Y387 HydrophobicContact SD-CD1 3.67Å; M369-Y387 HydrophobicContact SD-CE1 3.54Å; M369-Y387 VanDerWaalsContact SD-CE1 3.54Å; M369-Y387 HydrophobicContact SD-CE2 4.47Å; M369-Y387 HydrophobicContact SD-CG 4.2Å; T371-Y387 HydrophobicContact CG2-CD2 4.31Å; T371-Y387 HydrophobicContact CG2-CG 4.37Å; Y387-P389 HydrophobicContact CE1-CG 4.15Å
388	D	90.3	Very high	90.7	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.107	26%	0.26	C	S	.	.			trans	-132.2	124.3	174.7	-173.2	-60.1	0	0	0	108.6	I103 K106 E390 S391 W418	I103-D388 HydrophobicContact CD1-CB 3.41Å; I103-D388 VanDerWaalsContact CD1-CB 3.41Å; I103-D388 WeakPolarHBondContact CD1-OD2 3.41Å; I103-D388 HydrophobicContact CG1-CB 4.02Å; I103-D388 WeakPolarHBondContact CG1-OD2 3.35Å; K106-D388 IonicContact NZ-OD1 3.94Å; D388-E390 VanDerWaalsContact C-N 3.29Å; D388-E390 PolarHBondContact O-N 3.28Å; D388-E390 WeakPolarHBondContact OD1-CB 3.44Å; D388-E390 PolarHBondContact OD1-N 2.82Å; D388-S391 CarbonylContact O-C 3.47Å; D388-S391 PolarHBondContact O-N 3.05Å; D388-W418 HydrophobicContact CB-CH2 3.77Å; D388-W418 HydrophobicContact CB-CZ3 4.24Å
389	P	87.3	Confident	91.1	Very high	93 Å²	93	46.4 Å²	46.4	60%	0.604	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-32.8	-177.3	-24.2	34.1	0	0	0	114.3	Y387 S391	Y387-P389 HydrophobicContact CE1-CG 4.15Å; P389-S391 VanDerWaalsContact C-N 3.3Å; P389-S391 PolarHBondContact O-N 3.42Å
390	E	86.2	Confident	91.6	Very high	166 Å²	166	44.2 Å²	44.2	78%	0.776	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-25.9	-177	-62.2	179.6	170.3	0	0	111.8	K106 D388	K106-E390 IonicContact NZ-OE2 3.33Å; K106-E390 PolarHBondContact NZ-OE2 3.14Å; D388-E390 VanDerWaalsContact C-N 3.29Å; D388-E390 PolarHBondContact O-N 3.28Å; D388-E390 WeakPolarHBondContact OD1-CB 3.44Å; D388-E390 PolarHBondContact OD1-N 2.82Å
391	S	85.2	Confident	91.9	Very high	16 Å²	16	43 Å²	43	11%	0.112	23%	0.225	C	C	.	.			trans	-117.6	77	178.7	59.4	0	0	0	0	111.3	I103 D388 P389 G393 M411	I103-S391 WeakPolarHBondContact CD1-OG 3.49Å; D388-S391 CarbonylContact O-C 3.47Å; D388-S391 PolarHBondContact O-N 3.05Å; P389-S391 VanDerWaalsContact C-N 3.3Å; P389-S391 PolarHBondContact O-N 3.42Å; S391-G393 PolarHBondContact O-N 3.15Å; S391-M411 WeakPolarHBondContact O-CE 3.15Å
392	S	85.5	Confident	92.1	Very high	60 Å²	60	41.4 Å²	41.4	42%	0.42	22%	0.224	S	C	.	.			trans	-82.9	15.5	-179.8	-166.9	0	0	0	0	114.5	R370	R370-S392 WeakPolarHBondContact CD-O 3.4Å; R370-S392 PolarHBondContact NH1-O 2.85Å; R370-S392 VanDerWaalsContact NH1-O 3.15Å
393	G	88.4	Confident	92.2	Very high	24 Å²	24	42.2 Å²	42.2	25%	0.247	23%	0.228	C	C	.	.	S	Bend	trans	-73.6	170.5	176.5	0	0	0	0	0	112.5	S391 M411	S391-G393 PolarHBondContact O-N 3.15Å; G393-M411 WeakPolarHBondContact CA-SD 3.49Å; G393-M411 PolarHBondContact N-SD 2.8Å; G393-M411 VanDerWaalsContact N-SD 3.43Å; G393-M411 WeakPolarHBondContact O-CE 3.44Å
394	I	92.2	Very high	92.3	Very high	26 Å²	26	38.8 Å²	38.8	13%	0.133	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-90.1	118.1	178.6	-59.2	150.2	0	0	0	108	L337 I340 Y356 R370 S396	L337-I394 HydrophobicContact CD1-CB 4.22Å; L337-I394 HydrophobicContact CD1-CD1 4.5Å; L337-I394 HydrophobicContact CD1-CG2 4.2Å; L337-I394 HydrophobicContact CD2-CG2 4.17Å; I340-I394 HydrophobicContact CD1-CG2 4.4Å; Y356-I394 HydrophobicContact CD2-CD1 3.32Å; Y356-I394 HydrophobicContact CD2-CG1 3.78Å; Y356-I394 HydrophobicContact CD2-CG2 4.2Å; Y356-I394 HydrophobicContact CE2-CD1 3.19Å; Y356-I394 HydrophobicContact CE2-CG1 4.13Å; Y356-I394 HydrophobicContact CG-CD1 4.37Å; Y356-I394 HydrophobicContact CG-CG2 4.4Å; R370-I394 HydrophobicContact CG-CG1 4.28Å; I394-S396 PolarHBondContact O-N 3Å
395	S	93.3	Very high	92.3	Very high	4 Å²	4	42 Å²	42	3%	0.028	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-73.7	121.4	173	-171.2	0	0	0	0	110	G354 N398	G354-S395 WeakPolarHBondContact CA-O 3.35Å; S395-N398 VanDerWaalsContact OG-CG 3.23Å; S395-N398 PolarHBondContact OG-ND2 2.93Å; S395-N398 PolarHBondContact OG-OD1 3.01Å
396	S	93.9	Very high	92.4	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.021	21%	0.213	C	C	.	.			trans	-97.5	-37.3	-178.8	-56	0	0	0	0	112.4	L337 T338 I340 K341 I394 A410	L337-S396 WeakPolarHBondContact CD1-OG 3.49Å; T338-S396 WeakPolarHBondContact O-CB 3.38Å; T338-S396 PolarHBondContact O-OG 3.1Å; I340-S396 WeakPolarHBondContact CA-O 3.45Å; K341-S396 PolarHBondContact N-O 3Å; I394-S396 PolarHBondContact O-N 3Å; S396-A410 PolarHBondContact N-O 2.77Å
397	L	96	Very high	92.6	Very high	10 Å²	10	38.1 Å²	38.1	5%	0.052	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	115.1	-169.9	-75.3	-173.8	0	0	0	107.3	L117 T338 K341 S409 A410	L117-L397 HydrophobicContact CB-CD1 4.34Å; L117-L397 HydrophobicContact CD2-CB 3.59Å; L117-L397 HydrophobicContact CD2-CD1 4.5Å; L117-L397 HydrophobicContact CD2-CG 4.47Å; T338-L397 HydrophobicContact CG2-CD1 4.12Å; T338-L397 HydrophobicContact CG2-CG 4.13Å; K341-L397 HydrophobicContact CB-CD2 4.24Å; K341-L397 HydrophobicContact CD-CD2 4.06Å; K341-L397 HydrophobicContact CG-CD2 4.19Å; L397-S409 CarbonylContact O-C 3.54Å; L397-S409 VanDerWaalsContact O-CA 3.24Å; L397-S409 WeakPolarHBondContact O-CA 3.05Å; L397-A410 HydrophobicContact CB-CB 3.79Å; L397-A410 HydrophobicContact CD1-CB 4.27Å; L397-A410 PolarHBondContact N-O 3.31Å; L397-A410 PolarHBondContact O-N 3.06Å
398	N	97.1	Very high	92.8	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.6	-179.9	-61.7	-66.5	0	0	0	107.8	A343 V352 G354 I372 S395 L407 A408 S409	A343-N398 WeakPolarHBondContact CB-O 3.47Å; V352-N398 HydrophobicContact CB-CB 4.32Å; V352-N398 HydrophobicContact CG2-CB 4.01Å; G354-N398 PolarHBondContact N-ND2 2.99Å; I372-N398 WeakPolarHBondContact CD1-OD1 2.91Å; I372-N398 HydrophobicContact CG2-CB 4.31Å; S395-N398 VanDerWaalsContact OG-CG 3.23Å; S395-N398 PolarHBondContact OG-ND2 2.93Å; S395-N398 PolarHBondContact OG-OD1 3.01Å; N398-L407 HydrophobicContact CB-CD1 4.28Å; N398-A408 WeakPolarHBondContact CA-O 3.29Å; N398-S409 VanDerWaalsContact OD1-CB 3.3Å; N398-S409 WeakPolarHBondContact OD1-CB 3.37Å; N398-S409 PolarHBondContact OD1-OG 3.23Å
399	E	96.9	Very high	93.1	Very high	61 Å²	61	34 Å²	34	29%	0.285	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	132.6	178	-164.6	171.6	-172.4	0	0	109.1	L117 W119 A408	L117-E399 HydrophobicContact CD1-CB 3.65Å; L117-E399 HydrophobicContact CD1-CG 4.43Å; L117-E399 VanDerWaalsContact CD1-OE2 3.26Å; L117-E399 WeakPolarHBondContact CD1-OE2 3.48Å; L117-E399 HydrophobicContact CD2-CB 3.74Å; L117-E399 HydrophobicContact CG-CB 4.11Å; L117-E399 WeakPolarHBondContact CG-OE2 3.34Å; W119-E399 PolarHBondContact NE1-O 2.94Å; E399-A408 PolarHBondContact N-O 3.02Å; E399-A408 PolarHBondContact O-N 2.99Å
400	F	97	Very high	93.5	Very high	5 Å²	5	29.8 Å²	29.8	2%	0.022	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	147.6	173.4	-81.2	-77.5	0	0	0	110	F94 L98 W119 H345 P346 V352 T406 L407	F94-F400 HydrophobicContact CE1-CZ 4.3Å; F94-F400 AromaticContact CZ-CE1 3.83Å; F94-F400 HydrophobicContact CZ-CE1 3.83Å; F94-F400 AromaticContact CZ-CZ 3.96Å; F94-F400 HydrophobicContact CZ-CZ 3.96Å; L98-F400 HydrophobicContact CD1-CE1 4.38Å; L98-F400 HydrophobicContact CD1-CZ 4.11Å; W119-F400 VanDerWaalsContact CD1-O 3.28Å; W119-F400 PolarHBondContact NE1-O 2.95Å; H345-F400 HydrophobicContact CB-CD2 4.13Å; H345-F400 HydrophobicContact CB-CE2 4.47Å; H345-F400 AromaticContact CD2-CD2 3.57Å; H345-F400 AromaticContact CD2-CE2 3.59Å; H345-F400 AromaticContact CD2-CG 3.88Å; H345-F400 AromaticContact CD2-CZ 3.97Å; P346-F400 HydrophobicContact CG-CB 4.23Å; V352-F400 HydrophobicContact CG1-CD2 4.12Å; V352-F400 HydrophobicContact CG1-CE2 3.39Å; V352-F400 HydrophobicContact CG1-CZ 4.2Å; V352-F400 HydrophobicContact CG2-CD2 4.36Å; V352-F400 HydrophobicContact CG2-CE2 4.42Å; F400-T406 CarbonylContact C-O 3.51Å; F400-T406 WeakPolarHBondContact CA-O 3.33Å; F400-T406 WeakPolarHBondContact CD1-O 3.34Å; F400-L407 HydrophobicContact CD1-CB 3.93Å; F400-L407 HydrophobicContact CD1-CD1 4.16Å; F400-L407 HydrophobicContact CD2-CD1 4.03Å; F400-L407 HydrophobicContact CE1-CB 3.77Å; F400-L407 HydrophobicContact CE1-CD1 4.23Å; F400-L407 HydrophobicContact CE1-CG 4.49Å; F400-L407 HydrophobicContact CE2-CD1 4.15Å; F400-L407 HydrophobicContact CG-CD1 4.05Å; F400-L407 HydrophobicContact CZ-CB 4.37Å; F400-L407 HydrophobicContact CZ-CD1 4.22Å
401	N	95.7	Very high	93.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.			trans	-63.3	158.4	170.9	73.7	-14.9	0	0	0	110.6	W119 P124 P346 M403 G404 D405 T406	W119-N401 HydrophobicContact CD2-CB 3.66Å; W119-N401 HydrophobicContact CE3-CB 3.66Å; W119-N401 HydrophobicContact CG-CB 4.31Å; W119-N401 HydrophobicContact CH2-CB 3.79Å; W119-N401 HydrophobicContact CZ2-CB 3.75Å; W119-N401 HydrophobicContact CZ3-CB 3.74Å; P124-N401 PolarHBondContact O-ND2 3.15Å; P346-N401 WeakPolarHBondContact CG-O 3.49Å; N401-M403 PolarHBondContact O-N 2.56Å; N401-G404 WeakPolarHBondContact O-CA 3.46Å; N401-G404 PolarHBondContact O-N 2.83Å; N401-G404 WeakPolarHBondContact OD1-CA 3.46Å; N401-G404 PolarHBondContact OD1-N 2.82Å; N401-D405 PolarHBondContact ND2-OD1 2.87Å; N401-D405 PolarHBondContact OD1-N 3.27Å; N401-D405 PolarHBondContact OD1-OD1 2.85Å; N401-T406 PolarHBondContact N-O 3.26Å; N401-T406 PolarHBondContact OD1-N 3.14Å; N401-T406 VanDerWaalsContact OD1-N 3.14Å; N401-T406 PolarHBondContact OD1-O 3.38Å
402	P	94.4	Very high	94	Very high	55 Å²	55	22.9 Å²	22.9	36%	0.357	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.8	-178.9	-29.8	36.7	0	0	0	114.6	W119 H120 G404	W119-P402 HydrophobicContact CB-CG 4.25Å; H120-P402 WeakPolarHBondContact O-CG 3.48Å; P402-G404 VanDerWaalsContact C-N 3.35Å
403	M	93.6	Very high	94.3	Very high	93 Å²	93	26.1 Å²	26.1	46%	0.458	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.9	174.9	-67.9	-63.3	172.7	0	0	113.2	P124 R347 N401	P124-M403 HydrophobicContact CB-CG 4Å; P124-M403 HydrophobicContact CG-CE 4.17Å; P124-M403 HydrophobicContact CG-CG 3.77Å; R347-M403 WeakPolarHBondContact CD-O 3.34Å; N401-M403 PolarHBondContact O-N 2.56Å
404	G	93.2	Very high	94.6	Very high	4 Å²	4	29.1 Å²	29.1	4%	0.041	15%	0.151	C	C	.	.	S	Bend	trans	86.1	10.9	179.4	0	0	0	0	0	115.3	F94 H345 N401 P402	F94-G404 WeakPolarHBondContact CE2-O 3.47Å; H345-G404 VanDerWaalsContact CE1-CA 3.47Å; H345-G404 WeakPolarHBondContact CE1-CA 3.31Å; H345-G404 PolarHBondContact NE2-O 3.42Å; H345-G404 VanDerWaalsContact NE2-O 3.14Å; N401-G404 WeakPolarHBondContact O-CA 3.46Å; N401-G404 PolarHBondContact O-N 2.83Å; N401-G404 WeakPolarHBondContact OD1-CA 3.46Å; N401-G404 PolarHBondContact OD1-N 2.82Å; P402-G404 VanDerWaalsContact C-N 3.35Å
405	D	93.1	Very high	94.7	Very high	76 Å²	76	28 Å²	28	41%	0.406	15%	0.145	S	C	.	.	S	Bend	trans	-99.9	-21.1	-178.8	59.9	16.7	0	0	0	113.2	Y101 N401	Y101-D405 VanDerWaalsContact CE1-O 3.26Å; Y101-D405 WeakPolarHBondContact CE1-O 3.46Å; Y101-D405 PolarHBondContact OH-O 2.94Å; N401-D405 PolarHBondContact ND2-OD1 2.87Å; N401-D405 PolarHBondContact OD1-N 3.27Å; N401-D405 PolarHBondContact OD1-OD1 2.85Å
406	T	95.6	Very high	94.8	Very high	10 Å²	10	27.9 Å²	27.9	6%	0.061	14%	0.144	C	C	.	.			trans	-124.5	135.7	-172.9	-52.3	0	0	0	0	109.4	W119 F141 F400 N401 I417 W418	W119-T406 HydrophobicContact CH2-CG2 4Å; W119-T406 HydrophobicContact CZ2-CG2 4.48Å; F141-T406 HydrophobicContact CE2-CG2 4.4Å; F141-T406 HydrophobicContact CZ-CG2 3.89Å; F400-T406 CarbonylContact C-O 3.51Å; F400-T406 WeakPolarHBondContact CA-O 3.33Å; F400-T406 WeakPolarHBondContact CD1-O 3.34Å; N401-T406 PolarHBondContact N-O 3.26Å; N401-T406 PolarHBondContact OD1-N 3.14Å; N401-T406 VanDerWaalsContact OD1-N 3.14Å; N401-T406 PolarHBondContact OD1-O 3.38Å; T406-I417 HydrophobicContact CG2-CG2 3.43Å; T406-I417 VanDerWaalsContact CG2-CG2 3.43Å; T406-W418 WeakPolarHBondContact CG2-O 3.37Å
407	L	96.9	Very high	94.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.6	177.3	176.8	72	0	0	0	109.9	V352 I372 L386 N398 F400 W418	V352-L407 HydrophobicContact CG2-CD1 4.43Å; I372-L407 HydrophobicContact CD1-CD2 4.32Å; I372-L407 HydrophobicContact CG2-CD2 4.28Å; L386-L407 HydrophobicContact CD1-CD2 3.6Å; N398-L407 HydrophobicContact CB-CD1 4.28Å; F400-L407 HydrophobicContact CD1-CB 3.93Å; F400-L407 HydrophobicContact CD1-CD1 4.16Å; F400-L407 HydrophobicContact CD2-CD1 4.03Å; F400-L407 HydrophobicContact CE1-CB 3.77Å; F400-L407 HydrophobicContact CE1-CD1 4.23Å; F400-L407 HydrophobicContact CE1-CG 4.49Å; F400-L407 HydrophobicContact CE2-CD1 4.15Å; F400-L407 HydrophobicContact CG-CD1 4.05Å; F400-L407 HydrophobicContact CZ-CB 4.37Å; F400-L407 HydrophobicContact CZ-CD1 4.22Å; L407-W418 HydrophobicContact CB-CB 4.14Å; L407-W418 HydrophobicContact CD2-CG 4.42Å; L407-W418 PolarHBondContact N-O 3.04Å; L407-W418 PolarHBondContact O-N 2.96Å
408	A	96.8	Very high	94.8	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.025	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132.5	170	0	0	0	0	0	109.4	W119 V127 N398 E399 L416 I417	W119-A408 HydrophobicContact CH2-CB 4.06Å; W119-A408 HydrophobicContact CZ2-CB 3.23Å; V127-A408 HydrophobicContact CG2-CB 4.38Å; N398-A408 WeakPolarHBondContact CA-O 3.29Å; E399-A408 PolarHBondContact N-O 3.02Å; E399-A408 PolarHBondContact O-N 2.99Å; A408-L416 WeakPolarHBondContact CA-O 3.37Å; A408-I417 HydrophobicContact CB-CD1 3.85Å
409	S	96.6	Very high	94.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.007	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.7	178.3	-60.4	0	0	0	0	110.5	I372 L397 N398 I415 L416 W418	I372-S409 WeakPolarHBondContact CD1-OG 3.39Å; L397-S409 CarbonylContact O-C 3.54Å; L397-S409 VanDerWaalsContact O-CA 3.24Å; L397-S409 WeakPolarHBondContact O-CA 3.05Å; N398-S409 VanDerWaalsContact OD1-CB 3.3Å; N398-S409 WeakPolarHBondContact OD1-CB 3.37Å; N398-S409 PolarHBondContact OD1-OG 3.23Å; S409-I415 CarbonylContact O-C 3.58Å; S409-I415 WeakPolarHBondContact O-CA 3.24Å; S409-L416 PolarHBondContact N-O 3.49Å; S409-L416 PolarHBondContact O-N 2.86Å; S409-W418 PolarHBondContact OG-NE1 3Å
410	A	95	Very high	94.2	Very high	5 Å²	5	30.3 Å²	30.3	4%	0.041	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.2	169.6	0	0	0	0	0	109.4	A114 S396 L397	A114-A410 HydrophobicContact CB-CB 3.7Å; S396-A410 PolarHBondContact N-O 2.77Å; L397-A410 HydrophobicContact CB-CB 3.79Å; L397-A410 HydrophobicContact CD1-CB 4.27Å; L397-A410 PolarHBondContact N-O 3.31Å; L397-A410 PolarHBondContact O-N 3.06Å
411	M	93.1	Very high	92.9	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.069	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	93.2	-175.5	179.7	-162.7	-78.5	0	0	109.5	S391 G393 Y413 H414 L416	S391-M411 WeakPolarHBondContact O-CE 3.15Å; G393-M411 WeakPolarHBondContact CA-SD 3.49Å; G393-M411 PolarHBondContact N-SD 2.8Å; G393-M411 VanDerWaalsContact N-SD 3.43Å; G393-M411 WeakPolarHBondContact O-CE 3.44Å; M411-Y413 PolarHBondContact O-N 3.2Å; M411-H414 PolarHBondContact N-O 2.81Å; M411-H414 PolarHBondContact O-N 3.2Å; M411-L416 HydrophobicContact CB-CD1 4.05Å; M411-L416 HydrophobicContact CE-CD1 3.38Å; M411-L416 HydrophobicContact SD-CD1 3.96Å
412	G	90.3	Very high	91	Very high	24 Å²	24	44.4 Å²	44.4	25%	0.247	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	-107.5	-177	0	0	0	0	0	110.8	R113 A114	R113-G412 CarbonylContact C-O 3.47Å; R113-G412 WeakPolarHBondContact CA-O 3.14Å; R113-G412 WeakPolarHBondContact CB-O 3.41Å; A114-G412 PolarHBondContact N-O 3.21Å
413	Y	92.1	Very high	88.4	Confident	127 Å²	127	46.2 Å²	46.2	50%	0.498	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-16	179.6	-59.3	-98.8	0	0	0	113.3	D111 M411	D111-Y413 VanDerWaalsContact O-CE1 3.29Å; D111-Y413 WeakPolarHBondContact O-CE1 3.31Å; M411-Y413 PolarHBondContact O-N 3.2Å
414	H	93.1	Very high	85.7	Confident	88 Å²	88	52.6 Å²	52.6	41%	0.407	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146.4	-174	-56.2	-81.3	0	0	0	111.5	A107 A108 M411 L416	A107-H414 CarbonylContact O-C 3.56Å; A107-H414 WeakPolarHBondContact O-CA 3.34Å; A108-H414 WeakPolarHBondContact CB-ND1 3.36Å; M411-H414 PolarHBondContact N-O 2.81Å; M411-H414 PolarHBondContact O-N 3.2Å; H414-L416 HydrophobicContact CB-CD2 4.26Å
415	I	94.7	Very high	82.9	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126	167.1	-55.3	158.5	0	0	0	106.1	A107 P109 F110 V129 M137 W139 S409 I417	A107-I415 PolarHBondContact N-O 2.84Å; A107-I415 PolarHBondContact O-N 3.06Å; P109-I415 HydrophobicContact CG-CD1 3.81Å; F110-I415 HydrophobicContact CE2-CD1 3.92Å; V129-I415 HydrophobicContact CB-CD1 3.78Å; V129-I415 HydrophobicContact CB-CG1 4.42Å; V129-I415 HydrophobicContact CG1-CD1 3.92Å; V129-I415 HydrophobicContact CG1-CG1 4.12Å; V129-I415 HydrophobicContact CG2-CD1 3.63Å; V129-I415 HydrophobicContact CG2-CG1 4.08Å; V129-I415 HydrophobicContact CG2-CG2 4.28Å; M137-I415 HydrophobicContact CE-CD1 3.17Å; W139-I415 HydrophobicContact CE3-CG2 4.17Å; W139-I415 HydrophobicContact CZ3-CB 4.35Å; W139-I415 HydrophobicContact CZ3-CG2 3.88Å; S409-I415 CarbonylContact O-C 3.58Å; S409-I415 WeakPolarHBondContact O-CA 3.24Å; I415-I417 HydrophobicContact CG2-CD1 4.46Å
416	L	95.4	Very high	79.9	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.7	-177.7	-48.1	169.6	0	0	0	107.9	I103 K106 A408 S409 M411 H414	I103-L416 HydrophobicContact CD1-CD1 4.23Å; I103-L416 HydrophobicContact CD1-CD2 4.35Å; I103-L416 HydrophobicContact CG2-CB 4.41Å; K106-L416 HydrophobicContact CB-CD2 4.21Å; K106-L416 HydrophobicContact CD-CD2 4.16Å; K106-L416 HydrophobicContact CG-CD2 3.71Å; A408-L416 WeakPolarHBondContact CA-O 3.37Å; S409-L416 PolarHBondContact N-O 3.49Å; S409-L416 PolarHBondContact O-N 2.86Å; M411-L416 HydrophobicContact CB-CD1 4.05Å; M411-L416 HydrophobicContact CE-CD1 3.38Å; M411-L416 HydrophobicContact SD-CD1 3.96Å; H414-L416 HydrophobicContact CB-CD2 4.26Å
417	I	95.6	Very high	76.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117.1	172.9	-55.7	-58.9	0	0	0	107.5	L104 Q105 W119 V127 W139 F141 T406 A408 I415	L104-I417 PolarHBondContact N-O 3.47Å; Q105-I417 PolarHBondContact N-O 3.22Å; Q105-I417 PolarHBondContact O-N 3.18Å; W119-I417 HydrophobicContact CH2-CD1 4.47Å; V127-I417 HydrophobicContact CG1-CD1 4.39Å; W139-I417 HydrophobicContact CE3-CD1 4.43Å; W139-I417 HydrophobicContact CE3-CG1 4.32Å; W139-I417 HydrophobicContact CH2-CG1 3.69Å; W139-I417 HydrophobicContact CZ3-CD1 3.86Å; W139-I417 HydrophobicContact CZ3-CG1 3.42Å; W139-I417 VanDerWaalsContact CZ3-CG1 3.42Å; F141-I417 HydrophobicContact CD1-CD1 4.01Å; F141-I417 HydrophobicContact CD1-CG1 3.91Å; F141-I417 HydrophobicContact CD1-CG2 4.33Å; F141-I417 HydrophobicContact CD2-CG2 4.19Å; F141-I417 HydrophobicContact CE1-CD1 3.98Å; F141-I417 HydrophobicContact CE1-CG1 4.21Å; F141-I417 HydrophobicContact CE1-CG2 4.06Å; F141-I417 HydrophobicContact CE2-CG2 3.92Å; F141-I417 HydrophobicContact CG-CG1 4.24Å; F141-I417 HydrophobicContact CG-CG2 4.37Å; F141-I417 HydrophobicContact CZ-CG2 3.83Å; T406-I417 HydrophobicContact CG2-CG2 3.43Å; T406-I417 VanDerWaalsContact CG2-CG2 3.43Å; A408-I417 HydrophobicContact CB-CD1 3.85Å; I415-I417 HydrophobicContact CG2-CD1 4.46Å
418	W	94.8	Very high	75.9	Confident	6 Å²	6	82.3 Å²	82.3	2%	0.023	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.8	174.5	-51.5	74.3	0	0	0	108.8	Y101 R102 I103 I372 L386 D388 T406 L407 S409	Y101-W418 HydrophobicContact CD1-CB 3.98Å; R102-W418 WeakPolarHBondContact O-CA 3.1Å; I103-W418 HydrophobicContact CD1-CH2 3.78Å; I103-W418 HydrophobicContact CD1-CZ2 3.71Å; I103-W418 HydrophobicContact CD1-CZ3 4.28Å; I103-W418 HydrophobicContact CG1-CD2 3.77Å; I103-W418 HydrophobicContact CG1-CE3 3.71Å; I103-W418 HydrophobicContact CG1-CH2 3.67Å; I103-W418 HydrophobicContact CG1-CZ2 3.73Å; I103-W418 HydrophobicContact CG1-CZ3 3.66Å; I372-W418 HydrophobicContact CD1-CZ2 3.68Å; L386-W418 HydrophobicContact CB-CE3 4.29Å; L386-W418 HydrophobicContact CB-CH2 4.26Å; L386-W418 HydrophobicContact CB-CZ3 4.02Å; D388-W418 HydrophobicContact CB-CH2 3.77Å; D388-W418 HydrophobicContact CB-CZ3 4.24Å; T406-W418 WeakPolarHBondContact CG2-O 3.37Å; L407-W418 HydrophobicContact CB-CB 4.14Å; L407-W418 HydrophobicContact CD2-CG 4.42Å; L407-W418 PolarHBondContact N-O 3.04Å; L407-W418 PolarHBondContact O-N 2.96Å; S409-W418 PolarHBondContact OG-NE1 3Å
419	S	92.6	Very high	74.9	Confident	28 Å²	28	86.4 Å²	86.4	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	165	174.3	-170.6	0	0	0	0	108.9	R102 E421	R102-S419 PolarHBondContact N-O 2.89Å; R102-S419 VanDerWaalsContact N-O 3.16Å; R102-S419 PolarHBondContact O-N 3.01Å; R102-S419 VanDerWaalsContact O-N 3.17Å; S419-E421 PolarHBondContact O-N 3.38Å
420	Q	88.2	Confident	73.6	Confident	95 Å²	95	91.2 Å²	91.2	44%	0.444	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	130.6	165.2	-172.7	177.5	16.6	0	0	108.7	T97 Y101 E422	T97-Q420 HydrophobicContact CG2-CB 4.17Å; T97-Q420 HydrophobicContact CG2-CG 3.9Å; T97-Q420 VanDerWaalsContact CG2-OE1 3.26Å; Y101-Q420 HydrophobicContact CD2-CB 4.42Å; Y101-Q420 HydrophobicContact CE2-CB 4.13Å; Q420-E422 PolarHBondContact O-N 3.32Å
421	E	69.2	Low	72.4	Confident	130 Å²	130	96.2 Å²	96.2	61%	0.607	46%	0.456	S	S	*	.			trans	-66.4	107.6	167.7	-162	170.8	-168.6	0	0	107	S419 A423	S419-E421 PolarHBondContact O-N 3.38Å; E421-A423 PolarHBondContact O-N 3.42Å
422	E	57.4	Low	71.1	Confident	171 Å²	171	101.4 Å²	101.4	80%	0.799	48%	0.48	S	S	*	.			trans	-55.9	119	164.6	-75.7	-176.1	174.1	0	0	105.4	Q420 R424	Q420-E422 PolarHBondContact O-N 3.32Å; E422-R424 PolarHBondContact O-N 3.32Å
423	A	39.3	Very low	69.8	Low	93 Å²	93	106.5 Å²	106.5	77%	0.769	50%	0.495	S	S	*	.			trans	-53.8	97.1	171.2	0	0	0	0	0	105.9	E421 T425	E421-A423 PolarHBondContact O-N 3.42Å; A423-T425 VanDerWaalsContact C-N 3.3Å; A423-T425 PolarHBondContact O-N 2.93Å
424	R	37.5	Very low	68.2	Low	226 Å²	226	105.1 Å²	105.1	85%	0.853	50%	0.495	S	S	*	.			trans	-53.5	108.7	174	-80.6	-176.2	174.8	177.6	1	103.3	E422 R426	E422-R424 PolarHBondContact O-N 3.32Å; R424-R426 PolarHBondContact O-N 3.28Å
425	T	33	Very low	66.3	Low	121 Å²	121	106.4 Å²	106.4	74%	0.742	50%	0.502	S	S	*	.			trans	-55.6	101.6	164.6	32.7	0	0	0	0	103.6	A423 K427	A423-T425 VanDerWaalsContact C-N 3.3Å; A423-T425 PolarHBondContact O-N 2.93Å; T425-K427 PolarHBondContact O-N 2.83Å
426	R	30.5	Very low	63.9	Low	248 Å²	248	115.2 Å²	115.2	94%	0.936	54%	0.543	S	S	*	.			trans	-58.7	92.3	162.8	-74.8	-179	175.7	-178.3	-1.7	103.6	R424	R424-R426 PolarHBondContact O-N 3.28Å
427	K	33.9	Very low	61.1	Low	262 Å²	262	125.5 Å²	125.5	100%	1.139	59%	0.592	S	S	*	*			trans	-70.8	0	168	-85.6	-170.8	174.6	-177.3	0	108.8	T425	T425-K427 PolarHBondContact O-N 2.83Å

Retrieved 427 of 427 residues in 139.9 ms (Link to these results)

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