A0A087Y638_POEFO Loading...

Cysteine rich secretory protein LCCL domain containing 1

AlphaFold DB , UniProt , Accession A0A087Y638, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 507 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	33	Very low	224 Å²	224	150.3 Å²	150.3	100%	1.103	77%	0.774	S	S	*	*				0	129.9	0	-124.8	163.8	75.3	0	0	108.3
2	K	33.3	Very low	33.2	Very low	185 Å²	185	147.8 Å²	147.8	80%	0.804	78%	0.78	S	S	*	*			trans	74.7	89	164.3	-60.9	-173.8	177.2	-178.3	0	120.1
3	L	30.2	Very low	33.3	Very low	158 Å²	158	146.8 Å²	146.8	83%	0.827	78%	0.782	S	S	*	*				16.5	131.5	110	-101.3	108.8	0	0	0	120
4	Q	35.6	Very low	33.1	Very low	157 Å²	157	147.9 Å²	147.9	73%	0.734	79%	0.787	S	S	*	*				130.3	122	119	-88.5	-152.8	-21.4	0	0	119.3
5	L	33.8	Very low	33	Very low	131 Å²	131	148.6 Å²	148.6	69%	0.686	79%	0.79	S	S	*	*				65.9	114.3	129.2	-93.4	82.1	0	0	0	123.2
6	S	33.5	Very low	32.9	Very low	80 Å²	80	149.4 Å²	149.4	56%	0.559	79%	0.793	S	S	*	*				50.1	130.5	117.1	82.2	0	0	0	0	119.3
7	H	34.1	Very low	33	Very low	155 Å²	155	148.4 Å²	148.4	72%	0.718	79%	0.794	S	S	*	*				178.5	168.6	67.7	-115.8	85.1	0	0	0	110.6
8	W	30.9	Very low	33.1	Very low	216 Å²	216	150.4 Å²	150.4	82%	0.818	80%	0.798	S	S	*	*			trans	109.2	89	157.2	-66.2	87.2	0	0	0	120.2
9	I	32.6	Very low	33.2	Very low	140 Å²	140	147.4 Å²	147.4	72%	0.718	80%	0.796	S	S	*	*				48.1	106	120.6	-53.2	172.6	0	0	0	119.4
10	G	33.5	Very low	33.4	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	79%	0.794	S	S	*	*				69	110.2	105.3	0	0	0	0	0	120.8
11	V	32.4	Very low	33.3	Very low	139 Å²	139	147.3 Å²	147.3	84%	0.842	80%	0.8	S	S	*	*			trans	-145.8	110.3	142.8	-177.3	0	0	0	0	108.6
12	S	35.4	Very low	33.1	Very low	121 Å²	121	141.6 Å²	141.6	85%	0.846	78%	0.782	S	S	*	*			trans	-112.1	124.2	164.1	-72.9	0	0	0	0	108.5
13	V	33.4	Very low	33	Very low	134 Å²	134	140.3 Å²	140.3	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.9	124.1	-178.9	173.5	0	0	0	0	110.1
14	L	31.4	Very low	33	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-98.4	118.2	171.8	-111.6	141.9	0	0	0	108.9	L16	L14-L16 PolarHBondContact O-N 3.23Å
15	L	31.3	Very low	32.8	Very low	158 Å²	158	138.4 Å²	138.4	83%	0.827	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-70.9	116.8	171	-89.2	150.7	0	0	0	109.9
16	L	31.6	Very low	32.7	Very low	161 Å²	161	139.7 Å²	139.7	84%	0.843	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-81.3	116.8	167.7	-82.9	158.3	0	0	0	109.5	L14	L14-L16 PolarHBondContact O-N 3.23Å
17	V	33.8	Very low	32.8	Very low	133 Å²	133	141.7 Å²	141.7	81%	0.806	80%	0.796	S	S	*	*			trans	-106.1	110.2	158.1	-179.1	0	0	0	0	106.7	A19	V17-A19 PolarHBondContact O-N 2.9Å
18	Q	35.6	Very low	32.9	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	79%	0.794	S	S	*	*			trans	-69.1	117.2	172.9	-75.6	176.5	-48.9	0	0	109.4
19	A	34.8	Very low	33.5	Very low	93 Å²	93	133.1 Å²	133.1	77%	0.769	78%	0.776	S	S	*	*			trans	-88.8	106.6	162.5	0	0	0	0	0	108.2	V17 M21	V17-A19 PolarHBondContact O-N 2.9Å; A19-M21 PolarHBondContact O-N 2.76Å; A19-M21 VanDerWaalsContact O-N 3.14Å
20	S	37.1	Very low	34.1	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	77%	0.765	S	S	*	*			trans	-66.5	104.6	166.4	51.8	0	0	0	0	109.1	S22	S20-S22 PolarHBondContact O-N 3.36Å
21	M	31	Very low	34.4	Very low	184 Å²	184	128.7 Å²	128.7	91%	0.906	75%	0.749	S	S	*	*			trans	-65.9	103.9	165.8	-75.5	179	81.9	0	0	108.3	A19 M23	A19-M21 PolarHBondContact O-N 2.76Å; A19-M21 VanDerWaalsContact O-N 3.14Å; M21-M23 PolarHBondContact O-N 3.45Å
22	S	30.4	Very low	34.8	Very low	105 Å²	105	126.3 Å²	126.3	73%	0.734	73%	0.725	S	S	*	*			trans	-70.3	106.2	161.6	-64.7	0	0	0	0	107.3	S20 V24	S20-S22 PolarHBondContact O-N 3.36Å; S22-V24 PolarHBondContact O-N 3.2Å
23	M	30.1	Very low	35.2	Very low	157 Å²	157	126.2 Å²	126.2	77%	0.773	71%	0.712	S	S	*	*			trans	-67.1	98	172.4	-152.2	177.6	-151.4	0	0	107.4	M21 M25	M21-M23 PolarHBondContact O-N 3.45Å; M23-M25 PolarHBondContact O-N 3.38Å; M23-M25 VanDerWaalsContact O-N 3.08Å; M23-M25 HydrophobicContact SD-CE 3.92Å
24	V	30.1	Very low	35.7	Very low	127 Å²	127	130.1 Å²	130.1	77%	0.77	71%	0.712	S	S	*	*			trans	-73.2	99	166.6	177.9	0	0	0	0	106.2	S22 L26	S22-V24 PolarHBondContact O-N 3.2Å; V24-L26 PolarHBondContact O-N 2.95Å
25	M	31.3	Very low	36.1	Very low	148 Å²	148	125 Å²	125	73%	0.729	68%	0.684	S	S	*	*			trans	-62.5	110.6	169.9	-70.1	-70.3	-167.6	0	0	108.5	M23	M23-M25 PolarHBondContact O-N 3.38Å; M23-M25 VanDerWaalsContact O-N 3.08Å; M23-M25 HydrophobicContact SD-CE 3.92Å
26	L	31.6	Very low	36.7	Very low	159 Å²	159	122.2 Å²	122.2	83%	0.832	67%	0.669	S	S	*	*			trans	-68.5	125.3	164	-68.8	168.4	0	0	0	108	V24	V24-L26 PolarHBondContact O-N 2.95Å
27	P	37.3	Very low	37.3	Very low	122 Å²	122	116.6 Å²	116.6	79%	0.792	65%	0.65	S	S	*	*			trans	-77.6	130.2	176.6	28.7	-28.7	0	0	0	111.2
28	N	35	Very low	37.7	Very low	127 Å²	127	118.7 Å²	118.7	68%	0.679	65%	0.649	S	S	*	*			trans	65.7	87.8	156.6	-104.9	-20.6	0	0	0	119.5	T30	N28-T30 VanDerWaalsContact C-N 3.26Å; N28-T30 PolarHBondContact O-N 3.1Å; N28-T30 PolarHBondContact OD1-OG1 3.08Å
29	S	43.7	Very low	37.9	Very low	64 Å²	64	114.7 Å²	114.7	45%	0.448	63%	0.626	S	S	.	*			trans	-74.9	-7.6	164.3	64.1	0	0	0	0	114.2	G31 W32 E33	S29-G31 VanDerWaalsContact C-N 3.3Å; S29-G31 PolarHBondContact O-N 2.99Å; S29-W32 WeakPolarHBondContact O-CB 3.39Å; S29-W32 PolarHBondContact O-N 3.27Å; S29-E33 WeakPolarHBondContact CB-OE1 3.48Å; S29-E33 PolarHBondContact O-N 3.32Å; S29-E33 VanDerWaalsContact O-N 3.13Å; S29-E33 PolarHBondContact OG-OE1 2.98Å
30	T	45.2	Very low	38.2	Very low	79 Å²	79	117 Å²	117	49%	0.485	63%	0.625	S	S	.	*	H	α-helix	trans	-64.4	-30.2	-170.2	52.1	0	0	0	0	113.8	N28 R34	N28-T30 VanDerWaalsContact C-N 3.26Å; N28-T30 PolarHBondContact O-N 3.1Å; N28-T30 PolarHBondContact OD1-OG1 3.08Å; T30-R34 WeakPolarHBondContact O-CB 3.28Å; T30-R34 PolarHBondContact O-N 3.13Å
31	G	40.8	Very low	38.3	Very low	36 Å²	36	118 Å²	118	37%	0.371	62%	0.622	S	S	.	*	H	α-helix	trans	-73.4	-30.1	174	0	0	0	0	0	113.7	S29 M35	S29-G31 VanDerWaalsContact C-N 3.3Å; S29-G31 PolarHBondContact O-N 2.99Å; G31-M35 WeakPolarHBondContact O-CG 3.25Å; G31-M35 PolarHBondContact O-N 3.07Å
32	W	41	Very low	39.1	Very low	88 Å²	88	118.5 Å²	118.5	33%	0.333	62%	0.622	S	S	.	*	H	α-helix	trans	-75.8	-43	179.1	-74.2	109.9	0	0	0	111.8	S29 R34 M35 L36 L68 K71	S29-W32 WeakPolarHBondContact O-CB 3.39Å; S29-W32 PolarHBondContact O-N 3.27Å; W32-R34 VanDerWaalsContact C-N 3.31Å; W32-R34 PolarHBondContact O-N 3Å; W32-M35 PolarHBondContact O-N 2.89Å; W32-L36 WeakPolarHBondContact O-CB 3.42Å; W32-L36 VanDerWaalsContact O-CG 3.27Å; W32-L36 WeakPolarHBondContact O-CG 3.44Å; W32-L36 PolarHBondContact O-N 3.38Å; W32-L68 HydrophobicContact CH2-CD1 3.31Å; W32-L68 HydrophobicContact CZ2-CD1 4.25Å; W32-L68 HydrophobicContact CZ3-CD1 3.88Å; W32-K71 HydrophobicContact CZ2-CD 4.46Å; W32-K71 VanDerWaalsContact NE1-NZ 3.15Å
33	E	43	Very low	39.8	Very low	120 Å²	120	120.3 Å²	120.3	56%	0.561	62%	0.624	S	S	*	*	H	α-helix	trans	-63.1	-37.6	176.2	-72.4	157.6	-156.2	0	0	111.6	S29 L36 G37	S29-E33 WeakPolarHBondContact CB-OE1 3.48Å; S29-E33 PolarHBondContact O-N 3.32Å; S29-E33 VanDerWaalsContact O-N 3.13Å; S29-E33 PolarHBondContact OG-OE1 2.98Å; E33-L36 PolarHBondContact O-N 2.96Å; E33-G37 PolarHBondContact O-N 2.76Å
34	R	43.6	Very low	40.3	Very low	215 Å²	215	116.6 Å²	116.6	81%	0.811	63%	0.625	S	S	*	*	H	α-helix	trans	-72	-30.7	178.4	-158.4	173	-175.3	163	0.7	113.8	T30 W32	T30-R34 WeakPolarHBondContact O-CB 3.28Å; T30-R34 PolarHBondContact O-N 3.13Å; W32-R34 VanDerWaalsContact C-N 3.31Å; W32-R34 PolarHBondContact O-N 3Å
35	M	40.1	Very low	40.5	Very low	57 Å²	57	117.7 Å²	117.7	28%	0.281	63%	0.627	S	S	.	*	H	α-helix	trans	-74.9	-35.1	172.7	-73.4	-123	-72.4	0	0	112.2	G31 W32 L64	G31-M35 WeakPolarHBondContact O-CG 3.25Å; G31-M35 PolarHBondContact O-N 3.07Å; W32-M35 PolarHBondContact O-N 2.89Å; M35-L64 HydrophobicContact CE-CD2 4.25Å; M35-L64 HydrophobicContact SD-CD2 3.73Å
36	L	43.8	Very low	40.6	Very low	98 Å²	98	122.2 Å²	122.2	51%	0.513	64%	0.636	S	S	.	*	H	α-helix	trans	-78.9	-27.9	177.9	-67.8	170.2	0	0	0	112.9	W32 E33 K38 Y39	W32-L36 WeakPolarHBondContact O-CB 3.42Å; W32-L36 VanDerWaalsContact O-CG 3.27Å; W32-L36 WeakPolarHBondContact O-CG 3.44Å; W32-L36 PolarHBondContact O-N 3.38Å; E33-L36 PolarHBondContact O-N 2.96Å; L36-K38 PolarHBondContact O-N 3.15Å; L36-Y39 PolarHBondContact O-N 2.9Å; L36-Y39 VanDerWaalsContact O-N 3.12Å
37	G	43.7	Very low	40.7	Very low	43 Å²	43	125.3 Å²	125.3	44%	0.443	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-64.8	-16.9	178.7	0	0	0	0	0	115	E33 Y39	E33-G37 PolarHBondContact O-N 2.76Å; G37-Y39 PolarHBondContact O-N 3.12Å
38	K	42.7	Very low	40.4	Very low	178 Å²	178	128.6 Å²	128.6	77%	0.774	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-72.3	-4.3	172.2	-82.8	-173.1	173.9	-176.5	0	114.1	L36	L36-K38 PolarHBondContact O-N 3.15Å
39	Y	40.2	Very low	40.4	Very low	100 Å²	100	127 Å²	127	39%	0.392	65%	0.645	S	S	.	*	G	3₁₀ helix	trans	-122.6	13.7	-174	-71.3	-90.4	0	0	0	113.8	L36 G37 S60 D61 L64	L36-Y39 PolarHBondContact O-N 2.9Å; L36-Y39 VanDerWaalsContact O-N 3.12Å; G37-Y39 PolarHBondContact O-N 3.12Å; Y39-S60 PolarHBondContact OH-OG 3.39Å; Y39-D61 PolarHBondContact OH-OD1 3.42Å; Y39-L64 HydrophobicContact CE2-CD1 3.39Å; Y39-L64 WeakPolarHBondContact OH-CD1 3.48Å
40	L	39.9	Very low	39.9	Very low	142 Å²	142	133.9 Å²	133.9	74%	0.743	67%	0.667	S	S	*	*			trans	-113.5	110.2	172.2	-74.9	161.5	0	0	0	107.9
41	D	40.5	Very low	39.7	Very low	129 Å²	129	138.7 Å²	138.7	69%	0.69	69%	0.685	S	S	*	*			trans	-90.6	145.5	163.7	-69.7	-24.7	0	0	0	109.1	D43	D41-D43 VanDerWaalsContact C-N 3.28Å; D41-D43 PolarHBondContact O-N 2.84Å
42	E	47.1	Very low	39.4	Very low	195 Å²	195	148.3 Å²	148.3	91%	0.911	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-9.7	-167.3	-83.6	-172.4	136	0	0	116.1
43	D	44.7	Very low	39.7	Very low	143 Å²	143	147 Å²	147	77%	0.765	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	3.3	-161.9	-62	-40.6	0	0	0	116.9	D41 D45	D41-D43 VanDerWaalsContact C-N 3.28Å; D41-D43 PolarHBondContact O-N 2.84Å; D43-D45 VanDerWaalsContact C-N 3.29Å; D43-D45 PolarHBondContact O-N 3.48Å
44	G	41.3	Very low	39.8	Very low	78 Å²	78	148.1 Å²	148.1	80%	0.804	73%	0.726	S	S	*	*			trans	61.7	19	161.7	0	0	0	0	0	118.5
45	D	33.1	Very low	40.7	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	70%	0.7	S	S	*	*			trans	-109.4	146.4	-179.6	-106.6	-21.4	0	0	0	115	D43	D43-D45 VanDerWaalsContact C-N 3.29Å; D43-D45 PolarHBondContact O-N 3.48Å
46	W	34	Very low	42	Very low	242 Å²	242	141.1 Å²	141.1	92%	0.917	71%	0.709	S	S	*	*			trans	-73.7	124.2	-173.8	-71.5	80.8	0	0	0	112.4	Q48	W46-Q48 PolarHBondContact O-N 2.99Å
47	W	33.3	Very low	43.8	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.852	69%	0.689	S	S	*	*			trans	-51.2	113.2	167.2	-60.9	95.6	0	0	0	110.9	A49	W47-A49 PolarHBondContact O-N 2.92Å; W47-A49 VanDerWaalsContact O-N 3.15Å
48	Q	32.1	Very low	45.8	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	69%	0.689	S	S	*	*			trans	-57.9	119.4	168.9	-76.5	178.5	-8.3	0	0	109	W46 K50	W46-Q48 PolarHBondContact O-N 2.99Å; Q48-K50 PolarHBondContact O-N 3.08Å
49	A	35	Very low	47.7	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	69%	0.689	S	S	*	*			trans	-58.4	107.3	-176.8	0	0	0	0	0	111.4	W47 Q51	W47-A49 PolarHBondContact O-N 2.92Å; W47-A49 VanDerWaalsContact O-N 3.15Å; A49-Q51 PolarHBondContact O-N 3.44Å
50	K	33.1	Very low	49.9	Very low	209 Å²	209	133.8 Å²	133.8	91%	0.909	69%	0.692	S	S	*	*			trans	-67.5	115.6	155.1	-86.7	-177.3	176.8	175.5	0	108	Q48 R52	Q48-K50 PolarHBondContact O-N 3.08Å; K50-R52 PolarHBondContact O-N 2.97Å
51	Q	40.6	Very low	52.2	Low	181 Å²	181	127.6 Å²	127.6	85%	0.846	66%	0.659	S	S	*	*	S	Bend	trans	-60.2	113.5	175	-79.2	-87.5	-25.3	0	0	111.9	A49	A49-Q51 PolarHBondContact O-N 3.44Å
52	R	35.3	Very low	54.5	Low	238 Å²	238	121.9 Å²	121.9	90%	0.898	63%	0.63	S	S	*	*			trans	171.4	124.7	131.4	-95.7	170.9	177.7	177.8	-0.1	109.7	K50 K54	K50-R52 PolarHBondContact O-N 2.97Å; R52-K54 PolarHBondContact O-N 3.48Å
53	G	46.4	Very low	56.6	Low	60 Å²	60	117.1 Å²	117.1	62%	0.619	61%	0.608	S	S	*	*			trans	-62.3	125.6	-169	0	0	0	0	0	114.4
54	K	45.9	Very low	58.8	Low	143 Å²	143	111.6 Å²	111.6	62%	0.622	58%	0.578	S	S	*	*			trans	167.8	127.5	151.2	-93.9	175.7	-171.2	-152.6	0	105.9	R52 E101	R52-K54 PolarHBondContact O-N 3.48Å; K54-E101 WeakPolarHBondContact CE-OE1 3.49Å; K54-E101 IonicContact NZ-OE1 3.04Å; K54-E101 PolarHBondContact NZ-OE1 3.03Å
55	R	61.1	Low	61.4	Low	68 Å²	68	107.9 Å²	107.9	26%	0.257	54%	0.539	S	S	.	.			trans	-101.8	90.2	170.9	-177.8	176.6	173.6	179.8	-6	107.2	Y127 I183 L185	R55-Y127 VanDerWaalsContact CZ-CE2 3.45Å; R55-Y127 VanDerWaalsContact NH1-CE2 3.29Å; R55-Y127 PolarHBondContact NH2-OH 3.41Å; R55-I183 HydrophobicContact CG-CG2 4.22Å; R55-I183 CarbonylContact O-C 3.51Å; R55-L185 HydrophobicContact CB-CB 4.32Å
56	A	67.9	Low	64.4	Low	58 Å²	58	101.3 Å²	101.3	48%	0.479	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-74.3	153.3	174.4	0	0	0	0	0	110.6
57	I	82.4	Confident	67.3	Low	19 Å²	19	92.8 Å²	92.8	10%	0.097	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-66.4	134.8	170.3	-168.3	168.3	0	0	0	109	D61 A62 I65 W88 E93 C181	I57-D61 HydrophobicContact CD1-CB 4.46Å; I57-D61 HydrophobicContact CG1-CB 3.81Å; I57-A62 HydrophobicContact CD1-CB 4.26Å; I57-A62 HydrophobicContact CG1-CB 4.49Å; I57-I65 HydrophobicContact CD1-CD1 3.56Å; I57-W88 HydrophobicContact CD1-CH2 3.97Å; I57-W88 HydrophobicContact CD1-CZ2 4.48Å; I57-E93 WeakPolarHBondContact CG2-OE1 3.3Å; I57-C181 HydrophobicContact CD1-CB 4.29Å
58	T	85.5	Confident	70.4	Confident	70 Å²	70	82.1 Å²	82.1	43%	0.429	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-84.6	155.4	176.1	67.4	0	0	0	0	110.2	S60 D61 A62	T58-S60 PolarHBondContact O-N 3.4Å; T58-D61 PolarHBondContact O-N 3.28Å; T58-D61 WeakPolarHBondContact OG1-CB 3.11Å; T58-D61 PolarHBondContact OG1-N 3.3Å; T58-D61 VanDerWaalsContact OG1-N 3.09Å; T58-D61 PolarHBondContact OG1-OD2 2.87Å; T58-A62 PolarHBondContact O-N 3Å
59	S	83.1	Confident	73.5	Confident	111 Å²	111	73 Å²	73	78%	0.776	39%	0.394	S	S	*	.	H	α-helix	trans	-58.3	-32.8	175.1	-48.5	0	0	0	0	112.4	Q63	S59-Q63 PolarHBondContact O-N 2.85Å
60	S	86.6	Confident	76.5	Confident	64 Å²	64	69.2 Å²	69.2	45%	0.448	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-45.7	173	-173.5	0	0	0	0	111.7	Y39 T58 Q63 L64	Y39-S60 PolarHBondContact OH-OG 3.39Å; T58-S60 PolarHBondContact O-N 3.4Å; S60-Q63 PolarHBondContact O-N 2.9Å; S60-L64 WeakPolarHBondContact O-CG 3.13Å; S60-L64 PolarHBondContact O-N 2.88Å
61	D	86.8	Confident	79.6	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.07	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-40	177.6	-68.6	-32.8	0	0	0	112.1	Y39 I57 T58 L64 I65 P130	Y39-D61 PolarHBondContact OH-OD1 3.42Å; I57-D61 HydrophobicContact CD1-CB 4.46Å; I57-D61 HydrophobicContact CG1-CB 3.81Å; T58-D61 PolarHBondContact O-N 3.28Å; T58-D61 WeakPolarHBondContact OG1-CB 3.11Å; T58-D61 PolarHBondContact OG1-N 3.3Å; T58-D61 VanDerWaalsContact OG1-N 3.09Å; T58-D61 PolarHBondContact OG1-OD2 2.87Å; D61-L64 PolarHBondContact O-N 3.34Å; D61-I65 VanDerWaalsContact O-CG1 3.31Å; D61-I65 WeakPolarHBondContact O-CG1 3.22Å; D61-I65 PolarHBondContact O-N 2.92Å; D61-P130 HydrophobicContact CB-CG 4.07Å
62	A	89.9	Confident	82.3	Confident	8 Å²	8	53.7 Å²	53.7	7%	0.066	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-46.6	175.2	0	0	0	0	0	111.3	I57 T58 L64 I65 L66 W88	I57-A62 HydrophobicContact CD1-CB 4.26Å; I57-A62 HydrophobicContact CG1-CB 4.49Å; T58-A62 PolarHBondContact O-N 3Å; A62-L64 PolarHBondContact O-N 3.1Å; A62-I65 PolarHBondContact O-N 2.66Å; A62-L66 PolarHBondContact O-N 2.9Å; A62-W88 HydrophobicContact CB-CD2 4.2Å; A62-W88 HydrophobicContact CB-CE3 4.23Å; A62-W88 HydrophobicContact CB-CH2 3.57Å; A62-W88 HydrophobicContact CB-CZ2 3.55Å; A62-W88 HydrophobicContact CB-CZ3 3.94Å; A62-W88 WeakPolarHBondContact O-CZ3 3.19Å
63	Q	90.6	Very high	85.3	Confident	96 Å²	96	42.4 Å²	42.4	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-43.3	176.2	-171.1	62.3	47.6	0	0	111.7	S59 S60 I65 L66 D67	S59-Q63 PolarHBondContact O-N 2.85Å; S60-Q63 PolarHBondContact O-N 2.9Å; Q63-I65 PolarHBondContact O-N 3.35Å; Q63-L66 WeakPolarHBondContact O-CB 3.3Å; Q63-L66 PolarHBondContact O-N 3.04Å; Q63-D67 PolarHBondContact NE2-OD1 3.01Å; Q63-D67 WeakPolarHBondContact O-CB 3.44Å; Q63-D67 PolarHBondContact O-N 3.04Å
64	L	90.9	Very high	87.8	Confident	26 Å²	26	40 Å²	40	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-36.3	178.2	-70.7	170.9	0	0	0	113.3	M35 Y39 S60 D61 A62 L68 T131	M35-L64 HydrophobicContact CE-CD2 4.25Å; M35-L64 HydrophobicContact SD-CD2 3.73Å; Y39-L64 HydrophobicContact CE2-CD1 3.39Å; Y39-L64 WeakPolarHBondContact OH-CD1 3.48Å; S60-L64 WeakPolarHBondContact O-CG 3.13Å; S60-L64 PolarHBondContact O-N 2.88Å; D61-L64 PolarHBondContact O-N 3.34Å; A62-L64 PolarHBondContact O-N 3.1Å; L64-L68 WeakPolarHBondContact O-CB 3.19Å; L64-L68 PolarHBondContact O-N 2.89Å; L64-T131 HydrophobicContact CB-CG2 3.89Å
65	I	95.5	Very high	90.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-48.8	172.1	-71.4	176	0	0	0	109.2	I57 D61 A62 Q63 L68 H69 W88 P130 V134 I179 C181 L202	I57-I65 HydrophobicContact CD1-CD1 3.56Å; D61-I65 VanDerWaalsContact O-CG1 3.31Å; D61-I65 WeakPolarHBondContact O-CG1 3.22Å; D61-I65 PolarHBondContact O-N 2.92Å; A62-I65 PolarHBondContact O-N 2.66Å; Q63-I65 PolarHBondContact O-N 3.35Å; I65-L68 PolarHBondContact O-N 3.45Å; I65-H69 PolarHBondContact O-N 3.1Å; I65-H69 PolarHBondContact O-ND1 3.24Å; I65-W88 HydrophobicContact CB-CZ3 4.32Å; I65-W88 HydrophobicContact CG2-CZ3 4.18Å; I65-P130 HydrophobicContact CD1-CB 3.74Å; I65-P130 HydrophobicContact CG1-CB 4.05Å; I65-V134 HydrophobicContact CG1-CG2 4.35Å; I65-V134 HydrophobicContact CG2-CG2 4.15Å; I65-I179 HydrophobicContact CG2-CD1 4.26Å; I65-C181 HydrophobicContact CD1-CB 4.21Å; I65-L202 HydrophobicContact CD1-CD1 4.23Å
66	L	97.3	Very high	91.9	Very high	14 Å²	14	36 Å²	36	7%	0.073	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-49.7	-179.9	-177.6	64.8	0	0	0	112.1	A62 Q63 L68 H69 N70 M86 W88 I179	A62-L66 PolarHBondContact O-N 2.9Å; Q63-L66 WeakPolarHBondContact O-CB 3.3Å; Q63-L66 PolarHBondContact O-N 3.04Å; L66-L68 VanDerWaalsContact C-N 3.29Å; L66-L68 PolarHBondContact O-N 3.45Å; L66-H69 WeakPolarHBondContact O-CB 3.47Å; L66-H69 PolarHBondContact O-N 3.12Å; L66-N70 PolarHBondContact O-N 3.23Å; L66-N70 PolarHBondContact O-ND2 3.03Å; L66-M86 HydrophobicContact CD1-CB 4Å; L66-M86 WeakPolarHBondContact CD1-O 3.41Å; L66-W88 HydrophobicContact CB-CE3 4.35Å; L66-W88 HydrophobicContact CD2-CB 4.23Å; L66-I179 HydrophobicContact CD1-CG2 3.63Å
67	D	95	Very high	93.1	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.332	22%	0.221	S	C	.	.	H	α-helix	trans	-60.3	-42	180	-69.7	-14.4	0	0	0	110.9	Q63 N70 K71	Q63-D67 PolarHBondContact NE2-OD1 3.01Å; Q63-D67 WeakPolarHBondContact O-CB 3.44Å; Q63-D67 PolarHBondContact O-N 3.04Å; D67-N70 PolarHBondContact O-N 2.77Å; D67-K71 VanDerWaalsContact O-CB 3.25Å; D67-K71 WeakPolarHBondContact O-CB 3.37Å; D67-K71 PolarHBondContact O-N 3.41Å
68	L	96.8	Very high	93.8	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-42.5	176.7	179.2	55.5	0	0	0	111.9	W32 L64 I65 L66 K71 L72 T131 V134	W32-L68 HydrophobicContact CH2-CD1 3.31Å; W32-L68 HydrophobicContact CZ2-CD1 4.25Å; W32-L68 HydrophobicContact CZ3-CD1 3.88Å; L64-L68 WeakPolarHBondContact O-CB 3.19Å; L64-L68 PolarHBondContact O-N 2.89Å; I65-L68 PolarHBondContact O-N 3.45Å; L66-L68 VanDerWaalsContact C-N 3.29Å; L66-L68 PolarHBondContact O-N 3.45Å; L68-K71 PolarHBondContact O-N 2.93Å; L68-L72 HydrophobicContact CD1-CD1 3.66Å; L68-L72 HydrophobicContact CD1-CD2 4.36Å; L68-L72 HydrophobicContact CD1-CG 3.78Å; L68-L72 HydrophobicContact CG-CD1 3.83Å; L68-L72 HydrophobicContact CG-CG 4.37Å; L68-L72 WeakPolarHBondContact O-CB 3.19Å; L68-L72 WeakPolarHBondContact O-CG 3.2Å; L68-L72 PolarHBondContact O-N 2.04Å; L68-T131 HydrophobicContact CD2-CG2 3.94Å; L68-V134 HydrophobicContact CB-CG1 4.48Å; L68-V134 HydrophobicContact CD2-CB 3.74Å; L68-V134 HydrophobicContact CD2-CG1 3.75Å; L68-V134 HydrophobicContact CG-CB 4.36Å; L68-V134 HydrophobicContact CG-CG1 3.8Å
69	H	98.4	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.8	-51.3	174.7	-81.9	75.7	0	0	0	111.1	I65 L66 K71 L72 R73 M86 V134 I179 Y206	I65-H69 PolarHBondContact O-N 3.1Å; I65-H69 PolarHBondContact O-ND1 3.24Å; L66-H69 WeakPolarHBondContact O-CB 3.47Å; L66-H69 PolarHBondContact O-N 3.12Å; H69-K71 PolarHBondContact O-N 3.1Å; H69-L72 PolarHBondContact O-N 2.79Å; H69-R73 WeakPolarHBondContact O-CB 3.45Å; H69-R73 WeakPolarHBondContact O-CD 3.13Å; H69-R73 WeakPolarHBondContact O-CG 3.42Å; H69-R73 PolarHBondContact O-N 3.49Å; H69-M86 HydrophobicContact CB-SD 4.13Å; H69-V134 VanDerWaalsContact CE1-CG1 3.43Å; H69-V134 WeakPolarHBondContact CE1-CG1 3.12Å; H69-I179 VanDerWaalsContact CE1-CD1 3.44Å; H69-I179 WeakPolarHBondContact CE1-CD1 2.97Å; H69-I179 VanDerWaalsContact NE2-CD1 3.35Å; H69-I179 WeakPolarHBondContact NE2-CD1 3.32Å; H69-Y206 AromaticContact CD2-CE1 3.88Å; H69-Y206 AromaticContact NE2-CE1 3.72Å; H69-Y206 AromaticContact NE2-CZ 3.81Å; H69-Y206 PolarHBondContact NE2-OH 2.97Å
70	N	98.1	Very high	95.1	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.064	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-43.2	-179.5	-78.6	-40.3	0	0	0	112	L66 D67 L72 R73 G74 H85 M86 L239	L66-N70 PolarHBondContact O-N 3.23Å; L66-N70 PolarHBondContact O-ND2 3.03Å; D67-N70 PolarHBondContact O-N 2.77Å; N70-L72 PolarHBondContact O-N 2.97Å; N70-R73 PolarHBondContact O-N 2.9Å; N70-G74 PolarHBondContact O-N 3.42Å; N70-H85 PolarHBondContact ND2-NE2 2.84Å; N70-M86 PolarHBondContact ND2-O 2.73Å; N70-M86 WeakPolarHBondContact OD1-CB 3.45Å; N70-M86 PolarHBondContact OD1-N 3.02Å; N70-L239 HydrophobicContact CB-CD1 3.77Å
71	K	97.4	Very high	95.6	Very high	60 Å²	60	32 Å²	32	26%	0.261	16%	0.156	S	C	.	.	H	α-helix	trans	-56.9	-47.9	175.1	-178.3	-179.8	178.7	-177.5	0	112	W32 D67 L68 H69 G74 Q75	W32-K71 HydrophobicContact CZ2-CD 4.46Å; W32-K71 VanDerWaalsContact NE1-NZ 3.15Å; D67-K71 VanDerWaalsContact O-CB 3.25Å; D67-K71 WeakPolarHBondContact O-CB 3.37Å; D67-K71 PolarHBondContact O-N 3.41Å; L68-K71 PolarHBondContact O-N 2.93Å; H69-K71 PolarHBondContact O-N 3.1Å; K71-G74 PolarHBondContact O-N 3.49Å; K71-Q75 VanDerWaalsContact O-CG 3.25Å; K71-Q75 WeakPolarHBondContact O-CG 3.31Å; K71-Q75 PolarHBondContact O-N 2.83Å
72	L	98	Very high	96	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-68	-39.2	-179.5	-69.6	171.8	0	0	0	112.1	L68 H69 N70 G74 Q75 V76 V134 Y138 L171	L68-L72 HydrophobicContact CD1-CD1 3.66Å; L68-L72 HydrophobicContact CD1-CD2 4.36Å; L68-L72 HydrophobicContact CD1-CG 3.78Å; L68-L72 HydrophobicContact CG-CD1 3.83Å; L68-L72 HydrophobicContact CG-CG 4.37Å; L68-L72 WeakPolarHBondContact O-CB 3.19Å; L68-L72 WeakPolarHBondContact O-CG 3.2Å; L68-L72 PolarHBondContact O-N 2.04Å; H69-L72 PolarHBondContact O-N 2.79Å; N70-L72 PolarHBondContact O-N 2.97Å; L72-G74 VanDerWaalsContact C-N 3.3Å; L72-G74 PolarHBondContact O-N 2.89Å; L72-Q75 PolarHBondContact O-N 3.47Å; L72-Q75 VanDerWaalsContact O-N 3.12Å; L72-V76 WeakPolarHBondContact O-CG1 3.38Å; L72-V76 PolarHBondContact O-N 3.26Å; L72-V134 HydrophobicContact CD1-CG1 4.18Å; L72-Y138 HydrophobicContact CB-CD2 3.7Å; L72-Y138 HydrophobicContact CB-CE2 3.73Å; L72-Y138 HydrophobicContact CB-CG 4.39Å; L72-Y138 HydrophobicContact CD1-CD2 3.88Å; L72-Y138 HydrophobicContact CD1-CG 3.83Å; L72-Y138 HydrophobicContact CD2-CD1 3.8Å; L72-Y138 HydrophobicContact CD2-CD2 3.9Å; L72-Y138 HydrophobicContact CD2-CE1 3.88Å; L72-Y138 HydrophobicContact CD2-CE2 3.98Å; L72-Y138 HydrophobicContact CD2-CG 3.8Å; L72-Y138 HydrophobicContact CG-CD2 4.03Å; L72-Y138 HydrophobicContact CG-CE2 4.31Å; L72-Y138 HydrophobicContact CG-CG 4.22Å; L72-L171 HydrophobicContact CB-CD2 4.08Å; L72-L171 HydrophobicContact CD1-CD1 4.34Å; L72-L171 HydrophobicContact CD1-CD2 4.48Å
73	R	98.4	Very high	96.4	Very high	1 Å²	1	32 Å²	32	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-36.7	175.1	-73	166.7	68.1	77.1	-3.2	112.5	H69 N70 Q75 M83 E84 L171 W173 A174 S176 L239	H69-R73 WeakPolarHBondContact O-CB 3.45Å; H69-R73 WeakPolarHBondContact O-CD 3.13Å; H69-R73 WeakPolarHBondContact O-CG 3.42Å; H69-R73 PolarHBondContact O-N 3.49Å; N70-R73 PolarHBondContact O-N 2.9Å; R73-Q75 PolarHBondContact O-N 2.91Å; R73-M83 HydrophobicContact CB-CG 3.89Å; R73-M83 HydrophobicContact CB-SD 4.02Å; R73-M83 HydrophobicContact CG-SD 4.17Å; R73-M83 PolarHBondContact NH2-SD 3.21Å; R73-E84 PolarHBondContact NE-O 3.26Å; R73-E84 PolarHBondContact NH2-O 3.1Å; R73-L171 HydrophobicContact CG-CD2 4.33Å; R73-L171 WeakPolarHBondContact CG-O 3.47Å; R73-L171 PolarHBondContact NH1-O 3.23Å; R73-W173 PolarHBondContact NH1-O 3.16Å; R73-W173 PolarHBondContact NH2-O 3.25Å; R73-W173 VanDerWaalsContact NH2-O 3.11Å; R73-A174 PolarHBondContact NH2-O 2.77Å; R73-A174 VanDerWaalsContact NH2-O 3.09Å; R73-S176 PolarHBondContact NH2-O 3.32Å; R73-L239 HydrophobicContact CB-CD2 3.81Å
74	G	97.2	Very high	96.7	Very high	9 Å²	9	28.3 Å²	28.3	9%	0.093	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-8	176	0	0	0	0	0	114.8	N70 K71 L72 D237 N238	N70-G74 PolarHBondContact O-N 3.42Å; K71-G74 PolarHBondContact O-N 3.49Å; L72-G74 VanDerWaalsContact C-N 3.3Å; L72-G74 PolarHBondContact O-N 2.89Å; G74-D237 WeakPolarHBondContact CA-O 3.42Å; G74-N238 PolarHBondContact O-ND2 2.04Å
75	Q	96.3	Very high	97	Very high	115 Å²	115	28.8 Å²	28.8	54%	0.537	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	10.3	-174.3	-69	179.3	-2.7	0	0	113.7	K71 L72 R73	K71-Q75 VanDerWaalsContact O-CG 3.25Å; K71-Q75 WeakPolarHBondContact O-CG 3.31Å; K71-Q75 PolarHBondContact O-N 2.83Å; L72-Q75 PolarHBondContact O-N 3.47Å; L72-Q75 VanDerWaalsContact O-N 3.12Å; R73-Q75 PolarHBondContact O-N 2.91Å
76	V	97.5	Very high	97	Very high	12 Å²	12	28.8 Å²	28.8	7%	0.073	14%	0.139	C	C	.	.			trans	-64.9	147.5	-178.5	-61.3	0	0	0	0	112.3	L72 A80 M83 V172 Y218	L72-V76 WeakPolarHBondContact O-CG1 3.38Å; L72-V76 PolarHBondContact O-N 3.26Å; V76-A80 HydrophobicContact CG2-CB 3.85Å; V76-M83 HydrophobicContact CG1-CE 4.35Å; V76-M83 HydrophobicContact CG2-CE 3.98Å; V76-V172 HydrophobicContact CG1-CB 3.91Å; V76-V172 HydrophobicContact CG1-CG1 3.48Å; V76-V172 VanDerWaalsContact CG1-CG1 3.48Å; V76-Y218 HydrophobicContact CB-CE1 4.15Å; V76-Y218 HydrophobicContact CG1-CE1 4.41Å; V76-Y218 HydrophobicContact CG2-CE1 3.98Å; V76-Y218 HydrophobicContact CG2-CE2 4.23Å
77	Y	93.9	Very high	96.9	Very high	180 Å²	180	31.3 Å²	31.3	71%	0.706	16%	0.155	S	C	*	.	S	Bend	trans	-124.7	131.9	169.3	-174.5	-95.4	0	0	0	110	Y218	Y77-Y218 PolarHBondContact O-OH 3.21Å
78	P	96.8	Very high	97	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.026	15%	0.15	C	C	.	.	S	Bend	cis	-66.6	161.5	-2.8	32.6	-38.1	0	0	0	113	F146 Y148 Y218	P78-F146 VanDerWaalsContact CD-CB 3.5Å; P78-F146 HydrophobicContact CG-CB 3.92Å; P78-F146 HydrophobicContact CG-CD1 3.43Å; P78-F146 VanDerWaalsContact CG-CD1 3.43Å; P78-F146 HydrophobicContact CG-CD2 4.1Å; P78-F146 HydrophobicContact CG-CE1 3.91Å; P78-F146 HydrophobicContact CG-CG 3.53Å; P78-F146 HydrophobicContact CG-CZ 4.44Å; P78-Y148 HydrophobicContact CB-CE1 4.38Å; P78-Y148 HydrophobicContact CG-CE1 4.25Å; P78-Y218 WeakPolarHBondContact CD-OH 3.47Å; P78-Y218 HydrophobicContact CG-CE2 4.4Å; P78-Y218 WeakPolarHBondContact O-CE2 3.35Å; P78-Y218 PolarHBondContact O-OH 3.01Å; P78-Y218 VanDerWaalsContact O-OH 3.1Å
79	P	97.4	Very high	96.8	Very high	46 Å²	46	32.2 Å²	32.2	30%	0.299	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-65.1	143.9	-173.9	26.4	-34.7	0	0	0	112.3	H220 G221 P223	P79-H220 WeakPolarHBondContact O-CA 3.11Å; P79-G221 CarbonylContact C-O 3.47Å; P79-G221 PolarHBondContact O-N 2.87Å; P79-G221 VanDerWaalsContact O-O 3.12Å; P79-P223 HydrophobicContact CB-CG 4.32Å
80	A	97.8	Very high	96.4	Very high	5 Å²	5	37.2 Å²	37.2	4%	0.041	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-98.7	125.6	-177.2	0	0	0	0	0	111.8	V76 M83 Y218 K219 P223	V76-A80 HydrophobicContact CG2-CB 3.85Å; A80-M83 HydrophobicContact CB-CB 3.92Å; A80-M83 HydrophobicContact CB-CE 3.67Å; A80-Y218 HydrophobicContact CB-CD1 4.44Å; A80-Y218 HydrophobicContact CB-CD2 3.43Å; A80-Y218 VanDerWaalsContact CB-CD2 3.43Å; A80-Y218 HydrophobicContact CB-CE2 4.01Å; A80-Y218 HydrophobicContact CB-CG 3.68Å; A80-K219 WeakPolarHBondContact CA-O 3.37Å; A80-P223 WeakPolarHBondContact O-CA 3.43Å
81	S	96.7	Very high	95.7	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	-81	-19	179.5	56.3	0	0	0	0	114.8	K219 T222 C224 S225 S226	S81-K219 PolarHBondContact N-O 2.97Å; S81-K219 VanDerWaalsContact OG-CB 3.29Å; S81-K219 WeakPolarHBondContact OG-CB 3.5Å; S81-K219 PolarHBondContact OG-O 3.25Å; S81-T222 VanDerWaalsContact CA-O 3.27Å; S81-T222 WeakPolarHBondContact CA-O 3.35Å; S81-T222 WeakPolarHBondContact CB-O 3.35Å; S81-C224 CarbonylContact O-C 3.1Å; S81-C224 VanDerWaalsContact O-C 3.31Å; S81-C224 WeakPolarHBondContact O-CA 3.08Å; S81-C224 PolarHBondContact O-N 3.35Å; S81-S225 VanDerWaalsContact CB-OG 3.27Å; S81-S225 WeakPolarHBondContact CB-OG 3.36Å; S81-S225 PolarHBondContact O-N 3.37Å; S81-S226 CarbonylContact O-C 3.59Å; S81-S226 WeakPolarHBondContact O-CA 3.38Å; S81-S226 PolarHBondContact O-N 2.84Å
82	N	96.4	Very high	95.3	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.102	20%	0.196	C	C	.	.	S	Bend	trans	-132	23.9	-169.2	72.9	-39.5	0	0	0	113.8	E84 K219 S226	N82-E84 PolarHBondContact O-N 3.23Å; N82-K219 WeakPolarHBondContact OD1-CB 3.25Å; N82-K219 PolarHBondContact OD1-N 2.95Å; N82-S226 WeakPolarHBondContact CB-O 3.45Å
83	M	98.1	Very high	95	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.206	C	C	.	.			trans	-70.8	112.9	-175.3	-170	67.8	70	0	0	111.2	R73 V76 A80 V172 A174 Y218 L239 C240	R73-M83 HydrophobicContact CB-CG 3.89Å; R73-M83 HydrophobicContact CB-SD 4.02Å; R73-M83 HydrophobicContact CG-SD 4.17Å; R73-M83 PolarHBondContact NH2-SD 3.21Å; V76-M83 HydrophobicContact CG1-CE 4.35Å; V76-M83 HydrophobicContact CG2-CE 3.98Å; A80-M83 HydrophobicContact CB-CB 3.92Å; A80-M83 HydrophobicContact CB-CE 3.67Å; M83-V172 HydrophobicContact CE-CB 4.37Å; M83-V172 WeakPolarHBondContact CE-O 3.47Å; M83-A174 HydrophobicContact SD-CB 4.44Å; M83-Y218 HydrophobicContact CE-CD1 3.67Å; M83-Y218 HydrophobicContact CE-CE1 4.35Å; M83-Y218 HydrophobicContact CE-CG 3.95Å; M83-L239 HydrophobicContact CB-CD2 3.96Å; M83-L239 HydrophobicContact CG-CD2 3.33Å; M83-L239 CarbonylContact O-C 3.53Å; M83-L239 WeakPolarHBondContact O-CA 3.02Å; M83-C240 PolarHBondContact O-N 3.18Å; M83-C240 PolarHBondContact O-SG 3.42Å; M83-C240 VanDerWaalsContact O-SG 3.4Å
84	E	96.6	Very high	94.4	Very high	20 Å²	20	46 Å²	46	9%	0.093	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-76.4	141.5	-179.7	-60.4	176.5	-160.6	0	0	111.7	R73 N82 M86 A174 S177 P228 F231	R73-E84 PolarHBondContact NE-O 3.26Å; R73-E84 PolarHBondContact NH2-O 3.1Å; N82-E84 PolarHBondContact O-N 3.23Å; E84-M86 PolarHBondContact O-N 3Å; E84-A174 WeakPolarHBondContact CB-O 3.48Å; E84-A174 VanDerWaalsContact CG-O 3.29Å; E84-A174 WeakPolarHBondContact CG-O 3.34Å; E84-A174 PolarHBondContact N-O 3.11Å; E84-S177 WeakPolarHBondContact OE2-CB 3.25Å; E84-S177 PolarHBondContact OE2-OG 2.82Å; E84-P228 HydrophobicContact CG-CG 4.33Å; E84-F231 HydrophobicContact CB-CE1 4.21Å; E84-F231 HydrophobicContact CB-CE2 4.23Å; E84-F231 HydrophobicContact CB-CZ 3.66Å; E84-F231 HydrophobicContact CG-CE1 4.48Å; E84-F231 HydrophobicContact CG-CE2 3.67Å; E84-F231 HydrophobicContact CG-CZ 3.64Å; E84-F231 WeakPolarHBondContact OE2-CZ 3.44Å
85	H	96.5	Very high	93.8	Very high	36 Å²	36	46.1 Å²	46.1	17%	0.167	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-66	128.3	169.1	178.4	-100.2	0	0	0	110.2	N70 L239 C240 Y241	N70-H85 PolarHBondContact ND2-NE2 2.84Å; H85-L239 HydrophobicContact CB-CB 4.25Å; H85-C240 WeakPolarHBondContact CB-O 3Å; H85-C240 PolarHBondContact N-O 3.37Å; H85-Y241 HydrophobicContact CB-CD1 4.35Å; H85-Y241 HydrophobicContact CB-CD2 4.18Å; H85-Y241 HydrophobicContact CB-CE1 4.3Å; H85-Y241 HydrophobicContact CB-CE2 4.16Å; H85-Y241 HydrophobicContact CB-CG 4.31Å; H85-Y241 AromaticContact CD2-CE1 3.42Å; H85-Y241 VanDerWaalsContact CD2-CE1 3.42Å; H85-Y241 WeakPolarHBondContact CD2-CE1 3.4Å; H85-Y241 AromaticContact CD2-CE2 3.66Å; H85-Y241 AromaticContact CD2-CZ 3.06Å; H85-Y241 PolarHBondContact CD2-OH 2.79Å; H85-Y241 AromaticContact CE1-CE1 3.7Å; H85-Y241 AromaticContact CG-CE1 3.59Å; H85-Y241 AromaticContact CG-CZ 3.62Å; H85-Y241 AromaticContact ND1-CE1 3.77Å; H85-Y241 AromaticContact NE2-CE1 3.47Å; H85-Y241 WeakPolarHBondContact NE2-CE1 3.47Å; H85-Y241 AromaticContact NE2-CZ 3.41Å; H85-Y241 PolarHBondContact NE2-OH 2.61Å
86	M	96.9	Very high	93.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-82	142.5	175.2	-76.7	179.1	167.3	0	0	111.1	L66 H69 N70 E84 S176 S177 Y206	L66-M86 HydrophobicContact CD1-CB 4Å; L66-M86 WeakPolarHBondContact CD1-O 3.41Å; H69-M86 HydrophobicContact CB-SD 4.13Å; N70-M86 PolarHBondContact ND2-O 2.73Å; N70-M86 WeakPolarHBondContact OD1-CB 3.45Å; N70-M86 PolarHBondContact OD1-N 3.02Å; E84-M86 PolarHBondContact O-N 3Å; M86-S176 WeakPolarHBondContact CE-O 3.43Å; M86-S176 WeakPolarHBondContact CG-O 3.32Å; M86-S177 CarbonylContact C-O 3.54Å; M86-S177 VanDerWaalsContact CA-O 3.29Å; M86-S177 WeakPolarHBondContact CA-O 3.33Å; M86-Y206 HydrophobicContact CE-CD1 3.77Å; M86-Y206 HydrophobicContact CE-CE1 4.15Å
87	V	95.5	Very high	93.2	Very high	66 Å²	66	43.8 Å²	43.8	40%	0.4	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.4	168.9	-60.7	0	0	0	0	110.6	S177 R178 I179	V87-S177 PolarHBondContact N-O 3.42Å; V87-R178 HydrophobicContact CG2-CG 4.08Å; V87-R178 WeakPolarHBondContact O-CA 3.3Å; V87-I179 PolarHBondContact O-N 3.02Å
88	W	95.5	Very high	92.8	Very high	58 Å²	58	40 Å²	40	22%	0.22	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	138.9	173.7	-163.8	-97.5	0	0	0	110.8	I57 A62 I65 L66 E93 I179 C181	I57-W88 HydrophobicContact CD1-CH2 3.97Å; I57-W88 HydrophobicContact CD1-CZ2 4.48Å; A62-W88 HydrophobicContact CB-CD2 4.2Å; A62-W88 HydrophobicContact CB-CE3 4.23Å; A62-W88 HydrophobicContact CB-CH2 3.57Å; A62-W88 HydrophobicContact CB-CZ2 3.55Å; A62-W88 HydrophobicContact CB-CZ3 3.94Å; A62-W88 WeakPolarHBondContact O-CZ3 3.19Å; I65-W88 HydrophobicContact CB-CZ3 4.32Å; I65-W88 HydrophobicContact CG2-CZ3 4.18Å; L66-W88 HydrophobicContact CB-CE3 4.35Å; L66-W88 HydrophobicContact CD2-CB 4.23Å; W88-E93 HydrophobicContact CZ2-CB 4.13Å; W88-E93 HydrophobicContact CZ2-CG 4.17Å; W88-E93 PolarHBondContact NE1-OE2 3.1Å; W88-I179 CarbonylContact C-O 3.47Å; W88-I179 WeakPolarHBondContact CA-O 3.46Å; W88-I179 HydrophobicContact CE3-CG2 4.14Å; W88-C181 HydrophobicContact CH2-CB 3.76Å; W88-C181 VanDerWaalsContact CH2-N 3.28Å; W88-C181 HydrophobicContact CZ3-CB 4.45Å
89	D	93.4	Very high	92.5	Very high	25 Å²	25	41.4 Å²	41.4	13%	0.134	21%	0.205	C	C	.	.			trans	-126.8	115.2	177.7	-171	-61.7	0	0	0	109.7	E91 L92 E93 R178 I179	D89-E91 VanDerWaalsContact C-N 3.28Å; D89-E91 PolarHBondContact O-N 3.1Å; D89-E91 WeakPolarHBondContact OD1-CB 3.4Å; D89-E91 PolarHBondContact OD1-N 3.45Å; D89-L92 HydrophobicContact CB-CB 4.15Å; D89-L92 HydrophobicContact CB-CD1 3.93Å; D89-L92 HydrophobicContact CB-CG 3.96Å; D89-L92 PolarHBondContact O-N 3.18Å; D89-L92 PolarHBondContact OD1-N 3.38Å; D89-L92 VanDerWaalsContact OD1-N 3.15Å; D89-E93 PolarHBondContact O-N 2.62Å; D89-R178 HydrophobicContact CB-CB 4.03Å; D89-R178 HydrophobicContact CB-CG 4.49Å; D89-R178 WeakPolarHBondContact OD2-CD 3.48Å; D89-R178 IonicContact OD2-CZ 3.41Å; D89-R178 IonicContact OD2-NH1 2.66Å; D89-R178 PolarHBondContact OD2-NH1 2.86Å; D89-I179 PolarHBondContact N-O 2.86Å
90	T	89.1	Confident	92.3	Very high	106 Å²	106	39.2 Å²	39.2	65%	0.65	19%	0.19	S	C	*	.	H	α-helix	trans	-69	-24.4	-173.8	50.5	0	0	0	0	113	R94	T90-R94 WeakPolarHBondContact O-CB 3.27Å; T90-R94 PolarHBondContact O-N 3Å
91	E	85	Confident	91.9	Very high	98 Å²	98	43 Å²	43	46%	0.458	21%	0.207	S	C	.	.	H	α-helix	trans	-77.1	-35.7	175.6	-177.5	59.5	-163.1	0	0	110.9	D89 E93 R94 T95	D89-E91 VanDerWaalsContact C-N 3.28Å; D89-E91 PolarHBondContact O-N 3.1Å; D89-E91 WeakPolarHBondContact OD1-CB 3.4Å; D89-E91 PolarHBondContact OD1-N 3.45Å; E91-E93 VanDerWaalsContact C-N 3.34Å; E91-R94 PolarHBondContact O-N 3.27Å; E91-R94 IonicContact OE1-CZ 3.72Å; E91-R94 IonicContact OE1-NE 3.66Å; E91-R94 PolarHBondContact OE1-NE 2.97Å; E91-R94 IonicContact OE1-NH2 2.8Å; E91-R94 PolarHBondContact OE1-NH2 2.82Å; E91-R94 IonicContact OE2-CZ 2.89Å; E91-R94 IonicContact OE2-NE 3.66Å; E91-R94 PolarHBondContact OE2-NE 3.43Å; E91-R94 IonicContact OE2-NH2 3.53Å; E91-T95 WeakPolarHBondContact O-CG2 3.47Å; E91-T95 PolarHBondContact O-N 3.49Å; E91-T95 VanDerWaalsContact O-N 3.07Å; E91-T95 PolarHBondContact O-OG1 2.8Å
92	L	87.8	Confident	91.5	Very high	14 Å²	14	45.6 Å²	45.6	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-38	169.9	-66	-176.2	0	0	0	112	D89 T95 A96 I116 R178 N205	D89-L92 HydrophobicContact CB-CB 4.15Å; D89-L92 HydrophobicContact CB-CD1 3.93Å; D89-L92 HydrophobicContact CB-CG 3.96Å; D89-L92 PolarHBondContact O-N 3.18Å; D89-L92 PolarHBondContact OD1-N 3.38Å; D89-L92 VanDerWaalsContact OD1-N 3.15Å; L92-T95 WeakPolarHBondContact CA-OG1 3.27Å; L92-T95 PolarHBondContact O-OG1 2.03Å; L92-A96 WeakPolarHBondContact O-CB 3.27Å; L92-A96 PolarHBondContact O-N 2.87Å; L92-I116 HydrophobicContact CD2-CG2 3.92Å; L92-R178 HydrophobicContact CD1-CB 3.92Å; L92-N205 HydrophobicContact CB-CB 4.11Å; L92-N205 HydrophobicContact CD2-CB 4.22Å; L92-N205 PolarHBondContact O-ND2 3.44Å
93	E	92.1	Very high	91.1	Very high	47 Å²	47	46 Å²	46	22%	0.22	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-50	173.8	170.2	176.5	-159.1	0	0	111.3	I57 W88 D89 E91 T95 A96 E97	I57-E93 WeakPolarHBondContact CG2-OE1 3.3Å; W88-E93 HydrophobicContact CZ2-CB 4.13Å; W88-E93 HydrophobicContact CZ2-CG 4.17Å; W88-E93 PolarHBondContact NE1-OE2 3.1Å; D89-E93 PolarHBondContact O-N 2.62Å; E91-E93 VanDerWaalsContact C-N 3.34Å; E93-T95 VanDerWaalsContact C-N 3.3Å; E93-T95 PolarHBondContact O-N 3.4Å; E93-A96 CarbonylContact O-C 3.53Å; E93-A96 WeakPolarHBondContact O-CA 3.26Å; E93-A96 WeakPolarHBondContact O-CB 3.01Å; E93-A96 PolarHBondContact O-N 3.4Å; E93-E97 PolarHBondContact O-N 2.88Å
94	R	85.6	Confident	90.7	Very high	101 Å²	101	50.2 Å²	50.2	38%	0.381	25%	0.25	S	C	.	.	H	α-helix	trans	-55.8	-44.8	178.4	-169.6	-172.5	72.6	69.7	8.8	111.9	T90 E91 E97 E98	T90-R94 WeakPolarHBondContact O-CB 3.27Å; T90-R94 PolarHBondContact O-N 3Å; E91-R94 PolarHBondContact O-N 3.27Å; E91-R94 IonicContact OE1-CZ 3.72Å; E91-R94 IonicContact OE1-NE 3.66Å; E91-R94 PolarHBondContact OE1-NE 2.97Å; E91-R94 IonicContact OE1-NH2 2.8Å; E91-R94 PolarHBondContact OE1-NH2 2.82Å; E91-R94 IonicContact OE2-CZ 2.89Å; E91-R94 IonicContact OE2-NE 3.66Å; E91-R94 PolarHBondContact OE2-NE 3.43Å; E91-R94 IonicContact OE2-NH2 3.53Å; R94-E97 PolarHBondContact O-N 2.79Å; R94-E98 IonicContact CZ-OE1 2.84Å; R94-E98 IonicContact NH1-OE1 3.92Å; R94-E98 PolarHBondContact NH1-OE1 2.68Å; R94-E98 IonicContact NH1-OE2 3.35Å; R94-E98 WeakPolarHBondContact O-CG 3.3Å; R94-E98 PolarHBondContact O-N 3.47Å
95	T	83.9	Confident	90.4	Very high	13 Å²	13	51.6 Å²	51.6	8%	0.08	25%	0.254	C	S	.	.	H	α-helix	trans	-72.2	-28	177.6	53.8	0	0	0	0	113.1	E91 L92 E93 W99 L112 N205	E91-T95 WeakPolarHBondContact O-CG2 3.47Å; E91-T95 PolarHBondContact O-N 3.49Å; E91-T95 VanDerWaalsContact O-N 3.07Å; E91-T95 PolarHBondContact O-OG1 2.8Å; L92-T95 WeakPolarHBondContact CA-OG1 3.27Å; L92-T95 PolarHBondContact O-OG1 2.03Å; E93-T95 VanDerWaalsContact C-N 3.3Å; E93-T95 PolarHBondContact O-N 3.4Å; T95-W99 PolarHBondContact O-N 2.98Å; T95-L112 HydrophobicContact CG2-CD2 3.91Å; T95-N205 PolarHBondContact OG1-ND2 2.03Å; T95-N205 VanDerWaalsContact OG1-ND2 3.15Å
96	A	92.4	Very high	89.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70.4	-37.6	171.3	0	0	0	0	0	111.3	L92 E93 W99 A100 A182 V203 N205	L92-A96 WeakPolarHBondContact O-CB 3.27Å; L92-A96 PolarHBondContact O-N 2.87Å; E93-A96 CarbonylContact O-C 3.53Å; E93-A96 WeakPolarHBondContact O-CA 3.26Å; E93-A96 WeakPolarHBondContact O-CB 3.01Å; E93-A96 PolarHBondContact O-N 3.4Å; A96-W99 PolarHBondContact O-N 2.8Å; A96-A100 WeakPolarHBondContact O-CB 3.38Å; A96-A100 PolarHBondContact O-N 2.96Å; A96-A182 HydrophobicContact CB-CB 4Å; A96-V203 HydrophobicContact CB-CB 4.15Å; A96-V203 HydrophobicContact CB-CG1 3.92Å; A96-N205 WeakPolarHBondContact CA-ND2 3.38Å; A96-N205 PolarHBondContact N-ND2 2.87Å
97	E	88.8	Confident	89.2	Confident	78 Å²	78	56.6 Å²	56.6	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-52.2	177	-174	178	-155.5	0	0	110.9	E93 R94 W99 A100 E101 A182	E93-E97 PolarHBondContact O-N 2.88Å; R94-E97 PolarHBondContact O-N 2.79Å; E97-W99 PolarHBondContact O-N 3.35Å; E97-W99 VanDerWaalsContact O-N 3.09Å; E97-A100 PolarHBondContact O-N 3.11Å; E97-A100 VanDerWaalsContact O-N 3.07Å; E97-E101 WeakPolarHBondContact O-CG 3.18Å; E97-E101 PolarHBondContact O-N 3.03Å; E97-A182 HydrophobicContact CB-CB 3.64Å; E97-A182 HydrophobicContact CG-CB 4.35Å
98	E	86.8	Confident	88.3	Confident	99 Å²	99	53.5 Å²	53.5	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-52.3	-35.7	174.9	-72.9	178	168.2	0	0	112.1	R94 T102	R94-E98 IonicContact CZ-OE1 2.84Å; R94-E98 IonicContact NH1-OE1 3.92Å; R94-E98 PolarHBondContact NH1-OE1 2.68Å; R94-E98 IonicContact NH1-OE2 3.35Å; R94-E98 WeakPolarHBondContact O-CG 3.3Å; R94-E98 PolarHBondContact O-N 3.47Å; E98-T102 WeakPolarHBondContact O-CG2 3.48Å
99	W	90.3	Very high	87.7	Confident	34 Å²	34	53.1 Å²	53.1	13%	0.129	26%	0.263	C	S	.	.	H	α-helix	trans	-78.8	-42.1	178	-168.4	-112.3	0	0	0	113.2	T95 A96 E97 E101 T102 E106 H107 G108 P109 Y201 V203	T95-W99 PolarHBondContact O-N 2.98Å; A96-W99 PolarHBondContact O-N 2.8Å; E97-W99 PolarHBondContact O-N 3.35Å; E97-W99 VanDerWaalsContact O-N 3.09Å; W99-E101 PolarHBondContact O-N 2.86Å; W99-T102 HydrophobicContact CE3-CG2 4.09Å; W99-T102 HydrophobicContact CZ3-CG2 4.36Å; W99-T102 WeakPolarHBondContact O-CB 3.25Å; W99-T102 PolarHBondContact O-N 3.2Å; W99-T102 VanDerWaalsContact O-N 3.09Å; W99-T102 PolarHBondContact O-OG1 3.44Å; W99-E106 VanDerWaalsContact CE2-O 3.26Å; W99-E106 HydrophobicContact CZ2-CB 4.46Å; W99-E106 VanDerWaalsContact CZ2-O 3.24Å; W99-E106 WeakPolarHBondContact CZ2-O 3.47Å; W99-E106 PolarHBondContact NE1-O 3.1Å; W99-H107 VanDerWaalsContact CZ2-C 3.41Å; W99-H107 WeakPolarHBondContact CZ2-O 3.15Å; W99-G108 VanDerWaalsContact CZ2-N 3.34Å; W99-P109 HydrophobicContact CE3-CB 4.15Å; W99-P109 HydrophobicContact CZ3-CB 4.14Å; W99-Y201 PolarHBondContact NE1-OH 2.87Å; W99-V203 HydrophobicContact CB-CG1 4.4Å
100	A	92.2	Very high	86.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-34.1	177.4	0	0	0	0	0	111.5	A96 E97 T102 C103 A182 N184 Y201 V203	A96-A100 WeakPolarHBondContact O-CB 3.38Å; A96-A100 PolarHBondContact O-N 2.96Å; E97-A100 PolarHBondContact O-N 3.11Å; E97-A100 VanDerWaalsContact O-N 3.07Å; A100-T102 PolarHBondContact O-N 3.02Å; A100-C103 PolarHBondContact O-N 2.96Å; A100-A182 HydrophobicContact CB-CB 4.4Å; A100-N184 HydrophobicContact CB-CB 3.74Å; A100-N184 WeakPolarHBondContact O-CB 3.37Å; A100-N184 PolarHBondContact O-ND2 3.15Å; A100-Y201 HydrophobicContact CB-CD1 4.33Å; A100-V203 HydrophobicContact CB-CB 4.4Å; A100-V203 HydrophobicContact CB-CG2 3.76Å
101	E	89.9	Confident	84.9	Confident	85 Å²	85	53.5 Å²	53.5	40%	0.397	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.7	175.6	-75.2	-169.5	163.5	0	0	113.8	K54 E97 W99 C103 N184	K54-E101 WeakPolarHBondContact CE-OE1 3.49Å; K54-E101 IonicContact NZ-OE1 3.04Å; K54-E101 PolarHBondContact NZ-OE1 3.03Å; E97-E101 WeakPolarHBondContact O-CG 3.18Å; E97-E101 PolarHBondContact O-N 3.03Å; W99-E101 PolarHBondContact O-N 2.86Å; E101-C103 PolarHBondContact O-N 3.36Å; E101-N184 WeakPolarHBondContact CA-ND2 3.2Å
102	T	88.2	Confident	84.3	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.35	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21	-179.8	71.6	0	0	0	0	112.7	E98 W99 A100 L104	E98-T102 WeakPolarHBondContact O-CG2 3.48Å; W99-T102 HydrophobicContact CE3-CG2 4.09Å; W99-T102 HydrophobicContact CZ3-CG2 4.36Å; W99-T102 WeakPolarHBondContact O-CB 3.25Å; W99-T102 PolarHBondContact O-N 3.2Å; W99-T102 VanDerWaalsContact O-N 3.09Å; W99-T102 PolarHBondContact O-OG1 3.44Å; A100-T102 PolarHBondContact O-N 3.02Å; T102-L104 PolarHBondContact O-N 2.04Å; T102-L104 VanDerWaalsContact O-N 3.15Å; T102-L104 PolarHBondContact OG1-N 3.17Å
103	C	89.4	Confident	83.5	Confident	29 Å²	29	51.7 Å²	51.7	20%	0.196	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	32.8	-175	-68.9	0	0	0	0	113.5	A100 E101 N184 C186 M189	A100-C103 PolarHBondContact O-N 2.96Å; E101-C103 PolarHBondContact O-N 3.36Å; C103-N184 PolarHBondContact SG-ND2 2.96Å; C103-C186 WeakPolarHBondContact CA-SG 3.02Å; C103-C186 HydrophobicContact CB-CB 3.61Å; C103-C186 WeakPolarHBondContact CB-SG 2.96Å; C103-C186 WeakPolarHBondContact SG-CA 3.47Å; C103-C186 WeakPolarHBondContact SG-CB 3Å; C103-C186 CovalentContact SG-SG 2.03Å; C103-C186 PolarHBondContact SG-SG 3.42Å; C103-M189 WeakPolarHBondContact O-CG 3.42Å
104	L	88	Confident	82.6	Confident	89 Å²	89	53.6 Å²	53.6	47%	0.466	30%	0.296	S	S	.	.			trans	-100.4	122.1	174.4	-60.6	177.3	0	0	0	109.1	T102 E106 Y201	T102-L104 PolarHBondContact O-N 2.04Å; T102-L104 VanDerWaalsContact O-N 3.15Å; T102-L104 PolarHBondContact OG1-N 3.17Å; L104-E106 PolarHBondContact O-N 3.21Å; L104-Y201 WeakPolarHBondContact O-CE1 3.27Å; L104-Y201 PolarHBondContact O-OH 3.05Å
105	W	90.8	Very high	82.1	Confident	49 Å²	49	55.4 Å²	55.4	19%	0.186	31%	0.309	C	S	.	.	S	Bend	trans	-76.8	64.5	176.5	-174.4	-118.4	0	0	0	111.2	L120 V122 M189 N190 V191 W192 Y201	W105-L120 HydrophobicContact CH2-CB 3.89Å; W105-L120 HydrophobicContact CZ3-CB 3.75Å; W105-V122 HydrophobicContact CD2-CG1 3.9Å; W105-V122 HydrophobicContact CE3-CB 3.74Å; W105-V122 HydrophobicContact CE3-CG1 3.59Å; W105-V122 HydrophobicContact CH2-CB 3.97Å; W105-V122 HydrophobicContact CH2-CG1 3.47Å; W105-V122 VanDerWaalsContact CH2-CG1 3.47Å; W105-V122 HydrophobicContact CZ2-CG1 3.75Å; W105-V122 HydrophobicContact CZ3-CB 3.43Å; W105-V122 VanDerWaalsContact CZ3-CB 3.43Å; W105-V122 HydrophobicContact CZ3-CG1 3.38Å; W105-M189 HydrophobicContact CB-CE 3.75Å; W105-M189 HydrophobicContact CE3-CE 3.98Å; W105-N190 WeakPolarHBondContact CB-O 3.17Å; W105-V191 HydrophobicContact CB-CG2 4.28Å; W105-V191 HydrophobicContact CD2-CG1 4.28Å; W105-V191 HydrophobicContact CG-CB 4.4Å; W105-V191 HydrophobicContact CG-CG1 4.09Å; W105-V191 HydrophobicContact CG-CG2 4.22Å; W105-W192 AromaticContact CD1-NE1 3.93Å; W105-W192 HydrophobicContact CZ2-CH2 4.34Å; W105-W192 AromaticContact CZ2-CZ2 3.81Å; W105-W192 HydrophobicContact CZ2-CZ2 3.81Å; W105-W192 AromaticContact NE1-CD1 3.79Å; W105-W192 AromaticContact NE1-CD2 3.98Å; W105-W192 AromaticContact NE1-CE2 3.31Å; W105-W192 VanDerWaalsContact NE1-CE2 3.31Å; W105-W192 AromaticContact NE1-CZ2 3.63Å; W105-W192 AromaticContact NE1-NE1 3.19Å; W105-W192 VanDerWaalsContact NE1-NE1 3.19Å; W105-Y201 AromaticContact CE3-CD2 3.99Å; W105-Y201 HydrophobicContact CE3-CD2 3.99Å; W105-Y201 AromaticContact CE3-CE2 3.61Å; W105-Y201 HydrophobicContact CE3-CE2 3.61Å; W105-Y201 AromaticContact CZ3-CD2 3.93Å; W105-Y201 HydrophobicContact CZ3-CD2 3.93Å; W105-Y201 AromaticContact CZ3-CE2 3.63Å; W105-Y201 HydrophobicContact CZ3-CE2 3.63Å
106	E	83	Confident	82.3	Confident	71 Å²	71	55.2 Å²	55.2	33%	0.332	31%	0.308	S	S	.	.	S	Bend	trans	-153.6	151.5	-170.5	-81	-159.9	179.5	0	0	109.5	W99 L104 L120 Y201 T308 N311	W99-E106 VanDerWaalsContact CE2-O 3.26Å; W99-E106 HydrophobicContact CZ2-CB 4.46Å; W99-E106 VanDerWaalsContact CZ2-O 3.24Å; W99-E106 WeakPolarHBondContact CZ2-O 3.47Å; W99-E106 PolarHBondContact NE1-O 3.1Å; L104-E106 PolarHBondContact O-N 3.21Å; E106-L120 VanDerWaalsContact C-CD1 3.49Å; E106-L120 WeakPolarHBondContact O-CD1 3.42Å; E106-Y201 PolarHBondContact O-OH 2.52Å; E106-T308 HydrophobicContact CB-CG2 3.46Å; E106-T308 VanDerWaalsContact CB-CG2 3.46Å; E106-T308 HydrophobicContact CG-CG2 3.66Å; E106-T308 WeakPolarHBondContact OE2-CG2 3.39Å; E106-N311 PolarHBondContact OE1-ND2 3.18Å
107	H	85.3	Confident	82.1	Confident	70 Å²	70	55.3 Å²	55.3	32%	0.324	31%	0.309	S	S	.	.			trans	-74.6	142.5	174.1	-72.5	-72.4	0	0	0	111.5	W99 L113 Q118	W99-H107 VanDerWaalsContact CZ2-C 3.41Å; W99-H107 WeakPolarHBondContact CZ2-O 3.15Å; H107-L113 HydrophobicContact CB-CD1 3.76Å; H107-L113 HydrophobicContact CB-CD2 4.21Å; H107-Q118 PolarHBondContact CE1-O 2.9Å; H107-Q118 VanDerWaalsContact CE1-O 3.23Å; H107-Q118 PolarHBondContact ND1-OE1 3.04Å; H107-Q118 VanDerWaalsContact ND1-OE1 3.16Å
108	G	77.3	Confident	82.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.295	C	S	.	.			trans	173.6	-173.3	174.7	0	0	0	0	0	115	W99 Q118	W99-G108 VanDerWaalsContact CZ2-N 3.34Å; G108-Q118 PolarHBondContact O-NE2 2.84Å; G108-Q118 PolarHBondContact O-OE1 2.83Å
109	P	81.6	Confident	83	Confident	50 Å²	50	47.8 Å²	47.8	33%	0.325	27%	0.274	S	S	.	.			cis	-67.7	145	-5.2	28	-33.4	0	0	0	111.4	W99 G111 L112 L113	W99-P109 HydrophobicContact CE3-CB 4.15Å; W99-P109 HydrophobicContact CZ3-CB 4.14Å; P109-G111 PolarHBondContact O-N 2.98Å; P109-L112 HydrophobicContact CG-CB 3.99Å; P109-L112 HydrophobicContact CG-CD2 4.47Å; P109-L112 PolarHBondContact O-N 3.37Å; P109-L113 PolarHBondContact O-N 2.56Å
110	A	64.9	Low	83.3	Confident	76 Å²	76	46.6 Å²	46.6	63%	0.628	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.4	-172.2	0	0	0	0	0	114.4	L112 P114	A110-L112 VanDerWaalsContact C-N 3.3Å; A110-L112 PolarHBondContact O-N 3.14Å; A110-P114 WeakPolarHBondContact O-CD 3.29Å
111	G	60.3	Low	83.4	Confident	64 Å²	64	46.8 Å²	46.8	66%	0.66	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.1	175.9	0	0	0	0	0	114.7	P109	P109-G111 PolarHBondContact O-N 2.98Å
112	L	71.3	Confident	83.6	Confident	40 Å²	40	43.7 Å²	43.7	21%	0.209	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-32.9	-177.1	-161.3	64.4	0	0	0	112	T95 P109 A110 P114 Q115 I116	T95-L112 HydrophobicContact CG2-CD2 3.91Å; P109-L112 HydrophobicContact CG-CB 3.99Å; P109-L112 HydrophobicContact CG-CD2 4.47Å; P109-L112 PolarHBondContact O-N 3.37Å; A110-L112 VanDerWaalsContact C-N 3.3Å; A110-L112 PolarHBondContact O-N 3.14Å; L112-P114 VanDerWaalsContact C-N 3.29Å; L112-P114 WeakPolarHBondContact O-CD 3.42Å; L112-P114 VanDerWaalsContact O-N 3.09Å; L112-Q115 PolarHBondContact O-N 3.28Å; L112-I116 HydrophobicContact CB-CD1 4.33Å; L112-I116 HydrophobicContact CB-CG1 4.44Å; L112-I116 HydrophobicContact CD1-CG2 4.43Å; L112-I116 HydrophobicContact CD2-CD1 3.48Å; L112-I116 VanDerWaalsContact CD2-CD1 3.48Å; L112-I116 HydrophobicContact CD2-CG1 4.29Å; L112-I116 HydrophobicContact CG-CD1 3.6Å; L112-I116 HydrophobicContact CG-CG1 3.84Å; L112-I116 HydrophobicContact CG-CG2 4.16Å; L112-I116 WeakPolarHBondContact O-CG1 3.48Å; L112-I116 PolarHBondContact O-N 3.45Å; L112-I116 VanDerWaalsContact O-N 3.11Å
113	L	71.9	Confident	83.7	Confident	34 Å²	34	41.4 Å²	41.4	18%	0.178	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.5	-179	-61.9	-179.1	0	0	0	117.1	H107 P109 Q115 I116 Q118 K209	H107-L113 HydrophobicContact CB-CD1 3.76Å; H107-L113 HydrophobicContact CB-CD2 4.21Å; P109-L113 PolarHBondContact O-N 2.56Å; L113-Q115 VanDerWaalsContact C-N 3.29Å; L113-I116 VanDerWaalsContact O-O 3.12Å; L113-Q118 HydrophobicContact CD2-CB 4.1Å; L113-K209 PolarHBondContact O-NZ 2.82Å
114	P	72.6	Confident	83.6	Confident	86 Å²	86	46.7 Å²	46.7	56%	0.558	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.8	170.4	-23.9	35.9	0	0	0	113.6	A110 L112	A110-P114 WeakPolarHBondContact O-CD 3.29Å; L112-P114 VanDerWaalsContact C-N 3.29Å; L112-P114 WeakPolarHBondContact O-CD 3.42Å; L112-P114 VanDerWaalsContact O-N 3.09Å
115	Q	76.1	Confident	83.5	Confident	140 Å²	140	45.9 Å²	45.9	65%	0.654	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-27.9	-172.6	-63.1	176.6	68.6	0	0	112.7	L112 L113	L112-Q115 PolarHBondContact O-N 3.28Å; L113-Q115 VanDerWaalsContact C-N 3.29Å
116	I	87.2	Confident	83.2	Confident	9 Å²	9	54 Å²	54	5%	0.046	30%	0.303	C	S	.	.	S	Bend	trans	-117.8	153.2	-179.2	69.2	165.5	0	0	0	112.1	L92 L112 L113 N205 Y206 K209	L92-I116 HydrophobicContact CD2-CG2 3.92Å; L112-I116 HydrophobicContact CB-CD1 4.33Å; L112-I116 HydrophobicContact CB-CG1 4.44Å; L112-I116 HydrophobicContact CD1-CG2 4.43Å; L112-I116 HydrophobicContact CD2-CD1 3.48Å; L112-I116 VanDerWaalsContact CD2-CD1 3.48Å; L112-I116 HydrophobicContact CD2-CG1 4.29Å; L112-I116 HydrophobicContact CG-CD1 3.6Å; L112-I116 HydrophobicContact CG-CG1 3.84Å; L112-I116 HydrophobicContact CG-CG2 4.16Å; L112-I116 WeakPolarHBondContact O-CG1 3.48Å; L112-I116 PolarHBondContact O-N 3.45Å; L112-I116 VanDerWaalsContact O-N 3.11Å; L113-I116 VanDerWaalsContact O-O 3.12Å; I116-N205 HydrophobicContact CD1-CB 3.76Å; I116-N205 WeakPolarHBondContact CD1-OD1 3.46Å; I116-Y206 CarbonylContact C-O 3.45Å; I116-Y206 VanDerWaalsContact CA-O 3.31Å; I116-Y206 WeakPolarHBondContact CA-O 3.42Å; I116-Y206 WeakPolarHBondContact CB-O 3.33Å; I116-K209 WeakPolarHBondContact O-CD 3.39Å
117	G	88.7	Confident	83.1	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	157.2	159.6	0	0	0	0	0	110.6	Q170 N205 Y206	G117-Q170 VanDerWaalsContact CA-OE1 3.27Å; G117-N205 CarbonylContact O-C 3.52Å; G117-N205 WeakPolarHBondContact O-CA 3.46Å; G117-Y206 PolarHBondContact N-O 2.82Å; G117-Y206 PolarHBondContact O-N 2.95Å
118	Q	95.4	Very high	83	Confident	15 Å²	15	60.5 Å²	60.5	7%	0.07	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	130.3	174.4	-176.1	175	80.9	0	0	111.8	H107 G108 L113 L120 V203 C204 N205	H107-Q118 PolarHBondContact CE1-O 2.9Å; H107-Q118 VanDerWaalsContact CE1-O 3.23Å; H107-Q118 PolarHBondContact ND1-OE1 3.04Å; H107-Q118 VanDerWaalsContact ND1-OE1 3.16Å; G108-Q118 PolarHBondContact O-NE2 2.84Å; G108-Q118 PolarHBondContact O-OE1 2.83Å; L113-Q118 HydrophobicContact CD2-CB 4.1Å; Q118-L120 HydrophobicContact CG-CD2 3.85Å; Q118-L120 HydrophobicContact CG-CG 4.44Å; Q118-V203 HydrophobicContact CG-CG1 4.12Å; Q118-C204 CarbonylContact C-O 3.56Å; Q118-C204 VanDerWaalsContact CA-O 3.24Å; Q118-C204 WeakPolarHBondContact CA-O 3.43Å; Q118-N205 WeakPolarHBondContact CG-OD1 3.41Å; Q118-N205 PolarHBondContact NE2-OD1 3.19Å
119	N	98.1	Very high	83.4	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	141	168	-73.9	-6	0	0	0	109.8	W137 H167 C204 Y206	N119-W137 HydrophobicContact CB-CD2 3.83Å; N119-W137 HydrophobicContact CB-CE3 3.85Å; N119-W137 HydrophobicContact CB-CH2 3.67Å; N119-W137 HydrophobicContact CB-CZ2 3.63Å; N119-W137 HydrophobicContact CB-CZ3 3.78Å; N119-H167 PolarHBondContact ND2-O 2.89Å; N119-C204 PolarHBondContact N-O 3.4Å; N119-C204 PolarHBondContact O-N 3.02Å; N119-Y206 HydrophobicContact CB-CE2 3.86Å; N119-Y206 PolarHBondContact ND2-OH 3.02Å
120	L	96.7	Very high	83.6	Confident	9 Å²	9	60.5 Å²	60.5	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	140.1	-179.1	-59	-177.2	0	0	0	109.9	W105 E106 Q118 W137 Y201 L202 V203	W105-L120 HydrophobicContact CH2-CB 3.89Å; W105-L120 HydrophobicContact CZ3-CB 3.75Å; E106-L120 VanDerWaalsContact C-CD1 3.49Å; E106-L120 WeakPolarHBondContact O-CD1 3.42Å; Q118-L120 HydrophobicContact CG-CD2 3.85Å; Q118-L120 HydrophobicContact CG-CG 4.44Å; L120-W137 VanDerWaalsContact C-CZ2 3.47Å; L120-W137 PolarHBondContact O-NE1 3.15Å; L120-Y201 HydrophobicContact CB-CE2 4.17Å; L120-Y201 HydrophobicContact CD1-CE2 4.46Å; L120-Y201 WeakPolarHBondContact CD1-OH 3.48Å; L120-Y201 HydrophobicContact CD2-CE2 3.99Å; L120-Y201 WeakPolarHBondContact CD2-OH 3.42Å; L120-Y201 HydrophobicContact CG-CE2 4.43Å; L120-L202 WeakPolarHBondContact CA-O 3.49Å; L120-V203 HydrophobicContact CD2-CB 4.2Å; L120-V203 HydrophobicContact CD2-CG1 3.91Å; L120-V203 HydrophobicContact CD2-CG2 3.88Å
121	G	95	Very high	84.8	Confident	4 Å²	4	58.2 Å²	58.2	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.9	177.9	0	0	0	0	0	109.2	Y201 L202	G121-Y201 WeakPolarHBondContact O-CD2 3.43Å; G121-L202 PolarHBondContact N-O 2.83Å; G121-L202 PolarHBondContact O-N 2.98Å
122	V	93.8	Very high	86.2	Confident	21 Å²	21	56.9 Å²	56.9	13%	0.127	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.8	174.9	67.8	0	0	0	0	110	W105 M189 V191 W196 A199 V200	W105-V122 HydrophobicContact CD2-CG1 3.9Å; W105-V122 HydrophobicContact CE3-CB 3.74Å; W105-V122 HydrophobicContact CE3-CG1 3.59Å; W105-V122 HydrophobicContact CH2-CB 3.97Å; W105-V122 HydrophobicContact CH2-CG1 3.47Å; W105-V122 VanDerWaalsContact CH2-CG1 3.47Å; W105-V122 HydrophobicContact CZ2-CG1 3.75Å; W105-V122 HydrophobicContact CZ3-CB 3.43Å; W105-V122 VanDerWaalsContact CZ3-CB 3.43Å; W105-V122 HydrophobicContact CZ3-CG1 3.38Å; V122-M189 HydrophobicContact CG2-SD 4.1Å; V122-V191 HydrophobicContact CG1-CG1 3.87Å; V122-V191 HydrophobicContact CG1-CG2 4.13Å; V122-V191 HydrophobicContact CG2-CG2 4.11Å; V122-W196 HydrophobicContact CG1-CE3 4.4Å; V122-W196 HydrophobicContact CG1-CH2 4.46Å; V122-W196 HydrophobicContact CG1-CZ3 3.85Å; V122-W196 HydrophobicContact CG2-CE3 4.08Å; V122-W196 HydrophobicContact CG2-CZ3 4.19Å; V122-A199 HydrophobicContact CG2-CB 3.95Å; V122-V200 WeakPolarHBondContact CA-O 3.47Å
123	H	90.8	Very high	87.3	Confident	9 Å²	9	55.6 Å²	55.6	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.9	166.7	70.5	-77.8	0	0	0	110	R126 R128 H133 A199 V200	H123-R126 PolarHBondContact CD2-O 3.28Å; H123-R128 PolarHBondContact NE2-N 2.91Å; H123-H133 AromaticContact CE1-CE1 3.5Å; H123-H133 PolarHBondContact CE1-CE1 2.67Å; H123-H133 VanDerWaalsContact CE1-CE1 3.5Å; H123-H133 AromaticContact CE1-NE2 3.9Å; H123-H133 AromaticContact CG-NE2 3.88Å; H123-H133 AromaticContact ND1-CE1 3.04Å; H123-H133 PolarHBondContact ND1-CE1 3.2Å; H123-H133 AromaticContact ND1-NE2 2.99Å; H123-H133 PolarHBondContact ND1-NE2 3.13Å; H123-A199 CarbonylContact O-C 3.57Å; H123-A199 WeakPolarHBondContact O-CA 3.41Å; H123-V200 WeakPolarHBondContact CE1-CB 3.42Å; H123-V200 PolarHBondContact N-O 2.81Å; H123-V200 VanDerWaalsContact N-O 3.1Å; H123-V200 PolarHBondContact O-N 2.85Å
124	W	88	Confident	88.4	Confident	140 Å²	140	54 Å²	54	53%	0.53	27%	0.266	S	S	.	.			trans	-142.1	160.1	175.6	70.3	-51.3	0	0	0	108.8	W196	W124-W196 HydrophobicContact CB-CB 4.26Å; W124-W196 HydrophobicContact CB-CD2 4.31Å; W124-W196 HydrophobicContact CB-CE3 3.84Å; W124-W196 AromaticContact CD1-CD2 3.54Å; W124-W196 AromaticContact CD1-CE2 3.93Å; W124-W196 AromaticContact CD1-CE3 3.29Å; W124-W196 AromaticContact CD1-CH2 3.89Å; W124-W196 AromaticContact CD1-CZ3 3.48Å; W124-W196 VanDerWaalsContact CD1-CZ3 3.48Å; W124-W196 HydrophobicContact CD2-CB 4.29Å; W124-W196 HydrophobicContact CD2-CD2 4.17Å; W124-W196 HydrophobicContact CD2-CE3 4.48Å; W124-W196 HydrophobicContact CD2-CG 4.1Å; W124-W196 HydrophobicContact CE3-CB 4.4Å; W124-W196 HydrophobicContact CG-CB 4.24Å; W124-W196 AromaticContact CG-CD2 3.78Å; W124-W196 HydrophobicContact CG-CD2 3.78Å; W124-W196 AromaticContact CG-CE3 3.63Å; W124-W196 HydrophobicContact CG-CE3 3.63Å; W124-W196 HydrophobicContact CG-CG 4.07Å; W124-W196 HydrophobicContact CG-CZ3 4.24Å; W124-W196 AromaticContact NE1-CD2 3.84Å; W124-W196 AromaticContact NE1-CE2 3.8Å; W124-W196 AromaticContact NE1-CZ2 3.95Å
125	G	85.9	Confident	89.4	Confident	71 Å²	71	52.4 Å²	52.4	73%	0.732	25%	0.251	S	S	*	.	S	Bend	trans	85	-120.5	-176.8	0	0	0	0	0	112.8
126	R	82.7	Confident	90.2	Very high	220 Å²	220	48.4 Å²	48.4	83%	0.83	24%	0.242	S	C	*	.	S	Bend	trans	-62.2	141.5	-173.6	-66.2	-173.9	-176.6	-172.6	0.4	111.2	H123 R128	H123-R126 PolarHBondContact CD2-O 3.28Å; R126-R128 PolarHBondContact O-N 2.82Å
127	Y	81.8	Confident	90.7	Very high	137 Å²	137	48.5 Å²	48.5	54%	0.537	24%	0.242	S	C	.	.			trans	-54.9	133.5	172.9	179	-87.1	0	0	0	110.8	R55	R55-Y127 VanDerWaalsContact CZ-CE2 3.45Å; R55-Y127 VanDerWaalsContact NH1-CE2 3.29Å; R55-Y127 PolarHBondContact NH2-OH 3.41Å
128	R	84.1	Confident	91.1	Very high	140 Å²	140	49.8 Å²	49.8	53%	0.528	25%	0.247	S	C	.	.			trans	-131.7	141	167	-57.2	-176.2	179.3	178.8	-1.1	109.7	H123 R126 S132	H123-R128 PolarHBondContact NE2-N 2.91Å; R126-R128 PolarHBondContact O-N 2.82Å; R128-S132 WeakPolarHBondContact CB-OG 3.31Å
129	P	84.8	Confident	91.1	Very high	48 Å²	48	52.4 Å²	52.4	31%	0.312	26%	0.261	S	S	.	.			trans	-66.5	154.8	174.9	29.6	-35	0	0	0	110.3	T131 S132	P129-T131 PolarHBondContact O-N 3.5Å; P129-S132 VanDerWaalsContact O-CB 3.3Å; P129-S132 WeakPolarHBondContact O-CB 3.22Å; P129-S132 PolarHBondContact O-N 3.08Å; P129-S132 PolarHBondContact O-OG 3.2Å
130	P	85.4	Confident	91.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.013	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.7	-179.7	-26.5	37.6	0	0	0	112.8	D61 I65 S132 H133 I183	D61-P130 HydrophobicContact CB-CG 4.07Å; I65-P130 HydrophobicContact CD1-CB 3.74Å; I65-P130 HydrophobicContact CG1-CB 4.05Å; P130-S132 PolarHBondContact O-N 3.46Å; P130-S132 VanDerWaalsContact O-N 3.13Å; P130-H133 PolarHBondContact O-N 3.05Å; P130-H133 PolarHBondContact O-ND1 3.09Å; P130-I183 HydrophobicContact CB-CD1 3.72Å; P130-I183 HydrophobicContact CG-CD1 3.38Å
131	T	89.4	Confident	91.1	Very high	28 Å²	28	55 Å²	55	17%	0.172	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-25.6	175.5	51	0	0	0	0	114	L64 L68 P129 H133 V134 Q135	L64-T131 HydrophobicContact CB-CG2 3.89Å; L68-T131 HydrophobicContact CD2-CG2 3.94Å; P129-T131 PolarHBondContact O-N 3.5Å; T131-H133 VanDerWaalsContact C-N 3.29Å; T131-H133 PolarHBondContact O-N 3.25Å; T131-V134 WeakPolarHBondContact O-CB 3.01Å; T131-V134 PolarHBondContact O-N 2.76Å; T131-Q135 PolarHBondContact O-N 3.3Å
132	S	90.2	Very high	91.1	Very high	36 Å²	36	62.6 Å²	62.6	25%	0.252	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-32.7	175.7	67.6	0	0	0	0	113.2	R128 P129 P130 A136	R128-S132 WeakPolarHBondContact CB-OG 3.31Å; P129-S132 VanDerWaalsContact O-CB 3.3Å; P129-S132 WeakPolarHBondContact O-CB 3.22Å; P129-S132 PolarHBondContact O-N 3.08Å; P129-S132 PolarHBondContact O-OG 3.2Å; P130-S132 PolarHBondContact O-N 3.46Å; P130-S132 VanDerWaalsContact O-N 3.13Å; S132-A136 WeakPolarHBondContact O-CB 2.98Å; S132-A136 PolarHBondContact O-N 3.25Å
133	H	94.2	Very high	91.1	Very high	13 Å²	13	63.5 Å²	63.5	6%	0.06	31%	0.312	C	S	.	.	H	α-helix	trans	-74.4	-38.1	175.4	-57	89.2	0	0	0	111	H123 P130 T131 Q135 A136 W137 L202	H123-H133 AromaticContact CE1-CE1 3.5Å; H123-H133 PolarHBondContact CE1-CE1 2.67Å; H123-H133 VanDerWaalsContact CE1-CE1 3.5Å; H123-H133 AromaticContact CE1-NE2 3.9Å; H123-H133 AromaticContact CG-NE2 3.88Å; H123-H133 AromaticContact ND1-CE1 3.04Å; H123-H133 PolarHBondContact ND1-CE1 3.2Å; H123-H133 AromaticContact ND1-NE2 2.99Å; H123-H133 PolarHBondContact ND1-NE2 3.13Å; P130-H133 PolarHBondContact O-N 3.05Å; P130-H133 PolarHBondContact O-ND1 3.09Å; T131-H133 VanDerWaalsContact C-N 3.29Å; T131-H133 PolarHBondContact O-N 3.25Å; H133-Q135 VanDerWaalsContact C-N 3.31Å; H133-Q135 PolarHBondContact O-N 3.15Å; H133-A136 PolarHBondContact O-N 3.17Å; H133-W137 HydrophobicContact CB-CZ2 4.28Å; H133-W137 PolarHBondContact O-N 2.87Å; H133-L202 HydrophobicContact CB-CD2 3.61Å
134	V	94.9	Very high	91.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.1	-44.8	175.1	-177.6	0	0	0	0	110.2	I65 L68 H69 L72 T131 W137 Y138 L171	I65-V134 HydrophobicContact CG1-CG2 4.35Å; I65-V134 HydrophobicContact CG2-CG2 4.15Å; L68-V134 HydrophobicContact CB-CG1 4.48Å; L68-V134 HydrophobicContact CD2-CB 3.74Å; L68-V134 HydrophobicContact CD2-CG1 3.75Å; L68-V134 HydrophobicContact CG-CB 4.36Å; L68-V134 HydrophobicContact CG-CG1 3.8Å; H69-V134 VanDerWaalsContact CE1-CG1 3.43Å; H69-V134 WeakPolarHBondContact CE1-CG1 3.12Å; L72-V134 HydrophobicContact CD1-CG1 4.18Å; T131-V134 WeakPolarHBondContact O-CB 3.01Å; T131-V134 PolarHBondContact O-N 2.76Å; V134-W137 HydrophobicContact CG2-CE3 4.4Å; V134-W137 HydrophobicContact CG2-CZ3 4.19Å; V134-W137 PolarHBondContact O-N 2.92Å; V134-Y138 PolarHBondContact O-N 2.97Å; V134-L171 HydrophobicContact CG1-CD1 3.82Å
135	Q	94.5	Very high	91.6	Very high	53 Å²	53	60.4 Å²	60.4	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-44.8	174.1	-170.7	60.7	55.2	0	0	111.5	T131 H133 W137 Y138 D139	T131-Q135 PolarHBondContact O-N 3.3Å; H133-Q135 VanDerWaalsContact C-N 3.31Å; H133-Q135 PolarHBondContact O-N 3.15Å; Q135-W137 VanDerWaalsContact C-N 3.3Å; Q135-W137 PolarHBondContact O-N 3.45Å; Q135-Y138 CarbonylContact O-C 3.4Å; Q135-Y138 WeakPolarHBondContact O-CA 3.39Å; Q135-Y138 WeakPolarHBondContact O-CB 3.33Å; Q135-Y138 PolarHBondContact O-N 3.35Å; Q135-D139 PolarHBondContact NE2-OD1 2.86Å; Q135-D139 PolarHBondContact O-N 3.35Å
136	A	91.9	Very high	92	Very high	56 Å²	56	57.9 Å²	57.9	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-36.3	177.7	0	0	0	0	0	113	S132 H133	S132-A136 WeakPolarHBondContact O-CB 2.98Å; S132-A136 PolarHBondContact O-N 3.25Å; H133-A136 PolarHBondContact O-N 3.17Å
137	W	98.1	Very high	92.4	Very high	11 Å²	11	47.6 Å²	47.6	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-40.3	171.7	-63.2	-28.1	0	0	0	111.6	N119 L120 H133 V134 Q135 E140 H167 Y168 L171 L202 C204	N119-W137 HydrophobicContact CB-CD2 3.83Å; N119-W137 HydrophobicContact CB-CE3 3.85Å; N119-W137 HydrophobicContact CB-CH2 3.67Å; N119-W137 HydrophobicContact CB-CZ2 3.63Å; N119-W137 HydrophobicContact CB-CZ3 3.78Å; L120-W137 VanDerWaalsContact C-CZ2 3.47Å; L120-W137 PolarHBondContact O-NE1 3.15Å; H133-W137 HydrophobicContact CB-CZ2 4.28Å; H133-W137 PolarHBondContact O-N 2.87Å; V134-W137 HydrophobicContact CG2-CE3 4.4Å; V134-W137 HydrophobicContact CG2-CZ3 4.19Å; V134-W137 PolarHBondContact O-N 2.92Å; Q135-W137 VanDerWaalsContact C-N 3.3Å; Q135-W137 PolarHBondContact O-N 3.45Å; W137-E140 WeakPolarHBondContact O-CG 3.46Å; W137-H167 HydrophobicContact CB-CB 3.63Å; W137-H167 AromaticContact CD1-CG 3.65Å; W137-H167 HydrophobicContact CD2-CB 4.49Å; W137-H167 HydrophobicContact CG-CB 3.61Å; W137-Y168 WeakPolarHBondContact O-CA 2.99Å; W137-Y168 VanDerWaalsContact O-CB 3.31Å; W137-Y168 WeakPolarHBondContact O-CB 3.17Å; W137-Y168 PolarHBondContact O-N 2.83Å; W137-L171 HydrophobicContact CB-CD1 4.4Å; W137-L202 HydrophobicContact CH2-CD2 3.68Å; W137-L202 HydrophobicContact CH2-CG 4.2Å; W137-L202 HydrophobicContact CZ2-CD2 4.15Å; W137-L202 HydrophobicContact CZ3-CD2 4.43Å; W137-C204 HydrophobicContact CH2-CB 3.81Å; W137-C204 HydrophobicContact CZ3-CB 3.97Å
138	Y	97.6	Very high	92.8	Very high	30 Å²	30	44.5 Å²	44.5	12%	0.118	23%	0.228	C	C	.	.	H	α-helix	trans	-67.1	-38.2	177.3	-174	-95	0	0	0	112.6	L72 V134 Q135 E140 V141 Y168 L171 V172	L72-Y138 HydrophobicContact CB-CD2 3.7Å; L72-Y138 HydrophobicContact CB-CE2 3.73Å; L72-Y138 HydrophobicContact CB-CG 4.39Å; L72-Y138 HydrophobicContact CD1-CD2 3.88Å; L72-Y138 HydrophobicContact CD1-CG 3.83Å; L72-Y138 HydrophobicContact CD2-CD1 3.8Å; L72-Y138 HydrophobicContact CD2-CD2 3.9Å; L72-Y138 HydrophobicContact CD2-CE1 3.88Å; L72-Y138 HydrophobicContact CD2-CE2 3.98Å; L72-Y138 HydrophobicContact CD2-CG 3.8Å; L72-Y138 HydrophobicContact CG-CD2 4.03Å; L72-Y138 HydrophobicContact CG-CE2 4.31Å; L72-Y138 HydrophobicContact CG-CG 4.22Å; V134-Y138 PolarHBondContact O-N 2.97Å; Q135-Y138 CarbonylContact O-C 3.4Å; Q135-Y138 WeakPolarHBondContact O-CA 3.39Å; Q135-Y138 WeakPolarHBondContact O-CB 3.33Å; Q135-Y138 PolarHBondContact O-N 3.35Å; Y138-E140 PolarHBondContact O-N 2.98Å; Y138-V141 HydrophobicContact CD1-CG1 4.31Å; Y138-V141 HydrophobicContact CE1-CG1 4.1Å; Y138-V141 VanDerWaalsContact O-CB 3.28Å; Y138-V141 WeakPolarHBondContact O-CB 3.1Å; Y138-V141 VanDerWaalsContact O-CG1 3.24Å; Y138-V141 WeakPolarHBondContact O-CG1 3.47Å; Y138-V141 PolarHBondContact O-N 2.94Å; Y138-Y168 HydrophobicContact CD2-CD2 4Å; Y138-Y168 AromaticContact CD2-CE2 3.99Å; Y138-Y168 HydrophobicContact CD2-CE2 3.99Å; Y138-Y168 HydrophobicContact CE2-CD2 4.32Å; Y138-Y168 AromaticContact CE2-CE2 3.82Å; Y138-Y168 HydrophobicContact CE2-CE2 3.82Å; Y138-Y168 WeakPolarHBondContact O-CD2 3.38Å; Y138-L171 HydrophobicContact CD2-CD2 4.03Å; Y138-V172 HydrophobicContact CD2-CG1 4.42Å; Y138-V172 HydrophobicContact CE2-CG1 4.21Å
139	D	96	Very high	92.9	Very high	70 Å²	70	42 Å²	42	37%	0.374	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-62.2	-13.6	-177.8	-68.6	-15.6	0	0	0	113.3	Q135 V141 K142	Q135-D139 PolarHBondContact NE2-OD1 2.86Å; Q135-D139 PolarHBondContact O-N 3.35Å; D139-V141 PolarHBondContact O-N 2.83Å; D139-K142 VanDerWaalsContact O-CD 3.28Å; D139-K142 WeakPolarHBondContact O-CD 3.11Å; D139-K142 WeakPolarHBondContact O-CG 3.39Å; D139-K142 PolarHBondContact O-N 3.04Å
140	E	96.6	Very high	93.1	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.103	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-62.6	-15.4	168.7	-52.1	179.9	158.4	0	0	112.6	W137 Y138 K142 D143 Y144 V164 C165 T166 H167 Y168	W137-E140 WeakPolarHBondContact O-CG 3.46Å; Y138-E140 PolarHBondContact O-N 2.98Å; E140-K142 PolarHBondContact O-N 2.97Å; E140-K142 VanDerWaalsContact O-N 3.13Å; E140-D143 PolarHBondContact O-N 3.24Å; E140-Y144 PolarHBondContact O-N 3.31Å; E140-V164 WeakPolarHBondContact CG-O 3.27Å; E140-V164 WeakPolarHBondContact OE1-CG1 3.46Å; E140-C165 WeakPolarHBondContact OE2-CA 3.18Å; E140-T166 PolarHBondContact OE2-N 3.24Å; E140-H167 IonicContact OE1-CE1 2.68Å; E140-H167 IonicContact OE1-CG 3.72Å; E140-H167 IonicContact OE1-ND1 3.35Å; E140-H167 PolarHBondContact OE1-ND1 3.45Å; E140-H167 WeakPolarHBondContact OE2-CA 3.39Å; E140-H167 WeakPolarHBondContact OE2-CB 3.4Å; E140-H167 IonicContact OE2-CG 3.26Å; E140-H167 PolarHBondContact OE2-N 3.29Å; E140-H167 IonicContact OE2-ND1 3.56Å; E140-Y168 PolarHBondContact OE2-N 2.81Å
141	V	96.8	Very high	93.2	Very high	45 Å²	45	50 Å²	50	27%	0.273	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-52.7	-32.2	172.9	68.9	0	0	0	0	112.7	Y138 D139 D143 Y144 Y168	Y138-V141 HydrophobicContact CD1-CG1 4.31Å; Y138-V141 HydrophobicContact CE1-CG1 4.1Å; Y138-V141 VanDerWaalsContact O-CB 3.28Å; Y138-V141 WeakPolarHBondContact O-CB 3.1Å; Y138-V141 VanDerWaalsContact O-CG1 3.24Å; Y138-V141 WeakPolarHBondContact O-CG1 3.47Å; Y138-V141 PolarHBondContact O-N 2.94Å; D139-V141 PolarHBondContact O-N 2.83Å; V141-D143 PolarHBondContact O-N 3.02Å; V141-Y144 PolarHBondContact O-N 3.5Å; V141-Y168 HydrophobicContact CB-CD2 3.72Å; V141-Y168 HydrophobicContact CB-CE1 4.38Å; V141-Y168 HydrophobicContact CB-CE2 3.51Å; V141-Y168 HydrophobicContact CB-CG 4.24Å; V141-Y168 HydrophobicContact CG2-CD2 4.3Å; V141-Y168 HydrophobicContact CG2-CE1 4.15Å; V141-Y168 HydrophobicContact CG2-CE2 3.6Å
142	K	95.9	Very high	92.9	Very high	163 Å²	163	50.5 Å²	50.5	71%	0.709	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-62.1	-24.9	177.8	76	-165.6	173.4	-176.6	0	113.1	D139 E140	D139-K142 VanDerWaalsContact O-CD 3.28Å; D139-K142 WeakPolarHBondContact O-CD 3.11Å; D139-K142 WeakPolarHBondContact O-CG 3.39Å; D139-K142 PolarHBondContact O-N 3.04Å; E140-K142 PolarHBondContact O-N 2.97Å; E140-K142 VanDerWaalsContact O-N 3.13Å
143	D	92.8	Very high	92.1	Very high	40 Å²	40	55.7 Å²	55.7	21%	0.214	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-105.9	-6.2	-177	-72.9	-51.5	0	0	0	111.9	E140 V141 C160 S161 C165	E140-D143 PolarHBondContact O-N 3.24Å; V141-D143 PolarHBondContact O-N 3.02Å; D143-C160 CarbonylContact O-C 3.58Å; D143-C160 VanDerWaalsContact O-CA 3.3Å; D143-C160 WeakPolarHBondContact O-CA 3.29Å; D143-S161 WeakPolarHBondContact CA-OG 3.32Å; D143-S161 PolarHBondContact O-N 3.09Å; D143-S161 PolarHBondContact O-OG 3.07Å; D143-S161 VanDerWaalsContact O-OG 3.11Å; D143-S161 PolarHBondContact OD1-OG 2.91Å; D143-C165 PolarHBondContact O-SG 3.26Å
144	Y	94.6	Very high	91.2	Very high	21 Å²	21	60 Å²	60	8%	0.082	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.5	-178.5	178.8	-102.2	0	0	0	111.1	E140 V141 F146 P147 F158 K159 C165 Y168 T169 P217	E140-Y144 PolarHBondContact O-N 3.31Å; V141-Y144 PolarHBondContact O-N 3.5Å; Y144-F146 HydrophobicContact CE1-CB 4.19Å; Y144-F146 HydrophobicContact CE1-CD2 4.43Å; Y144-P147 WeakPolarHBondContact OH-CD 3.1Å; Y144-F158 HydrophobicContact CD2-CE2 4.46Å; Y144-F158 HydrophobicContact CE2-CD2 4.38Å; Y144-F158 HydrophobicContact CE2-CE2 4.16Å; Y144-K159 WeakPolarHBondContact CD2-O 3.46Å; Y144-C165 HydrophobicContact CD2-CB 4.08Å; Y144-Y168 AromaticContact CD1-CD1 3.86Å; Y144-Y168 HydrophobicContact CD1-CD1 3.86Å; Y144-Y168 AromaticContact CD1-CE1 3.37Å; Y144-Y168 HydrophobicContact CD1-CE1 3.37Å; Y144-Y168 HydrophobicContact CE1-CD1 4.45Å; Y144-Y168 AromaticContact CE1-CE1 3.83Å; Y144-Y168 HydrophobicContact CE1-CE1 3.83Å; Y144-Y168 AromaticContact CG-CD1 3.91Å; Y144-Y168 HydrophobicContact CG-CD1 3.91Å; Y144-Y168 AromaticContact CG-CE1 3.92Å; Y144-Y168 HydrophobicContact CG-CE1 3.92Å; Y144-T169 HydrophobicContact CD2-CG2 3.79Å; Y144-T169 HydrophobicContact CE1-CG2 4.33Å; Y144-T169 HydrophobicContact CE2-CG2 3.4Å; Y144-T169 VanDerWaalsContact CE2-CG2 3.4Å; Y144-T169 HydrophobicContact CG-CG2 4.4Å; Y144-P217 HydrophobicContact CE1-CG 4.43Å; Y144-P217 WeakPolarHBondContact OH-CD 3.45Å
145	S	94.9	Very high	90.4	Very high	63 Å²	63	67.2 Å²	67.2	44%	0.441	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	121.9	170.9	-57.7	0	0	0	0	110.4	K159	S145-K159 PolarHBondContact N-O 3.12Å
146	F	95.1	Very high	89.8	Confident	18 Å²	18	65.6 Å²	65.6	8%	0.079	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-65.5	128.3	-179.5	-175.6	-90.5	0	0	0	111.5	P78 Y144 Y148 P217 Y218 H220	P78-F146 VanDerWaalsContact CD-CB 3.5Å; P78-F146 HydrophobicContact CG-CB 3.92Å; P78-F146 HydrophobicContact CG-CD1 3.43Å; P78-F146 VanDerWaalsContact CG-CD1 3.43Å; P78-F146 HydrophobicContact CG-CD2 4.1Å; P78-F146 HydrophobicContact CG-CE1 3.91Å; P78-F146 HydrophobicContact CG-CG 3.53Å; P78-F146 HydrophobicContact CG-CZ 4.44Å; Y144-F146 HydrophobicContact CE1-CB 4.19Å; Y144-F146 HydrophobicContact CE1-CD2 4.43Å; F146-Y148 HydrophobicContact CD1-CD1 4.41Å; F146-Y148 HydrophobicContact CD1-CG 4.42Å; F146-Y148 PolarHBondContact O-N 2.95Å; F146-P217 HydrophobicContact CD2-CG 4.28Å; F146-P217 HydrophobicContact CE2-CG 4.17Å; F146-Y218 HydrophobicContact CD2-CD2 4.42Å; F146-Y218 HydrophobicContact CD2-CE1 4.16Å; F146-Y218 AromaticContact CD2-CE2 3.7Å; F146-Y218 HydrophobicContact CD2-CE2 3.7Å; F146-Y218 AromaticContact CD2-CZ 3.55Å; F146-Y218 HydrophobicContact CE2-CD1 4.26Å; F146-Y218 AromaticContact CE2-CD2 3.5Å; F146-Y218 HydrophobicContact CE2-CD2 3.5Å; F146-Y218 HydrophobicContact CE2-CE1 4.01Å; F146-Y218 AromaticContact CE2-CE2 3.18Å; F146-Y218 HydrophobicContact CE2-CE2 3.18Å; F146-Y218 HydrophobicContact CE2-CG 4.04Å; F146-Y218 AromaticContact CE2-CZ 3.46Å; F146-Y218 VanDerWaalsContact CE2-CZ 3.46Å; F146-Y218 AromaticContact CZ-CD2 3.93Å; F146-Y218 HydrophobicContact CZ-CD2 3.93Å; F146-Y218 AromaticContact CZ-CE2 3.77Å; F146-Y218 HydrophobicContact CZ-CE2 3.77Å; F146-Y218 WeakPolarHBondContact CZ-O 3.47Å; F146-H220 HydrophobicContact CE1-CB 3.82Å; F146-H220 HydrophobicContact CZ-CB 4.09Å
147	P	90.9	Very high	89.4	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.019	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-79.7	116.9	174.7	30.6	-31.5	0	0	0	109.9	Y144 C156 P157	Y144-P147 WeakPolarHBondContact OH-CD 3.1Å; P147-C156 HydrophobicContact CB-CB 4Å; P147-C156 HydrophobicContact CG-CB 3.97Å; P147-P157 HydrophobicContact CB-CG 4.2Å
148	Y	89.8	Confident	88.8	Confident	72 Å²	72	69.5 Å²	69.5	28%	0.282	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-76.7	156.6	175.9	-72.1	-87.4	0	0	0	111.6	P78 F146 Q150 E151 H220	P78-Y148 HydrophobicContact CB-CE1 4.38Å; P78-Y148 HydrophobicContact CG-CE1 4.25Å; F146-Y148 HydrophobicContact CD1-CD1 4.41Å; F146-Y148 HydrophobicContact CD1-CG 4.42Å; F146-Y148 PolarHBondContact O-N 2.95Å; Y148-Q150 PolarHBondContact O-N 2.79Å; Y148-Q150 VanDerWaalsContact O-N 3.09Å; Y148-E151 PolarHBondContact N-OE1 2.63Å; Y148-E151 WeakPolarHBondContact O-CB 3.4Å; Y148-E151 PolarHBondContact O-N 3.07Å; Y148-H220 AromaticContact CD1-ND1 3.99Å; Y148-H220 AromaticContact CE1-ND1 3.98Å
149	P	86.9	Confident	88.5	Confident	87 Å²	87	71.6 Å²	71.6	57%	0.565	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-52.4	-35.9	-175.9	-29.3	36.2	0	0	0	114.9	E151 C152	P149-E151 PolarHBondContact O-N 3.49Å; P149-C152 WeakPolarHBondContact O-CB 3.18Å; P149-C152 PolarHBondContact O-N 2.75Å; P149-C152 VanDerWaalsContact O-N 3.09Å
150	Q	89.3	Confident	88.3	Confident	148 Å²	148	70.2 Å²	70.2	69%	0.692	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-64.5	-20.3	177.4	66.2	-84.1	13.6	0	0	113.9	Y148	Y148-Q150 PolarHBondContact O-N 2.79Å; Y148-Q150 VanDerWaalsContact O-N 3.09Å
151	E	87.7	Confident	88.1	Confident	72 Å²	72	73.9 Å²	73.9	34%	0.336	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-92.3	-9.1	178.1	-50.7	-169	-99.4	0	0	112.1	Y148 P149 N153 P157 K159	Y148-E151 PolarHBondContact N-OE1 2.63Å; Y148-E151 WeakPolarHBondContact O-CB 3.4Å; Y148-E151 PolarHBondContact O-N 3.07Å; P149-E151 PolarHBondContact O-N 3.49Å; E151-N153 PolarHBondContact O-N 3.1Å; E151-P157 HydrophobicContact CB-CG 4.14Å; E151-P157 VanDerWaalsContact O-CD 3.24Å; E151-P157 WeakPolarHBondContact O-CD 3.25Å; E151-K159 IonicContact OE1-NZ 2.69Å; E151-K159 PolarHBondContact OE1-NZ 3.37Å; E151-K159 VanDerWaalsContact OE1-NZ 3.15Å; E151-K159 IonicContact OE2-NZ 3.72Å; E151-K159 PolarHBondContact OE2-NZ 2.87Å
152	C	83.2	Confident	87.5	Confident	37 Å²	37	72.7 Å²	72.7	25%	0.25	39%	0.385	C	S	.	.			trans	-94.3	87	-177.7	-61.2	0	0	0	0	110.8	P149 C156	P149-C152 WeakPolarHBondContact O-CB 3.18Å; P149-C152 PolarHBondContact O-N 2.75Å; P149-C152 VanDerWaalsContact O-N 3.09Å; C152-C156 HydrophobicContact CB-CB 4.05Å; C152-C156 WeakPolarHBondContact CB-SG 3.44Å; C152-C156 VanDerWaalsContact SG-CA 3.52Å; C152-C156 WeakPolarHBondContact SG-CB 3.29Å; C152-C156 CovalentContact SG-SG 2.04Å; C152-C156 PolarHBondContact SG-SG 2.84Å
153	N	72.6	Confident	86.7	Confident	145 Å²	145	71.1 Å²	71.1	78%	0.775	39%	0.392	S	S	*	.	S	Bend	trans	-151.1	112.4	176.1	-176.1	13	0	0	0	112.6	E151 Y155	E151-N153 PolarHBondContact O-N 3.1Å; N153-Y155 PolarHBondContact N-O 2.95Å
154	P	74.1	Confident	86.4	Confident	104 Å²	104	71.8 Å²	71.8	68%	0.675	40%	0.398	S	S	*	.	S	Bend	cis	-75.1	-7.1	-15.6	31.5	-33.3	0	0	0	112.7
155	Y	79.8	Confident	86.2	Confident	151 Å²	151	70.9 Å²	70.9	59%	0.592	39%	0.394	S	S	*	.	S	Bend	trans	-124.2	147.3	-177.1	-56.4	-64.1	0	0	0	110.5	N153	N153-Y155 PolarHBondContact N-O 2.95Å
156	C	80.4	Confident	86.1	Confident	20 Å²	20	70.8 Å²	70.8	14%	0.135	39%	0.391	C	S	.	.			trans	-74.4	134.5	171.9	-60.8	0	0	0	0	111.5	P147 C152 G214	P147-C156 HydrophobicContact CB-CB 4Å; P147-C156 HydrophobicContact CG-CB 3.97Å; C152-C156 HydrophobicContact CB-CB 4.05Å; C152-C156 WeakPolarHBondContact CB-SG 3.44Å; C152-C156 VanDerWaalsContact SG-CA 3.52Å; C152-C156 WeakPolarHBondContact SG-CB 3.29Å; C152-C156 CovalentContact SG-SG 2.04Å; C152-C156 PolarHBondContact SG-SG 2.84Å; C156-G214 PolarHBondContact N-O 2.63Å
157	P	84.7	Confident	86.1	Confident	47 Å²	47	71.5 Å²	71.5	31%	0.305	40%	0.395	S	S	.	.			trans	-69.8	136.2	174.8	28.2	-34.5	0	0	0	110.9	P147 E151	P147-P157 HydrophobicContact CB-CG 4.2Å; E151-P157 HydrophobicContact CB-CG 4.14Å; E151-P157 VanDerWaalsContact O-CD 3.24Å; E151-P157 WeakPolarHBondContact O-CD 3.25Å
158	F	85.5	Confident	86.4	Confident	102 Å²	102	71.4 Å²	71.4	45%	0.447	39%	0.394	S	S	.	.			trans	-88.2	112.6	169.5	-177.6	-99.7	0	0	0	109.9	Y144 C160 C165 T166 T169	Y144-F158 HydrophobicContact CD2-CE2 4.46Å; Y144-F158 HydrophobicContact CE2-CD2 4.38Å; Y144-F158 HydrophobicContact CE2-CE2 4.16Å; F158-C160 HydrophobicContact CD1-CB 4.29Å; F158-C160 HydrophobicContact CE1-CB 3.53Å; F158-C160 HydrophobicContact CZ-CB 3.9Å; F158-C165 HydrophobicContact CZ-CB 4.04Å; F158-T166 HydrophobicContact CE2-CG2 4.46Å; F158-T166 HydrophobicContact CZ-CG2 4.03Å; F158-T169 HydrophobicContact CE2-CG2 4.34Å
159	K	91	Very high	86.7	Confident	73 Å²	73	68.2 Å²	68.2	32%	0.317	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.9	-178.6	-63	175.9	-172.9	173.1	0	110.2	Y144 S145 E151	Y144-K159 WeakPolarHBondContact CD2-O 3.46Å; S145-K159 PolarHBondContact N-O 3.12Å; E151-K159 IonicContact OE1-NZ 2.69Å; E151-K159 PolarHBondContact OE1-NZ 3.37Å; E151-K159 VanDerWaalsContact OE1-NZ 3.15Å; E151-K159 IonicContact OE2-NZ 3.72Å; E151-K159 PolarHBondContact OE2-NZ 2.87Å
160	C	91.3	Very high	87.2	Confident	42 Å²	42	64.2 Å²	64.2	28%	0.284	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	119.1	176.9	-178.1	0	0	0	0	108.5	D143 F158 G162 C165	D143-C160 CarbonylContact O-C 3.58Å; D143-C160 VanDerWaalsContact O-CA 3.3Å; D143-C160 WeakPolarHBondContact O-CA 3.29Å; F158-C160 HydrophobicContact CD1-CB 4.29Å; F158-C160 HydrophobicContact CE1-CB 3.53Å; F158-C160 HydrophobicContact CZ-CB 3.9Å; C160-G162 PolarHBondContact SG-O 2.85Å; C160-C165 HydrophobicContact CB-CB 3.77Å; C160-C165 WeakPolarHBondContact CB-SG 3.42Å; C160-C165 WeakPolarHBondContact SG-CB 3.47Å; C160-C165 PolarHBondContact SG-N 3.09Å; C160-C165 VanDerWaalsContact SG-N 3.43Å; C160-C165 CovalentContact SG-SG 2.04Å; C160-C165 PolarHBondContact SG-SG 3.36Å
161	S	92.9	Very high	87.7	Confident	98 Å²	98	57.1 Å²	57.1	69%	0.685	32%	0.322	S	S	*	.			trans	-86.7	-19.1	175.3	52.9	0	0	0	0	112.9	D143	D143-S161 WeakPolarHBondContact CA-OG 3.32Å; D143-S161 PolarHBondContact O-N 3.09Å; D143-S161 PolarHBondContact O-OG 3.07Å; D143-S161 VanDerWaalsContact O-OG 3.11Å; D143-S161 PolarHBondContact OD1-OG 2.91Å
162	G	84.6	Confident	88.2	Confident	20 Å²	20	53.7 Å²	53.7	21%	0.206	31%	0.306	C	S	.	.	S	Bend	trans	-88.6	177.7	-178.7	0	0	0	0	0	113.7	C160 V164	C160-G162 PolarHBondContact SG-O 2.85Å; G162-V164 VanDerWaalsContact C-N 3.3Å; G162-V164 PolarHBondContact O-N 3.22Å
163	P	79.2	Confident	88.9	Confident	131 Å²	131	52.7 Å²	52.7	85%	0.851	30%	0.297	S	S	*	.	S	Bend	trans	-67.4	-31.7	178.1	27.7	-33.9	0	0	0	112.5
164	V	85.3	Confident	90.1	Very high	54 Å²	54	45.9 Å²	45.9	33%	0.327	26%	0.261	S	S	.	.			trans	-149.6	137.2	-179.7	-172.5	0	0	0	0	109.1	E140 G162 T166 H167	E140-V164 WeakPolarHBondContact CG-O 3.27Å; E140-V164 WeakPolarHBondContact OE1-CG1 3.46Å; G162-V164 VanDerWaalsContact C-N 3.3Å; G162-V164 PolarHBondContact O-N 3.22Å; V164-T166 WeakPolarHBondContact CG1-OG1 3.48Å; V164-H167 WeakPolarHBondContact CG1-ND1 3.29Å
165	C	91.6	Very high	91.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.007	24%	0.244	C	C	.	.			trans	-131	0.6	169	-56.2	0	0	0	0	112.8	E140 D143 Y144 F158 C160 H167 Y168 T169	E140-C165 WeakPolarHBondContact OE2-CA 3.18Å; D143-C165 PolarHBondContact O-SG 3.26Å; Y144-C165 HydrophobicContact CD2-CB 4.08Å; F158-C165 HydrophobicContact CZ-CB 4.04Å; C160-C165 HydrophobicContact CB-CB 3.77Å; C160-C165 WeakPolarHBondContact CB-SG 3.42Å; C160-C165 WeakPolarHBondContact SG-CB 3.47Å; C160-C165 PolarHBondContact SG-N 3.09Å; C160-C165 VanDerWaalsContact SG-N 3.43Å; C160-C165 CovalentContact SG-SG 2.04Å; C160-C165 PolarHBondContact SG-SG 3.36Å; C165-H167 VanDerWaalsContact C-N 3.33Å; C165-H167 PolarHBondContact O-N 2.88Å; C165-Y168 PolarHBondContact O-N 3.11Å; C165-T169 PolarHBondContact O-N 2.86Å; C165-T169 VanDerWaalsContact O-N 3.14Å; C165-T169 PolarHBondContact O-OG1 2.79Å
166	T	91.3	Very high	91.9	Very high	62 Å²	62	36.2 Å²	36.2	38%	0.38	22%	0.216	S	C	.	.	H	α-helix	trans	-76.5	-20.5	-171.3	48.8	0	0	0	0	113	E140 F158 V164 T169 Q170 N211	E140-T166 PolarHBondContact OE2-N 3.24Å; F158-T166 HydrophobicContact CE2-CG2 4.46Å; F158-T166 HydrophobicContact CZ-CG2 4.03Å; V164-T166 WeakPolarHBondContact CG1-OG1 3.48Å; T166-T169 WeakPolarHBondContact CA-OG1 3.35Å; T166-T169 PolarHBondContact O-OG1 3.3Å; T166-Q170 WeakPolarHBondContact O-CB 3.46Å; T166-Q170 PolarHBondContact O-N 3.32Å; T166-N211 PolarHBondContact O-ND2 2.81Å
167	H	95.8	Very high	92.6	Very high	33 Å²	33	36.3 Å²	36.3	15%	0.153	22%	0.217	C	C	.	.	H	α-helix	trans	-74.6	-42.6	175.1	-51.2	114.3	0	0	0	109.9	N119 W137 E140 V164 C165 Q170 L171	N119-H167 PolarHBondContact ND2-O 2.89Å; W137-H167 HydrophobicContact CB-CB 3.63Å; W137-H167 AromaticContact CD1-CG 3.65Å; W137-H167 HydrophobicContact CD2-CB 4.49Å; W137-H167 HydrophobicContact CG-CB 3.61Å; E140-H167 IonicContact OE1-CE1 2.68Å; E140-H167 IonicContact OE1-CG 3.72Å; E140-H167 IonicContact OE1-ND1 3.35Å; E140-H167 PolarHBondContact OE1-ND1 3.45Å; E140-H167 WeakPolarHBondContact OE2-CA 3.39Å; E140-H167 WeakPolarHBondContact OE2-CB 3.4Å; E140-H167 IonicContact OE2-CG 3.26Å; E140-H167 PolarHBondContact OE2-N 3.29Å; E140-H167 IonicContact OE2-ND1 3.56Å; V164-H167 WeakPolarHBondContact CG1-ND1 3.29Å; C165-H167 VanDerWaalsContact C-N 3.33Å; C165-H167 PolarHBondContact O-N 2.88Å; H167-Q170 PolarHBondContact O-N 2.89Å; H167-L171 WeakPolarHBondContact O-CB 3.39Å; H167-L171 PolarHBondContact O-N 3.21Å
168	Y	97.9	Very high	93.1	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-55.1	171.1	167.5	-102.9	0	0	0	111	W137 Y138 E140 V141 Y144 C165 Q170 L171 V172	W137-Y168 WeakPolarHBondContact O-CA 2.99Å; W137-Y168 VanDerWaalsContact O-CB 3.31Å; W137-Y168 WeakPolarHBondContact O-CB 3.17Å; W137-Y168 PolarHBondContact O-N 2.83Å; Y138-Y168 HydrophobicContact CD2-CD2 4Å; Y138-Y168 AromaticContact CD2-CE2 3.99Å; Y138-Y168 HydrophobicContact CD2-CE2 3.99Å; Y138-Y168 HydrophobicContact CE2-CD2 4.32Å; Y138-Y168 AromaticContact CE2-CE2 3.82Å; Y138-Y168 HydrophobicContact CE2-CE2 3.82Å; Y138-Y168 WeakPolarHBondContact O-CD2 3.38Å; E140-Y168 PolarHBondContact OE2-N 2.81Å; V141-Y168 HydrophobicContact CB-CD2 3.72Å; V141-Y168 HydrophobicContact CB-CE1 4.38Å; V141-Y168 HydrophobicContact CB-CE2 3.51Å; V141-Y168 HydrophobicContact CB-CG 4.24Å; V141-Y168 HydrophobicContact CG2-CD2 4.3Å; V141-Y168 HydrophobicContact CG2-CE1 4.15Å; V141-Y168 HydrophobicContact CG2-CE2 3.6Å; Y144-Y168 AromaticContact CD1-CD1 3.86Å; Y144-Y168 HydrophobicContact CD1-CD1 3.86Å; Y144-Y168 AromaticContact CD1-CE1 3.37Å; Y144-Y168 HydrophobicContact CD1-CE1 3.37Å; Y144-Y168 HydrophobicContact CE1-CD1 4.45Å; Y144-Y168 AromaticContact CE1-CE1 3.83Å; Y144-Y168 HydrophobicContact CE1-CE1 3.83Å; Y144-Y168 AromaticContact CG-CD1 3.91Å; Y144-Y168 HydrophobicContact CG-CD1 3.91Å; Y144-Y168 AromaticContact CG-CE1 3.92Å; Y144-Y168 HydrophobicContact CG-CE1 3.92Å; C165-Y168 PolarHBondContact O-N 3.11Å; Y168-Q170 PolarHBondContact O-N 2.81Å; Y168-L171 WeakPolarHBondContact O-CB 3.44Å; Y168-L171 PolarHBondContact O-N 2.98Å; Y168-V172 HydrophobicContact CD1-CG2 4.18Å; Y168-V172 HydrophobicContact CD2-CG1 4.09Å; Y168-V172 HydrophobicContact CD2-CG2 4.37Å; Y168-V172 HydrophobicContact CE1-CG2 3.71Å; Y168-V172 HydrophobicContact CE2-CB 4.43Å; Y168-V172 HydrophobicContact CE2-CG1 3.59Å; Y168-V172 HydrophobicContact CE2-CG2 3.95Å; Y168-V172 HydrophobicContact CG-CG2 4.48Å; Y168-V172 WeakPolarHBondContact O-CG2 3.33Å; Y168-V172 PolarHBondContact O-N 3.1Å
169	T	96.3	Very high	93.7	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-30.8	-175.3	55.2	0	0	0	0	113	Y144 F158 C165 T166 W173 N211	Y144-T169 HydrophobicContact CD2-CG2 3.79Å; Y144-T169 HydrophobicContact CE1-CG2 4.33Å; Y144-T169 HydrophobicContact CE2-CG2 3.4Å; Y144-T169 VanDerWaalsContact CE2-CG2 3.4Å; Y144-T169 HydrophobicContact CG-CG2 4.4Å; F158-T169 HydrophobicContact CE2-CG2 4.34Å; C165-T169 PolarHBondContact O-N 2.86Å; C165-T169 VanDerWaalsContact O-N 3.14Å; C165-T169 PolarHBondContact O-OG1 2.79Å; T166-T169 WeakPolarHBondContact CA-OG1 3.35Å; T166-T169 PolarHBondContact O-OG1 3.3Å; T169-W173 WeakPolarHBondContact O-CB 3.32Å; T169-W173 PolarHBondContact O-N 2.78Å; T169-W173 VanDerWaalsContact O-N 3.16Å; T169-N211 VanDerWaalsContact C-OD1 3.3Å; T169-N211 VanDerWaalsContact CB-OD1 3.26Å; T169-N211 WeakPolarHBondContact CB-OD1 3.34Å; T169-N211 PolarHBondContact OG1-OD1 3.2Å
170	Q	97.6	Very high	94	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-43.1	172.5	-179.7	56.7	84.4	0	0	112	G117 T166 H167 Y168 V172 W173 S176 Y206 N211	G117-Q170 VanDerWaalsContact CA-OE1 3.27Å; T166-Q170 WeakPolarHBondContact O-CB 3.46Å; T166-Q170 PolarHBondContact O-N 3.32Å; H167-Q170 PolarHBondContact O-N 2.89Å; Y168-Q170 PolarHBondContact O-N 2.81Å; Q170-V172 VanDerWaalsContact C-N 3.29Å; Q170-V172 PolarHBondContact O-N 3.47Å; Q170-W173 WeakPolarHBondContact O-CB 3.38Å; Q170-W173 PolarHBondContact O-N 3.26Å; Q170-S176 PolarHBondContact NE2-OG 3.4Å; Q170-Y206 HydrophobicContact CG-CD1 4.36Å; Q170-Y206 HydrophobicContact CG-CD2 3.55Å; Q170-Y206 HydrophobicContact CG-CE2 3.79Å; Q170-Y206 HydrophobicContact CG-CG 3.87Å; Q170-N211 PolarHBondContact N-OD1 2.99Å
171	L	98.4	Very high	94.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-42.5	178.2	-175.6	159.9	0	0	0	110.8	L72 R73 V134 W137 Y138 H167 Y168	L72-L171 HydrophobicContact CB-CD2 4.08Å; L72-L171 HydrophobicContact CD1-CD1 4.34Å; L72-L171 HydrophobicContact CD1-CD2 4.48Å; R73-L171 HydrophobicContact CG-CD2 4.33Å; R73-L171 WeakPolarHBondContact CG-O 3.47Å; R73-L171 PolarHBondContact NH1-O 3.23Å; V134-L171 HydrophobicContact CG1-CD1 3.82Å; W137-L171 HydrophobicContact CB-CD1 4.4Å; Y138-L171 HydrophobicContact CD2-CD2 4.03Å; H167-L171 WeakPolarHBondContact O-CB 3.39Å; H167-L171 PolarHBondContact O-N 3.21Å; Y168-L171 WeakPolarHBondContact O-CB 3.44Å; Y168-L171 PolarHBondContact O-N 2.98Å
172	V	98.3	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	18	-179.8	-54.6	0	0	0	0	114	V76 M83 Y138 Y168 Q170 A174 P217 Y218	V76-V172 HydrophobicContact CG1-CB 3.91Å; V76-V172 HydrophobicContact CG1-CG1 3.48Å; V76-V172 VanDerWaalsContact CG1-CG1 3.48Å; M83-V172 HydrophobicContact CE-CB 4.37Å; M83-V172 WeakPolarHBondContact CE-O 3.47Å; Y138-V172 HydrophobicContact CD2-CG1 4.42Å; Y138-V172 HydrophobicContact CE2-CG1 4.21Å; Y168-V172 HydrophobicContact CD1-CG2 4.18Å; Y168-V172 HydrophobicContact CD2-CG1 4.09Å; Y168-V172 HydrophobicContact CD2-CG2 4.37Å; Y168-V172 HydrophobicContact CE1-CG2 3.71Å; Y168-V172 HydrophobicContact CE2-CB 4.43Å; Y168-V172 HydrophobicContact CE2-CG1 3.59Å; Y168-V172 HydrophobicContact CE2-CG2 3.95Å; Y168-V172 HydrophobicContact CG-CG2 4.48Å; Y168-V172 WeakPolarHBondContact O-CG2 3.33Å; Y168-V172 PolarHBondContact O-N 3.1Å; Q170-V172 VanDerWaalsContact C-N 3.29Å; Q170-V172 PolarHBondContact O-N 3.47Å; V172-A174 PolarHBondContact O-N 3.06Å; V172-P217 HydrophobicContact CG2-CB 4.08Å; V172-P217 HydrophobicContact CG2-CG 4.38Å; V172-Y218 HydrophobicContact CB-CD1 4.45Å; V172-Y218 HydrophobicContact CB-CE1 4.35Å; V172-Y218 HydrophobicContact CG2-CD1 4.27Å; V172-Y218 HydrophobicContact CG2-CE1 4Å; V172-Y218 WeakPolarHBondContact O-CD1 3.35Å
173	W	98.4	Very high	94.8	Very high	16 Å²	16	24 Å²	24	6%	0.061	13%	0.133	C	C	.	.			trans	-73.7	116	179.9	-159.4	-90.4	0	0	0	110.9	R73 T169 Q170 T175 S176 N211 W212 H215 P217	R73-W173 PolarHBondContact NH1-O 3.16Å; R73-W173 PolarHBondContact NH2-O 3.25Å; R73-W173 VanDerWaalsContact NH2-O 3.11Å; T169-W173 WeakPolarHBondContact O-CB 3.32Å; T169-W173 PolarHBondContact O-N 2.78Å; T169-W173 VanDerWaalsContact O-N 3.16Å; Q170-W173 WeakPolarHBondContact O-CB 3.38Å; Q170-W173 PolarHBondContact O-N 3.26Å; W173-T175 VanDerWaalsContact C-N 3.31Å; W173-T175 PolarHBondContact NE1-OG1 2.88Å; W173-T175 PolarHBondContact O-N 3.11Å; W173-S176 PolarHBondContact O-N 3.01Å; W173-S176 VanDerWaalsContact O-N 3.08Å; W173-N211 VanDerWaalsContact CZ3-CA 3.42Å; W173-W212 HydrophobicContact CH2-CB 4.11Å; W173-W212 VanDerWaalsContact CH2-N 3.27Å; W173-W212 HydrophobicContact CZ2-CB 3.91Å; W173-W212 AromaticContact CZ2-CD1 3.74Å; W173-W212 HydrophobicContact CZ2-CG 4.25Å; W173-H215 HydrophobicContact CH2-CB 3.98Å; W173-H215 HydrophobicContact CZ2-CB 4.22Å; W173-P217 CarbonylContact C-O 3.51Å; W173-P217 WeakPolarHBondContact CA-O 3.31Å; W173-P217 VanDerWaalsContact CE3-CA 3.45Å; W173-P217 HydrophobicContact CE3-CB 3.78Å; W173-P217 HydrophobicContact CZ3-CB 4.09Å
174	A	97.3	Very high	95.4	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.017	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-46.6	-170.3	0	0	0	0	0	113	R73 M83 E84 V172 S176 P217	R73-A174 PolarHBondContact NH2-O 2.77Å; R73-A174 VanDerWaalsContact NH2-O 3.09Å; M83-A174 HydrophobicContact SD-CB 4.44Å; E84-A174 WeakPolarHBondContact CB-O 3.48Å; E84-A174 VanDerWaalsContact CG-O 3.29Å; E84-A174 WeakPolarHBondContact CG-O 3.34Å; E84-A174 PolarHBondContact N-O 3.11Å; V172-A174 PolarHBondContact O-N 3.06Å; A174-S176 PolarHBondContact O-N 2.83Å; A174-P217 PolarHBondContact N-O 3.09Å
175	T	95	Very high	95.7	Very high	52 Å²	52	18.5 Å²	18.5	32%	0.319	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-8	-174.8	61.7	0	0	0	0	114.2	W173 S177 P208	W173-T175 VanDerWaalsContact C-N 3.31Å; W173-T175 PolarHBondContact NE1-OG1 2.88Å; W173-T175 PolarHBondContact O-N 3.11Å; T175-S177 PolarHBondContact O-N 3.38Å; T175-S177 VanDerWaalsContact O-N 3.15Å; T175-P208 VanDerWaalsContact O-CD 3.25Å; T175-P208 WeakPolarHBondContact O-CD 3.31Å
176	S	96.8	Very high	95.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.094	C	C	.	.			trans	-77.3	100	174.5	-65.5	0	0	0	0	108	R73 M86 Q170 W173 A174 P208	R73-S176 PolarHBondContact NH2-O 3.32Å; M86-S176 WeakPolarHBondContact CE-O 3.43Å; M86-S176 WeakPolarHBondContact CG-O 3.32Å; Q170-S176 PolarHBondContact NE2-OG 3.4Å; W173-S176 PolarHBondContact O-N 3.01Å; W173-S176 VanDerWaalsContact O-N 3.08Å; A174-S176 PolarHBondContact O-N 2.83Å; S176-P208 WeakPolarHBondContact CB-O 3.4Å; S176-P208 PolarHBondContact OG-O 2.98Å
177	S	95	Very high	95.5	Very high	22 Å²	22	22.2 Å²	22.2	15%	0.154	10%	0.102	C	C	.	.			trans	-109	2.2	-175.7	42.5	0	0	0	0	114.1	E84 M86 V87 T175 S207	E84-S177 WeakPolarHBondContact OE2-CB 3.25Å; E84-S177 PolarHBondContact OE2-OG 2.82Å; M86-S177 CarbonylContact C-O 3.54Å; M86-S177 VanDerWaalsContact CA-O 3.29Å; M86-S177 WeakPolarHBondContact CA-O 3.33Å; V87-S177 PolarHBondContact N-O 3.42Å; T175-S177 PolarHBondContact O-N 3.38Å; T175-S177 VanDerWaalsContact O-N 3.15Å; S177-S207 PolarHBondContact N-O 2.88Å; S177-S207 VanDerWaalsContact N-O 3.17Å
178	R	96.1	Very high	95	Very high	114 Å²	114	26 Å²	26	43%	0.43	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.8	175.9	-64	172.2	178.9	-113.5	-0.3	110.9	V87 D89 L92 Y206 S207	V87-R178 HydrophobicContact CG2-CG 4.08Å; V87-R178 WeakPolarHBondContact O-CA 3.3Å; D89-R178 HydrophobicContact CB-CB 4.03Å; D89-R178 HydrophobicContact CB-CG 4.49Å; D89-R178 WeakPolarHBondContact OD2-CD 3.48Å; D89-R178 IonicContact OD2-CZ 3.41Å; D89-R178 IonicContact OD2-NH1 2.66Å; D89-R178 PolarHBondContact OD2-NH1 2.86Å; L92-R178 HydrophobicContact CD1-CB 3.92Å; R178-Y206 WeakPolarHBondContact O-CA 3.44Å; R178-S207 WeakPolarHBondContact CB-O 3.38Å; R178-S207 PolarHBondContact N-O 3.41Å; R178-S207 PolarHBondContact O-N 3.39Å
179	I	98.3	Very high	94.5	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	143.9	175.8	-171.9	175.5	0	0	0	110.5	I65 L66 H69 V87 W88 D89 C204 N205 Y206	I65-I179 HydrophobicContact CG2-CD1 4.26Å; L66-I179 HydrophobicContact CD1-CG2 3.63Å; H69-I179 VanDerWaalsContact CE1-CD1 3.44Å; H69-I179 WeakPolarHBondContact CE1-CD1 2.97Å; H69-I179 VanDerWaalsContact NE2-CD1 3.35Å; H69-I179 WeakPolarHBondContact NE2-CD1 3.32Å; V87-I179 PolarHBondContact O-N 3.02Å; W88-I179 CarbonylContact C-O 3.47Å; W88-I179 WeakPolarHBondContact CA-O 3.46Å; W88-I179 HydrophobicContact CE3-CG2 4.14Å; D89-I179 PolarHBondContact N-O 2.86Å; I179-C204 HydrophobicContact CD1-CB 4.42Å; I179-N205 VanDerWaalsContact CA-O 3.31Å; I179-N205 WeakPolarHBondContact CA-O 3.41Å; I179-Y206 HydrophobicContact CB-CD1 4.4Å; I179-Y206 HydrophobicContact CD1-CD1 4.17Å; I179-Y206 HydrophobicContact CD1-CE1 3.54Å; I179-Y206 HydrophobicContact CG1-CD1 4.15Å; I179-Y206 HydrophobicContact CG1-CE1 4Å
180	G	96.8	Very high	94.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	135.3	165.4	0	0	0	0	0	109.7	N205	G180-N205 PolarHBondContact N-O 3.07Å; G180-N205 PolarHBondContact O-N 3.35Å
181	C	97.5	Very high	93.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	155.6	-175.6	-50.7	0	0	0	0	112	I57 I65 W88 L202 V203 C204	I57-C181 HydrophobicContact CD1-CB 4.29Å; I65-C181 HydrophobicContact CD1-CB 4.21Å; W88-C181 HydrophobicContact CH2-CB 3.76Å; W88-C181 VanDerWaalsContact CH2-N 3.28Å; W88-C181 HydrophobicContact CZ3-CB 4.45Å; C181-L202 HydrophobicContact CB-CD1 4.11Å; C181-V203 CarbonylContact C-O 3.58Å; C181-V203 WeakPolarHBondContact CA-O 3.5Å; C181-V203 VanDerWaalsContact CB-O 3.28Å; C181-V203 WeakPolarHBondContact CB-O 3.46Å; C181-C204 HydrophobicContact CB-CB 4.01Å; C181-C204 WeakPolarHBondContact CB-SG 3.17Å; C181-C204 WeakPolarHBondContact SG-CA 3.21Å; C181-C204 WeakPolarHBondContact SG-CB 3.46Å; C181-C204 CovalentContact SG-SG 2.03Å; C181-C204 PolarHBondContact SG-SG 3.22Å
182	A	94.8	Very high	92.4	Very high	2 Å²	2	40 Å²	40	2%	0.017	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.1	172.8	0	0	0	0	0	111.5	A96 E97 A100 L202 V203	A96-A182 HydrophobicContact CB-CB 4Å; E97-A182 HydrophobicContact CB-CB 3.64Å; E97-A182 HydrophobicContact CG-CB 4.35Å; A100-A182 HydrophobicContact CB-CB 4.4Å; A182-L202 WeakPolarHBondContact O-CA 3.33Å; A182-V203 PolarHBondContact N-O 3.29Å; A182-V203 PolarHBondContact O-N 2.84Å
183	I	92.2	Very high	91.6	Very high	8 Å²	8	43 Å²	43	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.2	172.9	-75.9	-180	0	0	0	109.3	R55 P130 V200 Y201 L202	R55-I183 HydrophobicContact CG-CG2 4.22Å; R55-I183 CarbonylContact O-C 3.51Å; P130-I183 HydrophobicContact CB-CD1 3.72Å; P130-I183 HydrophobicContact CG-CD1 3.38Å; I183-V200 HydrophobicContact CG2-CG1 3.84Å; I183-Y201 CarbonylContact C-O 3.4Å; I183-Y201 VanDerWaalsContact CA-O 3.28Å; I183-Y201 WeakPolarHBondContact CA-O 3.33Å; I183-L202 HydrophobicContact CD1-CD1 4.03Å; I183-L202 HydrophobicContact CG1-CB 4.17Å; I183-L202 HydrophobicContact CG1-CD1 3.5Å; I183-L202 VanDerWaalsContact CG1-CD1 3.5Å; I183-L202 HydrophobicContact CG1-CG 4.43Å
184	N	92.7	Very high	90.6	Very high	17 Å²	17	48.5 Å²	48.5	9%	0.091	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.8	166.3	-171.9	33.2	0	0	0	111.5	A100 E101 C103 Y201	A100-N184 HydrophobicContact CB-CB 3.74Å; A100-N184 WeakPolarHBondContact O-CB 3.37Å; A100-N184 PolarHBondContact O-ND2 3.15Å; E101-N184 WeakPolarHBondContact CA-ND2 3.2Å; C103-N184 PolarHBondContact SG-ND2 2.96Å; N184-Y201 PolarHBondContact N-O 3.28Å; N184-Y201 PolarHBondContact O-N 3.33Å
185	L	90.7	Very high	90.2	Very high	52 Å²	52	54.2 Å²	54.2	27%	0.272	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111.9	172.5	-179	68.9	0	0	0	109.5	R55 K198 V200	R55-L185 HydrophobicContact CB-CB 4.32Å; L185-K198 HydrophobicContact CD1-CB 4.17Å; L185-K198 WeakPolarHBondContact CD1-O 3.36Å; L185-V200 HydrophobicContact CD1-CG2 3.96Å
186	C	90.1	Very high	89.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	110.5	-178.5	-64.2	0	0	0	0	110.8	C103 N188 M189 K198 A199	C103-C186 WeakPolarHBondContact CA-SG 3.02Å; C103-C186 HydrophobicContact CB-CB 3.61Å; C103-C186 WeakPolarHBondContact CB-SG 2.96Å; C103-C186 WeakPolarHBondContact SG-CA 3.47Å; C103-C186 WeakPolarHBondContact SG-CB 3Å; C103-C186 CovalentContact SG-SG 2.03Å; C103-C186 PolarHBondContact SG-SG 3.42Å; C186-N188 VanDerWaalsContact C-N 3.31Å; C186-N188 PolarHBondContact O-N 3Å; C186-M189 HydrophobicContact CB-CB 3.89Å; C186-M189 HydrophobicContact CB-CG 4.38Å; C186-M189 HydrophobicContact CB-SD 3.93Å; C186-K198 CarbonylContact O-C 3.56Å; C186-K198 VanDerWaalsContact O-CA 3.27Å; C186-K198 WeakPolarHBondContact O-CA 3.4Å; C186-K198 PolarHBondContact O-N 3.43Å; C186-A199 HydrophobicContact CB-CB 4.38Å; C186-A199 PolarHBondContact N-O 3.12Å; C186-A199 PolarHBondContact O-N 2.74Å
187	Y	88.7	Confident	89.4	Confident	141 Å²	141	59.5 Å²	59.5	55%	0.553	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	-38.2	-177.8	-73.5	-79.2	0	0	0	113.2	E197 K198	Y187-E197 VanDerWaalsContact O-CA 3.27Å; Y187-E197 WeakPolarHBondContact O-CA 3.03Å; Y187-K198 HydrophobicContact CD1-CG 4.35Å; Y187-K198 PolarHBondContact O-N 3.4Å
188	N	87	Confident	89	Confident	113 Å²	113	65 Å²	65	60%	0.604	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	109	174.7	-66.4	-55.8	0	0	0	108.4	C186 I195	C186-N188 VanDerWaalsContact C-N 3.31Å; C186-N188 PolarHBondContact O-N 3Å; N188-I195 HydrophobicContact CB-CG2 4.09Å
189	M	86.8	Confident	88.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.1	-179.9	-169.1	166	-173.5	0	0	110	C103 W105 V122 C186 V191 I195 W196 A199 Y201	C103-M189 WeakPolarHBondContact O-CG 3.42Å; W105-M189 HydrophobicContact CB-CE 3.75Å; W105-M189 HydrophobicContact CE3-CE 3.98Å; V122-M189 HydrophobicContact CG2-SD 4.1Å; C186-M189 HydrophobicContact CB-CB 3.89Å; C186-M189 HydrophobicContact CB-CG 4.38Å; C186-M189 HydrophobicContact CB-SD 3.93Å; M189-V191 HydrophobicContact CB-CG2 4.38Å; M189-V191 HydrophobicContact CG-CG2 3.95Å; M189-V191 PolarHBondContact O-N 3.34Å; M189-V191 HydrophobicContact SD-CG2 4.45Å; M189-I195 WeakPolarHBondContact O-CA 3.42Å; M189-W196 PolarHBondContact N-O 3.31Å; M189-W196 PolarHBondContact O-N 2.91Å; M189-A199 HydrophobicContact CB-CB 3.86Å; M189-A199 HydrophobicContact SD-CB 4.17Å; M189-Y201 HydrophobicContact CE-CD1 3.61Å; M189-Y201 HydrophobicContact CE-CD2 3.78Å; M189-Y201 HydrophobicContact CE-CE1 3.79Å; M189-Y201 HydrophobicContact CE-CE2 3.97Å; M189-Y201 HydrophobicContact CE-CG 3.61Å; M189-Y201 HydrophobicContact SD-CD1 4.38Å; M189-Y201 HydrophobicContact SD-CG 4.12Å
190	N	86.8	Confident	88.4	Confident	101 Å²	101	60.1 Å²	60.1	54%	0.54	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	102.2	175.1	-177.5	1.6	0	0	0	109.7	W105 G193 Q194	W105-N190 WeakPolarHBondContact CB-O 3.17Å; N190-G193 WeakPolarHBondContact OD1-CA 3.19Å; N190-G193 PolarHBondContact OD1-N 3.46Å; N190-Q194 CarbonylContact C-O 3.51Å; N190-Q194 WeakPolarHBondContact CA-O 3.39Å; N190-Q194 PolarHBondContact OD1-N 3.41Å
191	V	83.7	Confident	88.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111	177	-176	0	0	0	0	107.7	W105 V122 M189 G193 Q194 W196	W105-V191 HydrophobicContact CB-CG2 4.28Å; W105-V191 HydrophobicContact CD2-CG1 4.28Å; W105-V191 HydrophobicContact CG-CB 4.4Å; W105-V191 HydrophobicContact CG-CG1 4.09Å; W105-V191 HydrophobicContact CG-CG2 4.22Å; V122-V191 HydrophobicContact CG1-CG1 3.87Å; V122-V191 HydrophobicContact CG1-CG2 4.13Å; V122-V191 HydrophobicContact CG2-CG2 4.11Å; M189-V191 HydrophobicContact CB-CG2 4.38Å; M189-V191 HydrophobicContact CG-CG2 3.95Å; M189-V191 PolarHBondContact O-N 3.34Å; M189-V191 HydrophobicContact SD-CG2 4.45Å; V191-G193 VanDerWaalsContact C-N 3.26Å; V191-G193 PolarHBondContact O-N 2.97Å; V191-G193 VanDerWaalsContact O-N 3.16Å; V191-Q194 PolarHBondContact N-O 3.5Å; V191-Q194 PolarHBondContact O-N 2.98Å; V191-W196 HydrophobicContact CB-CD2 3.83Å; V191-W196 HydrophobicContact CB-CE3 4.25Å; V191-W196 HydrophobicContact CB-CG 4.09Å; V191-W196 HydrophobicContact CB-CZ2 4.32Å; V191-W196 HydrophobicContact CG1-CD2 4.24Å; V191-W196 HydrophobicContact CG1-CE3 4.34Å; V191-W196 HydrophobicContact CG1-CH2 4.07Å; V191-W196 HydrophobicContact CG1-CZ2 3.94Å; V191-W196 HydrophobicContact CG1-CZ3 4.27Å; V191-W196 HydrophobicContact CG2-CB 4.36Å; V191-W196 HydrophobicContact CG2-CD2 3.86Å; V191-W196 HydrophobicContact CG2-CE3 3.95Å; V191-W196 HydrophobicContact CG2-CG 4.05Å
192	W	78.3	Confident	88.2	Confident	199 Å²	199	60.1 Å²	60.1	75%	0.754	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	34.5	179.4	-54	-53.3	0	0	0	115.7	W105 W196	W105-W192 AromaticContact CD1-NE1 3.93Å; W105-W192 HydrophobicContact CZ2-CH2 4.34Å; W105-W192 AromaticContact CZ2-CZ2 3.81Å; W105-W192 HydrophobicContact CZ2-CZ2 3.81Å; W105-W192 AromaticContact NE1-CD1 3.79Å; W105-W192 AromaticContact NE1-CD2 3.98Å; W105-W192 AromaticContact NE1-CE2 3.31Å; W105-W192 VanDerWaalsContact NE1-CE2 3.31Å; W105-W192 AromaticContact NE1-CZ2 3.63Å; W105-W192 AromaticContact NE1-NE1 3.19Å; W105-W192 VanDerWaalsContact NE1-NE1 3.19Å; W192-W196 HydrophobicContact CZ3-CH2 4.27Å; W192-W196 HydrophobicContact CZ3-CZ2 4.34Å
193	G	79.7	Confident	88.3	Confident	64 Å²	64	60 Å²	60	66%	0.66	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	4.2	178.5	0	0	0	0	0	114.3	N190 V191	N190-G193 WeakPolarHBondContact OD1-CA 3.19Å; N190-G193 PolarHBondContact OD1-N 3.46Å; V191-G193 VanDerWaalsContact C-N 3.26Å; V191-G193 PolarHBondContact O-N 2.97Å; V191-G193 VanDerWaalsContact O-N 3.16Å
194	Q	78.8	Confident	88.6	Confident	131 Å²	131	59.6 Å²	59.6	61%	0.612	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.8	174.2	-65.5	-176.2	-25.7	0	0	110	N190 V191 W196	N190-Q194 CarbonylContact C-O 3.51Å; N190-Q194 WeakPolarHBondContact CA-O 3.39Å; N190-Q194 PolarHBondContact OD1-N 3.41Å; V191-Q194 PolarHBondContact N-O 3.5Å; V191-Q194 PolarHBondContact O-N 2.98Å; Q194-W196 PolarHBondContact O-N 3.05Å
195	I	87.5	Confident	88.8	Confident	121 Å²	121	58.8 Å²	58.8	62%	0.621	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.7	173.8	-59.8	175.4	0	0	0	107.6	N188 M189	N188-I195 HydrophobicContact CB-CG2 4.09Å; M189-I195 WeakPolarHBondContact O-CA 3.42Å
196	W	87.2	Confident	89.1	Confident	30 Å²	30	56.3 Å²	56.3	11%	0.114	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.2	172.1	-70.2	15.1	0	0	0	108.3	V122 W124 M189 V191 W192 Q194 A199	V122-W196 HydrophobicContact CG1-CE3 4.4Å; V122-W196 HydrophobicContact CG1-CH2 4.46Å; V122-W196 HydrophobicContact CG1-CZ3 3.85Å; V122-W196 HydrophobicContact CG2-CE3 4.08Å; V122-W196 HydrophobicContact CG2-CZ3 4.19Å; W124-W196 HydrophobicContact CB-CB 4.26Å; W124-W196 HydrophobicContact CB-CD2 4.31Å; W124-W196 HydrophobicContact CB-CE3 3.84Å; W124-W196 AromaticContact CD1-CD2 3.54Å; W124-W196 AromaticContact CD1-CE2 3.93Å; W124-W196 AromaticContact CD1-CE3 3.29Å; W124-W196 AromaticContact CD1-CH2 3.89Å; W124-W196 AromaticContact CD1-CZ3 3.48Å; W124-W196 VanDerWaalsContact CD1-CZ3 3.48Å; W124-W196 HydrophobicContact CD2-CB 4.29Å; W124-W196 HydrophobicContact CD2-CD2 4.17Å; W124-W196 HydrophobicContact CD2-CE3 4.48Å; W124-W196 HydrophobicContact CD2-CG 4.1Å; W124-W196 HydrophobicContact CE3-CB 4.4Å; W124-W196 HydrophobicContact CG-CB 4.24Å; W124-W196 AromaticContact CG-CD2 3.78Å; W124-W196 HydrophobicContact CG-CD2 3.78Å; W124-W196 AromaticContact CG-CE3 3.63Å; W124-W196 HydrophobicContact CG-CE3 3.63Å; W124-W196 HydrophobicContact CG-CG 4.07Å; W124-W196 HydrophobicContact CG-CZ3 4.24Å; W124-W196 AromaticContact NE1-CD2 3.84Å; W124-W196 AromaticContact NE1-CE2 3.8Å; W124-W196 AromaticContact NE1-CZ2 3.95Å; M189-W196 PolarHBondContact N-O 3.31Å; M189-W196 PolarHBondContact O-N 2.91Å; V191-W196 HydrophobicContact CB-CD2 3.83Å; V191-W196 HydrophobicContact CB-CE3 4.25Å; V191-W196 HydrophobicContact CB-CG 4.09Å; V191-W196 HydrophobicContact CB-CZ2 4.32Å; V191-W196 HydrophobicContact CG1-CD2 4.24Å; V191-W196 HydrophobicContact CG1-CE3 4.34Å; V191-W196 HydrophobicContact CG1-CH2 4.07Å; V191-W196 HydrophobicContact CG1-CZ2 3.94Å; V191-W196 HydrophobicContact CG1-CZ3 4.27Å; V191-W196 HydrophobicContact CG2-CB 4.36Å; V191-W196 HydrophobicContact CG2-CD2 3.86Å; V191-W196 HydrophobicContact CG2-CE3 3.95Å; V191-W196 HydrophobicContact CG2-CG 4.05Å; W192-W196 HydrophobicContact CZ3-CH2 4.27Å; W192-W196 HydrophobicContact CZ3-CZ2 4.34Å; Q194-W196 PolarHBondContact O-N 3.05Å; W196-A199 HydrophobicContact CB-CB 4Å
197	E	88.4	Confident	89.2	Confident	133 Å²	133	58 Å²	58	62%	0.621	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.3	175.9	-65	-173.5	173.2	0	0	110.5	Y187 A199	Y187-E197 VanDerWaalsContact O-CA 3.27Å; Y187-E197 WeakPolarHBondContact O-CA 3.03Å; E197-A199 PolarHBondContact O-N 2.03Å
198	K	87.3	Confident	89.4	Confident	137 Å²	137	54.3 Å²	54.3	60%	0.596	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.3	44.4	-179.9	-59.8	179.2	-177.9	175.6	0	112.2	L185 C186 Y187	L185-K198 HydrophobicContact CD1-CB 4.17Å; L185-K198 WeakPolarHBondContact CD1-O 3.36Å; C186-K198 CarbonylContact O-C 3.56Å; C186-K198 VanDerWaalsContact O-CA 3.27Å; C186-K198 WeakPolarHBondContact O-CA 3.4Å; C186-K198 PolarHBondContact O-N 3.43Å; Y187-K198 HydrophobicContact CD1-CG 4.35Å; Y187-K198 PolarHBondContact O-N 3.4Å
199	A	90.5	Very high	89.5	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	130.3	176.1	0	0	0	0	0	110.3	V122 H123 C186 M189 W196 E197	V122-A199 HydrophobicContact CG2-CB 3.95Å; H123-A199 CarbonylContact O-C 3.57Å; H123-A199 WeakPolarHBondContact O-CA 3.41Å; C186-A199 HydrophobicContact CB-CB 4.38Å; C186-A199 PolarHBondContact N-O 3.12Å; C186-A199 PolarHBondContact O-N 2.74Å; M189-A199 HydrophobicContact CB-CB 3.86Å; M189-A199 HydrophobicContact SD-CB 4.17Å; W196-A199 HydrophobicContact CB-CB 4Å; E197-A199 PolarHBondContact O-N 2.03Å
200	V	90.8	Very high	89.6	Confident	12 Å²	12	52 Å²	52	7%	0.073	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.6	171.6	178.7	0	0	0	0	107.5	V122 H123 I183 L185	V122-V200 WeakPolarHBondContact CA-O 3.47Å; H123-V200 WeakPolarHBondContact CE1-CB 3.42Å; H123-V200 PolarHBondContact N-O 2.81Å; H123-V200 VanDerWaalsContact N-O 3.1Å; H123-V200 PolarHBondContact O-N 2.85Å; I183-V200 HydrophobicContact CG2-CG1 3.84Å; L185-V200 HydrophobicContact CD1-CG2 3.96Å
201	Y	94.1	Very high	89.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.5	-175.6	-177.3	-149.5	0	0	0	110.2	W99 A100 L104 W105 E106 L120 G121 I183 N184 M189 V203	W99-Y201 PolarHBondContact NE1-OH 2.87Å; A100-Y201 HydrophobicContact CB-CD1 4.33Å; L104-Y201 WeakPolarHBondContact O-CE1 3.27Å; L104-Y201 PolarHBondContact O-OH 3.05Å; W105-Y201 AromaticContact CE3-CD2 3.99Å; W105-Y201 HydrophobicContact CE3-CD2 3.99Å; W105-Y201 AromaticContact CE3-CE2 3.61Å; W105-Y201 HydrophobicContact CE3-CE2 3.61Å; W105-Y201 AromaticContact CZ3-CD2 3.93Å; W105-Y201 HydrophobicContact CZ3-CD2 3.93Å; W105-Y201 AromaticContact CZ3-CE2 3.63Å; W105-Y201 HydrophobicContact CZ3-CE2 3.63Å; E106-Y201 PolarHBondContact O-OH 2.52Å; L120-Y201 HydrophobicContact CB-CE2 4.17Å; L120-Y201 HydrophobicContact CD1-CE2 4.46Å; L120-Y201 WeakPolarHBondContact CD1-OH 3.48Å; L120-Y201 HydrophobicContact CD2-CE2 3.99Å; L120-Y201 WeakPolarHBondContact CD2-OH 3.42Å; L120-Y201 HydrophobicContact CG-CE2 4.43Å; G121-Y201 WeakPolarHBondContact O-CD2 3.43Å; I183-Y201 CarbonylContact C-O 3.4Å; I183-Y201 VanDerWaalsContact CA-O 3.28Å; I183-Y201 WeakPolarHBondContact CA-O 3.33Å; N184-Y201 PolarHBondContact N-O 3.28Å; N184-Y201 PolarHBondContact O-N 3.33Å; M189-Y201 HydrophobicContact CE-CD1 3.61Å; M189-Y201 HydrophobicContact CE-CD2 3.78Å; M189-Y201 HydrophobicContact CE-CE1 3.79Å; M189-Y201 HydrophobicContact CE-CE2 3.97Å; M189-Y201 HydrophobicContact CE-CG 3.61Å; M189-Y201 HydrophobicContact SD-CD1 4.38Å; M189-Y201 HydrophobicContact SD-CG 4.12Å; Y201-V203 HydrophobicContact CD1-CG2 4.17Å; Y201-V203 HydrophobicContact CD2-CG2 4.42Å; Y201-V203 HydrophobicContact CE1-CG2 3.7Å; Y201-V203 HydrophobicContact CE2-CG2 3.94Å
202	L	95.6	Very high	89.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.8	174.1	176.2	71.2	0	0	0	109.4	I65 L120 G121 H133 W137 C181 A182 I183	I65-L202 HydrophobicContact CD1-CD1 4.23Å; L120-L202 WeakPolarHBondContact CA-O 3.49Å; G121-L202 PolarHBondContact N-O 2.83Å; G121-L202 PolarHBondContact O-N 2.98Å; H133-L202 HydrophobicContact CB-CD2 3.61Å; W137-L202 HydrophobicContact CH2-CD2 3.68Å; W137-L202 HydrophobicContact CH2-CG 4.2Å; W137-L202 HydrophobicContact CZ2-CD2 4.15Å; W137-L202 HydrophobicContact CZ3-CD2 4.43Å; C181-L202 HydrophobicContact CB-CD1 4.11Å; A182-L202 WeakPolarHBondContact O-CA 3.33Å; I183-L202 HydrophobicContact CD1-CD1 4.03Å; I183-L202 HydrophobicContact CG1-CB 4.17Å; I183-L202 HydrophobicContact CG1-CD1 3.5Å; I183-L202 VanDerWaalsContact CG1-CD1 3.5Å; I183-L202 HydrophobicContact CG1-CG 4.43Å
203	V	97.2	Very high	89.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.8	172.2	-177.9	0	0	0	0	107.6	A96 W99 A100 Q118 L120 C181 A182 Y201	A96-V203 HydrophobicContact CB-CB 4.15Å; A96-V203 HydrophobicContact CB-CG1 3.92Å; W99-V203 HydrophobicContact CB-CG1 4.4Å; A100-V203 HydrophobicContact CB-CB 4.4Å; A100-V203 HydrophobicContact CB-CG2 3.76Å; Q118-V203 HydrophobicContact CG-CG1 4.12Å; L120-V203 HydrophobicContact CD2-CB 4.2Å; L120-V203 HydrophobicContact CD2-CG1 3.91Å; L120-V203 HydrophobicContact CD2-CG2 3.88Å; C181-V203 CarbonylContact C-O 3.58Å; C181-V203 WeakPolarHBondContact CA-O 3.5Å; C181-V203 VanDerWaalsContact CB-O 3.28Å; C181-V203 WeakPolarHBondContact CB-O 3.46Å; A182-V203 PolarHBondContact N-O 3.29Å; A182-V203 PolarHBondContact O-N 2.84Å; Y201-V203 HydrophobicContact CD1-CG2 4.17Å; Y201-V203 HydrophobicContact CD2-CG2 4.42Å; Y201-V203 HydrophobicContact CE1-CG2 3.7Å; Y201-V203 HydrophobicContact CE2-CG2 3.94Å
204	C	98.1	Very high	89.2	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.3	172.8	-76.9	0	0	0	0	110.1	Q118 N119 W137 I179 C181 Y206	Q118-C204 CarbonylContact C-O 3.56Å; Q118-C204 VanDerWaalsContact CA-O 3.24Å; Q118-C204 WeakPolarHBondContact CA-O 3.43Å; N119-C204 PolarHBondContact N-O 3.4Å; N119-C204 PolarHBondContact O-N 3.02Å; W137-C204 HydrophobicContact CH2-CB 3.81Å; W137-C204 HydrophobicContact CZ3-CB 3.97Å; I179-C204 HydrophobicContact CD1-CB 4.42Å; C181-C204 HydrophobicContact CB-CB 4.01Å; C181-C204 WeakPolarHBondContact CB-SG 3.17Å; C181-C204 WeakPolarHBondContact SG-CA 3.21Å; C181-C204 WeakPolarHBondContact SG-CB 3.46Å; C181-C204 CovalentContact SG-SG 2.03Å; C181-C204 PolarHBondContact SG-SG 3.22Å; C204-Y206 HydrophobicContact CB-CE2 3.99Å; C204-Y206 WeakPolarHBondContact O-CE2 3.46Å
205	N	97.3	Very high	89.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.6	177.9	-70.4	-19.1	0	0	0	110.5	L92 T95 A96 I116 G117 Q118 I179 G180	L92-N205 HydrophobicContact CB-CB 4.11Å; L92-N205 HydrophobicContact CD2-CB 4.22Å; L92-N205 PolarHBondContact O-ND2 3.44Å; T95-N205 PolarHBondContact OG1-ND2 2.03Å; T95-N205 VanDerWaalsContact OG1-ND2 3.15Å; A96-N205 WeakPolarHBondContact CA-ND2 3.38Å; A96-N205 PolarHBondContact N-ND2 2.87Å; I116-N205 HydrophobicContact CD1-CB 3.76Å; I116-N205 WeakPolarHBondContact CD1-OD1 3.46Å; G117-N205 CarbonylContact O-C 3.52Å; G117-N205 WeakPolarHBondContact O-CA 3.46Å; Q118-N205 WeakPolarHBondContact CG-OD1 3.41Å; Q118-N205 PolarHBondContact NE2-OD1 3.19Å; I179-N205 VanDerWaalsContact CA-O 3.31Å; I179-N205 WeakPolarHBondContact CA-O 3.41Å; G180-N205 PolarHBondContact N-O 3.07Å; G180-N205 PolarHBondContact O-N 3.35Å
206	Y	97.3	Very high	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	139.8	-175.9	-56.5	-98.1	0	0	0	111	H69 M86 I116 G117 N119 Q170 R178 I179 C204	H69-Y206 AromaticContact CD2-CE1 3.88Å; H69-Y206 AromaticContact NE2-CE1 3.72Å; H69-Y206 AromaticContact NE2-CZ 3.81Å; H69-Y206 PolarHBondContact NE2-OH 2.97Å; M86-Y206 HydrophobicContact CE-CD1 3.77Å; M86-Y206 HydrophobicContact CE-CE1 4.15Å; I116-Y206 CarbonylContact C-O 3.45Å; I116-Y206 VanDerWaalsContact CA-O 3.31Å; I116-Y206 WeakPolarHBondContact CA-O 3.42Å; I116-Y206 WeakPolarHBondContact CB-O 3.33Å; G117-Y206 PolarHBondContact N-O 2.82Å; G117-Y206 PolarHBondContact O-N 2.95Å; N119-Y206 HydrophobicContact CB-CE2 3.86Å; N119-Y206 PolarHBondContact ND2-OH 3.02Å; Q170-Y206 HydrophobicContact CG-CD1 4.36Å; Q170-Y206 HydrophobicContact CG-CD2 3.55Å; Q170-Y206 HydrophobicContact CG-CE2 3.79Å; Q170-Y206 HydrophobicContact CG-CG 3.87Å; R178-Y206 WeakPolarHBondContact O-CA 3.44Å; I179-Y206 HydrophobicContact CB-CD1 4.4Å; I179-Y206 HydrophobicContact CD1-CD1 4.17Å; I179-Y206 HydrophobicContact CD1-CE1 3.54Å; I179-Y206 HydrophobicContact CG1-CD1 4.15Å; I179-Y206 HydrophobicContact CG1-CE1 4Å; C204-Y206 HydrophobicContact CB-CE2 3.99Å; C204-Y206 WeakPolarHBondContact O-CE2 3.46Å
207	S	92.8	Very high	90.1	Very high	36 Å²	36	48.9 Å²	48.9	25%	0.252	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141.4	173.5	-173.3	0	0	0	0	111.6	S177 R178	S177-S207 PolarHBondContact N-O 2.88Å; S177-S207 VanDerWaalsContact N-O 3.17Å; R178-S207 WeakPolarHBondContact CB-O 3.38Å; R178-S207 PolarHBondContact N-O 3.41Å; R178-S207 PolarHBondContact O-N 3.39Å
208	P	92.6	Very high	90.5	Very high	62 Å²	62	42.8 Å²	42.8	40%	0.403	20%	0.2	S	C	.	.	S	Bend	cis	-52.7	156.5	-20.6	-26.9	31.2	0	0	0	113.8	T175 S176	T175-P208 VanDerWaalsContact O-CD 3.25Å; T175-P208 WeakPolarHBondContact O-CD 3.31Å; S176-P208 WeakPolarHBondContact CB-O 3.4Å; S176-P208 PolarHBondContact OG-O 2.98Å
209	K	89.2	Confident	90.9	Very high	66 Å²	66	42.2 Å²	42.2	29%	0.287	20%	0.197	S	C	.	.			trans	-59	137.5	176.1	175	172.3	-175.1	169.3	0	112.1	L113 I116 W212	L113-K209 PolarHBondContact O-NZ 2.82Å; I116-K209 WeakPolarHBondContact O-CD 3.39Å; K209-W212 PolarHBondContact O-NE1 2.91Å
210	G	88.4	Confident	91.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.215	C	C	.	.			trans	-97.7	-163.5	170.4	0	0	0	0	0	113.5	W212	G210-W212 VanDerWaalsContact C-N 3.29Å; G210-W212 PolarHBondContact O-N 3.46Å
211	N	89.6	Confident	91.3	Very high	56 Å²	56	46.4 Å²	46.4	30%	0.299	22%	0.221	S	C	.	.			trans	56.8	38.4	178	-63.3	-16.3	0	0	0	113.9	T166 T169 Q170 W173 W213	T166-N211 PolarHBondContact O-ND2 2.81Å; T169-N211 VanDerWaalsContact C-OD1 3.3Å; T169-N211 VanDerWaalsContact CB-OD1 3.26Å; T169-N211 WeakPolarHBondContact CB-OD1 3.34Å; T169-N211 PolarHBondContact OG1-OD1 3.2Å; Q170-N211 PolarHBondContact N-OD1 2.99Å; W173-N211 VanDerWaalsContact CZ3-CA 3.42Å; N211-W213 PolarHBondContact O-N 3.3Å
212	W	77.9	Confident	91.4	Very high	146 Å²	146	51.3 Å²	51.3	55%	0.553	25%	0.251	S	S	*	.			trans	-65	129.3	172.3	-71.5	94.9	0	0	0	110.4	W173 K209 G210 G214 H215	W173-W212 HydrophobicContact CH2-CB 4.11Å; W173-W212 VanDerWaalsContact CH2-N 3.27Å; W173-W212 HydrophobicContact CZ2-CB 3.91Å; W173-W212 AromaticContact CZ2-CD1 3.74Å; W173-W212 HydrophobicContact CZ2-CG 4.25Å; K209-W212 PolarHBondContact O-NE1 2.91Å; G210-W212 VanDerWaalsContact C-N 3.29Å; G210-W212 PolarHBondContact O-N 3.46Å; W212-G214 PolarHBondContact O-N 3.46Å; W212-H215 HydrophobicContact CB-CB 4.15Å; W212-H215 PolarHBondContact O-N 3.28Å
213	W	73.4	Confident	91.5	Very high	214 Å²	214	53.2 Å²	53.2	81%	0.811	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	131	-178.1	-172.4	-95.9	0	0	0	110.9	N211 H215	N211-W213 PolarHBondContact O-N 3.3Å; W213-H215 VanDerWaalsContact C-N 3.32Å; W213-H215 PolarHBondContact O-CD2 3.02Å; W213-H215 VanDerWaalsContact O-CD2 3.29Å
214	G	79.4	Confident	91.4	Very high	11 Å²	11	54.4 Å²	54.4	11%	0.113	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	10.5	-179.2	0	0	0	0	0	115	C156 W212	C156-G214 PolarHBondContact N-O 2.63Å; W212-G214 PolarHBondContact O-N 3.46Å
215	H	84.4	Confident	91.3	Very high	120 Å²	120	57.9 Å²	57.9	56%	0.556	30%	0.296	S	S	*	.			trans	-118	146.1	176.1	-65	-90.3	0	0	0	111.6	W173 W212 W213	W173-H215 HydrophobicContact CH2-CB 3.98Å; W173-H215 HydrophobicContact CZ2-CB 4.22Å; W212-H215 HydrophobicContact CB-CB 4.15Å; W212-H215 PolarHBondContact O-N 3.28Å; W213-H215 VanDerWaalsContact C-N 3.32Å; W213-H215 PolarHBondContact O-CD2 3.02Å; W213-H215 VanDerWaalsContact O-CD2 3.29Å
216	S	91.5	Very high	91.1	Very high	31 Å²	31	60.6 Å²	60.6	22%	0.217	32%	0.315	C	S	.	.			trans	-74.6	152.2	169.3	64.8	0	0	0	0	110.4	Y218	S216-Y218 PolarHBondContact O-N 2.89Å; S216-Y218 PolarHBondContact OG-O 3.03Å
217	P	95.5	Very high	91	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.019	32%	0.323	C	S	.	.	S	Bend	trans	-65.3	-28	-179.2	24.9	-33.6	0	0	0	113.3	Y144 F146 V172 W173 A174	Y144-P217 HydrophobicContact CE1-CG 4.43Å; Y144-P217 WeakPolarHBondContact OH-CD 3.45Å; F146-P217 HydrophobicContact CD2-CG 4.28Å; F146-P217 HydrophobicContact CE2-CG 4.17Å; V172-P217 HydrophobicContact CG2-CB 4.08Å; V172-P217 HydrophobicContact CG2-CG 4.38Å; W173-P217 CarbonylContact C-O 3.51Å; W173-P217 WeakPolarHBondContact CA-O 3.31Å; W173-P217 VanDerWaalsContact CE3-CA 3.45Å; W173-P217 HydrophobicContact CE3-CB 3.78Å; W173-P217 HydrophobicContact CZ3-CB 4.09Å; A174-P217 PolarHBondContact N-O 3.09Å
218	Y	97.1	Very high	90.8	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.016	32%	0.322	C	S	.	.	S	Bend	trans	-152.8	171.4	176.9	51.4	-97.2	0	0	0	110.1	V76 Y77 P78 A80 M83 F146 V172 S216	V76-Y218 HydrophobicContact CB-CE1 4.15Å; V76-Y218 HydrophobicContact CG1-CE1 4.41Å; V76-Y218 HydrophobicContact CG2-CE1 3.98Å; V76-Y218 HydrophobicContact CG2-CE2 4.23Å; Y77-Y218 PolarHBondContact O-OH 3.21Å; P78-Y218 WeakPolarHBondContact CD-OH 3.47Å; P78-Y218 HydrophobicContact CG-CE2 4.4Å; P78-Y218 WeakPolarHBondContact O-CE2 3.35Å; P78-Y218 PolarHBondContact O-OH 3.01Å; P78-Y218 VanDerWaalsContact O-OH 3.1Å; A80-Y218 HydrophobicContact CB-CD1 4.44Å; A80-Y218 HydrophobicContact CB-CD2 3.43Å; A80-Y218 VanDerWaalsContact CB-CD2 3.43Å; A80-Y218 HydrophobicContact CB-CE2 4.01Å; A80-Y218 HydrophobicContact CB-CG 3.68Å; M83-Y218 HydrophobicContact CE-CD1 3.67Å; M83-Y218 HydrophobicContact CE-CE1 4.35Å; M83-Y218 HydrophobicContact CE-CG 3.95Å; F146-Y218 HydrophobicContact CD2-CD2 4.42Å; F146-Y218 HydrophobicContact CD2-CE1 4.16Å; F146-Y218 AromaticContact CD2-CE2 3.7Å; F146-Y218 HydrophobicContact CD2-CE2 3.7Å; F146-Y218 AromaticContact CD2-CZ 3.55Å; F146-Y218 HydrophobicContact CE2-CD1 4.26Å; F146-Y218 AromaticContact CE2-CD2 3.5Å; F146-Y218 HydrophobicContact CE2-CD2 3.5Å; F146-Y218 HydrophobicContact CE2-CE1 4.01Å; F146-Y218 AromaticContact CE2-CE2 3.18Å; F146-Y218 HydrophobicContact CE2-CE2 3.18Å; F146-Y218 HydrophobicContact CE2-CG 4.04Å; F146-Y218 AromaticContact CE2-CZ 3.46Å; F146-Y218 VanDerWaalsContact CE2-CZ 3.46Å; F146-Y218 AromaticContact CZ-CD2 3.93Å; F146-Y218 HydrophobicContact CZ-CD2 3.93Å; F146-Y218 AromaticContact CZ-CE2 3.77Å; F146-Y218 HydrophobicContact CZ-CE2 3.77Å; F146-Y218 WeakPolarHBondContact CZ-O 3.47Å; V172-Y218 HydrophobicContact CB-CD1 4.45Å; V172-Y218 HydrophobicContact CB-CE1 4.35Å; V172-Y218 HydrophobicContact CG2-CD1 4.27Å; V172-Y218 HydrophobicContact CG2-CE1 4Å; V172-Y218 WeakPolarHBondContact O-CD1 3.35Å; S216-Y218 PolarHBondContact O-N 2.89Å; S216-Y218 PolarHBondContact OG-O 3.03Å
219	K	95.1	Very high	90.4	Very high	125 Å²	125	65 Å²	65	54%	0.543	34%	0.343	S	S	.	.			trans	-89.5	122.6	173.4	-67.9	-178.6	179.6	-179.4	0	109.8	A80 S81 N82 G221	A80-K219 WeakPolarHBondContact CA-O 3.37Å; S81-K219 PolarHBondContact N-O 2.97Å; S81-K219 VanDerWaalsContact OG-CB 3.29Å; S81-K219 WeakPolarHBondContact OG-CB 3.5Å; S81-K219 PolarHBondContact OG-O 3.25Å; N82-K219 WeakPolarHBondContact OD1-CB 3.25Å; N82-K219 PolarHBondContact OD1-N 2.95Å; K219-G221 PolarHBondContact O-N 3.2Å
220	H	95.6	Very high	90.2	Very high	81 Å²	81	65.9 Å²	65.9	38%	0.375	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-62.2	132.8	172.6	171.5	-126	0	0	0	111.1	P79 F146 Y148	P79-H220 WeakPolarHBondContact O-CA 3.11Å; F146-H220 HydrophobicContact CE1-CB 3.82Å; F146-H220 HydrophobicContact CZ-CB 4.09Å; Y148-H220 AromaticContact CD1-ND1 3.99Å; Y148-H220 AromaticContact CE1-ND1 3.98Å
221	G	95.3	Very high	90	Very high	19 Å²	19	66.4 Å²	66.4	20%	0.196	36%	0.36	C	S	.	.	S	Bend	trans	161.6	-174.6	172	0	0	0	0	0	112.9	P79 K219	P79-G221 CarbonylContact C-O 3.47Å; P79-G221 PolarHBondContact O-N 2.87Å; P79-G221 VanDerWaalsContact O-O 3.12Å; K219-G221 PolarHBondContact O-N 3.2Å
222	T	96.3	Very high	89.4	Confident	104 Å²	104	66.4 Å²	66.4	64%	0.638	37%	0.373	S	S	*	.	S	Bend	trans	-57.7	131.2	176.7	-54.6	0	0	0	0	110.1	S81 C224 S225	S81-T222 VanDerWaalsContact CA-O 3.27Å; S81-T222 WeakPolarHBondContact CA-O 3.35Å; S81-T222 WeakPolarHBondContact CB-O 3.35Å; T222-C224 PolarHBondContact O-N 3.11Å; T222-S225 VanDerWaalsContact O-CB 3.26Å; T222-S225 WeakPolarHBondContact O-CB 3.07Å; T222-S225 PolarHBondContact O-N 2.96Å; T222-S225 VanDerWaalsContact O-N 3.1Å; T222-S225 PolarHBondContact O-OG 3.16Å
223	P	97.3	Very high	89.4	Confident	40 Å²	40	62.6 Å²	62.6	26%	0.26	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	137.1	177.7	-31.2	37.3	0	0	0	113.2	P79 A80 S225 N238	P79-P223 HydrophobicContact CB-CG 4.32Å; A80-P223 WeakPolarHBondContact O-CA 3.43Å; P223-S225 PolarHBondContact O-N 2.83Å; P223-N238 HydrophobicContact CB-CB 3.77Å; P223-N238 WeakPolarHBondContact CB-OD1 3.44Å; P223-N238 HydrophobicContact CG-CB 4.16Å
224	C	95.4	Very high	90.1	Very high	24 Å²	24	53 Å²	53	16%	0.162	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	0.9	-179.5	-51.3	0	0	0	0	117.5	S81 T222 S226 C227 C235	S81-C224 CarbonylContact O-C 3.1Å; S81-C224 VanDerWaalsContact O-C 3.31Å; S81-C224 WeakPolarHBondContact O-CA 3.08Å; S81-C224 PolarHBondContact O-N 3.35Å; T222-C224 PolarHBondContact O-N 3.11Å; C224-S226 PolarHBondContact O-N 3.21Å; C224-C227 WeakPolarHBondContact CA-SG 3.48Å; C224-C227 PolarHBondContact O-N 3.14Å; C224-C227 PolarHBondContact O-SG 2.8Å; C224-C235 HydrophobicContact CB-CB 3.47Å; C224-C235 VanDerWaalsContact CB-CB 3.47Å; C224-C235 WeakPolarHBondContact CB-SG 3Å; C224-C235 WeakPolarHBondContact SG-CB 3.5Å; C224-C235 CovalentContact SG-SG 2.03Å; C224-C235 PolarHBondContact SG-SG 2.89Å
225	S	94.9	Very high	90.8	Very high	74 Å²	74	55.9 Å²	55.9	52%	0.517	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.3	-179	62.4	0	0	0	0	114.7	S81 T222 P223	S81-S225 VanDerWaalsContact CB-OG 3.27Å; S81-S225 WeakPolarHBondContact CB-OG 3.36Å; S81-S225 PolarHBondContact O-N 3.37Å; T222-S225 VanDerWaalsContact O-CB 3.26Å; T222-S225 WeakPolarHBondContact O-CB 3.07Å; T222-S225 PolarHBondContact O-N 2.96Å; T222-S225 VanDerWaalsContact O-N 3.1Å; T222-S225 PolarHBondContact O-OG 3.16Å; P223-S225 PolarHBondContact O-N 2.83Å
226	S	94.9	Very high	91.2	Very high	56 Å²	56	55.9 Å²	55.9	39%	0.392	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.5	33.3	179.9	-68	0	0	0	0	112	S81 N82 C224	S81-S226 CarbonylContact O-C 3.59Å; S81-S226 WeakPolarHBondContact O-CA 3.38Å; S81-S226 PolarHBondContact O-N 2.84Å; N82-S226 WeakPolarHBondContact CB-O 3.45Å; C224-S226 PolarHBondContact O-N 3.21Å
227	C	93.5	Very high	91.4	Very high	27 Å²	27	59.8 Å²	59.8	18%	0.182	38%	0.381	C	S	.	.			trans	-60.4	139.9	173.9	-72	0	0	0	0	111.8	C224 C240	C224-C227 WeakPolarHBondContact CA-SG 3.48Å; C224-C227 PolarHBondContact O-N 3.14Å; C224-C227 PolarHBondContact O-SG 2.8Å; C227-C240 WeakPolarHBondContact CA-SG 3.43Å; C227-C240 HydrophobicContact CB-CB 3.75Å; C227-C240 WeakPolarHBondContact CB-SG 3.25Å; C227-C240 VanDerWaalsContact SG-CA 3.54Å; C227-C240 WeakPolarHBondContact SG-CB 3.37Å; C227-C240 CovalentContact SG-SG 2.03Å; C227-C240 PolarHBondContact SG-SG 3.4Å
228	P	89.2	Confident	91.5	Very high	34 Å²	34	63.4 Å²	63.4	22%	0.221	40%	0.4	C	S	.	.			trans	-60.6	144.7	175.2	-19.7	30.5	0	0	0	111.6	E84 S230 F231	E84-P228 HydrophobicContact CG-CG 4.33Å; P228-S230 PolarHBondContact O-N 3.47Å; P228-F231 HydrophobicContact CB-CD2 4.08Å; P228-F231 HydrophobicContact CG-CD2 4.11Å; P228-F231 HydrophobicContact CG-CE2 4.25Å; P228-F231 PolarHBondContact O-N 2.86Å
229	P	85.3	Confident	91.5	Very high	129 Å²	129	63.3 Å²	63.3	84%	0.838	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-55.9	-26.7	178.9	-27.3	34.9	0	0	0	114.2	F231 G232	P229-F231 PolarHBondContact O-N 3.43Å; P229-F231 VanDerWaalsContact O-N 3.08Å; P229-G232 PolarHBondContact O-N 3.34Å
230	S	83.8	Confident	91.5	Very high	85 Å²	85	57.4 Å²	57.4	59%	0.594	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-62.1	-11.4	176.4	55.2	0	0	0	0	114.7	P228	P228-S230 PolarHBondContact O-N 3.47Å
231	F	84.2	Confident	91.4	Very high	11 Å²	11	56.2 Å²	56.2	5%	0.048	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-97.1	-3.9	174.9	-71.9	-100.8	0	0	0	112.9	E84 P228 P229 G233 G234 C240 K242 V243	E84-F231 HydrophobicContact CB-CE1 4.21Å; E84-F231 HydrophobicContact CB-CE2 4.23Å; E84-F231 HydrophobicContact CB-CZ 3.66Å; E84-F231 HydrophobicContact CG-CE1 4.48Å; E84-F231 HydrophobicContact CG-CE2 3.67Å; E84-F231 HydrophobicContact CG-CZ 3.64Å; E84-F231 WeakPolarHBondContact OE2-CZ 3.44Å; P228-F231 HydrophobicContact CB-CD2 4.08Å; P228-F231 HydrophobicContact CG-CD2 4.11Å; P228-F231 HydrophobicContact CG-CE2 4.25Å; P228-F231 PolarHBondContact O-N 2.86Å; P229-F231 PolarHBondContact O-N 3.43Å; P229-F231 VanDerWaalsContact O-N 3.08Å; F231-G233 PolarHBondContact O-N 2.98Å; F231-G233 VanDerWaalsContact O-N 3.1Å; F231-G234 PolarHBondContact O-N 3.22Å; F231-C240 HydrophobicContact CB-CB 4.23Å; F231-C240 HydrophobicContact CD1-CB 3.93Å; F231-C240 WeakPolarHBondContact CD1-O 3.31Å; F231-C240 HydrophobicContact CE1-CB 4.46Å; F231-C240 VanDerWaalsContact CE1-O 3.27Å; F231-C240 WeakPolarHBondContact CE1-O 3.44Å; F231-C240 HydrophobicContact CG-CB 3.98Å; F231-K242 HydrophobicContact CD1-CG 3.65Å; F231-K242 HydrophobicContact CE1-CG 3.98Å; F231-K242 HydrophobicContact CG-CG 4.14Å; F231-K242 WeakPolarHBondContact O-CA 3.44Å; F231-V243 PolarHBondContact O-N 2.01Å; F231-V243 VanDerWaalsContact O-N 3.12Å
232	G	77.5	Confident	90.9	Very high	56 Å²	56	61.7 Å²	61.7	58%	0.577	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	16.1	173.5	0	0	0	0	0	115	P229 V243	P229-G232 PolarHBondContact O-N 3.34Å; G232-V243 WeakPolarHBondContact O-CG2 3.39Å
233	G	78.1	Confident	90	Very high	66 Å²	66	60.9 Å²	60.9	68%	0.68	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	7.1	176.6	0	0	0	0	0	115.7	F231	F231-G233 PolarHBondContact O-N 2.98Å; F231-G233 VanDerWaalsContact O-N 3.1Å
234	G	87.9	Confident	88.5	Confident	13 Å²	13	67.2 Å²	67.2	13%	0.134	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.3	176.9	0	0	0	0	0	112	F231 C240 Y241	F231-G234 PolarHBondContact O-N 3.22Å; G234-C240 WeakPolarHBondContact O-CA 3.4Å; G234-Y241 VanDerWaalsContact CA-O 3.31Å; G234-Y241 WeakPolarHBondContact CA-O 3.46Å; G234-Y241 PolarHBondContact N-O 3.19Å; G234-Y241 PolarHBondContact O-N 3.43Å
235	C	93.7	Very high	86.3	Confident	72 Å²	72	72 Å²	72	49%	0.486	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.1	175.2	-175.3	0	0	0	0	110	C224 L239	C224-C235 HydrophobicContact CB-CB 3.47Å; C224-C235 VanDerWaalsContact CB-CB 3.47Å; C224-C235 WeakPolarHBondContact CB-SG 3Å; C224-C235 WeakPolarHBondContact SG-CB 3.5Å; C224-C235 CovalentContact SG-SG 2.03Å; C224-C235 PolarHBondContact SG-SG 2.89Å; C235-L239 WeakPolarHBondContact CA-O 3.46Å
236	K	94.1	Very high	83.9	Confident	120 Å²	120	75.7 Å²	75.7	52%	0.522	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	137.2	174.2	168.6	-178.6	179.5	-174.6	0	108.7	N238 L239 Y241	K236-N238 PolarHBondContact O-N 3.26Å; K236-N238 VanDerWaalsContact O-N 3.11Å; K236-L239 PolarHBondContact N-O 3.46Å; K236-L239 VanDerWaalsContact N-O 3.1Å; K236-L239 WeakPolarHBondContact O-CB 3.35Å; K236-L239 PolarHBondContact O-N 3.09Å; K236-Y241 HydrophobicContact CB-CD2 3.57Å; K236-Y241 HydrophobicContact CB-CE2 3.54Å; K236-Y241 HydrophobicContact CB-CG 4.3Å; K236-Y241 HydrophobicContact CD-CE1 4.5Å; K236-Y241 HydrophobicContact CD-CE2 4.14Å; K236-Y241 HydrophobicContact CG-CD2 4.4Å; K236-Y241 HydrophobicContact CG-CE2 3.9Å; K236-Y241 WeakPolarHBondContact O-CE2 3.42Å
237	D	94.6	Very high	81.6	Confident	112 Å²	112	83.6 Å²	83.6	60%	0.599	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	37.6	-180	-55.9	-43.6	0	0	0	113.7	G74 L239	G74-D237 WeakPolarHBondContact CA-O 3.42Å; D237-L239 VanDerWaalsContact C-N 3.25Å; D237-L239 PolarHBondContact O-N 3.45Å
238	N	97.2	Very high	79.1	Confident	79 Å²	79	86.9 Å²	86.9	42%	0.422	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	16.4	-175.7	-56.1	-37.3	0	0	0	115.7	G74 P223 K236	G74-N238 PolarHBondContact O-ND2 2.04Å; P223-N238 HydrophobicContact CB-CB 3.77Å; P223-N238 WeakPolarHBondContact CB-OD1 3.44Å; P223-N238 HydrophobicContact CG-CB 4.16Å; K236-N238 PolarHBondContact O-N 3.26Å; K236-N238 VanDerWaalsContact O-N 3.11Å
239	L	96.9	Very high	76.4	Confident	3 Å²	3	91.8 Å²	91.8	2%	0.016	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	149.4	178.6	-56.2	174.5	0	0	0	111.6	N70 R73 M83 H85 C235 K236 D237 Y241	N70-L239 HydrophobicContact CB-CD1 3.77Å; R73-L239 HydrophobicContact CB-CD2 3.81Å; M83-L239 HydrophobicContact CB-CD2 3.96Å; M83-L239 HydrophobicContact CG-CD2 3.33Å; M83-L239 CarbonylContact O-C 3.53Å; M83-L239 WeakPolarHBondContact O-CA 3.02Å; H85-L239 HydrophobicContact CB-CB 4.25Å; C235-L239 WeakPolarHBondContact CA-O 3.46Å; K236-L239 PolarHBondContact N-O 3.46Å; K236-L239 VanDerWaalsContact N-O 3.1Å; K236-L239 WeakPolarHBondContact O-CB 3.35Å; K236-L239 PolarHBondContact O-N 3.09Å; D237-L239 VanDerWaalsContact C-N 3.25Å; D237-L239 PolarHBondContact O-N 3.45Å; L239-Y241 HydrophobicContact CB-CD2 4.27Å; L239-Y241 HydrophobicContact CB-CE2 4Å; L239-Y241 WeakPolarHBondContact O-CD2 3.28Å; L239-Y241 PolarHBondContact O-N 3.2Å
240	C	95.8	Very high	74	Confident	0 Å²	0	91 Å²	91	0%	0	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	117.4	171.6	-52.5	0	0	0	0	109.9	M83 H85 C227 F231 G234	M83-C240 PolarHBondContact O-N 3.18Å; M83-C240 PolarHBondContact O-SG 3.42Å; M83-C240 VanDerWaalsContact O-SG 3.4Å; H85-C240 WeakPolarHBondContact CB-O 3Å; H85-C240 PolarHBondContact N-O 3.37Å; C227-C240 WeakPolarHBondContact CA-SG 3.43Å; C227-C240 HydrophobicContact CB-CB 3.75Å; C227-C240 WeakPolarHBondContact CB-SG 3.25Å; C227-C240 VanDerWaalsContact SG-CA 3.54Å; C227-C240 WeakPolarHBondContact SG-CB 3.37Å; C227-C240 CovalentContact SG-SG 2.03Å; C227-C240 PolarHBondContact SG-SG 3.4Å; F231-C240 HydrophobicContact CB-CB 4.23Å; F231-C240 HydrophobicContact CD1-CB 3.93Å; F231-C240 WeakPolarHBondContact CD1-O 3.31Å; F231-C240 HydrophobicContact CE1-CB 4.46Å; F231-C240 VanDerWaalsContact CE1-O 3.27Å; F231-C240 WeakPolarHBondContact CE1-O 3.44Å; F231-C240 HydrophobicContact CG-CB 3.98Å; G234-C240 WeakPolarHBondContact O-CA 3.4Å
241	Y	93.4	Very high	71.7	Confident	56 Å²	56	93 Å²	93	22%	0.22	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.3	176.8	-87.1	-97.6	0	0	0	110.6	H85 G234 K236 L239 V243	H85-Y241 HydrophobicContact CB-CD1 4.35Å; H85-Y241 HydrophobicContact CB-CD2 4.18Å; H85-Y241 HydrophobicContact CB-CE1 4.3Å; H85-Y241 HydrophobicContact CB-CE2 4.16Å; H85-Y241 HydrophobicContact CB-CG 4.31Å; H85-Y241 AromaticContact CD2-CE1 3.42Å; H85-Y241 VanDerWaalsContact CD2-CE1 3.42Å; H85-Y241 WeakPolarHBondContact CD2-CE1 3.4Å; H85-Y241 AromaticContact CD2-CE2 3.66Å; H85-Y241 AromaticContact CD2-CZ 3.06Å; H85-Y241 PolarHBondContact CD2-OH 2.79Å; H85-Y241 AromaticContact CE1-CE1 3.7Å; H85-Y241 AromaticContact CG-CE1 3.59Å; H85-Y241 AromaticContact CG-CZ 3.62Å; H85-Y241 AromaticContact ND1-CE1 3.77Å; H85-Y241 AromaticContact NE2-CE1 3.47Å; H85-Y241 WeakPolarHBondContact NE2-CE1 3.47Å; H85-Y241 AromaticContact NE2-CZ 3.41Å; H85-Y241 PolarHBondContact NE2-OH 2.61Å; G234-Y241 VanDerWaalsContact CA-O 3.31Å; G234-Y241 WeakPolarHBondContact CA-O 3.46Å; G234-Y241 PolarHBondContact N-O 3.19Å; G234-Y241 PolarHBondContact O-N 3.43Å; K236-Y241 HydrophobicContact CB-CD2 3.57Å; K236-Y241 HydrophobicContact CB-CE2 3.54Å; K236-Y241 HydrophobicContact CB-CG 4.3Å; K236-Y241 HydrophobicContact CD-CE1 4.5Å; K236-Y241 HydrophobicContact CD-CE2 4.14Å; K236-Y241 HydrophobicContact CG-CD2 4.4Å; K236-Y241 HydrophobicContact CG-CE2 3.9Å; K236-Y241 WeakPolarHBondContact O-CE2 3.42Å; L239-Y241 HydrophobicContact CB-CD2 4.27Å; L239-Y241 HydrophobicContact CB-CE2 4Å; L239-Y241 WeakPolarHBondContact O-CD2 3.28Å; L239-Y241 PolarHBondContact O-N 3.2Å; Y241-V243 PolarHBondContact O-N 3.19Å
242	K	85.8	Confident	69.4	Low	134 Å²	134	101 Å²	101	58%	0.583	56%	0.561	S	S	*	*			trans	-71.1	119	171.6	-69	-173.5	175.1	-177.8	0	108.3	F231 E244	F231-K242 HydrophobicContact CD1-CG 3.65Å; F231-K242 HydrophobicContact CE1-CG 3.98Å; F231-K242 HydrophobicContact CG-CG 4.14Å; F231-K242 WeakPolarHBondContact O-CA 3.44Å; K242-E244 PolarHBondContact O-N 3.2Å
243	V	75.8	Confident	67.2	Low	88 Å²	88	107.4 Å²	107.4	53%	0.533	58%	0.576	S	S	.	*			trans	-71.3	111.2	166.2	-175.1	0	0	0	0	106.7	F231 G232 Y241 D245	F231-V243 PolarHBondContact O-N 2.01Å; F231-V243 VanDerWaalsContact O-N 3.12Å; G232-V243 WeakPolarHBondContact O-CG2 3.39Å; Y241-V243 PolarHBondContact O-N 3.19Å; V243-D245 PolarHBondContact O-N 3.31Å
244	E	67.2	Low	64.9	Low	173 Å²	173	112.8 Å²	112.8	81%	0.808	58%	0.584	S	S	*	*			trans	-70.2	123.6	166.4	-64.5	-170.8	170.3	0	0	107.2	K242 D246	K242-E244 PolarHBondContact O-N 3.2Å; E244-D246 PolarHBondContact O-N 3.43Å
245	D	48.6	Very low	62.1	Low	125 Å²	125	118.1 Å²	118.1	67%	0.668	61%	0.614	S	S	*	*			trans	-66.5	106.3	173.4	-171.9	15.7	0	0	0	107.2	V243 R247	V243-D245 PolarHBondContact O-N 3.31Å; D245-R247 PolarHBondContact O-N 3.4Å
246	D	43.9	Very low	59.1	Low	150 Å²	150	123.8 Å²	123.8	80%	0.802	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	42.7	-174.5	-159.2	17.8	0	0	0	112.3	E244	E244-D246 PolarHBondContact O-N 3.43Å
247	R	48.2	Very low	56.2	Low	223 Å²	223	127.2 Å²	127.2	84%	0.842	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	11.7	-179.4	-74.5	-172.6	172	-172.5	-0.2	114	D245	D245-R247 PolarHBondContact O-N 3.4Å
248	S	40.6	Very low	53	Low	96 Å²	96	127.1 Å²	127.1	67%	0.671	66%	0.659	S	S	*	*	S	Bend	trans	-141.3	25.4	176	65.4	0	0	0	0	116.3
249	N	32	Very low	49.7	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	68%	0.678	S	S	*	*			trans	-149.2	110	162.3	-88.6	-29.4	0	0	0	110.6
250	P	34.8	Very low	46.3	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	72%	0.715	S	S	*	*			trans	-67	149.9	163.9	-7.5	23.6	0	0	0	109.6	L252	P250-L252 PolarHBondContact O-N 3.14Å
251	P	35.1	Very low	43.1	Very low	127 Å²	127	145.5 Å²	145.5	83%	0.825	75%	0.748	S	S	*	*			trans	-63.5	131	175.1	-13	26.9	0	0	0	110.1	E253	P251-E253 PolarHBondContact O-N 2.84Å
252	L	35.8	Very low	40.2	Very low	178 Å²	178	151 Å²	151	93%	0.932	78%	0.775	S	S	*	*			trans	-75	103.8	168.8	-73	164.4	0	0	0	108.4	P250	P250-L252 PolarHBondContact O-N 3.14Å
253	E	31.9	Very low	37.5	Very low	192 Å²	192	150.9 Å²	150.9	90%	0.897	79%	0.788	S	S	*	*			trans	-86.8	146.9	158.4	-97	-179.7	162.6	0	0	110.3	P251	P251-E253 PolarHBondContact O-N 2.84Å
254	E	29.9	Very low	35.1	Very low	179 Å²	179	155.7 Å²	155.7	84%	0.836	81%	0.805	S	S	*	*			trans	-71.4	142.1	-171.1	-68.3	177.2	148.5	0	0	114
255	T	29.8	Very low	33.5	Very low	124 Å²	124	151 Å²	151	76%	0.761	80%	0.803	S	S	*	*			trans	55.6	122.1	146.4	58.4	0	0	0	0	120.6
256	E	30.5	Very low	32.7	Very low	191 Å²	191	151.5 Å²	151.5	89%	0.893	81%	0.813	S	S	*	*				174.4	148.9	99.9	-88.2	-171	167.7	0	0	111.6
257	E	31.9	Very low	31.9	Very low	193 Å²	193	156.3 Å²	156.3	90%	0.902	82%	0.82	S	S	*	*			trans	-65.7	143.4	-177.1	-66.5	177.4	125.7	0	0	113.9
258	S	28.9	Very low	30.9	Very low	110 Å²	110	148.9 Å²	148.9	77%	0.769	81%	0.813	S	S	*	*				174.6	126.6	123.9	42.8	0	0	0	0	114
259	N	27.8	Very low	30.2	Very low	152 Å²	152	151 Å²	151	81%	0.813	82%	0.821	S	S	*	*			trans	25.7	122.9	143.4	-62.2	-38.1	0	0	0	120.9
260	F	25.8	Very low	30.4	Very low	183 Å²	183	151.5 Å²	151.5	80%	0.803	82%	0.824	S	S	*	*				151.1	128.2	101.4	-136	-123.9	0	0	0	114
261	I	27.9	Very low	30.2	Very low	133 Å²	133	152.1 Å²	152.1	68%	0.682	83%	0.829	S	S	*	*			trans	58.1	126.3	148.9	-62.3	-175.1	0	0	0	122.5
262	E	31.4	Very low	29.8	Very low	172 Å²	172	157.9 Å²	157.9	80%	0.804	83%	0.834	S	S	*	*			trans	-58.5	158	168	-75.7	-175.2	142.9	0	0	115.1
263	P	29.6	Very low	29.2	Very low	130 Å²	130	154.8 Å²	154.8	84%	0.844	83%	0.827	S	S	*	*				-138.6	155.1	113.1	26.1	-7.4	0	0	0	115.6
264	E	25.7	Very low	28.9	Very low	189 Å²	189	157.1 Å²	157.1	88%	0.883	83%	0.828	S	S	*	*			trans	-66.1	151.3	178.8	-73.3	-169.9	135.4	0	0	116.7
265	G	32.9	Very low	28.6	Very low	75 Å²	75	153.5 Å²	153.5	77%	0.773	83%	0.828	S	S	*	*			trans	84.8	152.9	138.6	0	0	0	0	0	118.8
266	P	31.7	Very low	28.4	Very low	136 Å²	136	153.3 Å²	153.3	88%	0.883	83%	0.832	S	S	*	*			cis	-137.3	179.8	27.5	39.1	-18.6	0	0	0	117.7
267	R	28.1	Very low	28.3	Very low	251 Å²	251	153.1 Å²	153.1	95%	0.947	83%	0.832	S	S	*	*			trans	-66	160.3	-176.8	-66.3	169.6	175.2	171.7	-1.4	117
268	G	26.5	Very low	28.1	Very low	67 Å²	67	152.9 Å²	152.9	69%	0.691	83%	0.83	S	S	*	*			trans	116.7	138.8	147.3	0	0	0	0	0	112.8
269	T	26.5	Very low	27.9	Very low	139 Å²	139	155.2 Å²	155.2	85%	0.853	83%	0.834	S	S	*	*			cis	-172.6	140.1	9.9	14.6	0	0	0	0	106.5
270	N	36.6	Very low	28.3	Very low	149 Å²	149	156.2 Å²	156.2	80%	0.797	84%	0.839	S	S	*	*			trans	-64.6	155.2	162	-91.3	-12.2	0	0	0	110.3
271	P	30.6	Very low	28.5	Very low	125 Å²	125	155.6 Å²	155.6	81%	0.812	84%	0.838	S	S	*	*				-138.6	137.7	118.9	19.2	1.4	0	0	0	115
272	W	25.1	Very low	28.7	Very low	247 Å²	247	158.8 Å²	158.8	94%	0.936	85%	0.847	S	S	*	*			trans	-67	145.1	157.1	-92.7	21.2	0	0	0	112.5
273	S	25.1	Very low	28.5	Very low	114 Å²	114	157.6 Å²	157.6	80%	0.797	85%	0.846	S	S	*	*			trans	-172.1	146.3	144.9	59.5	0	0	0	0	107.7
274	R	24.7	Very low	28.7	Very low	240 Å²	240	157.1 Å²	157.1	91%	0.906	83%	0.833	S	S	*	*			cis	-165.8	141.3	-7.9	-138.1	170.1	-179.8	161	-2.7	104.5
275	A	24.5	Very low	28.8	Very low	103 Å²	103	153.8 Å²	153.8	85%	0.851	83%	0.825	S	S	*	*			trans	-75.9	149.8	173.8	0	0	0	0	0	111.7
276	S	25.7	Very low	28.8	Very low	120 Å²	120	153.9 Å²	153.9	84%	0.839	81%	0.811	S	S	*	*			trans	-120.4	121	158.8	59.9	0	0	0	0	109.1
277	E	26.7	Very low	28.9	Very low	188 Å²	188	153.7 Å²	153.7	88%	0.879	80%	0.801	S	S	*	*			trans	-73	135.3	166.3	-74	169.8	133.5	0	0	110.1
278	E	28.1	Very low	29.4	Very low	188 Å²	188	146.4 Å²	146.4	88%	0.879	78%	0.779	S	S	*	*			trans	162	94.2	138.1	-91.5	178.3	176.9	0	0	108.7
279	D	25.5	Very low	30.6	Very low	159 Å²	159	148 Å²	148	85%	0.85	77%	0.769	S	S	*	*				-171.5	109.1	123.7	-122.2	-21.1	0	0	0	111	Q281	D279-Q281 PolarHBondContact O-N 3.46Å
280	L	36	Very low	32	Very low	173 Å²	173	144.1 Å²	144.1	91%	0.906	74%	0.741	S	S	*	*			trans	-84.7	94.2	171.8	-86.6	162.4	0	0	0	109
281	Q	30.6	Very low	32.9	Very low	169 Å²	169	138.2 Å²	138.2	79%	0.79	71%	0.709	S	S	*	*			trans	-126.1	108.8	153.6	-98.6	171	-2.7	0	0	110	D279 N283	D279-Q281 PolarHBondContact O-N 3.46Å; Q281-N283 PolarHBondContact O-N 2.97Å
282	K	31.8	Very low	34.2	Very low	200 Å²	200	133 Å²	133	87%	0.87	68%	0.675	S	S	*	*			trans	-54.6	97.3	167.3	-82.9	177.7	171.8	177.6	0	109.4	E284	K282-E284 VanDerWaalsContact C-N 3.28Å; K282-E284 PolarHBondContact O-N 3.02Å
283	N	27	Very low	36.4	Very low	148 Å²	148	124.3 Å²	124.3	79%	0.791	65%	0.645	S	S	*	*			trans	-80.7	86.3	152.7	-85.5	-8.9	0	0	0	107.7	Q281 V285	Q281-N283 PolarHBondContact O-N 2.97Å; N283-V285 VanDerWaalsContact C-N 3.25Å; N283-V285 PolarHBondContact O-N 3.02Å
284	E	32.4	Very low	38.8	Very low	120 Å²	120	124.4 Å²	124.4	56%	0.561	64%	0.636	S	S	*	*			trans	-65.5	91.5	162.4	-164.7	173.4	-125.9	0	0	106.6	K282 V286 R461	K282-E284 VanDerWaalsContact C-N 3.28Å; K282-E284 PolarHBondContact O-N 3.02Å; E284-V286 VanDerWaalsContact C-N 3.27Å; E284-V286 HydrophobicContact CG-CG2 4.37Å; E284-V286 PolarHBondContact O-N 3.02Å; E284-R461 IonicContact OE2-NH2 3Å; E284-R461 PolarHBondContact OE2-NH2 2.81Å
285	V	28.6	Very low	41.7	Very low	119 Å²	119	113.5 Å²	113.5	72%	0.721	60%	0.596	S	S	*	*			trans	-71.6	88.8	175	-177.8	0	0	0	0	107.6	N283 I287	N283-V285 VanDerWaalsContact C-N 3.25Å; N283-V285 PolarHBondContact O-N 3.02Å; V285-I287 HydrophobicContact CG1-CG1 4.26Å; V285-I287 PolarHBondContact O-N 3.26Å; V285-I287 VanDerWaalsContact O-N 3.15Å
286	V	33.8	Very low	44.7	Very low	77 Å²	77	112.6 Å²	112.6	47%	0.467	58%	0.58	S	S	.	*			trans	-70.6	105	167.3	-176.2	0	0	0	0	106.9	E284 I288	E284-V286 VanDerWaalsContact C-N 3.27Å; E284-V286 HydrophobicContact CG-CG2 4.37Å; E284-V286 PolarHBondContact O-N 3.02Å; V286-I288 VanDerWaalsContact C-N 3.33Å; V286-I288 HydrophobicContact CB-CG1 4.39Å; V286-I288 HydrophobicContact CG1-CG1 3.77Å; V286-I288 PolarHBondContact O-N 2.88Å
287	I	32	Very low	47.7	Very low	132 Å²	132	107.8 Å²	107.8	68%	0.677	55%	0.547	S	S	*	.			trans	-72.6	92.8	172.2	-60.7	173.9	0	0	0	107.2	V285 Q289	V285-I287 HydrophobicContact CG1-CG1 4.26Å; V285-I287 PolarHBondContact O-N 3.26Å; V285-I287 VanDerWaalsContact O-N 3.15Å; I287-Q289 VanDerWaalsContact C-N 3.32Å; I287-Q289 PolarHBondContact O-N 3.23Å
288	I	39.4	Very low	50.6	Low	97 Å²	97	102.4 Å²	102.4	50%	0.497	52%	0.524	S	S	.	.			trans	-80.1	84	175.2	-58.1	176.8	0	0	0	107.9	V286 Q290 I507	V286-I288 VanDerWaalsContact C-N 3.33Å; V286-I288 HydrophobicContact CB-CG1 4.39Å; V286-I288 HydrophobicContact CG1-CG1 3.77Å; V286-I288 PolarHBondContact O-N 2.88Å; I288-Q290 HydrophobicContact CG2-CG 3.98Å; I288-I507 HydrophobicContact CD1-CD1 4.25Å; I288-I507 HydrophobicContact CG2-CD1 3.3Å; I288-I507 HydrophobicContact CG2-CG1 4.13Å
289	Q	52.1	Low	53.5	Low	100 Å²	100	94.1 Å²	94.1	47%	0.467	49%	0.486	S	S	.	.			trans	-93.5	116.3	163	-154.9	168.5	6.7	0	0	106.8	I287 F504	I287-Q289 VanDerWaalsContact C-N 3.32Å; I287-Q289 PolarHBondContact O-N 3.23Å; Q289-F504 HydrophobicContact CB-CD1 4.02Å; Q289-F504 HydrophobicContact CB-CE1 4.3Å; Q289-F504 HydrophobicContact CG-CD1 4.04Å; Q289-F504 HydrophobicContact CG-CE1 3.88Å; Q289-F504 WeakPolarHBondContact O-CB 3.24Å; Q289-F504 VanDerWaalsContact O-CD1 3.3Å; Q289-F504 WeakPolarHBondContact O-CD1 3.46Å
290	Q	55.4	Low	56.5	Low	59 Å²	59	90.5 Å²	90.5	28%	0.276	46%	0.463	S	S	.	.			trans	-96.2	146.7	178	-68.6	-179.7	-47.5	0	0	111.2	I288 I507	I288-Q290 HydrophobicContact CG2-CG 3.98Å; Q290-I507 HydrophobicContact CG-CD1 4.14Å; Q290-I507 HydrophobicContact CG-CG1 4.46Å; Q290-I507 VanDerWaalsContact NE2-CG1 3.32Å
291	M	54.6	Low	58.9	Low	25 Å²	25	82.3 Å²	82.3	12%	0.123	42%	0.42	C	S	.	.	S	Bend	trans	-83.7	-28.4	172.5	-93.8	176.4	76.7	0	0	113.6	D469 M471 F504	M291-D469 HydrophobicContact CB-CB 4.02Å; M291-D469 HydrophobicContact CE-CB 4.41Å; M291-D469 HydrophobicContact CG-CB 4.25Å; M291-D469 VanDerWaalsContact SD-C 3.54Å; M291-D469 HydrophobicContact SD-CB 3.48Å; M291-D469 WeakPolarHBondContact SD-CB 3.12Å; M291-M471 HydrophobicContact CE-CB 3.63Å; M291-M471 HydrophobicContact CE-CG 4.13Å; M291-M471 HydrophobicContact SD-CB 3.79Å; M291-F504 HydrophobicContact CB-CB 4.19Å; M291-F504 HydrophobicContact CB-CD2 4.49Å; M291-F504 HydrophobicContact CB-CG 4.29Å; M291-F504 HydrophobicContact CG-CB 3.69Å; M291-F504 HydrophobicContact CG-CD1 3.9Å; M291-F504 HydrophobicContact CG-CD2 3.21Å; M291-F504 HydrophobicContact CG-CE1 4.28Å; M291-F504 HydrophobicContact CG-CE2 3.62Å; M291-F504 HydrophobicContact CG-CG 3.35Å; M291-F504 HydrophobicContact CG-CZ 4.14Å; M291-F504 HydrophobicContact SD-CB 4.1Å; M291-F504 HydrophobicContact SD-CD2 3.21Å; M291-F504 WeakPolarHBondContact SD-CD2 3.24Å; M291-F504 HydrophobicContact SD-CE2 3.71Å; M291-F504 HydrophobicContact SD-CG 3.89Å
292	S	59.5	Low	61.3	Low	14 Å²	14	80.7 Å²	80.7	10%	0.098	41%	0.406	C	S	.	.	S	Bend	trans	-78.2	136.7	178.6	44.3	0	0	0	0	110.8	R316 E318	S292-R316 WeakPolarHBondContact CA-O 3Å; S292-E318 PolarHBondContact OG-OE2 3.43Å; S292-E318 VanDerWaalsContact OG-OE2 3.11Å
293	Q	70.7	Confident	63.6	Low	66 Å²	66	74.7 Å²	74.7	31%	0.308	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	118	164.8	-64.6	177.8	16	0	0	108	V295 R316 Y317 E318	Q293-V295 PolarHBondContact O-N 3.44Å; Q293-R316 PolarHBondContact N-O 3.16Å; Q293-R316 VanDerWaalsContact N-O 3.16Å; Q293-Y317 HydrophobicContact CB-CD1 3.83Å; Q293-Y317 HydrophobicContact CB-CE1 3.97Å; Q293-Y317 VanDerWaalsContact OE1-CE1 3.26Å; Q293-E318 PolarHBondContact O-N 3.4Å; Q293-E318 VanDerWaalsContact O-N 3.07Å
294	L	75.5	Confident	65.8	Low	116 Å²	116	70.8 Å²	70.8	61%	0.607	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	124	169.9	-77.5	149.2	0	0	0	108.8	E318	L294-E318 HydrophobicContact CD2-CG 4.41Å
295	V	84.7	Confident	67.3	Low	11 Å²	11	65.5 Å²	65.5	7%	0.067	34%	0.337	C	S	.	.			trans	-127.7	157.8	-177.8	-69.5	0	0	0	0	111.4	Q293 T299 Q304 Y317 E318 P320 C343	Q293-V295 PolarHBondContact O-N 3.44Å; V295-T299 HydrophobicContact CB-CG2 3.9Å; V295-T299 HydrophobicContact CG1-CG2 3.72Å; V295-Q304 HydrophobicContact CG1-CG 4.28Å; V295-Y317 HydrophobicContact CG1-CD1 3.49Å; V295-Y317 VanDerWaalsContact CG1-CD1 3.49Å; V295-Y317 HydrophobicContact CG1-CE1 4.02Å; V295-Y317 HydrophobicContact CG2-CD1 4.36Å; V295-E318 WeakPolarHBondContact CG2-O 3.24Å; V295-E318 PolarHBondContact N-O 3.34Å; V295-E318 VanDerWaalsContact N-O 3.15Å; V295-P320 WeakPolarHBondContact O-CD 3.36Å; V295-C343 VanDerWaalsContact CG2-SG 3.56Å
296	T	89	Confident	68.4	Low	84 Å²	84	67.3 Å²	67.3	52%	0.515	34%	0.335	S	S	.	.			trans	-91.2	162.2	172	65.5	0	0	0	0	110.7	D298 T299	T296-D298 PolarHBondContact O-N 2.92Å; T296-T299 PolarHBondContact N-OG1 2.74Å; T296-T299 WeakPolarHBondContact O-CB 3.06Å; T296-T299 PolarHBondContact O-N 2.92Å; T296-T299 PolarHBondContact O-OG1 3.09Å; T296-T299 PolarHBondContact OG1-N 3.07Å; T296-T299 PolarHBondContact OG1-OG1 2.75Å
297	C	88	Confident	69.2	Low	19 Å²	19	66.3 Å²	66.3	13%	0.128	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.1	177.6	-61	0	0	0	0	114.2	C323 A326 S341	C297-C323 WeakPolarHBondContact CA-SG 3.45Å; C297-C323 HydrophobicContact CB-CB 3.59Å; C297-C323 WeakPolarHBondContact CB-SG 3.05Å; C297-C323 WeakPolarHBondContact SG-CA 3.21Å; C297-C323 WeakPolarHBondContact SG-CB 3.38Å; C297-C323 CovalentContact SG-SG 2.04Å; C297-C323 PolarHBondContact SG-SG 3.27Å; C297-A326 HydrophobicContact CB-CB 3.41Å; C297-A326 VanDerWaalsContact CB-CB 3.41Å; C297-S341 WeakPolarHBondContact O-CB 3.28Å; C297-S341 PolarHBondContact O-OG 3.36Å
298	D	87.4	Confident	69.4	Low	74 Å²	74	61.9 Å²	61.9	40%	0.396	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-2.9	-179.5	-60.1	-46.2	0	0	0	113.6	T296 K300 A327 G328	T296-D298 PolarHBondContact O-N 2.92Å; D298-K300 PolarHBondContact O-N 2.84Å; D298-A327 PolarHBondContact OD1-N 2.84Å; D298-G328 WeakPolarHBondContact OD1-CA 2.92Å; D298-G328 PolarHBondContact OD1-N 2.97Å
299	T	88.6	Confident	69.7	Low	14 Å²	14	60.7 Å²	60.7	9%	0.086	32%	0.317	C	S	.	.			trans	-62.1	119.4	-177.4	-67.6	0	0	0	0	110.9	V295 T296 Q304 S341 V342	V295-T299 HydrophobicContact CB-CG2 3.9Å; V295-T299 HydrophobicContact CG1-CG2 3.72Å; T296-T299 PolarHBondContact N-OG1 2.74Å; T296-T299 WeakPolarHBondContact O-CB 3.06Å; T296-T299 PolarHBondContact O-N 2.92Å; T296-T299 PolarHBondContact O-OG1 3.09Å; T296-T299 PolarHBondContact OG1-N 3.07Å; T296-T299 PolarHBondContact OG1-OG1 2.75Å; T299-Q304 HydrophobicContact CG2-CG 3.39Å; T299-Q304 VanDerWaalsContact CG2-NE2 3.27Å; T299-S341 WeakPolarHBondContact O-CA 3.4Å; T299-V342 PolarHBondContact O-N 3.26Å
300	K	90.1	Very high	69.6	Low	84 Å²	84	56 Å²	56	37%	0.365	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-87.6	146.7	177.4	-53.8	169.5	-176.4	161.4	0	110.2	D298 R302 D303 Q304 Q339 S340	D298-K300 PolarHBondContact O-N 2.84Å; K300-R302 PolarHBondContact O-N 3.31Å; K300-D303 WeakPolarHBondContact CB-OD2 3.45Å; K300-D303 WeakPolarHBondContact O-CB 3.26Å; K300-D303 PolarHBondContact O-N 3.33Å; K300-Q304 PolarHBondContact O-N 2.94Å; K300-Q339 VanDerWaalsContact CD-O 3.3Å; K300-Q339 WeakPolarHBondContact CD-O 3.16Å; K300-Q339 VanDerWaalsContact CG-O 3.29Å; K300-Q339 WeakPolarHBondContact CG-O 3.18Å; K300-S340 WeakPolarHBondContact CA-O 3.43Å
301	L	84.8	Confident	69.3	Low	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-35.3	178	-173.1	63.2	0	0	0	111.9	D303 Q304 C305 Y317 M338 S340 V342 V361 R363 F390	L301-D303 PolarHBondContact O-N 2.94Å; L301-Q304 PolarHBondContact O-N 2.69Å; L301-C305 WeakPolarHBondContact O-CB 3.46Å; L301-C305 PolarHBondContact O-N 3.09Å; L301-C305 PolarHBondContact O-SG 3.25Å; L301-C305 VanDerWaalsContact O-SG 3.39Å; L301-Y317 HydrophobicContact CD1-CE2 4.02Å; L301-M338 PolarHBondContact N-O 3.21Å; L301-S340 PolarHBondContact N-O 3.13Å; L301-V342 HydrophobicContact CB-CG2 3.81Å; L301-V342 HydrophobicContact CD1-CG2 4.05Å; L301-V361 HydrophobicContact CD1-CB 4.49Å; L301-V361 HydrophobicContact CD1-CG1 3.73Å; L301-V361 HydrophobicContact CD2-CG1 3.65Å; L301-V361 HydrophobicContact CG-CG1 4.33Å; L301-R363 HydrophobicContact CD2-CG 4.19Å; L301-F390 HydrophobicContact CB-CD1 4.04Å; L301-F390 HydrophobicContact CB-CE1 3.78Å; L301-F390 HydrophobicContact CB-CZ 4.22Å; L301-F390 HydrophobicContact CD2-CB 3.34Å; L301-F390 HydrophobicContact CD2-CD1 3.28Å; L301-F390 HydrophobicContact CD2-CD2 3.94Å; L301-F390 HydrophobicContact CD2-CE1 3.89Å; L301-F390 HydrophobicContact CD2-CE2 4.49Å; L301-F390 HydrophobicContact CD2-CG 3.27Å; L301-F390 HydrophobicContact CD2-CZ 4.46Å; L301-F390 HydrophobicContact CG-CD1 4.3Å; L301-F390 HydrophobicContact CG-CE1 4.5Å
302	R	82.7	Confident	69	Low	134 Å²	134	66.1 Å²	66.1	51%	0.506	34%	0.338	S	S	.	.	H	α-helix	trans	-59.9	-34.2	176	-175	178	-175.1	-173.5	1.4	112.5	K300 C305 M338	K300-R302 PolarHBondContact O-N 3.31Å; R302-C305 CarbonylContact O-C 3.49Å; R302-C305 PolarHBondContact O-N 3.37Å; R302-M338 HydrophobicContact CB-CB 4.23Å; R302-M338 HydrophobicContact CB-CE 4.18Å; R302-M338 WeakPolarHBondContact CB-O 3.43Å; R302-M338 HydrophobicContact CG-CE 4.1Å; R302-M338 PolarHBondContact N-O 2.94Å
303	D	80.1	Confident	69	Low	75 Å²	75	66.5 Å²	66.5	40%	0.401	34%	0.34	S	S	.	.	H	α-helix	trans	-72.9	-36.7	-176.7	-60.1	-25.6	0	0	0	110.8	K300 L301	K300-D303 WeakPolarHBondContact CB-OD2 3.45Å; K300-D303 WeakPolarHBondContact O-CB 3.26Å; K300-D303 PolarHBondContact O-N 3.33Å; L301-D303 PolarHBondContact O-N 2.94Å
304	Q	72.1	Confident	68.9	Low	66 Å²	66	64 Å²	64	31%	0.308	33%	0.33	S	S	.	.	H	α-helix	trans	-79.5	-22.8	174.6	-59.7	-57.2	-26.2	0	0	113	V295 T299 K300 L301 Y317	V295-Q304 HydrophobicContact CG1-CG 4.28Å; T299-Q304 HydrophobicContact CG2-CG 3.39Å; T299-Q304 VanDerWaalsContact CG2-NE2 3.27Å; K300-Q304 PolarHBondContact O-N 2.94Å; L301-Q304 PolarHBondContact O-N 2.69Å; Q304-Y317 HydrophobicContact CB-CE1 3.97Å; Q304-Y317 HydrophobicContact CG-CE1 3.96Å
305	C	64.5	Low	68.8	Low	9 Å²	9	59.5 Å²	59.5	6%	0.061	31%	0.306	C	S	.	.			trans	-107.5	66.4	-178.8	-69	0	0	0	0	113.1	L301 R302 C310 R363	L301-C305 WeakPolarHBondContact O-CB 3.46Å; L301-C305 PolarHBondContact O-N 3.09Å; L301-C305 PolarHBondContact O-SG 3.25Å; L301-C305 VanDerWaalsContact O-SG 3.39Å; R302-C305 CarbonylContact O-C 3.49Å; R302-C305 PolarHBondContact O-N 3.37Å; C305-C310 WeakPolarHBondContact CA-SG 3.48Å; C305-C310 HydrophobicContact CB-CB 3.46Å; C305-C310 VanDerWaalsContact CB-CB 3.46Å; C305-C310 WeakPolarHBondContact CB-SG 3.36Å; C305-C310 WeakPolarHBondContact SG-CB 3.49Å; C305-C310 CovalentContact SG-SG 2.03Å; C305-C310 PolarHBondContact SG-SG 3.5Å; C305-R363 VanDerWaalsContact CB-CZ 3.41Å; C305-R363 PolarHBondContact O-NH2 3.15Å
306	K	52.1	Low	68.7	Low	156 Å²	156	59.2 Å²	59.2	68%	0.678	30%	0.303	S	S	*	.			trans	-104.3	113.3	167.4	-63.4	-179.5	-177.2	176.6	0	108.8
307	G	49.3	Very low	68.5	Low	57 Å²	57	55.2 Å²	55.2	59%	0.588	28%	0.279	S	S	*	.	S	Bend	trans	94.1	-154	-179.8	0	0	0	0	0	115.7	T309	G307-T309 VanDerWaalsContact C-N 3.32Å; G307-T309 PolarHBondContact O-N 2.87Å
308	T	37.4	Very low	68.5	Low	39 Å²	39	56.2 Å²	56.2	24%	0.239	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-70.6	-16.9	-169	56.4	0	0	0	0	115.3	E106 C310 N311	E106-T308 HydrophobicContact CB-CG2 3.46Å; E106-T308 VanDerWaalsContact CB-CG2 3.46Å; E106-T308 HydrophobicContact CG-CG2 3.66Å; E106-T308 WeakPolarHBondContact OE2-CG2 3.39Å; T308-C310 PolarHBondContact O-N 3.05Å; T308-N311 PolarHBondContact O-N 3.13Å
309	T	44.7	Very low	68.6	Low	71 Å²	71	53 Å²	53	44%	0.436	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-57.2	-36.8	-178.2	35	0	0	0	0	112.1	G307 S313 H315	G307-T309 VanDerWaalsContact C-N 3.32Å; G307-T309 PolarHBondContact O-N 2.87Å; T309-S313 PolarHBondContact O-OG 3.33Å; T309-H315 PolarHBondContact O-CE1 3Å; T309-H315 PolarHBondContact O-NE2 3.03Å
310	C	51.1	Low	68.6	Low	3 Å²	3	55.1 Å²	55.1	2%	0.02	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-104.7	32.8	-173.8	-66.2	0	0	0	0	114.5	C305 T308 R363	C305-C310 WeakPolarHBondContact CA-SG 3.48Å; C305-C310 HydrophobicContact CB-CB 3.46Å; C305-C310 VanDerWaalsContact CB-CB 3.46Å; C305-C310 WeakPolarHBondContact CB-SG 3.36Å; C305-C310 WeakPolarHBondContact SG-CB 3.49Å; C305-C310 CovalentContact SG-SG 2.03Å; C305-C310 PolarHBondContact SG-SG 3.5Å; T308-C310 PolarHBondContact O-N 3.05Å; C310-R363 VanDerWaalsContact O-CD 3.22Å; C310-R363 WeakPolarHBondContact O-CD 3.44Å; C310-R363 PolarHBondContact O-NH1 3.03Å
311	N	48.3	Very low	68.6	Low	104 Å²	104	54.1 Å²	54.1	56%	0.556	29%	0.286	S	S	*	.	S	Bend	trans	-88.3	106.4	171.6	-116.9	-14.3	0	0	0	110.6	E106 T308 S313	E106-N311 PolarHBondContact OE1-ND2 3.18Å; T308-N311 PolarHBondContact O-N 3.13Å; N311-S313 PolarHBondContact O-N 3.02Å; N311-S313 PolarHBondContact O-OG 3.45Å
312	R	48.9	Very low	68.8	Low	192 Å²	192	55.9 Å²	55.9	73%	0.725	30%	0.304	S	S	*	.	S	Bend	trans	62.3	-10.5	173.5	-114.9	178.8	-173.2	-169.1	3	118.5	P415	R312-P415 HydrophobicContact CB-CB 3.91Å; R312-P415 HydrophobicContact CG-CB 3.91Å; R312-P415 HydrophobicContact CG-CG 4.45Å; R312-P415 WeakPolarHBondContact O-CB 3.41Å
313	S	58.6	Low	69.2	Low	22 Å²	22	49.6 Å²	49.6	15%	0.154	28%	0.281	C	S	.	.			trans	-86.9	142.9	-177.9	40.7	0	0	0	0	114.1	T309 N311 H315	T309-S313 PolarHBondContact O-OG 3.33Å; N311-S313 PolarHBondContact O-N 3.02Å; N311-S313 PolarHBondContact O-OG 3.45Å; S313-H315 PolarHBondContact O-CE1 3.31Å; S313-H315 PolarHBondContact O-ND1 3.13Å; S313-H315 PolarHBondContact OG-CE1 3.23Å
314	T	68.1	Low	69.6	Low	13 Å²	13	48.4 Å²	48.4	8%	0.08	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	148.1	159.6	-56.3	0	0	0	0	108.7	D360 V361 T362 H418	T314-D360 HydrophobicContact CG2-CB 3.62Å; T314-V361 CarbonylContact C-O 3.57Å; T314-V361 VanDerWaalsContact CA-O 3.27Å; T314-V361 WeakPolarHBondContact CA-O 3.35Å; T314-T362 WeakPolarHBondContact CG2-OG1 3.49Å; T314-T362 PolarHBondContact OG1-OG1 3.18Å; T314-H418 PolarHBondContact O-CE1 3.3Å; T314-H418 PolarHBondContact O-ND1 3.36Å
315	H	75.1	Confident	70.2	Confident	22 Å²	22	52.1 Å²	52.1	10%	0.102	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.1	179	-73.9	70.2	0	0	0	109.9	T309 S313 Y317 D360 V361	T309-H315 PolarHBondContact O-CE1 3Å; T309-H315 PolarHBondContact O-NE2 3.03Å; S313-H315 PolarHBondContact O-CE1 3.31Å; S313-H315 PolarHBondContact O-ND1 3.13Å; S313-H315 PolarHBondContact OG-CE1 3.23Å; H315-Y317 HydrophobicContact CB-CD2 4.14Å; H315-Y317 HydrophobicContact CB-CE2 3.43Å; H315-Y317 VanDerWaalsContact CB-CE2 3.43Å; H315-D360 CarbonylContact O-C 3.52Å; H315-D360 WeakPolarHBondContact O-CA 3.39Å; H315-V361 PolarHBondContact N-O 3.26Å; H315-V361 PolarHBondContact O-N 2.75Å
316	R	81.6	Confident	71.2	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.019	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.6	176.6	-171.9	158.8	-66.8	165.2	6.1	111.2	S292 Q293 D360 V395 C419 D469	S292-R316 WeakPolarHBondContact CA-O 3Å; Q293-R316 PolarHBondContact N-O 3.16Å; Q293-R316 VanDerWaalsContact N-O 3.16Å; R316-D360 WeakPolarHBondContact CB-OD1 3.42Å; R316-D360 IonicContact CZ-OD1 3.15Å; R316-D360 IonicContact CZ-OD2 3.42Å; R316-D360 IonicContact NE-OD1 3.87Å; R316-D360 PolarHBondContact NE-OD1 3.1Å; R316-D360 IonicContact NE-OD2 2.59Å; R316-D360 IonicContact NH2-OD1 3.67Å; R316-D360 PolarHBondContact NH2-OD1 2.85Å; R316-D360 IonicContact NH2-OD2 2.86Å; R316-D360 PolarHBondContact NH2-OD2 2.03Å; R316-V395 HydrophobicContact CG-CG2 4.4Å; R316-C419 PolarHBondContact NH2-O 3.42Å; R316-D469 IonicContact NH1-OD1 3.59Å; R316-D469 PolarHBondContact NH1-OD1 3.14Å; R316-D469 IonicContact NH1-OD2 3.9Å
317	Y	85.7	Confident	72.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	149.4	177.3	-67	-84.1	0	0	0	110.5	Q293 V295 L301 Q304 H315 V342 W358 L359 V361	Q293-Y317 HydrophobicContact CB-CD1 3.83Å; Q293-Y317 HydrophobicContact CB-CE1 3.97Å; Q293-Y317 VanDerWaalsContact OE1-CE1 3.26Å; V295-Y317 HydrophobicContact CG1-CD1 3.49Å; V295-Y317 VanDerWaalsContact CG1-CD1 3.49Å; V295-Y317 HydrophobicContact CG1-CE1 4.02Å; V295-Y317 HydrophobicContact CG2-CD1 4.36Å; L301-Y317 HydrophobicContact CD1-CE2 4.02Å; Q304-Y317 HydrophobicContact CB-CE1 3.97Å; Q304-Y317 HydrophobicContact CG-CE1 3.96Å; H315-Y317 HydrophobicContact CB-CD2 4.14Å; H315-Y317 HydrophobicContact CB-CE2 3.43Å; H315-Y317 VanDerWaalsContact CB-CE2 3.43Å; Y317-V342 HydrophobicContact CD2-CG1 4.17Å; Y317-V342 HydrophobicContact CG-CG1 4.18Å; Y317-W358 WeakPolarHBondContact O-CA 3.37Å; Y317-L359 PolarHBondContact N-O 3.38Å; Y317-L359 PolarHBondContact O-N 2.97Å; Y317-V361 HydrophobicContact CD2-CB 3.88Å; Y317-V361 HydrophobicContact CD2-CG2 3.39Å; Y317-V361 HydrophobicContact CE2-CB 3.77Å; Y317-V361 HydrophobicContact CE2-CG1 4.49Å; Y317-V361 HydrophobicContact CE2-CG2 3.71Å; Y317-V361 HydrophobicContact CG-CG2 4.45Å
318	E	86.9	Confident	74	Confident	40 Å²	40	46.9 Å²	46.9	19%	0.187	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118	176.1	-176	168.6	167.7	0	0	109.9	S292 Q293 L294 V295 W358	S292-E318 PolarHBondContact OG-OE2 3.43Å; S292-E318 VanDerWaalsContact OG-OE2 3.11Å; Q293-E318 PolarHBondContact O-N 3.4Å; Q293-E318 VanDerWaalsContact O-N 3.07Å; L294-E318 HydrophobicContact CD2-CG 4.41Å; V295-E318 WeakPolarHBondContact CG2-O 3.24Å; V295-E318 PolarHBondContact N-O 3.34Å; V295-E318 VanDerWaalsContact N-O 3.15Å; E318-W358 VanDerWaalsContact CD-NE1 3.29Å; E318-W358 PolarHBondContact OE2-NE1 2.85Å; E318-W358 VanDerWaalsContact OE2-NE1 3.14Å
319	C	88.8	Confident	76.5	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.034	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.7	-176.9	-72	0	0	0	0	110.9	C343 I352 G356 G357 L359	C319-C343 HydrophobicContact CB-CB 3.7Å; C319-C343 WeakPolarHBondContact CB-SG 3.05Å; C319-C343 WeakPolarHBondContact SG-CA 3.35Å; C319-C343 WeakPolarHBondContact SG-CB 3.47Å; C319-C343 CovalentContact SG-SG 2.03Å; C319-C343 PolarHBondContact SG-SG 3.37Å; C319-I352 HydrophobicContact CB-CD1 3.65Å; C319-G356 CarbonylContact O-C 3.58Å; C319-G356 WeakPolarHBondContact O-CA 3.31Å; C319-G357 PolarHBondContact N-O 3.24Å; C319-G357 PolarHBondContact O-N 2.93Å; C319-L359 HydrophobicContact CB-CD2 4.45Å; C319-L359 WeakPolarHBondContact SG-CD2 3.49Å
320	P	90.4	Very high	78.9	Confident	59 Å²	59	50.3 Å²	50.3	38%	0.383	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-70.8	165.1	174.1	30	-35.6	0	0	0	110.9	V295 C323 G356	V295-P320 WeakPolarHBondContact O-CD 3.36Å; P320-C323 PolarHBondContact O-SG 3.28Å; P320-G356 WeakPolarHBondContact O-CA 3.33Å
321	A	88.6	Confident	80.9	Confident	63 Å²	63	51 Å²	51	52%	0.521	28%	0.283	S	S	.	.	S	Bend	trans	-67	159.5	169.8	0	0	0	0	0	111.6	N354 D355	A321-N354 CarbonylContact C-O 3.54Å; A321-N354 VanDerWaalsContact CA-O 3.23Å; A321-N354 WeakPolarHBondContact CA-O 3.24Å; A321-D355 WeakPolarHBondContact CB-O 3.24Å
322	G	89.9	Confident	83	Confident	38 Å²	38	46 Å²	46	39%	0.392	26%	0.256	S	S	.	.			trans	82.3	17.4	173.1	0	0	0	0	0	115.1	L324 N354	G322-L324 VanDerWaalsContact C-N 3.27Å; G322-L324 PolarHBondContact O-N 3.12Å; G322-N354 VanDerWaalsContact C-OD1 3.3Å; G322-N354 VanDerWaalsContact CA-OD1 3.28Å; G322-N354 WeakPolarHBondContact CA-OD1 3.28Å; G322-N354 PolarHBondContact N-O 3.47Å; G322-N354 PolarHBondContact N-OD1 2.86Å
323	C	90.7	Very high	84.9	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.014	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-77.3	-5.9	-178	-63.9	0	0	0	0	115	C297 P320 D325 A326 C343 R344 L347 N354	C297-C323 WeakPolarHBondContact CA-SG 3.45Å; C297-C323 HydrophobicContact CB-CB 3.59Å; C297-C323 WeakPolarHBondContact CB-SG 3.05Å; C297-C323 WeakPolarHBondContact SG-CA 3.21Å; C297-C323 WeakPolarHBondContact SG-CB 3.38Å; C297-C323 CovalentContact SG-SG 2.04Å; C297-C323 PolarHBondContact SG-SG 3.27Å; P320-C323 PolarHBondContact O-SG 3.28Å; C323-D325 PolarHBondContact O-N 2.93Å; C323-A326 WeakPolarHBondContact O-CB 3.02Å; C323-A326 PolarHBondContact O-N 3.15Å; C323-C343 HydrophobicContact CB-CB 4.24Å; C323-R344 WeakPolarHBondContact O-CG 3.28Å; C323-R344 PolarHBondContact O-NE 3.21Å; C323-L347 VanDerWaalsContact C-CD1 3.49Å; C323-L347 HydrophobicContact CB-CD1 3.7Å; C323-N354 PolarHBondContact N-OD1 2.77Å
324	L	88.8	Confident	86.2	Confident	50 Å²	50	41.2 Å²	41.2	26%	0.262	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-61.6	-43.9	179.8	-169.7	65.9	0	0	0	111.9	G322 R344 L347 N354 V378	G322-L324 VanDerWaalsContact C-N 3.27Å; G322-L324 PolarHBondContact O-N 3.12Å; L324-R344 PolarHBondContact O-NE 3.28Å; L324-R344 PolarHBondContact O-NH2 2.88Å; L324-L347 HydrophobicContact CB-CD1 4.46Å; L324-N354 HydrophobicContact CB-CB 4.49Å; L324-N354 VanDerWaalsContact CB-OD1 3.26Å; L324-N354 WeakPolarHBondContact CB-OD1 3.44Å; L324-N354 PolarHBondContact N-OD1 3.46Å; L324-V378 HydrophobicContact CD1-CG2 3.78Å
325	D	85.1	Confident	87.3	Confident	144 Å²	144	44.9 Å²	44.9	77%	0.77	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-90.1	2.3	-176.3	-58.4	-46.5	0	0	0	113.7	C323	C323-D325 PolarHBondContact O-N 2.93Å
326	A	84.6	Confident	88.1	Confident	18 Å²	18	44 Å²	44	15%	0.149	26%	0.256	C	S	.	.			trans	-67.5	152.4	-177.7	0	0	0	0	0	112.9	C297 C323 G328 R344	C297-A326 HydrophobicContact CB-CB 3.41Å; C297-A326 VanDerWaalsContact CB-CB 3.41Å; C323-A326 WeakPolarHBondContact O-CB 3.02Å; C323-A326 PolarHBondContact O-N 3.15Å; A326-G328 PolarHBondContact O-N 3.41Å; A326-R344 PolarHBondContact O-NE 2.99Å; A326-R344 PolarHBondContact O-NH1 3.49Å; A326-R344 PolarHBondContact O-NH2 3.49Å
327	A	81.1	Confident	88.7	Confident	88 Å²	88	44.3 Å²	44.3	73%	0.727	26%	0.257	S	S	*	.			trans	-74	-12.3	-174.8	0	0	0	0	0	114.1	D298 R329	D298-A327 PolarHBondContact OD1-N 2.84Å; A327-R329 PolarHBondContact O-N 3.22Å
328	G	80	Confident	88.8	Confident	6 Å²	6	45.4 Å²	45.4	6%	0.062	26%	0.263	C	S	.	.			trans	-56	131.4	-175.7	0	0	0	0	0	112.7	D298 A326 R344	D298-G328 WeakPolarHBondContact OD1-CA 2.92Å; D298-G328 PolarHBondContact OD1-N 2.97Å; A326-G328 PolarHBondContact O-N 3.41Å; G328-R344 WeakPolarHBondContact O-CD 3.36Å; G328-R344 PolarHBondContact O-NH1 3.34Å
329	R	90.6	Very high	89	Confident	181 Å²	181	47.6 Å²	47.6	68%	0.683	27%	0.273	S	S	*	.			trans	-81.3	146.4	-179.9	-63.2	-179.1	-175.9	177.7	0.4	110.5	A327 S340 S341	A327-R329 PolarHBondContact O-N 3.22Å; R329-S340 CarbonylContact O-C 3.27Å; R329-S340 WeakPolarHBondContact O-CA 3.42Å; R329-S341 PolarHBondContact O-N 2.84Å
330	V	94.4	Very high	89.2	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	27%	0.271	C	S	.	.			trans	-120.3	125.3	170	-178.4	0	0	0	0	108	Y336 R344 A345 H348 V378 S380 L381	V330-Y336 HydrophobicContact CG1-CD1 3.56Å; V330-Y336 HydrophobicContact CG1-CE1 3.72Å; V330-R344 HydrophobicContact CG2-CB 3.39Å; V330-A345 HydrophobicContact CG1-CB 4.37Å; V330-H348 HydrophobicContact CG1-CB 4.48Å; V330-V378 HydrophobicContact CB-CG1 4.38Å; V330-V378 HydrophobicContact CG2-CG1 3.98Å; V330-S380 CarbonylContact O-C 3.57Å; V330-S380 VanDerWaalsContact O-CA 3.27Å; V330-S380 WeakPolarHBondContact O-CA 3.3Å; V330-L381 PolarHBondContact O-N 2.92Å
331	V	93.8	Very high	89.3	Confident	17 Å²	17	44.5 Å²	44.5	10%	0.103	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-119.5	119	179.7	-174.3	0	0	0	0	108.6	Y336 E337 S340 F370 L381 K383	V331-Y336 CarbonylContact O-C 3.6Å; V331-Y336 VanDerWaalsContact O-CA 3.3Å; V331-Y336 WeakPolarHBondContact O-CA 3.37Å; V331-E337 HydrophobicContact CB-CB 3.91Å; V331-E337 HydrophobicContact CG1-CB 4.18Å; V331-E337 PolarHBondContact O-N 2.92Å; V331-S340 PolarHBondContact N-OG 3.07Å; V331-S340 PolarHBondContact O-OG 3.04Å; V331-F370 HydrophobicContact CG1-CB 4.25Å; V331-L381 CarbonylContact C-O 3.53Å; V331-L381 WeakPolarHBondContact CA-O 3.35Å; V331-L381 HydrophobicContact CG2-CB 4.24Å; V331-K383 HydrophobicContact CG1-CB 3.78Å; V331-K383 HydrophobicContact CG1-CD 4.43Å
332	G	91.5	Very high	89.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.			trans	97.9	173.2	-179.9	0	0	0	0	0	115.6	Y335 Y336 I371 S380 L381	G332-Y335 CarbonylContact C-O 3.57Å; G332-Y335 WeakPolarHBondContact CA-O 3.49Å; G332-Y336 WeakPolarHBondContact O-CD1 3.45Å; G332-Y336 VanDerWaalsContact O-CE1 3.24Å; G332-Y336 WeakPolarHBondContact O-CE1 3.28Å; G332-I371 CarbonylContact C-O 3.39Å; G332-I371 VanDerWaalsContact C-O 3.27Å; G332-I371 WeakPolarHBondContact CA-O 3.45Å; G332-S380 WeakPolarHBondContact O-CB 3.35Å; G332-S380 PolarHBondContact O-OG 3.49Å; G332-L381 PolarHBondContact N-O 2.76Å
333	T	88.6	Confident	89.7	Confident	25 Å²	25	39.7 Å²	39.7	15%	0.153	21%	0.209	C	C	.	.	S	Bend	trans	-138.9	133.6	-176.6	-60.1	0	0	0	0	107.8	Y335 I371 S373 S380	T333-Y335 PolarHBondContact N-O 3.42Å; T333-Y335 PolarHBondContact O-N 2.96Å; T333-I371 WeakPolarHBondContact CB-O 2.95Å; T333-I371 PolarHBondContact N-O 3.35Å; T333-I371 VanDerWaalsContact N-O 3.16Å; T333-I371 PolarHBondContact OG1-O 2.86Å; T333-S373 VanDerWaalsContact CG2-OG 3.3Å; T333-S373 WeakPolarHBondContact CG2-OG 2.95Å; T333-S373 WeakPolarHBondContact OG1-CB 3.37Å; T333-S373 PolarHBondContact OG1-N 2.73Å; T333-S373 PolarHBondContact OG1-OG 3.48Å; T333-S380 PolarHBondContact OG1-OG 2.98Å
334	V	85.5	Confident	89.8	Confident	88 Å²	88	41.5 Å²	41.5	53%	0.533	22%	0.216	S	C	.	.	S	Bend	trans	65.6	-54.8	-169.3	179.9	0	0	0	0	112.5
335	Y	90.8	Very high	90.1	Very high	90 Å²	90	39.1 Å²	39.1	35%	0.353	20%	0.204	S	C	.	.	S	Bend	trans	-102.2	123.6	168.4	-57	-75.4	0	0	0	108.9	G332 T333 R364 K367 F370 F390 T391	G332-Y335 CarbonylContact C-O 3.57Å; G332-Y335 WeakPolarHBondContact CA-O 3.49Å; T333-Y335 PolarHBondContact N-O 3.42Å; T333-Y335 PolarHBondContact O-N 2.96Å; Y335-R364 HydrophobicContact CD1-CB 4.49Å; Y335-R364 HydrophobicContact CD1-CG 4.23Å; Y335-R364 HydrophobicContact CE1-CG 4.23Å; Y335-K367 HydrophobicContact CD2-CD 4.49Å; Y335-K367 HydrophobicContact CG-CD 4.46Å; Y335-K367 HydrophobicContact CG-CG 4.34Å; Y335-F370 WeakPolarHBondContact O-CD1 3.48Å; Y335-F390 WeakPolarHBondContact CA-O 2.97Å; Y335-T391 HydrophobicContact CD1-CG2 3.58Å; Y335-T391 HydrophobicContact CE1-CG2 3.72Å
336	Y	92.9	Very high	90.5	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.2	179.2	-58.2	-77.1	0	0	0	110	V330 V331 G332 A345 H348 A349 S389 F390 V392	V330-Y336 HydrophobicContact CG1-CD1 3.56Å; V330-Y336 HydrophobicContact CG1-CE1 3.72Å; V331-Y336 CarbonylContact O-C 3.6Å; V331-Y336 VanDerWaalsContact O-CA 3.3Å; V331-Y336 WeakPolarHBondContact O-CA 3.37Å; G332-Y336 WeakPolarHBondContact O-CD1 3.45Å; G332-Y336 VanDerWaalsContact O-CE1 3.24Å; G332-Y336 WeakPolarHBondContact O-CE1 3.28Å; Y336-A345 HydrophobicContact CD1-CB 3.93Å; Y336-A345 HydrophobicContact CD2-CB 3.96Å; Y336-A345 HydrophobicContact CE1-CB 4.21Å; Y336-A345 HydrophobicContact CE2-CB 4.23Å; Y336-A345 HydrophobicContact CG-CB 3.78Å; Y336-H348 HydrophobicContact CE1-CB 4.39Å; Y336-H348 AromaticContact CE1-ND1 3.45Å; Y336-H348 WeakPolarHBondContact CE1-ND1 3.49Å; Y336-H348 AromaticContact CZ-ND1 3.58Å; Y336-H348 PolarHBondContact OH-ND1 2.8Å; Y336-A349 HydrophobicContact CE2-CB 4.29Å; Y336-A349 WeakPolarHBondContact OH-CB 3.06Å; Y336-A349 PolarHBondContact OH-N 3.35Å; Y336-S389 CarbonylContact O-C 3.54Å; Y336-S389 WeakPolarHBondContact O-CA 3.14Å; Y336-F390 HydrophobicContact CD2-CD2 4.5Å; Y336-F390 HydrophobicContact CD2-CE2 4.24Å; Y336-F390 HydrophobicContact CG-CE2 4.34Å; Y336-F390 HydrophobicContact CG-CZ 4.42Å; Y336-F390 PolarHBondContact N-O 3.39Å; Y336-F390 WeakPolarHBondContact O-CD1 3.41Å; Y336-F390 PolarHBondContact O-N 2.59Å; Y336-V392 HydrophobicContact CD2-CG2 4.46Å; Y336-V392 HydrophobicContact CE2-CG2 3.9Å
337	E	93.6	Very high	91	Very high	11 Å²	11	31.8 Å²	31.8	5%	0.051	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	143	175.1	-175.7	-178.1	-173.9	0	0	109.9	V331 Q339 S340 F370 K383 A387 F390	V331-E337 HydrophobicContact CB-CB 3.91Å; V331-E337 HydrophobicContact CG1-CB 4.18Å; V331-E337 PolarHBondContact O-N 2.92Å; E337-Q339 PolarHBondContact O-N 3.4Å; E337-S340 WeakPolarHBondContact O-CB 3.46Å; E337-S340 PolarHBondContact O-N 3.48Å; E337-S340 PolarHBondContact O-OG 3.33Å; E337-F370 HydrophobicContact CB-CD1 4.34Å; E337-F370 HydrophobicContact CB-CE1 3.98Å; E337-F370 HydrophobicContact CB-CE2 4.49Å; E337-F370 HydrophobicContact CB-CZ 4.06Å; E337-F370 HydrophobicContact CG-CZ 4.43Å; E337-K383 VanDerWaalsContact CD-NZ 3.28Å; E337-K383 IonicContact OE1-NZ 3.74Å; E337-K383 PolarHBondContact OE1-NZ 2.88Å; E337-K383 WeakPolarHBondContact OE2-CD 3.38Å; E337-K383 IonicContact OE2-NZ 2.63Å; E337-K383 PolarHBondContact OE2-NZ 3.15Å; E337-A387 HydrophobicContact CG-CB 3.97Å; E337-F390 WeakPolarHBondContact O-CE1 3.4Å
338	M	89.1	Confident	91.6	Very high	22 Å²	22	27.6 Å²	27.6	11%	0.108	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.4	179.8	-58.6	-162.1	-19.7	0	0	116.1	L301 R302 S340 R363 N388	L301-M338 PolarHBondContact N-O 3.21Å; R302-M338 HydrophobicContact CB-CB 4.23Å; R302-M338 HydrophobicContact CB-CE 4.18Å; R302-M338 WeakPolarHBondContact CB-O 3.43Å; R302-M338 HydrophobicContact CG-CE 4.1Å; R302-M338 PolarHBondContact N-O 2.94Å; M338-S340 PolarHBondContact O-N 3.5Å; M338-R363 PolarHBondContact SD-NE 3.18Å; M338-R363 VanDerWaalsContact SD-NE 3.45Å; M338-R363 PolarHBondContact SD-NH2 3.03Å; M338-N388 HydrophobicContact CE-CB 4.4Å; M338-N388 HydrophobicContact CG-CB 3.7Å; M338-N388 WeakPolarHBondContact CG-O 3.27Å; M338-N388 PolarHBondContact N-O 2.83Å; M338-N388 VanDerWaalsContact N-O 3.13Å; M338-N388 HydrophobicContact SD-CB 3.55Å; M338-N388 VanDerWaalsContact SD-CB 3.55Å
339	Q	89.8	Confident	92.2	Very high	86 Å²	86	29.3 Å²	29.3	40%	0.402	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.5	174.5	-61.5	-172.3	5.4	0	0	113.2	K300 E337	K300-Q339 VanDerWaalsContact CD-O 3.3Å; K300-Q339 WeakPolarHBondContact CD-O 3.16Å; K300-Q339 VanDerWaalsContact CG-O 3.29Å; K300-Q339 WeakPolarHBondContact CG-O 3.18Å; E337-Q339 PolarHBondContact O-N 3.4Å
340	S	92.8	Very high	92.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-75.3	145.8	177	-53.5	0	0	0	0	111.2	K300 L301 R329 V331 E337 M338 V342	K300-S340 WeakPolarHBondContact CA-O 3.43Å; L301-S340 PolarHBondContact N-O 3.13Å; R329-S340 CarbonylContact O-C 3.27Å; R329-S340 WeakPolarHBondContact O-CA 3.42Å; V331-S340 PolarHBondContact N-OG 3.07Å; V331-S340 PolarHBondContact O-OG 3.04Å; E337-S340 WeakPolarHBondContact O-CB 3.46Å; E337-S340 PolarHBondContact O-N 3.48Å; E337-S340 PolarHBondContact O-OG 3.33Å; M338-S340 PolarHBondContact O-N 3.5Å; S340-V342 PolarHBondContact O-N 3.07Å
341	S	94.2	Very high	92.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-59.7	131.5	167.8	157.1	0	0	0	0	110.2	C297 T299 R329 R344 A345	C297-S341 WeakPolarHBondContact O-CB 3.28Å; C297-S341 PolarHBondContact O-OG 3.36Å; T299-S341 WeakPolarHBondContact O-CA 3.4Å; R329-S341 PolarHBondContact O-N 2.84Å; S341-R344 PolarHBondContact OG-N 3.37Å; S341-R344 VanDerWaalsContact OG-N 3.12Å; S341-A345 WeakPolarHBondContact O-CB 3.26Å; S341-A345 PolarHBondContact O-N 3.49Å
342	V	92.6	Very high	91.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67	-48.7	-179.8	175.4	0	0	0	0	110.8	T299 L301 Y317 S340 A345 G346 L359 V361	T299-V342 PolarHBondContact O-N 3.26Å; L301-V342 HydrophobicContact CB-CG2 3.81Å; L301-V342 HydrophobicContact CD1-CG2 4.05Å; Y317-V342 HydrophobicContact CD2-CG1 4.17Å; Y317-V342 HydrophobicContact CG-CG1 4.18Å; S340-V342 PolarHBondContact O-N 3.07Å; V342-A345 PolarHBondContact O-N 3.19Å; V342-G346 PolarHBondContact O-N 3.02Å; V342-L359 HydrophobicContact CG1-CD1 3.84Å; V342-L359 HydrophobicContact CG1-CD2 4.41Å; V342-L359 HydrophobicContact CG1-CG 4.44Å; V342-V361 HydrophobicContact CG1-CG2 3.55Å
343	C	93.3	Very high	91.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.7	-42.9	-178.1	-59.1	0	0	0	0	112.2	V295 C319 C323 A345 G346 L347 I352	V295-C343 VanDerWaalsContact CG2-SG 3.56Å; C319-C343 HydrophobicContact CB-CB 3.7Å; C319-C343 WeakPolarHBondContact CB-SG 3.05Å; C319-C343 WeakPolarHBondContact SG-CA 3.35Å; C319-C343 WeakPolarHBondContact SG-CB 3.47Å; C319-C343 CovalentContact SG-SG 2.03Å; C319-C343 PolarHBondContact SG-SG 3.37Å; C323-C343 HydrophobicContact CB-CB 4.24Å; C343-A345 VanDerWaalsContact C-N 3.35Å; C343-A345 PolarHBondContact O-N 2.9Å; C343-G346 WeakPolarHBondContact O-CA 3.41Å; C343-G346 PolarHBondContact O-N 3.03Å; C343-G346 VanDerWaalsContact O-N 3.12Å; C343-L347 PolarHBondContact O-N 2.97Å; C343-I352 HydrophobicContact CB-CD1 4.48Å
344	R	94	Very high	91.9	Very high	40 Å²	40	28.5 Å²	28.5	15%	0.151	16%	0.155	C	C	.	.	H	α-helix	trans	-69.8	-31.9	175.9	-65.4	-167.6	90.6	-161.7	9.2	112.7	C323 L324 A326 G328 V330 S341 G346 L347 H348	C323-R344 WeakPolarHBondContact O-CG 3.28Å; C323-R344 PolarHBondContact O-NE 3.21Å; L324-R344 PolarHBondContact O-NE 3.28Å; L324-R344 PolarHBondContact O-NH2 2.88Å; A326-R344 PolarHBondContact O-NE 2.99Å; A326-R344 PolarHBondContact O-NH1 3.49Å; A326-R344 PolarHBondContact O-NH2 3.49Å; G328-R344 WeakPolarHBondContact O-CD 3.36Å; G328-R344 PolarHBondContact O-NH1 3.34Å; V330-R344 HydrophobicContact CG2-CB 3.39Å; S341-R344 PolarHBondContact OG-N 3.37Å; S341-R344 VanDerWaalsContact OG-N 3.12Å; R344-G346 VanDerWaalsContact C-N 3.3Å; R344-L347 PolarHBondContact O-N 2.69Å; R344-H348 VanDerWaalsContact O-CB 3.28Å; R344-H348 WeakPolarHBondContact O-CB 3.18Å; R344-H348 PolarHBondContact O-N 3.21Å
345	A	94.6	Very high	91.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-36.2	169.6	0	0	0	0	0	111.6	V330 Y336 S341 V342 C343 A349 F390 V392	V330-A345 HydrophobicContact CG1-CB 4.37Å; Y336-A345 HydrophobicContact CD1-CB 3.93Å; Y336-A345 HydrophobicContact CD2-CB 3.96Å; Y336-A345 HydrophobicContact CE1-CB 4.21Å; Y336-A345 HydrophobicContact CE2-CB 4.23Å; Y336-A345 HydrophobicContact CG-CB 3.78Å; S341-A345 WeakPolarHBondContact O-CB 3.26Å; S341-A345 PolarHBondContact O-N 3.49Å; V342-A345 PolarHBondContact O-N 3.19Å; C343-A345 VanDerWaalsContact C-N 3.35Å; C343-A345 PolarHBondContact O-N 2.9Å; A345-A349 VanDerWaalsContact O-CB 3.24Å; A345-A349 WeakPolarHBondContact O-CB 3.22Å; A345-A349 PolarHBondContact O-N 3.19Å; A345-F390 HydrophobicContact CB-CE2 4Å; A345-F390 HydrophobicContact CB-CZ 4.02Å; A345-V392 HydrophobicContact CB-CG1 4.41Å
346	G	93.8	Very high	91.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.7	-49	171.3	0	0	0	0	0	113	V342 C343 R344 A349 G350 V351	V342-G346 PolarHBondContact O-N 3.02Å; C343-G346 WeakPolarHBondContact O-CA 3.41Å; C343-G346 PolarHBondContact O-N 3.03Å; C343-G346 VanDerWaalsContact O-N 3.12Å; R344-G346 VanDerWaalsContact C-N 3.3Å; G346-A349 PolarHBondContact O-N 3.26Å; G346-G350 PolarHBondContact O-N 3Å; G346-V351 PolarHBondContact O-N 2.85Å
347	L	93.9	Very high	91.1	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-59.3	-52.9	173.5	-72.3	169.6	0	0	0	111.4	C323 L324 C343 R344 A349 G350 I352 D353 N376 V378	C323-L347 VanDerWaalsContact C-CD1 3.49Å; C323-L347 HydrophobicContact CB-CD1 3.7Å; L324-L347 HydrophobicContact CB-CD1 4.46Å; C343-L347 PolarHBondContact O-N 2.97Å; R344-L347 PolarHBondContact O-N 2.69Å; L347-A349 PolarHBondContact O-N 3.27Å; L347-A349 VanDerWaalsContact O-N 3.16Å; L347-G350 PolarHBondContact O-N 2.84Å; L347-I352 HydrophobicContact CD2-CG1 4.38Å; L347-I352 HydrophobicContact CG-CD1 4.45Å; L347-I352 HydrophobicContact CG-CG1 4.3Å; L347-D353 VanDerWaalsContact CD2-O 3.31Å; L347-D353 WeakPolarHBondContact CD2-O 3.17Å; L347-N376 VanDerWaalsContact O-CB 3.22Å; L347-N376 WeakPolarHBondContact O-CB 3.41Å; L347-N376 PolarHBondContact O-ND2 3Å; L347-V378 HydrophobicContact CB-CG2 3.83Å
348	H	94.7	Very high	90.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-55.8	-36	177.8	-178.1	-83.6	0	0	0	112.5	V330 Y336 R344 S373 K375 N376 V378 S380	V330-H348 HydrophobicContact CG1-CB 4.48Å; Y336-H348 HydrophobicContact CE1-CB 4.39Å; Y336-H348 AromaticContact CE1-ND1 3.45Å; Y336-H348 WeakPolarHBondContact CE1-ND1 3.49Å; Y336-H348 AromaticContact CZ-ND1 3.58Å; Y336-H348 PolarHBondContact OH-ND1 2.8Å; R344-H348 VanDerWaalsContact O-CB 3.28Å; R344-H348 WeakPolarHBondContact O-CB 3.18Å; R344-H348 PolarHBondContact O-N 3.21Å; H348-S373 PolarHBondContact CE1-OG 2.84Å; H348-S373 VanDerWaalsContact CE1-OG 3.27Å; H348-S373 PolarHBondContact NE2-O 3.18Å; H348-S373 PolarHBondContact NE2-OG 3.04Å; H348-K375 VanDerWaalsContact O-CB 3.25Å; H348-K375 WeakPolarHBondContact O-CB 3.4Å; H348-N376 PolarHBondContact O-ND2 3.02Å; H348-V378 HydrophobicContact CB-CB 3.92Å; H348-V378 HydrophobicContact CB-CG1 4Å; H348-V378 PolarHBondContact CD2-O 3.27Å; H348-S380 WeakPolarHBondContact NE2-CB 3.39Å; H348-S380 PolarHBondContact NE2-OG 3.06Å
349	A	92.9	Very high	90.6	Very high	42 Å²	42	31.3 Å²	31.3	35%	0.347	17%	0.174	S	C	.	.	H	α-helix	trans	-78.5	-15.9	176.4	0	0	0	0	0	114.1	Y336 A345 G346 L347 V351 V392	Y336-A349 HydrophobicContact CE2-CB 4.29Å; Y336-A349 WeakPolarHBondContact OH-CB 3.06Å; Y336-A349 PolarHBondContact OH-N 3.35Å; A345-A349 VanDerWaalsContact O-CB 3.24Å; A345-A349 WeakPolarHBondContact O-CB 3.22Å; A345-A349 PolarHBondContact O-N 3.19Å; G346-A349 PolarHBondContact O-N 3.26Å; L347-A349 PolarHBondContact O-N 3.27Å; L347-A349 VanDerWaalsContact O-N 3.16Å; A349-V351 VanDerWaalsContact C-N 3.31Å; A349-V351 HydrophobicContact CB-CG2 3.86Å; A349-V392 HydrophobicContact CB-CG2 3.33Å
350	G	90.2	Very high	90.3	Very high	25 Å²	25	27.8 Å²	27.8	26%	0.258	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	25.7	-173.7	0	0	0	0	0	112.6	G346 L347 N376 R394	G346-G350 PolarHBondContact O-N 3Å; L347-G350 PolarHBondContact O-N 2.84Å; G350-N376 WeakPolarHBondContact CA-ND2 3.13Å; G350-N376 PolarHBondContact N-ND2 3.37Å; G350-R394 PolarHBondContact O-NH2 2.92Å
351	V	91.6	Very high	90.1	Very high	14 Å²	14	27.9 Å²	27.9	9%	0.085	16%	0.159	C	C	.	.	S	Bend	trans	-83.3	-38	178.6	169.1	0	0	0	0	111.1	G346 A349 L359 V392 S393 R394	G346-V351 PolarHBondContact O-N 2.85Å; A349-V351 VanDerWaalsContact C-N 3.31Å; A349-V351 HydrophobicContact CB-CG2 3.86Å; V351-L359 HydrophobicContact CG1-CB 3.63Å; V351-V392 HydrophobicContact CG2-CB 4.48Å; V351-V392 HydrophobicContact CG2-CG2 3.95Å; V351-S393 VanDerWaalsContact CG1-C 3.4Å; V351-S393 WeakPolarHBondContact CG1-O 3.4Å; V351-R394 HydrophobicContact CG1-CB 4.22Å; V351-R394 PolarHBondContact O-NH1 3.2Å; V351-R394 PolarHBondContact O-NH2 2.99Å
352	I	90.3	Very high	89.6	Confident	8 Å²	8	28.9 Å²	28.9	4%	0.041	17%	0.165	C	C	.	.	S	Bend	trans	-126.9	158.6	172.9	57	168	0	0	0	108.7	C319 C343 L347 L359	C319-I352 HydrophobicContact CB-CD1 3.65Å; C343-I352 HydrophobicContact CB-CD1 4.48Å; L347-I352 HydrophobicContact CD2-CG1 4.38Å; L347-I352 HydrophobicContact CG-CD1 4.45Å; L347-I352 HydrophobicContact CG-CG1 4.3Å; I352-L359 HydrophobicContact CD1-CD2 3.74Å; I352-L359 HydrophobicContact CG1-CD2 4.29Å; I352-L359 HydrophobicContact CG2-CB 4.17Å; I352-L359 HydrophobicContact CG2-CD2 4.18Å
353	D	88.7	Confident	89.1	Confident	98 Å²	98	31.7 Å²	31.7	52%	0.524	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-104.3	179.1	175.9	-59.2	-48.1	0	0	0	110.2	L347 D355 G356	L347-D353 VanDerWaalsContact CD2-O 3.31Å; L347-D353 WeakPolarHBondContact CD2-O 3.17Å; D353-D355 PolarHBondContact O-N 3.15Å; D353-D355 VanDerWaalsContact O-N 3.13Å; D353-G356 PolarHBondContact O-N 3.17Å
354	N	90.1	Very high	88.6	Confident	64 Å²	64	37.9 Å²	37.9	34%	0.342	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.7	-178.1	-164.9	47.6	0	0	0	113.5	A321 G322 C323 L324 G356	A321-N354 CarbonylContact C-O 3.54Å; A321-N354 VanDerWaalsContact CA-O 3.23Å; A321-N354 WeakPolarHBondContact CA-O 3.24Å; G322-N354 VanDerWaalsContact C-OD1 3.3Å; G322-N354 VanDerWaalsContact CA-OD1 3.28Å; G322-N354 WeakPolarHBondContact CA-OD1 3.28Å; G322-N354 PolarHBondContact N-O 3.47Å; G322-N354 PolarHBondContact N-OD1 2.86Å; C323-N354 PolarHBondContact N-OD1 2.77Å; L324-N354 HydrophobicContact CB-CB 4.49Å; L324-N354 VanDerWaalsContact CB-OD1 3.26Å; L324-N354 WeakPolarHBondContact CB-OD1 3.44Å; L324-N354 PolarHBondContact N-OD1 3.46Å; N354-G356 PolarHBondContact O-N 2.94Å
355	D	84.6	Confident	87.8	Confident	145 Å²	145	38.7 Å²	38.7	78%	0.775	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-5.8	169.3	-58.8	-35.1	0	0	0	112.4	A321 D353	A321-D355 WeakPolarHBondContact CB-O 3.24Å; D353-D355 PolarHBondContact O-N 3.15Å; D353-D355 VanDerWaalsContact O-N 3.13Å
356	G	85	Confident	87.4	Confident	14 Å²	14	46.3 Å²	46.3	14%	0.144	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	83.2	-150.3	-179.5	0	0	0	0	0	112.3	C319 P320 D353 N354	C319-G356 CarbonylContact O-C 3.58Å; C319-G356 WeakPolarHBondContact O-CA 3.31Å; P320-G356 WeakPolarHBondContact O-CA 3.33Å; D353-G356 PolarHBondContact O-N 3.17Å; N354-G356 PolarHBondContact O-N 2.94Å
357	G	82.8	Confident	87	Confident	19 Å²	19	49.7 Å²	49.7	20%	0.196	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.8	-166.8	178.2	0	0	0	0	0	113.7	C319	C319-G357 PolarHBondContact N-O 3.24Å; C319-G357 PolarHBondContact O-N 2.93Å
358	W	83.9	Confident	86.5	Confident	95 Å²	95	54.6 Å²	54.6	36%	0.36	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	139.9	-168.4	-49.8	-87.5	0	0	0	112.6	Y317 E318 V395 R421	Y317-W358 WeakPolarHBondContact O-CA 3.37Å; E318-W358 VanDerWaalsContact CD-NE1 3.29Å; E318-W358 PolarHBondContact OE2-NE1 2.85Å; E318-W358 VanDerWaalsContact OE2-NE1 3.14Å; W358-V395 HydrophobicContact CB-CG2 3.81Å; W358-R421 VanDerWaalsContact CE2-NH1 3.25Å
359	L	88.3	Confident	85.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	147.2	171.1	70.6	120.7	0	0	0	112.1	Y317 C319 V342 V351 I352 V361 V392	Y317-L359 PolarHBondContact N-O 3.38Å; Y317-L359 PolarHBondContact O-N 2.97Å; C319-L359 HydrophobicContact CB-CD2 4.45Å; C319-L359 WeakPolarHBondContact SG-CD2 3.49Å; V342-L359 HydrophobicContact CG1-CD1 3.84Å; V342-L359 HydrophobicContact CG1-CD2 4.41Å; V342-L359 HydrophobicContact CG1-CG 4.44Å; V351-L359 HydrophobicContact CG1-CB 3.63Å; I352-L359 HydrophobicContact CD1-CD2 3.74Å; I352-L359 HydrophobicContact CG1-CD2 4.29Å; I352-L359 HydrophobicContact CG2-CB 4.17Å; I352-L359 HydrophobicContact CG2-CD2 4.18Å; L359-V361 HydrophobicContact CD1-CG2 3.47Å; L359-V361 VanDerWaalsContact CD1-CG2 3.47Å; L359-V361 HydrophobicContact CG-CG2 4.48Å; L359-V392 HydrophobicContact CD1-CB 3.81Å; L359-V392 HydrophobicContact CD1-CG1 3.62Å
360	D	85.3	Confident	85.9	Confident	13 Å²	13	59.7 Å²	59.7	7%	0.07	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.5	174.3	-79.8	-12.9	0	0	0	109	T314 H315 R316 V392 S393	T314-D360 HydrophobicContact CG2-CB 3.62Å; H315-D360 CarbonylContact O-C 3.52Å; H315-D360 WeakPolarHBondContact O-CA 3.39Å; R316-D360 WeakPolarHBondContact CB-OD1 3.42Å; R316-D360 IonicContact CZ-OD1 3.15Å; R316-D360 IonicContact CZ-OD2 3.42Å; R316-D360 IonicContact NE-OD1 3.87Å; R316-D360 PolarHBondContact NE-OD1 3.1Å; R316-D360 IonicContact NE-OD2 2.59Å; R316-D360 IonicContact NH2-OD1 3.67Å; R316-D360 PolarHBondContact NH2-OD1 2.85Å; R316-D360 IonicContact NH2-OD2 2.86Å; R316-D360 PolarHBondContact NH2-OD2 2.03Å; D360-V392 CarbonylContact O-C 3.55Å; D360-V392 WeakPolarHBondContact O-CA 3.48Å; D360-S393 PolarHBondContact N-O 2.99Å; D360-S393 PolarHBondContact O-N 3.04Å; D360-S393 PolarHBondContact O-OG 3.5Å
361	V	86.6	Confident	85.5	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.4	179	179.9	0	0	0	0	109.3	L301 T314 H315 Y317 V342 L359 F390 V392	L301-V361 HydrophobicContact CD1-CB 4.49Å; L301-V361 HydrophobicContact CD1-CG1 3.73Å; L301-V361 HydrophobicContact CD2-CG1 3.65Å; L301-V361 HydrophobicContact CG-CG1 4.33Å; T314-V361 CarbonylContact C-O 3.57Å; T314-V361 VanDerWaalsContact CA-O 3.27Å; T314-V361 WeakPolarHBondContact CA-O 3.35Å; H315-V361 PolarHBondContact N-O 3.26Å; H315-V361 PolarHBondContact O-N 2.75Å; Y317-V361 HydrophobicContact CD2-CB 3.88Å; Y317-V361 HydrophobicContact CD2-CG2 3.39Å; Y317-V361 HydrophobicContact CE2-CB 3.77Å; Y317-V361 HydrophobicContact CE2-CG1 4.49Å; Y317-V361 HydrophobicContact CE2-CG2 3.71Å; Y317-V361 HydrophobicContact CG-CG2 4.45Å; V342-V361 HydrophobicContact CG1-CG2 3.55Å; L359-V361 HydrophobicContact CD1-CG2 3.47Å; L359-V361 VanDerWaalsContact CD1-CG2 3.47Å; L359-V361 HydrophobicContact CG-CG2 4.48Å; V361-F390 HydrophobicContact CG1-CB 4.1Å; V361-F390 HydrophobicContact CG1-CD2 3.63Å; V361-F390 HydrophobicContact CG1-CE2 4.28Å; V361-F390 HydrophobicContact CG1-CG 4.12Å; V361-V392 HydrophobicContact CG2-CG1 4.19Å
362	T	84	Confident	85.4	Confident	20 Å²	20	69.4 Å²	69.4	12%	0.123	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	118	176.5	-57.2	0	0	0	0	109.5	T314 F390 T391	T314-T362 WeakPolarHBondContact CG2-OG1 3.49Å; T314-T362 PolarHBondContact OG1-OG1 3.18Å; T362-F390 CarbonylContact O-C 3.53Å; T362-F390 WeakPolarHBondContact O-CA 2.99Å; T362-T391 PolarHBondContact N-O 2.64Å; T362-T391 PolarHBondContact O-N 2.03Å; T362-T391 PolarHBondContact O-OG1 2.81Å
363	R	83.1	Confident	85.4	Confident	60 Å²	60	70.4 Å²	70.4	23%	0.226	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	140.3	171.6	-92.5	-168.4	169.9	175.9	-10.2	110.8	L301 C305 C310 M338	L301-R363 HydrophobicContact CD2-CG 4.19Å; C305-R363 VanDerWaalsContact CB-CZ 3.41Å; C305-R363 PolarHBondContact O-NH2 3.15Å; C310-R363 VanDerWaalsContact O-CD 3.22Å; C310-R363 WeakPolarHBondContact O-CD 3.44Å; C310-R363 PolarHBondContact O-NH1 3.03Å; M338-R363 PolarHBondContact SD-NE 3.18Å; M338-R363 VanDerWaalsContact SD-NE 3.45Å; M338-R363 PolarHBondContact SD-NH2 3.03Å
364	R	82	Confident	85.5	Confident	130 Å²	130	71.1 Å²	71.1	49%	0.491	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	162.9	175.3	-62.8	-57.9	-176.3	168.7	0.6	108.9	Y335 S389 T391	Y335-R364 HydrophobicContact CD1-CB 4.49Å; Y335-R364 HydrophobicContact CD1-CG 4.23Å; Y335-R364 HydrophobicContact CE1-CG 4.23Å; R364-S389 CarbonylContact C-O 3.44Å; R364-S389 WeakPolarHBondContact CA-O 3.25Å; R364-S389 WeakPolarHBondContact CB-OG 3.31Å; R364-S389 PolarHBondContact N-O 2.79Å; R364-T391 HydrophobicContact CG-CG2 3.73Å; R364-T391 PolarHBondContact NE-OG1 3.02Å; R364-T391 VanDerWaalsContact NE-OG1 3.15Å
365	G	78.6	Confident	85.4	Confident	56 Å²	56	72.8 Å²	72.8	58%	0.577	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	-178	175.8	0	0	0	0	0	112.7	K367 S389	G365-K367 PolarHBondContact O-N 3.33Å; G365-S389 PolarHBondContact O-N 3.35Å; G365-S389 PolarHBondContact O-OG 3.33Å
366	R	84.7	Confident	85.7	Confident	161 Å²	161	70.5 Å²	70.5	61%	0.608	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	135.3	177	-136.2	167.4	74.8	117.2	-2.4	110.4	S386 A387	R366-S386 PolarHBondContact NE-OG 3.4Å; R366-S386 PolarHBondContact NH1-OG 3Å; R366-S386 PolarHBondContact NH2-OG 2.81Å; R366-A387 WeakPolarHBondContact CA-O 3.26Å; R366-A387 WeakPolarHBondContact CG-O 3.05Å
367	K	86.4	Confident	85.8	Confident	70 Å²	70	72.6 Å²	72.6	30%	0.304	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138	172.5	-71.6	-69.1	-173.6	176.5	0	108.6	Y335 G365 F370 S386 A387 S389	Y335-K367 HydrophobicContact CD2-CD 4.49Å; Y335-K367 HydrophobicContact CG-CD 4.46Å; Y335-K367 HydrophobicContact CG-CG 4.34Å; G365-K367 PolarHBondContact O-N 3.33Å; K367-F370 HydrophobicContact CB-CE1 4.32Å; K367-F370 HydrophobicContact CB-CE2 4.25Å; K367-F370 HydrophobicContact CB-CZ 3.92Å; K367-S386 CarbonylContact O-C 3.46Å; K367-S386 WeakPolarHBondContact O-CA 3.49Å; K367-S386 PolarHBondContact O-OG 3.13Å; K367-A387 PolarHBondContact N-O 2.88Å; K367-A387 PolarHBondContact O-N 2.86Å; K367-S389 VanDerWaalsContact CG-OG 3.3Å; K367-S389 WeakPolarHBondContact CG-OG 3.01Å
368	N	83.8	Confident	86.1	Confident	110 Å²	110	71.7 Å²	71.7	59%	0.588	35%	0.354	S	S	*	.	S	Bend	trans	-75.6	-27.2	-173.9	-66.6	-21	0	0	0	113.1	H385 S386	N368-H385 CarbonylContact O-C 3.2Å; N368-S386 PolarHBondContact O-N 3.23Å; N368-S386 PolarHBondContact OD1-OG 2.78Å
369	Y	81.3	Confident	86.5	Confident	145 Å²	145	74 Å²	74	57%	0.569	37%	0.369	S	S	*	.			trans	-151.2	160.6	177	61.6	-91.7	0	0	0	110.5	I371 K383	Y369-I371 HydrophobicContact CD2-CG1 4.05Å; Y369-I371 HydrophobicContact CE2-CD1 4.07Å; Y369-I371 HydrophobicContact CE2-CG1 3.95Å; Y369-K383 CarbonylContact C-O 3.44Å; Y369-K383 VanDerWaalsContact CA-O 3.24Å; Y369-K383 WeakPolarHBondContact CA-O 3.28Å
370	F	91.8	Very high	86.8	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.018	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-129.7	123.4	-179.7	-65.4	-94.8	0	0	0	108.6	V331 Y335 E337 K367 G382 K383 A387	V331-F370 HydrophobicContact CG1-CB 4.25Å; Y335-F370 WeakPolarHBondContact O-CD1 3.48Å; E337-F370 HydrophobicContact CB-CD1 4.34Å; E337-F370 HydrophobicContact CB-CE1 3.98Å; E337-F370 HydrophobicContact CB-CE2 4.49Å; E337-F370 HydrophobicContact CB-CZ 4.06Å; E337-F370 HydrophobicContact CG-CZ 4.43Å; K367-F370 HydrophobicContact CB-CE1 4.32Å; K367-F370 HydrophobicContact CB-CE2 4.25Å; K367-F370 HydrophobicContact CB-CZ 3.92Å; F370-G382 VanDerWaalsContact O-CA 3.32Å; F370-G382 WeakPolarHBondContact O-CA 3.23Å; F370-K383 HydrophobicContact CB-CB 4.14Å; F370-K383 HydrophobicContact CD2-CB 4.11Å; F370-K383 HydrophobicContact CD2-CG 4.5Å; F370-K383 PolarHBondContact N-O 3.26Å; F370-K383 PolarHBondContact O-N 2.82Å; F370-A387 HydrophobicContact CE2-CB 3.78Å; F370-A387 HydrophobicContact CZ-CB 4.17Å
371	I	83.6	Confident	87.2	Confident	105 Å²	105	77.5 Å²	77.5	54%	0.538	39%	0.388	S	S	.	.			trans	-85.9	131.4	-177.8	-58.3	170.7	0	0	0	109.1	G332 T333 Y369	G332-I371 CarbonylContact C-O 3.39Å; G332-I371 VanDerWaalsContact C-O 3.27Å; G332-I371 WeakPolarHBondContact CA-O 3.45Å; T333-I371 WeakPolarHBondContact CB-O 2.95Å; T333-I371 PolarHBondContact N-O 3.35Å; T333-I371 VanDerWaalsContact N-O 3.16Å; T333-I371 PolarHBondContact OG1-O 2.86Å; Y369-I371 HydrophobicContact CD2-CG1 4.05Å; Y369-I371 HydrophobicContact CE2-CD1 4.07Å; Y369-I371 HydrophobicContact CE2-CG1 3.95Å
372	K	88.6	Confident	87.2	Confident	139 Å²	139	79 Å²	79	60%	0.604	40%	0.403	S	S	*	.			trans	-76.1	142.4	170.8	63.8	-178.2	-175.1	179.4	0	111.2	S380	K372-S380 WeakPolarHBondContact CB-O 3.37Å
373	S	89.3	Confident	87.5	Confident	29 Å²	29	80.7 Å²	80.7	20%	0.203	41%	0.409	C	S	.	.			trans	-151.9	169.4	167.9	67.6	0	0	0	0	110.7	T333 H348 S380	T333-S373 VanDerWaalsContact CG2-OG 3.3Å; T333-S373 WeakPolarHBondContact CG2-OG 2.95Å; T333-S373 WeakPolarHBondContact OG1-CB 3.37Å; T333-S373 PolarHBondContact OG1-N 2.73Å; T333-S373 PolarHBondContact OG1-OG 3.48Å; H348-S373 PolarHBondContact CE1-OG 2.84Å; H348-S373 VanDerWaalsContact CE1-OG 3.27Å; H348-S373 PolarHBondContact NE2-O 3.18Å; H348-S373 PolarHBondContact NE2-OG 3.04Å; S373-S380 PolarHBondContact N-OG 2.83Å; S373-S380 PolarHBondContact O-N 2.04Å; S373-S380 PolarHBondContact O-OG 3.2Å
374	N	91.8	Very high	87.7	Confident	113 Å²	113	86.6 Å²	86.6	60%	0.604	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.8	169.5	-173.8	8.3	0	0	0	107.5	V378	N374-V378 PolarHBondContact OD1-O 2.95Å; N374-V378 VanDerWaalsContact OD1-O 3.09Å
375	K	88.4	Confident	87.8	Confident	98 Å²	98	87.2 Å²	87.2	43%	0.426	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	138	-177.7	-68.8	-170.1	177.3	-168.1	0	109.9	H348 G377 V378	H348-K375 VanDerWaalsContact O-CB 3.25Å; H348-K375 WeakPolarHBondContact O-CB 3.4Å; K375-G377 PolarHBondContact O-N 3.19Å; K375-V378 PolarHBondContact N-O 2.03Å; K375-V378 PolarHBondContact O-N 2.93Å; K375-V378 VanDerWaalsContact O-O 3.13Å
376	N	90.7	Very high	88.1	Confident	98 Å²	98	86.2 Å²	86.2	52%	0.524	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	42.6	176.2	-51.2	-38	0	0	0	113.4	L347 H348 G350 V378	L347-N376 VanDerWaalsContact O-CB 3.22Å; L347-N376 WeakPolarHBondContact O-CB 3.41Å; L347-N376 PolarHBondContact O-ND2 3Å; H348-N376 PolarHBondContact O-ND2 3.02Å; G350-N376 WeakPolarHBondContact CA-ND2 3.13Å; G350-N376 PolarHBondContact N-ND2 3.37Å; N376-V378 PolarHBondContact O-N 3.3Å
377	G	85.9	Confident	88.2	Confident	58 Å²	58	79.1 Å²	79.1	60%	0.598	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	2.6	179.5	0	0	0	0	0	115.6	K375	K375-G377 PolarHBondContact O-N 3.19Å
378	V	90.9	Very high	88.3	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.3	175.1	-178.3	0	0	0	0	109.8	L324 V330 L347 H348 N374 K375 N376	L324-V378 HydrophobicContact CD1-CG2 3.78Å; V330-V378 HydrophobicContact CB-CG1 4.38Å; V330-V378 HydrophobicContact CG2-CG1 3.98Å; L347-V378 HydrophobicContact CB-CG2 3.83Å; H348-V378 HydrophobicContact CB-CB 3.92Å; H348-V378 HydrophobicContact CB-CG1 4Å; H348-V378 PolarHBondContact CD2-O 3.27Å; N374-V378 PolarHBondContact OD1-O 2.95Å; N374-V378 VanDerWaalsContact OD1-O 3.09Å; K375-V378 PolarHBondContact N-O 2.03Å; K375-V378 PolarHBondContact O-N 2.93Å; K375-V378 VanDerWaalsContact O-O 3.13Å; N376-V378 PolarHBondContact O-N 3.3Å
379	Q	91.5	Very high	88.6	Confident	143 Å²	143	74.5 Å²	74.5	67%	0.668	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.5	172.1	-171.5	175.8	12.8	0	0	110.4
380	S	93.9	Very high	89.1	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.014	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-89.8	153.1	173.2	59.5	0	0	0	0	112.5	V330 G332 T333 H348 K372 S373	V330-S380 CarbonylContact O-C 3.57Å; V330-S380 VanDerWaalsContact O-CA 3.27Å; V330-S380 WeakPolarHBondContact O-CA 3.3Å; G332-S380 WeakPolarHBondContact O-CB 3.35Å; G332-S380 PolarHBondContact O-OG 3.49Å; T333-S380 PolarHBondContact OG1-OG 2.98Å; H348-S380 WeakPolarHBondContact NE2-CB 3.39Å; H348-S380 PolarHBondContact NE2-OG 3.06Å; K372-S380 WeakPolarHBondContact CB-O 3.37Å; S373-S380 PolarHBondContact N-OG 2.83Å; S373-S380 PolarHBondContact O-N 2.04Å; S373-S380 PolarHBondContact O-OG 3.2Å
381	L	93.7	Very high	89	Confident	85 Å²	85	68.3 Å²	68.3	45%	0.445	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-93.2	152.7	175.6	-58.3	176.2	0	0	0	110.9	V330 V331 G332	V330-L381 PolarHBondContact O-N 2.92Å; V331-L381 CarbonylContact C-O 3.53Å; V331-L381 WeakPolarHBondContact CA-O 3.35Å; V331-L381 HydrophobicContact CG2-CB 4.24Å; G332-L381 PolarHBondContact N-O 2.76Å
382	G	88	Confident	89.4	Confident	32 Å²	32	64.2 Å²	64.2	33%	0.33	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-97.8	148.7	177.1	0	0	0	0	0	110.5	F370	F370-G382 VanDerWaalsContact O-CA 3.32Å; F370-G382 WeakPolarHBondContact O-CA 3.23Å
383	K	88.8	Confident	89.4	Confident	56 Å²	56	59.9 Å²	59.9	24%	0.243	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-143.8	123.9	177	-177.2	172.2	-176.7	165.1	0	110.2	V331 E337 Y369 F370 H385	V331-K383 HydrophobicContact CG1-CB 3.78Å; V331-K383 HydrophobicContact CG1-CD 4.43Å; E337-K383 VanDerWaalsContact CD-NZ 3.28Å; E337-K383 IonicContact OE1-NZ 3.74Å; E337-K383 PolarHBondContact OE1-NZ 2.88Å; E337-K383 WeakPolarHBondContact OE2-CD 3.38Å; E337-K383 IonicContact OE2-NZ 2.63Å; E337-K383 PolarHBondContact OE2-NZ 3.15Å; Y369-K383 CarbonylContact C-O 3.44Å; Y369-K383 VanDerWaalsContact CA-O 3.24Å; Y369-K383 WeakPolarHBondContact CA-O 3.28Å; F370-K383 HydrophobicContact CB-CB 4.14Å; F370-K383 HydrophobicContact CD2-CB 4.11Å; F370-K383 HydrophobicContact CD2-CG 4.5Å; F370-K383 PolarHBondContact N-O 3.26Å; F370-K383 PolarHBondContact O-N 2.82Å; K383-H385 HydrophobicContact CG-CB 4.41Å
384	Y	87.1	Confident	89.2	Confident	185 Å²	185	65.8 Å²	65.8	73%	0.725	34%	0.341	S	S	*	.			trans	-100.2	23	-177.7	-59	-80.8	0	0	0	113.1
385	H	85.3	Confident	88.8	Confident	142 Å²	142	61.1 Å²	61.1	66%	0.657	32%	0.317	S	S	*	.	S	Bend	trans	-122.3	149.1	176.4	-65	-66.7	0	0	0	110.5	N368 K383 A387	N368-H385 CarbonylContact O-C 3.2Å; K383-H385 HydrophobicContact CG-CB 4.41Å; H385-A387 PolarHBondContact O-N 3.41Å
386	S	84.4	Confident	88.3	Confident	36 Å²	36	59.4 Å²	59.4	25%	0.252	32%	0.321	S	S	.	.			trans	-71.8	124.9	-175.9	-166.4	0	0	0	0	111.8	R366 K367 N368	R366-S386 PolarHBondContact NE-OG 3.4Å; R366-S386 PolarHBondContact NH1-OG 3Å; R366-S386 PolarHBondContact NH2-OG 2.81Å; K367-S386 CarbonylContact O-C 3.46Å; K367-S386 WeakPolarHBondContact O-CA 3.49Å; K367-S386 PolarHBondContact O-OG 3.13Å; N368-S386 PolarHBondContact O-N 3.23Å; N368-S386 PolarHBondContact OD1-OG 2.78Å
387	A	87.6	Confident	87.9	Confident	12 Å²	12	58.8 Å²	58.8	10%	0.099	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	161.3	179.8	0	0	0	0	0	111.7	E337 R366 K367 F370 H385	E337-A387 HydrophobicContact CG-CB 3.97Å; R366-A387 WeakPolarHBondContact CA-O 3.26Å; R366-A387 WeakPolarHBondContact CG-O 3.05Å; K367-A387 PolarHBondContact N-O 2.88Å; K367-A387 PolarHBondContact O-N 2.86Å; F370-A387 HydrophobicContact CE2-CB 3.78Å; F370-A387 HydrophobicContact CZ-CB 4.17Å; H385-A387 PolarHBondContact O-N 3.41Å
388	N	88.6	Confident	88	Confident	83 Å²	83	60.9 Å²	60.9	44%	0.444	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	142.7	175.5	-69.5	-22.3	0	0	0	110.4	M338	M338-N388 HydrophobicContact CE-CB 4.4Å; M338-N388 HydrophobicContact CG-CB 3.7Å; M338-N388 WeakPolarHBondContact CG-O 3.27Å; M338-N388 PolarHBondContact N-O 2.83Å; M338-N388 VanDerWaalsContact N-O 3.13Å; M338-N388 HydrophobicContact SD-CB 3.55Å; M338-N388 VanDerWaalsContact SD-CB 3.55Å
389	S	90.3	Very high	87.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	164.8	-172.8	69.3	0	0	0	0	112.9	Y336 R364 G365 K367	Y336-S389 CarbonylContact O-C 3.54Å; Y336-S389 WeakPolarHBondContact O-CA 3.14Å; R364-S389 CarbonylContact C-O 3.44Å; R364-S389 WeakPolarHBondContact CA-O 3.25Å; R364-S389 WeakPolarHBondContact CB-OG 3.31Å; R364-S389 PolarHBondContact N-O 2.79Å; G365-S389 PolarHBondContact O-N 3.35Å; G365-S389 PolarHBondContact O-OG 3.33Å; K367-S389 VanDerWaalsContact CG-OG 3.3Å; K367-S389 WeakPolarHBondContact CG-OG 3.01Å
390	F	91.2	Very high	87.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	162.3	171	69.4	-92.7	0	0	0	111	L301 Y335 Y336 E337 A345 V361 T362 V392	L301-F390 HydrophobicContact CB-CD1 4.04Å; L301-F390 HydrophobicContact CB-CE1 3.78Å; L301-F390 HydrophobicContact CB-CZ 4.22Å; L301-F390 HydrophobicContact CD2-CB 3.34Å; L301-F390 HydrophobicContact CD2-CD1 3.28Å; L301-F390 HydrophobicContact CD2-CD2 3.94Å; L301-F390 HydrophobicContact CD2-CE1 3.89Å; L301-F390 HydrophobicContact CD2-CE2 4.49Å; L301-F390 HydrophobicContact CD2-CG 3.27Å; L301-F390 HydrophobicContact CD2-CZ 4.46Å; L301-F390 HydrophobicContact CG-CD1 4.3Å; L301-F390 HydrophobicContact CG-CE1 4.5Å; Y335-F390 WeakPolarHBondContact CA-O 2.97Å; Y336-F390 HydrophobicContact CD2-CD2 4.5Å; Y336-F390 HydrophobicContact CD2-CE2 4.24Å; Y336-F390 HydrophobicContact CG-CE2 4.34Å; Y336-F390 HydrophobicContact CG-CZ 4.42Å; Y336-F390 PolarHBondContact N-O 3.39Å; Y336-F390 WeakPolarHBondContact O-CD1 3.41Å; Y336-F390 PolarHBondContact O-N 2.59Å; E337-F390 WeakPolarHBondContact O-CE1 3.4Å; A345-F390 HydrophobicContact CB-CE2 4Å; A345-F390 HydrophobicContact CB-CZ 4.02Å; V361-F390 HydrophobicContact CG1-CB 4.1Å; V361-F390 HydrophobicContact CG1-CD2 3.63Å; V361-F390 HydrophobicContact CG1-CE2 4.28Å; V361-F390 HydrophobicContact CG1-CG 4.12Å; T362-F390 CarbonylContact O-C 3.53Å; T362-F390 WeakPolarHBondContact O-CA 2.99Å; F390-V392 HydrophobicContact CD2-CG1 3.92Å; F390-V392 HydrophobicContact CE2-CG1 3.65Å
391	T	90.4	Very high	87.5	Confident	18 Å²	18	62 Å²	62	11%	0.11	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147.2	173.6	51	0	0	0	0	108.8	Y335 T362 R364	Y335-T391 HydrophobicContact CD1-CG2 3.58Å; Y335-T391 HydrophobicContact CE1-CG2 3.72Å; T362-T391 PolarHBondContact N-O 2.64Å; T362-T391 PolarHBondContact O-N 2.03Å; T362-T391 PolarHBondContact O-OG1 2.81Å; R364-T391 HydrophobicContact CG-CG2 3.73Å; R364-T391 PolarHBondContact NE-OG1 3.02Å; R364-T391 VanDerWaalsContact NE-OG1 3.15Å
392	V	91.4	Very high	87.3	Confident	19 Å²	19	58.5 Å²	58.5	12%	0.115	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.4	174.7	-60	0	0	0	0	109.9	Y336 A345 A349 V351 L359 D360 V361 F390	Y336-V392 HydrophobicContact CD2-CG2 4.46Å; Y336-V392 HydrophobicContact CE2-CG2 3.9Å; A345-V392 HydrophobicContact CB-CG1 4.41Å; A349-V392 HydrophobicContact CB-CG2 3.33Å; V351-V392 HydrophobicContact CG2-CB 4.48Å; V351-V392 HydrophobicContact CG2-CG2 3.95Å; L359-V392 HydrophobicContact CD1-CB 3.81Å; L359-V392 HydrophobicContact CD1-CG1 3.62Å; D360-V392 CarbonylContact O-C 3.55Å; D360-V392 WeakPolarHBondContact O-CA 3.48Å; V361-V392 HydrophobicContact CG2-CG1 4.19Å; F390-V392 HydrophobicContact CD2-CG1 3.92Å; F390-V392 HydrophobicContact CE2-CG1 3.65Å
393	S	88.1	Confident	87.3	Confident	48 Å²	48	61 Å²	61	34%	0.336	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.8	179.9	50.1	0	0	0	0	111.2	V351 D360	V351-S393 VanDerWaalsContact CG1-C 3.4Å; V351-S393 WeakPolarHBondContact CG1-O 3.4Å; D360-S393 PolarHBondContact N-O 2.99Å; D360-S393 PolarHBondContact O-N 3.04Å; D360-S393 PolarHBondContact O-OG 3.5Å
394	R	85.8	Confident	87.3	Confident	153 Å²	153	59.1 Å²	59.1	58%	0.577	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.4	175.8	-165.7	176.4	-67.1	-93.1	-0.1	110.1	G350 V351 A396	G350-R394 PolarHBondContact O-NH2 2.92Å; V351-R394 HydrophobicContact CG1-CB 4.22Å; V351-R394 PolarHBondContact O-NH1 3.2Å; V351-R394 PolarHBondContact O-NH2 2.99Å; R394-A396 PolarHBondContact O-N 3.03Å
395	V	82.3	Confident	87.4	Confident	16 Å²	16	51.3 Å²	51.3	10%	0.097	29%	0.291	C	S	.	.			trans	-67.4	115.3	172.2	175.1	0	0	0	0	108.3	R316 W358 V397 R421	R316-V395 HydrophobicContact CG-CG2 4.4Å; W358-V395 HydrophobicContact CB-CG2 3.81Å; V395-V397 PolarHBondContact O-N 2.83Å; V395-R421 HydrophobicContact CG1-CB 3.86Å
396	A	78.8	Confident	87.2	Confident	62 Å²	62	44.6 Å²	44.6	51%	0.512	26%	0.259	S	S	.	.			trans	-71.4	129.1	174.1	0	0	0	0	0	109.5	R394 P420 R421	R394-A396 PolarHBondContact O-N 3.03Å; A396-P420 HydrophobicContact CB-CB 4.18Å; A396-P420 CarbonylContact O-C 3.52Å; A396-P420 WeakPolarHBondContact O-CA 3.31Å; A396-P420 VanDerWaalsContact O-CB 3.26Å; A396-P420 WeakPolarHBondContact O-CB 3.43Å; A396-R421 PolarHBondContact O-N 3.46Å
397	V	82.6	Confident	87	Confident	85 Å²	85	47.7 Å²	47.7	52%	0.515	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130.5	174.5	-178.4	0	0	0	0	108.5	V395 R421 Y467	V395-V397 PolarHBondContact O-N 2.83Å; V397-R421 CarbonylContact C-O 3.41Å; V397-R421 VanDerWaalsContact CA-O 3.28Å; V397-R421 WeakPolarHBondContact CA-O 3.03Å; V397-R421 HydrophobicContact CG2-CB 4.29Å; V397-Y467 HydrophobicContact CG1-CD1 4.27Å; V397-Y467 HydrophobicContact CG1-CE1 3.79Å
398	K	86.6	Confident	86.5	Confident	101 Å²	101	53.9 Å²	53.9	44%	0.439	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118.9	177.3	-171.7	170.1	176.5	-176.2	0	109.9	I400 L409 P420 R421 L422 Y423	K398-I400 HydrophobicContact CG-CG2 4.18Å; K398-L409 HydrophobicContact CD-CD2 3.84Å; K398-P420 HydrophobicContact CB-CB 4.19Å; K398-P420 HydrophobicContact CB-CG 4.28Å; K398-R421 PolarHBondContact N-O 3.43Å; K398-L422 HydrophobicContact CB-CD2 4.27Å; K398-L422 WeakPolarHBondContact O-CA 3.05Å; K398-Y423 PolarHBondContact O-N 3.47Å
399	A	87.3	Confident	85.9	Confident	78 Å²	78	50.5 Å²	50.5	65%	0.645	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	134.5	167.5	0	0	0	0	0	109.2	Y423	A399-Y423 HydrophobicContact CB-CD1 4.45Å
400	I	90.6	Very high	85.1	Confident	16 Å²	16	50.9 Å²	50.9	8%	0.082	28%	0.281	C	S	.	.			trans	-128.5	165.1	-176.3	59.2	162.2	0	0	0	110.7	K398 T404 L409 L422 Y423 P425 A450 C451	K398-I400 HydrophobicContact CG-CG2 4.18Å; I400-T404 HydrophobicContact CB-CG2 4.2Å; I400-T404 HydrophobicContact CG2-CG2 4.18Å; I400-L409 HydrophobicContact CD1-CD1 4.19Å; I400-L409 HydrophobicContact CG2-CD1 3.98Å; I400-L409 HydrophobicContact CG2-CD2 3.78Å; I400-L422 HydrophobicContact CD1-CB 3.99Å; I400-L422 HydrophobicContact CD1-CD1 3.95Å; I400-L422 HydrophobicContact CD1-CG 4.42Å; I400-L422 HydrophobicContact CG1-CB 4.26Å; I400-L422 HydrophobicContact CG2-CD2 4.01Å; I400-Y423 WeakPolarHBondContact CG1-O 3.5Å; I400-Y423 PolarHBondContact N-O 3.46Å; I400-Y423 VanDerWaalsContact N-O 3.1Å; I400-P425 VanDerWaalsContact O-CD 3.22Å; I400-P425 WeakPolarHBondContact O-CD 3.36Å; I400-A450 HydrophobicContact CD1-CB 3.89Å; I400-C451 WeakPolarHBondContact CD1-SG 3.36Å
401	T	89.7	Confident	83.7	Confident	75 Å²	75	53.6 Å²	53.6	46%	0.46	30%	0.299	S	S	.	.			trans	-97.3	163.2	174.1	54.4	0	0	0	0	110.3	D403 T404	T401-D403 WeakPolarHBondContact CB-OD1 3.22Å; T401-D403 PolarHBondContact O-N 3.19Å; T401-D403 PolarHBondContact OG1-OD1 3.46Å; T401-T404 PolarHBondContact N-OG1 2.04Å; T401-T404 VanDerWaalsContact N-OG1 3.12Å; T401-T404 WeakPolarHBondContact O-CB 3.32Å; T401-T404 PolarHBondContact O-N 3.17Å; T401-T404 PolarHBondContact O-OG1 3.11Å; T401-T404 PolarHBondContact OG1-OG1 3.48Å
402	C	88.9	Confident	82.5	Confident	12 Å²	12	54.8 Å²	54.8	8%	0.081	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.6	-176.7	-61.4	0	0	0	0	113.8	C428 E431 C436 S449	C402-C428 HydrophobicContact CB-CB 3.61Å; C402-C428 WeakPolarHBondContact CB-SG 3.38Å; C402-C428 WeakPolarHBondContact SG-CA 3.36Å; C402-C428 WeakPolarHBondContact SG-CB 3.43Å; C402-C428 CovalentContact SG-SG 2.04Å; C402-C428 PolarHBondContact SG-SG 2.71Å; C402-E431 HydrophobicContact CB-CB 4.49Å; C402-E431 HydrophobicContact CB-CG 4.05Å; C402-C436 VanDerWaalsContact C-SG 3.53Å; C402-C436 PolarHBondContact O-SG 2.91Å; C402-S449 WeakPolarHBondContact O-CB 3.13Å; C402-S449 PolarHBondContact O-OG 3.28Å
403	D	87.7	Confident	80.9	Confident	84 Å²	84	60.6 Å²	60.6	45%	0.449	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-8.3	175.9	65.5	-43.6	0	0	0	113.4	T401 T405 L435	T401-D403 WeakPolarHBondContact CB-OD1 3.22Å; T401-D403 PolarHBondContact O-N 3.19Å; T401-D403 PolarHBondContact OG1-OD1 3.46Å; D403-T405 PolarHBondContact O-N 3.43Å; D403-L435 HydrophobicContact CB-CB 4.49Å
404	T	88.6	Confident	79.1	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.098	35%	0.351	C	S	.	.			trans	-65.8	125.4	-179.4	-54.5	0	0	0	0	110.9	I400 T401 L409 A450	I400-T404 HydrophobicContact CB-CG2 4.2Å; I400-T404 HydrophobicContact CG2-CG2 4.18Å; T401-T404 PolarHBondContact N-OG1 2.04Å; T401-T404 VanDerWaalsContact N-OG1 3.12Å; T401-T404 WeakPolarHBondContact O-CB 3.32Å; T401-T404 PolarHBondContact O-N 3.17Å; T401-T404 PolarHBondContact O-OG1 3.11Å; T401-T404 PolarHBondContact OG1-OG1 3.48Å; T404-L409 HydrophobicContact CG2-CD1 3.57Å; T404-L409 HydrophobicContact CG2-CD2 3.81Å; T404-L409 HydrophobicContact CG2-CG 3.67Å; T404-A450 PolarHBondContact O-N 3.45Å; T404-A450 VanDerWaalsContact O-N 3.14Å
405	T	89	Confident	77.5	Confident	22 Å²	22	63 Å²	63	14%	0.135	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-94.8	155.1	177.4	61	0	0	0	0	111.7	D403 E407 Q408 K447	D403-T405 PolarHBondContact O-N 3.43Å; T405-E407 PolarHBondContact O-N 2.93Å; T405-Q408 PolarHBondContact O-N 2.8Å; T405-K447 WeakPolarHBondContact CG2-O 3.28Å
406	V	82.4	Confident	76	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-70	-24.8	-178.8	-177.2	0	0	0	0	111.9	Q408 L409 C410 Y412 D446 A450 V470 F501	V406-Q408 PolarHBondContact O-N 3.13Å; V406-L409 PolarHBondContact O-N 3.08Å; V406-C410 HydrophobicContact CG1-CB 4.3Å; V406-C410 WeakPolarHBondContact CG1-SG 3.38Å; V406-C410 PolarHBondContact O-N 3.04Å; V406-Y412 WeakPolarHBondContact CG1-OH 3.42Å; V406-Y412 PolarHBondContact O-OH 3.32Å; V406-D446 PolarHBondContact N-O 3.29Å; V406-A450 HydrophobicContact CG2-CB 3.78Å; V406-V470 HydrophobicContact CG1-CG1 3.59Å; V406-V470 HydrophobicContact CG2-CG1 4.12Å; V406-F501 HydrophobicContact CB-CD1 3.6Å; V406-F501 HydrophobicContact CB-CE1 3.61Å; V406-F501 HydrophobicContact CB-CG 4.06Å; V406-F501 HydrophobicContact CB-CZ 4.12Å; V406-F501 HydrophobicContact CG1-CB 4.03Å; V406-F501 HydrophobicContact CG1-CD1 3.84Å; V406-F501 HydrophobicContact CG1-CD2 4.44Å; V406-F501 HydrophobicContact CG1-CE1 4.34Å; V406-F501 HydrophobicContact CG1-CG 3.88Å; V406-F501 HydrophobicContact CG2-CD1 3.63Å; V406-F501 HydrophobicContact CG2-CD2 3.81Å; V406-F501 HydrophobicContact CG2-CE1 3.31Å; V406-F501 HydrophobicContact CG2-CE2 3.5Å; V406-F501 HydrophobicContact CG2-CG 3.86Å; V406-F501 HydrophobicContact CG2-CZ 3.27Å
407	E	80.1	Confident	75	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-50.5	-41.1	170.3	-171.8	171	-159.4	0	0	112.9	T405 D446	T405-E407 PolarHBondContact O-N 2.93Å; E407-D446 HydrophobicContact CB-CB 4.28Å; E407-D446 PolarHBondContact N-O 3.36Å; E407-D446 VanDerWaalsContact N-O 3.11Å
408	Q	76.3	Confident	74	Confident	141 Å²	141	68.4 Å²	68.4	66%	0.659	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-82.3	-14.4	-175.7	-62.8	173.6	-2.9	0	0	114.1	T405 V406	T405-Q408 PolarHBondContact O-N 2.8Å; V406-Q408 PolarHBondContact O-N 3.13Å
409	L	76.6	Confident	73.4	Confident	13 Å²	13	63.6 Å²	63.6	7%	0.068	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-32.8	-168.4	-67	173.5	0	0	0	113.4	K398 I400 T404 V406 L422	K398-L409 HydrophobicContact CD-CD2 3.84Å; I400-L409 HydrophobicContact CD1-CD1 4.19Å; I400-L409 HydrophobicContact CG2-CD1 3.98Å; I400-L409 HydrophobicContact CG2-CD2 3.78Å; T404-L409 HydrophobicContact CG2-CD1 3.57Å; T404-L409 HydrophobicContact CG2-CD2 3.81Å; T404-L409 HydrophobicContact CG2-CG 3.67Å; V406-L409 PolarHBondContact O-N 3.08Å; L409-L422 HydrophobicContact CD1-CD1 3.54Å; L409-L422 HydrophobicContact CD1-CD2 3.8Å; L409-L422 HydrophobicContact CD1-CG 4.31Å; L409-L422 HydrophobicContact CD2-CD2 4.32Å; L409-L422 HydrophobicContact CG-CD2 4.49Å
410	C	72.8	Confident	73.1	Confident	8 Å²	8	61 Å²	61	5%	0.054	31%	0.306	C	S	.	.			trans	-105.7	121.4	-172.2	-59.7	0	0	0	0	109.9	V406 Y412 C419 P472	V406-C410 HydrophobicContact CG1-CB 4.3Å; V406-C410 WeakPolarHBondContact CG1-SG 3.38Å; V406-C410 PolarHBondContact O-N 3.04Å; C410-Y412 HydrophobicContact CB-CD2 4.25Å; C410-Y412 HydrophobicContact CB-CE2 3.87Å; C410-Y412 WeakPolarHBondContact O-CD2 3.38Å; C410-Y412 VanDerWaalsContact O-CE2 3.28Å; C410-Y412 WeakPolarHBondContact O-CE2 3.47Å; C410-Y412 PolarHBondContact O-N 2.79Å; C410-C419 HydrophobicContact CB-CB 4.24Å; C410-C419 WeakPolarHBondContact CB-SG 3.14Å; C410-C419 WeakPolarHBondContact SG-CB 3.45Å; C410-C419 CovalentContact SG-SG 2.01Å; C410-C419 PolarHBondContact SG-SG 3.43Å; C410-P472 HydrophobicContact CB-CG 4.14Å
411	P	62.7	Low	72.8	Confident	56 Å²	56	60.7 Å²	60.7	36%	0.364	30%	0.304	S	S	.	.			trans	-72.5	98	167.2	28.4	-29.1	0	0	0	107.2	E413 R417	P411-E413 PolarHBondContact O-N 3.24Å; P411-R417 HydrophobicContact CG-CB 4.42Å
412	Y	64	Low	72.8	Confident	44 Å²	44	57.1 Å²	57.1	17%	0.173	28%	0.282	C	S	.	.			trans	-72.4	33.8	173.7	-59.2	-96.9	0	0	0	112.3	V406 C410 D446 P472 K499	V406-Y412 WeakPolarHBondContact CG1-OH 3.42Å; V406-Y412 PolarHBondContact O-OH 3.32Å; C410-Y412 HydrophobicContact CB-CD2 4.25Å; C410-Y412 HydrophobicContact CB-CE2 3.87Å; C410-Y412 WeakPolarHBondContact O-CD2 3.38Å; C410-Y412 VanDerWaalsContact O-CE2 3.28Å; C410-Y412 WeakPolarHBondContact O-CE2 3.47Å; C410-Y412 PolarHBondContact O-N 2.79Å; Y412-D446 WeakPolarHBondContact OH-CB 3.41Å; Y412-P472 HydrophobicContact CD1-CB 3.89Å; Y412-P472 HydrophobicContact CE1-CB 3.87Å; Y412-P472 HydrophobicContact CE1-CG 4.46Å; Y412-K499 VanDerWaalsContact CB-NZ 3.25Å; Y412-K499 HydrophobicContact CD1-CB 3.47Å; Y412-K499 VanDerWaalsContact CD1-CB 3.47Å; Y412-K499 HydrophobicContact CD1-CD 3.42Å; Y412-K499 VanDerWaalsContact CD1-CD 3.42Å; Y412-K499 HydrophobicContact CD1-CG 3.32Å; Y412-K499 HydrophobicContact CD2-CD 3.49Å; Y412-K499 VanDerWaalsContact CD2-CD 3.49Å; Y412-K499 HydrophobicContact CD2-CG 4.35Å; Y412-K499 HydrophobicContact CE1-CB 3.17Å; Y412-K499 HydrophobicContact CE1-CD 3.72Å; Y412-K499 HydrophobicContact CE1-CG 3.61Å; Y412-K499 HydrophobicContact CE2-CD 3.8Å; Y412-K499 HydrophobicContact CG-CB 4.26Å; Y412-K499 HydrophobicContact CG-CD 3.28Å; Y412-K499 HydrophobicContact CG-CG 3.72Å; Y412-K499 VanDerWaalsContact CG-NZ 3.34Å
413	E	58.1	Low	72.9	Confident	141 Å²	141	61 Å²	61	66%	0.659	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-83.4	140.4	177.1	-66.6	-179	174.5	0	0	108.8	P411 P415 S416	P411-E413 PolarHBondContact O-N 3.24Å; E413-P415 CarbonylContact O-C 3.59Å; E413-S416 WeakPolarHBondContact O-CA 3.27Å; E413-S416 PolarHBondContact O-N 2.81Å
414	K	50.2	Low	73.2	Confident	188 Å²	188	57 Å²	57	82%	0.817	27%	0.274	S	S	*	.	S	Bend	trans	-87.8	131.1	173.5	-69.1	-174.5	178.9	-176.8	0	109
415	P	51.9	Low	73.3	Confident	62 Å²	62	58.2 Å²	58.2	40%	0.403	28%	0.283	S	S	.	.	S	Bend	cis	-72.6	138.3	1.7	27.8	-32.3	0	0	0	113.4	R312 E413 R417	R312-P415 HydrophobicContact CB-CB 3.91Å; R312-P415 HydrophobicContact CG-CB 3.91Å; R312-P415 HydrophobicContact CG-CG 4.45Å; R312-P415 WeakPolarHBondContact O-CB 3.41Å; E413-P415 CarbonylContact O-C 3.59Å; P415-R417 PolarHBondContact O-N 3.06Å; P415-R417 VanDerWaalsContact O-N 3.13Å
416	S	51.6	Low	73.5	Confident	65 Å²	65	65.8 Å²	65.8	46%	0.455	31%	0.309	S	S	.	.			trans	-57.2	114.6	-176.2	44	0	0	0	0	111.3	E413	E413-S416 WeakPolarHBondContact O-CA 3.27Å; E413-S416 PolarHBondContact O-N 2.81Å
417	R	57.4	Low	73.8	Confident	170 Å²	170	68.1 Å²	68.1	64%	0.642	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-82.1	146.6	167.1	-62.5	-172.7	-175.1	-163.7	5.5	108.7	P411 P415	P411-R417 HydrophobicContact CG-CB 4.42Å; P415-R417 PolarHBondContact O-N 3.06Å; P415-R417 VanDerWaalsContact O-N 3.13Å
418	H	61.7	Low	74.2	Confident	42 Å²	42	63.4 Å²	63.4	19%	0.194	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-62.7	140.7	168.1	-80.4	44.3	0	0	0	109.1	T314	T314-H418 PolarHBondContact O-CE1 3.3Å; T314-H418 PolarHBondContact O-ND1 3.36Å
419	C	74.6	Confident	74.6	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62.4	151	169.6	-53.5	0	0	0	0	109.3	R316 C410 V470 P472	R316-C419 PolarHBondContact NH2-O 3.42Å; C410-C419 HydrophobicContact CB-CB 4.24Å; C410-C419 WeakPolarHBondContact CB-SG 3.14Å; C410-C419 WeakPolarHBondContact SG-CB 3.45Å; C410-C419 CovalentContact SG-SG 2.01Å; C410-C419 PolarHBondContact SG-SG 3.43Å; C419-V470 HydrophobicContact CB-CB 4.29Å; C419-V470 PolarHBondContact SG-O 3.03Å; C419-P472 VanDerWaalsContact SG-CD 3.54Å; C419-P472 WeakPolarHBondContact SG-CG 2.95Å
420	P	79.6	Confident	74.9	Confident	24 Å²	24	65.9 Å²	65.9	16%	0.156	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-55.3	146.8	167.6	25.3	-32.7	0	0	0	109.1	A396 K398 L422	A396-P420 HydrophobicContact CB-CB 4.18Å; A396-P420 CarbonylContact O-C 3.52Å; A396-P420 WeakPolarHBondContact O-CA 3.31Å; A396-P420 VanDerWaalsContact O-CB 3.26Å; A396-P420 WeakPolarHBondContact O-CB 3.43Å; K398-P420 HydrophobicContact CB-CB 4.19Å; K398-P420 HydrophobicContact CB-CG 4.28Å; P420-L422 HydrophobicContact CG-CD2 4.06Å; P420-L422 WeakPolarHBondContact O-CD2 3.38Å; P420-L422 WeakPolarHBondContact O-CG 3.3Å; P420-L422 PolarHBondContact O-N 3.48Å
421	R	85.3	Confident	75.2	Confident	9 Å²	9	70.3 Å²	70.3	3%	0.034	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	130.2	168.4	174	165.6	-73.4	179.9	-3.2	107.7	W358 V395 A396 V397 K398 Y467 D469 V506	W358-R421 VanDerWaalsContact CE2-NH1 3.25Å; V395-R421 HydrophobicContact CG1-CB 3.86Å; A396-R421 PolarHBondContact O-N 3.46Å; V397-R421 CarbonylContact C-O 3.41Å; V397-R421 VanDerWaalsContact CA-O 3.28Å; V397-R421 WeakPolarHBondContact CA-O 3.03Å; V397-R421 HydrophobicContact CG2-CB 4.29Å; K398-R421 PolarHBondContact N-O 3.43Å; R421-Y467 HydrophobicContact CG-CD1 4.11Å; R421-D469 WeakPolarHBondContact CB-OD1 3.44Å; R421-D469 WeakPolarHBondContact CG-OD1 3.17Å; R421-D469 IonicContact CZ-OD1 3.75Å; R421-D469 IonicContact CZ-OD2 3.75Å; R421-D469 IonicContact NE-OD1 2.79Å; R421-D469 PolarHBondContact NE-OD1 3.02Å; R421-D469 IonicContact NE-OD2 3.41Å; R421-D469 IonicContact NH2-OD1 3.79Å; R421-D469 IonicContact NH2-OD2 2.9Å; R421-D469 PolarHBondContact NH2-OD2 3.42Å; R421-V506 VanDerWaalsContact CZ-CG1 3.43Å; R421-V506 VanDerWaalsContact NH1-CG1 3.35Å
422	L	89	Confident	75.9	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.9	-174.7	-52.6	175.1	0	0	0	109.2	K398 I400 L409 P420 A450 Y467 I468 V470	K398-L422 HydrophobicContact CB-CD2 4.27Å; K398-L422 WeakPolarHBondContact O-CA 3.05Å; I400-L422 HydrophobicContact CD1-CB 3.99Å; I400-L422 HydrophobicContact CD1-CD1 3.95Å; I400-L422 HydrophobicContact CD1-CG 4.42Å; I400-L422 HydrophobicContact CG1-CB 4.26Å; I400-L422 HydrophobicContact CG2-CD2 4.01Å; L409-L422 HydrophobicContact CD1-CD1 3.54Å; L409-L422 HydrophobicContact CD1-CD2 3.8Å; L409-L422 HydrophobicContact CD1-CG 4.31Å; L409-L422 HydrophobicContact CD2-CD2 4.32Å; L409-L422 HydrophobicContact CG-CD2 4.49Å; P420-L422 HydrophobicContact CG-CD2 4.06Å; P420-L422 WeakPolarHBondContact O-CD2 3.38Å; P420-L422 WeakPolarHBondContact O-CG 3.3Å; P420-L422 PolarHBondContact O-N 3.48Å; L422-A450 HydrophobicContact CD1-CB 4.07Å; L422-Y467 CarbonylContact O-C 3.52Å; L422-Y467 VanDerWaalsContact O-CA 3.32Å; L422-Y467 WeakPolarHBondContact O-CA 3.45Å; L422-I468 HydrophobicContact CB-CD1 4.36Å; L422-I468 HydrophobicContact CB-CG1 3.78Å; L422-I468 HydrophobicContact CD1-CD1 4.37Å; L422-I468 HydrophobicContact CD1-CG1 4.45Å; L422-I468 PolarHBondContact N-O 2.78Å; L422-I468 PolarHBondContact O-N 3.48Å; L422-V470 HydrophobicContact CD1-CB 4.47Å; L422-V470 HydrophobicContact CD1-CG2 3.62Å; L422-V470 HydrophobicContact CG-CG2 4.5Å
423	Y	91.5	Very high	76.4	Confident	92 Å²	92	73.3 Å²	73.3	36%	0.361	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.7	168.7	179.6	-99.2	0	0	0	109.2	K398 A399 I400 Y467	K398-Y423 PolarHBondContact O-N 3.47Å; A399-Y423 HydrophobicContact CB-CD1 4.45Å; I400-Y423 WeakPolarHBondContact CG1-O 3.5Å; I400-Y423 PolarHBondContact N-O 3.46Å; I400-Y423 VanDerWaalsContact N-O 3.1Å; Y423-Y467 AromaticContact CD2-CD1 3.79Å; Y423-Y467 HydrophobicContact CD2-CD1 3.79Å; Y423-Y467 HydrophobicContact CD2-CD2 4.26Å; Y423-Y467 AromaticContact CD2-CE1 3.53Å; Y423-Y467 HydrophobicContact CD2-CE1 3.53Å; Y423-Y467 HydrophobicContact CD2-CE2 4.03Å; Y423-Y467 HydrophobicContact CD2-CG 4.15Å; Y423-Y467 AromaticContact CD2-CZ 3.66Å; Y423-Y467 HydrophobicContact CE2-CE2 4.33Å; Y423-Y467 HydrophobicContact CG-CD1 4.36Å; Y423-Y467 HydrophobicContact CG-CE1 4.05Å
424	C	92.9	Very high	77.1	Confident	0 Å²	0	77 Å²	77	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.1	179.1	-77.8	0	0	0	0	111.2	C451 I460 G465 G466 I468	C424-C451 WeakPolarHBondContact CA-SG 3.45Å; C424-C451 HydrophobicContact CB-CB 3.72Å; C424-C451 WeakPolarHBondContact CB-SG 3.41Å; C424-C451 WeakPolarHBondContact SG-CA 3.28Å; C424-C451 WeakPolarHBondContact SG-CB 3.18Å; C424-C451 CovalentContact SG-SG 2.04Å; C424-C451 PolarHBondContact SG-SG 3.07Å; C424-I460 HydrophobicContact CB-CD1 3.58Å; C424-G465 WeakPolarHBondContact O-CA 3.27Å; C424-G466 PolarHBondContact N-O 3.48Å; C424-G466 PolarHBondContact O-N 2.76Å; C424-I468 VanDerWaalsContact SG-CD1 3.54Å
425	P	92.3	Very high	78.2	Confident	43 Å²	43	73.4 Å²	73.4	28%	0.279	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-72.3	164.9	174.5	31.6	-33.9	0	0	0	110.5	I400	I400-P425 VanDerWaalsContact O-CD 3.22Å; I400-P425 WeakPolarHBondContact O-CD 3.36Å
426	R	91.9	Very high	79.6	Confident	180 Å²	180	70.5 Å²	70.5	68%	0.679	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	160.1	172.8	64.9	-178.2	-178.1	172	1.5	111.6	C428 N462	R426-C428 PolarHBondContact O-N 3.16Å; R426-N462 CarbonylContact C-O 3.54Å; R426-N462 WeakPolarHBondContact CA-O 3.47Å
427	N	90	Very high	81.4	Confident	50 Å²	50	72.1 Å²	72.1	27%	0.267	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	30	170.3	-64	-2	0	0	0	116.2	L429 E430 N462	N427-L429 PolarHBondContact O-N 2.87Å; N427-E430 HydrophobicContact CB-CG 4.34Å; N427-E430 PolarHBondContact ND2-OE1 3.07Å; N427-E430 VanDerWaalsContact ND2-OE1 3.13Å; N427-E430 PolarHBondContact O-N 3Å; N427-N462 VanDerWaalsContact C-OD1 3.28Å; N427-N462 WeakPolarHBondContact CA-OD1 3.4Å; N427-N462 PolarHBondContact N-O 2.96Å
428	C	87.8	Confident	83.1	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.014	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-11.8	174.5	-68.5	0	0	0	0	115.3	C402 R426 C451 R452 N462	C402-C428 HydrophobicContact CB-CB 3.61Å; C402-C428 WeakPolarHBondContact CB-SG 3.38Å; C402-C428 WeakPolarHBondContact SG-CA 3.36Å; C402-C428 WeakPolarHBondContact SG-CB 3.43Å; C402-C428 CovalentContact SG-SG 2.04Å; C402-C428 PolarHBondContact SG-SG 2.71Å; R426-C428 PolarHBondContact O-N 3.16Å; C428-C451 HydrophobicContact CB-CB 4.41Å; C428-R452 HydrophobicContact CB-CG 4.13Å; C428-R452 PolarHBondContact O-NE 3.27Å; C428-N462 PolarHBondContact N-OD1 3.13Å
429	L	85.4	Confident	84.5	Confident	58 Å²	58	62.4 Å²	62.4	30%	0.304	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-28.5	171.1	-70.6	175.5	0	0	0	113.6	N427 E431 R452 V455 N462 I487	N427-L429 PolarHBondContact O-N 2.87Å; L429-E431 PolarHBondContact O-N 3Å; L429-R452 PolarHBondContact O-NH2 3.29Å; L429-V455 HydrophobicContact CD1-CG1 4.42Å; L429-N462 HydrophobicContact CD1-CB 3.7Å; L429-N462 HydrophobicContact CG-CB 4.05Å; L429-N462 VanDerWaalsContact CG-CG 3.46Å; L429-N462 WeakPolarHBondContact CG-OD1 3.27Å; L429-N462 PolarHBondContact N-OD1 3.22Å; L429-I487 HydrophobicContact CD2-CD1 3.5Å; L429-I487 HydrophobicContact CD2-CG1 3.26Å
430	E	83.1	Confident	85.3	Confident	149 Å²	149	62.3 Å²	62.3	70%	0.696	29%	0.289	S	S	*	.	S	Bend	trans	-74.7	-17.7	-176.6	-66.4	168	-160.4	0	0	112.3	N427	N427-E430 HydrophobicContact CB-CG 4.34Å; N427-E430 PolarHBondContact ND2-OE1 3.07Å; N427-E430 VanDerWaalsContact ND2-OE1 3.13Å; N427-E430 PolarHBondContact O-N 3Å
431	E	79.1	Confident	85.8	Confident	100 Å²	100	62.3 Å²	62.3	47%	0.467	29%	0.288	S	S	.	.	S	Bend	trans	-72.9	159.4	179.8	-75.9	-68.5	178.8	0	0	113.9	C402 L429 P433 R452	C402-E431 HydrophobicContact CB-CB 4.49Å; C402-E431 HydrophobicContact CB-CG 4.05Å; L429-E431 PolarHBondContact O-N 3Å; E431-P433 VanDerWaalsContact O-CD 3.28Å; E431-P433 WeakPolarHBondContact O-CD 3.5Å; E431-R452 PolarHBondContact O-NH2 3.12Å
432	N	77.4	Confident	85.8	Confident	79 Å²	79	69.4 Å²	69.4	42%	0.422	32%	0.319	S	S	.	.			trans	-59.4	120	-175.3	-171.8	-27.5	0	0	0	112	R434 L435 C436	N432-R434 PolarHBondContact O-N 3.44Å; N432-R434 VanDerWaalsContact O-N 3.08Å; N432-R434 WeakPolarHBondContact OD1-CB 3.35Å; N432-R434 PolarHBondContact OD1-N 2.92Å; N432-L435 HydrophobicContact CB-CB 4.49Å; N432-L435 HydrophobicContact CB-CD1 4.12Å; N432-L435 HydrophobicContact CB-CG 4.29Å; N432-L435 PolarHBondContact O-N 2.57Å; N432-C436 PolarHBondContact O-N 3.12Å; N432-C436 VanDerWaalsContact O-N 3.1Å
433	P	72.8	Confident	85.7	Confident	84 Å²	84	70.2 Å²	70.2	55%	0.545	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.6	-179.3	-24.3	33.7	0	0	0	115.9	E431 C436 R437 R452	E431-P433 VanDerWaalsContact O-CD 3.28Å; E431-P433 WeakPolarHBondContact O-CD 3.5Å; P433-C436 CarbonylContact O-C 3.42Å; P433-R437 WeakPolarHBondContact O-CG 3.47Å; P433-R452 VanDerWaalsContact CA-NH1 3.32Å
434	R	73.1	Confident	85.7	Confident	220 Å²	220	66 Å²	66	83%	0.83	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-27	176.7	-65.8	-172.6	179.1	174.4	1	113.2	N432	N432-R434 PolarHBondContact O-N 3.44Å; N432-R434 VanDerWaalsContact O-N 3.08Å; N432-R434 WeakPolarHBondContact OD1-CB 3.35Å; N432-R434 PolarHBondContact OD1-N 2.92Å
435	L	74.4	Confident	85.6	Confident	111 Å²	111	66.2 Å²	66.2	58%	0.581	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-37.7	176.8	-64.7	174.8	0	0	0	110.9	D403 N432	D403-L435 HydrophobicContact CB-CB 4.49Å; N432-L435 HydrophobicContact CB-CB 4.49Å; N432-L435 HydrophobicContact CB-CD1 4.12Å; N432-L435 HydrophobicContact CB-CG 4.29Å; N432-L435 PolarHBondContact O-N 2.57Å
436	C	81.6	Confident	85.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	30%	0.295	C	S	.	.	S	Bend	trans	-106.6	62.8	-177.8	-50.2	0	0	0	0	110.9	C402 N432 P433 R452	C402-C436 VanDerWaalsContact C-SG 3.53Å; C402-C436 PolarHBondContact O-SG 2.91Å; N432-C436 PolarHBondContact O-N 3.12Å; N432-C436 VanDerWaalsContact O-N 3.1Å; P433-C436 CarbonylContact O-C 3.42Å; C436-R452 VanDerWaalsContact CB-CD 3.47Å; C436-R452 HydrophobicContact CB-CG 4.18Å; C436-R452 WeakPolarHBondContact O-CD 3.15Å; C436-R452 PolarHBondContact O-NH1 3.33Å
437	R	89.5	Confident	85.2	Confident	99 Å²	99	60.6 Å²	60.6	37%	0.374	28%	0.284	S	S	.	.			trans	-71.6	149.6	179.6	-66.7	173.8	66.1	-159.5	2.1	111.1	P433 S448 S449 E490	P433-R437 WeakPolarHBondContact O-CG 3.47Å; R437-S448 CarbonylContact O-C 3.52Å; R437-S448 VanDerWaalsContact O-CA 3.27Å; R437-S448 WeakPolarHBondContact O-CA 3.22Å; R437-S449 PolarHBondContact O-N 2.93Å; R437-E490 IonicContact CZ-OE1 3.85Å; R437-E490 IonicContact CZ-OE2 2.86Å; R437-E490 IonicContact NE-OE1 3.59Å; R437-E490 PolarHBondContact NE-OE1 3.39Å; R437-E490 IonicContact NE-OE2 2.63Å; R437-E490 PolarHBondContact NE-OE2 2.98Å; R437-E490 IonicContact NH2-OE1 2.63Å; R437-E490 IonicContact NH2-OE2 3.77Å; R437-E490 PolarHBondContact NH2-OE2 3.34Å
438	V	92.3	Very high	85.2	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.03	27%	0.272	C	S	.	.			trans	-126.5	117	172.5	-179.3	0	0	0	0	107.4	Y444 R452 A453 H456 I487 S489 E490	V438-Y444 HydrophobicContact CG1-CD1 3.82Å; V438-Y444 HydrophobicContact CG1-CE1 3.77Å; V438-R452 HydrophobicContact CG2-CB 3.58Å; V438-A453 HydrophobicContact CG1-CB 4.14Å; V438-H456 HydrophobicContact CG1-CB 4.31Å; V438-I487 HydrophobicContact CB-CG2 4.23Å; V438-I487 HydrophobicContact CG2-CG2 4.06Å; V438-S489 CarbonylContact O-C 3.55Å; V438-S489 VanDerWaalsContact O-CA 3.3Å; V438-S489 WeakPolarHBondContact O-CA 3.47Å; V438-E490 PolarHBondContact O-N 3.48Å
439	I	91.2	Very high	85.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.015	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-118.5	116.7	-175.9	-53.7	172.7	0	0	0	108.4	Y444 S445 K447 S448 Y479 E490 L492	I439-Y444 VanDerWaalsContact O-CA 3.3Å; I439-Y444 WeakPolarHBondContact O-CA 3.17Å; I439-S445 PolarHBondContact O-N 2.98Å; I439-S445 VanDerWaalsContact O-N 3.1Å; I439-K447 HydrophobicContact CD1-CB 4.37Å; I439-S448 PolarHBondContact N-OG 3.36Å; I439-S448 PolarHBondContact O-OG 2.87Å; I439-Y479 HydrophobicContact CG2-CG 4.47Å; I439-E490 WeakPolarHBondContact CA-O 3.21Å; I439-E490 HydrophobicContact CG1-CB 4.27Å; I439-L492 HydrophobicContact CG2-CB 3.6Å; I439-L492 HydrophobicContact CG2-CD2 4.02Å; I439-L492 HydrophobicContact CG2-CG 4.47Å
440	G	90.4	Very high	85.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	97.3	-178.2	-179.1	0	0	0	0	0	115.4	Y444 I480 S489 E490	G440-Y444 VanDerWaalsContact O-CE1 3.3Å; G440-Y444 WeakPolarHBondContact O-CE1 3.45Å; G440-I480 CarbonylContact C-O 3.31Å; G440-I480 VanDerWaalsContact C-O 3.31Å; G440-I480 WeakPolarHBondContact CA-O 3.35Å; G440-S489 WeakPolarHBondContact O-CB 3.3Å; G440-S489 PolarHBondContact O-OG 3.26Å; G440-E490 PolarHBondContact N-O 2.89Å
441	T	90.4	Very high	86.1	Confident	24 Å²	24	48.2 Å²	48.2	15%	0.147	22%	0.223	C	C	.	.	S	Bend	trans	-146.4	137.9	-179.1	-168.9	0	0	0	0	109.3	I443 I480 S482 Q484	T441-I443 PolarHBondContact N-O 3.31Å; T441-I443 PolarHBondContact O-N 2.93Å; T441-I480 HydrophobicContact CG2-CB 4.16Å; T441-I480 HydrophobicContact CG2-CG2 4.5Å; T441-I480 WeakPolarHBondContact CG2-O 3.33Å; T441-I480 PolarHBondContact N-O 3.06Å; T441-S482 WeakPolarHBondContact CB-OG 3.48Å; T441-S482 PolarHBondContact OG1-OG 3.43Å; T441-Q484 PolarHBondContact OG1-NE2 3.22Å
442	K	85.3	Confident	86.8	Confident	157 Å²	157	44.4 Å²	44.4	68%	0.683	21%	0.205	S	C	*	.	S	Bend	trans	60.6	-39.1	-169.3	-57.1	180	177.7	178.8	0	115.3
443	I	87.4	Confident	87.5	Confident	18 Å²	18	40.7 Å²	40.7	9%	0.092	19%	0.185	C	C	.	.	S	Bend	trans	-122.8	122	170.3	-54	-150.8	0	0	0	107.1	T441 V473 R476 Y479 A500 R502	T441-I443 PolarHBondContact N-O 3.31Å; T441-I443 PolarHBondContact O-N 2.93Å; I443-V473 HydrophobicContact CD1-CG2 4.34Å; I443-V473 HydrophobicContact CG2-CG2 3.76Å; I443-R476 VanDerWaalsContact CD1-CZ 3.47Å; I443-R476 HydrophobicContact CG2-CG 4.42Å; I443-Y479 HydrophobicContact CG2-CE1 4.36Å; I443-A500 HydrophobicContact CG2-CB 3.72Å; I443-R502 HydrophobicContact CD1-CG 4.27Å; I443-R502 HydrophobicContact CG1-CG 4.03Å
444	Y	91.3	Very high	88.4	Confident	3 Å²	3	36.7 Å²	36.7	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	146.3	-176.7	-57.3	-80.4	0	0	0	110.1	V438 I439 G440 A453 H456 A457 A500 F501 I503	V438-Y444 HydrophobicContact CG1-CD1 3.82Å; V438-Y444 HydrophobicContact CG1-CE1 3.77Å; I439-Y444 VanDerWaalsContact O-CA 3.3Å; I439-Y444 WeakPolarHBondContact O-CA 3.17Å; G440-Y444 VanDerWaalsContact O-CE1 3.3Å; G440-Y444 WeakPolarHBondContact O-CE1 3.45Å; Y444-A453 HydrophobicContact CD1-CB 3.92Å; Y444-A453 HydrophobicContact CD2-CB 4.1Å; Y444-A453 HydrophobicContact CE1-CB 4.12Å; Y444-A453 HydrophobicContact CE2-CB 4.28Å; Y444-A453 HydrophobicContact CG-CB 3.91Å; Y444-H456 AromaticContact CE1-ND1 3.55Å; Y444-H456 AromaticContact CZ-ND1 3.61Å; Y444-H456 PolarHBondContact OH-ND1 3.47Å; Y444-A457 HydrophobicContact CE2-CB 4.29Å; Y444-A457 WeakPolarHBondContact OH-CB 3.22Å; Y444-A457 PolarHBondContact OH-N 3.23Å; Y444-A500 CarbonylContact O-C 3.31Å; Y444-A500 VanDerWaalsContact O-CA 3.25Å; Y444-A500 WeakPolarHBondContact O-CA 3.15Å; Y444-F501 HydrophobicContact CD2-CE2 4.25Å; Y444-F501 HydrophobicContact CG-CE2 4.46Å; Y444-F501 HydrophobicContact CG-CZ 4.4Å; Y444-F501 PolarHBondContact N-O 2.76Å; Y444-F501 PolarHBondContact O-N 3.19Å; Y444-I503 HydrophobicContact CD2-CD1 4.06Å; Y444-I503 HydrophobicContact CD2-CG1 4.26Å; Y444-I503 HydrophobicContact CE2-CD1 4.08Å; Y444-I503 HydrophobicContact CE2-CG1 4.43Å
445	S	90.7	Very high	89.3	Confident	4 Å²	4	26.5 Å²	26.5	3%	0.028	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	143.2	169.4	163.3	0	0	0	0	109.6	I439 K447 S448 F501	I439-S445 PolarHBondContact O-N 2.98Å; I439-S445 VanDerWaalsContact O-N 3.1Å; S445-K447 PolarHBondContact O-N 2.82Å; S445-K447 PolarHBondContact OG-N 2.84Å; S445-S448 WeakPolarHBondContact O-CB 3.43Å; S445-S448 PolarHBondContact O-N 3.29Å; S445-S448 PolarHBondContact O-OG 3.23Å; S445-F501 WeakPolarHBondContact O-CE1 3.21Å
446	D	87.3	Confident	90.2	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.011	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-24.2	173.4	58.5	-16	0	0	0	116.2	V406 E407 Y412 S448 K499	V406-D446 PolarHBondContact N-O 3.29Å; E407-D446 HydrophobicContact CB-CB 4.28Å; E407-D446 PolarHBondContact N-O 3.36Å; E407-D446 VanDerWaalsContact N-O 3.11Å; Y412-D446 WeakPolarHBondContact OH-CB 3.41Å; D446-S448 PolarHBondContact O-N 3.15Å; D446-K499 HydrophobicContact CB-CB 4.12Å; D446-K499 WeakPolarHBondContact CB-O 3.24Å; D446-K499 VanDerWaalsContact CG-N 3.27Å; D446-K499 PolarHBondContact N-O 2.85Å; D446-K499 PolarHBondContact OD2-N 3.45Å
447	K	88.2	Confident	90.6	Very high	103 Å²	103	22.9 Å²	22.9	45%	0.448	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-8.6	173.6	-62.8	-178.2	-178.8	179	0	114.3	T405 I439 S445	T405-K447 WeakPolarHBondContact CG2-O 3.28Å; I439-K447 HydrophobicContact CD1-CB 4.37Å; S445-K447 PolarHBondContact O-N 2.82Å; S445-K447 PolarHBondContact OG-N 2.84Å
448	S	91.1	Very high	90.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-75.8	144.7	178.1	-51.5	0	0	0	0	110.7	R437 I439 S445 D446 A450	R437-S448 CarbonylContact O-C 3.52Å; R437-S448 VanDerWaalsContact O-CA 3.27Å; R437-S448 WeakPolarHBondContact O-CA 3.22Å; I439-S448 PolarHBondContact N-OG 3.36Å; I439-S448 PolarHBondContact O-OG 2.87Å; S445-S448 WeakPolarHBondContact O-CB 3.43Å; S445-S448 PolarHBondContact O-N 3.29Å; S445-S448 PolarHBondContact O-OG 3.23Å; D446-S448 PolarHBondContact O-N 3.15Å; S448-A450 PolarHBondContact O-N 2.82Å
449	S	92.1	Very high	90.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-60.4	126.6	167.5	158.6	0	0	0	0	109.8	C402 R437 R452 A453	C402-S449 WeakPolarHBondContact O-CB 3.13Å; C402-S449 PolarHBondContact O-OG 3.28Å; R437-S449 PolarHBondContact O-N 2.93Å; S449-R452 PolarHBondContact OG-N 3.16Å; S449-A453 WeakPolarHBondContact O-CB 3.3Å; S449-A453 PolarHBondContact O-N 2.83Å
450	A	91.3	Very high	90.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.7	-46.2	-178.4	0	0	0	0	0	111.5	I400 T404 V406 L422 S448 A454 I468	I400-A450 HydrophobicContact CD1-CB 3.89Å; T404-A450 PolarHBondContact O-N 3.45Å; T404-A450 VanDerWaalsContact O-N 3.14Å; V406-A450 HydrophobicContact CG2-CB 3.78Å; L422-A450 HydrophobicContact CD1-CB 4.07Å; S448-A450 PolarHBondContact O-N 2.82Å; A450-A454 WeakPolarHBondContact O-CB 3.2Å; A450-A454 PolarHBondContact O-N 3.41Å; A450-I468 HydrophobicContact CB-CD1 4.24Å
451	C	92.3	Very high	90.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72	-40.9	-176	-61.6	0	0	0	0	113	I400 C424 C428 A454 V455	I400-C451 WeakPolarHBondContact CD1-SG 3.36Å; C424-C451 WeakPolarHBondContact CA-SG 3.45Å; C424-C451 HydrophobicContact CB-CB 3.72Å; C424-C451 WeakPolarHBondContact CB-SG 3.41Å; C424-C451 WeakPolarHBondContact SG-CA 3.28Å; C424-C451 WeakPolarHBondContact SG-CB 3.18Å; C424-C451 CovalentContact SG-SG 2.04Å; C424-C451 PolarHBondContact SG-SG 3.07Å; C428-C451 HydrophobicContact CB-CB 4.41Å; C451-A454 WeakPolarHBondContact O-CB 3.29Å; C451-A454 PolarHBondContact O-N 3.42Å; C451-V455 WeakPolarHBondContact O-CG2 3.49Å; C451-V455 PolarHBondContact O-N 3.06Å
452	R	92	Very high	90.1	Very high	20 Å²	20	29.7 Å²	29.7	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-69.7	-38.6	175.1	-84.9	-163.9	171.6	-171.1	-10	112.5	C428 L429 E431 P433 C436 V438 S449 A454 V455 H456 I487	C428-R452 HydrophobicContact CB-CG 4.13Å; C428-R452 PolarHBondContact O-NE 3.27Å; L429-R452 PolarHBondContact O-NH2 3.29Å; E431-R452 PolarHBondContact O-NH2 3.12Å; P433-R452 VanDerWaalsContact CA-NH1 3.32Å; C436-R452 VanDerWaalsContact CB-CD 3.47Å; C436-R452 HydrophobicContact CB-CG 4.18Å; C436-R452 WeakPolarHBondContact O-CD 3.15Å; C436-R452 PolarHBondContact O-NH1 3.33Å; V438-R452 HydrophobicContact CG2-CB 3.58Å; S449-R452 PolarHBondContact OG-N 3.16Å; R452-A454 PolarHBondContact O-N 2.93Å; R452-V455 PolarHBondContact O-N 3.24Å; R452-H456 WeakPolarHBondContact O-CB 3.4Å; R452-H456 PolarHBondContact O-N 2.81Å; R452-I487 HydrophobicContact CB-CD1 4.12Å; R452-I487 HydrophobicContact CG-CD1 4.34Å; R452-I487 WeakPolarHBondContact O-CD1 3.39Å
453	A	92.6	Very high	90.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-31.8	173.6	0	0	0	0	0	111.2	V438 Y444 S449 H456 A457 F501 I503	V438-A453 HydrophobicContact CG1-CB 4.14Å; Y444-A453 HydrophobicContact CD1-CB 3.92Å; Y444-A453 HydrophobicContact CD2-CB 4.1Å; Y444-A453 HydrophobicContact CE1-CB 4.12Å; Y444-A453 HydrophobicContact CE2-CB 4.28Å; Y444-A453 HydrophobicContact CG-CB 3.91Å; S449-A453 WeakPolarHBondContact O-CB 3.3Å; S449-A453 PolarHBondContact O-N 2.83Å; A453-H456 PolarHBondContact O-N 3.17Å; A453-A457 VanDerWaalsContact O-CB 3.27Å; A453-A457 WeakPolarHBondContact O-CB 3.07Å; A453-A457 PolarHBondContact O-N 2.95Å; A453-F501 HydrophobicContact CB-CE2 4.41Å; A453-F501 HydrophobicContact CB-CZ 4.25Å; A453-I503 HydrophobicContact CB-CD1 3.43Å; A453-I503 VanDerWaalsContact CB-CD1 3.43Å
454	A	92.1	Very high	90.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69	-41.6	174.4	0	0	0	0	0	112.7	A450 C451 R452 A457 G458 V459 I460 I468 I503	A450-A454 WeakPolarHBondContact O-CB 3.2Å; A450-A454 PolarHBondContact O-N 3.41Å; C451-A454 WeakPolarHBondContact O-CB 3.29Å; C451-A454 PolarHBondContact O-N 3.42Å; R452-A454 PolarHBondContact O-N 2.93Å; A454-A457 PolarHBondContact O-N 3.18Å; A454-G458 PolarHBondContact O-N 3.43Å; A454-V459 HydrophobicContact CB-CB 4.37Å; A454-V459 WeakPolarHBondContact O-CB 3.37Å; A454-V459 PolarHBondContact O-N 2.92Å; A454-I460 HydrophobicContact CB-CD1 3.86Å; A454-I460 HydrophobicContact CB-CG1 3.74Å; A454-I468 HydrophobicContact CB-CD1 3.89Å; A454-I468 HydrophobicContact CB-CG2 3.8Å; A454-I503 HydrophobicContact CB-CD1 4.05Å; A454-I503 HydrophobicContact CB-CG2 3.82Å
455	V	92.4	Very high	89.9	Confident	7 Å²	7	29 Å²	29	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-47.9	171.2	174.1	0	0	0	0	110.3	L429 C451 R452 A457 G458 I460 N462 N485 I487	L429-V455 HydrophobicContact CD1-CG1 4.42Å; C451-V455 WeakPolarHBondContact O-CG2 3.49Å; C451-V455 PolarHBondContact O-N 3.06Å; R452-V455 PolarHBondContact O-N 3.24Å; V455-A457 VanDerWaalsContact C-N 3.28Å; V455-A457 PolarHBondContact O-N 3.22Å; V455-G458 PolarHBondContact O-N 2.84Å; V455-I460 HydrophobicContact CG2-CD1 4.25Å; V455-I460 HydrophobicContact CG2-CG1 3.91Å; V455-N462 HydrophobicContact CG1-CB 4.14Å; V455-N462 HydrophobicContact CG2-CB 4.2Å; V455-N485 WeakPolarHBondContact O-CB 3.42Å; V455-N485 PolarHBondContact O-ND2 3.49Å; V455-I487 HydrophobicContact CB-CD1 3.86Å; V455-I487 HydrophobicContact CG1-CD1 3.81Å
456	H	93.1	Very high	89.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.7	-44	177.9	173.7	-84.8	0	0	0	110.9	V438 Y444 R452 A453 G458 S482 Q484 N485 I487	V438-H456 HydrophobicContact CG1-CB 4.31Å; Y444-H456 AromaticContact CE1-ND1 3.55Å; Y444-H456 AromaticContact CZ-ND1 3.61Å; Y444-H456 PolarHBondContact OH-ND1 3.47Å; R452-H456 WeakPolarHBondContact O-CB 3.4Å; R452-H456 PolarHBondContact O-N 2.81Å; A453-H456 PolarHBondContact O-N 3.17Å; H456-G458 PolarHBondContact O-N 3.42Å; H456-S482 PolarHBondContact CE1-OG 3Å; H456-S482 PolarHBondContact NE2-O 2.9Å; H456-S482 PolarHBondContact NE2-OG 3.49Å; H456-Q484 PolarHBondContact CE1-OE1 2.67Å; H456-Q484 VanDerWaalsContact O-CB 3.22Å; H456-Q484 WeakPolarHBondContact O-CB 3.4Å; H456-Q484 PolarHBondContact O-OE1 3.27Å; H456-N485 PolarHBondContact O-ND2 2.79Å; H456-I487 HydrophobicContact CB-CB 4Å; H456-I487 HydrophobicContact CB-CD1 3.98Å; H456-I487 HydrophobicContact CB-CG2 4.12Å; H456-I487 PolarHBondContact CD2-O 3.38Å
457	A	89.8	Confident	89.8	Confident	36 Å²	36	34.9 Å²	34.9	30%	0.298	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.3	176.4	0	0	0	0	0	114.5	Y444 A453 A454 V455 V459	Y444-A457 HydrophobicContact CE2-CB 4.29Å; Y444-A457 WeakPolarHBondContact OH-CB 3.22Å; Y444-A457 PolarHBondContact OH-N 3.23Å; A453-A457 VanDerWaalsContact O-CB 3.27Å; A453-A457 WeakPolarHBondContact O-CB 3.07Å; A453-A457 PolarHBondContact O-N 2.95Å; A454-A457 PolarHBondContact O-N 3.18Å; V455-A457 VanDerWaalsContact C-N 3.28Å; V455-A457 PolarHBondContact O-N 3.22Å; A457-V459 VanDerWaalsContact C-N 3.26Å; A457-V459 HydrophobicContact CB-CB 4.49Å; A457-V459 HydrophobicContact CB-CG2 3.74Å; A457-V459 PolarHBondContact O-N 2.71Å
458	G	88.9	Confident	89.9	Confident	27 Å²	27	30 Å²	30	28%	0.278	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	17.3	-174.9	0	0	0	0	0	113.5	A454 V455 H456 N485	A454-G458 PolarHBondContact O-N 3.43Å; V455-G458 PolarHBondContact O-N 2.84Å; H456-G458 PolarHBondContact O-N 3.42Å; G458-N485 VanDerWaalsContact CA-ND2 3.25Å; G458-N485 WeakPolarHBondContact CA-ND2 3.33Å; G458-N485 PolarHBondContact N-ND2 2.78Å; G458-N485 VanDerWaalsContact N-ND2 3.12Å
459	V	88.8	Confident	89.6	Confident	28 Å²	28	30 Å²	30	17%	0.17	17%	0.172	C	C	.	.	S	Bend	trans	-78.6	-36.3	-176.9	170.5	0	0	0	0	111.5	A454 A457 I468 I503 F504 S505	A454-V459 HydrophobicContact CB-CB 4.37Å; A454-V459 WeakPolarHBondContact O-CB 3.37Å; A454-V459 PolarHBondContact O-N 2.92Å; A457-V459 VanDerWaalsContact C-N 3.26Å; A457-V459 HydrophobicContact CB-CB 4.49Å; A457-V459 HydrophobicContact CB-CG2 3.74Å; A457-V459 PolarHBondContact O-N 2.71Å; V459-I468 HydrophobicContact CG1-CG2 4.05Å; V459-I503 HydrophobicContact CB-CG2 4.32Å; V459-I503 HydrophobicContact CG1-CG2 4.1Å; V459-I503 HydrophobicContact CG2-CG2 4.2Å; V459-F504 VanDerWaalsContact CG1-C 3.49Å; V459-F504 WeakPolarHBondContact CG1-O 3.42Å; V459-S505 VanDerWaalsContact CG1-CA 3.41Å
460	I	90.3	Very high	89.2	Confident	19 Å²	19	30.1 Å²	30.1	10%	0.097	17%	0.172	C	C	.	.	S	Bend	trans	-132.7	153.4	174.8	58.3	174.5	0	0	0	110.2	C424 A454 V455 I468	C424-I460 HydrophobicContact CB-CD1 3.58Å; A454-I460 HydrophobicContact CB-CD1 3.86Å; A454-I460 HydrophobicContact CB-CG1 3.74Å; V455-I460 HydrophobicContact CG2-CD1 4.25Å; V455-I460 HydrophobicContact CG2-CG1 3.91Å; I460-I468 HydrophobicContact CD1-CG2 4.09Å; I460-I468 HydrophobicContact CG1-CG2 4.39Å; I460-I468 HydrophobicContact CG2-CG2 3.49Å; I460-I468 VanDerWaalsContact CG2-CG2 3.49Å
461	R	88.7	Confident	88.6	Confident	169 Å²	169	33 Å²	33	64%	0.638	19%	0.187	S	C	*	.	B	Isolated β-bridge	trans	-89.6	130.4	174.5	-68	-179.7	171.9	175.3	-3.8	109.9	E284 G463 V464 G465	E284-R461 IonicContact OE2-NH2 3Å; E284-R461 PolarHBondContact OE2-NH2 2.81Å; R461-G463 VanDerWaalsContact C-N 3.3Å; R461-G463 PolarHBondContact O-N 2.77Å; R461-V464 PolarHBondContact O-N 2.79Å; R461-V464 VanDerWaalsContact O-N 3.1Å; R461-G465 PolarHBondContact O-N 2.79Å
462	N	87.4	Confident	87.9	Confident	31 Å²	31	34.6 Å²	34.6	17%	0.166	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-43.4	-177.2	-179	62.3	0	0	0	113.2	R426 N427 C428 L429 V455 V464	R426-N462 CarbonylContact C-O 3.54Å; R426-N462 WeakPolarHBondContact CA-O 3.47Å; N427-N462 VanDerWaalsContact C-OD1 3.28Å; N427-N462 WeakPolarHBondContact CA-OD1 3.4Å; N427-N462 PolarHBondContact N-O 2.96Å; C428-N462 PolarHBondContact N-OD1 3.13Å; L429-N462 HydrophobicContact CD1-CB 3.7Å; L429-N462 HydrophobicContact CG-CB 4.05Å; L429-N462 VanDerWaalsContact CG-CG 3.46Å; L429-N462 WeakPolarHBondContact CG-OD1 3.27Å; L429-N462 PolarHBondContact N-OD1 3.22Å; V455-N462 HydrophobicContact CG1-CB 4.14Å; V455-N462 HydrophobicContact CG2-CB 4.2Å; N462-V464 PolarHBondContact O-N 2.85Å
463	G	85.3	Confident	87.2	Confident	50 Å²	50	35.2 Å²	35.2	52%	0.515	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16	-176.9	0	0	0	0	0	115.3	R461	R461-G463 VanDerWaalsContact C-N 3.3Å; R461-G463 PolarHBondContact O-N 2.77Å
464	V	86.4	Confident	86.5	Confident	107 Å²	107	42 Å²	42	65%	0.648	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-35.4	-176.3	-175.8	0	0	0	0	111.3	R461 N462	R461-V464 PolarHBondContact O-N 2.79Å; R461-V464 VanDerWaalsContact O-N 3.1Å; N462-V464 PolarHBondContact O-N 2.85Å
465	G	87.1	Confident	85.9	Confident	7 Å²	7	46.8 Å²	46.8	7%	0.072	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	72.7	-156.6	-165.8	0	0	0	0	0	110.8	C424 R461	C424-G465 WeakPolarHBondContact O-CA 3.27Å; R461-G465 PolarHBondContact O-N 2.79Å
466	G	88.8	Confident	85.4	Confident	16 Å²	16	52.1 Å²	52.1	17%	0.165	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.4	-176.1	174.2	0	0	0	0	0	114.6	C424	C424-G466 PolarHBondContact N-O 3.48Å; C424-G466 PolarHBondContact O-N 2.76Å
467	Y	87.8	Confident	84.9	Confident	113 Å²	113	57.6 Å²	57.6	44%	0.443	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138	177.8	-63.7	-77.7	0	0	0	111.3	V397 R421 L422 Y423	V397-Y467 HydrophobicContact CG1-CD1 4.27Å; V397-Y467 HydrophobicContact CG1-CE1 3.79Å; R421-Y467 HydrophobicContact CG-CD1 4.11Å; L422-Y467 CarbonylContact O-C 3.52Å; L422-Y467 VanDerWaalsContact O-CA 3.32Å; L422-Y467 WeakPolarHBondContact O-CA 3.45Å; Y423-Y467 AromaticContact CD2-CD1 3.79Å; Y423-Y467 HydrophobicContact CD2-CD1 3.79Å; Y423-Y467 HydrophobicContact CD2-CD2 4.26Å; Y423-Y467 AromaticContact CD2-CE1 3.53Å; Y423-Y467 HydrophobicContact CD2-CE1 3.53Å; Y423-Y467 HydrophobicContact CD2-CE2 4.03Å; Y423-Y467 HydrophobicContact CD2-CG 4.15Å; Y423-Y467 AromaticContact CD2-CZ 3.66Å; Y423-Y467 HydrophobicContact CE2-CE2 4.33Å; Y423-Y467 HydrophobicContact CG-CD1 4.36Å; Y423-Y467 HydrophobicContact CG-CE1 4.05Å
468	I	88.9	Confident	84.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.8	175.2	66.6	172.8	0	0	0	109.9	L422 C424 A450 A454 V459 I460 V470 I503	L422-I468 HydrophobicContact CB-CD1 4.36Å; L422-I468 HydrophobicContact CB-CG1 3.78Å; L422-I468 HydrophobicContact CD1-CD1 4.37Å; L422-I468 HydrophobicContact CD1-CG1 4.45Å; L422-I468 PolarHBondContact N-O 2.78Å; L422-I468 PolarHBondContact O-N 3.48Å; C424-I468 VanDerWaalsContact SG-CD1 3.54Å; A450-I468 HydrophobicContact CB-CD1 4.24Å; A454-I468 HydrophobicContact CB-CD1 3.89Å; A454-I468 HydrophobicContact CB-CG2 3.8Å; V459-I468 HydrophobicContact CG1-CG2 4.05Å; I460-I468 HydrophobicContact CD1-CG2 4.09Å; I460-I468 HydrophobicContact CG1-CG2 4.39Å; I460-I468 HydrophobicContact CG2-CG2 3.49Å; I460-I468 VanDerWaalsContact CG2-CG2 3.49Å; I468-V470 HydrophobicContact CD1-CG2 4.28Å; I468-V470 HydrophobicContact CG1-CG2 4.48Å; I468-I503 HydrophobicContact CB-CG2 4.09Å; I468-I503 HydrophobicContact CD1-CG2 4.27Å; I468-I503 HydrophobicContact CG2-CG2 4.48Å
469	D	84.6	Confident	84.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.3	169.5	-74.1	-26.6	0	0	0	109.6	M291 R316 R421 I503 F504 V506	M291-D469 HydrophobicContact CB-CB 4.02Å; M291-D469 HydrophobicContact CE-CB 4.41Å; M291-D469 HydrophobicContact CG-CB 4.25Å; M291-D469 VanDerWaalsContact SD-C 3.54Å; M291-D469 HydrophobicContact SD-CB 3.48Å; M291-D469 WeakPolarHBondContact SD-CB 3.12Å; R316-D469 IonicContact NH1-OD1 3.59Å; R316-D469 PolarHBondContact NH1-OD1 3.14Å; R316-D469 IonicContact NH1-OD2 3.9Å; R421-D469 WeakPolarHBondContact CB-OD1 3.44Å; R421-D469 WeakPolarHBondContact CG-OD1 3.17Å; R421-D469 IonicContact CZ-OD1 3.75Å; R421-D469 IonicContact CZ-OD2 3.75Å; R421-D469 IonicContact NE-OD1 2.79Å; R421-D469 PolarHBondContact NE-OD1 3.02Å; R421-D469 IonicContact NE-OD2 3.41Å; R421-D469 IonicContact NH2-OD1 3.79Å; R421-D469 IonicContact NH2-OD2 2.9Å; R421-D469 PolarHBondContact NH2-OD2 3.42Å; D469-I503 WeakPolarHBondContact O-CA 3.21Å; D469-F504 PolarHBondContact N-O 3.46Å; D469-F504 VanDerWaalsContact N-O 3.09Å; D469-F504 PolarHBondContact O-N 3.06Å; D469-V506 HydrophobicContact CB-CG2 4.43Å
470	V	83.8	Confident	84.6	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.9	-177.2	179.6	0	0	0	0	109.9	V406 C419 L422 I468 F501 R502	V406-V470 HydrophobicContact CG1-CG1 3.59Å; V406-V470 HydrophobicContact CG2-CG1 4.12Å; C419-V470 HydrophobicContact CB-CB 4.29Å; C419-V470 PolarHBondContact SG-O 3.03Å; L422-V470 HydrophobicContact CD1-CB 4.47Å; L422-V470 HydrophobicContact CD1-CG2 3.62Å; L422-V470 HydrophobicContact CG-CG2 4.5Å; I468-V470 HydrophobicContact CD1-CG2 4.28Å; I468-V470 HydrophobicContact CG1-CG2 4.48Å; V470-F501 HydrophobicContact CG1-CB 3.76Å; V470-F501 HydrophobicContact CG1-CD2 3.64Å; V470-F501 HydrophobicContact CG1-CE2 4.46Å; V470-F501 HydrophobicContact CG1-CG 3.94Å; V470-R502 WeakPolarHBondContact CA-O 3.32Å
471	M	78.7	Confident	84.6	Confident	61 Å²	61	63.3 Å²	63.3	30%	0.3	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115	176.6	-167.2	171	67.8	0	0	109.9	M291 V473 F501 R502 F504	M291-M471 HydrophobicContact CE-CB 3.63Å; M291-M471 HydrophobicContact CE-CG 4.13Å; M291-M471 HydrophobicContact SD-CB 3.79Å; M471-V473 HydrophobicContact CE-CG1 3.81Å; M471-V473 HydrophobicContact CG-CG1 4.49Å; M471-V473 PolarHBondContact O-N 3.09Å; M471-F501 CarbonylContact O-C 3.51Å; M471-F501 WeakPolarHBondContact O-CA 3.24Å; M471-F501 WeakPolarHBondContact O-CB 3.37Å; M471-R502 PolarHBondContact N-O 3.39Å; M471-R502 PolarHBondContact O-N 2.98Å; M471-F504 HydrophobicContact CB-CD2 4.41Å; M471-F504 HydrophobicContact CB-CE2 3.67Å; M471-F504 HydrophobicContact CE-CE2 3.99Å; M471-F504 HydrophobicContact CE-CZ 3.74Å; M471-F504 HydrophobicContact SD-CE2 4.43Å; M471-F504 HydrophobicContact SD-CZ 4.44Å
472	P	78.6	Confident	84.8	Confident	33 Å²	33	56.3 Å²	56.3	21%	0.214	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.7	167.8	-21.6	34.2	0	0	0	110	C410 Y412 C419	C410-P472 HydrophobicContact CB-CG 4.14Å; Y412-P472 HydrophobicContact CD1-CB 3.89Å; Y412-P472 HydrophobicContact CE1-CB 3.87Å; Y412-P472 HydrophobicContact CE1-CG 4.46Å; C419-P472 VanDerWaalsContact SG-CD 3.54Å; C419-P472 WeakPolarHBondContact SG-CG 2.95Å
473	V	76.6	Confident	85	Confident	34 Å²	34	62.5 Å²	62.5	21%	0.206	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.1	174.3	-58.5	0	0	0	0	109.8	I443 M471 A500 R502	I443-V473 HydrophobicContact CD1-CG2 4.34Å; I443-V473 HydrophobicContact CG2-CG2 3.76Å; M471-V473 HydrophobicContact CE-CG1 3.81Å; M471-V473 HydrophobicContact CG-CG1 4.49Å; M471-V473 PolarHBondContact O-N 3.09Å; V473-A500 HydrophobicContact CG2-CB 3.54Å; V473-A500 PolarHBondContact N-O 3.36Å; V473-A500 CarbonylContact O-C 3.55Å; V473-A500 PolarHBondContact O-N 3.21Å; V473-R502 HydrophobicContact CG1-CG 4.01Å; V473-R502 HydrophobicContact CG2-CG 4.32Å
474	D	78.3	Confident	85.1	Confident	141 Å²	141	63.2 Å²	63.2	75%	0.754	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-62.6	142.1	175.5	-65	-44.6	0	0	0	110.7
475	K	80.1	Confident	85.2	Confident	102 Å²	102	62 Å²	62	44%	0.443	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-58.5	150.9	-179	69	175.4	-171.7	170.6	0	111.3	G498	K475-G498 WeakPolarHBondContact CB-O 3.43Å; K475-G498 WeakPolarHBondContact CD-O 3.43Å
476	R	81.6	Confident	85	Confident	119 Å²	119	63.8 Å²	63.8	45%	0.449	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-99.1	147.7	168.5	-68.6	-169.1	166	-171.3	-0.6	111.5	I443 H478 Y479	I443-R476 VanDerWaalsContact CD1-CZ 3.47Å; I443-R476 HydrophobicContact CG2-CG 4.42Å; R476-H478 WeakPolarHBondContact CB-O 3.18Å; R476-Y479 HydrophobicContact CB-CE1 4.25Å; R476-Y479 HydrophobicContact CB-CE2 4.18Å; R476-Y479 PolarHBondContact N-OH 3.17Å; R476-Y479 VanDerWaalsContact O-CE2 3.29Å; R476-Y479 WeakPolarHBondContact O-CE2 3.49Å
477	N	82.8	Confident	85	Confident	114 Å²	114	63.5 Å²	63.5	61%	0.61	32%	0.318	S	S	*	.	S	Bend	trans	-73.1	-22.7	170.3	-63.2	-19.1	0	0	0	111.5	N494	N477-N494 PolarHBondContact O-N 3.4Å
478	H	85.5	Confident	85.1	Confident	83 Å²	83	65 Å²	65	38%	0.384	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	129.2	177.4	-172.4	45.9	0	0	0	111.9	R476 L492 Q493	R476-H478 WeakPolarHBondContact CB-O 3.18Å; H478-L492 WeakPolarHBondContact CA-O 3.44Å; H478-L492 PolarHBondContact ND1-O 3.2Å; H478-Q493 WeakPolarHBondContact ND1-CG 3.49Å
479	Y	89.1	Confident	85.3	Confident	5 Å²	5	65 Å²	65	2%	0.02	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.8	170.9	-64	-91.6	0	0	0	108.6	I439 I443 R476 S491 L492 P495 A500	I439-Y479 HydrophobicContact CG2-CG 4.47Å; I443-Y479 HydrophobicContact CG2-CE1 4.36Å; R476-Y479 HydrophobicContact CB-CE1 4.25Å; R476-Y479 HydrophobicContact CB-CE2 4.18Å; R476-Y479 PolarHBondContact N-OH 3.17Å; R476-Y479 VanDerWaalsContact O-CE2 3.29Å; R476-Y479 WeakPolarHBondContact O-CE2 3.49Å; Y479-S491 CarbonylContact O-C 3.59Å; Y479-S491 WeakPolarHBondContact O-CA 3.3Å; Y479-S491 WeakPolarHBondContact O-CB 3.35Å; Y479-L492 HydrophobicContact CD2-CB 4.07Å; Y479-L492 PolarHBondContact N-O 2.83Å; Y479-L492 PolarHBondContact O-N 2.93Å; Y479-P495 HydrophobicContact CD2-CG 4.26Å; Y479-P495 HydrophobicContact CE2-CG 3.76Å; Y479-A500 HydrophobicContact CE1-CB 4.4Å; Y479-A500 WeakPolarHBondContact OH-CB 3.25Å
480	I	86.5	Confident	85.6	Confident	98 Å²	98	68.2 Å²	68.2	50%	0.503	34%	0.342	S	S	.	.			trans	-89.3	136.1	-179.3	-58.6	167.2	0	0	0	108.6	G440 T441	G440-I480 CarbonylContact C-O 3.31Å; G440-I480 VanDerWaalsContact C-O 3.31Å; G440-I480 WeakPolarHBondContact CA-O 3.35Å; T441-I480 HydrophobicContact CG2-CB 4.16Å; T441-I480 HydrophobicContact CG2-CG2 4.5Å; T441-I480 WeakPolarHBondContact CG2-O 3.33Å; T441-I480 PolarHBondContact N-O 3.06Å
481	S	90.2	Very high	85.9	Confident	45 Å²	45	71.5 Å²	71.5	32%	0.315	37%	0.365	S	S	.	.			trans	-77.6	148.1	172.3	46.6	0	0	0	0	111.5	S489	S481-S489 WeakPolarHBondContact CB-O 3.27Å
482	S	92.2	Very high	86.3	Confident	22 Å²	22	71.1 Å²	71.1	15%	0.154	36%	0.364	C	S	.	.			trans	-149.6	155.9	171.3	59.9	0	0	0	0	111.1	T441 H456 S489	T441-S482 WeakPolarHBondContact CB-OG 3.48Å; T441-S482 PolarHBondContact OG1-OG 3.43Å; H456-S482 PolarHBondContact CE1-OG 3Å; H456-S482 PolarHBondContact NE2-O 2.9Å; H456-S482 PolarHBondContact NE2-OG 3.49Å; S482-S489 PolarHBondContact N-OG 2.63Å; S482-S489 PolarHBondContact O-N 3.28Å; S482-S489 PolarHBondContact O-OG 3.24Å
483	Y	91.1	Very high	86.6	Confident	160 Å²	160	76.2 Å²	76.2	63%	0.627	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	112.7	167.1	-175.5	-106.4	0	0	0	109.4	I487 F488	Y483-I487 WeakPolarHBondContact CA-O 3.2Å; Y483-I487 WeakPolarHBondContact CD2-O 3.3Å; Y483-F488 HydrophobicContact CD2-CB 4.09Å; Y483-F488 HydrophobicContact CD2-CD2 4.22Å
484	Q	88.4	Confident	86.7	Confident	66 Å²	66	80.6 Å²	80.6	31%	0.308	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	138.7	-179.9	-61.2	-179.7	1.1	0	0	110.1	T441 H456 G486 I487	T441-Q484 PolarHBondContact OG1-NE2 3.22Å; H456-Q484 PolarHBondContact CE1-OE1 2.67Å; H456-Q484 VanDerWaalsContact O-CB 3.22Å; H456-Q484 WeakPolarHBondContact O-CB 3.4Å; H456-Q484 PolarHBondContact O-OE1 3.27Å; Q484-G486 PolarHBondContact O-N 2.87Å; Q484-G486 VanDerWaalsContact O-N 3.1Å; Q484-I487 PolarHBondContact N-O 3.47Å; Q484-I487 PolarHBondContact O-N 3.16Å
485	N	87.9	Confident	86.6	Confident	81 Å²	81	74.7 Å²	74.7	43%	0.433	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	39.5	173.8	-60.7	-58.4	0	0	0	114.3	V455 H456 G458 I487	V455-N485 WeakPolarHBondContact O-CB 3.42Å; V455-N485 PolarHBondContact O-ND2 3.49Å; H456-N485 PolarHBondContact O-ND2 2.79Å; G458-N485 VanDerWaalsContact CA-ND2 3.25Å; G458-N485 WeakPolarHBondContact CA-ND2 3.33Å; G458-N485 PolarHBondContact N-ND2 2.78Å; G458-N485 VanDerWaalsContact N-ND2 3.12Å; N485-I487 VanDerWaalsContact C-N 3.33Å; N485-I487 PolarHBondContact O-N 2.92Å
486	G	83.9	Confident	85.7	Confident	44 Å²	44	75.6 Å²	75.6	45%	0.454	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	5	178.9	0	0	0	0	0	115.4	Q484	Q484-G486 PolarHBondContact O-N 2.87Å; Q484-G486 VanDerWaalsContact O-N 3.1Å
487	I	87.8	Confident	84.9	Confident	10 Å²	10	71.9 Å²	71.9	5%	0.051	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.4	-179.8	-61.1	177.6	0	0	0	109.8	L429 V438 R452 V455 H456 Y483 Q484 N485	L429-I487 HydrophobicContact CD2-CD1 3.5Å; L429-I487 HydrophobicContact CD2-CG1 3.26Å; V438-I487 HydrophobicContact CB-CG2 4.23Å; V438-I487 HydrophobicContact CG2-CG2 4.06Å; R452-I487 HydrophobicContact CB-CD1 4.12Å; R452-I487 HydrophobicContact CG-CD1 4.34Å; R452-I487 WeakPolarHBondContact O-CD1 3.39Å; V455-I487 HydrophobicContact CB-CD1 3.86Å; V455-I487 HydrophobicContact CG1-CD1 3.81Å; H456-I487 HydrophobicContact CB-CB 4Å; H456-I487 HydrophobicContact CB-CD1 3.98Å; H456-I487 HydrophobicContact CB-CG2 4.12Å; H456-I487 PolarHBondContact CD2-O 3.38Å; Y483-I487 WeakPolarHBondContact CA-O 3.2Å; Y483-I487 WeakPolarHBondContact CD2-O 3.3Å; Q484-I487 PolarHBondContact N-O 3.47Å; Q484-I487 PolarHBondContact O-N 3.16Å; N485-I487 VanDerWaalsContact C-N 3.33Å; N485-I487 PolarHBondContact O-N 2.92Å
488	F	90.8	Very high	84.1	Confident	144 Å²	144	68.3 Å²	68.3	63%	0.632	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.2	166.4	-166.8	-91	0	0	0	109.1	Y483	Y483-F488 HydrophobicContact CD2-CB 4.09Å; Y483-F488 HydrophobicContact CD2-CD2 4.22Å
489	S	92.8	Very high	83.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-86.2	149.9	174.9	72.8	0	0	0	0	111.9	V438 G440 S481 S482	V438-S489 CarbonylContact O-C 3.55Å; V438-S489 VanDerWaalsContact O-CA 3.3Å; V438-S489 WeakPolarHBondContact O-CA 3.47Å; G440-S489 WeakPolarHBondContact O-CB 3.3Å; G440-S489 PolarHBondContact O-OG 3.26Å; S481-S489 WeakPolarHBondContact CB-O 3.27Å; S482-S489 PolarHBondContact N-OG 2.63Å; S482-S489 PolarHBondContact O-N 3.28Å; S482-S489 PolarHBondContact O-OG 3.24Å
490	E	91.2	Very high	83.8	Confident	70 Å²	70	68 Å²	68	33%	0.327	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-86.2	145.8	178.7	-60.4	176.7	-141.1	0	0	111.1	R437 V438 I439 G440	R437-E490 IonicContact CZ-OE1 3.85Å; R437-E490 IonicContact CZ-OE2 2.86Å; R437-E490 IonicContact NE-OE1 3.59Å; R437-E490 PolarHBondContact NE-OE1 3.39Å; R437-E490 IonicContact NE-OE2 2.63Å; R437-E490 PolarHBondContact NE-OE2 2.98Å; R437-E490 IonicContact NH2-OE1 2.63Å; R437-E490 IonicContact NH2-OE2 3.77Å; R437-E490 PolarHBondContact NH2-OE2 3.34Å; V438-E490 PolarHBondContact O-N 3.48Å; I439-E490 WeakPolarHBondContact CA-O 3.21Å; I439-E490 HydrophobicContact CG1-CB 4.27Å; G440-E490 PolarHBondContact N-O 2.89Å
491	S	90.4	Very high	83.8	Confident	70 Å²	70	63.3 Å²	63.3	49%	0.49	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-87.6	145.7	169.6	59.9	0	0	0	0	110.8	Y479	Y479-S491 CarbonylContact O-C 3.59Å; Y479-S491 WeakPolarHBondContact O-CA 3.3Å; Y479-S491 WeakPolarHBondContact O-CB 3.35Å
492	L	86.4	Confident	83.7	Confident	52 Å²	52	64.3 Å²	64.3	27%	0.272	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	128.4	176.2	-174.6	60.1	0	0	0	110.2	I439 H478 Y479 P495	I439-L492 HydrophobicContact CG2-CB 3.6Å; I439-L492 HydrophobicContact CG2-CD2 4.02Å; I439-L492 HydrophobicContact CG2-CG 4.47Å; H478-L492 WeakPolarHBondContact CA-O 3.44Å; H478-L492 PolarHBondContact ND1-O 3.2Å; Y479-L492 HydrophobicContact CD2-CB 4.07Å; Y479-L492 PolarHBondContact N-O 2.83Å; Y479-L492 PolarHBondContact O-N 2.93Å; L492-P495 HydrophobicContact CD2-CB 3.76Å; L492-P495 HydrophobicContact CD2-CG 4.09Å; L492-P495 HydrophobicContact CG-CB 4.09Å; L492-P495 HydrophobicContact CG-CG 4.2Å
493	Q	85.1	Confident	83.4	Confident	141 Å²	141	64 Å²	64	66%	0.659	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	138.9	177.2	-76.2	179.5	14.4	0	0	110.1	H478 P495	H478-Q493 WeakPolarHBondContact ND1-CG 3.49Å; Q493-P495 VanDerWaalsContact C-CD 3.5Å
494	N	78.4	Confident	83.1	Confident	125 Å²	125	57 Å²	57	67%	0.668	32%	0.321	S	S	*	.	S	Bend	trans	42.1	56.3	177.3	-62.5	-33.6	0	0	0	114.1	N477	N477-N494 PolarHBondContact O-N 3.4Å
495	P	76	Confident	82.6	Confident	17 Å²	17	54.4 Å²	54.4	11%	0.11	31%	0.311	C	S	.	.			trans	-58.8	130.6	-179.4	11.5	-16.3	0	0	0	111.4	Y479 L492 Q493 G497	Y479-P495 HydrophobicContact CD2-CG 4.26Å; Y479-P495 HydrophobicContact CE2-CG 3.76Å; L492-P495 HydrophobicContact CD2-CB 3.76Å; L492-P495 HydrophobicContact CD2-CG 4.09Å; L492-P495 HydrophobicContact CG-CB 4.09Å; L492-P495 HydrophobicContact CG-CG 4.2Å; Q493-P495 VanDerWaalsContact C-CD 3.5Å; P495-G497 PolarHBondContact O-N 3.05Å; P495-G497 VanDerWaalsContact O-N 3.13Å
496	P	60.8	Low	81.8	Confident	121 Å²	121	52.2 Å²	52.2	79%	0.786	30%	0.3	S	S	*	.	S	Bend	trans	-70.2	110.6	174	27.4	-31.4	0	0	0	108.6
497	G	65.1	Low	80.6	Confident	42 Å²	42	56.7 Å²	56.7	43%	0.433	31%	0.313	S	S	.	.	S	Bend	trans	63.8	-164.7	-174	0	0	0	0	0	113.6	P495	P495-G497 PolarHBondContact O-N 3.05Å; P495-G497 VanDerWaalsContact O-N 3.13Å
498	G	65.9	Low	80.3	Confident	38 Å²	38	59.1 Å²	59.1	39%	0.392	33%	0.326	S	S	.	.			trans	100.5	163.5	176.6	0	0	0	0	0	114.8	K475	K475-G498 WeakPolarHBondContact CB-O 3.43Å; K475-G498 WeakPolarHBondContact CD-O 3.43Å
499	K	82.5	Confident	79.7	Confident	81 Å²	81	54.6 Å²	54.6	35%	0.352	31%	0.31	S	S	.	.			trans	-117.1	173.3	173.6	-60.8	115	167.1	-162.3	0	110.3	Y412 D446	Y412-K499 VanDerWaalsContact CB-NZ 3.25Å; Y412-K499 HydrophobicContact CD1-CB 3.47Å; Y412-K499 VanDerWaalsContact CD1-CB 3.47Å; Y412-K499 HydrophobicContact CD1-CD 3.42Å; Y412-K499 VanDerWaalsContact CD1-CD 3.42Å; Y412-K499 HydrophobicContact CD1-CG 3.32Å; Y412-K499 HydrophobicContact CD2-CD 3.49Å; Y412-K499 VanDerWaalsContact CD2-CD 3.49Å; Y412-K499 HydrophobicContact CD2-CG 4.35Å; Y412-K499 HydrophobicContact CE1-CB 3.17Å; Y412-K499 HydrophobicContact CE1-CD 3.72Å; Y412-K499 HydrophobicContact CE1-CG 3.61Å; Y412-K499 HydrophobicContact CE2-CD 3.8Å; Y412-K499 HydrophobicContact CG-CB 4.26Å; Y412-K499 HydrophobicContact CG-CD 3.28Å; Y412-K499 HydrophobicContact CG-CG 3.72Å; Y412-K499 VanDerWaalsContact CG-NZ 3.34Å; D446-K499 HydrophobicContact CB-CB 4.12Å; D446-K499 WeakPolarHBondContact CB-O 3.24Å; D446-K499 VanDerWaalsContact CG-N 3.27Å; D446-K499 PolarHBondContact N-O 2.85Å; D446-K499 PolarHBondContact OD2-N 3.45Å
500	A	86.3	Confident	79	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	166.6	174	0	0	0	0	0	110.5	I443 Y444 V473 Y479	I443-A500 HydrophobicContact CG2-CB 3.72Å; Y444-A500 CarbonylContact O-C 3.31Å; Y444-A500 VanDerWaalsContact O-CA 3.25Å; Y444-A500 WeakPolarHBondContact O-CA 3.15Å; V473-A500 HydrophobicContact CG2-CB 3.54Å; V473-A500 PolarHBondContact N-O 3.36Å; V473-A500 CarbonylContact O-C 3.55Å; V473-A500 PolarHBondContact O-N 3.21Å; Y479-A500 HydrophobicContact CE1-CB 4.4Å; Y479-A500 WeakPolarHBondContact OH-CB 3.25Å
501	F	87.3	Confident	78.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	162	171.7	68.6	-87.1	0	0	0	112.5	V406 Y444 S445 A453 V470 M471 I503	V406-F501 HydrophobicContact CB-CD1 3.6Å; V406-F501 HydrophobicContact CB-CE1 3.61Å; V406-F501 HydrophobicContact CB-CG 4.06Å; V406-F501 HydrophobicContact CB-CZ 4.12Å; V406-F501 HydrophobicContact CG1-CB 4.03Å; V406-F501 HydrophobicContact CG1-CD1 3.84Å; V406-F501 HydrophobicContact CG1-CD2 4.44Å; V406-F501 HydrophobicContact CG1-CE1 4.34Å; V406-F501 HydrophobicContact CG1-CG 3.88Å; V406-F501 HydrophobicContact CG2-CD1 3.63Å; V406-F501 HydrophobicContact CG2-CD2 3.81Å; V406-F501 HydrophobicContact CG2-CE1 3.31Å; V406-F501 HydrophobicContact CG2-CE2 3.5Å; V406-F501 HydrophobicContact CG2-CG 3.86Å; V406-F501 HydrophobicContact CG2-CZ 3.27Å; Y444-F501 HydrophobicContact CD2-CE2 4.25Å; Y444-F501 HydrophobicContact CG-CE2 4.46Å; Y444-F501 HydrophobicContact CG-CZ 4.4Å; Y444-F501 PolarHBondContact N-O 2.76Å; Y444-F501 PolarHBondContact O-N 3.19Å; S445-F501 WeakPolarHBondContact O-CE1 3.21Å; A453-F501 HydrophobicContact CB-CE2 4.41Å; A453-F501 HydrophobicContact CB-CZ 4.25Å; V470-F501 HydrophobicContact CG1-CB 3.76Å; V470-F501 HydrophobicContact CG1-CD2 3.64Å; V470-F501 HydrophobicContact CG1-CE2 4.46Å; V470-F501 HydrophobicContact CG1-CG 3.94Å; M471-F501 CarbonylContact O-C 3.51Å; M471-F501 WeakPolarHBondContact O-CA 3.24Å; M471-F501 WeakPolarHBondContact O-CB 3.37Å; F501-I503 HydrophobicContact CD2-CD1 4.33Å; F501-I503 HydrophobicContact CD2-CG1 3.66Å; F501-I503 HydrophobicContact CE2-CD1 3.57Å; F501-I503 HydrophobicContact CE2-CG1 3.41Å; F501-I503 VanDerWaalsContact CE2-CG1 3.41Å; F501-I503 HydrophobicContact CZ-CD1 4.49Å
502	R	86.9	Confident	77.5	Confident	67 Å²	67	56.1 Å²	56.1	25%	0.253	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	149.5	168.4	-65.5	-176.9	66	-178.7	-3.2	108.9	I443 V470 M471 V473 F504	I443-R502 HydrophobicContact CD1-CG 4.27Å; I443-R502 HydrophobicContact CG1-CG 4.03Å; V470-R502 WeakPolarHBondContact CA-O 3.32Å; M471-R502 PolarHBondContact N-O 3.39Å; M471-R502 PolarHBondContact O-N 2.98Å; V473-R502 HydrophobicContact CG1-CG 4.01Å; V473-R502 HydrophobicContact CG2-CG 4.32Å; R502-F504 HydrophobicContact CB-CD2 4.35Å; R502-F504 HydrophobicContact CB-CE2 3.47Å; R502-F504 VanDerWaalsContact CB-CE2 3.47Å; R502-F504 HydrophobicContact CB-CZ 3.86Å
503	I	87.1	Confident	76.9	Confident	16 Å²	16	56.3 Å²	56.3	8%	0.082	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	142.5	-179.5	-52.8	172	0	0	0	108.4	Y444 A453 A454 V459 I468 D469 F501	Y444-I503 HydrophobicContact CD2-CD1 4.06Å; Y444-I503 HydrophobicContact CD2-CG1 4.26Å; Y444-I503 HydrophobicContact CE2-CD1 4.08Å; Y444-I503 HydrophobicContact CE2-CG1 4.43Å; A453-I503 HydrophobicContact CB-CD1 3.43Å; A453-I503 VanDerWaalsContact CB-CD1 3.43Å; A454-I503 HydrophobicContact CB-CD1 4.05Å; A454-I503 HydrophobicContact CB-CG2 3.82Å; V459-I503 HydrophobicContact CB-CG2 4.32Å; V459-I503 HydrophobicContact CG1-CG2 4.1Å; V459-I503 HydrophobicContact CG2-CG2 4.2Å; I468-I503 HydrophobicContact CB-CG2 4.09Å; I468-I503 HydrophobicContact CD1-CG2 4.27Å; I468-I503 HydrophobicContact CG2-CG2 4.48Å; D469-I503 WeakPolarHBondContact O-CA 3.21Å; F501-I503 HydrophobicContact CD2-CD1 4.33Å; F501-I503 HydrophobicContact CD2-CG1 3.66Å; F501-I503 HydrophobicContact CE2-CD1 3.57Å; F501-I503 HydrophobicContact CE2-CG1 3.41Å; F501-I503 VanDerWaalsContact CE2-CG1 3.41Å; F501-I503 HydrophobicContact CZ-CD1 4.49Å
504	F	83.4	Confident	76.4	Confident	11 Å²	11	50.3 Å²	50.3	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.4	-176.5	-59.7	-103.6	0	0	0	110	Q289 M291 V459 D469 M471 R502	Q289-F504 HydrophobicContact CB-CD1 4.02Å; Q289-F504 HydrophobicContact CB-CE1 4.3Å; Q289-F504 HydrophobicContact CG-CD1 4.04Å; Q289-F504 HydrophobicContact CG-CE1 3.88Å; Q289-F504 WeakPolarHBondContact O-CB 3.24Å; Q289-F504 VanDerWaalsContact O-CD1 3.3Å; Q289-F504 WeakPolarHBondContact O-CD1 3.46Å; M291-F504 HydrophobicContact CB-CB 4.19Å; M291-F504 HydrophobicContact CB-CD2 4.49Å; M291-F504 HydrophobicContact CB-CG 4.29Å; M291-F504 HydrophobicContact CG-CB 3.69Å; M291-F504 HydrophobicContact CG-CD1 3.9Å; M291-F504 HydrophobicContact CG-CD2 3.21Å; M291-F504 HydrophobicContact CG-CE1 4.28Å; M291-F504 HydrophobicContact CG-CE2 3.62Å; M291-F504 HydrophobicContact CG-CG 3.35Å; M291-F504 HydrophobicContact CG-CZ 4.14Å; M291-F504 HydrophobicContact SD-CB 4.1Å; M291-F504 HydrophobicContact SD-CD2 3.21Å; M291-F504 WeakPolarHBondContact SD-CD2 3.24Å; M291-F504 HydrophobicContact SD-CE2 3.71Å; M291-F504 HydrophobicContact SD-CG 3.89Å; V459-F504 VanDerWaalsContact CG1-C 3.49Å; V459-F504 WeakPolarHBondContact CG1-O 3.42Å; D469-F504 PolarHBondContact N-O 3.46Å; D469-F504 VanDerWaalsContact N-O 3.09Å; D469-F504 PolarHBondContact O-N 3.06Å; M471-F504 HydrophobicContact CB-CD2 4.41Å; M471-F504 HydrophobicContact CB-CE2 3.67Å; M471-F504 HydrophobicContact CE-CE2 3.99Å; M471-F504 HydrophobicContact CE-CZ 3.74Å; M471-F504 HydrophobicContact SD-CE2 4.43Å; M471-F504 HydrophobicContact SD-CZ 4.44Å; R502-F504 HydrophobicContact CB-CD2 4.35Å; R502-F504 HydrophobicContact CB-CE2 3.47Å; R502-F504 VanDerWaalsContact CB-CE2 3.47Å; R502-F504 HydrophobicContact CB-CZ 3.86Å
505	S	78.3	Confident	76.2	Confident	13 Å²	13	44.5 Å²	44.5	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.8	177.7	55.6	0	0	0	0	111.4	V459	V459-S505 VanDerWaalsContact CG1-CA 3.41Å
506	V	71.3	Confident	76.2	Confident	34 Å²	34	46.8 Å²	46.8	21%	0.206	28%	0.28	C	S	.	.			trans	-99	119.3	164.6	-178.4	0	0	0	0	106	R421 D469	R421-V506 VanDerWaalsContact CZ-CG1 3.43Å; R421-V506 VanDerWaalsContact NH1-CG1 3.35Å; D469-V506 HydrophobicContact CB-CG2 4.43Å
507	I	59.9	Low	77.6	Confident	139 Å²	139	40.1 Å²	40.1	71%	0.713	23%	0.234	S	C	*	.			trans	-93.5	0	175	-55.9	176.8	0	0	0	108.5	I288 Q290	I288-I507 HydrophobicContact CD1-CD1 4.25Å; I288-I507 HydrophobicContact CG2-CD1 3.3Å; I288-I507 HydrophobicContact CG2-CG1 4.13Å; Q290-I507 HydrophobicContact CG-CD1 4.14Å; Q290-I507 HydrophobicContact CG-CG1 4.46Å; Q290-I507 VanDerWaalsContact NE2-CG1 3.32Å

Retrieved 507 of 507 residues in 102.4 ms (Link to these results)

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