A0A061IFQ1_CRIGR Loading...

Adenosine deaminase domain-containing protein 2

Required for male fertility and normal male germ cell differentiation.

AlphaFold DB , UniProt , Accession A0A061IFQ1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 564 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	30.4	Very low	237 Å²	237	158.5 Å²	158.5	100%	1.167	84%	0.841	S	S	*	*				0	93.8	0	-59.8	163.1	108.7	0	0	105.2
2	A	27.8	Very low	30.5	Very low	100 Å²	100	153.2 Å²	153.2	83%	0.826	82%	0.822	S	S	*	*			cis	59.5	126.5	33.2	0	0	0	0	0	111.9
3	S	26.5	Very low	32.4	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	79%	0.785	S	S	*	*			cis	-137.6	149.5	1.2	63.4	0	0	0	0	109.5
4	V	33.7	Very low	33.8	Very low	126 Å²	126	141.5 Å²	141.5	76%	0.764	75%	0.748	S	S	*	*				36	113.8	79.7	-170.7	0	0	0	0	112.8
5	D	27.6	Very low	34.5	Very low	165 Å²	165	133.3 Å²	133.3	88%	0.882	71%	0.709	S	S	*	*			trans	-126.3	132.7	158.4	-172.3	23.8	0	0	0	107.3
6	E	28.1	Very low	34.6	Very low	167 Å²	167	129.1 Å²	129.1	78%	0.78	70%	0.698	S	S	*	*			trans	-93.6	151.1	-169.2	-99.9	-123.3	121.8	0	0	112.3	G8	E6-G8 PolarHBondContact O-N 3.18Å
7	G	31.1	Very low	34.7	Very low	69 Å²	69	124.6 Å²	124.6	71%	0.711	68%	0.679	S	S	*	*			trans	-65	87.3	-177.9	0	0	0	0	0	113.4	R9	G7-R9 VanDerWaalsContact C-N 3.32Å; G7-R9 PolarHBondContact O-N 3.32Å
8	G	25	Very low	35.3	Very low	69 Å²	69	119.7 Å²	119.7	71%	0.711	65%	0.652	S	S	*	*			trans	-59.6	84.8	173.6	0	0	0	0	0	112.8	E6 R10	E6-G8 PolarHBondContact O-N 3.18Å; G8-R10 VanDerWaalsContact C-N 3.31Å; G8-R10 PolarHBondContact O-N 3.01Å
9	R	30.4	Very low	35.3	Very low	245 Å²	245	123.3 Å²	123.3	93%	0.925	66%	0.663	S	S	*	*			trans	-61.2	83.3	178.1	-84	-174.3	165.6	-167	-2.2	111.8	G7 R11	G7-R9 VanDerWaalsContact C-N 3.32Å; G7-R9 PolarHBondContact O-N 3.32Å; R9-R11 PolarHBondContact O-N 3.38Å
10	R	35	Very low	35.4	Very low	223 Å²	223	121.4 Å²	121.4	84%	0.842	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.5	165.5	-66.7	-174.6	178.9	-159.1	-1.6	108.8	G8	G8-R10 VanDerWaalsContact C-N 3.31Å; G8-R10 PolarHBondContact O-N 3.01Å
11	R	34.3	Very low	35	Very low	236 Å²	236	120.5 Å²	120.5	89%	0.891	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-62.7	130.7	168.6	-66	-177.1	-179	-177.7	0.6	108.3	R9	R9-R11 PolarHBondContact O-N 3.38Å
12	P	32.1	Very low	34.9	Very low	94 Å²	94	115.2 Å²	115.2	61%	0.61	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-72.3	142.2	-174.4	28.5	-35	0	0	0	112.3
13	R	54.5	Low	34.9	Very low	92 Å²	92	112.9 Å²	112.9	35%	0.347	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-57.7	148.3	178.3	-58.1	-179.7	-174.2	139	10	110.4	A15 A16 S17 S234	R13-A15 PolarHBondContact O-N 2.91Å; R13-A16 HydrophobicContact CB-CB 4.27Å; R13-A16 CarbonylContact O-C 3.12Å; R13-A16 PolarHBondContact O-N 2.93Å; R13-S17 WeakPolarHBondContact O-CB 2.97Å; R13-S17 PolarHBondContact O-N 3.08Å; R13-S17 PolarHBondContact O-OG 3.3Å; R13-S234 PolarHBondContact NH1-OG 2.96Å
14	L	52.2	Low	35	Very low	51 Å²	51	113.2 Å²	113.2	27%	0.267	62%	0.624	S	S	.	*	H	α-helix	trans	-62.7	-40.9	-169.3	-150.1	100.4	0	0	0	113.5	A16 S17 L18 F448	L14-A16 VanDerWaalsContact C-N 3.25Å; L14-A16 PolarHBondContact O-N 3.46Å; L14-S17 PolarHBondContact O-OG 3.19Å; L14-L18 HydrophobicContact CD2-CD1 4.44Å; L14-L18 WeakPolarHBondContact O-CD1 3.28Å; L14-L18 VanDerWaalsContact O-CG 3.26Å; L14-L18 WeakPolarHBondContact O-CG 3.42Å; L14-F448 HydrophobicContact CD1-CE1 4.02Å; L14-F448 HydrophobicContact CD1-CZ 3.7Å; L14-F448 HydrophobicContact CD2-CE2 4.25Å; L14-F448 HydrophobicContact CD2-CZ 3.76Å; L14-F448 HydrophobicContact CG-CZ 4.36Å
15	A	43.8	Very low	34.9	Very low	19 Å²	19	113 Å²	113	16%	0.157	61%	0.61	C	S	.	*	H	α-helix	trans	-72.1	-15.3	176.5	0	0	0	0	0	114.1	R13 F315	R13-A15 PolarHBondContact O-N 2.91Å; A15-F315 HydrophobicContact CB-CE2 3.83Å; A15-F315 HydrophobicContact CB-CZ 4.14Å
16	A	36.1	Very low	35	Very low	66 Å²	66	115.6 Å²	115.6	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-111.4	-16.7	-177.1	0	0	0	0	0	114	R13 L14	R13-A16 HydrophobicContact CB-CB 4.27Å; R13-A16 CarbonylContact O-C 3.12Å; R13-A16 PolarHBondContact O-N 2.93Å; L14-A16 VanDerWaalsContact C-N 3.25Å; L14-A16 PolarHBondContact O-N 3.46Å
17	S	36.9	Very low	35.1	Very low	52 Å²	52	112.8 Å²	112.8	36%	0.364	60%	0.603	S	S	.	*	H	α-helix	trans	-78.1	-32.6	170.3	66.3	0	0	0	0	111.3	R13 L14	R13-S17 WeakPolarHBondContact O-CB 2.97Å; R13-S17 PolarHBondContact O-N 3.08Å; R13-S17 PolarHBondContact O-OG 3.3Å; L14-S17 PolarHBondContact O-OG 3.19Å
18	L	45.3	Very low	35.1	Very low	36 Å²	36	115.5 Å²	115.5	19%	0.188	61%	0.611	C	S	.	*	S	Bend	trans	-83.3	111.9	169	-55	175.9	0	0	0	107.9	L14 I20 T404 H446	L14-L18 HydrophobicContact CD2-CD1 4.44Å; L14-L18 WeakPolarHBondContact O-CD1 3.28Å; L14-L18 VanDerWaalsContact O-CG 3.26Å; L14-L18 WeakPolarHBondContact O-CG 3.42Å; L18-I20 HydrophobicContact CB-CD1 3.86Å; L18-I20 HydrophobicContact CB-CG1 3.71Å; L18-I20 HydrophobicContact CD1-CD1 4.2Å; L18-I20 PolarHBondContact O-N 3.12Å; L18-T404 HydrophobicContact CD1-CG2 4.32Å; L18-H446 VanDerWaalsContact CD1-CD2 3.49Å; L18-H446 WeakPolarHBondContact CD1-CD2 3.41Å; L18-H446 WeakPolarHBondContact CD1-NE2 3.3Å; L18-H446 WeakPolarHBondContact CD2-CE1 3.47Å; L18-H446 WeakPolarHBondContact CD2-NE2 3.44Å
19	Q	34.7	Very low	35.1	Very low	188 Å²	188	115.7 Å²	115.7	88%	0.879	61%	0.614	S	S	*	*			trans	-74.6	61.2	177.7	-67.3	-176.8	-14.5	0	0	111.4	S21	Q19-S21 PolarHBondContact O-N 2.96Å
20	I	37.4	Very low	34.9	Very low	86 Å²	86	107.9 Å²	107.9	44%	0.441	61%	0.609	S	S	.	*			trans	-79.6	72.4	-178	-50.3	178.3	0	0	0	109.5	L18 P22 F315 T404	L18-I20 HydrophobicContact CB-CD1 3.86Å; L18-I20 HydrophobicContact CB-CG1 3.71Å; L18-I20 HydrophobicContact CD1-CD1 4.2Å; L18-I20 PolarHBondContact O-N 3.12Å; I20-P22 VanDerWaalsContact O-CD 3.24Å; I20-P22 WeakPolarHBondContact O-CD 3.39Å; I20-F315 HydrophobicContact CD1-CE1 4.43Å; I20-T404 HydrophobicContact CD1-CG2 4.04Å
21	S	28.3	Very low	34.5	Very low	103 Å²	103	106.6 Å²	106.6	72%	0.72	61%	0.613	S	S	*	*			trans	-72.7	115.5	164.1	-69.3	0	0	0	0	109.1	Q19 G23	Q19-S21 PolarHBondContact O-N 2.96Å; S21-G23 VanDerWaalsContact C-N 3.33Å; S21-G23 PolarHBondContact O-N 3.19Å
22	P	31.2	Very low	34	Very low	125 Å²	125	104.3 Å²	104.3	81%	0.812	61%	0.612	S	S	*	*			trans	-68	95.7	167	28.7	-32.6	0	0	0	108.2	I20	I20-P22 VanDerWaalsContact O-CD 3.24Å; I20-P22 WeakPolarHBondContact O-CD 3.39Å
23	G	29.6	Very low	34	Very low	51 Å²	51	105.8 Å²	105.8	53%	0.526	62%	0.622	S	S	.	*			trans	-54.7	133.1	-175.3	0	0	0	0	0	111.8	S21 W25	S21-G23 VanDerWaalsContact C-N 3.33Å; S21-G23 PolarHBondContact O-N 3.19Å; G23-W25 PolarHBondContact O-N 3.19Å
24	P	28	Very low	32.6	Very low	114 Å²	114	108.1 Å²	108.1	74%	0.74	65%	0.647	S	S	*	*			trans	-64	126.5	-177.7	25.8	-33.8	0	0	0	110.2	R26	P24-R26 PolarHBondContact O-N 3.23Å; P24-R26 VanDerWaalsContact O-N 3.1Å
25	W	31.5	Very low	31.3	Very low	122 Å²	122	114.5 Å²	114.5	46%	0.462	68%	0.675	S	S	.	*			trans	-60.8	114	175.1	-78.2	47.3	0	0	0	109.6	G23 P399 P439	G23-W25 PolarHBondContact O-N 3.19Å; W25-P399 HydrophobicContact CZ2-CB 4.24Å; W25-P439 HydrophobicContact CH2-CB 3.69Å; W25-P439 HydrophobicContact CH2-CG 3.62Å; W25-P439 HydrophobicContact CZ2-CB 3.55Å; W25-P439 HydrophobicContact CZ2-CG 3.77Å
26	R	29.7	Very low	30.4	Very low	219 Å²	219	118.9 Å²	118.9	83%	0.826	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-103.5	123.7	166	-69.8	-173.3	178.6	-124.2	2.5	108.8	P24	P24-R26 PolarHBondContact O-N 3.23Å; P24-R26 VanDerWaalsContact O-N 3.1Å
27	P	29.8	Very low	29.8	Very low	109 Å²	109	119.4 Å²	119.4	71%	0.708	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-69.3	129.5	164.3	29.6	-31.4	0	0	0	108.6	G29	P27-G29 PolarHBondContact O-N 3.33Å
28	S	30.6	Very low	29.3	Very low	125 Å²	125	125.5 Å²	125.5	87%	0.874	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-66.5	116.6	169	-56.5	0	0	0	0	108.7
29	G	26.6	Very low	28.3	Very low	74 Å²	74	127.6 Å²	127.6	76%	0.763	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.8	135.4	169.7	0	0	0	0	0	109.9	P27	P27-G29 PolarHBondContact O-N 3.33Å
30	G	25.9	Very low	27.8	Very low	81 Å²	81	123.4 Å²	123.4	84%	0.835	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.5	141.5	169.4	0	0	0	0	0	110.6
31	Q	26.3	Very low	28	Very low	196 Å²	196	125.5 Å²	125.5	92%	0.916	80%	0.799	S	S	*	*			trans	-126.5	129.8	160.9	-70.9	-174.4	-78.8	0	0	108.1
32	E	24.1	Very low	27.9	Very low	187 Å²	187	124.1 Å²	124.1	87%	0.874	80%	0.801	S	S	*	*			trans	-76.2	159.8	165.5	-76.5	-174.7	137.9	0	0	110
33	P	30.8	Very low	27.5	Very low	125 Å²	125	124.7 Å²	124.7	81%	0.812	80%	0.803	S	S	*	*			trans	-81.8	161.6	-164.4	32.3	-36.4	0	0	0	114.2
34	T	24.6	Very low	27.9	Very low	142 Å²	142	128.3 Å²	128.3	87%	0.871	82%	0.817	S	S	*	*			trans	-145.1	158.6	160.2	-39.4	0	0	0	0	108.7
35	E	25.4	Very low	27.8	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.864	82%	0.816	S	S	*	*			trans	-102.1	161.4	-152.4	-57	177	114	0	0	116.2
36	A	24.8	Very low	27.4	Very low	110 Å²	110	127 Å²	127	91%	0.909	83%	0.834	S	S	*	*			trans	67.2	144.1	146.7	0	0	0	0	0	121.6
37	G	24.7	Very low	28	Very low	78 Å²	78	121.5 Å²	121.5	80%	0.804	83%	0.827	S	S	*	*			trans	155	99.5	170.4	0	0	0	0	0	113.4
38	D	25.3	Very low	27.8	Very low	179 Å²	179	124.3 Å²	124.3	96%	0.957	83%	0.831	S	S	*	*			trans	-75.8	157.3	179.1	-72.7	-66.4	0	0	0	114.1
39	G	25.2	Very low	27.6	Very low	81 Å²	81	124.7 Å²	124.7	84%	0.835	83%	0.828	S	S	*	*			trans	163.8	99.9	165.1	0	0	0	0	0	116.7
40	A	24.7	Very low	27.5	Very low	99 Å²	99	124.3 Å²	124.3	82%	0.818	82%	0.823	S	S	*	*			trans	-148.8	174.3	168.3	0	0	0	0	0	108.8
41	P	41.2	Very low	27.6	Very low	130 Å²	130	130.2 Å²	130.2	84%	0.844	83%	0.832	S	S	*	*			cis	-129.4	-174.6	-2.2	41.5	-25.5	0	0	0	114
42	G	25.5	Very low	27.6	Very low	75 Å²	75	125.6 Å²	125.6	77%	0.773	83%	0.827	S	S	*	*			trans	-178.1	112.9	168.5	0	0	0	0	0	115.9
43	T	23.9	Very low	27.7	Very low	137 Å²	137	129.1 Å²	129.1	84%	0.84	83%	0.833	S	S	*	*			trans	-153.2	172.2	177.2	17	0	0	0	0	108.9
44	P	37.8	Very low	27.4	Very low	127 Å²	127	126 Å²	126	83%	0.825	82%	0.823	S	S	*	*			cis	-128.4	-171.2	-14.3	37.7	-19.7	0	0	0	113.2
45	G	25.1	Very low	27.4	Very low	70 Å²	70	127.7 Å²	127.7	72%	0.722	82%	0.821	S	S	*	*			trans	178.6	130.7	166	0	0	0	0	0	117.1
46	T	24.2	Very low	27.3	Very low	138 Å²	138	126.5 Å²	126.5	85%	0.847	82%	0.816	S	S	*	*			trans	-164.9	174	178.2	16.2	0	0	0	0	108.5
47	P	40.9	Very low	27.4	Very low	103 Å²	103	124.9 Å²	124.9	67%	0.669	80%	0.802	S	S	*	*			cis	-133.5	-153.4	-13.2	26.8	-0	0	0	0	112.9
48	E	26.3	Very low	27.3	Very low	169 Å²	169	127.5 Å²	127.5	79%	0.79	81%	0.808	S	S	*	*			trans	75.3	157.8	161.1	-56.3	-166.6	174.4	0	0	118
49	T	27.1	Very low	27.2	Very low	133 Å²	133	122.1 Å²	122.1	82%	0.816	80%	0.795	S	S	*	*			cis	-154.9	178.6	-11.6	12.4	0	0	0	0	108.2
50	G	24.6	Very low	27.2	Very low	65 Å²	65	128 Å²	128	67%	0.67	80%	0.801	S	S	*	*			cis	163.3	159	-4.7	0	0	0	0	0	114
51	M	26.2	Very low	27.2	Very low	205 Å²	205	127.4 Å²	127.4	100%	1.01	80%	0.796	S	S	*	*			trans	71.5	167.8	165.2	-73	-161.4	173.8	0	0	122.6
52	A	26.9	Very low	26.3	Very low	100 Å²	100	127.5 Å²	127.5	83%	0.826	80%	0.799	S	S	*	*			trans	-155.6	164.7	-171.2	0	0	0	0	0	114.2
53	R	26.2	Very low	26.2	Very low	260 Å²	260	134.3 Å²	134.3	98%	0.981	81%	0.807	S	S	*	*			trans	-166.4	158.4	169.3	-92.8	177.9	174.2	-175.2	-3.5	108.3
54	G	23.9	Very low	26.3	Very low	60 Å²	60	132 Å²	132	62%	0.619	80%	0.802	S	S	*	*			cis	152.6	119.4	-12.3	0	0	0	0	0	113.8
55	Q	24.9	Very low	26	Very low	178 Å²	178	132.4 Å²	132.4	83%	0.832	80%	0.804	S	S	*	*			trans	66.2	165.8	158.9	-63.6	160.4	-96.1	0	0	116.7
56	E	24.8	Very low	25.9	Very low	159 Å²	159	133 Å²	133	74%	0.743	81%	0.811	S	S	*	*			cis	-167.5	176.9	-13.1	-112.7	175.9	-106.6	0	0	108.3
57	A	25.5	Very low	25.8	Very low	76 Å²	76	130.1 Å²	130.1	63%	0.628	81%	0.808	S	S	*	*			cis	-165.4	-167	-5.9	0	0	0	0	0	110.1
58	S	24.1	Very low	24.9	Very low	133 Å²	133	131.3 Å²	131.3	93%	0.93	82%	0.819	S	S	*	*			trans	70.2	155.4	165.5	82	0	0	0	0	120.4
59	G	23.2	Very low	24.8	Very low	66 Å²	66	129.1 Å²	129.1	68%	0.68	82%	0.817	S	S	*	*			cis	173	166.4	-9.3	0	0	0	0	0	115
60	E	24.8	Very low	24.6	Very low	204 Å²	204	130 Å²	130	95%	0.953	82%	0.816	S	S	*	*			trans	68.5	152.6	166.2	-66.8	-164.5	112	0	0	119.9
61	A	24.4	Very low	24.6	Very low	87 Å²	87	138.3 Å²	138.3	72%	0.719	83%	0.827	S	S	*	*			cis	-158.1	173.3	-10.2	0	0	0	0	0	111.1
62	C	21.8	Very low	24.4	Very low	133 Å²	133	132.3 Å²	132.3	90%	0.899	81%	0.81	S	S	*	*			trans	-132.2	158.1	-167	-55	0	0	0	0	115.9
63	K	23	Very low	24.3	Very low	217 Å²	217	135.6 Å²	135.6	94%	0.943	81%	0.808	S	S	*	*			trans	-158.2	154.8	164.7	-116.4	169	-170.4	174.5	0	115.5
64	A	25.9	Very low	24.8	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	80%	0.795	S	S	*	*			trans	-135.8	179.5	169.5	0	0	0	0	0	108.9
65	P	32.3	Very low	25	Very low	134 Å²	134	130.9 Å²	130.9	87%	0.87	81%	0.81	S	S	*	*				-146.5	-169.9	66.3	38.5	-16.5	0	0	0	114.7
66	G	22.7	Very low	25	Very low	83 Å²	83	125.6 Å²	125.6	86%	0.856	80%	0.803	S	S	*	*			trans	-118.9	-168.2	-173.3	0	0	0	0	0	116.8
67	G	21.6	Very low	25.1	Very low	77 Å²	77	125.7 Å²	125.7	79%	0.794	81%	0.809	S	S	*	*			trans	160.7	140.1	168.3	0	0	0	0	0	118.1
68	S	22.8	Very low	25.1	Very low	129 Å²	129	131.4 Å²	131.4	90%	0.902	82%	0.82	S	S	*	*			trans	83	161.5	162.9	-146.7	0	0	0	0	120.7
69	V	25	Very low	25.9	Very low	123 Å²	123	130.3 Å²	130.3	75%	0.745	81%	0.809	S	S	*	*			trans	-151	141.9	-159.7	-179.1	0	0	0	0	111.5
70	L	22.7	Very low	26.3	Very low	152 Å²	152	134.2 Å²	134.2	80%	0.796	81%	0.812	S	S	*	*			trans	158.5	126.7	134.6	-87	168.3	0	0	0	114.5
71	R	23.2	Very low	26.8	Very low	239 Å²	239	127.6 Å²	127.6	90%	0.902	79%	0.792	S	S	*	*			trans	41.5	143.4	147.3	-76.4	-172.8	165.4	176.1	-4.8	121.7
72	A	22.7	Very low	27.5	Very low	78 Å²	78	126.3 Å²	126.3	65%	0.645	78%	0.781	S	S	*	*			cis	-166.6	155.7	-4.1	0	0	0	0	0	112
73	E	24.5	Very low	28.3	Very low	169 Å²	169	127.5 Å²	127.5	79%	0.79	77%	0.774	S	S	*	*			trans	32.7	151.5	146.4	-56.2	-44	100	0	0	123.4
74	P	36.7	Very low	29.1	Very low	110 Å²	110	123.9 Å²	123.9	71%	0.714	76%	0.76	S	S	*	*			cis	-138.4	122.8	-30	34.1	-15.2	0	0	0	113.8
75	A	28.3	Very low	30.1	Very low	111 Å²	111	121.7 Å²	121.7	92%	0.917	74%	0.735	S	S	*	*			trans	-161.4	120.9	163.7	0	0	0	0	0	111.5
76	G	24.7	Very low	30.6	Very low	68 Å²	68	119.5 Å²	119.5	70%	0.701	72%	0.724	S	S	*	*			trans	160.7	127.2	171.9	0	0	0	0	0	115.9
77	N	27.4	Very low	31.7	Very low	160 Å²	160	122.9 Å²	122.9	86%	0.856	72%	0.721	S	S	*	*			trans	-46.6	146.3	172.5	-50.7	-36	0	0	0	114.5	P79	N77-P79 VanDerWaalsContact O-CD 3.32Å; N77-P79 WeakPolarHBondContact O-CD 3.27Å
78	F	24.6	Very low	33.2	Very low	197 Å²	197	121.4 Å²	121.4	86%	0.864	70%	0.695	S	S	*	*			trans	-99	113.6	161.2	-85.3	-81.2	0	0	0	111.8
79	P	42.6	Very low	34.5	Very low	109 Å²	109	118.4 Å²	118.4	71%	0.708	68%	0.678	S	S	*	*			trans	-126.6	69.4	159.3	38	-25	0	0	0	110.7	N77	N77-P79 VanDerWaalsContact O-CD 3.32Å; N77-P79 WeakPolarHBondContact O-CD 3.27Å
80	M	30.2	Very low	35.9	Very low	149 Å²	149	121.9 Å²	121.9	73%	0.734	68%	0.678	S	S	*	*	S	Bend	trans	-150.6	-21.8	176.5	-146.3	162.7	-74.2	0	0	116.6	A82	M80-A82 PolarHBondContact O-N 2.67Å
81	A	36.4	Very low	37.5	Very low	64 Å²	64	120.5 Å²	120.5	53%	0.529	67%	0.671	S	S	.	*	H	α-helix	trans	-72.7	-26.7	-176.3	0	0	0	0	0	115.1	Q83	A81-Q83 PolarHBondContact O-N 3.25Å
82	A	39.1	Very low	39.6	Very low	60 Å²	60	110 Å²	110	50%	0.496	63%	0.634	S	S	.	*	H	α-helix	trans	-72.7	-25.6	-174.4	0	0	0	0	0	114.1	M80 S86	M80-A82 PolarHBondContact O-N 2.67Å; A82-S86 PolarHBondContact O-N 3.48Å; A82-S86 PolarHBondContact O-OG 3.29Å
83	Q	38.5	Very low	41.9	Very low	159 Å²	159	109.5 Å²	109.5	74%	0.743	62%	0.624	S	S	*	*	H	α-helix	trans	-76.4	-35.6	-176	-99.3	178.1	-7.2	0	0	113.2	A81 S86	A81-Q83 PolarHBondContact O-N 3.25Å; Q83-S86 WeakPolarHBondContact O-CB 3.38Å; Q83-S86 PolarHBondContact O-N 3.28Å
84	E	40.1	Very low	44	Very low	141 Å²	141	104.2 Å²	104.2	66%	0.659	60%	0.604	S	S	*	*	H	α-helix	trans	-72.1	-38.7	175.7	-63.8	-164	142.9	0	0	112.1	S86 L87	E84-S86 PolarHBondContact O-N 3.48Å; E84-L87 PolarHBondContact O-N 2.94Å
85	L	46	Very low	45.5	Very low	43 Å²	43	104.2 Å²	104.2	23%	0.225	60%	0.602	C	S	.	*	H	α-helix	trans	-63.6	-23.6	175.2	-68.9	174	0	0	0	112.9	L87 L88 L164	L85-L87 PolarHBondContact O-N 2.58Å; L85-L88 HydrophobicContact CD2-CD1 4.07Å; L85-L88 PolarHBondContact O-N 3.22Å; L85-L164 HydrophobicContact CD1-CD1 4.14Å
86	S	43.8	Very low	47.7	Very low	89 Å²	89	104.1 Å²	104.1	62%	0.622	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-14.1	175.1	-62.6	0	0	0	0	113.8	A82 Q83 E84	A82-S86 PolarHBondContact O-N 3.48Å; A82-S86 PolarHBondContact O-OG 3.29Å; Q83-S86 WeakPolarHBondContact O-CB 3.38Å; Q83-S86 PolarHBondContact O-N 3.28Å; E84-S86 PolarHBondContact O-N 3.48Å
87	L	44.6	Very low	50.2	Low	153 Å²	153	100.9 Å²	100.9	80%	0.801	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.5	178	-69.7	170.4	0	0	0	114	E84 L85 A89	E84-L87 PolarHBondContact O-N 2.94Å; L85-L87 PolarHBondContact O-N 2.58Å; L87-A89 PolarHBondContact O-N 3.14Å
88	L	53.7	Low	52.6	Low	47 Å²	47	94.9 Å²	94.9	25%	0.246	52%	0.518	C	S	.	.	S	Bend	trans	-61.8	118.6	169.5	-88.4	161.3	0	0	0	110.1	L85 R90 L100	L85-L88 HydrophobicContact CD2-CD1 4.07Å; L85-L88 PolarHBondContact O-N 3.22Å; L88-R90 PolarHBondContact O-N 3.2Å; L88-L100 HydrophobicContact CD2-CB 4.18Å; L88-L100 HydrophobicContact CD2-CD1 4.09Å; L88-L100 HydrophobicContact CD2-CD2 4.01Å; L88-L100 HydrophobicContact CD2-CG 4.32Å
89	A	49.1	Very low	55.2	Low	66 Å²	66	88.6 Å²	88.6	55%	0.545	50%	0.503	S	S	.	.			trans	-49.3	135.2	175.7	0	0	0	0	0	110.3	L87 D91	L87-A89 PolarHBondContact O-N 3.14Å; A89-D91 PolarHBondContact O-N 3Å; A89-D91 VanDerWaalsContact O-N 3.08Å
90	R	54.1	Low	56.9	Low	196 Å²	196	85.5 Å²	85.5	74%	0.74	48%	0.48	S	S	*	.	S	Bend	trans	-54.7	-35.5	-169.9	-95.1	-174.8	173.6	-95.1	-2.9	113.4	L88	L88-R90 PolarHBondContact O-N 3.2Å
91	D	58.3	Low	59.2	Low	122 Å²	122	78.4 Å²	78.4	65%	0.652	45%	0.445	S	S	*	.	S	Bend	trans	-137.7	101.4	172.1	-62	-78.7	0	0	0	109.1	A89	A89-D91 PolarHBondContact O-N 3Å; A89-D91 VanDerWaalsContact O-N 3.08Å
92	P	66.4	Low	61.1	Low	20 Å²	20	78.8 Å²	78.8	13%	0.13	44%	0.441	C	S	.	.			trans	-77.5	154	175	31	-32.2	0	0	0	111	L100 L154 L157	P92-L100 HydrophobicContact CB-CD1 3.55Å; P92-L100 HydrophobicContact CG-CD1 4.01Å; P92-L154 HydrophobicContact CG-CD2 3.82Å; P92-L157 HydrophobicContact CG-CD1 4.45Å
93	P	71.8	Confident	62.9	Low	67 Å²	67	81.6 Å²	81.6	44%	0.435	44%	0.444	S	S	.	.			trans	-57.8	141.5	173.5	-23	33.4	0	0	0	111.5	V95 Q96 A97	P93-V95 PolarHBondContact O-N 3.37Å; P93-V95 VanDerWaalsContact O-N 3.08Å; P93-Q96 PolarHBondContact O-N 3.34Å; P93-A97 PolarHBondContact O-N 3.28Å
94	P	67.5	Low	64.5	Low	57 Å²	57	74.3 Å²	74.3	37%	0.37	41%	0.41	S	S	.	.	H	α-helix	trans	-51.8	-38.8	-178.3	-26.7	31.9	0	0	0	113.5	Q96 A97 Q150 L154	P94-Q96 PolarHBondContact O-N 2.92Å; P94-A97 WeakPolarHBondContact O-CB 3.37Å; P94-A97 PolarHBondContact O-N 3.08Å; P94-Q150 HydrophobicContact CB-CB 3.95Å; P94-Q150 WeakPolarHBondContact O-CB 3.33Å; P94-Q150 VanDerWaalsContact O-CG 3.26Å; P94-Q150 WeakPolarHBondContact O-CG 3.48Å; P94-L154 HydrophobicContact CB-CD1 4.11Å; P94-L154 HydrophobicContact CG-CD1 3.95Å
95	V	68.4	Low	66.2	Low	110 Å²	110	67.8 Å²	67.8	67%	0.667	38%	0.38	S	S	*	.	H	α-helix	trans	-58.4	-30.1	177.5	-173.7	0	0	0	0	113.2	P93	P93-V95 PolarHBondContact O-N 3.37Å; P93-V95 VanDerWaalsContact O-N 3.08Å
96	Q	74.9	Confident	67.4	Low	110 Å²	110	69.1 Å²	69.1	51%	0.514	40%	0.397	S	S	.	.	H	α-helix	trans	-94.4	-22.3	-179.7	-63.2	178.9	-0.1	0	0	112.7	P93 P94 V98 A99 L100	P93-Q96 PolarHBondContact O-N 3.34Å; P94-Q96 PolarHBondContact O-N 2.92Å; Q96-V98 VanDerWaalsContact C-N 3.3Å; Q96-V98 PolarHBondContact O-N 2.81Å; Q96-A99 PolarHBondContact O-N 3.17Å; Q96-A99 VanDerWaalsContact O-N 3.11Å; Q96-L100 HydrophobicContact CB-CD1 4.32Å; Q96-L100 WeakPolarHBondContact O-CG 3.3Å; Q96-L100 PolarHBondContact O-N 2.8Å; Q96-L100 VanDerWaalsContact O-N 3.09Å
97	A	77	Confident	68.5	Low	0 Å²	0	70 Å²	70	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-57.3	-37.5	-173.9	0	0	0	0	0	114	P93 P94 L100 L101 A153 L154 L157	P93-A97 PolarHBondContact O-N 3.28Å; P94-A97 WeakPolarHBondContact O-CB 3.37Å; P94-A97 PolarHBondContact O-N 3.08Å; A97-L100 PolarHBondContact O-N 3.44Å; A97-L101 WeakPolarHBondContact O-CB 3.31Å; A97-L101 PolarHBondContact O-N 2.95Å; A97-A153 HydrophobicContact CB-CB 4.15Å; A97-L154 HydrophobicContact CB-CD2 3.52Å; A97-L154 HydrophobicContact CB-CG 3.6Å; A97-L157 HydrophobicContact CB-CD1 4.39Å
98	V	78.4	Confident	69.6	Low	33 Å²	33	66.5 Å²	66.5	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-65.2	-40.7	178.8	-174	0	0	0	0	111.4	Q96 T102 F114 K149 Q150 A153	Q96-V98 VanDerWaalsContact C-N 3.3Å; Q96-V98 PolarHBondContact O-N 2.81Å; V98-T102 WeakPolarHBondContact O-CB 3.46Å; V98-T102 PolarHBondContact O-N 3.21Å; V98-T102 PolarHBondContact O-OG1 3.17Å; V98-F114 HydrophobicContact CG1-CE2 4.48Å; V98-F114 HydrophobicContact CG1-CZ 4.23Å; V98-K149 HydrophobicContact CG2-CG 4.45Å; V98-Q150 HydrophobicContact CG2-CB 4.39Å; V98-Q150 HydrophobicContact CG2-CG 3.87Å; V98-A153 HydrophobicContact CB-CB 4.36Å; V98-A153 HydrophobicContact CG2-CB 3.88Å
99	A	79.2	Confident	70.2	Confident	65 Å²	65	67.6 Å²	67.6	54%	0.537	40%	0.4	S	S	.	.	H	α-helix	trans	-69.4	-44.6	178.1	0	0	0	0	0	111.4	Q96 L101 T102 Q103	Q96-A99 PolarHBondContact O-N 3.17Å; Q96-A99 VanDerWaalsContact O-N 3.11Å; A99-L101 PolarHBondContact O-N 3.5Å; A99-T102 PolarHBondContact O-N 3.28Å; A99-Q103 WeakPolarHBondContact O-CB 3.5Å; A99-Q103 PolarHBondContact O-N 3.32Å
100	L	77.4	Confident	71.4	Confident	44 Å²	44	66.7 Å²	66.7	23%	0.23	39%	0.387	C	S	.	.	H	α-helix	trans	-63.4	-40	177.7	-66	171.9	0	0	0	112.3	L88 P92 Q96 A97 C104 L157	L88-L100 HydrophobicContact CD2-CB 4.18Å; L88-L100 HydrophobicContact CD2-CD1 4.09Å; L88-L100 HydrophobicContact CD2-CD2 4.01Å; L88-L100 HydrophobicContact CD2-CG 4.32Å; P92-L100 HydrophobicContact CB-CD1 3.55Å; P92-L100 HydrophobicContact CG-CD1 4.01Å; Q96-L100 HydrophobicContact CB-CD1 4.32Å; Q96-L100 WeakPolarHBondContact O-CG 3.3Å; Q96-L100 PolarHBondContact O-N 2.8Å; Q96-L100 VanDerWaalsContact O-N 3.09Å; A97-L100 PolarHBondContact O-N 3.44Å; L100-C104 WeakPolarHBondContact O-CB 3.38Å; L100-C104 PolarHBondContact O-N 3.18Å; L100-L157 HydrophobicContact CB-CD1 4.2Å
101	L	77.9	Confident	72.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-46.2	172.9	-178.8	66.4	0	0	0	111.2	A97 A99 Q103 C104 V105 L112 F114 A153 A156 L157 I160	A97-L101 WeakPolarHBondContact O-CB 3.31Å; A97-L101 PolarHBondContact O-N 2.95Å; A99-L101 PolarHBondContact O-N 3.5Å; L101-Q103 VanDerWaalsContact C-N 3.31Å; L101-Q103 PolarHBondContact O-N 2.87Å; L101-C104 PolarHBondContact O-N 2.89Å; L101-V105 HydrophobicContact CD1-CG2 3.81Å; L101-V105 HydrophobicContact CG-CG2 4.17Å; L101-V105 WeakPolarHBondContact O-CB 3.38Å; L101-V105 VanDerWaalsContact O-CG2 3.25Å; L101-V105 WeakPolarHBondContact O-CG2 3.48Å; L101-V105 PolarHBondContact O-N 3.1Å; L101-L112 HydrophobicContact CD2-CD1 3.98Å; L101-L112 HydrophobicContact CD2-CD2 4.05Å; L101-L112 HydrophobicContact CG-CD2 4.02Å; L101-F114 HydrophobicContact CD2-CZ 4.11Å; L101-A153 HydrophobicContact CB-CB 4.33Å; L101-A153 HydrophobicContact CD2-CB 3.94Å; L101-A156 HydrophobicContact CD1-CB 4.03Å; L101-A156 HydrophobicContact CD2-CB 3.79Å; L101-L157 HydrophobicContact CB-CD1 4.36Å; L101-L157 HydrophobicContact CB-CD2 4.19Å; L101-L157 HydrophobicContact CB-CG 4.05Å; L101-L157 HydrophobicContact CD1-CD2 3.97Å; L101-L157 HydrophobicContact CD1-CG 4.06Å; L101-I160 HydrophobicContact CD1-CD1 3.61Å
102	T	77.6	Confident	73.3	Confident	72 Å²	72	56.6 Å²	56.6	44%	0.442	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-41.5	-179.7	-53.7	0	0	0	0	111.3	V98 A99 A106	V98-T102 WeakPolarHBondContact O-CB 3.46Å; V98-T102 PolarHBondContact O-N 3.21Å; V98-T102 PolarHBondContact O-OG1 3.17Å; A99-T102 PolarHBondContact O-N 3.28Å; T102-A106 VanDerWaalsContact O-CB 3.29Å; T102-A106 WeakPolarHBondContact O-CB 3.46Å; T102-A106 PolarHBondContact O-N 2.98Å
103	Q	76.2	Confident	74	Confident	119 Å²	119	58.7 Å²	58.7	56%	0.556	37%	0.365	S	S	*	.	H	α-helix	trans	-67.9	-44	175.4	-175.2	178.9	-3.4	0	0	112.5	A99 L101 V105 A106 N107	A99-Q103 WeakPolarHBondContact O-CB 3.5Å; A99-Q103 PolarHBondContact O-N 3.32Å; L101-Q103 VanDerWaalsContact C-N 3.31Å; L101-Q103 PolarHBondContact O-N 2.87Å; Q103-V105 PolarHBondContact O-N 3.11Å; Q103-A106 PolarHBondContact O-N 3.47Å; Q103-N107 WeakPolarHBondContact O-CB 3.33Å; Q103-N107 PolarHBondContact O-N 2.84Å; Q103-N107 PolarHBondContact O-OD1 3.19Å
104	C	71.9	Confident	74.5	Confident	7 Å²	7	57.7 Å²	57.7	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-59.8	-46	177	179.2	0	0	0	0	111.5	L100 L101 N107 L108 L157	L100-C104 WeakPolarHBondContact O-CB 3.38Å; L100-C104 PolarHBondContact O-N 3.18Å; L101-C104 PolarHBondContact O-N 2.89Å; C104-N107 PolarHBondContact O-N 3.19Å; C104-L108 VanDerWaalsContact O-CG 3.29Å; C104-L108 WeakPolarHBondContact O-CG 3.44Å; C104-L108 PolarHBondContact O-N 3.47Å; C104-L108 VanDerWaalsContact O-N 3.11Å; C104-L157 HydrophobicContact CB-CD2 4.39Å
105	V	75.1	Confident	75.1	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.024	36%	0.356	C	S	.	.	H	α-helix	trans	-68.5	-41.3	-179.3	169.1	0	0	0	0	111.7	L101 Q103 N107 L108 G109 V110 L112 L132 I160	L101-V105 HydrophobicContact CD1-CG2 3.81Å; L101-V105 HydrophobicContact CG-CG2 4.17Å; L101-V105 WeakPolarHBondContact O-CB 3.38Å; L101-V105 VanDerWaalsContact O-CG2 3.25Å; L101-V105 WeakPolarHBondContact O-CG2 3.48Å; L101-V105 PolarHBondContact O-N 3.1Å; Q103-V105 PolarHBondContact O-N 3.11Å; V105-N107 PolarHBondContact O-N 3.01Å; V105-L108 CarbonylContact O-C 3.55Å; V105-L108 PolarHBondContact O-N 2.99Å; V105-L108 VanDerWaalsContact O-N 3.14Å; V105-G109 PolarHBondContact O-N 3.25Å; V105-G109 VanDerWaalsContact O-N 3.11Å; V105-V110 HydrophobicContact CG1-CB 3.82Å; V105-V110 HydrophobicContact CG1-CG1 3.81Å; V105-V110 WeakPolarHBondContact CG1-O 3.36Å; V105-V110 PolarHBondContact O-N 3.21Å; V105-V110 VanDerWaalsContact O-N 3.13Å; V105-L112 HydrophobicContact CB-CB 4.47Å; V105-L112 HydrophobicContact CG1-CB 3.79Å; V105-L132 HydrophobicContact CG1-CD2 4.32Å; V105-L132 HydrophobicContact CG2-CD2 3.54Å; V105-I160 HydrophobicContact CG2-CD1 4.47Å
106	A	71.6	Confident	75.5	Confident	70 Å²	70	58.5 Å²	58.5	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-61.4	-42	173.1	0	0	0	0	0	112.6	T102 Q103 L108 G109	T102-A106 VanDerWaalsContact O-CB 3.29Å; T102-A106 WeakPolarHBondContact O-CB 3.46Å; T102-A106 PolarHBondContact O-N 2.98Å; Q103-A106 PolarHBondContact O-N 3.47Å; A106-L108 PolarHBondContact O-N 3.05Å; A106-G109 PolarHBondContact O-N 3.43Å
107	N	67.9	Low	75	Confident	108 Å²	108	56.9 Å²	56.9	58%	0.578	34%	0.343	S	S	*	.	H	α-helix	trans	-66.9	-22.8	175.8	-76	11.7	0	0	0	113.3	Q103 C104 V105	Q103-N107 WeakPolarHBondContact O-CB 3.33Å; Q103-N107 PolarHBondContact O-N 2.84Å; Q103-N107 PolarHBondContact O-OD1 3.19Å; C104-N107 PolarHBondContact O-N 3.19Å; V105-N107 PolarHBondContact O-N 3.01Å
108	L	66.4	Low	74.1	Confident	79 Å²	79	65.7 Å²	65.7	41%	0.414	38%	0.384	S	S	.	.	H	α-helix	trans	-91.1	-6.4	175.8	-69.5	168.6	0	0	0	113.3	C104 V105 A106 V110	C104-L108 VanDerWaalsContact O-CG 3.29Å; C104-L108 WeakPolarHBondContact O-CG 3.44Å; C104-L108 PolarHBondContact O-N 3.47Å; C104-L108 VanDerWaalsContact O-N 3.11Å; V105-L108 CarbonylContact O-C 3.55Å; V105-L108 PolarHBondContact O-N 2.99Å; V105-L108 VanDerWaalsContact O-N 3.14Å; A106-L108 PolarHBondContact O-N 3.05Å; L108-V110 HydrophobicContact CB-CG2 4.09Å; L108-V110 PolarHBondContact O-N 2.94Å
109	G	66.3	Low	72.9	Confident	71 Å²	71	69.2 Å²	69.2	73%	0.732	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	13.7	-177.2	0	0	0	0	0	114.9	V105 A106	V105-G109 PolarHBondContact O-N 3.25Å; V105-G109 VanDerWaalsContact O-N 3.11Å; A106-G109 PolarHBondContact O-N 3.43Å
110	V	74.1	Confident	71.3	Confident	46 Å²	46	70.9 Å²	70.9	28%	0.279	42%	0.42	S	S	.	.			trans	-89.6	151.7	-174.6	165.1	0	0	0	0	110.3	V105 L108 L132 D133	V105-V110 HydrophobicContact CG1-CB 3.82Å; V105-V110 HydrophobicContact CG1-CG1 3.81Å; V105-V110 WeakPolarHBondContact CG1-O 3.36Å; V105-V110 PolarHBondContact O-N 3.21Å; V105-V110 VanDerWaalsContact O-N 3.13Å; L108-V110 HydrophobicContact CB-CG2 4.09Å; L108-V110 PolarHBondContact O-N 2.94Å; V110-L132 HydrophobicContact CG1-CB 4.11Å; V110-L132 HydrophobicContact CG1-CD2 4.33Å; V110-D133 WeakPolarHBondContact CA-OD2 3.41Å; V110-D133 HydrophobicContact CG1-CB 4.31Å; V110-D133 WeakPolarHBondContact CG2-OD2 3.5Å
111	S	72.4	Confident	70.1	Confident	66 Å²	66	71.2 Å²	71.2	46%	0.462	43%	0.434	S	S	.	.			trans	-87.6	138.9	171.6	68.5	0	0	0	0	112	L132 D133	S111-L132 WeakPolarHBondContact O-CA 3.48Å; S111-D133 WeakPolarHBondContact CA-OD1 3.47Å; S111-D133 VanDerWaalsContact CB-OD1 3.27Å; S111-D133 WeakPolarHBondContact CB-OD1 3.46Å; S111-D133 PolarHBondContact N-OD1 3Å; S111-D133 PolarHBondContact O-N 3.49Å; S111-D133 PolarHBondContact OG-OD1 3.46Å
112	L	81	Confident	69	Low	41 Å²	41	77.9 Å²	77.9	22%	0.215	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	118.8	178.5	170.4	61.1	0	0	0	110.8	L101 V105 F114 A130 E131 L132	L101-L112 HydrophobicContact CD2-CD1 3.98Å; L101-L112 HydrophobicContact CD2-CD2 4.05Å; L101-L112 HydrophobicContact CG-CD2 4.02Å; V105-L112 HydrophobicContact CB-CB 4.47Å; V105-L112 HydrophobicContact CG1-CB 3.79Å; L112-F114 HydrophobicContact CD1-CD2 4.24Å; L112-F114 HydrophobicContact CD1-CE2 3.86Å; L112-F114 HydrophobicContact CD1-CZ 4.19Å; L112-F114 HydrophobicContact CD2-CE2 3.78Å; L112-F114 HydrophobicContact CD2-CZ 4.29Å; L112-F114 HydrophobicContact CG-CD2 4.28Å; L112-F114 HydrophobicContact CG-CE2 3.84Å; L112-A130 HydrophobicContact CD1-CB 4.15Å; L112-E131 WeakPolarHBondContact CA-O 3.29Å; L112-L132 HydrophobicContact CB-CD2 4.26Å; L112-L132 HydrophobicContact CD1-CD2 3.72Å
113	T	82	Confident	67.9	Low	64 Å²	64	80.8 Å²	80.8	39%	0.393	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	154.9	167.5	53.7	0	0	0	0	110.2	A130 E131	T113-A130 WeakPolarHBondContact O-CA 3.34Å; T113-E131 PolarHBondContact N-O 3.32Å; T113-E131 VanDerWaalsContact N-O 3.09Å; T113-E131 PolarHBondContact O-N 3.07Å
114	F	81.6	Confident	66.9	Low	46 Å²	46	80.6 Å²	80.6	20%	0.202	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.6	172.4	-73	-93.7	0	0	0	108	V98 L101 L112 V128 C129 A130 K149 A152 A153	V98-F114 HydrophobicContact CG1-CE2 4.48Å; V98-F114 HydrophobicContact CG1-CZ 4.23Å; L101-F114 HydrophobicContact CD2-CZ 4.11Å; L112-F114 HydrophobicContact CD1-CD2 4.24Å; L112-F114 HydrophobicContact CD1-CE2 3.86Å; L112-F114 HydrophobicContact CD1-CZ 4.19Å; L112-F114 HydrophobicContact CD2-CE2 3.78Å; L112-F114 HydrophobicContact CD2-CZ 4.29Å; L112-F114 HydrophobicContact CG-CD2 4.28Å; L112-F114 HydrophobicContact CG-CE2 3.84Å; F114-V128 HydrophobicContact CB-CG1 4.15Å; F114-V128 HydrophobicContact CD1-CG1 3.95Å; F114-C129 WeakPolarHBondContact CA-O 3.31Å; F114-A130 HydrophobicContact CD1-CB 3.98Å; F114-A130 HydrophobicContact CE1-CB 3.87Å; F114-K149 HydrophobicContact CD1-CD 4.3Å; F114-K149 HydrophobicContact CD1-CG 3.74Å; F114-K149 HydrophobicContact CD2-CD 4.49Å; F114-K149 HydrophobicContact CE1-CG 3.75Å; F114-K149 HydrophobicContact CG-CD 4.25Å; F114-K149 HydrophobicContact CG-CG 4.19Å; F114-K149 HydrophobicContact CZ-CG 4.23Å; F114-A152 HydrophobicContact CE1-CB 4.38Å; F114-A153 HydrophobicContact CE1-CB 4.34Å; F114-A153 HydrophobicContact CZ-CB 4.3Å
115	L	80.3	Confident	66.6	Low	79 Å²	79	83.6 Å²	83.6	41%	0.414	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.3	179.9	-55	179.1	0	0	0	109.3	V128 C129 E131	L115-V128 WeakPolarHBondContact O-CA 3.42Å; L115-C129 PolarHBondContact N-O 3.07Å; L115-C129 PolarHBondContact O-N 3.01Å; L115-E131 WeakPolarHBondContact CD1-OE2 3.37Å
116	E	77.2	Confident	66.5	Low	105 Å²	105	87.5 Å²	87.5	49%	0.491	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.5	170.7	-62.5	-171.8	168.1	0	0	109	V128 K145	E116-V128 HydrophobicContact CG-CG2 4.42Å; E116-K145 VanDerWaalsContact OE1-CD 3.3Å; E116-K145 WeakPolarHBondContact OE1-CD 3.01Å; E116-K145 VanDerWaalsContact OE1-CE 3.25Å; E116-K145 WeakPolarHBondContact OE1-CE 3.17Å; E116-K145 IonicContact OE1-NZ 3.9Å; E116-K145 PolarHBondContact OE1-NZ 2.86Å; E116-K145 WeakPolarHBondContact OE2-CE 3.47Å; E116-K145 IonicContact OE2-NZ 2.73Å; E116-K145 PolarHBondContact OE2-NZ 3.06Å
117	D	64.2	Low	66.9	Low	75 Å²	75	85.5 Å²	85.5	40%	0.401	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.5	177.3	-174.5	-15.7	0	0	0	109.1	T119 S127	D117-T119 VanDerWaalsContact C-N 3.29Å; D117-T119 PolarHBondContact O-N 3.18Å; D117-T119 WeakPolarHBondContact OD1-CB 3.45Å; D117-T119 WeakPolarHBondContact OD1-CG2 3.48Å; D117-T119 PolarHBondContact OD1-N 3.37Å; D117-T119 PolarHBondContact OD1-OG1 2.79Å; D117-T119 PolarHBondContact OD2-OG1 3.38Å; D117-S127 PolarHBondContact N-O 2.84Å
118	Q	57.6	Low	67.5	Low	186 Å²	186	80.6 Å²	80.6	87%	0.869	50%	0.495	S	S	*	.			trans	-89.2	16.9	-175.8	-71	-170.9	78.8	0	0	113.8	A120	Q118-A120 PolarHBondContact O-N 2.99Å
119	T	52.4	Low	68.3	Low	106 Å²	106	77.6 Å²	77.6	65%	0.65	48%	0.48	S	S	*	.			trans	-70.6	76.8	168.2	49.2	0	0	0	0	111.9	D117 G121	D117-T119 VanDerWaalsContact C-N 3.29Å; D117-T119 PolarHBondContact O-N 3.18Å; D117-T119 WeakPolarHBondContact OD1-CB 3.45Å; D117-T119 WeakPolarHBondContact OD1-CG2 3.48Å; D117-T119 PolarHBondContact OD1-N 3.37Å; D117-T119 PolarHBondContact OD1-OG1 2.79Å; D117-T119 PolarHBondContact OD2-OG1 3.38Å; T119-G121 PolarHBondContact O-N 2.89Å
120	A	45.3	Very low	69.1	Low	101 Å²	101	74.2 Å²	74.2	84%	0.835	45%	0.446	S	S	*	.			trans	-65	103.5	-179.3	0	0	0	0	0	112.6	Q118	Q118-A120 PolarHBondContact O-N 2.99Å
121	G	53.1	Low	69.3	Low	51 Å²	51	74.5 Å²	74.5	53%	0.526	44%	0.444	S	S	.	.			trans	-78.1	171.9	166.5	0	0	0	0	0	112.9	T119 D123	T119-G121 PolarHBondContact O-N 2.89Å; G121-D123 VanDerWaalsContact C-N 3.32Å; G121-D123 PolarHBondContact O-N 2.64Å
122	P	54.6	Low	69.6	Low	140 Å²	140	72.2 Å²	72.2	91%	0.909	43%	0.426	S	S	*	.	S	Bend	trans	-71.3	-21.5	-175.1	-19.8	33.9	0	0	0	115.2
123	D	54.6	Low	68.9	Low	133 Å²	133	74.9 Å²	74.9	71%	0.711	44%	0.441	S	S	*	.	S	Bend	trans	-92.7	148.1	178.5	-69	-54.5	0	0	0	111.5	G121 S125	G121-D123 VanDerWaalsContact C-N 3.32Å; G121-D123 PolarHBondContact O-N 2.64Å; D123-S125 PolarHBondContact O-N 2.78Å
124	S	55.9	Low	68.1	Low	115 Å²	115	74.4 Å²	74.4	80%	0.804	45%	0.449	S	S	*	.	S	Bend	trans	-76.7	52.1	-174.7	48.2	0	0	0	0	114.4
125	S	65.3	Low	67.6	Low	69 Å²	69	75.7 Å²	75.7	48%	0.483	46%	0.457	S	S	.	.			trans	-105	133	173.2	58	0	0	0	0	112	D123 G142	D123-S125 PolarHBondContact O-N 2.78Å; S125-G142 CarbonylContact C-O 3.58Å; S125-G142 WeakPolarHBondContact CA-O 3.26Å
126	F	73.3	Confident	67.5	Low	87 Å²	87	75.9 Å²	75.9	38%	0.382	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	144.5	169.2	-59.4	-89.1	0	0	0	110	T141 G142 S144 K145 A148	F126-T141 VanDerWaalsContact O-CA 3.32Å; F126-T141 WeakPolarHBondContact O-CA 3.4Å; F126-G142 PolarHBondContact N-O 2.77Å; F126-G142 PolarHBondContact O-N 3Å; F126-S144 VanDerWaalsContact CD2-C 3.49Å; F126-K145 HydrophobicContact CB-CG 4.29Å; F126-K145 HydrophobicContact CD1-CD 4.22Å; F126-K145 HydrophobicContact CD1-CG 3.39Å; F126-K145 HydrophobicContact CD2-CG 4.28Å; F126-K145 HydrophobicContact CE1-CD 4.21Å; F126-K145 HydrophobicContact CE1-CG 3.68Å; F126-K145 HydrophobicContact CG-CG 3.71Å; F126-K145 HydrophobicContact CZ-CG 4.24Å; F126-A148 HydrophobicContact CB-CB 4.06Å; F126-A148 WeakPolarHBondContact O-CB 3.39Å
127	S	80	Confident	67.6	Low	27 Å²	27	71 Å²	71	19%	0.189	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.9	173.3	-175.8	0	0	0	0	109.7	D117	D117-S127 PolarHBondContact N-O 2.84Å
128	V	81.2	Confident	68.3	Low	6 Å²	6	70.9 Å²	70.9	4%	0.036	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	133.9	179.3	178.1	0	0	0	0	108.5	F114 L115 E116 A139 G140 A148 K149 A152	F114-V128 HydrophobicContact CB-CG1 4.15Å; F114-V128 HydrophobicContact CD1-CG1 3.95Å; L115-V128 WeakPolarHBondContact O-CA 3.42Å; E116-V128 HydrophobicContact CG-CG2 4.42Å; V128-A139 CarbonylContact O-C 3.51Å; V128-A139 VanDerWaalsContact O-CA 3.3Å; V128-A139 WeakPolarHBondContact O-CA 3.32Å; V128-G140 PolarHBondContact N-O 3.03Å; V128-G140 PolarHBondContact O-N 3.11Å; V128-A148 HydrophobicContact CB-CB 4.2Å; V128-A148 HydrophobicContact CG2-CB 3.73Å; V128-K149 HydrophobicContact CG1-CB 4.33Å; V128-A152 HydrophobicContact CB-CB 4.35Å; V128-A152 HydrophobicContact CG1-CB 4.22Å; V128-A152 VanDerWaalsContact O-CB 3.23Å; V128-A152 WeakPolarHBondContact O-CB 3.39Å
129	C	81.6	Confident	69.3	Low	16 Å²	16	64.3 Å²	64.3	11%	0.108	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	157.9	167	61.3	0	0	0	0	110.8	F114 L115 V136 A139	F114-C129 WeakPolarHBondContact CA-O 3.31Å; L115-C129 PolarHBondContact N-O 3.07Å; L115-C129 PolarHBondContact O-N 3.01Å; C129-V136 HydrophobicContact CB-CG1 3.95Å; C129-A139 HydrophobicContact CB-CB 4.16Å
130	A	83.1	Confident	70.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.9	173.6	0	0	0	0	0	108.5	L112 T113 F114 C137 A156	L112-A130 HydrophobicContact CD1-CB 4.15Å; T113-A130 WeakPolarHBondContact O-CA 3.34Å; F114-A130 HydrophobicContact CD1-CB 3.98Å; F114-A130 HydrophobicContact CE1-CB 3.87Å; A130-C137 VanDerWaalsContact O-CB 3.32Å; A130-C137 WeakPolarHBondContact O-CB 3.41Å; A130-C137 PolarHBondContact O-N 2.83Å; A130-A156 HydrophobicContact CB-CB 4.1Å
131	E	79.5	Confident	72.4	Confident	52 Å²	52	58.8 Å²	58.8	24%	0.243	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136	176.7	-177.7	-169.5	137.8	0	0	109.3	L112 T113 L115 G134 L135 V136	L112-E131 WeakPolarHBondContact CA-O 3.29Å; T113-E131 PolarHBondContact N-O 3.32Å; T113-E131 VanDerWaalsContact N-O 3.09Å; T113-E131 PolarHBondContact O-N 3.07Å; L115-E131 WeakPolarHBondContact CD1-OE2 3.37Å; E131-G134 WeakPolarHBondContact OE1-CA 3.26Å; E131-L135 WeakPolarHBondContact CA-O 3.47Å; E131-V136 HydrophobicContact CB-CG2 4.42Å; E131-V136 HydrophobicContact CG-CG2 4.18Å
132	L	77.3	Confident	73.6	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.094	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	103.4	-174.9	-63	176.4	0	0	0	108.8	V105 V110 S111 L112 G134 L135 I160	V105-L132 HydrophobicContact CG1-CD2 4.32Å; V105-L132 HydrophobicContact CG2-CD2 3.54Å; V110-L132 HydrophobicContact CG1-CB 4.11Å; V110-L132 HydrophobicContact CG1-CD2 4.33Å; S111-L132 WeakPolarHBondContact O-CA 3.48Å; L112-L132 HydrophobicContact CB-CD2 4.26Å; L112-L132 HydrophobicContact CD1-CD2 3.72Å; L132-G134 VanDerWaalsContact C-N 3.29Å; L132-G134 PolarHBondContact O-N 3.2Å; L132-L135 PolarHBondContact N-O 2.83Å; L132-L135 WeakPolarHBondContact O-CB 3.45Å; L132-L135 PolarHBondContact O-N 3.39Å; L132-I160 HydrophobicContact CD1-CD1 3.74Å; L132-I160 HydrophobicContact CD1-CG1 3.86Å
133	D	68.1	Low	74.7	Confident	97 Å²	97	60.4 Å²	60.4	52%	0.519	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	50.7	-173.1	-71.7	-17.7	0	0	0	113.7	V110 S111 L135	V110-D133 WeakPolarHBondContact CA-OD2 3.41Å; V110-D133 HydrophobicContact CG1-CB 4.31Å; V110-D133 WeakPolarHBondContact CG2-OD2 3.5Å; S111-D133 WeakPolarHBondContact CA-OD1 3.47Å; S111-D133 VanDerWaalsContact CB-OD1 3.27Å; S111-D133 WeakPolarHBondContact CB-OD1 3.46Å; S111-D133 PolarHBondContact N-OD1 3Å; S111-D133 PolarHBondContact O-N 3.49Å; S111-D133 PolarHBondContact OG-OD1 3.46Å; D133-L135 VanDerWaalsContact C-N 3.29Å; D133-L135 PolarHBondContact O-N 2.85Å
134	G	63.8	Low	75.8	Confident	54 Å²	54	56.1 Å²	56.1	56%	0.557	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-5.3	-178.8	0	0	0	0	0	115.4	E131 L132	E131-G134 WeakPolarHBondContact OE1-CA 3.26Å; L132-G134 VanDerWaalsContact C-N 3.29Å; L132-G134 PolarHBondContact O-N 3.2Å
135	L	71.9	Confident	76.9	Confident	73 Å²	73	55.2 Å²	55.2	38%	0.382	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	110.1	174.7	-166.8	155.8	0	0	0	110.8	E131 L132 D133 C137 Y159	E131-L135 WeakPolarHBondContact CA-O 3.47Å; L132-L135 PolarHBondContact N-O 2.83Å; L132-L135 WeakPolarHBondContact O-CB 3.45Å; L132-L135 PolarHBondContact O-N 3.39Å; D133-L135 VanDerWaalsContact C-N 3.29Å; D133-L135 PolarHBondContact O-N 2.85Å; L135-C137 PolarHBondContact O-N 3Å; L135-Y159 HydrophobicContact CD1-CE1 4.17Å; L135-Y159 HydrophobicContact CD2-CD1 4.17Å; L135-Y159 HydrophobicContact CD2-CE1 3.4Å; L135-Y159 VanDerWaalsContact CD2-CE1 3.4Å; L135-Y159 HydrophobicContact CG-CE1 4.46Å
136	V	78.1	Confident	77.5	Confident	83 Å²	83	58.2 Å²	58.2	50%	0.503	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119	177.2	-175.7	0	0	0	0	110.8	C129 E131	C129-V136 HydrophobicContact CB-CG1 3.95Å; E131-V136 HydrophobicContact CB-CG2 4.42Å; E131-V136 HydrophobicContact CG-CG2 4.18Å
137	C	78.5	Confident	77.8	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.02	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-81.6	159.8	174.6	-67.8	0	0	0	0	112.1	A130 L135 A139 A156	A130-C137 VanDerWaalsContact O-CB 3.32Å; A130-C137 WeakPolarHBondContact O-CB 3.41Å; A130-C137 PolarHBondContact O-N 2.83Å; L135-C137 PolarHBondContact O-N 3Å; C137-A139 PolarHBondContact O-N 3.15Å; C137-A156 HydrophobicContact CB-CB 3.95Å
138	P	78.4	Confident	77.8	Confident	71 Å²	71	57 Å²	57	46%	0.461	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-55.2	133.3	177.9	-24.8	34.5	0	0	0	112.7	S155 Y159	P138-S155 VanDerWaalsContact O-CB 3.25Å; P138-S155 WeakPolarHBondContact O-CB 3.3Å; P138-Y159 HydrophobicContact CG-CD2 4.46Å
139	A	80.3	Confident	77.9	Confident	48 Å²	48	60.6 Å²	60.6	40%	0.397	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-64.4	145.3	-177	0	0	0	0	0	112.8	V128 C129 C137	V128-A139 CarbonylContact O-C 3.51Å; V128-A139 VanDerWaalsContact O-CA 3.3Å; V128-A139 WeakPolarHBondContact O-CA 3.32Å; C129-A139 HydrophobicContact CB-CB 4.16Å; C137-A139 PolarHBondContact O-N 3.15Å
140	G	81.9	Confident	78	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.9	167.3	0	0	0	0	0	110.8	V128	V128-G140 PolarHBondContact N-O 3.03Å; V128-G140 PolarHBondContact O-N 3.11Å
141	T	79.9	Confident	77.9	Confident	90 Å²	90	65 Å²	65	55%	0.552	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.7	175.9	52.8	0	0	0	0	111	F126	F126-T141 VanDerWaalsContact O-CA 3.32Å; F126-T141 WeakPolarHBondContact O-CA 3.4Å
142	G	78.9	Confident	78.2	Confident	8 Å²	8	62.5 Å²	62.5	8%	0.082	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	162.7	179.5	0	0	0	0	0	112.7	S125 F126 S144	S125-G142 CarbonylContact C-O 3.58Å; S125-G142 WeakPolarHBondContact CA-O 3.26Å; F126-G142 PolarHBondContact N-O 2.77Å; F126-G142 PolarHBondContact O-N 3Å; G142-S144 PolarHBondContact O-N 3.49Å
143	R	76.4	Confident	78.4	Confident	217 Å²	217	61.7 Å²	61.7	82%	0.819	33%	0.331	S	S	*	.	S	Bend	trans	-77.3	-6.3	177.4	-62.7	177.4	176.3	177.2	-1.4	112.8	E147	R143-E147 WeakPolarHBondContact CA-OE2 3.33Å; R143-E147 WeakPolarHBondContact CB-OE2 3.22Å; R143-E147 PolarHBondContact N-OE2 3.23Å
144	S	79.5	Confident	79	Confident	43 Å²	43	58 Å²	58	30%	0.301	31%	0.311	S	S	.	.	S	Bend	trans	-137.3	155.4	168.1	69.3	0	0	0	0	111.1	F126 G142 M146 E147 A148	F126-S144 VanDerWaalsContact CD2-C 3.49Å; G142-S144 PolarHBondContact O-N 3.49Å; S144-M146 PolarHBondContact O-N 2.94Å; S144-E147 PolarHBondContact N-OE2 3.06Å; S144-E147 PolarHBondContact O-N 3.43Å; S144-E147 VanDerWaalsContact O-N 3.16Å; S144-E147 VanDerWaalsContact OG-CB 3.3Å; S144-E147 WeakPolarHBondContact OG-CB 3.45Å; S144-E147 PolarHBondContact OG-N 2.97Å; S144-E147 VanDerWaalsContact OG-N 3.16Å; S144-A148 PolarHBondContact O-N 2.94Å
145	K	77.5	Confident	79.8	Confident	97 Å²	97	56.6 Å²	56.6	42%	0.422	29%	0.293	S	S	.	.	H	α-helix	trans	-54.3	-35.4	173.1	-68.4	-174.8	162.4	-148.9	0	113	E116 F126 K149	E116-K145 VanDerWaalsContact OE1-CD 3.3Å; E116-K145 WeakPolarHBondContact OE1-CD 3.01Å; E116-K145 VanDerWaalsContact OE1-CE 3.25Å; E116-K145 WeakPolarHBondContact OE1-CE 3.17Å; E116-K145 IonicContact OE1-NZ 3.9Å; E116-K145 PolarHBondContact OE1-NZ 2.86Å; E116-K145 WeakPolarHBondContact OE2-CE 3.47Å; E116-K145 IonicContact OE2-NZ 2.73Å; E116-K145 PolarHBondContact OE2-NZ 3.06Å; F126-K145 HydrophobicContact CB-CG 4.29Å; F126-K145 HydrophobicContact CD1-CD 4.22Å; F126-K145 HydrophobicContact CD1-CG 3.39Å; F126-K145 HydrophobicContact CD2-CG 4.28Å; F126-K145 HydrophobicContact CE1-CD 4.21Å; F126-K145 HydrophobicContact CE1-CG 3.68Å; F126-K145 HydrophobicContact CG-CG 3.71Å; F126-K145 HydrophobicContact CZ-CG 4.24Å; K145-K149 VanDerWaalsContact O-CB 3.28Å; K145-K149 WeakPolarHBondContact O-CB 3.47Å; K145-K149 PolarHBondContact O-N 2.92Å
146	M	78.4	Confident	80.2	Confident	132 Å²	132	53.1 Å²	53.1	65%	0.65	28%	0.275	S	S	*	.	H	α-helix	trans	-68.8	-44.6	178.1	-176.3	172.8	67.6	0	0	111.9	S144 K149 Q150	S144-M146 PolarHBondContact O-N 2.94Å; M146-K149 PolarHBondContact O-N 2.99Å; M146-Q150 VanDerWaalsContact O-CG 3.28Å; M146-Q150 WeakPolarHBondContact O-CG 3.37Å; M146-Q150 PolarHBondContact O-N 3.02Å
147	E	79.1	Confident	80.1	Confident	88 Å²	88	50.3 Å²	50.3	41%	0.411	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-45.1	177.3	-176.1	-179.8	-153.2	0	0	111.6	R143 S144 K149 Q150 Q151	R143-E147 WeakPolarHBondContact CA-OE2 3.33Å; R143-E147 WeakPolarHBondContact CB-OE2 3.22Å; R143-E147 PolarHBondContact N-OE2 3.23Å; S144-E147 PolarHBondContact N-OE2 3.06Å; S144-E147 PolarHBondContact O-N 3.43Å; S144-E147 VanDerWaalsContact O-N 3.16Å; S144-E147 VanDerWaalsContact OG-CB 3.3Å; S144-E147 WeakPolarHBondContact OG-CB 3.45Å; S144-E147 PolarHBondContact OG-N 2.97Å; S144-E147 VanDerWaalsContact OG-N 3.16Å; E147-K149 VanDerWaalsContact C-N 3.33Å; E147-K149 PolarHBondContact O-N 2.84Å; E147-Q150 WeakPolarHBondContact O-CB 3.34Å; E147-Q150 PolarHBondContact O-N 3.16Å; E147-Q150 VanDerWaalsContact O-N 3.16Å; E147-Q151 PolarHBondContact O-N 2.52Å
148	A	80.9	Confident	80.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-44.7	174.5	0	0	0	0	0	111.7	F126 V128 S144 Q150 Q151 A152	F126-A148 HydrophobicContact CB-CB 4.06Å; F126-A148 WeakPolarHBondContact O-CB 3.39Å; V128-A148 HydrophobicContact CB-CB 4.2Å; V128-A148 HydrophobicContact CG2-CB 3.73Å; S144-A148 PolarHBondContact O-N 2.94Å; A148-Q150 PolarHBondContact O-N 3.49Å; A148-Q151 PolarHBondContact O-N 2.95Å; A148-A152 WeakPolarHBondContact O-CB 3.45Å; A148-A152 PolarHBondContact O-N 2.84Å
149	K	81.9	Confident	80	Confident	82 Å²	82	55.8 Å²	55.8	36%	0.357	27%	0.273	S	S	.	.	H	α-helix	trans	-64.3	-37	175.5	-175.8	169.4	-178.6	166.7	0	113.3	V98 F114 V128 K145 M146 E147 A153	V98-K149 HydrophobicContact CG2-CG 4.45Å; F114-K149 HydrophobicContact CD1-CD 4.3Å; F114-K149 HydrophobicContact CD1-CG 3.74Å; F114-K149 HydrophobicContact CD2-CD 4.49Å; F114-K149 HydrophobicContact CE1-CG 3.75Å; F114-K149 HydrophobicContact CG-CD 4.25Å; F114-K149 HydrophobicContact CG-CG 4.19Å; F114-K149 HydrophobicContact CZ-CG 4.23Å; V128-K149 HydrophobicContact CG1-CB 4.33Å; K145-K149 VanDerWaalsContact O-CB 3.28Å; K145-K149 WeakPolarHBondContact O-CB 3.47Å; K145-K149 PolarHBondContact O-N 2.92Å; M146-K149 PolarHBondContact O-N 2.99Å; E147-K149 VanDerWaalsContact C-N 3.33Å; E147-K149 PolarHBondContact O-N 2.84Å; K149-A153 PolarHBondContact O-N 3.3Å; K149-A153 VanDerWaalsContact O-N 3.09Å
150	Q	85.3	Confident	79.6	Confident	27 Å²	27	54.7 Å²	54.7	13%	0.126	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-44.1	173.9	-74.5	173.4	11.6	0	0	111.6	P94 V98 M146 E147 A148 A153 L154	P94-Q150 HydrophobicContact CB-CB 3.95Å; P94-Q150 WeakPolarHBondContact O-CB 3.33Å; P94-Q150 VanDerWaalsContact O-CG 3.26Å; P94-Q150 WeakPolarHBondContact O-CG 3.48Å; V98-Q150 HydrophobicContact CG2-CB 4.39Å; V98-Q150 HydrophobicContact CG2-CG 3.87Å; M146-Q150 VanDerWaalsContact O-CG 3.28Å; M146-Q150 WeakPolarHBondContact O-CG 3.37Å; M146-Q150 PolarHBondContact O-N 3.02Å; E147-Q150 WeakPolarHBondContact O-CB 3.34Å; E147-Q150 PolarHBondContact O-N 3.16Å; E147-Q150 VanDerWaalsContact O-N 3.16Å; A148-Q150 PolarHBondContact O-N 3.49Å; Q150-A153 PolarHBondContact O-N 3.44Å; Q150-L154 PolarHBondContact O-N 3.28Å; Q150-L154 VanDerWaalsContact O-N 3.12Å
151	Q	81.1	Confident	79.2	Confident	81 Å²	81	58.1 Å²	58.1	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-66.9	-36.8	177	-168.4	58.7	37.7	0	0	112	E147 A148 A153 L154 S155	E147-Q151 PolarHBondContact O-N 2.52Å; A148-Q151 PolarHBondContact O-N 2.95Å; Q151-A153 VanDerWaalsContact C-N 3.31Å; Q151-A153 PolarHBondContact O-N 3Å; Q151-L154 PolarHBondContact O-N 3.03Å; Q151-S155 PolarHBondContact O-N 3.13Å; Q151-S155 PolarHBondContact O-OG 3.19Å
152	A	84.6	Confident	78.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-39.2	173.8	0	0	0	0	0	111.8	F114 V128 A148 S155 A156	F114-A152 HydrophobicContact CE1-CB 4.38Å; V128-A152 HydrophobicContact CB-CB 4.35Å; V128-A152 HydrophobicContact CG1-CB 4.22Å; V128-A152 VanDerWaalsContact O-CB 3.23Å; V128-A152 WeakPolarHBondContact O-CB 3.39Å; A148-A152 WeakPolarHBondContact O-CB 3.45Å; A148-A152 PolarHBondContact O-N 2.84Å; A152-S155 PolarHBondContact O-N 3.13Å; A152-A156 WeakPolarHBondContact O-CB 3.42Å; A152-A156 PolarHBondContact O-N 3.01Å
153	A	81.7	Confident	77.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.9	-36.4	177	0	0	0	0	0	112.9	A97 V98 L101 F114 K149 Q150 Q151 A156 L157	A97-A153 HydrophobicContact CB-CB 4.15Å; V98-A153 HydrophobicContact CB-CB 4.36Å; V98-A153 HydrophobicContact CG2-CB 3.88Å; L101-A153 HydrophobicContact CB-CB 4.33Å; L101-A153 HydrophobicContact CD2-CB 3.94Å; F114-A153 HydrophobicContact CE1-CB 4.34Å; F114-A153 HydrophobicContact CZ-CB 4.3Å; K149-A153 PolarHBondContact O-N 3.3Å; K149-A153 VanDerWaalsContact O-N 3.09Å; Q150-A153 PolarHBondContact O-N 3.44Å; Q151-A153 VanDerWaalsContact C-N 3.31Å; Q151-A153 PolarHBondContact O-N 3Å; A153-A156 PolarHBondContact O-N 3.48Å; A153-L157 WeakPolarHBondContact O-CG 3.45Å; A153-L157 PolarHBondContact O-N 3.36Å
154	L	81.6	Confident	76.9	Confident	20 Å²	20	58.9 Å²	58.9	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-48.2	170.5	-73.8	173.6	0	0	0	111.7	P92 P94 A97 Q150 Q151 A156 L157 Q158	P92-L154 HydrophobicContact CG-CD2 3.82Å; P94-L154 HydrophobicContact CB-CD1 4.11Å; P94-L154 HydrophobicContact CG-CD1 3.95Å; A97-L154 HydrophobicContact CB-CD2 3.52Å; A97-L154 HydrophobicContact CB-CG 3.6Å; Q150-L154 PolarHBondContact O-N 3.28Å; Q150-L154 VanDerWaalsContact O-N 3.12Å; Q151-L154 PolarHBondContact O-N 3.03Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 3.09Å; L154-L157 PolarHBondContact O-N 3.43Å; L154-Q158 WeakPolarHBondContact O-CG 3.33Å; L154-Q158 PolarHBondContact O-N 3.46Å
155	S	80.3	Confident	75.7	Confident	25 Å²	25	62.7 Å²	62.7	18%	0.175	29%	0.29	C	S	.	.	H	α-helix	trans	-57.2	-42.8	177	-64	0	0	0	0	112.1	P138 Q151 A152 Y159	P138-S155 VanDerWaalsContact O-CB 3.25Å; P138-S155 WeakPolarHBondContact O-CB 3.3Å; Q151-S155 PolarHBondContact O-N 3.13Å; Q151-S155 PolarHBondContact O-OG 3.19Å; A152-S155 PolarHBondContact O-N 3.13Å; S155-Y159 WeakPolarHBondContact O-CB 3.07Å; S155-Y159 PolarHBondContact O-N 3.02Å
156	A	79.2	Confident	74.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-43.8	177	0	0	0	0	0	112.8	L101 A130 C137 A152 A153 L154 Q158 Y159 I160	L101-A156 HydrophobicContact CD1-CB 4.03Å; L101-A156 HydrophobicContact CD2-CB 3.79Å; A130-A156 HydrophobicContact CB-CB 4.1Å; C137-A156 HydrophobicContact CB-CB 3.95Å; A152-A156 WeakPolarHBondContact O-CB 3.42Å; A152-A156 PolarHBondContact O-N 3.01Å; A153-A156 PolarHBondContact O-N 3.48Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 3.09Å; A156-Q158 PolarHBondContact O-N 3.37Å; A156-Y159 WeakPolarHBondContact O-CB 3.25Å; A156-Y159 PolarHBondContact O-N 3.48Å; A156-Y159 VanDerWaalsContact O-N 3.15Å; A156-I160 WeakPolarHBondContact O-CG1 3.08Å; A156-I160 PolarHBondContact O-N 3.32Å
157	L	77.7	Confident	72.3	Confident	23 Å²	23	64 Å²	64	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-43.7	175.5	-78.2	171.1	0	0	0	112.1	P92 A97 L100 L101 C104 A153 L154 Y159 R161	P92-L157 HydrophobicContact CG-CD1 4.45Å; A97-L157 HydrophobicContact CB-CD1 4.39Å; L100-L157 HydrophobicContact CB-CD1 4.2Å; L101-L157 HydrophobicContact CB-CD1 4.36Å; L101-L157 HydrophobicContact CB-CD2 4.19Å; L101-L157 HydrophobicContact CB-CG 4.05Å; L101-L157 HydrophobicContact CD1-CD2 3.97Å; L101-L157 HydrophobicContact CD1-CG 4.06Å; C104-L157 HydrophobicContact CB-CD2 4.39Å; A153-L157 WeakPolarHBondContact O-CG 3.45Å; A153-L157 PolarHBondContact O-N 3.36Å; L154-L157 PolarHBondContact O-N 3.43Å; L157-Y159 VanDerWaalsContact C-N 3.32Å; L157-Y159 PolarHBondContact O-N 3.28Å; L157-R161 WeakPolarHBondContact O-CB 3.43Å; L157-R161 PolarHBondContact O-N 3.32Å
158	Q	78.6	Confident	70.1	Confident	111 Å²	111	68.1 Å²	68.1	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-35.7	175.3	-70.2	-177.5	-7	0	0	112	L154 A156 K162	L154-Q158 WeakPolarHBondContact O-CG 3.33Å; L154-Q158 PolarHBondContact O-N 3.46Å; A156-Q158 PolarHBondContact O-N 3.37Å; Q158-K162 WeakPolarHBondContact O-CB 3.41Å; Q158-K162 PolarHBondContact O-N 3.2Å; Q158-K162 VanDerWaalsContact O-N 3.07Å
159	Y	74.9	Confident	67.9	Low	78 Å²	78	71.4 Å²	71.4	31%	0.306	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-47.8	176.5	-170.8	-88	0	0	0	112.5	L135 P138 S155 A156 L157 R161 K162 H163	L135-Y159 HydrophobicContact CD1-CE1 4.17Å; L135-Y159 HydrophobicContact CD2-CD1 4.17Å; L135-Y159 HydrophobicContact CD2-CE1 3.4Å; L135-Y159 VanDerWaalsContact CD2-CE1 3.4Å; L135-Y159 HydrophobicContact CG-CE1 4.46Å; P138-Y159 HydrophobicContact CG-CD2 4.46Å; S155-Y159 WeakPolarHBondContact O-CB 3.07Å; S155-Y159 PolarHBondContact O-N 3.02Å; A156-Y159 WeakPolarHBondContact O-CB 3.25Å; A156-Y159 PolarHBondContact O-N 3.48Å; A156-Y159 VanDerWaalsContact O-N 3.15Å; L157-Y159 VanDerWaalsContact C-N 3.32Å; L157-Y159 PolarHBondContact O-N 3.28Å; Y159-R161 PolarHBondContact O-N 2.86Å; Y159-K162 PolarHBondContact O-N 3.3Å; Y159-H163 AromaticContact CD1-CD2 3.7Å; Y159-H163 AromaticContact CE1-CD2 3.27Å; Y159-H163 WeakPolarHBondContact CE1-CD2 3.47Å; Y159-H163 AromaticContact CE1-NE2 3.23Å; Y159-H163 WeakPolarHBondContact CE1-NE2 3.4Å; Y159-H163 AromaticContact CE2-NE2 3.88Å; Y159-H163 AromaticContact CZ-CD2 3.67Å; Y159-H163 AromaticContact CZ-NE2 3.13Å; Y159-H163 PolarHBondContact O-CD2 2.85Å; Y159-H163 PolarHBondContact O-N 3.02Å; Y159-H163 PolarHBondContact OH-NE2 3.32Å
160	I	72.3	Confident	65.7	Low	25 Å²	25	73.7 Å²	73.7	13%	0.128	37%	0.373	C	S	.	.	H	α-helix	trans	-57.1	-51.2	174.7	-65.8	163.2	0	0	0	109.9	L101 V105 L132 A156 K162 H163 L164	L101-I160 HydrophobicContact CD1-CD1 3.61Å; V105-I160 HydrophobicContact CG2-CD1 4.47Å; L132-I160 HydrophobicContact CD1-CD1 3.74Å; L132-I160 HydrophobicContact CD1-CG1 3.86Å; A156-I160 WeakPolarHBondContact O-CG1 3.08Å; A156-I160 PolarHBondContact O-N 3.32Å; I160-K162 VanDerWaalsContact C-N 3.31Å; I160-K162 PolarHBondContact O-N 3.35Å; I160-H163 PolarHBondContact O-N 2.98Å; I160-H163 VanDerWaalsContact O-N 3.11Å; I160-L164 HydrophobicContact CG2-CD1 3.81Å; I160-L164 HydrophobicContact CG2-CG 4.3Å; I160-L164 PolarHBondContact O-N 3.24Å
161	R	72.8	Confident	63.1	Low	74 Å²	74	79 Å²	79	28%	0.279	41%	0.408	S	S	.	.	H	α-helix	trans	-53.9	-47.4	179.4	-176.9	179.5	-172	119.2	22.9	112	L157 Y159 H163 L164 E165	L157-R161 WeakPolarHBondContact O-CB 3.43Å; L157-R161 PolarHBondContact O-N 3.32Å; Y159-R161 PolarHBondContact O-N 2.86Å; R161-H163 VanDerWaalsContact C-N 3.26Å; R161-H163 PolarHBondContact O-N 3.27Å; R161-L164 PolarHBondContact O-N 2.91Å; R161-E165 HydrophobicContact CG-CG 4.36Å; R161-E165 WeakPolarHBondContact CG-OE1 3.48Å; R161-E165 IonicContact CZ-OE1 3.35Å; R161-E165 IonicContact NE-OE1 2.76Å; R161-E165 PolarHBondContact NE-OE1 3.41Å; R161-E165 IonicContact NH2-OE1 2.61Å; R161-E165 PolarHBondContact NH2-OE1 3.4Å; R161-E165 WeakPolarHBondContact O-CB 3.43Å; R161-E165 WeakPolarHBondContact O-CG 3.44Å; R161-E165 PolarHBondContact O-N 2.82Å
162	K	69.1	Low	60.8	Low	160 Å²	160	79.1 Å²	79.1	70%	0.696	42%	0.422	S	S	*	.	H	α-helix	trans	-66.7	-22.4	-178	-171.5	174	-177.9	178.1	0	113.9	Q158 Y159 I160 K166	Q158-K162 WeakPolarHBondContact O-CB 3.41Å; Q158-K162 PolarHBondContact O-N 3.2Å; Q158-K162 VanDerWaalsContact O-N 3.07Å; Y159-K162 PolarHBondContact O-N 3.3Å; I160-K162 VanDerWaalsContact C-N 3.31Å; I160-K162 PolarHBondContact O-N 3.35Å; K162-K166 WeakPolarHBondContact O-CB 3.37Å
163	H	62.3	Low	58.2	Low	90 Å²	90	85 Å²	85	42%	0.417	46%	0.46	S	S	.	.	H	α-helix	trans	-88.8	-35.4	172.1	-77.5	-64.6	0	0	0	112.9	Y159 I160 R161 K166 S167	Y159-H163 AromaticContact CD1-CD2 3.7Å; Y159-H163 AromaticContact CE1-CD2 3.27Å; Y159-H163 WeakPolarHBondContact CE1-CD2 3.47Å; Y159-H163 AromaticContact CE1-NE2 3.23Å; Y159-H163 WeakPolarHBondContact CE1-NE2 3.4Å; Y159-H163 AromaticContact CE2-NE2 3.88Å; Y159-H163 AromaticContact CZ-CD2 3.67Å; Y159-H163 AromaticContact CZ-NE2 3.13Å; Y159-H163 PolarHBondContact O-CD2 2.85Å; Y159-H163 PolarHBondContact O-N 3.02Å; Y159-H163 PolarHBondContact OH-NE2 3.32Å; I160-H163 PolarHBondContact O-N 2.98Å; I160-H163 VanDerWaalsContact O-N 3.11Å; R161-H163 VanDerWaalsContact C-N 3.26Å; R161-H163 PolarHBondContact O-N 3.27Å; H163-K166 CarbonylContact O-C 3.52Å; H163-K166 WeakPolarHBondContact O-CA 3.24Å; H163-K166 WeakPolarHBondContact O-CB 3.46Å; H163-K166 PolarHBondContact O-N 3.23Å; H163-S167 PolarHBondContact O-N 3.28Å; H163-S167 VanDerWaalsContact O-N 3.08Å
164	L	56.3	Low	55.7	Low	81 Å²	81	96.3 Å²	96.3	42%	0.424	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-47.5	171.5	-70.4	172.6	0	0	0	111.2	L85 I160 R161 K166 S167	L85-L164 HydrophobicContact CD1-CD1 4.14Å; I160-L164 HydrophobicContact CG2-CD1 3.81Å; I160-L164 HydrophobicContact CG2-CG 4.3Å; I160-L164 PolarHBondContact O-N 3.24Å; R161-L164 PolarHBondContact O-N 2.91Å; L164-K166 PolarHBondContact O-N 3.39Å; L164-S167 PolarHBondContact O-N 3.1Å
165	E	53.7	Low	53.6	Low	122 Å²	122	104.6 Å²	104.6	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-62.3	-7.2	173.2	-69.7	175.8	-179.6	0	0	113.3	R161	R161-E165 HydrophobicContact CG-CG 4.36Å; R161-E165 WeakPolarHBondContact CG-OE1 3.48Å; R161-E165 IonicContact CZ-OE1 3.35Å; R161-E165 IonicContact NE-OE1 2.76Å; R161-E165 PolarHBondContact NE-OE1 3.41Å; R161-E165 IonicContact NH2-OE1 2.61Å; R161-E165 PolarHBondContact NH2-OE1 3.4Å; R161-E165 WeakPolarHBondContact O-CB 3.43Å; R161-E165 WeakPolarHBondContact O-CG 3.44Å; R161-E165 PolarHBondContact O-N 2.82Å
166	K	46.2	Very low	51.1	Low	163 Å²	163	108.9 Å²	108.9	71%	0.709	57%	0.568	S	S	*	*	H	α-helix	trans	-108	-9.3	176	-152.4	-177.4	-175.7	-169.4	0	113.4	K162 H163 L164	K162-K166 WeakPolarHBondContact O-CB 3.37Å; H163-K166 CarbonylContact O-C 3.52Å; H163-K166 WeakPolarHBondContact O-CA 3.24Å; H163-K166 WeakPolarHBondContact O-CB 3.46Å; H163-K166 PolarHBondContact O-N 3.23Å; L164-K166 PolarHBondContact O-N 3.39Å
167	S	38	Very low	48.5	Very low	94 Å²	94	116.5 Å²	116.5	66%	0.657	61%	0.608	S	S	*	*	H	α-helix	trans	-92	-32.5	-177.5	-160.9	0	0	0	0	112.2	H163 L164 A169	H163-S167 PolarHBondContact O-N 3.28Å; H163-S167 VanDerWaalsContact O-N 3.08Å; L164-S167 PolarHBondContact O-N 3.1Å; S167-A169 PolarHBondContact O-N 3.36Å
168	E	33.8	Very low	46.5	Very low	174 Å²	174	124.1 Å²	124.1	81%	0.813	65%	0.648	S	S	*	*			trans	-75.5	58.8	170.4	-68.4	-160.5	137.8	0	0	112.5
169	A	34	Very low	44	Very low	70 Å²	70	124.2 Å²	124.2	58%	0.579	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-83.5	130.4	164.2	0	0	0	0	0	109.8	S167 V171	S167-A169 PolarHBondContact O-N 3.36Å; A169-V171 PolarHBondContact O-N 3.13Å
170	P	35.7	Very low	42.1	Very low	129 Å²	129	126.2 Å²	126.2	84%	0.838	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-58.9	126.5	175.7	-25.6	35.1	0	0	0	111.9	A172	P170-A172 PolarHBondContact O-N 2.92Å
171	V	32	Very low	40.1	Very low	140 Å²	140	132.3 Å²	132.3	85%	0.848	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-57.8	128.2	-178.2	176.3	0	0	0	0	110.8	A169	A169-V171 PolarHBondContact O-N 3.13Å
172	A	32.6	Very low	38.5	Very low	82 Å²	82	137 Å²	137	68%	0.678	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-63.1	126.6	180	0	0	0	0	0	111.5	P170 R174	P170-A172 PolarHBondContact O-N 2.92Å; A172-R174 PolarHBondContact O-N 3.19Å
173	P	29.3	Very low	37.1	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-67.2	128.6	170.4	27.9	-32.5	0	0	0	109.5
174	R	29.4	Very low	36.2	Very low	238 Å²	238	136.6 Å²	136.6	90%	0.898	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-57.5	146.5	173.7	-67.4	173.8	173.3	165.4	-3.8	110.1	A172 P176	A172-R174 PolarHBondContact O-N 3.19Å; R174-P176 WeakPolarHBondContact O-CD 3.3Å
175	Q	37.4	Very low	36	Very low	194 Å²	194	139 Å²	139	91%	0.907	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-50.3	119.8	176.2	-70.2	175	-38.6	0	0	111.7
176	P	27.1	Very low	36.6	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-75.7	149.8	155.1	-6.7	26.2	0	0	0	109.2	R174	R174-P176 WeakPolarHBondContact O-CD 3.3Å
177	L	24.8	Very low	38.3	Very low	160 Å²	160	135.9 Å²	135.9	84%	0.838	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-64.3	165	166.4	-75.4	152.2	0	0	0	110.8	T179	L177-T179 PolarHBondContact O-N 3.42Å
178	L	36.2	Very low	40.9	Very low	184 Å²	184	134.1 Å²	134.1	96%	0.963	74%	0.74	S	S	*	*	S	Bend	trans	-62.4	89.4	-177.9	-75.1	165.3	0	0	0	113
179	T	26.6	Very low	43.7	Very low	112 Å²	112	126.4 Å²	126.4	69%	0.687	70%	0.704	S	S	*	*			trans	-133.3	87.9	171.9	52.1	0	0	0	0	112.5	L177 L181	L177-T179 PolarHBondContact O-N 3.42Å; T179-L181 PolarHBondContact O-N 3.28Å
180	S	35.3	Very low	46.6	Very low	121 Å²	121	125.1 Å²	125.1	85%	0.846	69%	0.686	S	S	*	*			trans	24.8	77.2	151.6	-173.9	0	0	0	0	118.3
181	L	30.2	Very low	49.4	Very low	153 Å²	153	122.8 Å²	122.8	80%	0.801	66%	0.664	S	S	*	*			trans	-88.1	143.9	157.2	-73.7	168	0	0	0	110	T179 I183	T179-L181 PolarHBondContact O-N 3.28Å; L181-I183 PolarHBondContact O-N 2.72Å
182	N	38.2	Very low	52.4	Low	171 Å²	171	118.6 Å²	118.6	91%	0.914	63%	0.633	S	S	*	*			trans	-76.6	100.9	-179.3	-97.2	-28	0	0	0	111.6	E184	N182-E184 PolarHBondContact O-N 2.8Å
183	I	39.5	Very low	55.4	Low	135 Å²	135	114.7 Å²	114.7	69%	0.692	60%	0.6	S	S	*	*			trans	-89.2	84.2	-175.5	-56.9	158.1	0	0	0	110.9	L181 I186	L181-I183 PolarHBondContact O-N 2.72Å; I183-I186 HydrophobicContact CG2-CD1 3.98Å
184	E	43.3	Very low	58.6	Low	107 Å²	107	108.9 Å²	108.9	50%	0.5	56%	0.563	S	S	.	*	S	Bend	trans	-135.2	14.5	166.1	-73.3	-150.4	136.3	0	0	114.8	N182 K235	N182-E184 PolarHBondContact O-N 2.8Å; E184-K235 IonicContact OE1-NZ 2.62Å; E184-K235 PolarHBondContact OE1-NZ 3.22Å
185	N	53.8	Low	61.8	Low	133 Å²	133	99.9 Å²	99.9	71%	0.711	54%	0.539	S	S	*	.			trans	-153.3	89.3	173.9	-109	-35.7	0	0	0	112.7
186	I	66.1	Low	64.6	Low	132 Å²	132	92.3 Å²	92.3	68%	0.677	51%	0.506	S	S	*	.			trans	-132.2	-35.8	177.4	-60.4	-176.9	0	0	0	113.1	I183	I183-I186 HydrophobicContact CG2-CD1 3.98Å
187	L	81.4	Confident	67.9	Low	87 Å²	87	86.9 Å²	86.9	46%	0.455	47%	0.471	S	S	.	.	S	Bend	trans	-105.5	142.2	-178.7	-60.9	179.4	0	0	0	112.8	Q191 R192	L187-Q191 HydrophobicContact CB-CB 4.29Å; L187-Q191 HydrophobicContact CD2-CB 4.47Å; L187-R192 HydrophobicContact CB-CG 3.96Å; L187-R192 VanDerWaalsContact O-CZ 3.32Å; L187-R192 PolarHBondContact O-NE 3.19Å; L187-R192 PolarHBondContact O-NH2 3.17Å
188	T	91.7	Very high	71.3	Confident	57 Å²	57	80.9 Å²	80.9	35%	0.35	44%	0.443	S	S	.	.			trans	-78.2	169.4	174	62.9	0	0	0	0	112.7	E190 Q191 R192	T188-E190 WeakPolarHBondContact CB-OE1 3.18Å; T188-E190 PolarHBondContact O-N 2.97Å; T188-E190 PolarHBondContact OG1-OE1 3.39Å; T188-E190 PolarHBondContact OG1-OE2 2.65Å; T188-Q191 PolarHBondContact O-N 3.19Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.32Å; T188-Q191 PolarHBondContact OG1-OE1 2.97Å; T188-R192 VanDerWaalsContact O-CG 3.24Å; T188-R192 WeakPolarHBondContact O-CG 3.24Å; T188-R192 PolarHBondContact O-N 2.9Å
189	H	92.7	Very high	74	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.056	42%	0.422	C	S	.	.	H	α-helix	trans	-60.1	-48.5	-176.1	178.2	74.8	0	0	0	112	Q191 R192 C193 E224 Y238 H317 S405 F448	H189-Q191 PolarHBondContact O-N 2.81Å; H189-R192 PolarHBondContact O-N 2.96Å; H189-C193 PolarHBondContact O-N 2.94Å; H189-C193 PolarHBondContact O-SG 2.85Å; H189-C193 VanDerWaalsContact O-SG 3.4Å; H189-E224 IonicContact CE1-OE2 2.64Å; H189-E224 IonicContact ND1-OE2 3.84Å; H189-Y238 AromaticContact CE1-CE1 3.83Å; H189-Y238 AromaticContact ND1-CE1 3.59Å; H189-Y238 AromaticContact ND1-CZ 3.7Å; H189-Y238 PolarHBondContact ND1-OH 2.95Å; H189-H317 AromaticContact CE1-CE1 3.64Å; H189-H317 AromaticContact CE1-CG 3.83Å; H189-H317 AromaticContact CE1-ND1 3.26Å; H189-H317 PolarHBondContact CE1-ND1 2.75Å; H189-H317 VanDerWaalsContact CE1-ND1 3.26Å; H189-H317 AromaticContact NE2-ND1 3.43Å; H189-H317 PolarHBondContact NE2-ND1 3.48Å; H189-S405 PolarHBondContact NE2-OG 2.77Å; H189-F448 AromaticContact CD2-CE2 3.89Å
190	E	94.7	Very high	77.3	Confident	43 Å²	43	70 Å²	70	20%	0.201	39%	0.391	C	S	.	.	H	α-helix	trans	-63.6	-37.5	178.1	64.5	-75.8	174.4	0	0	113	T188 A194 V407 F448	T188-E190 WeakPolarHBondContact CB-OE1 3.18Å; T188-E190 PolarHBondContact O-N 2.97Å; T188-E190 PolarHBondContact OG1-OE1 3.39Å; T188-E190 PolarHBondContact OG1-OE2 2.65Å; E190-A194 WeakPolarHBondContact O-CB 3.36Å; E190-A194 PolarHBondContact O-N 3.09Å; E190-V407 HydrophobicContact CB-CG1 3.84Å; E190-V407 HydrophobicContact CB-CG2 4.15Å; E190-F448 HydrophobicContact CB-CB 4.03Å
191	Q	94.9	Very high	80.1	Confident	79 Å²	79	64.3 Å²	64.3	37%	0.369	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-44.1	173.9	-72.7	171.5	-11.3	0	0	111.6	L187 T188 H189 A194 A195	L187-Q191 HydrophobicContact CB-CB 4.29Å; L187-Q191 HydrophobicContact CD2-CB 4.47Å; T188-Q191 PolarHBondContact O-N 3.19Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.32Å; T188-Q191 PolarHBondContact OG1-OE1 2.97Å; H189-Q191 PolarHBondContact O-N 2.81Å; Q191-A194 PolarHBondContact O-N 3.36Å; Q191-A195 VanDerWaalsContact O-CB 3.27Å; Q191-A195 WeakPolarHBondContact O-CB 3.49Å; Q191-A195 PolarHBondContact O-N 2.88Å
192	R	94.9	Very high	83	Confident	52 Å²	52	60.5 Å²	60.5	20%	0.196	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-45.8	176.8	-65.6	167	-154.1	179.5	-2.6	111.6	L187 T188 H189 A194 A195 V196 E236 Y238	L187-R192 HydrophobicContact CB-CG 3.96Å; L187-R192 VanDerWaalsContact O-CZ 3.32Å; L187-R192 PolarHBondContact O-NE 3.19Å; L187-R192 PolarHBondContact O-NH2 3.17Å; T188-R192 VanDerWaalsContact O-CG 3.24Å; T188-R192 WeakPolarHBondContact O-CG 3.24Å; T188-R192 PolarHBondContact O-N 2.9Å; H189-R192 PolarHBondContact O-N 2.96Å; R192-A194 PolarHBondContact O-N 2.73Å; R192-A195 PolarHBondContact O-N 3.35Å; R192-V196 WeakPolarHBondContact O-CB 3.49Å; R192-V196 WeakPolarHBondContact O-CG2 3.44Å; R192-V196 PolarHBondContact O-N 3.05Å; R192-E236 IonicContact CZ-OE2 3.34Å; R192-E236 IonicContact NH1-OE2 3.53Å; R192-E236 PolarHBondContact NH1-OE2 3.37Å; R192-E236 IonicContact NH2-OE2 2.79Å; R192-Y238 HydrophobicContact CB-CD1 4.08Å; R192-Y238 HydrophobicContact CB-CE1 4.1Å; R192-Y238 HydrophobicContact CB-CG 4.34Å; R192-Y238 PolarHBondContact NH1-OH 3.17Å
193	C	96.6	Very high	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-47.4	176.7	-73.6	0	0	0	0	111.4	H189 V197 I222 V407	H189-C193 PolarHBondContact O-N 2.94Å; H189-C193 PolarHBondContact O-SG 2.85Å; H189-C193 VanDerWaalsContact O-SG 3.4Å; C193-V197 VanDerWaalsContact O-CG2 3.25Å; C193-V197 WeakPolarHBondContact O-CG2 3.22Å; C193-V197 PolarHBondContact O-N 3.04Å; C193-V197 VanDerWaalsContact O-N 3.09Å; C193-I222 HydrophobicContact CB-CD1 4.22Å; C193-V407 HydrophobicContact CB-CG2 3.89Å
194	A	96.4	Very high	88.2	Confident	3 Å²	3	54.8 Å²	54.8	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-44.9	177.1	0	0	0	0	0	112.5	E190 Q191 R192 V196 V197 S198 Y319 P451 V453	E190-A194 WeakPolarHBondContact O-CB 3.36Å; E190-A194 PolarHBondContact O-N 3.09Å; Q191-A194 PolarHBondContact O-N 3.36Å; R192-A194 PolarHBondContact O-N 2.73Å; A194-V196 PolarHBondContact O-N 3.16Å; A194-V197 CarbonylContact O-C 3.57Å; A194-V197 PolarHBondContact O-N 3.33Å; A194-V197 VanDerWaalsContact O-N 3.13Å; A194-S198 PolarHBondContact O-N 2.96Å; A194-Y319 HydrophobicContact CB-CD2 4.34Å; A194-Y319 HydrophobicContact CB-CE2 3.79Å; A194-P451 HydrophobicContact CB-CG 3.57Å; A194-V453 HydrophobicContact CB-CG2 3.97Å; A194-V453 VanDerWaalsContact O-CG2 3.28Å; A194-V453 WeakPolarHBondContact O-CG2 3.43Å
195	A	95.5	Very high	90.4	Very high	48 Å²	48	49.9 Å²	49.9	40%	0.397	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-41.4	178.7	0	0	0	0	0	112.7	Q191 R192 V197 S198 A199	Q191-A195 VanDerWaalsContact O-CB 3.27Å; Q191-A195 WeakPolarHBondContact O-CB 3.49Å; Q191-A195 PolarHBondContact O-N 2.88Å; R192-A195 PolarHBondContact O-N 3.35Å; A195-V197 VanDerWaalsContact C-N 3.31Å; A195-V197 PolarHBondContact O-N 3.34Å; A195-S198 PolarHBondContact O-N 2.91Å; A195-A199 WeakPolarHBondContact O-CB 3.33Å; A195-A199 PolarHBondContact O-N 2.9Å
196	V	96.6	Very high	91.9	Very high	35 Å²	35	48.4 Å²	48.4	21%	0.212	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-31.5	175.5	167.2	0	0	0	0	112	R192 A194 G200 I222 L240	R192-V196 WeakPolarHBondContact O-CB 3.49Å; R192-V196 WeakPolarHBondContact O-CG2 3.44Å; R192-V196 PolarHBondContact O-N 3.05Å; A194-V196 PolarHBondContact O-N 3.16Å; V196-G200 PolarHBondContact O-N 2.87Å; V196-G200 VanDerWaalsContact O-N 3.09Å; V196-I222 HydrophobicContact CG1-CG1 4.45Å; V196-I222 HydrophobicContact CG1-CG2 4.09Å; V196-L240 HydrophobicContact CG1-CB 3.93Å
197	V	97.3	Very high	92.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-72.9	-40.3	172.7	174.5	0	0	0	0	111.6	C193 A194 A195 G200 L201 V218 A220 I222 L240 Y319 V453	C193-V197 VanDerWaalsContact O-CG2 3.25Å; C193-V197 WeakPolarHBondContact O-CG2 3.22Å; C193-V197 PolarHBondContact O-N 3.04Å; C193-V197 VanDerWaalsContact O-N 3.09Å; A194-V197 CarbonylContact O-C 3.57Å; A194-V197 PolarHBondContact O-N 3.33Å; A194-V197 VanDerWaalsContact O-N 3.13Å; A195-V197 VanDerWaalsContact C-N 3.31Å; A195-V197 PolarHBondContact O-N 3.34Å; V197-G200 PolarHBondContact O-N 3.46Å; V197-L201 HydrophobicContact CG1-CD1 3.85Å; V197-L201 WeakPolarHBondContact O-CB 3.48Å; V197-L201 WeakPolarHBondContact O-CD1 3.47Å; V197-L201 WeakPolarHBondContact O-CG 3.44Å; V197-L201 PolarHBondContact O-N 2.95Å; V197-V218 HydrophobicContact CG1-CG1 3.82Å; V197-A220 HydrophobicContact CG1-CB 4.19Å; V197-A220 HydrophobicContact CG2-CB 3.5Å; V197-A220 VanDerWaalsContact CG2-CB 3.5Å; V197-I222 HydrophobicContact CG2-CD1 3.82Å; V197-I222 HydrophobicContact CG2-CG1 4.06Å; V197-L240 HydrophobicContact CG2-CD1 4.23Å; V197-Y319 HydrophobicContact CB-CD1 4.32Å; V197-Y319 HydrophobicContact CG1-CD1 3.9Å; V197-Y319 HydrophobicContact CG1-CE1 4.11Å; V197-Y319 HydrophobicContact CG2-CD1 4.14Å; V197-Y319 HydrophobicContact CG2-CG 4.05Å; V197-V453 HydrophobicContact CG1-CG1 4.25Å; V197-V453 HydrophobicContact CG1-CG2 4.48Å
198	S	95.1	Very high	92.5	Very high	35 Å²	35	52 Å²	52	25%	0.245	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-60.9	174.3	-160.9	0	0	0	0	110.7	A194 A195 G200 L201 D202 V453	A194-S198 PolarHBondContact O-N 2.96Å; A195-S198 PolarHBondContact O-N 2.91Å; S198-G200 PolarHBondContact O-N 3.36Å; S198-L201 CarbonylContact O-C 3.52Å; S198-L201 WeakPolarHBondContact O-CA 3.25Å; S198-L201 WeakPolarHBondContact O-CB 3.37Å; S198-L201 PolarHBondContact O-N 3.34Å; S198-D202 PolarHBondContact O-N 2.75Å; S198-D202 PolarHBondContact OG-OD2 3.5Å; S198-V453 VanDerWaalsContact CA-CG1 3.46Å
199	A	94.4	Very high	92.3	Very high	65 Å²	65	50 Å²	50	54%	0.537	27%	0.271	S	S	.	.	H	α-helix	trans	-56.8	-30.8	-179.8	0	0	0	0	0	112.7	A195 R203	A195-A199 WeakPolarHBondContact O-CB 3.33Å; A195-A199 PolarHBondContact O-N 2.9Å; A199-R203 VanDerWaalsContact O-CB 3.24Å; A199-R203 WeakPolarHBondContact O-CB 3.48Å; A199-R203 PolarHBondContact O-N 2.91Å
200	G	94.4	Very high	92.1	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-40.6	171.5	0	0	0	0	0	114.2	V196 V197 S198 L204	V196-G200 PolarHBondContact O-N 2.87Å; V196-G200 VanDerWaalsContact O-N 3.09Å; V197-G200 PolarHBondContact O-N 3.46Å; S198-G200 PolarHBondContact O-N 3.36Å; G200-L204 VanDerWaalsContact O-CD1 3.3Å; G200-L204 WeakPolarHBondContact O-CD1 3.47Å; G200-L204 WeakPolarHBondContact O-CG 3.44Å; G200-L204 PolarHBondContact O-N 3.08Å
201	L	93.5	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-45.5	173.8	-78.9	158.9	0	0	0	112.3	V197 S198 R203 L204 L205 K215 V218 L243 V453	V197-L201 HydrophobicContact CG1-CD1 3.85Å; V197-L201 WeakPolarHBondContact O-CB 3.48Å; V197-L201 WeakPolarHBondContact O-CD1 3.47Å; V197-L201 WeakPolarHBondContact O-CG 3.44Å; V197-L201 PolarHBondContact O-N 2.95Å; S198-L201 CarbonylContact O-C 3.52Å; S198-L201 WeakPolarHBondContact O-CA 3.25Å; S198-L201 WeakPolarHBondContact O-CB 3.37Å; S198-L201 PolarHBondContact O-N 3.34Å; L201-R203 VanDerWaalsContact C-N 3.26Å; L201-R203 PolarHBondContact O-N 2.87Å; L201-L204 CarbonylContact O-C 3.48Å; L201-L204 PolarHBondContact O-N 2.87Å; L201-L205 HydrophobicContact CD2-CD1 3.99Å; L201-L205 WeakPolarHBondContact O-CB 3.36Å; L201-L205 PolarHBondContact O-N 2.88Å; L201-K215 HydrophobicContact CD1-CG 4.36Å; L201-K215 HydrophobicContact CD2-CG 4.4Å; L201-V218 HydrophobicContact CD1-CB 4.48Å; L201-V218 HydrophobicContact CD1-CG1 4.23Å; L201-V218 HydrophobicContact CD1-CG2 3.7Å; L201-V218 HydrophobicContact CD2-CG2 3.97Å; L201-V218 HydrophobicContact CG-CG2 4.45Å; L201-L243 HydrophobicContact CD1-CD1 4.36Å; L201-L243 HydrophobicContact CD2-CD1 3.65Å; L201-L243 HydrophobicContact CD2-CD2 4.09Å; L201-L243 HydrophobicContact CG-CD1 3.7Å; L201-V453 HydrophobicContact CD1-CG1 3.59Å
202	D	92.1	Very high	91.5	Very high	74 Å²	74	51.5 Å²	51.5	40%	0.396	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-32.6	-176.4	-58.6	-41	0	0	0	111.2	S198 K215	S198-D202 PolarHBondContact O-N 2.75Å; S198-D202 PolarHBondContact OG-OD2 3.5Å; D202-K215 WeakPolarHBondContact OD1-CE 3.43Å; D202-K215 IonicContact OD1-NZ 3.91Å; D202-K215 PolarHBondContact OD1-NZ 3.24Å
203	R	92.9	Very high	91.2	Very high	159 Å²	159	50.4 Å²	50.4	60%	0.6	29%	0.286	S	S	*	.	H	α-helix	trans	-69	-29.3	169.4	-175.1	-172.3	66.8	-159.4	-4.1	113.9	A199 L201	A199-R203 VanDerWaalsContact O-CB 3.24Å; A199-R203 WeakPolarHBondContact O-CB 3.48Å; A199-R203 PolarHBondContact O-N 2.91Å; L201-R203 VanDerWaalsContact C-N 3.26Å; L201-R203 PolarHBondContact O-N 2.87Å
204	L	93.4	Very high	90.9	Very high	26 Å²	26	50.5 Å²	50.5	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-99.5	-15.8	-176.3	-67.6	171.3	0	0	0	113.4	G200 L201 W470 I477	G200-L204 VanDerWaalsContact O-CD1 3.3Å; G200-L204 WeakPolarHBondContact O-CD1 3.47Å; G200-L204 WeakPolarHBondContact O-CG 3.44Å; G200-L204 PolarHBondContact O-N 3.08Å; L201-L204 CarbonylContact O-C 3.48Å; L201-L204 PolarHBondContact O-N 2.87Å; L204-W470 HydrophobicContact CD1-CB 4Å; L204-W470 HydrophobicContact CD1-CD2 3.71Å; L204-W470 HydrophobicContact CD1-CE3 4.12Å; L204-W470 HydrophobicContact CD1-CG 3.66Å; L204-W470 HydrophobicContact CD2-CD2 4.49Å; L204-W470 HydrophobicContact CD2-CG 4.26Å; L204-I477 HydrophobicContact CB-CD1 3.66Å; L204-I477 HydrophobicContact CB-CG1 4.09Å; L204-I477 HydrophobicContact CD1-CD1 4.39Å; L204-I477 HydrophobicContact CD1-CG1 4.26Å
205	L	90.6	Very high	90.6	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.021	29%	0.289	C	S	.	.	S	Bend	trans	-135.1	88.7	-177.9	-63.9	176.9	0	0	0	107.9	L201 Q212 K215 L468 I477	L201-L205 HydrophobicContact CD2-CD1 3.99Å; L201-L205 WeakPolarHBondContact O-CB 3.36Å; L201-L205 PolarHBondContact O-N 2.88Å; L205-Q212 PolarHBondContact O-NE2 3.04Å; L205-K215 HydrophobicContact CD1-CG 4.28Å; L205-L468 HydrophobicContact CD1-CD1 3.96Å; L205-L468 HydrophobicContact CD2-CD1 4.07Å; L205-I477 HydrophobicContact CD2-CD1 3.75Å; L205-I477 HydrophobicContact CG-CD1 3.94Å
206	N	84.1	Confident	90.3	Very high	102 Å²	102	50.4 Å²	50.4	55%	0.545	29%	0.286	S	S	.	.			trans	-56	154.6	169.8	63.1	-19.9	0	0	0	111.3	S208 S209 Q212	N206-S208 PolarHBondContact ND2-OG 2.99Å; N206-S208 PolarHBondContact O-N 3.14Å; N206-S208 VanDerWaalsContact O-N 3.08Å; N206-S209 WeakPolarHBondContact O-CB 3.44Å; N206-S209 PolarHBondContact O-N 3.02Å; N206-S209 WeakPolarHBondContact OD1-CB 3.43Å; N206-S209 PolarHBondContact OD1-N 3.44Å; N206-Q212 PolarHBondContact O-NE2 2.88Å
207	E	79.5	Confident	90.1	Very high	191 Å²	191	50.3 Å²	50.3	89%	0.893	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.1	-172.2	-61.8	179.6	157	0	0	113.3	S209	E207-S209 VanDerWaalsContact C-N 3.28Å; E207-S209 PolarHBondContact O-N 2.91Å
208	S	81.6	Confident	90	Very high	103 Å²	103	50.4 Å²	50.4	72%	0.72	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	3.8	175.7	55.1	0	0	0	0	115.4	N206	N206-S208 PolarHBondContact ND2-OG 2.99Å; N206-S208 PolarHBondContact O-N 3.14Å; N206-S208 VanDerWaalsContact O-N 3.08Å
209	S	87.3	Confident	90.2	Very high	16 Å²	16	48.7 Å²	48.7	11%	0.112	27%	0.274	C	S	.	.			trans	-64.6	130.2	179.6	-171.7	0	0	0	0	111.5	N206 E207 Y211 Q212	N206-S209 WeakPolarHBondContact O-CB 3.44Å; N206-S209 PolarHBondContact O-N 3.02Å; N206-S209 WeakPolarHBondContact OD1-CB 3.43Å; N206-S209 PolarHBondContact OD1-N 3.44Å; E207-S209 VanDerWaalsContact C-N 3.28Å; E207-S209 PolarHBondContact O-N 2.91Å; S209-Y211 PolarHBondContact O-N 2.92Å; S209-Y211 PolarHBondContact OG-N 2.7Å; S209-Q212 WeakPolarHBondContact O-CG 3.16Å; S209-Q212 PolarHBondContact O-N 3.02Å
210	P	87.7	Confident	90.4	Very high	88 Å²	88	45.6 Å²	45.6	57%	0.571	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-9	173.7	29.4	-36.1	0	0	0	112.7	C463	P210-C463 PolarHBondContact O-SG 2.73Å
211	Y	90.2	Very high	90.6	Very high	51 Å²	51	45.5 Å²	45.5	20%	0.2	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	9.2	-176.2	-47.6	-59.2	0	0	0	114.7	S209 A213 C214 L466 L468 V479	S209-Y211 PolarHBondContact O-N 2.92Å; S209-Y211 PolarHBondContact OG-N 2.7Å; Y211-A213 VanDerWaalsContact C-N 3.26Å; Y211-A213 PolarHBondContact O-N 2.6Å; Y211-C214 WeakPolarHBondContact O-CB 3.44Å; Y211-C214 PolarHBondContact O-N 2.83Å; Y211-L466 HydrophobicContact CD1-CD1 3.9Å; Y211-L466 HydrophobicContact CE1-CD1 3.79Å; Y211-L468 HydrophobicContact CD1-CD2 4.34Å; Y211-L468 HydrophobicContact CD2-CD2 4.47Å; Y211-L468 HydrophobicContact CG-CD2 4.05Å; Y211-V479 HydrophobicContact CD2-CG2 4.25Å; Y211-V479 HydrophobicContact CE1-CG1 4.01Å; Y211-V479 HydrophobicContact CE1-CG2 4.29Å; Y211-V479 HydrophobicContact CE2-CG2 3.71Å
212	Q	88.4	Confident	90.8	Very high	26 Å²	26	45.5 Å²	45.5	12%	0.121	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-53.9	-38.6	-179.7	-75.2	-63	-20.8	0	0	113.4	L205 N206 S209 C214 K215	L205-Q212 PolarHBondContact O-NE2 3.04Å; N206-Q212 PolarHBondContact O-NE2 2.88Å; S209-Q212 WeakPolarHBondContact O-CG 3.16Å; S209-Q212 PolarHBondContact O-N 3.02Å; Q212-C214 PolarHBondContact O-N 3.18Å; Q212-C214 VanDerWaalsContact O-N 3.08Å; Q212-K215 VanDerWaalsContact O-CB 3.32Å; Q212-K215 WeakPolarHBondContact O-CB 3.39Å; Q212-K215 WeakPolarHBondContact O-CG 3.38Å; Q212-K215 PolarHBondContact O-N 3.11Å; Q212-K215 VanDerWaalsContact OE1-CD 3.28Å
213	A	87.5	Confident	91.1	Very high	29 Å²	29	42 Å²	42	24%	0.24	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-62.1	-17.3	177.7	0	0	0	0	0	113.8	Y211 K215 G216 M459 C463	Y211-A213 VanDerWaalsContact C-N 3.26Å; Y211-A213 PolarHBondContact O-N 2.6Å; A213-K215 PolarHBondContact O-N 2.72Å; A213-G216 PolarHBondContact O-N 2.89Å; A213-M459 HydrophobicContact CB-CB 4.07Å; A213-C463 HydrophobicContact CB-CB 3.99Å
214	C	89.9	Confident	91.2	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.014	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-64.5	-23.6	170.9	-74.5	0	0	0	0	113.5	Y211 Q212 G216 T217 T245 L468	Y211-C214 WeakPolarHBondContact O-CB 3.44Å; Y211-C214 PolarHBondContact O-N 2.83Å; Q212-C214 PolarHBondContact O-N 3.18Å; Q212-C214 VanDerWaalsContact O-N 3.08Å; C214-G216 PolarHBondContact O-N 2.97Å; C214-T217 PolarHBondContact O-N 2.77Å; C214-T217 PolarHBondContact O-OG1 3.18Å; C214-T217 VanDerWaalsContact O-OG1 3.09Å; C214-T245 HydrophobicContact CB-CG2 4.07Å; C214-L468 HydrophobicContact CB-CD1 3.47Å; C214-L468 VanDerWaalsContact CB-CD1 3.47Å; C214-L468 HydrophobicContact CB-CG 3.87Å
215	K	90	Very high	91.2	Very high	17 Å²	17	36.8 Å²	36.8	7%	0.074	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-53.8	-34.9	177	-73.8	-177.1	168.8	172.1	0	112.1	L201 D202 L205 Q212 A213 T217 V218 A454	L201-K215 HydrophobicContact CD1-CG 4.36Å; L201-K215 HydrophobicContact CD2-CG 4.4Å; D202-K215 WeakPolarHBondContact OD1-CE 3.43Å; D202-K215 IonicContact OD1-NZ 3.91Å; D202-K215 PolarHBondContact OD1-NZ 3.24Å; L205-K215 HydrophobicContact CD1-CG 4.28Å; Q212-K215 VanDerWaalsContact O-CB 3.32Å; Q212-K215 WeakPolarHBondContact O-CB 3.39Å; Q212-K215 WeakPolarHBondContact O-CG 3.38Å; Q212-K215 PolarHBondContact O-N 3.11Å; Q212-K215 VanDerWaalsContact OE1-CD 3.28Å; A213-K215 PolarHBondContact O-N 2.72Å; K215-T217 PolarHBondContact O-N 3.17Å; K215-T217 VanDerWaalsContact O-N 3.09Å; K215-V218 VanDerWaalsContact O-CG2 3.24Å; K215-V218 WeakPolarHBondContact O-CG2 3.25Å; K215-V218 PolarHBondContact O-N 3.28Å; K215-A454 HydrophobicContact CB-CB 4.2Å
216	G	89.6	Confident	91	Very high	32 Å²	32	39.8 Å²	39.8	33%	0.33	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-63.4	-9.7	176.3	0	0	0	0	0	115.7	A213 C214 N322	A213-G216 PolarHBondContact O-N 2.89Å; C214-G216 PolarHBondContact O-N 2.97Å; G216-N322 PolarHBondContact O-ND2 2.78Å
217	T	93	Very high	90.8	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.209	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-127.3	22	-176.9	61.1	0	0	0	0	113.6	C214 K215 T245 G246	C214-T217 PolarHBondContact O-N 2.77Å; C214-T217 PolarHBondContact O-OG1 3.18Å; C214-T217 VanDerWaalsContact O-OG1 3.09Å; K215-T217 PolarHBondContact O-N 3.17Å; K215-T217 VanDerWaalsContact O-N 3.09Å; T217-T245 WeakPolarHBondContact O-CA 3.2Å; T217-G246 PolarHBondContact OG1-N 3.16Å
218	V	95.7	Very high	90.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	22%	0.215	C	C	.	.			trans	-67.4	140.8	-176	169.9	0	0	0	0	112.2	V197 L201 K215 L243 T245 Y319 S321	V197-V218 HydrophobicContact CG1-CG1 3.82Å; L201-V218 HydrophobicContact CD1-CB 4.48Å; L201-V218 HydrophobicContact CD1-CG1 4.23Å; L201-V218 HydrophobicContact CD1-CG2 3.7Å; L201-V218 HydrophobicContact CD2-CG2 3.97Å; L201-V218 HydrophobicContact CG-CG2 4.45Å; K215-V218 VanDerWaalsContact O-CG2 3.24Å; K215-V218 WeakPolarHBondContact O-CG2 3.25Å; K215-V218 PolarHBondContact O-N 3.28Å; V218-L243 HydrophobicContact CG1-CD1 4.27Å; V218-L243 HydrophobicContact CG1-CG 4.48Å; V218-T245 HydrophobicContact CG2-CG2 3.68Å; V218-Y319 HydrophobicContact CG1-CD1 4.44Å; V218-S321 PolarHBondContact O-N 3.1Å; V218-S321 PolarHBondContact O-OG 3.45Å
219	A	97.9	Very high	89.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.6	146.4	0	0	0	0	0	110	G244 G266 L267 A270 Y319 V320	A219-G244 PolarHBondContact N-O 3.15Å; A219-G244 PolarHBondContact O-N 2.9Å; A219-G266 VanDerWaalsContact CB-C 3.49Å; A219-L267 VanDerWaalsContact CB-CA 3.43Å; A219-L267 HydrophobicContact CB-CB 4.01Å; A219-L267 HydrophobicContact CB-CD1 4.48Å; A219-L267 VanDerWaalsContact CB-N 3.33Å; A219-A270 HydrophobicContact CB-CB 4.13Å; A219-A270 WeakPolarHBondContact O-CB 3.34Å; A219-Y319 CarbonylContact C-O 3.6Å; A219-Y319 WeakPolarHBondContact CA-O 3.27Å; A219-Y319 WeakPolarHBondContact CB-O 3.3Å; A219-V320 HydrophobicContact CB-CB 4.47Å; A219-V320 HydrophobicContact CB-CG1 4.22Å; A219-V320 HydrophobicContact CB-CG2 4.08Å
220	A	98.5	Very high	87.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	159.7	-177.7	0	0	0	0	0	111.4	V197 I222 L240 A242 L318 Y319	V197-A220 HydrophobicContact CG1-CB 4.19Å; V197-A220 HydrophobicContact CG2-CB 3.5Å; V197-A220 VanDerWaalsContact CG2-CB 3.5Å; A220-I222 HydrophobicContact CB-CD1 4.38Å; A220-L240 HydrophobicContact CB-CD1 3.6Å; A220-A242 CarbonylContact C-O 3.51Å; A220-A242 WeakPolarHBondContact CA-O 3.32Å; A220-L318 WeakPolarHBondContact O-CA 3.46Å; A220-Y319 PolarHBondContact N-O 3.11Å; A220-Y319 PolarHBondContact O-N 2.98Å
221	V	98.8	Very high	86	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.1	165.5	-164.7	0	0	0	0	108.2	V241 A242 A270 L274 L316 H317 L318	V221-V241 HydrophobicContact CB-CG2 4.27Å; V221-V241 HydrophobicContact CG1-CG2 4.31Å; V221-V241 VanDerWaalsContact O-CG2 3.27Å; V221-V241 WeakPolarHBondContact O-CG2 3.42Å; V221-V241 PolarHBondContact O-N 3.25Å; V221-A242 HydrophobicContact CB-CB 4.13Å; V221-A242 HydrophobicContact CG2-CB 4.12Å; V221-A242 PolarHBondContact N-O 2.89Å; V221-A242 PolarHBondContact O-N 3.48Å; V221-A270 HydrophobicContact CG2-CB 4.42Å; V221-L274 HydrophobicContact CB-CD1 4.12Å; V221-L274 HydrophobicContact CG1-CD1 3.83Å; V221-L274 HydrophobicContact CG1-CD2 4.04Å; V221-L274 HydrophobicContact CG1-CG 4.46Å; V221-L274 HydrophobicContact CG2-CB 4.17Å; V221-L274 HydrophobicContact CG2-CD1 4.44Å; V221-L274 HydrophobicContact CG2-CD2 4.21Å; V221-L274 HydrophobicContact CG2-CG 4.5Å; V221-L316 HydrophobicContact CG1-CD2 4.05Å; V221-H317 CarbonylContact C-O 3.58Å; V221-H317 WeakPolarHBondContact CA-O 3.48Å; V221-L318 HydrophobicContact CG1-CD2 4.28Å; V221-L318 HydrophobicContact CG2-CD2 3.85Å
222	I	98.6	Very high	84.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.2	174	-51.2	85.6	0	0	0	107.2	C193 V196 V197 A220 Y238 E239 H317	C193-I222 HydrophobicContact CB-CD1 4.22Å; V196-I222 HydrophobicContact CG1-CG1 4.45Å; V196-I222 HydrophobicContact CG1-CG2 4.09Å; V197-I222 HydrophobicContact CG2-CD1 3.82Å; V197-I222 HydrophobicContact CG2-CG1 4.06Å; A220-I222 HydrophobicContact CB-CD1 4.38Å; I222-Y238 HydrophobicContact CG2-CD1 4.08Å; I222-E239 CarbonylContact C-O 3.47Å; I222-E239 WeakPolarHBondContact CA-O 3.34Å; I222-H317 HydrophobicContact CB-CB 4.35Å; I222-H317 PolarHBondContact N-O 2.85Å; I222-H317 PolarHBondContact O-N 3.36Å
223	L	97.8	Very high	82.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.1	171.1	-172.8	90.5	0	0	0	108.1	R225 Y238 E239 V241 V297 V314 F315 L316	L223-R225 HydrophobicContact CD2-CG 3.89Å; L223-R225 HydrophobicContact CG-CG 4.32Å; L223-Y238 WeakPolarHBondContact O-CA 3.4Å; L223-E239 PolarHBondContact N-O 3.37Å; L223-E239 PolarHBondContact O-N 3.01Å; L223-V241 HydrophobicContact CB-CG1 3.59Å; L223-V241 HydrophobicContact CB-CG2 4.09Å; L223-V241 HydrophobicContact CD2-CG1 4.26Å; L223-V241 HydrophobicContact CG-CG1 4.43Å; L223-V297 HydrophobicContact CD1-CG1 4.35Å; L223-V297 HydrophobicContact CD2-CG1 3.56Å; L223-V314 HydrophobicContact CD1-CG1 3.5Å; L223-V314 HydrophobicContact CD2-CG1 4.37Å; L223-V314 HydrophobicContact CG-CG1 4.01Å; L223-F315 WeakPolarHBondContact CA-O 3.37Å; L223-L316 HydrophobicContact CD1-CD2 3.7Å
224	E	95.8	Very high	81.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.4	167.7	-177.1	168.2	-159.4	0	0	108.8	H189 E236 T237 Y238 V314 F315 H317	H189-E224 IonicContact CE1-OE2 2.64Å; H189-E224 IonicContact ND1-OE2 3.84Å; E224-E236 WeakPolarHBondContact OE1-CB 3.27Å; E224-T237 CarbonylContact C-O 3.58Å; E224-T237 VanDerWaalsContact CA-O 3.3Å; E224-T237 WeakPolarHBondContact CA-O 3.45Å; E224-Y238 HydrophobicContact CG-CD2 4.38Å; E224-Y238 HydrophobicContact CG-CE1 4.46Å; E224-Y238 HydrophobicContact CG-CE2 3.95Å; E224-Y238 VanDerWaalsContact OE1-CE2 3.25Å; E224-Y238 WeakPolarHBondContact OE1-CE2 3.33Å; E224-Y238 PolarHBondContact OE1-OH 3.33Å; E224-Y238 PolarHBondContact OE2-OH 2.97Å; E224-V314 WeakPolarHBondContact O-CA 3.33Å; E224-F315 HydrophobicContact CB-CB 4.27Å; E224-F315 PolarHBondContact N-O 3.02Å; E224-F315 PolarHBondContact O-N 2.67Å; E224-H317 WeakPolarHBondContact CB-NE2 3.44Å; E224-H317 IonicContact OE2-CE1 3.55Å; E224-H317 PolarHBondContact OE2-CE1 2.91Å; E224-H317 VanDerWaalsContact OE2-CE1 3.27Å; E224-H317 IonicContact OE2-NE2 2.9Å; E224-H317 PolarHBondContact OE2-NE2 2.8Å
225	R	92.1	Very high	81	Confident	72 Å²	72	52.9 Å²	52.9	27%	0.272	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.7	171.3	-64	-177.8	-69.9	-113.2	-14.3	109.5	L223 T237 E239 G313 V314	L223-R225 HydrophobicContact CD2-CG 3.89Å; L223-R225 HydrophobicContact CG-CG 4.32Å; R225-T237 PolarHBondContact N-O 3.42Å; R225-T237 PolarHBondContact O-N 2.92Å; R225-T237 PolarHBondContact O-OG1 3.31Å; R225-E239 IonicContact CZ-OE2 3.95Å; R225-E239 IonicContact NH1-OE2 2.79Å; R225-E239 PolarHBondContact NH1-OE2 3.48Å; R225-E239 IonicContact NH2-OE2 3.75Å; R225-E239 PolarHBondContact NH2-OE2 2.86Å; R225-G313 CarbonylContact C-O 3.6Å; R225-G313 WeakPolarHBondContact CA-O 3.49Å; R225-V314 HydrophobicContact CG-CG1 4.33Å; R225-V314 HydrophobicContact CG-CG2 4.18Å
226	E	87.6	Confident	80.8	Confident	67 Å²	67	54 Å²	54	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122	171.7	-171	178.5	-158.4	0	0	109.9	S234 G313	E226-S234 WeakPolarHBondContact OE1-CB 3.42Å; E226-S234 PolarHBondContact OE1-OG 2.75Å; E226-G313 PolarHBondContact N-O 3.26Å
227	V	78.8	Confident	80.8	Confident	75 Å²	75	54.7 Å²	54.7	46%	0.455	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.7	176.4	-176	0	0	0	0	108.9	G229 S234 K235	V227-G229 PolarHBondContact O-N 2.92Å; V227-S234 CarbonylContact O-C 3.59Å; V227-S234 VanDerWaalsContact O-CA 3.31Å; V227-S234 WeakPolarHBondContact O-CA 3.14Å; V227-K235 PolarHBondContact N-O 2.98Å; V227-K235 PolarHBondContact O-N 2.75Å
228	Q	66.9	Low	80.9	Confident	186 Å²	186	54.8 Å²	54.8	87%	0.869	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	113.4	174.6	-67.4	-178.4	-6.3	0	0	109.8
229	G	59.2	Low	81	Confident	37 Å²	37	57.5 Å²	57.5	38%	0.381	32%	0.315	S	S	.	.			trans	-80.8	159.6	175.3	0	0	0	0	0	112.3	V227 I231 H233	V227-G229 PolarHBondContact O-N 2.92Å; G229-I231 PolarHBondContact O-N 2.92Å; G229-I231 VanDerWaalsContact O-N 3.13Å; G229-H233 WeakPolarHBondContact CA-O 3.29Å; G229-H233 PolarHBondContact N-O 3.37Å
230	T	54.1	Low	81	Confident	150 Å²	150	58 Å²	58	92%	0.92	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-12.3	-173.2	46.7	0	0	0	0	115.2
231	I	56.2	Low	81	Confident	140 Å²	140	58 Å²	58	72%	0.718	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	62.9	-176.8	-44	179.5	0	0	0	111.1	G229 H233	G229-I231 PolarHBondContact O-N 2.92Å; G229-I231 VanDerWaalsContact O-N 3.13Å; I231-H233 PolarHBondContact O-N 2.71Å; I231-H233 PolarHBondContact O-ND1 3.31Å
232	G	54	Low	81	Confident	71 Å²	71	58 Å²	58	73%	0.732	32%	0.318	S	S	*	.	S	Bend	trans	65.5	-0.3	167.8	0	0	0	0	0	117.3
233	H	55	Low	81	Confident	97 Å²	97	58 Å²	58	45%	0.449	32%	0.318	S	S	.	.			trans	-103.8	123.1	175.5	-66.1	76.1	0	0	0	108.2	G229 I231	G229-H233 WeakPolarHBondContact CA-O 3.29Å; G229-H233 PolarHBondContact N-O 3.37Å; I231-H233 PolarHBondContact O-N 2.71Å; I231-H233 PolarHBondContact O-ND1 3.31Å
234	S	63.9	Low	81	Confident	20 Å²	20	58 Å²	58	14%	0.14	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.8	168.1	47.9	0	0	0	0	109	R13 E226 V227	R13-S234 PolarHBondContact NH1-OG 2.96Å; E226-S234 WeakPolarHBondContact OE1-CB 3.42Å; E226-S234 PolarHBondContact OE1-OG 2.75Å; V227-S234 CarbonylContact O-C 3.59Å; V227-S234 VanDerWaalsContact O-CA 3.31Å; V227-S234 WeakPolarHBondContact O-CA 3.14Å
235	K	77.6	Confident	81	Confident	108 Å²	108	57.8 Å²	57.8	47%	0.47	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.6	-178	-170.2	-176.9	-166.3	92.4	0	108.8	E184 V227	E184-K235 IonicContact OE1-NZ 2.62Å; E184-K235 PolarHBondContact OE1-NZ 3.22Å; V227-K235 PolarHBondContact N-O 2.98Å; V227-K235 PolarHBondContact O-N 2.75Å
236	E	85.3	Confident	81.1	Confident	41 Å²	41	54.6 Å²	54.6	19%	0.192	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	126.9	177.7	-61.5	161.3	175.9	0	0	109.2	R192 E224 Y238	R192-E236 IonicContact CZ-OE2 3.34Å; R192-E236 IonicContact NH1-OE2 3.53Å; R192-E236 PolarHBondContact NH1-OE2 3.37Å; R192-E236 IonicContact NH2-OE2 2.79Å; E224-E236 WeakPolarHBondContact OE1-CB 3.27Å; E236-Y238 HydrophobicContact CB-CE2 3.85Å
237	T	91	Very high	81.2	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.282	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.7	179.1	60.2	0	0	0	0	111.1	E224 R225	E224-T237 CarbonylContact C-O 3.58Å; E224-T237 VanDerWaalsContact CA-O 3.3Å; E224-T237 WeakPolarHBondContact CA-O 3.45Å; R225-T237 PolarHBondContact N-O 3.42Å; R225-T237 PolarHBondContact O-N 2.92Å; R225-T237 PolarHBondContact O-OG1 3.31Å
238	Y	94.9	Very high	81.8	Confident	36 Å²	36	52.4 Å²	52.4	14%	0.141	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.7	-171.7	-71.6	-116.6	0	0	0	110.1	H189 R192 I222 L223 E224 E236	H189-Y238 AromaticContact CE1-CE1 3.83Å; H189-Y238 AromaticContact ND1-CE1 3.59Å; H189-Y238 AromaticContact ND1-CZ 3.7Å; H189-Y238 PolarHBondContact ND1-OH 2.95Å; R192-Y238 HydrophobicContact CB-CD1 4.08Å; R192-Y238 HydrophobicContact CB-CE1 4.1Å; R192-Y238 HydrophobicContact CB-CG 4.34Å; R192-Y238 PolarHBondContact NH1-OH 3.17Å; I222-Y238 HydrophobicContact CG2-CD1 4.08Å; L223-Y238 WeakPolarHBondContact O-CA 3.4Å; E224-Y238 HydrophobicContact CG-CD2 4.38Å; E224-Y238 HydrophobicContact CG-CE1 4.46Å; E224-Y238 HydrophobicContact CG-CE2 3.95Å; E224-Y238 VanDerWaalsContact OE1-CE2 3.25Å; E224-Y238 WeakPolarHBondContact OE1-CE2 3.33Å; E224-Y238 PolarHBondContact OE1-OH 3.33Å; E224-Y238 PolarHBondContact OE2-OH 2.97Å; E236-Y238 HydrophobicContact CB-CE2 3.85Å
239	E	96.8	Very high	83	Confident	58 Å²	58	43.7 Å²	43.7	27%	0.271	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.5	-177.1	178.4	171.2	-136.5	0	0	111.8	I222 L223 R225 V241 L472	I222-E239 CarbonylContact C-O 3.47Å; I222-E239 WeakPolarHBondContact CA-O 3.34Å; L223-E239 PolarHBondContact N-O 3.37Å; L223-E239 PolarHBondContact O-N 3.01Å; R225-E239 IonicContact CZ-OE2 3.95Å; R225-E239 IonicContact NH1-OE2 2.79Å; R225-E239 PolarHBondContact NH1-OE2 3.48Å; R225-E239 IonicContact NH2-OE2 3.75Å; R225-E239 PolarHBondContact NH2-OE2 2.86Å; E239-V241 HydrophobicContact CG-CG1 4.23Å; E239-V241 PolarHBondContact O-N 2.8Å; E239-L472 VanDerWaalsContact CD-CD2 3.47Å; E239-L472 HydrophobicContact CG-CD2 4.09Å; E239-L472 VanDerWaalsContact OE1-CD2 3.29Å; E239-L472 WeakPolarHBondContact OE1-CD2 3.26Å
240	L	98.3	Very high	84.5	Confident	9 Å²	9	42 Å²	42	5%	0.047	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	111.5	171.9	-178.1	66.1	0	0	0	109.8	V196 V197 A220 A242 L243 W470	V196-L240 HydrophobicContact CG1-CB 3.93Å; V197-L240 HydrophobicContact CG2-CD1 4.23Å; A220-L240 HydrophobicContact CB-CD1 3.6Å; L240-A242 WeakPolarHBondContact CD1-O 3.45Å; L240-L243 HydrophobicContact CD2-CD1 3.98Å; L240-W470 HydrophobicContact CD2-CE3 4.48Å; L240-W470 HydrophobicContact CD2-CZ3 4.18Å; L240-W470 HydrophobicContact CG-CZ3 4Å; L240-W470 WeakPolarHBondContact O-CZ3 3.41Å
241	V	98.4	Very high	86.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-21.9	-178.6	-67.2	0	0	0	0	114.1	V221 L223 E239 L274 F277 S471 L472	V221-V241 HydrophobicContact CB-CG2 4.27Å; V221-V241 HydrophobicContact CG1-CG2 4.31Å; V221-V241 VanDerWaalsContact O-CG2 3.27Å; V221-V241 WeakPolarHBondContact O-CG2 3.42Å; V221-V241 PolarHBondContact O-N 3.25Å; L223-V241 HydrophobicContact CB-CG1 3.59Å; L223-V241 HydrophobicContact CB-CG2 4.09Å; L223-V241 HydrophobicContact CD2-CG1 4.26Å; L223-V241 HydrophobicContact CG-CG1 4.43Å; E239-V241 HydrophobicContact CG-CG1 4.23Å; E239-V241 PolarHBondContact O-N 2.8Å; V241-L274 HydrophobicContact CG2-CD1 3.9Å; V241-F277 HydrophobicContact CB-CD1 4.25Å; V241-F277 HydrophobicContact CB-CD2 4.08Å; V241-F277 HydrophobicContact CB-CE1 4.17Å; V241-F277 HydrophobicContact CB-CE2 4.01Å; V241-F277 HydrophobicContact CB-CG 4.19Å; V241-F277 HydrophobicContact CB-CZ 4.05Å; V241-F277 HydrophobicContact CG1-CD2 4.35Å; V241-F277 HydrophobicContact CG1-CE1 4.13Å; V241-F277 HydrophobicContact CG1-CE2 3.77Å; V241-F277 HydrophobicContact CG1-CZ 3.64Å; V241-F277 HydrophobicContact CG2-CD1 4.49Å; V241-F277 HydrophobicContact CG2-CE1 4.46Å; V241-S471 WeakPolarHBondContact O-CA 3.4Å; V241-L472 HydrophobicContact CG1-CD2 4.12Å; V241-L472 PolarHBondContact O-N 3.08Å
242	A	98.7	Very high	87.7	Confident	0 Å²	0	32 Å²	32	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	145.5	177.4	0	0	0	0	0	112.2	A220 V221 L240 A270 A273 L274 W470	A220-A242 CarbonylContact C-O 3.51Å; A220-A242 WeakPolarHBondContact CA-O 3.32Å; V221-A242 HydrophobicContact CB-CB 4.13Å; V221-A242 HydrophobicContact CG2-CB 4.12Å; V221-A242 PolarHBondContact N-O 2.89Å; V221-A242 PolarHBondContact O-N 3.48Å; L240-A242 WeakPolarHBondContact CD1-O 3.45Å; A242-A270 WeakPolarHBondContact CB-O 3.42Å; A242-A273 HydrophobicContact CB-CB 3.71Å; A242-L274 HydrophobicContact CB-CB 4.06Å; A242-W470 CarbonylContact C-O 3.59Å; A242-W470 WeakPolarHBondContact CA-O 3.47Å
243	L	98.4	Very high	89.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.3	179.7	-173.1	138.8	0	0	0	111.1	L201 V218 L240 T245 N469 W470	L201-L243 HydrophobicContact CD1-CD1 4.36Å; L201-L243 HydrophobicContact CD2-CD1 3.65Å; L201-L243 HydrophobicContact CD2-CD2 4.09Å; L201-L243 HydrophobicContact CG-CD1 3.7Å; V218-L243 HydrophobicContact CG1-CD1 4.27Å; V218-L243 HydrophobicContact CG1-CG 4.48Å; L240-L243 HydrophobicContact CD2-CD1 3.98Å; L243-T245 HydrophobicContact CD2-CG2 4.16Å; L243-N469 WeakPolarHBondContact O-CA 3.42Å; L243-W470 PolarHBondContact N-O 2.85Å; L243-W470 PolarHBondContact O-N 2.89Å
244	G	98	Very high	91	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	144.4	173.6	0	0	0	0	0	112.4	A219 G266 L468	A219-G244 PolarHBondContact N-O 3.15Å; A219-G244 PolarHBondContact O-N 2.9Å; G244-G266 WeakPolarHBondContact O-CA 3.32Å; G244-L468 CarbonylContact C-O 3.43Å; G244-L468 VanDerWaalsContact CA-O 3.3Å; G244-L468 WeakPolarHBondContact CA-O 3.24Å
245	T	96.4	Very high	92.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.			trans	-123.4	174.4	173.7	76	0	0	0	0	111.5	C214 T217 V218 L243 S467 L468	C214-T245 HydrophobicContact CB-CG2 4.07Å; T217-T245 WeakPolarHBondContact O-CA 3.2Å; V218-T245 HydrophobicContact CG2-CG2 3.68Å; L243-T245 HydrophobicContact CD2-CG2 4.16Å; T245-S467 WeakPolarHBondContact O-CB 3.4Å; T245-S467 PolarHBondContact O-OG 3.43Å; T245-L468 HydrophobicContact CG2-CB 4.09Å; T245-L468 HydrophobicContact CG2-CD1 4.31Å; T245-L468 HydrophobicContact CG2-CG 4.4Å; T245-L468 PolarHBondContact N-O 2.95Å; T245-L468 WeakPolarHBondContact OG1-CB 3.25Å; T245-L468 WeakPolarHBondContact OG1-CG 3.46Å; T245-L468 PolarHBondContact OG1-N 2.87Å
246	G	93.4	Very high	92.9	Very high	6 Å²	6	33.6 Å²	33.6	6%	0.062	18%	0.181	C	C	.	.			trans	112.1	154.3	176.7	0	0	0	0	0	112.9	T217 C264 H265 G266	T217-G246 PolarHBondContact OG1-N 3.16Å; G246-C264 CarbonylContact C-O 3.58Å; G246-C264 WeakPolarHBondContact CA-O 3.32Å; G246-H265 CarbonylContact O-C 3.39Å; G246-H265 WeakPolarHBondContact O-CA 3.44Å; G246-G266 PolarHBondContact O-N 2.79Å
247	S	89.7	Confident	93.2	Very high	52 Å²	52	33.6 Å²	33.6	36%	0.364	19%	0.185	S	C	.	.	S	Bend	trans	-127.4	13.8	-168.9	59.3	0	0	0	0	113.9	H265 K325	S247-H265 VanDerWaalsContact C-CD2 3.42Å; S247-H265 PolarHBondContact O-NE2 3.49Å; S247-K325 PolarHBondContact O-NZ 2.83Å
248	S	91.4	Very high	93.4	Very high	43 Å²	43	31.5 Å²	31.5	30%	0.301	17%	0.172	S	C	.	.			trans	-149.7	177.7	-171.9	-167.2	0	0	0	0	113.1	C264 H265	S248-C264 CarbonylContact O-C 3.53Å; S248-C264 WeakPolarHBondContact O-CA 3.4Å; S248-C264 WeakPolarHBondContact O-CB 3.13Å; S248-C264 PolarHBondContact O-N 3.39Å; S248-C264 VanDerWaalsContact O-N 3.14Å; S248-H265 VanDerWaalsContact C-CE1 3.5Å; S248-H265 PolarHBondContact O-N 2.94Å; S248-H265 PolarHBondContact O-ND1 3.48Å
249	S	92.4	Very high	93.4	Very high	4 Å²	4	36.4 Å²	36.4	3%	0.028	19%	0.191	C	C	.	.			trans	-135.8	154.2	178.8	55.7	0	0	0	0	110.4	A251 H262 H352	S249-A251 PolarHBondContact O-N 3.09Å; S249-H262 WeakPolarHBondContact CB-O 3.34Å; S249-H352 WeakPolarHBondContact OG-CB 3.39Å
250	C	91.3	Very high	93.3	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.014	18%	0.183	C	C	.	.			trans	-53.8	132	177.3	-46.6	0	0	0	0	110.7	L261 H262 V372 V482	C250-L261 PolarHBondContact SG-O 2.89Å; C250-H262 PolarHBondContact N-O 3.44Å; C250-V372 HydrophobicContact CB-CG1 4.24Å; C250-V372 VanDerWaalsContact O-CB 3.24Å; C250-V372 WeakPolarHBondContact O-CB 3.44Å; C250-V372 WeakPolarHBondContact O-CG1 3.38Å; C250-V482 VanDerWaalsContact CA-O 3.32Å; C250-V482 WeakPolarHBondContact CA-O 3.45Å; C250-V482 PolarHBondContact SG-O 3.45Å
251	A	87.8	Confident	93.2	Very high	47 Å²	47	34.7 Å²	34.7	39%	0.388	18%	0.181	S	C	.	.			trans	-89.3	-21.5	-173.7	0	0	0	0	0	114.5	S249	S249-A251 PolarHBondContact O-N 3.09Å
252	G	88.1	Confident	93	Very high	32 Å²	32	35.5 Å²	35.5	33%	0.33	19%	0.185	S	C	.	.	S	Bend	trans	-86.1	-163.9	-169.5	0	0	0	0	0	116.4	V372	G252-V372 WeakPolarHBondContact O-CB 3.29Å; G252-V372 VanDerWaalsContact O-CG2 3.28Å; G252-V372 WeakPolarHBondContact O-CG2 3.41Å; G252-V372 PolarHBondContact O-N 2.79Å
253	W	89.8	Confident	92.9	Very high	173 Å²	173	36 Å²	36	66%	0.655	19%	0.187	S	C	*	.	B	Isolated β-bridge	trans	-55.3	151.2	179.7	-54.4	96.8	0	0	0	114.1	R260 T370 H371	W253-R260 VanDerWaalsContact O-CZ 3.26Å; W253-R260 PolarHBondContact O-NH1 2.9Å; W253-R260 PolarHBondContact O-NH2 2.74Å; W253-T370 CarbonylContact C-O 3.58Å; W253-T370 WeakPolarHBondContact CA-O 3.47Å; W253-T370 HydrophobicContact CZ3-CG2 4.18Å; W253-H371 AromaticContact CD2-CE1 3.97Å; W253-H371 AromaticContact CE3-CE1 3.75Å; W253-H371 AromaticContact CH2-CE1 3.77Å; W253-H371 AromaticContact CZ2-CE1 3.98Å; W253-H371 AromaticContact CZ3-CE1 3.66Å
254	L	90.1	Very high	92.8	Very high	20 Å²	20	36 Å²	36	11%	0.105	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-66	132.5	173.4	-69.3	177.4	0	0	0	112.3	F256 D369 T370 H371 V372 K556 V559	L254-F256 HydrophobicContact CB-CE1 3.78Å; L254-F256 HydrophobicContact CB-CZ 3.88Å; L254-F256 HydrophobicContact CD1-CE1 4.1Å; L254-F256 HydrophobicContact CD1-CZ 4.47Å; L254-D369 WeakPolarHBondContact CD1-O 3.32Å; L254-T370 PolarHBondContact N-O 3.33Å; L254-H371 WeakPolarHBondContact CD2-O 3.44Å; L254-H371 WeakPolarHBondContact CG-O 3.34Å; L254-V372 HydrophobicContact CD2-CG2 3.96Å; L254-K556 HydrophobicContact CD1-CD 4.28Å; L254-K556 HydrophobicContact CD2-CD 3.96Å; L254-V559 HydrophobicContact CD1-CG2 4.21Å; L254-V559 HydrophobicContact CD2-CG2 4.28Å
255	E	89.5	Confident	92.7	Very high	49 Å²	49	36.5 Å²	36.5	23%	0.229	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-103.5	123.5	168.1	-165.4	-175	148.7	0	0	109.3	S257 R260 R486	E255-S257 VanDerWaalsContact CD-OG 3.28Å; E255-S257 WeakPolarHBondContact OE1-CB 3.48Å; E255-S257 PolarHBondContact OE1-OG 3.22Å; E255-R260 HydrophobicContact CB-CB 4.27Å; E255-R260 VanDerWaalsContact N-NH2 3.14Å; E255-R260 WeakPolarHBondContact OE2-CB 3.31Å; E255-R260 WeakPolarHBondContact OE2-CD 3.43Å; E255-R486 IonicContact OE1-NH2 3.23Å; E255-R486 PolarHBondContact OE1-NH2 3.2Å; E255-R486 IonicContact OE2-NE 2.78Å; E255-R486 IonicContact OE2-NH2 2.64Å; E255-R486 PolarHBondContact OE2-NH2 2.86Å
256	F	91.8	Very high	92.7	Very high	88 Å²	88	36.7 Å²	36.7	39%	0.386	19%	0.191	S	C	.	.			trans	-87.7	-12.9	-175.6	-53.4	-62.7	0	0	0	113.9	L254 G258 L558 V559 F562	L254-F256 HydrophobicContact CB-CE1 3.78Å; L254-F256 HydrophobicContact CB-CZ 3.88Å; L254-F256 HydrophobicContact CD1-CE1 4.1Å; L254-F256 HydrophobicContact CD1-CZ 4.47Å; F256-G258 PolarHBondContact O-N 2.54Å; F256-L558 HydrophobicContact CD1-CB 3.51Å; F256-L558 HydrophobicContact CE1-CB 3.62Å; F256-L558 HydrophobicContact CE1-CD1 4.18Å; F256-L558 HydrophobicContact CG-CB 4.19Å; F256-L558 HydrophobicContact CZ-CB 4.37Å; F256-L558 HydrophobicContact CZ-CD1 4.13Å; F256-V559 HydrophobicContact CD1-CG2 3.73Å; F256-V559 HydrophobicContact CE1-CG2 3.85Å; F256-F562 WeakPolarHBondContact O-CB 3.45Å; F256-F562 VanDerWaalsContact O-CD1 3.31Å; F256-F562 WeakPolarHBondContact O-CD1 3.45Å
257	S	91.6	Very high	92.8	Very high	41 Å²	41	36.9 Å²	36.9	29%	0.287	19%	0.191	S	C	.	.	S	Bend	trans	-59.9	-15.3	-176.5	73.9	0	0	0	0	116	E255 R259 F562	E255-S257 VanDerWaalsContact CD-OG 3.28Å; E255-S257 WeakPolarHBondContact OE1-CB 3.48Å; E255-S257 PolarHBondContact OE1-OG 3.22Å; S257-R259 PolarHBondContact O-N 3.19Å; S257-R259 WeakPolarHBondContact OG-CB 3.1Å; S257-R259 PolarHBondContact OG-N 3.13Å; S257-F562 WeakPolarHBondContact O-CD2 3.25Å
258	G	94.5	Very high	93.2	Very high	1 Å²	1	35 Å²	35	1%	0.01	18%	0.177	C	C	.	.	S	Bend	trans	73.3	-7.1	-170.1	0	0	0	0	0	115.5	F256 K501 A502 F562	F256-G258 PolarHBondContact O-N 2.54Å; G258-K501 WeakPolarHBondContact O-CA 3.37Å; G258-K501 WeakPolarHBondContact O-CB 3.43Å; G258-K501 PolarHBondContact O-N 2.79Å; G258-A502 PolarHBondContact O-N 3.05Å; G258-A502 VanDerWaalsContact O-N 3.13Å; G258-F562 VanDerWaalsContact CA-CE1 3.49Å
259	R	95.3	Very high	93.6	Very high	140 Å²	140	32.9 Å²	32.9	53%	0.528	16%	0.163	S	C	.	.			trans	-81.9	-17	-173.1	-66.7	-175.6	178.4	-148.9	-1.8	114.6	S257 P496 C500 A502	S257-R259 PolarHBondContact O-N 3.19Å; S257-R259 WeakPolarHBondContact OG-CB 3.1Å; S257-R259 PolarHBondContact OG-N 3.13Å; R259-P496 HydrophobicContact CB-CB 3.93Å; R259-P496 HydrophobicContact CB-CG 3.87Å; R259-P496 HydrophobicContact CG-CB 4.37Å; R259-P496 HydrophobicContact CG-CG 4.09Å; R259-P496 WeakPolarHBondContact O-CB 3.42Å; R259-C500 VanDerWaalsContact O-CB 3.25Å; R259-C500 WeakPolarHBondContact O-CB 3.43Å; R259-A502 HydrophobicContact CG-CB 4.17Å
260	R	94.8	Very high	93.9	Very high	31 Å²	31	32.8 Å²	32.8	12%	0.117	16%	0.162	C	C	.	.	S	Bend	trans	-96.8	140.2	179	-147	-177.3	55.4	-167.5	-8.3	112.5	W253 E255 H262 T484 R486	W253-R260 VanDerWaalsContact O-CZ 3.26Å; W253-R260 PolarHBondContact O-NH1 2.9Å; W253-R260 PolarHBondContact O-NH2 2.74Å; E255-R260 HydrophobicContact CB-CB 4.27Å; E255-R260 VanDerWaalsContact N-NH2 3.14Å; E255-R260 WeakPolarHBondContact OE2-CB 3.31Å; E255-R260 WeakPolarHBondContact OE2-CD 3.43Å; R260-H262 PolarHBondContact NH2-CD2 2.81Å; R260-H262 PolarHBondContact NH2-NE2 2.94Å; R260-T484 WeakPolarHBondContact CD-O 3.23Å; R260-T484 WeakPolarHBondContact CG-O 3.45Å; R260-R486 HydrophobicContact CG-CG 4.37Å
261	L	96.1	Very high	94.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.			trans	-70.4	146.3	157.9	-66.6	174.3	0	0	0	108.8	C250 I269 R272 V480 G485 L499	C250-L261 PolarHBondContact SG-O 2.89Å; L261-I269 HydrophobicContact CD1-CD1 3.99Å; L261-R272 VanDerWaalsContact CD2-NE 3.27Å; L261-V480 HydrophobicContact CD1-CB 4.47Å; L261-V480 HydrophobicContact CD1-CG1 3.92Å; L261-V480 HydrophobicContact CD1-CG2 3.95Å; L261-G485 PolarHBondContact N-O 3.46Å; L261-L499 HydrophobicContact CD2-CB 4.19Å; L261-L499 WeakPolarHBondContact CD2-O 3.09Å
262	H	94.7	Very high	94.8	Very high	17 Å²	17	33.6 Å²	33.6	8%	0.079	15%	0.154	C	C	.	.	S	Bend	trans	-114.1	-13.7	178.3	-79.2	-158.2	0	0	0	111.4	S249 C250 R260 V372 C374	S249-H262 WeakPolarHBondContact CB-O 3.34Å; C250-H262 PolarHBondContact N-O 3.44Å; R260-H262 PolarHBondContact NH2-CD2 2.81Å; R260-H262 PolarHBondContact NH2-NE2 2.94Å; H262-V372 HydrophobicContact CB-CG1 3.77Å; H262-V372 WeakPolarHBondContact O-CG1 3.46Å; H262-C374 PolarHBondContact O-SG 2.9Å
263	D	95.6	Very high	95.3	Very high	10 Å²	10	32 Å²	32	5%	0.053	14%	0.139	C	C	.	.			trans	-150.3	123	-169.5	-165.4	-35.1	0	0	0	107.5	H265 V268 I269 C374 K380	D263-H265 IonicContact OD1-CE1 3.81Å; D263-H265 IonicContact OD1-CG 3.46Å; D263-H265 PolarHBondContact OD1-N 3.48Å; D263-H265 IonicContact OD1-ND1 3.86Å; D263-H265 PolarHBondContact OD1-ND1 3.15Å; D263-V268 HydrophobicContact CB-CG1 4.17Å; D263-I269 WeakPolarHBondContact O-CD1 3.2Å; D263-C374 HydrophobicContact CB-CB 4.34Å; D263-C374 WeakPolarHBondContact OD2-CB 3.34Å; D263-K380 IonicContact OD1-NZ 3.77Å; D263-K380 WeakPolarHBondContact OD2-CE 3.35Å; D263-K380 IonicContact OD2-NZ 2.7Å; D263-K380 PolarHBondContact OD2-NZ 3.22Å
264	C	96.3	Very high	95.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.108	C	C	.	.			trans	-128	23.3	-169.7	-64.1	0	0	0	0	111.2	G246 S248 S467 V482	G246-C264 CarbonylContact C-O 3.58Å; G246-C264 WeakPolarHBondContact CA-O 3.32Å; S248-C264 CarbonylContact O-C 3.53Å; S248-C264 WeakPolarHBondContact O-CA 3.4Å; S248-C264 WeakPolarHBondContact O-CB 3.13Å; S248-C264 PolarHBondContact O-N 3.39Å; S248-C264 VanDerWaalsContact O-N 3.14Å; C264-S467 PolarHBondContact O-OG 2.82Å; C264-V482 HydrophobicContact CB-CB 4.25Å; C264-V482 HydrophobicContact CB-CG1 3.88Å; C264-V482 HydrophobicContact CB-CG2 3.52Å
265	H	95.6	Very high	96.1	Very high	11 Å²	11	23.7 Å²	23.7	5%	0.051	11%	0.107	C	C	.	.			trans	-68.7	135.2	166.3	-64.7	88.6	0	0	0	109.3	G246 S247 S248 D263 L267 V268 I269 H352	G246-H265 CarbonylContact O-C 3.39Å; G246-H265 WeakPolarHBondContact O-CA 3.44Å; S247-H265 VanDerWaalsContact C-CD2 3.42Å; S247-H265 PolarHBondContact O-NE2 3.49Å; S248-H265 VanDerWaalsContact C-CE1 3.5Å; S248-H265 PolarHBondContact O-N 2.94Å; S248-H265 PolarHBondContact O-ND1 3.48Å; D263-H265 IonicContact OD1-CE1 3.81Å; D263-H265 IonicContact OD1-CG 3.46Å; D263-H265 PolarHBondContact OD1-N 3.48Å; D263-H265 IonicContact OD1-ND1 3.86Å; D263-H265 PolarHBondContact OD1-ND1 3.15Å; H265-L267 VanDerWaalsContact C-N 3.28Å; H265-L267 PolarHBondContact O-N 3.12Å; H265-L267 VanDerWaalsContact O-N 3.12Å; H265-V268 HydrophobicContact CB-CG2 4.19Å; H265-V268 WeakPolarHBondContact O-CA 3.43Å; H265-V268 WeakPolarHBondContact O-CB 3.32Å; H265-V268 PolarHBondContact O-N 2.98Å; H265-I269 PolarHBondContact O-N 3.1Å; H265-H352 AromaticContact CE1-CD2 3.58Å; H265-H352 AromaticContact CE1-CG 3.97Å; H265-H352 AromaticContact CE1-NE2 3.75Å; H265-H352 AromaticContact NE2-CD2 3.87Å; H265-H352 AromaticContact NE2-CE1 3.8Å; H265-H352 AromaticContact NE2-NE2 3.53Å
266	G	96.6	Very high	96.5	Very high	3 Å²	3	24.6 Å²	24.6	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-48.1	-46.4	-174.2	0	0	0	0	0	113.6	A219 G244 G246 V268 I269 A270	A219-G266 VanDerWaalsContact CB-C 3.49Å; G244-G266 WeakPolarHBondContact O-CA 3.32Å; G246-G266 PolarHBondContact O-N 2.79Å; G266-V268 VanDerWaalsContact C-N 3.31Å; G266-V268 PolarHBondContact O-N 2.83Å; G266-I269 PolarHBondContact O-N 3.45Å; G266-I269 VanDerWaalsContact O-N 3.14Å; G266-A270 WeakPolarHBondContact O-CB 3.35Å; G266-A270 PolarHBondContact O-N 3.48Å
267	L	97.2	Very high	96.9	Very high	11 Å²	11	20.4 Å²	20.4	6%	0.058	9%	0.09	C	C	.	.	H	α-helix	trans	-60.2	-35.6	178	178.1	59.9	0	0	0	113.7	A219 H265 R271 L318 V320 A377 L381 W384	A219-L267 VanDerWaalsContact CB-CA 3.43Å; A219-L267 HydrophobicContact CB-CB 4.01Å; A219-L267 HydrophobicContact CB-CD1 4.48Å; A219-L267 VanDerWaalsContact CB-N 3.33Å; H265-L267 VanDerWaalsContact C-N 3.28Å; H265-L267 PolarHBondContact O-N 3.12Å; H265-L267 VanDerWaalsContact O-N 3.12Å; L267-R271 PolarHBondContact O-N 3.11Å; L267-L318 HydrophobicContact CD1-CD1 4.47Å; L267-V320 HydrophobicContact CD1-CG2 4.07Å; L267-A377 HydrophobicContact CD2-CB 4.41Å; L267-L381 HydrophobicContact CD2-CD2 4.41Å; L267-W384 HydrophobicContact CD1-CZ3 4.08Å; L267-W384 HydrophobicContact CD2-CZ3 4.33Å; L267-W384 HydrophobicContact CG-CH2 4.35Å; L267-W384 HydrophobicContact CG-CZ3 3.86Å
268	V	98	Very high	97.2	Very high	11 Å²	11	18.5 Å²	18.5	7%	0.067	8%	0.076	C	C	.	.	H	α-helix	trans	-73.8	-39.6	176.7	-174.8	0	0	0	0	110.6	D263 H265 G266 R272 K380 W384	D263-V268 HydrophobicContact CB-CG1 4.17Å; H265-V268 HydrophobicContact CB-CG2 4.19Å; H265-V268 WeakPolarHBondContact O-CA 3.43Å; H265-V268 WeakPolarHBondContact O-CB 3.32Å; H265-V268 PolarHBondContact O-N 2.98Å; G266-V268 VanDerWaalsContact C-N 3.31Å; G266-V268 PolarHBondContact O-N 2.83Å; V268-R272 VanDerWaalsContact O-CG 3.28Å; V268-R272 WeakPolarHBondContact O-CG 3.38Å; V268-R272 PolarHBondContact O-N 3.28Å; V268-R272 VanDerWaalsContact O-N 3.07Å; V268-K380 HydrophobicContact CG2-CD 3.59Å; V268-W384 HydrophobicContact CG2-CH2 4.39Å
269	I	98.6	Very high	97.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-70.2	-44.4	179.5	-65.9	-65.5	0	0	0	111.3	L261 D263 H265 G266 R271 R272 A273 N469 L499	L261-I269 HydrophobicContact CD1-CD1 3.99Å; D263-I269 WeakPolarHBondContact O-CD1 3.2Å; H265-I269 PolarHBondContact O-N 3.1Å; G266-I269 PolarHBondContact O-N 3.45Å; G266-I269 VanDerWaalsContact O-N 3.14Å; I269-R271 VanDerWaalsContact C-N 3.34Å; I269-R271 PolarHBondContact O-N 2.83Å; I269-R272 CarbonylContact O-C 3.5Å; I269-R272 WeakPolarHBondContact O-CA 3.4Å; I269-R272 WeakPolarHBondContact O-CB 3.45Å; I269-R272 PolarHBondContact O-N 2.84Å; I269-A273 PolarHBondContact O-N 3.25Å; I269-N469 HydrophobicContact CG2-CB 3.35Å; I269-L499 HydrophobicContact CG2-CD1 4Å
270	A	98.6	Very high	97.5	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.008	6%	0.064	C	C	.	.	H	α-helix	trans	-57.4	-44.9	174.2	0	0	0	0	0	111.5	A219 V221 A242 G266 R272 A273 L274	A219-A270 HydrophobicContact CB-CB 4.13Å; A219-A270 WeakPolarHBondContact O-CB 3.34Å; V221-A270 HydrophobicContact CG2-CB 4.42Å; A242-A270 WeakPolarHBondContact CB-O 3.42Å; G266-A270 WeakPolarHBondContact O-CB 3.35Å; G266-A270 PolarHBondContact O-N 3.48Å; A270-R272 VanDerWaalsContact C-N 3.33Å; A270-R272 PolarHBondContact O-N 2.93Å; A270-A273 PolarHBondContact O-N 3.17Å; A270-L274 PolarHBondContact O-N 2.81Å
271	R	98.6	Very high	97.7	Very high	30 Å²	30	14.5 Å²	14.5	11%	0.113	6%	0.062	C	C	.	.	H	α-helix	trans	-62.5	-37	172.8	-177.5	-176.1	164.4	-72.9	-5.7	112.5	L267 I269 L274 L275 W384 L389	L267-R271 PolarHBondContact O-N 3.11Å; I269-R271 VanDerWaalsContact C-N 3.34Å; I269-R271 PolarHBondContact O-N 2.83Å; R271-L274 WeakPolarHBondContact O-CB 3.41Å; R271-L274 PolarHBondContact O-N 2.62Å; R271-L275 WeakPolarHBondContact O-CG 3.1Å; R271-L275 PolarHBondContact O-N 3.07Å; R271-L275 VanDerWaalsContact O-N 3.11Å; R271-W384 HydrophobicContact CB-CH2 4.15Å; R271-W384 HydrophobicContact CB-CZ3 4.22Å; R271-W384 VanDerWaalsContact CD-CH2 3.5Å; R271-W384 HydrophobicContact CG-CH2 4.48Å; R271-L389 HydrophobicContact CG-CB 4.5Å; R271-L389 HydrophobicContact CG-CD2 4.11Å; R271-L389 PolarHBondContact NE-O 3.09Å; R271-L389 PolarHBondContact NH2-O 3.48Å
272	R	98.7	Very high	97.8	Very high	36 Å²	36	14.5 Å²	14.5	14%	0.136	6%	0.062	C	C	.	.	H	α-helix	trans	-67.2	-41.6	175.8	-70.5	174.9	92	93.6	11.1	111.4	L261 V268 I269 A270 L274 L275 R276 L499 F504	L261-R272 VanDerWaalsContact CD2-NE 3.27Å; V268-R272 VanDerWaalsContact O-CG 3.28Å; V268-R272 WeakPolarHBondContact O-CG 3.38Å; V268-R272 PolarHBondContact O-N 3.28Å; V268-R272 VanDerWaalsContact O-N 3.07Å; I269-R272 CarbonylContact O-C 3.5Å; I269-R272 WeakPolarHBondContact O-CA 3.4Å; I269-R272 WeakPolarHBondContact O-CB 3.45Å; I269-R272 PolarHBondContact O-N 2.84Å; A270-R272 VanDerWaalsContact C-N 3.33Å; A270-R272 PolarHBondContact O-N 2.93Å; R272-L274 VanDerWaalsContact C-N 3.27Å; R272-L274 PolarHBondContact O-N 3.3Å; R272-L275 WeakPolarHBondContact O-CB 3.24Å; R272-L275 PolarHBondContact O-N 3.41Å; R272-L275 VanDerWaalsContact O-N 3.1Å; R272-R276 PolarHBondContact O-N 3.28Å; R272-R276 VanDerWaalsContact O-N 3.17Å; R272-L499 HydrophobicContact CB-CB 4.13Å; R272-L499 HydrophobicContact CB-CD1 3.96Å; R272-L499 HydrophobicContact CB-CD2 4.41Å; R272-L499 HydrophobicContact CB-CG 4.41Å; R272-L499 PolarHBondContact NE-O 3.08Å; R272-L499 PolarHBondContact NH2-O 3.05Å; R272-F504 HydrophobicContact CB-CE2 4.26Å; R272-F504 HydrophobicContact CB-CZ 4.02Å; R272-F504 HydrophobicContact CG-CE2 4.34Å; R272-F504 VanDerWaalsContact O-CZ 3.27Å; R272-F504 WeakPolarHBondContact O-CZ 3.49Å
273	A	98.8	Very high	97.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.4	-35.9	171.2	0	0	0	0	0	111.9	A242 I269 A270 L275 R276 F277 W470 S471 L499	A242-A273 HydrophobicContact CB-CB 3.71Å; I269-A273 PolarHBondContact O-N 3.25Å; A270-A273 PolarHBondContact O-N 3.17Å; A273-L275 VanDerWaalsContact C-N 3.35Å; A273-L275 PolarHBondContact O-N 3.4Å; A273-R276 WeakPolarHBondContact O-CB 3.06Å; A273-R276 PolarHBondContact O-N 2.88Å; A273-F277 PolarHBondContact O-N 2.84Å; A273-W470 VanDerWaalsContact CB-O 3.28Å; A273-W470 WeakPolarHBondContact CB-O 3.33Å; A273-S471 WeakPolarHBondContact O-CB 3.36Å; A273-S471 PolarHBondContact O-OG 3.49Å; A273-S471 VanDerWaalsContact O-OG 3.05Å; A273-L499 HydrophobicContact CB-CD1 4.33Å; A273-L499 HydrophobicContact CB-CD2 4.46Å
274	L	98.8	Very high	98	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-63.5	-36	171.8	-172.3	70	0	0	0	112.8	V221 V241 A242 A270 R271 R272 R276 F277 F278 L316 L389	V221-L274 HydrophobicContact CB-CD1 4.12Å; V221-L274 HydrophobicContact CG1-CD1 3.83Å; V221-L274 HydrophobicContact CG1-CD2 4.04Å; V221-L274 HydrophobicContact CG1-CG 4.46Å; V221-L274 HydrophobicContact CG2-CB 4.17Å; V221-L274 HydrophobicContact CG2-CD1 4.44Å; V221-L274 HydrophobicContact CG2-CD2 4.21Å; V221-L274 HydrophobicContact CG2-CG 4.5Å; V241-L274 HydrophobicContact CG2-CD1 3.9Å; A242-L274 HydrophobicContact CB-CB 4.06Å; A270-L274 PolarHBondContact O-N 2.81Å; R271-L274 WeakPolarHBondContact O-CB 3.41Å; R271-L274 PolarHBondContact O-N 2.62Å; R272-L274 VanDerWaalsContact C-N 3.27Å; R272-L274 PolarHBondContact O-N 3.3Å; L274-R276 VanDerWaalsContact C-N 3.34Å; L274-F277 HydrophobicContact CD1-CD1 4.12Å; L274-F277 WeakPolarHBondContact O-CB 3.24Å; L274-F277 PolarHBondContact O-N 2.61Å; L274-F278 HydrophobicContact CD1-CD2 4.11Å; L274-F278 HydrophobicContact CD1-CE2 3.59Å; L274-F278 HydrophobicContact CD1-CZ 4.44Å; L274-F278 HydrophobicContact CD2-CE2 4.06Å; L274-F278 HydrophobicContact CG-CD2 3.87Å; L274-F278 HydrophobicContact CG-CE2 3.65Å; L274-F278 VanDerWaalsContact O-CD2 3.29Å; L274-F278 WeakPolarHBondContact O-CD2 3.37Å; L274-F278 PolarHBondContact O-N 3Å; L274-L316 HydrophobicContact CD1-CD2 4.2Å; L274-L389 HydrophobicContact CD2-CB 4.03Å; L274-L389 HydrophobicContact CD2-CD1 3.81Å; L274-L389 HydrophobicContact CD2-CG 4.5Å
275	L	98.7	Very high	98	Very high	17 Å²	17	16.9 Å²	16.9	9%	0.089	8%	0.076	C	C	.	.	H	α-helix	trans	-63.1	-42.1	172.7	-55.6	-171.7	0	0	0	111.4	R271 R272 A273 F277 F278 F279 L389 G390 L394 F504	R271-L275 WeakPolarHBondContact O-CG 3.1Å; R271-L275 PolarHBondContact O-N 3.07Å; R271-L275 VanDerWaalsContact O-N 3.11Å; R272-L275 WeakPolarHBondContact O-CB 3.24Å; R272-L275 PolarHBondContact O-N 3.41Å; R272-L275 VanDerWaalsContact O-N 3.1Å; A273-L275 VanDerWaalsContact C-N 3.35Å; A273-L275 PolarHBondContact O-N 3.4Å; L275-F277 VanDerWaalsContact C-N 3.34Å; L275-F278 PolarHBondContact O-N 3.26Å; L275-F279 WeakPolarHBondContact O-CD2 3.46Å; L275-F279 PolarHBondContact O-N 3.23Å; L275-L389 WeakPolarHBondContact CD2-O 3.4Å; L275-G390 WeakPolarHBondContact CD2-O 3.09Å; L275-L394 HydrophobicContact CD2-CD1 3.82Å; L275-F504 HydrophobicContact CB-CD1 4.26Å; L275-F504 HydrophobicContact CB-CE1 3.69Å; L275-F504 HydrophobicContact CB-CZ 3.98Å; L275-F504 HydrophobicContact CD1-CE2 4.27Å; L275-F504 HydrophobicContact CD1-CZ 4.29Å
276	R	98.4	Very high	98	Very high	67 Å²	67	18.1 Å²	18.1	25%	0.253	8%	0.082	S	C	.	.	H	α-helix	trans	-62.4	-41.2	176.3	-179.3	174.6	176.3	76.2	-2.3	111.3	R272 A273 L274 R280 D474 L499 F504	R272-R276 PolarHBondContact O-N 3.28Å; R272-R276 VanDerWaalsContact O-N 3.17Å; A273-R276 WeakPolarHBondContact O-CB 3.06Å; A273-R276 PolarHBondContact O-N 2.88Å; L274-R276 VanDerWaalsContact C-N 3.34Å; R276-R280 PolarHBondContact O-N 3.12Å; R276-D474 WeakPolarHBondContact CD-OD2 3.38Å; R276-D474 IonicContact CZ-OD1 3Å; R276-D474 VanDerWaalsContact CZ-OD1 3.28Å; R276-D474 IonicContact CZ-OD2 2.77Å; R276-D474 IonicContact NE-OD1 2.95Å; R276-D474 PolarHBondContact NE-OD1 3.29Å; R276-D474 IonicContact NE-OD2 3.36Å; R276-D474 PolarHBondContact NE-OD2 2.74Å; R276-D474 IonicContact NH2-OD1 3.02Å; R276-D474 PolarHBondContact NH2-OD1 2.76Å; R276-L499 HydrophobicContact CB-CD2 4.09Å; R276-F504 HydrophobicContact CB-CE1 4.24Å
277	F	98.6	Very high	98	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-56.7	-54	170.5	174.3	-106.6	0	0	0	111.3	V241 A273 L274 L275 F279 R280 Q281 V297 S471 L472	V241-F277 HydrophobicContact CB-CD1 4.25Å; V241-F277 HydrophobicContact CB-CD2 4.08Å; V241-F277 HydrophobicContact CB-CE1 4.17Å; V241-F277 HydrophobicContact CB-CE2 4.01Å; V241-F277 HydrophobicContact CB-CG 4.19Å; V241-F277 HydrophobicContact CB-CZ 4.05Å; V241-F277 HydrophobicContact CG1-CD2 4.35Å; V241-F277 HydrophobicContact CG1-CE1 4.13Å; V241-F277 HydrophobicContact CG1-CE2 3.77Å; V241-F277 HydrophobicContact CG1-CZ 3.64Å; V241-F277 HydrophobicContact CG2-CD1 4.49Å; V241-F277 HydrophobicContact CG2-CE1 4.46Å; A273-F277 PolarHBondContact O-N 2.84Å; L274-F277 HydrophobicContact CD1-CD1 4.12Å; L274-F277 WeakPolarHBondContact O-CB 3.24Å; L274-F277 PolarHBondContact O-N 2.61Å; L275-F277 VanDerWaalsContact C-N 3.34Å; F277-F279 PolarHBondContact O-N 2.83Å; F277-R280 WeakPolarHBondContact O-CA 3.3Å; F277-R280 WeakPolarHBondContact O-CB 3.48Å; F277-R280 PolarHBondContact O-N 3.07Å; F277-Q281 HydrophobicContact CD1-CG 4.01Å; F277-Q281 HydrophobicContact CD2-CG 4.09Å; F277-Q281 HydrophobicContact CE1-CG 3.7Å; F277-Q281 HydrophobicContact CE2-CG 3.77Å; F277-Q281 HydrophobicContact CG-CG 4.21Å; F277-Q281 HydrophobicContact CZ-CG 3.57Å; F277-Q281 WeakPolarHBondContact O-CG 3.2Å; F277-Q281 PolarHBondContact O-N 3.44Å; F277-V297 HydrophobicContact CE1-CG1 4.43Å; F277-V297 HydrophobicContact CE1-CG2 4.04Å; F277-V297 HydrophobicContact CZ-CG1 3.93Å; F277-V297 HydrophobicContact CZ-CG2 4.23Å; F277-S471 WeakPolarHBondContact CB-OG 3.49Å; F277-S471 PolarHBondContact N-OG 2.98Å; F277-L472 HydrophobicContact CD2-CB 4.12Å; F277-L472 HydrophobicContact CE2-CB 4.3Å; F277-L472 HydrophobicContact CE2-CD2 4.1Å
278	F	98.7	Very high	97.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.2	-33.5	-177.2	-79.7	-62.9	0	0	0	114.5	L274 L275 R280 Q281 L282 V297 L298 L310 L316 L394 L398 L401	L274-F278 HydrophobicContact CD1-CD2 4.11Å; L274-F278 HydrophobicContact CD1-CE2 3.59Å; L274-F278 HydrophobicContact CD1-CZ 4.44Å; L274-F278 HydrophobicContact CD2-CE2 4.06Å; L274-F278 HydrophobicContact CG-CD2 3.87Å; L274-F278 HydrophobicContact CG-CE2 3.65Å; L274-F278 VanDerWaalsContact O-CD2 3.29Å; L274-F278 WeakPolarHBondContact O-CD2 3.37Å; L274-F278 PolarHBondContact O-N 3Å; L275-F278 PolarHBondContact O-N 3.26Å; F278-R280 VanDerWaalsContact C-N 3.33Å; F278-R280 PolarHBondContact O-N 2.9Å; F278-Q281 PolarHBondContact O-N 3.48Å; F278-L282 WeakPolarHBondContact O-CG 3.37Å; F278-L282 PolarHBondContact O-N 3.19Å; F278-V297 HydrophobicContact CD1-CG2 4.42Å; F278-V297 HydrophobicContact CE1-CG2 3.81Å; F278-L298 HydrophobicContact CD1-CD2 4.23Å; F278-L298 HydrophobicContact CE1-CD2 4.21Å; F278-L310 HydrophobicContact CE1-CD2 3.77Å; F278-L310 HydrophobicContact CZ-CD2 4.05Å; F278-L316 HydrophobicContact CE2-CD1 4.15Å; F278-L316 HydrophobicContact CZ-CD1 4.06Å; F278-L316 HydrophobicContact CZ-CD2 4.27Å; F278-L394 HydrophobicContact CB-CD1 3.64Å; F278-L394 HydrophobicContact CB-CD2 4.26Å; F278-L394 HydrophobicContact CG-CD1 4.42Å; F278-L398 HydrophobicContact CB-CD1 4.12Å; F278-L398 HydrophobicContact CD1-CD1 3.98Å; F278-L398 HydrophobicContact CG-CD1 4.17Å; F278-L401 HydrophobicContact CD1-CD1 4.14Å; F278-L401 HydrophobicContact CD2-CD1 3.56Å; F278-L401 HydrophobicContact CE1-CD1 4.1Å; F278-L401 HydrophobicContact CE2-CD1 3.51Å; F278-L401 HydrophobicContact CG-CD1 3.9Å; F278-L401 HydrophobicContact CZ-CD1 3.81Å
279	F	98.6	Very high	97.5	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-38	170.1	-78.5	-64.2	0	0	0	112.5	L275 F277 L283 L393 L394 F397 F504 A507 F508 V511	L275-F279 WeakPolarHBondContact O-CD2 3.46Å; L275-F279 PolarHBondContact O-N 3.23Å; F277-F279 PolarHBondContact O-N 2.83Å; F279-L283 WeakPolarHBondContact O-CG 3.34Å; F279-L283 PolarHBondContact O-N 3.4Å; F279-L393 HydrophobicContact CZ-CB 3.99Å; F279-L394 HydrophobicContact CD1-CD2 3.76Å; F279-L394 HydrophobicContact CD2-CD2 4.1Å; F279-L394 HydrophobicContact CE1-CD2 3.57Å; F279-L394 HydrophobicContact CE1-CG 4.43Å; F279-L394 HydrophobicContact CE2-CD2 3.93Å; F279-L394 HydrophobicContact CE2-CG 4.17Å; F279-L394 HydrophobicContact CG-CD2 4.02Å; F279-L394 HydrophobicContact CZ-CD2 3.66Å; F279-L394 HydrophobicContact CZ-CG 4.05Å; F279-F397 HydrophobicContact CE1-CD2 4.4Å; F279-F397 HydrophobicContact CE1-CE2 4.27Å; F279-F504 HydrophobicContact CD2-CD1 4.16Å; F279-F504 HydrophobicContact CE2-CB 4.48Å; F279-F504 HydrophobicContact CE2-CD1 4.02Å; F279-A507 HydrophobicContact CB-CB 3.99Å; F279-A507 HydrophobicContact CD1-CB 4.03Å; F279-A507 HydrophobicContact CD2-CB 3.88Å; F279-A507 HydrophobicContact CE2-CB 4.38Å; F279-A507 HydrophobicContact CG-CB 3.71Å; F279-F508 HydrophobicContact CE1-CB 4.14Å; F279-F508 HydrophobicContact CZ-CB 4.18Å; F279-V511 HydrophobicContact CD1-CG2 4Å
280	R	97.8	Very high	97.3	Very high	63 Å²	63	30.9 Å²	30.9	24%	0.238	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-43.3	171.4	-70.5	171.6	161.9	136.5	1.8	112.2	R276 F277 F278 L282 L283 L284 L472 G473 D474	R276-R280 PolarHBondContact O-N 3.12Å; F277-R280 WeakPolarHBondContact O-CA 3.3Å; F277-R280 WeakPolarHBondContact O-CB 3.48Å; F277-R280 PolarHBondContact O-N 3.07Å; F278-R280 VanDerWaalsContact C-N 3.33Å; F278-R280 PolarHBondContact O-N 2.9Å; R280-L282 VanDerWaalsContact C-N 3.29Å; R280-L282 PolarHBondContact O-N 3.3Å; R280-L283 PolarHBondContact O-N 3.21Å; R280-L284 VanDerWaalsContact O-CB 3.3Å; R280-L284 WeakPolarHBondContact O-CB 3.31Å; R280-L284 PolarHBondContact O-N 2.88Å; R280-L472 PolarHBondContact NH1-O 2.94Å; R280-G473 VanDerWaalsContact CZ-O 3.27Å; R280-G473 VanDerWaalsContact NH2-C 3.32Å; R280-G473 PolarHBondContact NH2-O 2.96Å; R280-D474 IonicContact CZ-OD1 3.91Å; R280-D474 IonicContact CZ-OD2 3.93Å; R280-D474 VanDerWaalsContact NH1-CG 3.3Å; R280-D474 IonicContact NH1-OD1 3.27Å; R280-D474 IonicContact NH1-OD2 3.25Å; R280-D474 PolarHBondContact NH1-OD2 3.44Å; R280-D474 VanDerWaalsContact NH2-CG 3.25Å; R280-D474 IonicContact NH2-OD1 2.91Å; R280-D474 PolarHBondContact NH2-OD1 3.15Å; R280-D474 IonicContact NH2-OD2 3.28Å
281	Q	98.1	Very high	97	Very high	18 Å²	18	38.8 Å²	38.8	8%	0.084	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-34.2	-178.9	-65.8	-65.5	-45.6	0	0	112.3	F277 F278 A285 S296 V297 L298	F277-Q281 HydrophobicContact CD1-CG 4.01Å; F277-Q281 HydrophobicContact CD2-CG 4.09Å; F277-Q281 HydrophobicContact CE1-CG 3.7Å; F277-Q281 HydrophobicContact CE2-CG 3.77Å; F277-Q281 HydrophobicContact CG-CG 4.21Å; F277-Q281 HydrophobicContact CZ-CG 3.57Å; F277-Q281 WeakPolarHBondContact O-CG 3.2Å; F277-Q281 PolarHBondContact O-N 3.44Å; F278-Q281 PolarHBondContact O-N 3.48Å; Q281-A285 WeakPolarHBondContact O-CB 3.48Å; Q281-A285 PolarHBondContact O-N 2.84Å; Q281-S296 PolarHBondContact O-OG 2.59Å; Q281-S296 VanDerWaalsContact OE1-CA 3.25Å; Q281-S296 PolarHBondContact OE1-OG 2.86Å; Q281-V297 HydrophobicContact CB-CG2 4.14Å; Q281-V297 HydrophobicContact CG-CG2 3.82Å; Q281-L298 HydrophobicContact CB-CD1 3.79Å; Q281-L298 HydrophobicContact CB-CG 4.08Å
282	L	98.3	Very high	96.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-54.8	171.8	-76.4	163.1	0	0	0	110.8	F278 R280 L284 A285 I286 L298 F308 L394 F397 L398 V511	F278-L282 WeakPolarHBondContact O-CG 3.37Å; F278-L282 PolarHBondContact O-N 3.19Å; R280-L282 VanDerWaalsContact C-N 3.29Å; R280-L282 PolarHBondContact O-N 3.3Å; L282-L284 VanDerWaalsContact C-N 3.28Å; L282-L284 PolarHBondContact O-N 2.88Å; L282-A285 PolarHBondContact O-N 2.92Å; L282-A285 VanDerWaalsContact O-N 3.07Å; L282-I286 WeakPolarHBondContact O-CD1 3.21Å; L282-I286 WeakPolarHBondContact O-CG1 3.21Å; L282-I286 PolarHBondContact O-N 3.16Å; L282-L298 HydrophobicContact CB-CD1 4.4Å; L282-L298 HydrophobicContact CD2-CD1 3.7Å; L282-L298 HydrophobicContact CG-CD1 3.67Å; L282-F308 HydrophobicContact CD2-CB 4.15Å; L282-F308 HydrophobicContact CD2-CD2 3.52Å; L282-F308 HydrophobicContact CD2-CE2 4.11Å; L282-F308 HydrophobicContact CD2-CG 3.91Å; L282-L394 HydrophobicContact CD1-CD2 3.75Å; L282-F397 HydrophobicContact CD1-CB 3.69Å; L282-F397 HydrophobicContact CD1-CD2 3.99Å; L282-F397 HydrophobicContact CD1-CG 4.13Å; L282-F397 HydrophobicContact CD2-CB 3.92Å; L282-F397 HydrophobicContact CG-CB 4.5Å; L282-L398 HydrophobicContact CD1-CD1 4.35Å; L282-L398 HydrophobicContact CD1-CG 4.48Å; L282-L398 HydrophobicContact CD2-CD2 4.21Å; L282-L398 HydrophobicContact CD2-CG 4.34Å; L282-V511 HydrophobicContact CB-CG1 4.23Å; L282-V511 HydrophobicContact CB-CG2 3.99Å; L282-V511 HydrophobicContact CD1-CG1 4.3Å; L282-V511 HydrophobicContact CD1-CG2 4.44Å
283	L	97.8	Very high	96.4	Very high	24 Å²	24	41.1 Å²	41.1	13%	0.126	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-40	177.6	-63.5	169.9	0	0	0	111.9	F279 R280 A285 I286 E287 Q510 V511 A514	F279-L283 WeakPolarHBondContact O-CG 3.34Å; F279-L283 PolarHBondContact O-N 3.4Å; R280-L283 PolarHBondContact O-N 3.21Å; L283-A285 VanDerWaalsContact C-N 3.31Å; L283-A285 PolarHBondContact O-N 2.76Å; L283-I286 PolarHBondContact O-N 3Å; L283-E287 WeakPolarHBondContact O-CB 3.2Å; L283-E287 PolarHBondContact O-N 2.89Å; L283-Q510 HydrophobicContact CD1-CG 4.1Å; L283-Q510 HydrophobicContact CD2-CG 3.97Å; L283-V511 HydrophobicContact CD2-CG2 3.76Å; L283-V511 HydrophobicContact CG-CG2 3.87Å; L283-A514 HydrophobicContact CD2-CB 4.04Å
284	L	96.6	Very high	96	Very high	49 Å²	49	48.1 Å²	48.1	26%	0.257	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-33.7	176.2	-174.1	64.5	0	0	0	113.1	R280 L282 G288 G292 R295	R280-L284 VanDerWaalsContact O-CB 3.3Å; R280-L284 WeakPolarHBondContact O-CB 3.31Å; R280-L284 PolarHBondContact O-N 2.88Å; L282-L284 VanDerWaalsContact C-N 3.28Å; L282-L284 PolarHBondContact O-N 2.88Å; L284-G288 WeakPolarHBondContact O-CA 3.49Å; L284-G288 PolarHBondContact O-N 2.78Å; L284-G292 CarbonylContact O-C 3.21Å; L284-G292 WeakPolarHBondContact O-CA 3.28Å; L284-R295 HydrophobicContact CD2-CB 4.36Å
285	A	96.6	Very high	95.7	Very high	4 Å²	4	57.1 Å²	57.1	3%	0.033	28%	0.281	C	S	.	.	H	α-helix	trans	-79.8	-24.5	175.3	0	0	0	0	0	113.5	Q281 L282 L283 K293 F308	Q281-A285 WeakPolarHBondContact O-CB 3.48Å; Q281-A285 PolarHBondContact O-N 2.84Å; L282-A285 PolarHBondContact O-N 2.92Å; L282-A285 VanDerWaalsContact O-N 3.07Å; L283-A285 VanDerWaalsContact C-N 3.31Å; L283-A285 PolarHBondContact O-N 2.76Å; A285-K293 WeakPolarHBondContact O-CE 3.17Å; A285-K293 WeakPolarHBondContact O-CG 3.37Å; A285-F308 HydrophobicContact CB-CD1 4.32Å; A285-F308 HydrophobicContact CB-CE1 3.87Å
286	I	96	Very high	95.6	Very high	37 Å²	37	56.5 Å²	56.5	19%	0.19	28%	0.277	C	S	.	.	H	α-helix	trans	-88.4	-63.9	179.7	-60.5	157.2	0	0	0	110.4	L282 L283 F308 V511 A514 L515	L282-I286 WeakPolarHBondContact O-CD1 3.21Å; L282-I286 WeakPolarHBondContact O-CG1 3.21Å; L282-I286 PolarHBondContact O-N 3.16Å; L283-I286 PolarHBondContact O-N 3Å; I286-F308 HydrophobicContact CD1-CE2 4.32Å; I286-F308 HydrophobicContact CD1-CZ 4.36Å; I286-F308 HydrophobicContact CG1-CE2 4.1Å; I286-F308 HydrophobicContact CG1-CZ 3.65Å; I286-V511 HydrophobicContact CD1-CG1 4.12Å; I286-A514 HydrophobicContact CD1-CB 4.21Å; I286-A514 HydrophobicContact CG2-CB 3.94Å; I286-A514 WeakPolarHBondContact CG2-O 3.23Å; I286-L515 HydrophobicContact CD1-CD1 4.2Å; I286-L515 HydrophobicContact CD1-CD2 3.54Å; I286-L515 HydrophobicContact CD1-CG 3.65Å; I286-L515 HydrophobicContact CG1-CD2 3.71Å; I286-L515 HydrophobicContact CG1-CG 4.39Å; I286-L515 HydrophobicContact CG2-CD2 4.38Å
287	E	95.8	Very high	95.5	Very high	116 Å²	116	53.4 Å²	53.4	54%	0.542	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-26	-167.7	-56.7	172.6	153	0	0	112.2	L283 G289 A514	L283-E287 WeakPolarHBondContact O-CB 3.2Å; L283-E287 PolarHBondContact O-N 2.89Å; E287-G289 PolarHBondContact O-N 3.14Å; E287-A514 HydrophobicContact CG-CB 4.19Å; E287-A514 WeakPolarHBondContact OE1-CB 3.45Å
288	G	92.1	Very high	95.4	Very high	35 Å²	35	53.5 Å²	53.5	36%	0.361	27%	0.267	S	S	.	.	S	Bend	trans	-72.2	8.9	-171.7	0	0	0	0	0	116.9	L284 G292	L284-G288 WeakPolarHBondContact O-CA 3.49Å; L284-G288 PolarHBondContact O-N 2.78Å; G288-G292 VanDerWaalsContact O-CA 3.3Å; G288-G292 WeakPolarHBondContact O-CA 3.39Å; G288-G292 PolarHBondContact O-N 3.18Å
289	G	94.2	Very high	95.3	Very high	28 Å²	28	54.9 Å²	54.9	29%	0.289	28%	0.278	S	S	.	.	H	α-helix	trans	60.3	-160	-178.9	0	0	0	0	0	113.9	E287 K291 G292 K293	E287-G289 PolarHBondContact O-N 3.14Å; G289-K291 PolarHBondContact O-N 3.13Å; G289-G292 PolarHBondContact O-N 3Å; G289-K293 WeakPolarHBondContact O-CG 3.19Å; G289-K293 PolarHBondContact O-N 3.49Å
290	P	93.1	Very high	95.1	Very high	114 Å²	114	59.1 Å²	59.1	74%	0.74	31%	0.306	S	S	*	.	H	α-helix	trans	-59.2	-47.3	-179.6	-25.3	35.1	0	0	0	113.1	G292 K293 E294	P290-G292 VanDerWaalsContact C-N 3.3Å; P290-G292 PolarHBondContact O-N 2.88Å; P290-K293 PolarHBondContact O-N 2.79Å; P290-E294 WeakPolarHBondContact O-CB 3.36Å; P290-E294 PolarHBondContact O-N 2.78Å
291	K	92.8	Very high	94.8	Very high	166 Å²	166	58.5 Å²	58.5	72%	0.722	31%	0.306	S	S	*	.	H	α-helix	trans	-65.2	-30.9	179.8	-65	-175.7	177.6	-177.9	0	112.8	G289 R295	G289-K291 PolarHBondContact O-N 3.13Å; K291-R295 WeakPolarHBondContact O-CB 3.49Å; K291-R295 VanDerWaalsContact O-CG 3.24Å; K291-R295 WeakPolarHBondContact O-CG 3.29Å; K291-R295 PolarHBondContact O-N 2.57Å; K291-R295 VanDerWaalsContact O-N 3.1Å
292	G	92.4	Very high	94.3	Very high	4 Å²	4	63.5 Å²	63.5	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-71.4	-45.1	172.5	0	0	0	0	0	112.4	L284 G288 G289 P290 E294 R295 S296	L284-G292 CarbonylContact O-C 3.21Å; L284-G292 WeakPolarHBondContact O-CA 3.28Å; G288-G292 VanDerWaalsContact O-CA 3.3Å; G288-G292 WeakPolarHBondContact O-CA 3.39Å; G288-G292 PolarHBondContact O-N 3.18Å; G289-G292 PolarHBondContact O-N 3Å; P290-G292 VanDerWaalsContact C-N 3.3Å; P290-G292 PolarHBondContact O-N 2.88Å; G292-E294 VanDerWaalsContact C-N 3.3Å; G292-E294 PolarHBondContact O-N 3.04Å; G292-R295 PolarHBondContact O-N 3.23Å; G292-S296 VanDerWaalsContact O-CB 3.32Å; G292-S296 WeakPolarHBondContact O-CB 3.24Å; G292-S296 PolarHBondContact O-N 3.22Å
293	K	92.2	Very high	93.7	Very high	111 Å²	111	66.5 Å²	66.5	48%	0.483	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-36.9	175.1	-72.7	169.8	-178.2	-179.4	0	112.6	A285 G289 P290 K311	A285-K293 WeakPolarHBondContact O-CE 3.17Å; A285-K293 WeakPolarHBondContact O-CG 3.37Å; G289-K293 WeakPolarHBondContact O-CG 3.19Å; G289-K293 PolarHBondContact O-N 3.49Å; P290-K293 PolarHBondContact O-N 2.79Å; K293-K311 PolarHBondContact O-NZ 3.48Å
294	E	91.4	Very high	93	Very high	147 Å²	147	70.6 Å²	70.6	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-64	-55.5	171.7	-174.8	-175.4	-174.2	0	0	111.5	P290 G292 S296 K311	P290-E294 WeakPolarHBondContact O-CB 3.36Å; P290-E294 PolarHBondContact O-N 2.78Å; G292-E294 VanDerWaalsContact C-N 3.3Å; G292-E294 PolarHBondContact O-N 3.04Å; E294-S296 VanDerWaalsContact C-N 3.35Å; E294-S296 PolarHBondContact O-N 2.79Å; E294-K311 PolarHBondContact O-NZ 3.2Å
295	R	92.1	Very high	92.6	Very high	191 Å²	191	70.7 Å²	70.7	72%	0.721	41%	0.413	S	S	*	.	H	α-helix	trans	-70.7	-22.1	-176.4	-70.5	176.4	67.1	-161.2	1.9	115.1	L284 K291 G292	L284-R295 HydrophobicContact CD2-CB 4.36Å; K291-R295 WeakPolarHBondContact O-CB 3.49Å; K291-R295 VanDerWaalsContact O-CG 3.24Å; K291-R295 WeakPolarHBondContact O-CG 3.29Å; K291-R295 PolarHBondContact O-N 2.57Å; K291-R295 VanDerWaalsContact O-N 3.1Å; G292-R295 PolarHBondContact O-N 3.23Å
296	S	95.9	Very high	92.5	Very high	3 Å²	3	71.4 Å²	71.4	2%	0.021	42%	0.417	C	S	.	.	S	Bend	trans	-67.9	143.9	179.3	-174.7	0	0	0	0	111.1	Q281 G292 E294 L298 K311	Q281-S296 PolarHBondContact O-OG 2.59Å; Q281-S296 VanDerWaalsContact OE1-CA 3.25Å; Q281-S296 PolarHBondContact OE1-OG 2.86Å; G292-S296 VanDerWaalsContact O-CB 3.32Å; G292-S296 WeakPolarHBondContact O-CB 3.24Å; G292-S296 PolarHBondContact O-N 3.22Å; E294-S296 VanDerWaalsContact C-N 3.35Å; E294-S296 PolarHBondContact O-N 2.79Å; S296-L298 PolarHBondContact O-N 2.83Å; S296-L298 PolarHBondContact OG-N 2.86Å; S296-K311 WeakPolarHBondContact O-CD 3.41Å; S296-K311 VanDerWaalsContact O-CE 3.25Å; S296-K311 WeakPolarHBondContact O-CE 3.45Å; S296-K311 PolarHBondContact O-NZ 3.14Å
297	V	96.3	Very high	92.5	Very high	3 Å²	3	71.2 Å²	71.2	2%	0.018	42%	0.418	C	S	.	.	S	Bend	trans	-73.2	-4.7	171.4	-53.9	0	0	0	0	112.8	L223 F277 F278 Q281 L310 K311 V314	L223-V297 HydrophobicContact CD1-CG1 4.35Å; L223-V297 HydrophobicContact CD2-CG1 3.56Å; F277-V297 HydrophobicContact CE1-CG1 4.43Å; F277-V297 HydrophobicContact CE1-CG2 4.04Å; F277-V297 HydrophobicContact CZ-CG1 3.93Å; F277-V297 HydrophobicContact CZ-CG2 4.23Å; F278-V297 HydrophobicContact CD1-CG2 4.42Å; F278-V297 HydrophobicContact CE1-CG2 3.81Å; Q281-V297 HydrophobicContact CB-CG2 4.14Å; Q281-V297 HydrophobicContact CG-CG2 3.82Å; V297-L310 HydrophobicContact CB-CD2 4.47Å; V297-L310 HydrophobicContact CG2-CD2 4.07Å; V297-K311 PolarHBondContact O-N 3.33Å; V297-V314 HydrophobicContact CB-CG1 4.42Å
298	L	97.4	Very high	92.5	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.01	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	146.5	-175	-57.5	177	0	0	0	112	F278 Q281 L282 S296 F308 A309 L310 K311 L398	F278-L298 HydrophobicContact CD1-CD2 4.23Å; F278-L298 HydrophobicContact CE1-CD2 4.21Å; Q281-L298 HydrophobicContact CB-CD1 3.79Å; Q281-L298 HydrophobicContact CB-CG 4.08Å; L282-L298 HydrophobicContact CB-CD1 4.4Å; L282-L298 HydrophobicContact CD2-CD1 3.7Å; L282-L298 HydrophobicContact CG-CD1 3.67Å; S296-L298 PolarHBondContact O-N 2.83Å; S296-L298 PolarHBondContact OG-N 2.86Å; L298-F308 HydrophobicContact CB-CD1 4.49Å; L298-A309 CarbonylContact C-O 3.56Å; L298-A309 VanDerWaalsContact CA-O 3.22Å; L298-A309 WeakPolarHBondContact CA-O 3.5Å; L298-A309 WeakPolarHBondContact CD2-O 3.42Å; L298-L310 HydrophobicContact CD2-CD2 4.18Å; L298-K311 WeakPolarHBondContact O-CE 3.45Å; L298-L398 HydrophobicContact CD1-CD1 4.39Å; L298-L398 HydrophobicContact CD1-CD2 3.93Å; L298-L398 HydrophobicContact CD2-CD1 4.32Å; L298-L398 HydrophobicContact CD2-CD2 3.56Å; L298-L398 HydrophobicContact CG-CD2 4.33Å
299	A	95.6	Very high	92.8	Very high	30 Å²	30	65.8 Å²	65.8	25%	0.248	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.9	168.8	0	0	0	0	0	110.1	Q301 F308 A309 K311	A299-Q301 PolarHBondContact O-N 2.87Å; A299-F308 CarbonylContact O-C 3.54Å; A299-F308 VanDerWaalsContact O-CA 3.25Å; A299-F308 WeakPolarHBondContact O-CA 3.48Å; A299-A309 PolarHBondContact N-O 3.2Å; A299-A309 PolarHBondContact O-N 3.03Å; A299-K311 HydrophobicContact CB-CG 3.89Å
300	P	94.6	Very high	92.9	Very high	96 Å²	96	66.5 Å²	66.5	62%	0.623	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	135.7	169.6	-21.4	33.2	0	0	0	110.8	P307 F308	P300-P307 WeakPolarHBondContact CA-O 3.28Å; P300-F308 HydrophobicContact CG-CD1 4.44Å; P300-F308 HydrophobicContact CG-CE1 4.15Å
301	Q	92.4	Very high	93	Very high	51 Å²	51	63.9 Å²	63.9	24%	0.238	36%	0.361	C	S	.	.			trans	-105.9	118.4	175.8	-177	174.6	-9	0	0	109.4	A299 P307 A309	A299-Q301 PolarHBondContact O-N 2.87Å; Q301-P307 PolarHBondContact N-O 2.93Å; Q301-A309 HydrophobicContact CB-CB 4.36Å
302	P	87.2	Confident	93	Very high	122 Å²	122	61.8 Å²	61.8	79%	0.792	36%	0.364	S	S	*	.			trans	-76.7	152.1	173.9	31.9	-34.2	0	0	0	111.5
303	G	86.3	Confident	93	Very high	64 Å²	64	62.6 Å²	62.6	66%	0.66	37%	0.372	S	S	*	.	S	Bend	trans	103	-174.6	177	0	0	0	0	0	114.5	G305	G303-G305 PolarHBondContact O-N 2.81Å
304	P	82.6	Confident	93.1	Very high	109 Å²	109	58.1 Å²	58.1	71%	0.708	35%	0.354	S	S	*	.	S	Bend	trans	-76	122.6	-179.4	30.3	-33.4	0	0	0	111.1
305	G	87.9	Confident	93.3	Very high	52 Å²	52	52.6 Å²	52.6	54%	0.536	33%	0.328	S	S	.	.	S	Bend	trans	146.4	-153.1	176.6	0	0	0	0	0	113.7	G303	G303-G305 PolarHBondContact O-N 2.81Å
306	P	93.5	Very high	93.6	Very high	18 Å²	18	43.6 Å²	43.6	12%	0.117	29%	0.294	C	S	.	.			trans	-67.5	134.4	173.3	-14.4	29.6	0	0	0	111	F308 L398	P306-F308 PolarHBondContact O-N 2.96Å; P306-L398 VanDerWaalsContact CB-C 3.48Å
307	P	95.8	Very high	93.8	Very high	34 Å²	34	43.5 Å²	43.5	22%	0.221	29%	0.293	C	S	.	.	S	Bend	trans	-70.3	-7.1	-173.7	25.6	-36.1	0	0	0	116.1	P300 Q301 H396 L515	P300-P307 WeakPolarHBondContact CA-O 3.28Å; Q301-P307 PolarHBondContact N-O 2.93Å; P307-H396 WeakPolarHBondContact CD-O 3.46Å; P307-L515 HydrophobicContact CG-CD1 4.12Å
308	F	97.6	Very high	93.9	Very high	14 Å²	14	43.5 Å²	43.5	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	154.2	176.6	-61.7	-93	0	0	0	111.5	L282 A285 I286 L298 A299 P300 P306 F397 L398 P399 L515	L282-F308 HydrophobicContact CD2-CB 4.15Å; L282-F308 HydrophobicContact CD2-CD2 3.52Å; L282-F308 HydrophobicContact CD2-CE2 4.11Å; L282-F308 HydrophobicContact CD2-CG 3.91Å; A285-F308 HydrophobicContact CB-CD1 4.32Å; A285-F308 HydrophobicContact CB-CE1 3.87Å; I286-F308 HydrophobicContact CD1-CE2 4.32Å; I286-F308 HydrophobicContact CD1-CZ 4.36Å; I286-F308 HydrophobicContact CG1-CE2 4.1Å; I286-F308 HydrophobicContact CG1-CZ 3.65Å; L298-F308 HydrophobicContact CB-CD1 4.49Å; A299-F308 CarbonylContact O-C 3.54Å; A299-F308 VanDerWaalsContact O-CA 3.25Å; A299-F308 WeakPolarHBondContact O-CA 3.48Å; P300-F308 HydrophobicContact CG-CD1 4.44Å; P300-F308 HydrophobicContact CG-CE1 4.15Å; P306-F308 PolarHBondContact O-N 2.96Å; F308-F397 PolarHBondContact N-O 3.49Å; F308-F397 VanDerWaalsContact N-O 3.11Å; F308-L398 HydrophobicContact CB-CD2 3.71Å; F308-L398 WeakPolarHBondContact O-CD2 3.41Å; F308-P399 WeakPolarHBondContact O-CD 3.44Å; F308-L515 HydrophobicContact CE2-CD1 4.15Å; F308-L515 HydrophobicContact CE2-CD2 3.94Å; F308-L515 HydrophobicContact CZ-CD2 4.31Å
309	A	97.1	Very high	93.9	Very high	23 Å²	23	43.4 Å²	43.4	19%	0.19	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	169	167.3	0	0	0	0	0	110.5	L298 A299 Q301 P399	L298-A309 CarbonylContact C-O 3.56Å; L298-A309 VanDerWaalsContact CA-O 3.22Å; L298-A309 WeakPolarHBondContact CA-O 3.5Å; L298-A309 WeakPolarHBondContact CD2-O 3.42Å; A299-A309 PolarHBondContact N-O 3.2Å; A299-A309 PolarHBondContact O-N 3.03Å; Q301-A309 HydrophobicContact CB-CB 4.36Å; A309-P399 HydrophobicContact CB-CG 4.39Å
310	L	96.5	Very high	94	Very high	42 Å²	42	42.5 Å²	42.5	22%	0.22	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	144.8	159.8	-75.9	170.2	0	0	0	109.6	F278 V297 L298 V314 L401	F278-L310 HydrophobicContact CE1-CD2 3.77Å; F278-L310 HydrophobicContact CZ-CD2 4.05Å; V297-L310 HydrophobicContact CB-CD2 4.47Å; V297-L310 HydrophobicContact CG2-CD2 4.07Å; L298-L310 HydrophobicContact CD2-CD2 4.18Å; L310-V314 HydrophobicContact CD2-CG1 4.02Å; L310-L401 HydrophobicContact CD1-CD2 3.98Å; L310-L401 HydrophobicContact CG-CD2 4.02Å
311	K	95.6	Very high	94	Very high	59 Å²	59	38.4 Å²	38.4	26%	0.257	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-62.9	150.9	168.8	-75.7	172.6	175.9	170.7	0	110.5	K293 E294 S296 V297 L298 A299 V314	K293-K311 PolarHBondContact O-NZ 3.48Å; E294-K311 PolarHBondContact O-NZ 3.2Å; S296-K311 WeakPolarHBondContact O-CD 3.41Å; S296-K311 VanDerWaalsContact O-CE 3.25Å; S296-K311 WeakPolarHBondContact O-CE 3.45Å; S296-K311 PolarHBondContact O-NZ 3.14Å; V297-K311 PolarHBondContact O-N 3.33Å; L298-K311 WeakPolarHBondContact O-CE 3.45Å; A299-K311 HydrophobicContact CB-CG 3.89Å; K311-V314 HydrophobicContact CB-CG2 3.77Å; K311-V314 WeakPolarHBondContact O-CB 3.17Å; K311-V314 VanDerWaalsContact O-CG2 3.32Å; K311-V314 WeakPolarHBondContact O-CG2 3.29Å; K311-V314 PolarHBondContact O-N 3.4Å
312	P	92.6	Very high	93.9	Very high	123 Å²	123	39.5 Å²	39.5	80%	0.799	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	149.4	169.1	-24.1	34.6	0	0	0	111.8	V314	P312-V314 PolarHBondContact O-N 2.92Å
313	G	91.7	Very high	94.1	Very high	20 Å²	20	34 Å²	34	21%	0.206	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	9.6	-177.8	0	0	0	0	0	114.9	R225 E226	R225-G313 CarbonylContact C-O 3.6Å; R225-G313 WeakPolarHBondContact CA-O 3.49Å; E226-G313 PolarHBondContact N-O 3.26Å
314	V	95.1	Very high	94.2	Very high	17 Å²	17	31.2 Å²	31.2	10%	0.103	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.5	176.6	-173.5	0	0	0	0	110.7	L223 E224 R225 V297 L310 K311 P312	L223-V314 HydrophobicContact CD1-CG1 3.5Å; L223-V314 HydrophobicContact CD2-CG1 4.37Å; L223-V314 HydrophobicContact CG-CG1 4.01Å; E224-V314 WeakPolarHBondContact O-CA 3.33Å; R225-V314 HydrophobicContact CG-CG1 4.33Å; R225-V314 HydrophobicContact CG-CG2 4.18Å; V297-V314 HydrophobicContact CB-CG1 4.42Å; L310-V314 HydrophobicContact CD2-CG1 4.02Å; K311-V314 HydrophobicContact CB-CG2 3.77Å; K311-V314 WeakPolarHBondContact O-CB 3.17Å; K311-V314 VanDerWaalsContact O-CG2 3.32Å; K311-V314 WeakPolarHBondContact O-CG2 3.29Å; K311-V314 PolarHBondContact O-N 3.4Å; P312-V314 PolarHBondContact O-N 2.92Å
315	F	96.6	Very high	94.5	Very high	32 Å²	32	29.4 Å²	29.4	14%	0.14	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	160.6	-177.2	-53.8	-77.9	0	0	0	111.7	A15 I20 L223 E224 H317	A15-F315 HydrophobicContact CB-CE2 3.83Å; A15-F315 HydrophobicContact CB-CZ 4.14Å; I20-F315 HydrophobicContact CD1-CE1 4.43Å; L223-F315 WeakPolarHBondContact CA-O 3.37Å; E224-F315 HydrophobicContact CB-CB 4.27Å; E224-F315 PolarHBondContact N-O 3.02Å; E224-F315 PolarHBondContact O-N 2.67Å; F315-H317 WeakPolarHBondContact CB-NE2 3.28Å
316	L	98.2	Very high	94.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.8	-177.3	-70.7	171.4	0	0	0	110.2	V221 L223 L274 F278 L401 A403 T404	V221-L316 HydrophobicContact CG1-CD2 4.05Å; L223-L316 HydrophobicContact CD1-CD2 3.7Å; L274-L316 HydrophobicContact CD1-CD2 4.2Å; F278-L316 HydrophobicContact CE2-CD1 4.15Å; F278-L316 HydrophobicContact CZ-CD1 4.06Å; F278-L316 HydrophobicContact CZ-CD2 4.27Å; L316-L401 HydrophobicContact CD1-CB 4.34Å; L316-A403 HydrophobicContact CB-CB 4.35Å; L316-A403 CarbonylContact O-C 3.54Å; L316-A403 WeakPolarHBondContact O-CA 3.2Å; L316-A403 VanDerWaalsContact O-CB 3.29Å; L316-A403 WeakPolarHBondContact O-CB 3.3Å; L316-T404 PolarHBondContact O-N 2.9Å
317	H	98.4	Very high	94	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.1	-173.1	-50.3	-84.3	0	0	0	109.2	H189 V221 I222 E224 F315 S405	H189-H317 AromaticContact CE1-CE1 3.64Å; H189-H317 AromaticContact CE1-CG 3.83Å; H189-H317 AromaticContact CE1-ND1 3.26Å; H189-H317 PolarHBondContact CE1-ND1 2.75Å; H189-H317 VanDerWaalsContact CE1-ND1 3.26Å; H189-H317 AromaticContact NE2-ND1 3.43Å; H189-H317 PolarHBondContact NE2-ND1 3.48Å; V221-H317 CarbonylContact C-O 3.58Å; V221-H317 WeakPolarHBondContact CA-O 3.48Å; I222-H317 HydrophobicContact CB-CB 4.35Å; I222-H317 PolarHBondContact N-O 2.85Å; I222-H317 PolarHBondContact O-N 3.36Å; E224-H317 WeakPolarHBondContact CB-NE2 3.44Å; E224-H317 IonicContact OE2-CE1 3.55Å; E224-H317 PolarHBondContact OE2-CE1 2.91Å; E224-H317 VanDerWaalsContact OE2-CE1 3.27Å; E224-H317 IonicContact OE2-NE2 2.9Å; E224-H317 PolarHBondContact OE2-NE2 2.8Å; F315-H317 WeakPolarHBondContact CB-NE2 3.28Å; H317-S405 WeakPolarHBondContact CB-OG 3.14Å; H317-S405 PolarHBondContact ND1-OG 2.89Å
318	L	98.5	Very high	92.9	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	134	177.3	-59.4	177.6	0	0	0	109	A220 V221 L267 L381 L389 A403 S405 L406 V407	A220-L318 WeakPolarHBondContact O-CA 3.46Å; V221-L318 HydrophobicContact CG1-CD2 4.28Å; V221-L318 HydrophobicContact CG2-CD2 3.85Å; L267-L318 HydrophobicContact CD1-CD1 4.47Å; L318-L381 HydrophobicContact CD1-CD1 3.69Å; L318-L389 HydrophobicContact CD2-CD1 4.46Å; L318-A403 HydrophobicContact CD1-CB 4.19Å; L318-A403 HydrophobicContact CG-CB 3.89Å; L318-S405 PolarHBondContact N-O 2.92Å; L318-L406 HydrophobicContact CB-CD1 3.62Å; L318-L406 HydrophobicContact CD1-CD1 4.34Å; L318-L406 CarbonylContact O-C 3.53Å; L318-L406 WeakPolarHBondContact O-CA 3.24Å; L318-V407 PolarHBondContact O-N 3.25Å
319	Y	98.4	Very high	91.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.8	163.5	174.9	-85.3	0	0	0	108.6	A194 V197 V218 A219 A220 V407 A409 P451 V453	A194-Y319 HydrophobicContact CB-CD2 4.34Å; A194-Y319 HydrophobicContact CB-CE2 3.79Å; V197-Y319 HydrophobicContact CB-CD1 4.32Å; V197-Y319 HydrophobicContact CG1-CD1 3.9Å; V197-Y319 HydrophobicContact CG1-CE1 4.11Å; V197-Y319 HydrophobicContact CG2-CD1 4.14Å; V197-Y319 HydrophobicContact CG2-CG 4.05Å; V218-Y319 HydrophobicContact CG1-CD1 4.44Å; A219-Y319 CarbonylContact C-O 3.6Å; A219-Y319 WeakPolarHBondContact CA-O 3.27Å; A219-Y319 WeakPolarHBondContact CB-O 3.3Å; A220-Y319 PolarHBondContact N-O 3.11Å; A220-Y319 PolarHBondContact O-N 2.98Å; Y319-V407 CarbonylContact C-O 3.55Å; Y319-V407 WeakPolarHBondContact CA-O 3.47Å; Y319-V407 HydrophobicContact CD2-CB 4.02Å; Y319-V407 HydrophobicContact CD2-CG1 3.76Å; Y319-V407 HydrophobicContact CE2-CG1 4.16Å; Y319-A409 HydrophobicContact CE2-CB 3.89Å; Y319-A409 WeakPolarHBondContact OH-CB 3.3Å; Y319-P451 PolarHBondContact OH-O 2.84Å; Y319-V453 HydrophobicContact CE1-CB 4.45Å; Y319-V453 HydrophobicContact CE1-CG2 4.25Å; Y319-V453 HydrophobicContact CE2-CG2 4.34Å; Y319-V453 WeakPolarHBondContact OH-CG2 3.46Å; Y319-V453 PolarHBondContact OH-N 3.33Å
320	V	96.7	Very high	90	Very high	11 Å²	11	30.2 Å²	30.2	7%	0.067	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	129.6	176.6	-166.5	0	0	0	0	110	A219 L267 N322 L406 V407 L408 A409	A219-V320 HydrophobicContact CB-CB 4.47Å; A219-V320 HydrophobicContact CB-CG1 4.22Å; A219-V320 HydrophobicContact CB-CG2 4.08Å; L267-V320 HydrophobicContact CD1-CG2 4.07Å; V320-N322 VanDerWaalsContact C-N 3.34Å; V320-N322 WeakPolarHBondContact CG1-O 3.41Å; V320-N322 PolarHBondContact O-N 3.12Å; V320-L406 HydrophobicContact CG2-CD1 3.71Å; V320-V407 PolarHBondContact N-O 3.07Å; V320-L408 HydrophobicContact CB-CD1 4.46Å; V320-L408 WeakPolarHBondContact O-CD1 3.37Å; V320-A409 PolarHBondContact O-N 2.86Å
321	S	94.5	Very high	87.7	Confident	11 Å²	11	31.4 Å²	31.4	8%	0.077	17%	0.171	C	C	.	.	S	Bend	trans	-77.4	-14.9	-178.5	-51.3	0	0	0	0	114.8	V218	V218-S321 PolarHBondContact O-N 3.1Å; V218-S321 PolarHBondContact O-OG 3.45Å
322	N	91.4	Very high	85.3	Confident	74 Å²	74	39.1 Å²	39.1	40%	0.396	20%	0.2	S	C	.	.	S	Bend	trans	-136.4	148.4	-173.4	-63.8	-114.9	0	0	0	110	G216 V320 L408	G216-N322 PolarHBondContact O-ND2 2.78Å; V320-N322 VanDerWaalsContact C-N 3.34Å; V320-N322 WeakPolarHBondContact CG1-O 3.41Å; V320-N322 PolarHBondContact O-N 3.12Å; N322-L408 VanDerWaalsContact C-CD1 3.48Å; N322-L408 WeakPolarHBondContact O-CD1 3.27Å
323	T	90.4	Very high	83.1	Confident	6 Å²	6	37.8 Å²	37.8	4%	0.037	19%	0.185	C	C	.	.			trans	-56.4	128.8	174.1	-59.9	0	0	0	0	109.8	K325 A328 H329 D410 H413	T323-K325 PolarHBondContact O-N 3.14Å; T323-A328 HydrophobicContact CG2-CB 4.15Å; T323-A328 WeakPolarHBondContact CG2-O 3.44Å; T323-H329 HydrophobicContact CG2-CB 3.9Å; T323-D410 VanDerWaalsContact CB-OD2 3.23Å; T323-D410 WeakPolarHBondContact CB-OD2 3.28Å; T323-D410 PolarHBondContact N-OD2 3.29Å; T323-D410 PolarHBondContact OG1-OD2 2.95Å; T323-H413 VanDerWaalsContact OG1-CB 3.28Å; T323-H413 WeakPolarHBondContact OG1-CB 3.48Å
324	P	90	Very high	80.8	Confident	5 Å²	5	42 Å²	42	3%	0.032	21%	0.209	C	C	.	.			trans	-59.3	106.5	179.4	-26.9	36	0	0	0	111.9	G326 A377 L381 L418	P324-G326 PolarHBondContact O-N 2.85Å; P324-A377 HydrophobicContact CB-CB 3.77Å; P324-L381 HydrophobicContact CG-CD2 4.41Å; P324-L418 HydrophobicContact CG-CD1 4.37Å
325	K	88.8	Confident	78.5	Confident	71 Å²	71	46 Å²	46	31%	0.309	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.5	138.5	175.4	-66.7	-173.3	178.9	-180	0	111.5	S247 T323 L357 S376 A377 S378	S247-K325 PolarHBondContact O-NZ 2.83Å; T323-K325 PolarHBondContact O-N 3.14Å; K325-L357 HydrophobicContact CB-CD2 4.32Å; K325-S376 CarbonylContact O-C 3.52Å; K325-S376 WeakPolarHBondContact O-CB 3.3Å; K325-S376 PolarHBondContact O-OG 3.24Å; K325-A377 PolarHBondContact O-N 2.81Å; K325-S378 PolarHBondContact O-N 3.31Å; K325-S378 VanDerWaalsContact O-N 3.16Å
326	G	86.9	Confident	75.9	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	118.4	-154.3	-170.7	0	0	0	0	0	111.2	P324 A328 H329 S378	P324-G326 PolarHBondContact O-N 2.85Å; G326-A328 PolarHBondContact O-N 3.02Å; G326-H329 PolarHBondContact O-N 2.82Å; G326-S378 WeakPolarHBondContact CA-OG 3.49Å
327	A	82.9	Confident	73.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-11.9	-178.9	0	0	0	0	0	116.3	A346 F347 S378 T417 A421	A327-A346 WeakPolarHBondContact CA-O 3.5Å; A327-A346 VanDerWaalsContact CB-O 3.3Å; A327-A346 WeakPolarHBondContact CB-O 3.29Å; A327-F347 HydrophobicContact CB-CD1 4.21Å; A327-S378 PolarHBondContact N-OG 3.08Å; A327-T417 WeakPolarHBondContact O-CG2 3.29Å; A327-A421 HydrophobicContact CB-CB 4.14Å
328	A	72.4	Confident	71.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-13	174.1	0	0	0	0	0	114	T323 G326 L418 A421	T323-A328 HydrophobicContact CG2-CB 4.15Å; T323-A328 WeakPolarHBondContact CG2-O 3.44Å; G326-A328 PolarHBondContact O-N 3.02Å; A328-L418 HydrophobicContact CB-CD1 3.75Å; A328-A421 HydrophobicContact CB-CB 3.88Å
329	H	70.1	Confident	69	Low	93 Å²	93	64.9 Å²	64.9	43%	0.431	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-7.4	-171.8	-170.3	61.7	0	0	0	113.2	T323 G326 I331	T323-H329 HydrophobicContact CG2-CB 3.9Å; G326-H329 PolarHBondContact O-N 2.82Å; H329-I331 PolarHBondContact O-N 3.22Å
330	D	63.3	Low	66.8	Low	62 Å²	62	69.2 Å²	69.2	33%	0.332	37%	0.366	S	S	.	.			trans	-83.4	55.8	-176	-153.6	-8.3	0	0	0	111.5	A346	D330-A346 HydrophobicContact CB-CB 4.04Å; D330-A346 WeakPolarHBondContact OD2-CA 3.27Å; D330-A346 WeakPolarHBondContact OD2-CB 3.31Å
331	I	50.1	Low	64.7	Low	67 Å²	67	69 Å²	69	34%	0.344	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-19.9	-167.7	-62.3	168.8	0	0	0	112.3	H329 L333 C412 D414	H329-I331 PolarHBondContact O-N 3.22Å; I331-L333 PolarHBondContact O-N 2.91Å; I331-L333 VanDerWaalsContact O-N 3.1Å; I331-C412 WeakPolarHBondContact CD1-O 3.3Å; I331-D414 HydrophobicContact CD1-CB 4.07Å; I331-D414 HydrophobicContact CG1-CB 4.26Å
332	Y	44.3	Very low	62.7	Low	222 Å²	222	70.6 Å²	70.6	87%	0.871	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	6.3	-173.2	-71	-79.8	0	0	0	115.5
333	L	47.1	Very low	60.9	Low	95 Å²	95	72.8 Å²	72.8	50%	0.497	38%	0.379	S	S	.	.	S	Bend	trans	-107.8	115.6	176.4	-70.3	176.3	0	0	0	110.1	I331 L335	I331-L333 PolarHBondContact O-N 2.91Å; I331-L333 VanDerWaalsContact O-N 3.1Å; L333-L335 PolarHBondContact O-N 3.43Å
334	P	41.7	Very low	59.6	Low	109 Å²	109	75.5 Å²	75.5	71%	0.708	39%	0.389	S	S	*	.			trans	-52.1	134.9	-174.9	-30.4	35.7	0	0	0	114.5	A336 R344	P334-A336 PolarHBondContact O-N 2.85Å; P334-R344 PolarHBondContact O-NH2 3.49Å
335	L	48.4	Very low	58.1	Low	101 Å²	101	78.2 Å²	78.2	53%	0.529	41%	0.406	S	S	.	.			trans	-73.1	68.2	178.7	-71.3	172.9	0	0	0	112.1	L333 S337	L333-L335 PolarHBondContact O-N 3.43Å; L335-S337 PolarHBondContact O-N 3.2Å
336	A	42.1	Very low	57	Low	58 Å²	58	75.2 Å²	75.2	48%	0.479	40%	0.395	S	S	.	.			trans	-72.5	116.9	165.3	0	0	0	0	0	110.4	P334 R344	P334-A336 PolarHBondContact O-N 2.85Å; A336-R344 PolarHBondContact O-NH1 3.08Å; A336-R344 PolarHBondContact O-NH2 3.01Å
337	S	47.5	Very low	56.5	Low	85 Å²	85	75.6 Å²	75.6	59%	0.594	40%	0.396	S	S	*	.			trans	43.7	128.4	172.9	55.3	0	0	0	0	119.3	L335 D339 N340	L335-S337 PolarHBondContact O-N 3.2Å; S337-D339 VanDerWaalsContact C-N 3.33Å; S337-D339 PolarHBondContact O-N 2.8Å; S337-N340 PolarHBondContact O-N 2.75Å
338	E	52.7	Low	56.6	Low	130 Å²	130	79.2 Å²	79.2	61%	0.607	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-54.2	-41.3	-176.5	-73.9	-68.9	111.7	0	0	113.6	N340 V341 R420	E338-N340 VanDerWaalsContact C-N 3.27Å; E338-N340 PolarHBondContact O-N 2.8Å; E338-N340 VanDerWaalsContact O-N 3.17Å; E338-V341 WeakPolarHBondContact O-CG2 3.45Å; E338-V341 PolarHBondContact O-N 3.1Å; E338-R420 IonicContact OE1-NH1 3.2Å; E338-R420 PolarHBondContact OE1-NH1 3.42Å; E338-R420 IonicContact OE2-NH1 2.74Å; E338-R420 PolarHBondContact OE2-NH1 3.45Å
339	D	48.7	Very low	57.5	Low	159 Å²	159	79.4 Å²	79.4	85%	0.85	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-65	-23.1	-171	-63.4	-60.1	0	0	0	115	S337	S337-D339 VanDerWaalsContact C-N 3.33Å; S337-D339 PolarHBondContact O-N 2.8Å
340	N	51.8	Low	58.5	Low	92 Å²	92	75.7 Å²	75.7	49%	0.492	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-112.6	12.6	-174.3	-150.1	-2.4	0	0	0	113.9	S337 E338 L342	S337-N340 PolarHBondContact O-N 2.75Å; E338-N340 VanDerWaalsContact C-N 3.27Å; E338-N340 PolarHBondContact O-N 2.8Å; E338-N340 VanDerWaalsContact O-N 3.17Å; N340-L342 PolarHBondContact O-N 3.47Å
341	V	53.2	Low	59.9	Low	5 Å²	5	73 Å²	73	3%	0.03	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-64.1	-38.5	-178.5	176.6	0	0	0	0	112.1	E338 H343 R344 F347	E338-V341 WeakPolarHBondContact O-CG2 3.45Å; E338-V341 PolarHBondContact O-N 3.1Å; V341-H343 PolarHBondContact O-N 3.25Å; V341-R344 WeakPolarHBondContact O-CB 3.47Å; V341-R344 PolarHBondContact O-N 2.61Å; V341-F347 HydrophobicContact CG1-CD2 3.78Å; V341-F347 HydrophobicContact CG1-CE1 4.38Å; V341-F347 HydrophobicContact CG1-CE2 3.33Å; V341-F347 HydrophobicContact CG1-CG 4.46Å; V341-F347 HydrophobicContact CG1-CZ 3.66Å; V341-F347 WeakPolarHBondContact O-CD2 3.35Å
342	L	52.5	Low	61.8	Low	46 Å²	46	70 Å²	70	24%	0.241	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-72.8	-21.8	-173.5	-68.3	171.8	0	0	0	114.8	N340 R425 K427	N340-L342 PolarHBondContact O-N 3.47Å; L342-R425 HydrophobicContact CD2-CG 4.07Å; L342-K427 VanDerWaalsContact CD1-CE 3.5Å
343	H	53.6	Low	64	Low	120 Å²	120	59.8 Å²	59.8	56%	0.556	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-85.7	-14.3	179.3	-65.8	-70.5	0	0	0	113.4	V341 R348	V341-H343 PolarHBondContact O-N 3.25Å; H343-R348 PolarHBondContact O-NH2 2.88Å
344	R	62.6	Low	65.9	Low	63 Å²	63	58.1 Å²	58.1	24%	0.238	32%	0.32	C	S	.	.	S	Bend	trans	-57.8	137.8	175.8	-77.8	179.8	156.7	89.9	-11.5	110.9	P334 A336 V341 A346 F347	P334-R344 PolarHBondContact O-NH2 3.49Å; A336-R344 PolarHBondContact O-NH1 3.08Å; A336-R344 PolarHBondContact O-NH2 3.01Å; V341-R344 WeakPolarHBondContact O-CB 3.47Å; V341-R344 PolarHBondContact O-N 2.61Å; R344-A346 PolarHBondContact O-N 2.8Å; R344-A346 VanDerWaalsContact O-N 3.11Å; R344-F347 PolarHBondContact O-N 3.35Å
345	P	60.2	Low	67.9	Low	61 Å²	61	54.8 Å²	54.8	40%	0.396	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-53.8	-31.1	176.1	-28.5	36.3	0	0	0	114.6	F347 R348	P345-F347 VanDerWaalsContact C-N 3.29Å; P345-F347 PolarHBondContact O-N 2.85Å; P345-R348 WeakPolarHBondContact O-CB 3.48Å; P345-R348 PolarHBondContact O-N 2.86Å
346	A	63.9	Low	69.7	Low	8 Å²	8	55.4 Å²	55.4	7%	0.066	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-52.5	-41.7	174	0	0	0	0	0	113.4	A327 D330 R344 Q350	A327-A346 WeakPolarHBondContact CA-O 3.5Å; A327-A346 VanDerWaalsContact CB-O 3.3Å; A327-A346 WeakPolarHBondContact CB-O 3.29Å; D330-A346 HydrophobicContact CB-CB 4.04Å; D330-A346 WeakPolarHBondContact OD2-CA 3.27Å; D330-A346 WeakPolarHBondContact OD2-CB 3.31Å; R344-A346 PolarHBondContact O-N 2.8Å; R344-A346 VanDerWaalsContact O-N 3.11Å; A346-Q350 PolarHBondContact O-NE2 3.37Å
347	F	76.9	Confident	71.9	Confident	10 Å²	10	55.4 Å²	55.4	4%	0.044	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-88	-2.5	-177.7	-80.5	-89	0	0	0	114.2	A327 V341 R344 P345 T417 R420 A421 R425	A327-F347 HydrophobicContact CB-CD1 4.21Å; V341-F347 HydrophobicContact CG1-CD2 3.78Å; V341-F347 HydrophobicContact CG1-CE1 4.38Å; V341-F347 HydrophobicContact CG1-CE2 3.33Å; V341-F347 HydrophobicContact CG1-CG 4.46Å; V341-F347 HydrophobicContact CG1-CZ 3.66Å; V341-F347 WeakPolarHBondContact O-CD2 3.35Å; R344-F347 PolarHBondContact O-N 3.35Å; P345-F347 VanDerWaalsContact C-N 3.29Å; P345-F347 PolarHBondContact O-N 2.85Å; F347-T417 HydrophobicContact CZ-CG2 3.93Å; F347-R420 HydrophobicContact CE1-CB 4.02Å; F347-A421 HydrophobicContact CE1-CB 4.46Å; F347-R425 WeakPolarHBondContact O-CD 3.2Å; F347-R425 PolarHBondContact O-NH1 3.35Å
348	R	85.9	Confident	73.9	Confident	78 Å²	78	55.5 Å²	55.5	29%	0.294	29%	0.287	S	S	.	.	S	Bend	trans	-73.8	165.7	170.4	-57.4	-174.8	-167	176.7	2.6	110.3	H343 P345 Q350 L550	H343-R348 PolarHBondContact O-NH2 2.88Å; P345-R348 WeakPolarHBondContact O-CB 3.48Å; P345-R348 PolarHBondContact O-N 2.86Å; R348-Q350 PolarHBondContact O-N 3.03Å; R348-L550 WeakPolarHBondContact CA-O 3.29Å; R348-L550 WeakPolarHBondContact CB-O 3.48Å
349	L	90.8	Very high	75.6	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	27%	0.266	C	S	.	.			trans	-60.4	132	174.1	-66.4	-168.6	0	0	0	110.4	P359 V360 L375 D379 L545 L550 G551 W553	L349-P359 WeakPolarHBondContact O-CA 3.31Å; L349-V360 HydrophobicContact CB-CB 4.32Å; L349-V360 HydrophobicContact CB-CG2 3.86Å; L349-V360 WeakPolarHBondContact O-CG2 3.49Å; L349-V360 PolarHBondContact O-N 3.27Å; L349-L375 HydrophobicContact CB-CD2 3.99Å; L349-L375 HydrophobicContact CD1-CD2 4.22Å; L349-D379 HydrophobicContact CD2-CB 3.86Å; L349-L545 HydrophobicContact CD1-CD1 4.26Å; L349-L545 HydrophobicContact CD2-CD1 4.28Å; L349-L545 HydrophobicContact CD2-CD2 4.18Å; L349-L550 PolarHBondContact N-O 3.18Å; L349-G551 WeakPolarHBondContact CD1-O 3.4Å; L349-W553 HydrophobicContact CD1-CB 4.04Å; L349-W553 HydrophobicContact CD1-CE3 3.99Å; L349-W553 HydrophobicContact CD2-CE3 4.34Å
350	Q	91.4	Very high	77.4	Confident	15 Å²	15	43.3 Å²	43.3	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148	175.5	-53.8	-174.8	3	0	0	110.4	A346 R348 L357 K358 L375 S376 D379	A346-Q350 PolarHBondContact O-NE2 3.37Å; R348-Q350 PolarHBondContact O-N 3.03Å; Q350-L357 HydrophobicContact CB-CD1 3.62Å; Q350-L357 HydrophobicContact CB-CG 4.22Å; Q350-K358 CarbonylContact C-O 3.5Å; Q350-K358 WeakPolarHBondContact CA-O 3.17Å; Q350-L375 CarbonylContact O-C 3.54Å; Q350-L375 VanDerWaalsContact O-CA 3.31Å; Q350-L375 WeakPolarHBondContact O-CA 3.44Å; Q350-L375 VanDerWaalsContact O-CD2 3.27Å; Q350-L375 WeakPolarHBondContact O-CD2 3.34Å; Q350-S376 WeakPolarHBondContact O-CB 3.32Å; Q350-S376 PolarHBondContact O-N 2.93Å; Q350-D379 PolarHBondContact N-OD2 2.95Å
351	A	91.7	Very high	79	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.033	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.6	176.5	0	0	0	0	0	112.4	V353 L357 K358 V360 C374 L375	A351-V353 HydrophobicContact CB-CG2 4.1Å; A351-V353 PolarHBondContact O-N 2.76Å; A351-L357 WeakPolarHBondContact O-CA 3.39Å; A351-K358 PolarHBondContact N-O 2.79Å; A351-K358 PolarHBondContact O-N 2.74Å; A351-V360 HydrophobicContact CB-CG2 3.98Å; A351-C374 CarbonylContact C-O 3.6Å; A351-C374 WeakPolarHBondContact CA-O 3.3Å; A351-L375 HydrophobicContact CB-CD2 4.27Å
352	H	91.5	Very high	80.5	Confident	6 Å²	6	49 Å²	49	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	119.6	161.8	-66.4	-84.1	0	0	0	109	S249 H265 Q356 G373 C374	S249-H352 WeakPolarHBondContact OG-CB 3.39Å; H265-H352 AromaticContact CE1-CD2 3.58Å; H265-H352 AromaticContact CE1-CG 3.97Å; H265-H352 AromaticContact CE1-NE2 3.75Å; H265-H352 AromaticContact NE2-CD2 3.87Å; H265-H352 AromaticContact NE2-CE1 3.8Å; H265-H352 AromaticContact NE2-NE2 3.53Å; H352-Q356 CarbonylContact C-O 3.51Å; H352-Q356 VanDerWaalsContact CA-O 3.31Å; H352-Q356 WeakPolarHBondContact CA-O 3.49Å; H352-G373 CarbonylContact O-C 3.59Å; H352-G373 WeakPolarHBondContact O-CA 3.36Å; H352-C374 PolarHBondContact N-O 3.32Å; H352-C374 PolarHBondContact O-N 2.99Å
353	V	89.6	Confident	82.2	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	127.9	177.2	-168.6	0	0	0	0	107.2	A351 G355 Q356 V363 L367	A351-V353 HydrophobicContact CB-CG2 4.1Å; A351-V353 PolarHBondContact O-N 2.76Å; V353-G355 PolarHBondContact O-N 3.06Å; V353-Q356 PolarHBondContact N-O 2.84Å; V353-Q356 PolarHBondContact O-N 2.86Å; V353-V363 HydrophobicContact CB-CG1 4.43Å; V353-V363 HydrophobicContact CG1-CG1 4.12Å; V353-V363 HydrophobicContact CG2-CG1 3.89Å; V353-V363 HydrophobicContact CG2-CG2 3.84Å; V353-L367 HydrophobicContact CG1-CB 4.32Å
354	C	86.9	Confident	83.8	Confident	59 Å²	59	43.9 Å²	43.9	40%	0.399	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	41.1	-175.1	-52.9	0	0	0	0	112.6	Q356 H371	C354-Q356 VanDerWaalsContact C-N 3.26Å; C354-Q356 PolarHBondContact O-N 2.91Å; C354-H371 VanDerWaalsContact SG-CD2 3.6Å
355	G	83.6	Confident	85	Confident	40 Å²	40	44.3 Å²	44.3	41%	0.412	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-23.9	-177.1	0	0	0	0	0	116	V353	V353-G355 PolarHBondContact O-N 3.06Å
356	Q	86.9	Confident	86.3	Confident	113 Å²	113	44.7 Å²	44.7	53%	0.528	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	137.4	-174.8	-65.4	-179.3	-19.1	0	0	112.4	H352 V353 C354	H352-Q356 CarbonylContact C-O 3.51Å; H352-Q356 VanDerWaalsContact CA-O 3.31Å; H352-Q356 WeakPolarHBondContact CA-O 3.49Å; V353-Q356 PolarHBondContact N-O 2.84Å; V353-Q356 PolarHBondContact O-N 2.86Å; C354-Q356 VanDerWaalsContact C-N 3.26Å; C354-Q356 PolarHBondContact O-N 2.91Å
357	L	88.8	Confident	87.5	Confident	59 Å²	59	47.6 Å²	47.6	31%	0.309	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.5	172.3	-177	56.7	0	0	0	109.9	K325 Q350 A351	K325-L357 HydrophobicContact CB-CD2 4.32Å; Q350-L357 HydrophobicContact CB-CD1 3.62Å; Q350-L357 HydrophobicContact CB-CG 4.22Å; A351-L357 WeakPolarHBondContact O-CA 3.39Å
358	K	87.8	Confident	87.8	Confident	86 Å²	86	50.9 Å²	50.9	37%	0.374	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.6	-179	-62.7	-175.9	-178.8	175.5	0	111.5	Q350 A351 V360 V363	Q350-K358 CarbonylContact C-O 3.5Å; Q350-K358 WeakPolarHBondContact CA-O 3.17Å; A351-K358 PolarHBondContact N-O 2.79Å; A351-K358 PolarHBondContact O-N 2.74Å; K358-V360 PolarHBondContact O-N 3.43Å; K358-V363 HydrophobicContact CB-CG2 4.33Å
359	P	88.3	Confident	87.7	Confident	25 Å²	25	52 Å²	52	16%	0.162	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	134.3	167.8	-25.5	35.3	0	0	0	111.2	L349 S361 Y362	L349-P359 WeakPolarHBondContact O-CA 3.31Å; P359-S361 PolarHBondContact O-N 3.25Å; P359-Y362 HydrophobicContact CB-CD2 3.91Å; P359-Y362 HydrophobicContact CB-CE2 4.24Å; P359-Y362 HydrophobicContact CB-CG 4.25Å; P359-Y362 HydrophobicContact CG-CD2 3.79Å; P359-Y362 HydrophobicContact CG-CE2 3.96Å; P359-Y362 PolarHBondContact O-N 2.98Å
360	V	88.4	Confident	87.6	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.055	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-59.7	-33.2	-174.8	172.1	0	0	0	0	112.1	L349 A351 K358 Y362 V363 R368 L375 P554	L349-V360 HydrophobicContact CB-CB 4.32Å; L349-V360 HydrophobicContact CB-CG2 3.86Å; L349-V360 WeakPolarHBondContact O-CG2 3.49Å; L349-V360 PolarHBondContact O-N 3.27Å; A351-V360 HydrophobicContact CB-CG2 3.98Å; K358-V360 PolarHBondContact O-N 3.43Å; V360-Y362 PolarHBondContact O-N 3.26Å; V360-V363 PolarHBondContact O-N 2.78Å; V360-R368 PolarHBondContact O-NH1 2.93Å; V360-L375 HydrophobicContact CG2-CD2 3.56Å; V360-P554 HydrophobicContact CG1-CG 3.69Å; V360-P554 HydrophobicContact CG2-CG 4.28Å
361	S	84.3	Confident	87.6	Confident	67 Å²	67	55 Å²	55	47%	0.469	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-57.7	-27.2	173.6	53.4	0	0	0	0	113.7	P359	P359-S361 PolarHBondContact O-N 3.25Å
362	Y	85.8	Confident	87.6	Confident	150 Å²	150	54.8 Å²	54.8	59%	0.588	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-98.8	-0.9	-177.6	-55.8	-18.1	0	0	0	113.1	P359 V360	P359-Y362 HydrophobicContact CB-CD2 3.91Å; P359-Y362 HydrophobicContact CB-CE2 4.24Å; P359-Y362 HydrophobicContact CB-CG 4.25Å; P359-Y362 HydrophobicContact CG-CD2 3.79Å; P359-Y362 HydrophobicContact CG-CE2 3.96Å; P359-Y362 PolarHBondContact O-N 2.98Å; V360-Y362 PolarHBondContact O-N 3.26Å
363	V	86.8	Confident	87.5	Confident	7 Å²	7	55.2 Å²	55.2	4%	0.042	32%	0.316	C	S	.	.	S	Bend	trans	-86	114.5	174.6	-171.9	0	0	0	0	109	V353 K358 V360 L367 R368	V353-V363 HydrophobicContact CB-CG1 4.43Å; V353-V363 HydrophobicContact CG1-CG1 4.12Å; V353-V363 HydrophobicContact CG2-CG1 3.89Å; V353-V363 HydrophobicContact CG2-CG2 3.84Å; K358-V363 HydrophobicContact CB-CG2 4.33Å; V360-V363 PolarHBondContact O-N 2.78Å; V363-L367 HydrophobicContact CG1-CB 4.05Å; V363-R368 HydrophobicContact CB-CG 3.83Å; V363-R368 HydrophobicContact CG1-CG 3.48Å; V363-R368 VanDerWaalsContact CG1-CG 3.48Å; V363-R368 WeakPolarHBondContact O-CD 3.32Å; V363-R368 PolarHBondContact O-NH1 2.91Å
364	A	88.8	Confident	87.7	Confident	50 Å²	50	55.5 Å²	55.5	41%	0.413	32%	0.318	S	S	.	.			trans	-54.5	141.1	178.6	0	0	0	0	0	112.1	A366 L367 R368	A364-A366 VanDerWaalsContact C-N 3.33Å; A364-A366 PolarHBondContact O-N 3.08Å; A364-L367 PolarHBondContact O-N 3.37Å; A364-R368 PolarHBondContact O-N 2.81Å; A364-R368 VanDerWaalsContact O-N 3.17Å
365	P	87.1	Confident	88	Confident	73 Å²	73	53.3 Å²	53.3	47%	0.474	30%	0.303	S	S	.	.	H	α-helix	trans	-49.9	-49.6	-177	-27.3	33.2	0	0	0	113.4	L367 R368 D369	P365-L367 PolarHBondContact O-N 3.31Å; P365-L367 VanDerWaalsContact O-N 3.1Å; P365-R368 WeakPolarHBondContact O-CA 3.22Å; P365-R368 WeakPolarHBondContact O-CB 3.37Å; P365-R368 PolarHBondContact O-N 3.25Å; P365-D369 PolarHBondContact O-N 2.87Å; P365-D369 VanDerWaalsContact O-OD2 3.08Å
366	A	88.2	Confident	88.5	Confident	68 Å²	68	51.4 Å²	51.4	56%	0.562	28%	0.283	S	S	*	.	H	α-helix	trans	-51.6	-38.7	178	0	0	0	0	0	113.5	A364 T370	A364-A366 VanDerWaalsContact C-N 3.33Å; A364-A366 PolarHBondContact O-N 3.08Å; A366-T370 WeakPolarHBondContact O-CB 3.28Å; A366-T370 VanDerWaalsContact O-CG2 3.3Å; A366-T370 WeakPolarHBondContact O-CG2 3.42Å; A366-T370 PolarHBondContact O-N 3.34Å; A366-T370 VanDerWaalsContact O-N 3.11Å; A366-T370 PolarHBondContact O-OG1 3.4Å
367	L	87.1	Confident	88.8	Confident	69 Å²	69	46.4 Å²	46.4	36%	0.361	26%	0.261	S	S	.	.	H	α-helix	trans	-75.5	-35.8	175.8	-67.5	177.2	0	0	0	112.6	V353 V363 A364 P365 D369 H371	V353-L367 HydrophobicContact CG1-CB 4.32Å; V363-L367 HydrophobicContact CG1-CB 4.05Å; A364-L367 PolarHBondContact O-N 3.37Å; P365-L367 PolarHBondContact O-N 3.31Å; P365-L367 VanDerWaalsContact O-N 3.1Å; L367-D369 VanDerWaalsContact C-N 3.29Å; L367-D369 PolarHBondContact O-N 3.34Å; L367-H371 WeakPolarHBondContact O-CB 3.42Å; L367-H371 PolarHBondContact O-N 3.12Å
368	R	83.2	Confident	89	Confident	79 Å²	79	43.6 Å²	43.6	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-39.2	176	-61.4	-169.1	-63.8	-133.2	12.1	111.8	V360 V363 A364 P365	V360-R368 PolarHBondContact O-NH1 2.93Å; V363-R368 HydrophobicContact CB-CG 3.83Å; V363-R368 HydrophobicContact CG1-CG 3.48Å; V363-R368 VanDerWaalsContact CG1-CG 3.48Å; V363-R368 WeakPolarHBondContact O-CD 3.32Å; V363-R368 PolarHBondContact O-NH1 2.91Å; A364-R368 PolarHBondContact O-N 2.81Å; A364-R368 VanDerWaalsContact O-N 3.17Å; P365-R368 WeakPolarHBondContact O-CA 3.22Å; P365-R368 WeakPolarHBondContact O-CB 3.37Å; P365-R368 PolarHBondContact O-N 3.25Å
369	D	85.4	Confident	89.4	Confident	101 Å²	101	39.7 Å²	39.7	54%	0.54	23%	0.229	S	C	.	.	H	α-helix	trans	-89.7	-24.4	-171.5	-59.3	-36.8	0	0	0	113.4	L254 P365 L367	L254-D369 WeakPolarHBondContact CD1-O 3.32Å; P365-D369 PolarHBondContact O-N 2.87Å; P365-D369 VanDerWaalsContact O-OD2 3.08Å; L367-D369 VanDerWaalsContact C-N 3.29Å; L367-D369 PolarHBondContact O-N 3.34Å
370	T	88.7	Confident	89.7	Confident	54 Å²	54	39.4 Å²	39.4	33%	0.331	23%	0.225	S	C	.	.	H	α-helix	trans	-103.2	-33.3	179.3	62.3	0	0	0	0	114.7	W253 L254 A366	W253-T370 CarbonylContact C-O 3.58Å; W253-T370 WeakPolarHBondContact CA-O 3.47Å; W253-T370 HydrophobicContact CZ3-CG2 4.18Å; L254-T370 PolarHBondContact N-O 3.33Å; A366-T370 WeakPolarHBondContact O-CB 3.28Å; A366-T370 VanDerWaalsContact O-CG2 3.3Å; A366-T370 WeakPolarHBondContact O-CG2 3.42Å; A366-T370 PolarHBondContact O-N 3.34Å; A366-T370 VanDerWaalsContact O-N 3.11Å; A366-T370 PolarHBondContact O-OG1 3.4Å
371	H	91.4	Very high	90	Very high	29 Å²	29	39 Å²	39	13%	0.134	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-105.3	164	-172.1	-75.2	62.8	0	0	0	113.3	W253 L254 C354 L367 G373 K556	W253-H371 AromaticContact CD2-CE1 3.97Å; W253-H371 AromaticContact CE3-CE1 3.75Å; W253-H371 AromaticContact CH2-CE1 3.77Å; W253-H371 AromaticContact CZ2-CE1 3.98Å; W253-H371 AromaticContact CZ3-CE1 3.66Å; L254-H371 WeakPolarHBondContact CD2-O 3.44Å; L254-H371 WeakPolarHBondContact CG-O 3.34Å; C354-H371 VanDerWaalsContact SG-CD2 3.6Å; L367-H371 WeakPolarHBondContact O-CB 3.42Å; L367-H371 PolarHBondContact O-N 3.12Å; H371-G373 PolarHBondContact O-N 2.78Å; H371-K556 PolarHBondContact O-NZ 3.37Å; H371-K556 VanDerWaalsContact O-NZ 3.15Å
372	V	90.7	Very high	90.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.			trans	-72.7	76.2	173.4	178.4	0	0	0	0	110.5	C250 G252 L254 H262 C374	C250-V372 HydrophobicContact CB-CG1 4.24Å; C250-V372 VanDerWaalsContact O-CB 3.24Å; C250-V372 WeakPolarHBondContact O-CB 3.44Å; C250-V372 WeakPolarHBondContact O-CG1 3.38Å; G252-V372 WeakPolarHBondContact O-CB 3.29Å; G252-V372 VanDerWaalsContact O-CG2 3.28Å; G252-V372 WeakPolarHBondContact O-CG2 3.41Å; G252-V372 PolarHBondContact O-N 2.79Å; L254-V372 HydrophobicContact CD2-CG2 3.96Å; H262-V372 HydrophobicContact CB-CG1 3.77Å; H262-V372 WeakPolarHBondContact O-CG1 3.46Å; V372-C374 VanDerWaalsContact CG1-SG 3.51Å
373	G	90.8	Very high	91	Very high	14 Å²	14	29.5 Å²	29.5	14%	0.144	18%	0.177	C	C	.	.			trans	-74.7	117.3	161.2	0	0	0	0	0	111.9	H352 H371 K556	H352-G373 CarbonylContact O-C 3.59Å; H352-G373 WeakPolarHBondContact O-CA 3.36Å; H371-G373 PolarHBondContact O-N 2.78Å; G373-K556 WeakPolarHBondContact O-CE 3.38Å; G373-K556 PolarHBondContact O-NZ 3.43Å
374	C	93	Very high	91.5	Very high	13 Å²	13	30.2 Å²	30.2	9%	0.088	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	114	-177.2	-79.4	0	0	0	0	110.3	H262 D263 A351 H352 V372	H262-C374 PolarHBondContact O-SG 2.9Å; D263-C374 HydrophobicContact CB-CB 4.34Å; D263-C374 WeakPolarHBondContact OD2-CB 3.34Å; A351-C374 CarbonylContact C-O 3.6Å; A351-C374 WeakPolarHBondContact CA-O 3.3Å; H352-C374 PolarHBondContact N-O 3.32Å; H352-C374 PolarHBondContact O-N 2.99Å; V372-C374 VanDerWaalsContact CG1-SG 3.51Å
375	L	94	Very high	91.8	Very high	14 Å²	14	28 Å²	28	7%	0.073	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	160.3	-178	-79.6	163.9	0	0	0	113.3	L349 Q350 A351 V360 K380 W553	L349-L375 HydrophobicContact CB-CD2 3.99Å; L349-L375 HydrophobicContact CD1-CD2 4.22Å; Q350-L375 CarbonylContact O-C 3.54Å; Q350-L375 VanDerWaalsContact O-CA 3.31Å; Q350-L375 WeakPolarHBondContact O-CA 3.44Å; Q350-L375 VanDerWaalsContact O-CD2 3.27Å; Q350-L375 WeakPolarHBondContact O-CD2 3.34Å; A351-L375 HydrophobicContact CB-CD2 4.27Å; V360-L375 HydrophobicContact CG2-CD2 3.56Å; L375-K380 VanDerWaalsContact O-CE 3.29Å; L375-K380 WeakPolarHBondContact O-CE 3.48Å; L375-K380 PolarHBondContact O-NZ 2.78Å; L375-W553 HydrophobicContact CD1-CD2 3.14Å; L375-W553 HydrophobicContact CD1-CE3 3.46Å; L375-W553 VanDerWaalsContact CD1-CE3 3.46Å; L375-W553 HydrophobicContact CD1-CG 3.74Å; L375-W553 HydrophobicContact CD1-CH2 3.58Å; L375-W553 HydrophobicContact CD1-CZ2 3.31Å; L375-W553 HydrophobicContact CD1-CZ3 3.66Å
376	S	93.8	Very high	92.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.			trans	-62.5	165.2	-176.3	84.9	0	0	0	0	112.9	K325 Q350 S378 D379 K380	K325-S376 CarbonylContact O-C 3.52Å; K325-S376 WeakPolarHBondContact O-CB 3.3Å; K325-S376 PolarHBondContact O-OG 3.24Å; Q350-S376 WeakPolarHBondContact O-CB 3.32Å; Q350-S376 PolarHBondContact O-N 2.93Å; S376-S378 PolarHBondContact OG-OG 2.75Å; S376-D379 WeakPolarHBondContact CB-OD2 3.31Å; S376-D379 VanDerWaalsContact OG-CB 3.32Å; S376-D379 WeakPolarHBondContact OG-CB 3.39Å; S376-D379 PolarHBondContact OG-N 2.85Å; S376-D379 VanDerWaalsContact OG-N 3.1Å; S376-D379 PolarHBondContact OG-OD2 2.86Å; S376-K380 VanDerWaalsContact O-CG 3.3Å; S376-K380 WeakPolarHBondContact O-CG 3.34Å; S376-K380 PolarHBondContact O-N 3.22Å
377	A	93.5	Very high	92.5	Very high	7 Å²	7	21.4 Å²	21.4	6%	0.058	11%	0.112	C	C	.	.	H	α-helix	trans	-72.8	-38.1	178.4	0	0	0	0	0	111.4	L267 P324 K325 K380 L381	L267-A377 HydrophobicContact CD2-CB 4.41Å; P324-A377 HydrophobicContact CB-CB 3.77Å; K325-A377 PolarHBondContact O-N 2.81Å; A377-K380 PolarHBondContact O-N 2.79Å; A377-L381 PolarHBondContact O-N 2.66Å; A377-L381 VanDerWaalsContact O-N 3.08Å
378	S	93.1	Very high	93	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.1	-41.8	176.1	61.7	0	0	0	0	112.5	K325 G326 A327 S376 K380 L381 A382	K325-S378 PolarHBondContact O-N 3.31Å; K325-S378 VanDerWaalsContact O-N 3.16Å; G326-S378 WeakPolarHBondContact CA-OG 3.49Å; A327-S378 PolarHBondContact N-OG 3.08Å; S376-S378 PolarHBondContact OG-OG 2.75Å; S378-K380 VanDerWaalsContact C-N 3.3Å; S378-K380 PolarHBondContact O-N 3.44Å; S378-L381 PolarHBondContact O-N 3.27Å; S378-L381 VanDerWaalsContact O-N 3.15Å; S378-A382 PolarHBondContact O-N 2.93Å
379	D	94.3	Very high	93.6	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-66.7	-33.4	180	-61.4	-30.5	0	0	0	112.2	L349 Q350 S376 R383 R425 W553	L349-D379 HydrophobicContact CD2-CB 3.86Å; Q350-D379 PolarHBondContact N-OD2 2.95Å; S376-D379 WeakPolarHBondContact CB-OD2 3.31Å; S376-D379 VanDerWaalsContact OG-CB 3.32Å; S376-D379 WeakPolarHBondContact OG-CB 3.39Å; S376-D379 PolarHBondContact OG-N 2.85Å; S376-D379 VanDerWaalsContact OG-N 3.1Å; S376-D379 PolarHBondContact OG-OD2 2.86Å; D379-R383 WeakPolarHBondContact O-CB 3.45Å; D379-R383 PolarHBondContact O-N 3.36Å; D379-R383 VanDerWaalsContact O-N 3.12Å; D379-R425 IonicContact OD1-CZ 2.66Å; D379-R425 IonicContact OD1-NH1 3.66Å; D379-R425 PolarHBondContact OD1-NH1 2.89Å; D379-R425 IonicContact OD1-NH2 2.72Å; D379-R425 PolarHBondContact OD1-NH2 2.74Å; D379-W553 HydrophobicContact CB-CZ3 4.31Å
380	K	95.8	Very high	94.1	Very high	19 Å²	19	10.1 Å²	10.1	8%	0.083	6%	0.06	C	C	.	.	H	α-helix	trans	-67.9	-41	171.1	-72.7	179.9	-161.2	111.9	0	112.3	D263 V268 L375 S376 A377 S378 R383 W384 W553	D263-K380 IonicContact OD1-NZ 3.77Å; D263-K380 WeakPolarHBondContact OD2-CE 3.35Å; D263-K380 IonicContact OD2-NZ 2.7Å; D263-K380 PolarHBondContact OD2-NZ 3.22Å; V268-K380 HydrophobicContact CG2-CD 3.59Å; L375-K380 VanDerWaalsContact O-CE 3.29Å; L375-K380 WeakPolarHBondContact O-CE 3.48Å; L375-K380 PolarHBondContact O-NZ 2.78Å; S376-K380 VanDerWaalsContact O-CG 3.3Å; S376-K380 WeakPolarHBondContact O-CG 3.34Å; S376-K380 PolarHBondContact O-N 3.22Å; A377-K380 PolarHBondContact O-N 2.79Å; S378-K380 VanDerWaalsContact C-N 3.3Å; S378-K380 PolarHBondContact O-N 3.44Å; K380-R383 CarbonylContact O-C 3.51Å; K380-R383 WeakPolarHBondContact O-CB 3.48Å; K380-R383 PolarHBondContact O-N 2.92Å; K380-W384 HydrophobicContact CB-CD2 4.48Å; K380-W384 HydrophobicContact CB-CH2 3.99Å; K380-W384 HydrophobicContact CB-CZ2 3.63Å; K380-W384 HydrophobicContact CD-CH2 4.26Å; K380-W384 HydrophobicContact CD-CZ2 3.89Å; K380-W384 HydrophobicContact CG-CZ2 4.18Å; K380-W384 PolarHBondContact O-N 3.09Å; K380-W553 HydrophobicContact CG-CH2 4.23Å
381	L	95.3	Very high	94.4	Very high	1 Å²	1	8 Å²	8	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-66.6	-45.5	-179.8	-171.8	55	0	0	0	111.3	L267 L318 P324 A377 S378 R383 W384 A385 L406 I422 L445	L267-L381 HydrophobicContact CD2-CD2 4.41Å; L318-L381 HydrophobicContact CD1-CD1 3.69Å; P324-L381 HydrophobicContact CG-CD2 4.41Å; A377-L381 PolarHBondContact O-N 2.66Å; A377-L381 VanDerWaalsContact O-N 3.08Å; S378-L381 PolarHBondContact O-N 3.27Å; S378-L381 VanDerWaalsContact O-N 3.15Å; L381-R383 PolarHBondContact O-N 2.83Å; L381-W384 HydrophobicContact CD1-CE3 4.21Å; L381-W384 PolarHBondContact O-N 3.47Å; L381-A385 PolarHBondContact O-N 2.86Å; L381-L406 HydrophobicContact CD2-CD1 4.4Å; L381-L406 HydrophobicContact CD2-CD2 3.84Å; L381-I422 HydrophobicContact CD2-CD1 3.62Å; L381-I422 HydrophobicContact CD2-CG1 4.03Å; L381-I422 HydrophobicContact CG-CD1 4.15Å; L381-I422 HydrophobicContact CG-CG1 4.16Å; L381-I422 HydrophobicContact CG-CG2 4.46Å; L381-L445 HydrophobicContact CD1-CD1 3.95Å; L381-L445 HydrophobicContact CG-CD1 4.25Å
382	A	94.5	Very high	94.7	Very high	5 Å²	5	6.9 Å²	6.9	4%	0.041	5%	0.045	C	C	.	.	H	α-helix	trans	-53.5	-42.1	169.7	0	0	0	0	0	112.1	S378 A385 I422	S378-A382 PolarHBondContact O-N 2.93Å; A382-A385 WeakPolarHBondContact O-CB 3.33Å; A382-A385 PolarHBondContact O-N 2.81Å; A382-I422 WeakPolarHBondContact CA-O 3.24Å; A382-I422 WeakPolarHBondContact CB-O 3.37Å
383	R	95.2	Very high	95	Very high	13 Å²	13	7.3 Å²	7.3	5%	0.049	5%	0.047	C	C	.	.	H	α-helix	trans	-68	-34.6	176.3	-177.2	163	-158.5	118.7	25	113.8	D379 K380 L381 V386 L387 R538 L541 S542 W553	D379-R383 WeakPolarHBondContact O-CB 3.45Å; D379-R383 PolarHBondContact O-N 3.36Å; D379-R383 VanDerWaalsContact O-N 3.12Å; K380-R383 CarbonylContact O-C 3.51Å; K380-R383 WeakPolarHBondContact O-CB 3.48Å; K380-R383 PolarHBondContact O-N 2.92Å; L381-R383 PolarHBondContact O-N 2.83Å; R383-V386 PolarHBondContact O-N 3.03Å; R383-L387 HydrophobicContact CG-CD1 3.92Å; R383-L387 HydrophobicContact CG-CG 4.4Å; R383-L387 PolarHBondContact O-N 3.31Å; R383-R538 VanDerWaalsContact NH2-CA 3.28Å; R383-R538 PolarHBondContact NH2-O 3.05Å; R383-L541 HydrophobicContact CG-CD2 3.94Å; R383-S542 PolarHBondContact NH1-OG 3.05Å; R383-S542 PolarHBondContact NH2-OG 3.39Å; R383-W553 HydrophobicContact CB-CH2 3.87Å; R383-W553 HydrophobicContact CB-CZ3 3.94Å; R383-W553 VanDerWaalsContact CD-CZ3 3.48Å; R383-W553 HydrophobicContact CG-CH2 4.14Å; R383-W553 HydrophobicContact CG-CZ3 4.32Å; R383-W553 VanDerWaalsContact NH1-CE3 3.27Å
384	W	96.8	Very high	95.4	Very high	21 Å²	21	6.8 Å²	6.8	8%	0.08	4%	0.041	C	C	.	.	H	α-helix	trans	-78.2	-23.7	177.6	-55.6	-26.9	0	0	0	112.7	L267 V268 R271 K380 L381 V386 G388 L389	L267-W384 HydrophobicContact CD1-CZ3 4.08Å; L267-W384 HydrophobicContact CD2-CZ3 4.33Å; L267-W384 HydrophobicContact CG-CH2 4.35Å; L267-W384 HydrophobicContact CG-CZ3 3.86Å; V268-W384 HydrophobicContact CG2-CH2 4.39Å; R271-W384 HydrophobicContact CB-CH2 4.15Å; R271-W384 HydrophobicContact CB-CZ3 4.22Å; R271-W384 VanDerWaalsContact CD-CH2 3.5Å; R271-W384 HydrophobicContact CG-CH2 4.48Å; K380-W384 HydrophobicContact CB-CD2 4.48Å; K380-W384 HydrophobicContact CB-CH2 3.99Å; K380-W384 HydrophobicContact CB-CZ2 3.63Å; K380-W384 HydrophobicContact CD-CH2 4.26Å; K380-W384 HydrophobicContact CD-CZ2 3.89Å; K380-W384 HydrophobicContact CG-CZ2 4.18Å; K380-W384 PolarHBondContact O-N 3.09Å; L381-W384 HydrophobicContact CD1-CE3 4.21Å; L381-W384 PolarHBondContact O-N 3.47Å; W384-V386 PolarHBondContact O-N 3.22Å; W384-G388 WeakPolarHBondContact O-CA 3.32Å; W384-G388 PolarHBondContact O-N 3.43Å; W384-L389 HydrophobicContact CB-CD2 3.99Å; W384-L389 HydrophobicContact CD2-CD2 4.17Å; W384-L389 HydrophobicContact CE3-CD2 3.83Å; W384-L389 HydrophobicContact CG-CD2 4.24Å
385	A	95.3	Very high	95.6	Very high	4 Å²	4	7.2 Å²	7.2	3%	0.033	5%	0.046	C	C	.	.	H	α-helix	trans	-64.8	-13	167.6	0	0	0	0	0	113	L381 A382 I422 R442 T443 L445	L381-A385 PolarHBondContact O-N 2.86Å; A382-A385 WeakPolarHBondContact O-CB 3.33Å; A382-A385 PolarHBondContact O-N 2.81Å; A385-I422 HydrophobicContact CB-CG2 4.31Å; A385-R442 CarbonylContact O-C 3.58Å; A385-R442 WeakPolarHBondContact O-CA 3.34Å; A385-T443 PolarHBondContact O-N 2.91Å; A385-L445 HydrophobicContact CB-CD1 4.37Å
386	V	94.8	Very high	95.7	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-115.6	-34.4	179	-178.4	0	0	0	0	113.5	R383 W384 L428 L436 V441 R442 L541	R383-V386 PolarHBondContact O-N 3.03Å; W384-V386 PolarHBondContact O-N 3.22Å; V386-L428 HydrophobicContact CG2-CD1 4.49Å; V386-L436 HydrophobicContact CG1-CD1 3.52Å; V386-V441 WeakPolarHBondContact CA-O 3.48Å; V386-R442 HydrophobicContact CG2-CB 4.29Å; V386-L541 HydrophobicContact CB-CD1 4.49Å; V386-L541 HydrophobicContact CB-CD2 3.92Å; V386-L541 HydrophobicContact CG1-CD1 4.06Å; V386-L541 HydrophobicContact CG1-CD2 3.87Å
387	L	95.7	Very high	95.9	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-108.6	2.9	-177.1	-58.7	-177.2	0	0	0	114.4	R383 Y440 Y534 A537 R538 L541	R383-L387 HydrophobicContact CG-CD1 3.92Å; R383-L387 HydrophobicContact CG-CG 4.4Å; R383-L387 PolarHBondContact O-N 3.31Å; L387-Y440 HydrophobicContact CD2-CD1 4.05Å; L387-Y440 HydrophobicContact CD2-CG 4.31Å; L387-Y534 HydrophobicContact CB-CE2 3.96Å; L387-Y534 HydrophobicContact CD1-CE2 4.41Å; L387-A537 HydrophobicContact CD2-CB 3.56Å; L387-R538 HydrophobicContact CD1-CB 4.13Å; L387-L541 HydrophobicContact CD1-CD2 3.87Å; L387-L541 HydrophobicContact CD2-CD2 4.16Å; L387-L541 HydrophobicContact CG-CD2 3.72Å
388	G	96.8	Very high	96.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	165.8	-172.8	0	0	0	0	0	114.5	W384 L401	W384-G388 WeakPolarHBondContact O-CA 3.32Å; W384-G388 PolarHBondContact O-N 3.43Å; G388-L401 CarbonylContact C-O 3.44Å; G388-L401 WeakPolarHBondContact CA-O 3.18Å
389	L	97.6	Very high	96.2	Very high	5 Å²	5	9.5 Å²	9.5	3%	0.026	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.2	173	-62.3	170.7	0	0	0	111.8	R271 L274 L275 L318 W384 G391 L401 A403	R271-L389 HydrophobicContact CG-CB 4.5Å; R271-L389 HydrophobicContact CG-CD2 4.11Å; R271-L389 PolarHBondContact NE-O 3.09Å; R271-L389 PolarHBondContact NH2-O 3.48Å; L274-L389 HydrophobicContact CD2-CB 4.03Å; L274-L389 HydrophobicContact CD2-CD1 3.81Å; L274-L389 HydrophobicContact CD2-CG 4.5Å; L275-L389 WeakPolarHBondContact CD2-O 3.4Å; L318-L389 HydrophobicContact CD2-CD1 4.46Å; W384-L389 HydrophobicContact CB-CD2 3.99Å; W384-L389 HydrophobicContact CD2-CD2 4.17Å; W384-L389 HydrophobicContact CE3-CD2 3.83Å; W384-L389 HydrophobicContact CG-CD2 4.24Å; L389-G391 PolarHBondContact O-N 3.47Å; L389-L401 WeakPolarHBondContact CB-O 3.44Å; L389-L401 PolarHBondContact N-O 3.13Å; L389-A403 HydrophobicContact CD1-CB 3.94Å
390	G	95.6	Very high	96.3	Very high	8 Å²	8	10.4 Å²	10.4	8%	0.082	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-39.6	-172.3	0	0	0	0	0	115.7	L275	L275-G390 WeakPolarHBondContact CD2-O 3.09Å
391	G	95.5	Very high	96.4	Very high	8 Å²	8	9.8 Å²	9.8	8%	0.082	6%	0.061	C	C	.	.	H	α-helix	trans	68.7	173	178.9	0	0	0	0	0	115.7	L389 L393 L394 A395 Y534	L389-G391 PolarHBondContact O-N 3.47Å; G391-L393 VanDerWaalsContact C-N 3.3Å; G391-L393 PolarHBondContact O-N 2.92Å; G391-L394 PolarHBondContact O-N 3.16Å; G391-A395 PolarHBondContact O-N 2.94Å; G391-A395 VanDerWaalsContact O-N 3.15Å; G391-Y534 VanDerWaalsContact CA-CE2 3.49Å
392	G	96.1	Very high	96.5	Very high	6 Å²	6	11.8 Å²	11.8	6%	0.062	7%	0.069	C	C	.	.	H	α-helix	trans	-64.8	-10.9	-163.9	0	0	0	0	0	119.2	K530 A531	G392-K530 CarbonylContact O-C 3.54Å; G392-K530 VanDerWaalsContact O-CA 3.32Å; G392-K530 WeakPolarHBondContact O-CA 3.47Å; G392-A531 PolarHBondContact O-N 2.79Å
393	L	97.8	Very high	96.6	Very high	10 Å²	10	11.9 Å²	11.9	5%	0.052	7%	0.069	C	C	.	.	H	α-helix	trans	-87.5	-40.2	172.5	-65.4	-176.6	0	0	0	111.9	F279 G391 A395 F504 F508 Y526 A529 K530	F279-L393 HydrophobicContact CZ-CB 3.99Å; G391-L393 VanDerWaalsContact C-N 3.3Å; G391-L393 PolarHBondContact O-N 2.92Å; L393-A395 VanDerWaalsContact C-N 3.28Å; L393-F504 HydrophobicContact CD1-CB 3.99Å; L393-F508 HydrophobicContact CB-CD2 4.14Å; L393-F508 HydrophobicContact CD1-CB 4.28Å; L393-F508 HydrophobicContact CD2-CD2 4.18Å; L393-F508 HydrophobicContact CD2-CG 4.22Å; L393-Y526 HydrophobicContact CD1-CD2 4.31Å; L393-Y526 HydrophobicContact CD1-CE2 3.6Å; L393-A529 HydrophobicContact CD2-CB 3.73Å; L393-A529 WeakPolarHBondContact CD2-O 3.44Å; L393-K530 HydrophobicContact CD2-CG 4.25Å
394	L	98	Very high	96.7	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-73.1	-22.8	174.9	-71.1	177.3	0	0	0	112.1	L275 F278 F279 L282 G391 H396 F397 L398	L275-L394 HydrophobicContact CD2-CD1 3.82Å; F278-L394 HydrophobicContact CB-CD1 3.64Å; F278-L394 HydrophobicContact CB-CD2 4.26Å; F278-L394 HydrophobicContact CG-CD1 4.42Å; F279-L394 HydrophobicContact CD1-CD2 3.76Å; F279-L394 HydrophobicContact CD2-CD2 4.1Å; F279-L394 HydrophobicContact CE1-CD2 3.57Å; F279-L394 HydrophobicContact CE1-CG 4.43Å; F279-L394 HydrophobicContact CE2-CD2 3.93Å; F279-L394 HydrophobicContact CE2-CG 4.17Å; F279-L394 HydrophobicContact CG-CD2 4.02Å; F279-L394 HydrophobicContact CZ-CD2 3.66Å; F279-L394 HydrophobicContact CZ-CG 4.05Å; L282-L394 HydrophobicContact CD1-CD2 3.75Å; G391-L394 PolarHBondContact O-N 3.16Å; L394-H396 PolarHBondContact O-N 2.95Å; L394-F397 CarbonylContact O-C 3.56Å; L394-F397 WeakPolarHBondContact O-CA 3.34Å; L394-F397 PolarHBondContact O-N 3.37Å; L394-L398 HydrophobicContact CD2-CD1 4.44Å; L394-L398 PolarHBondContact O-N 3.33Å
395	A	97.3	Very high	96.7	Very high	23 Å²	23	11.3 Å²	11.3	19%	0.19	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-6.1	177.3	0	0	0	0	0	115.6	G391 L393 A531	G391-A395 PolarHBondContact O-N 2.94Å; G391-A395 VanDerWaalsContact O-N 3.15Å; L393-A395 VanDerWaalsContact C-N 3.28Å; A395-A531 HydrophobicContact CB-CB 3.79Å
396	H	96.9	Very high	96.9	Very high	40 Å²	40	11.1 Å²	11.1	19%	0.185	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-14	167.8	-68.7	-85.7	0	0	0	113.7	P307 L394 F508 L520 A529 A531	P307-H396 WeakPolarHBondContact CD-O 3.46Å; L394-H396 PolarHBondContact O-N 2.95Å; H396-F508 HydrophobicContact CB-CE2 4.33Å; H396-F508 AromaticContact CD2-CE2 3.44Å; H396-F508 VanDerWaalsContact CD2-CE2 3.44Å; H396-F508 WeakPolarHBondContact CD2-CE2 3.39Å; H396-F508 AromaticContact CD2-CZ 3.96Å; H396-F508 AromaticContact NE2-CE2 3.97Å; H396-L520 HydrophobicContact CB-CD1 4.21Å; H396-L520 WeakPolarHBondContact ND1-CD2 3.27Å; H396-A529 PolarHBondContact CD2-O 2.75Å; H396-A529 PolarHBondContact NE2-O 3.01Å; H396-A531 PolarHBondContact NE2-N 3.42Å; H396-A531 VanDerWaalsContact NE2-N 3.17Å
397	F	97.8	Very high	97	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-29.1	-168.3	-53.8	-49	0	0	0	112.9	F279 L282 F308 L394 F508 V511 A512 L515 L520	F279-F397 HydrophobicContact CE1-CD2 4.4Å; F279-F397 HydrophobicContact CE1-CE2 4.27Å; L282-F397 HydrophobicContact CD1-CB 3.69Å; L282-F397 HydrophobicContact CD1-CD2 3.99Å; L282-F397 HydrophobicContact CD1-CG 4.13Å; L282-F397 HydrophobicContact CD2-CB 3.92Å; L282-F397 HydrophobicContact CG-CB 4.5Å; F308-F397 PolarHBondContact N-O 3.49Å; F308-F397 VanDerWaalsContact N-O 3.11Å; L394-F397 CarbonylContact O-C 3.56Å; L394-F397 WeakPolarHBondContact O-CA 3.34Å; L394-F397 PolarHBondContact O-N 3.37Å; F397-F508 AromaticContact CE2-CD2 3.55Å; F397-F508 HydrophobicContact CE2-CD2 3.55Å; F397-F508 AromaticContact CE2-CE2 3.81Å; F397-F508 HydrophobicContact CE2-CE2 3.81Å; F397-F508 AromaticContact CZ-CD2 3.93Å; F397-F508 HydrophobicContact CZ-CD2 3.93Å; F397-F508 AromaticContact CZ-CE2 3.8Å; F397-F508 HydrophobicContact CZ-CE2 3.8Å; F397-V511 HydrophobicContact CD1-CG1 3.93Å; F397-V511 HydrophobicContact CD2-CB 4.41Å; F397-V511 HydrophobicContact CD2-CG1 3.85Å; F397-V511 HydrophobicContact CE1-CG1 3.82Å; F397-V511 HydrophobicContact CE2-CB 3.93Å; F397-V511 HydrophobicContact CE2-CG1 3.71Å; F397-V511 HydrophobicContact CG-CG1 3.95Å; F397-V511 HydrophobicContact CZ-CB 4.05Å; F397-V511 HydrophobicContact CZ-CG1 3.71Å; F397-A512 HydrophobicContact CZ-CB 4.3Å; F397-L515 HydrophobicContact CD1-CD1 3.66Å; F397-L515 HydrophobicContact CE1-CD1 3.88Å; F397-L520 HydrophobicContact CE1-CD1 3.69Å; F397-L520 HydrophobicContact CZ-CD1 3.94Å
398	L	97.5	Very high	97	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.01	7%	0.068	C	C	.	.	S	Bend	trans	-133.9	148.8	-177.4	-62.3	173.7	0	0	0	111.5	F278 L282 L298 P306 F308 L394 L401	F278-L398 HydrophobicContact CB-CD1 4.12Å; F278-L398 HydrophobicContact CD1-CD1 3.98Å; F278-L398 HydrophobicContact CG-CD1 4.17Å; L282-L398 HydrophobicContact CD1-CD1 4.35Å; L282-L398 HydrophobicContact CD1-CG 4.48Å; L282-L398 HydrophobicContact CD2-CD2 4.21Å; L282-L398 HydrophobicContact CD2-CG 4.34Å; L298-L398 HydrophobicContact CD1-CD1 4.39Å; L298-L398 HydrophobicContact CD1-CD2 3.93Å; L298-L398 HydrophobicContact CD2-CD1 4.32Å; L298-L398 HydrophobicContact CD2-CD2 3.56Å; L298-L398 HydrophobicContact CG-CD2 4.33Å; P306-L398 VanDerWaalsContact CB-C 3.48Å; F308-L398 HydrophobicContact CB-CD2 3.71Å; F308-L398 WeakPolarHBondContact O-CD2 3.41Å; L394-L398 HydrophobicContact CD2-CD1 4.44Å; L394-L398 PolarHBondContact O-N 3.33Å; L398-L401 HydrophobicContact CB-CD2 4.41Å; L398-L401 HydrophobicContact CD1-CD1 3.92Å
399	P	96.1	Very high	96.9	Very high	26 Å²	26	11.1 Å²	11.1	17%	0.169	7%	0.068	C	C	.	.			trans	-65.3	170.2	164.4	30.6	-36.3	0	0	0	111.1	W25 F308 A309 L401	W25-P399 HydrophobicContact CZ2-CB 4.24Å; F308-P399 WeakPolarHBondContact O-CD 3.44Å; A309-P399 HydrophobicContact CB-CG 4.39Å; P399-L401 PolarHBondContact O-N 3.17Å
400	P	96.6	Very high	96.5	Very high	24 Å²	24	11.9 Å²	11.9	16%	0.156	7%	0.072	C	C	.	.			trans	-60.2	121.1	178.2	-23.7	35.5	0	0	0	111.7	Y402 P439 Y440	P400-Y402 HydrophobicContact CB-CE2 3.69Å; P400-Y402 WeakPolarHBondContact O-CD2 3.44Å; P400-Y402 WeakPolarHBondContact O-CE2 3.47Å; P400-P439 VanDerWaalsContact CD-CG 3.47Å; P400-P439 HydrophobicContact CG-CG 3.72Å; P400-Y440 HydrophobicContact CB-CD1 4.2Å; P400-Y440 HydrophobicContact CB-CE1 3.95Å; P400-Y440 HydrophobicContact CG-CD1 3.76Å; P400-Y440 HydrophobicContact CG-CE1 3.44Å; P400-Y440 VanDerWaalsContact CG-CE1 3.44Å
401	L	97.2	Very high	96	Very high	5 Å²	5	16.4 Å²	16.4	3%	0.026	10%	0.1	C	C	.	.			trans	-91.6	109.8	-179.2	-51.2	174.8	0	0	0	109	F278 L310 L316 G388 L389 L398 P399	F278-L401 HydrophobicContact CD1-CD1 4.14Å; F278-L401 HydrophobicContact CD2-CD1 3.56Å; F278-L401 HydrophobicContact CE1-CD1 4.1Å; F278-L401 HydrophobicContact CE2-CD1 3.51Å; F278-L401 HydrophobicContact CG-CD1 3.9Å; F278-L401 HydrophobicContact CZ-CD1 3.81Å; L310-L401 HydrophobicContact CD1-CD2 3.98Å; L310-L401 HydrophobicContact CG-CD2 4.02Å; L316-L401 HydrophobicContact CD1-CB 4.34Å; G388-L401 CarbonylContact C-O 3.44Å; G388-L401 WeakPolarHBondContact CA-O 3.18Å; L389-L401 WeakPolarHBondContact CB-O 3.44Å; L389-L401 PolarHBondContact N-O 3.13Å; L398-L401 HydrophobicContact CB-CD2 4.41Å; L398-L401 HydrophobicContact CD1-CD1 3.92Å; P399-L401 PolarHBondContact O-N 3.17Å
402	Y	97.3	Very high	95.3	Very high	44 Å²	44	20.8 Å²	20.8	17%	0.173	13%	0.128	C	C	.	.			trans	-96.3	161.8	174.1	-54	-85.2	0	0	0	110.3	P400 V441 T443	P400-Y402 HydrophobicContact CB-CE2 3.69Å; P400-Y402 WeakPolarHBondContact O-CD2 3.44Å; P400-Y402 WeakPolarHBondContact O-CE2 3.47Å; Y402-V441 HydrophobicContact CE2-CG2 4.47Å; Y402-V441 PolarHBondContact OH-N 2.97Å; Y402-V441 PolarHBondContact OH-O 3.07Å; Y402-T443 WeakPolarHBondContact CD1-OG1 3.22Å; Y402-T443 WeakPolarHBondContact CD2-OG1 3.38Å; Y402-T443 HydrophobicContact CG-CG2 4.25Å; Y402-T443 VanDerWaalsContact CG-OG1 3.27Å
403	A	97.4	Very high	94.7	Very high	6 Å²	6	21.7 Å²	21.7	5%	0.05	13%	0.131	C	C	.	.			trans	-93.4	147.4	163.9	0	0	0	0	0	109.4	L316 L318 L389 L445	L316-A403 HydrophobicContact CB-CB 4.35Å; L316-A403 CarbonylContact O-C 3.54Å; L316-A403 WeakPolarHBondContact O-CA 3.2Å; L316-A403 VanDerWaalsContact O-CB 3.29Å; L316-A403 WeakPolarHBondContact O-CB 3.3Å; L318-A403 HydrophobicContact CD1-CB 4.19Å; L318-A403 HydrophobicContact CG-CB 3.89Å; L389-A403 HydrophobicContact CD1-CB 3.94Å; A403-L445 HydrophobicContact CB-CD2 3.67Å; A403-L445 WeakPolarHBondContact O-CD2 3.15Å
404	T	96.8	Very high	94.1	Very high	22 Å²	22	23.2 Å²	23.2	14%	0.135	14%	0.139	C	C	.	.	S	Bend	trans	-81.4	-39.4	176.8	-47.1	0	0	0	0	110.7	L18 I20 L316 H446	L18-T404 HydrophobicContact CD1-CG2 4.32Å; I20-T404 HydrophobicContact CD1-CG2 4.04Å; L316-T404 PolarHBondContact O-N 2.9Å; T404-H446 PolarHBondContact O-CD2 2.92Å; T404-H446 PolarHBondContact O-N 3.35Å
405	S	97.4	Very high	93.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	161.2	-177.6	68.6	0	0	0	0	114.6	H189 H317 L318 H446	H189-S405 PolarHBondContact NE2-OG 2.77Å; H317-S405 WeakPolarHBondContact CB-OG 3.14Å; H317-S405 PolarHBondContact ND1-OG 2.89Å; L318-S405 PolarHBondContact N-O 2.92Å; S405-H446 CarbonylContact C-O 3.54Å; S405-H446 WeakPolarHBondContact CA-O 3.31Å; S405-H446 VanDerWaalsContact CB-O 3.24Å; S405-H446 WeakPolarHBondContact CB-O 3.47Å
406	L	97.6	Very high	93	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	114.9	167.3	176.5	73.6	0	0	0	108.6	L318 V320 L381 L418 I422 H446 L447 F448	L318-L406 HydrophobicContact CB-CD1 3.62Å; L318-L406 HydrophobicContact CD1-CD1 4.34Å; L318-L406 CarbonylContact O-C 3.53Å; L318-L406 WeakPolarHBondContact O-CA 3.24Å; V320-L406 HydrophobicContact CG2-CD1 3.71Å; L381-L406 HydrophobicContact CD2-CD1 4.4Å; L381-L406 HydrophobicContact CD2-CD2 3.84Å; L406-L418 HydrophobicContact CD2-CD2 4.24Å; L406-I422 HydrophobicContact CD2-CD1 3.97Å; L406-H446 PolarHBondContact N-O 3.4Å; L406-L447 HydrophobicContact CB-CD2 3.85Å; L406-L447 HydrophobicContact CD2-CD2 3.95Å; L406-L447 HydrophobicContact CG-CD2 4.49Å; L406-L447 WeakPolarHBondContact O-CA 3.48Å; L406-F448 PolarHBondContact O-N 2.94Å
407	V	97.5	Very high	92.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.4	167.6	-177.2	0	0	0	0	108	E190 C193 L318 Y319 V320 F448	E190-V407 HydrophobicContact CB-CG1 3.84Å; E190-V407 HydrophobicContact CB-CG2 4.15Å; C193-V407 HydrophobicContact CB-CG2 3.89Å; L318-V407 PolarHBondContact O-N 3.25Å; Y319-V407 CarbonylContact C-O 3.55Å; Y319-V407 WeakPolarHBondContact CA-O 3.47Å; Y319-V407 HydrophobicContact CD2-CB 4.02Å; Y319-V407 HydrophobicContact CD2-CG1 3.76Å; Y319-V407 HydrophobicContact CE2-CG1 4.16Å; V320-V407 PolarHBondContact N-O 3.07Å; V407-F448 WeakPolarHBondContact CA-O 3.02Å; V407-F448 HydrophobicContact CG2-CB 4.29Å
408	L	95.8	Very high	92.1	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.2	175.3	177.3	55.5	0	0	0	109.1	V320 N322 D410 H413 L418 F448 T449 G450	V320-L408 HydrophobicContact CB-CD1 4.46Å; V320-L408 WeakPolarHBondContact O-CD1 3.37Å; N322-L408 VanDerWaalsContact C-CD1 3.48Å; N322-L408 WeakPolarHBondContact O-CD1 3.27Å; L408-D410 HydrophobicContact CD1-CB 3.74Å; L408-D410 HydrophobicContact CG-CB 4.06Å; L408-H413 HydrophobicContact CD2-CB 3.55Å; L408-H413 VanDerWaalsContact CD2-CG 3.45Å; L408-H413 HydrophobicContact CG-CB 4.42Å; L408-L418 HydrophobicContact CD2-CD1 4.46Å; L408-L418 HydrophobicContact CD2-CD2 3.58Å; L408-F448 PolarHBondContact N-O 2.76Å; L408-T449 WeakPolarHBondContact O-CA 3.19Å; L408-G450 PolarHBondContact O-N 2.77Å
409	A	94.5	Very high	91.7	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.008	18%	0.183	C	C	.	.			trans	-100.7	5.8	-179	0	0	0	0	0	114.6	Y319 V320 P411 G450 P451 L452	Y319-A409 HydrophobicContact CE2-CB 3.89Å; Y319-A409 WeakPolarHBondContact OH-CB 3.3Å; V320-A409 PolarHBondContact O-N 2.86Å; A409-P411 WeakPolarHBondContact O-CD 3.49Å; A409-G450 WeakPolarHBondContact CA-O 3.49Å; A409-P451 WeakPolarHBondContact CB-O 3.41Å; A409-L452 HydrophobicContact CB-CG 4.43Å; A409-L452 WeakPolarHBondContact O-CD1 3.47Å; A409-L452 WeakPolarHBondContact O-CG 3.5Å
410	D	90.5	Very high	91.4	Very high	20 Å²	20	30.6 Å²	30.6	11%	0.107	18%	0.18	C	C	.	.			trans	-71.8	119.7	174.9	-171	-24.5	0	0	0	110	T323 L408 C412 H413	T323-D410 VanDerWaalsContact CB-OD2 3.23Å; T323-D410 WeakPolarHBondContact CB-OD2 3.28Å; T323-D410 PolarHBondContact N-OD2 3.29Å; T323-D410 PolarHBondContact OG1-OD2 2.95Å; L408-D410 HydrophobicContact CD1-CB 3.74Å; L408-D410 HydrophobicContact CG-CB 4.06Å; D410-C412 PolarHBondContact O-N 3.28Å; D410-C412 WeakPolarHBondContact OD1-CB 3.45Å; D410-C412 PolarHBondContact OD1-N 2.63Å; D410-H413 HydrophobicContact CB-CB 4.44Å; D410-H413 PolarHBondContact O-ND1 3.47Å
411	P	84.1	Confident	91	Very high	103 Å²	103	29.5 Å²	29.5	67%	0.669	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.2	179.8	31.8	-35.3	0	0	0	113.1	A409	A409-P411 WeakPolarHBondContact O-CD 3.49Å
412	C	81.1	Confident	90.7	Very high	100 Å²	100	29.3 Å²	29.3	68%	0.676	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.4	13.1	-175.7	-61.9	0	0	0	0	113.6	I331 D410	I331-C412 WeakPolarHBondContact CD1-O 3.3Å; D410-C412 PolarHBondContact O-N 3.28Å; D410-C412 WeakPolarHBondContact OD1-CB 3.45Å; D410-C412 PolarHBondContact OD1-N 2.63Å
413	H	82.9	Confident	90.3	Very high	26 Å²	26	28.2 Å²	28.2	12%	0.12	17%	0.169	C	C	.	.			trans	-83.4	150.7	-179.2	84.7	-92.7	0	0	0	113.2	T323 L408 D410 T449	T323-H413 VanDerWaalsContact OG1-CB 3.28Å; T323-H413 WeakPolarHBondContact OG1-CB 3.48Å; L408-H413 HydrophobicContact CD2-CB 3.55Å; L408-H413 VanDerWaalsContact CD2-CG 3.45Å; L408-H413 HydrophobicContact CG-CB 4.42Å; D410-H413 HydrophobicContact CB-CB 4.44Å; D410-H413 PolarHBondContact O-ND1 3.47Å; H413-T449 PolarHBondContact CE1-OG1 2.88Å
414	D	84.8	Confident	89.8	Confident	42 Å²	42	30.1 Å²	30.1	23%	0.225	18%	0.182	C	C	.	.			trans	-101.6	109	169.7	178.3	61	0	0	0	110.1	I331 P416 T417 L418	I331-D414 HydrophobicContact CD1-CB 4.07Å; I331-D414 HydrophobicContact CG1-CB 4.26Å; D414-P416 WeakPolarHBondContact OD1-CD 3.26Å; D414-T417 PolarHBondContact O-N 2.72Å; D414-T417 WeakPolarHBondContact OD2-CA 3.36Å; D414-T417 WeakPolarHBondContact OD2-CB 3.41Å; D414-T417 PolarHBondContact OD2-N 3.11Å; D414-T417 PolarHBondContact OD2-OG1 3.32Å; D414-L418 WeakPolarHBondContact O-CB 3.42Å; D414-L418 PolarHBondContact O-N 3.47Å
415	P	86.3	Confident	89.2	Confident	65 Å²	65	29.3 Å²	29.3	42%	0.422	18%	0.176	S	C	.	.	H	α-helix	trans	-59.2	-42.1	-176.8	-17.1	25	0	0	0	114.4	T417 L418 N419	P415-T417 PolarHBondContact O-N 3.03Å; P415-L418 PolarHBondContact O-N 3.38Å; P415-N419 VanDerWaalsContact O-CB 3.26Å; P415-N419 WeakPolarHBondContact O-CB 3.38Å; P415-N419 PolarHBondContact O-N 2.89Å
416	P	87.3	Confident	88.5	Confident	66 Å²	66	29.5 Å²	29.5	43%	0.429	18%	0.177	S	C	.	.	H	α-helix	trans	-57.9	-44.6	173.1	-27	35.7	0	0	0	113.9	D414 N419 R420	D414-P416 WeakPolarHBondContact OD1-CD 3.26Å; P416-N419 PolarHBondContact O-N 2.92Å; P416-R420 WeakPolarHBondContact O-CB 3.18Å; P416-R420 WeakPolarHBondContact O-CG 3.34Å; P416-R420 PolarHBondContact O-N 3.46Å; P416-R420 PolarHBondContact O-NE 2.98Å
417	T	85.7	Confident	87.8	Confident	9 Å²	9	35.2 Å²	35.2	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-70.5	-39.7	178.9	-64.9	0	0	0	0	112	A327 F347 D414 P415 N419 R420 A421	A327-T417 WeakPolarHBondContact O-CG2 3.29Å; F347-T417 HydrophobicContact CZ-CG2 3.93Å; D414-T417 PolarHBondContact O-N 2.72Å; D414-T417 WeakPolarHBondContact OD2-CA 3.36Å; D414-T417 WeakPolarHBondContact OD2-CB 3.41Å; D414-T417 PolarHBondContact OD2-N 3.11Å; D414-T417 PolarHBondContact OD2-OG1 3.32Å; P415-T417 PolarHBondContact O-N 3.03Å; T417-N419 VanDerWaalsContact C-N 3.34Å; T417-N419 PolarHBondContact O-N 2.81Å; T417-R420 PolarHBondContact O-N 3.47Å; T417-R420 PolarHBondContact OG1-NH2 3.42Å; T417-R420 VanDerWaalsContact OG1-NH2 3.08Å; T417-A421 WeakPolarHBondContact O-CB 3.46Å; T417-A421 PolarHBondContact O-N 3.43Å
418	L	88.7	Confident	87	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-46.7	170.1	-178.2	67.6	0	0	0	111.4	P324 A328 L406 L408 D414 P415 A421 I422 L447	P324-L418 HydrophobicContact CG-CD1 4.37Å; A328-L418 HydrophobicContact CB-CD1 3.75Å; L406-L418 HydrophobicContact CD2-CD2 4.24Å; L408-L418 HydrophobicContact CD2-CD1 4.46Å; L408-L418 HydrophobicContact CD2-CD2 3.58Å; D414-L418 WeakPolarHBondContact O-CB 3.42Å; D414-L418 PolarHBondContact O-N 3.47Å; P415-L418 PolarHBondContact O-N 3.38Å; L418-A421 PolarHBondContact O-N 2.92Å; L418-I422 HydrophobicContact CD1-CD1 3.85Å; L418-I422 HydrophobicContact CD1-CG1 4.49Å; L418-I422 HydrophobicContact CG-CD1 3.97Å; L418-I422 VanDerWaalsContact O-CG1 3.31Å; L418-I422 WeakPolarHBondContact O-CG1 3.39Å; L418-I422 PolarHBondContact O-N 3.43Å; L418-I422 VanDerWaalsContact O-N 3.08Å; L418-L447 HydrophobicContact CD2-CD1 4.17Å; L418-L447 HydrophobicContact CG-CD1 4.14Å
419	N	90.4	Very high	85.7	Confident	74 Å²	74	43.1 Å²	43.1	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-60.3	-49.8	178.2	-173.4	33.9	0	0	0	111.9	P415 P416 T417 A421 I422 H423 L447	P415-N419 VanDerWaalsContact O-CB 3.26Å; P415-N419 WeakPolarHBondContact O-CB 3.38Å; P415-N419 PolarHBondContact O-N 2.89Å; P416-N419 PolarHBondContact O-N 2.92Å; T417-N419 VanDerWaalsContact C-N 3.34Å; T417-N419 PolarHBondContact O-N 2.81Å; N419-A421 PolarHBondContact O-N 3.5Å; N419-I422 PolarHBondContact O-N 3.17Å; N419-H423 WeakPolarHBondContact O-CB 3.24Å; N419-H423 PolarHBondContact O-N 3.25Å; N419-H423 PolarHBondContact OD1-ND1 3.42Å; N419-L447 HydrophobicContact CB-CD1 3.86Å
420	R	88.7	Confident	84.1	Confident	32 Å²	32	44.8 Å²	44.8	12%	0.121	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-41.2	175.7	-71.8	-179.8	-67.4	-143	3.3	112.3	E338 F347 P416 T417 I422 S424	E338-R420 IonicContact OE1-NH1 3.2Å; E338-R420 PolarHBondContact OE1-NH1 3.42Å; E338-R420 IonicContact OE2-NH1 2.74Å; E338-R420 PolarHBondContact OE2-NH1 3.45Å; F347-R420 HydrophobicContact CE1-CB 4.02Å; P416-R420 WeakPolarHBondContact O-CB 3.18Å; P416-R420 WeakPolarHBondContact O-CG 3.34Å; P416-R420 PolarHBondContact O-N 3.46Å; P416-R420 PolarHBondContact O-NE 2.98Å; T417-R420 PolarHBondContact O-N 3.47Å; T417-R420 PolarHBondContact OG1-NH2 3.42Å; T417-R420 VanDerWaalsContact OG1-NH2 3.08Å; R420-I422 VanDerWaalsContact C-N 3.29Å; R420-I422 PolarHBondContact O-N 3.41Å; R420-S424 WeakPolarHBondContact CA-OG 3.16Å; R420-S424 VanDerWaalsContact O-CB 3.3Å; R420-S424 WeakPolarHBondContact O-CB 3.5Å; R420-S424 PolarHBondContact O-N 2.64Å; R420-S424 VanDerWaalsContact O-N 3.12Å
421	A	89	Confident	82.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-32.3	-179.6	0	0	0	0	0	112.8	A327 A328 F347 T417 L418 N419 R425	A327-A421 HydrophobicContact CB-CB 4.14Å; A328-A421 HydrophobicContact CB-CB 3.88Å; F347-A421 HydrophobicContact CE1-CB 4.46Å; T417-A421 WeakPolarHBondContact O-CB 3.46Å; T417-A421 PolarHBondContact O-N 3.43Å; L418-A421 PolarHBondContact O-N 2.92Å; N419-A421 PolarHBondContact O-N 3.5Å; A421-R425 PolarHBondContact O-NE 2.99Å; A421-R425 PolarHBondContact O-NH2 3.44Å
422	I	90.8	Very high	80.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-87.7	-52.5	178.2	-61.5	168	0	0	0	111.7	L381 A382 A385 L406 L418 N419 R420 L445 L447	L381-I422 HydrophobicContact CD2-CD1 3.62Å; L381-I422 HydrophobicContact CD2-CG1 4.03Å; L381-I422 HydrophobicContact CG-CD1 4.15Å; L381-I422 HydrophobicContact CG-CG1 4.16Å; L381-I422 HydrophobicContact CG-CG2 4.46Å; A382-I422 WeakPolarHBondContact CA-O 3.24Å; A382-I422 WeakPolarHBondContact CB-O 3.37Å; A385-I422 HydrophobicContact CB-CG2 4.31Å; L406-I422 HydrophobicContact CD2-CD1 3.97Å; L418-I422 HydrophobicContact CD1-CD1 3.85Å; L418-I422 HydrophobicContact CD1-CG1 4.49Å; L418-I422 HydrophobicContact CG-CD1 3.97Å; L418-I422 VanDerWaalsContact O-CG1 3.31Å; L418-I422 WeakPolarHBondContact O-CG1 3.39Å; L418-I422 PolarHBondContact O-N 3.43Å; L418-I422 VanDerWaalsContact O-N 3.08Å; N419-I422 PolarHBondContact O-N 3.17Å; R420-I422 VanDerWaalsContact C-N 3.29Å; R420-I422 PolarHBondContact O-N 3.41Å; I422-L445 HydrophobicContact CG2-CD1 3.92Å; I422-L447 HydrophobicContact CD1-CD2 4.04Å
423	H	89.8	Confident	79	Confident	22 Å²	22	49.6 Å²	49.6	10%	0.102	28%	0.282	C	S	.	.	H	α-helix	trans	-96.9	-23.2	-165	-59.9	122.3	0	0	0	114.9	N419 R442 L445	N419-H423 WeakPolarHBondContact O-CB 3.24Å; N419-H423 PolarHBondContact O-N 3.25Å; N419-H423 PolarHBondContact OD1-ND1 3.42Å; H423-R442 WeakPolarHBondContact O-CD 3.21Å; H423-R442 PolarHBondContact O-NE 3.17Å; H423-R442 PolarHBondContact O-NH1 3.42Å; H423-L445 PolarHBondContact CE1-O 2.64Å; H423-L445 VanDerWaalsContact CE1-O 3.31Å; H423-L445 PolarHBondContact NE2-N 3.33Å
424	S	85.5	Confident	77.9	Confident	46 Å²	46	53.3 Å²	53.3	32%	0.322	31%	0.312	S	S	.	.	S	Bend	trans	-91.7	-2	-175.2	-50.3	0	0	0	0	114.6	R420 P426 K427	R420-S424 WeakPolarHBondContact CA-OG 3.16Å; R420-S424 VanDerWaalsContact O-CB 3.3Å; R420-S424 WeakPolarHBondContact O-CB 3.5Å; R420-S424 PolarHBondContact O-N 2.64Å; R420-S424 VanDerWaalsContact O-N 3.12Å; S424-P426 CarbonylContact O-C 3.58Å; S424-K427 PolarHBondContact O-N 3.27Å
425	R	83.9	Confident	77.1	Confident	5 Å²	5	54 Å²	54	2%	0.019	32%	0.319	C	S	.	.	S	Bend	trans	-127.5	125.7	-170.8	-66.2	-171	-57.7	135.4	17	113.9	L342 F347 D379 A421 R442 L550	L342-R425 HydrophobicContact CD2-CG 4.07Å; F347-R425 WeakPolarHBondContact O-CD 3.2Å; F347-R425 PolarHBondContact O-NH1 3.35Å; D379-R425 IonicContact OD1-CZ 2.66Å; D379-R425 IonicContact OD1-NH1 3.66Å; D379-R425 PolarHBondContact OD1-NH1 2.89Å; D379-R425 IonicContact OD1-NH2 2.72Å; D379-R425 PolarHBondContact OD1-NH2 2.74Å; A421-R425 PolarHBondContact O-NE 2.99Å; A421-R425 PolarHBondContact O-NH2 3.44Å; R425-R442 PolarHBondContact O-NH2 3.35Å; R425-R442 VanDerWaalsContact O-NH2 3.14Å; R425-L550 HydrophobicContact CB-CD1 4.03Å; R425-L550 HydrophobicContact CG-CD1 4.06Å
426	P	82.5	Confident	76.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.019	31%	0.305	C	S	.	.	S	Bend	cis	-63.7	165.8	-22.1	31.1	-32.5	0	0	0	110.2	S424 L428 R442 L541 L544 L545 L550	S424-P426 CarbonylContact O-C 3.58Å; P426-L428 HydrophobicContact CG-CD2 4.26Å; P426-L428 PolarHBondContact O-N 3.08Å; P426-R442 VanDerWaalsContact O-CZ 3.3Å; P426-R442 PolarHBondContact O-NH1 2.83Å; P426-R442 PolarHBondContact O-NH2 3.38Å; P426-L541 HydrophobicContact CG-CD1 3.59Å; P426-L544 HydrophobicContact CB-CB 4.19Å; P426-L544 HydrophobicContact CG-CB 3.98Å; P426-L545 HydrophobicContact CB-CD2 4.17Å; P426-L545 HydrophobicContact CB-CG 4.37Å; P426-L545 HydrophobicContact CG-CD2 4.23Å; P426-L545 HydrophobicContact CG-CG 4.13Å; P426-L550 HydrophobicContact CB-CD1 4.3Å
427	K	83.4	Confident	76.9	Confident	122 Å²	122	50.6 Å²	50.6	53%	0.53	30%	0.295	S	S	.	.			trans	-64.1	131.1	161.2	-68.5	-178.8	176	178.5	0	107.6	L342 S424 Q548	L342-K427 VanDerWaalsContact CD1-CE 3.5Å; S424-K427 PolarHBondContact O-N 3.27Å; K427-Q548 PolarHBondContact O-NE2 3.11Å
428	L	81.8	Confident	76.9	Confident	18 Å²	18	55 Å²	55	9%	0.094	33%	0.325	C	S	.	.	S	Bend	trans	-91.5	-33.9	176.7	-65.2	-177.6	0	0	0	111	V386 P426 S430 L436 R442 L541 L544	V386-L428 HydrophobicContact CG2-CD1 4.49Å; P426-L428 HydrophobicContact CG-CD2 4.26Å; P426-L428 PolarHBondContact O-N 3.08Å; L428-S430 PolarHBondContact O-N 2.75Å; L428-L436 HydrophobicContact CD1-CD1 3.91Å; L428-L436 HydrophobicContact CD2-CD1 4.09Å; L428-R442 HydrophobicContact CD1-CB 3.72Å; L428-L541 HydrophobicContact CD2-CD1 4.33Å; L428-L544 HydrophobicContact CD2-CD1 4.03Å
429	D	68.3	Low	77	Confident	148 Å²	148	56.5 Å²	56.5	79%	0.791	34%	0.335	S	S	*	.	S	Bend	trans	-82.2	41.5	-172.1	-35	-78.2	0	0	0	111.8
430	S	59.6	Low	77.1	Confident	36 Å²	36	53.6 Å²	53.6	25%	0.252	32%	0.319	S	S	.	.	S	Bend	trans	-89.3	167.1	179.9	70.9	0	0	0	0	111.8	L428 L432 G433	L428-S430 PolarHBondContact O-N 2.75Å; S430-L432 PolarHBondContact O-N 3.08Å; S430-G433 PolarHBondContact O-N 3.02Å
431	V	49.3	Very low	77.2	Confident	160 Å²	160	56.1 Å²	56.1	97%	0.97	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-18.4	-171.3	-172.9	0	0	0	0	114.7	G433	V431-G433 VanDerWaalsContact C-N 3.28Å; V431-G433 PolarHBondContact O-N 3.08Å
432	L	51.5	Low	77.3	Confident	127 Å²	127	58.9 Å²	58.9	67%	0.665	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-3.8	173.7	-79.9	142.7	0	0	0	114.6	S430 C435	S430-L432 PolarHBondContact O-N 3.08Å; L432-C435 PolarHBondContact O-SG 2.97Å
433	G	49.3	Very low	77.3	Confident	37 Å²	37	60.8 Å²	60.8	38%	0.381	36%	0.359	S	S	.	.			trans	76.9	175.9	-174.6	0	0	0	0	0	113.7	S430 V431 C435	S430-G433 PolarHBondContact O-N 3.02Å; V431-G433 VanDerWaalsContact C-N 3.28Å; V431-G433 PolarHBondContact O-N 3.08Å; G433-C435 VanDerWaalsContact C-N 3.3Å; G433-C435 PolarHBondContact O-N 2.94Å; G433-C435 PolarHBondContact O-SG 3.2Å
434	S	59.6	Low	77.4	Confident	105 Å²	105	63.7 Å²	63.7	73%	0.734	38%	0.379	S	S	*	.			trans	-79.6	68.7	-178	43.6	0	0	0	0	112.1	L436	S434-L436 PolarHBondContact O-N 2.87Å
435	C	67.5	Low	77.7	Confident	55 Å²	55	61.9 Å²	61.9	37%	0.372	37%	0.365	S	S	.	.			trans	-60.6	-10.6	-168.8	-43.9	0	0	0	0	117	L432 G433 Q540	L432-C435 PolarHBondContact O-SG 2.97Å; G433-C435 VanDerWaalsContact C-N 3.3Å; G433-C435 PolarHBondContact O-N 2.94Å; G433-C435 PolarHBondContact O-SG 3.2Å; C435-Q540 VanDerWaalsContact O-CD 3.27Å; C435-Q540 PolarHBondContact O-NE2 3.09Å; C435-Q540 PolarHBondContact O-OE1 3.43Å
436	L	83.2	Confident	78.2	Confident	26 Å²	26	64.5 Å²	64.5	14%	0.136	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62.2	131.5	-172.5	-66.9	175.3	0	0	0	111.8	V386 L428 S434 Q540 L541	V386-L436 HydrophobicContact CG1-CD1 3.52Å; L428-L436 HydrophobicContact CD1-CD1 3.91Å; L428-L436 HydrophobicContact CD2-CD1 4.09Å; S434-L436 PolarHBondContact O-N 2.87Å; L436-Q540 VanDerWaalsContact CA-OE1 3.31Å; L436-Q540 HydrophobicContact CD2-CB 4.48Å; L436-L541 HydrophobicContact CD2-CB 4.44Å
437	P	87.3	Confident	78.8	Confident	34 Å²	34	66.8 Å²	66.8	22%	0.221	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-68.6	143.9	178.3	30.1	-37	0	0	0	110.6	Y440 E536 A537	P437-Y440 HydrophobicContact CG-CD2 4.48Å; P437-Y440 WeakPolarHBondContact O-CD2 3.25Å; P437-Y440 PolarHBondContact O-N 3.09Å; P437-E536 HydrophobicContact CG-CB 4.22Å; P437-A537 HydrophobicContact CG-CB 3.8Å
438	C	85.5	Confident	79.4	Confident	101 Å²	101	63.1 Å²	63.1	68%	0.682	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	136.3	170.5	-177.6	0	0	0	0	110.3
439	P	90.4	Very high	80	Confident	34 Å²	34	66.7 Å²	66.7	22%	0.221	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	cis	-104.7	34.1	5	42	-38.8	0	0	0	114	W25 P400	W25-P439 HydrophobicContact CH2-CB 3.69Å; W25-P439 HydrophobicContact CH2-CG 3.62Å; W25-P439 HydrophobicContact CZ2-CB 3.55Å; W25-P439 HydrophobicContact CZ2-CG 3.77Å; P400-P439 VanDerWaalsContact CD-CG 3.47Å; P400-P439 HydrophobicContact CG-CG 3.72Å
440	Y	92.9	Very high	81.2	Confident	14 Å²	14	60.1 Å²	60.1	6%	0.055	36%	0.364	C	S	.	.			trans	-86.7	124.8	-175.9	-65.3	-76.1	0	0	0	112.3	L387 P400 P437 P533 Y534 A537	L387-Y440 HydrophobicContact CD2-CD1 4.05Å; L387-Y440 HydrophobicContact CD2-CG 4.31Å; P400-Y440 HydrophobicContact CB-CD1 4.2Å; P400-Y440 HydrophobicContact CB-CE1 3.95Å; P400-Y440 HydrophobicContact CG-CD1 3.76Å; P400-Y440 HydrophobicContact CG-CE1 3.44Å; P400-Y440 VanDerWaalsContact CG-CE1 3.44Å; P437-Y440 HydrophobicContact CG-CD2 4.48Å; P437-Y440 WeakPolarHBondContact O-CD2 3.25Å; P437-Y440 PolarHBondContact O-N 3.09Å; Y440-P533 HydrophobicContact CE2-CB 4.11Å; Y440-Y534 HydrophobicContact CE1-CD2 4.07Å; Y440-Y534 AromaticContact CZ-CD2 3.99Å; Y440-Y534 WeakPolarHBondContact OH-CB 3.29Å; Y440-A537 HydrophobicContact CD1-CB 4.48Å; Y440-A537 HydrophobicContact CD2-CB 3.5Å; Y440-A537 HydrophobicContact CE2-CB 4.13Å; Y440-A537 HydrophobicContact CG-CB 3.72Å
441	V	91.2	Very high	82.8	Confident	84 Å²	84	61.3 Å²	61.3	51%	0.509	37%	0.371	S	S	.	.			trans	-142.3	160.8	-175.8	-65.8	0	0	0	0	109.8	V386 Y402 T443	V386-V441 WeakPolarHBondContact CA-O 3.48Å; Y402-V441 HydrophobicContact CE2-CG2 4.47Å; Y402-V441 PolarHBondContact OH-N 2.97Å; Y402-V441 PolarHBondContact OH-O 3.07Å; V441-T443 PolarHBondContact O-N 3.09Å
442	R	90.3	Very high	84.8	Confident	58 Å²	58	58.5 Å²	58.5	22%	0.219	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-77.4	119.5	166.9	173.8	163.9	-73.6	144.3	1.4	109.9	A385 V386 H423 R425 P426 L428	A385-R442 CarbonylContact O-C 3.58Å; A385-R442 WeakPolarHBondContact O-CA 3.34Å; V386-R442 HydrophobicContact CG2-CB 4.29Å; H423-R442 WeakPolarHBondContact O-CD 3.21Å; H423-R442 PolarHBondContact O-NE 3.17Å; H423-R442 PolarHBondContact O-NH1 3.42Å; R425-R442 PolarHBondContact O-NH2 3.35Å; R425-R442 VanDerWaalsContact O-NH2 3.14Å; P426-R442 VanDerWaalsContact O-CZ 3.3Å; P426-R442 PolarHBondContact O-NH1 2.83Å; P426-R442 PolarHBondContact O-NH2 3.38Å; L428-R442 HydrophobicContact CD1-CB 3.72Å
443	T	91.1	Very high	86.6	Confident	41 Å²	41	53.2 Å²	53.2	25%	0.252	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-98.7	134.4	166.7	-57.8	0	0	0	0	109.5	A385 Y402 V441	A385-T443 PolarHBondContact O-N 2.91Å; Y402-T443 WeakPolarHBondContact CD1-OG1 3.22Å; Y402-T443 WeakPolarHBondContact CD2-OG1 3.38Å; Y402-T443 HydrophobicContact CG-CG2 4.25Å; Y402-T443 VanDerWaalsContact CG-OG1 3.27Å; V441-T443 PolarHBondContact O-N 3.09Å
444	T	90.4	Very high	88.2	Confident	83 Å²	83	52.4 Å²	52.4	51%	0.509	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-78.6	126.3	173.8	-54.4	0	0	0	0	110.1
445	L	93.1	Very high	88.7	Confident	8 Å²	8	51 Å²	51	4%	0.042	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-85.4	124.8	169.5	-75.4	157.9	0	0	0	109.4	L381 A385 A403 I422 H423 L447	L381-L445 HydrophobicContact CD1-CD1 3.95Å; L381-L445 HydrophobicContact CG-CD1 4.25Å; A385-L445 HydrophobicContact CB-CD1 4.37Å; A403-L445 HydrophobicContact CB-CD2 3.67Å; A403-L445 WeakPolarHBondContact O-CD2 3.15Å; I422-L445 HydrophobicContact CG2-CD1 3.92Å; H423-L445 PolarHBondContact CE1-O 2.64Å; H423-L445 VanDerWaalsContact CE1-O 3.31Å; H423-L445 PolarHBondContact NE2-N 3.33Å; L445-L447 HydrophobicContact CB-CD2 4Å; L445-L447 WeakPolarHBondContact O-CD2 3.35Å; L445-L447 PolarHBondContact O-N 2.78Å
446	H	95.1	Very high	88.3	Confident	61 Å²	61	54.2 Å²	54.2	28%	0.282	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	116.4	171.7	-66.6	-79.1	0	0	0	109.7	L18 T404 S405 L406 F448	L18-H446 VanDerWaalsContact CD1-CD2 3.49Å; L18-H446 WeakPolarHBondContact CD1-CD2 3.41Å; L18-H446 WeakPolarHBondContact CD1-NE2 3.3Å; L18-H446 WeakPolarHBondContact CD2-CE1 3.47Å; L18-H446 WeakPolarHBondContact CD2-NE2 3.44Å; T404-H446 PolarHBondContact O-CD2 2.92Å; T404-H446 PolarHBondContact O-N 3.35Å; S405-H446 CarbonylContact C-O 3.54Å; S405-H446 WeakPolarHBondContact CA-O 3.31Å; S405-H446 VanDerWaalsContact CB-O 3.24Å; S405-H446 WeakPolarHBondContact CB-O 3.47Å; L406-H446 PolarHBondContact N-O 3.4Å; H446-F448 HydrophobicContact CB-CE2 3.62Å; H446-F448 HydrophobicContact CB-CZ 4.08Å; H446-F448 WeakPolarHBondContact O-CD2 3.15Å; H446-F448 WeakPolarHBondContact O-CE2 3.36Å
447	L	94.9	Very high	87.1	Confident	51 Å²	51	59 Å²	59	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.7	-173.3	-49.1	-176.4	0	0	0	110.2	L406 L418 N419 I422 L445	L406-L447 HydrophobicContact CB-CD2 3.85Å; L406-L447 HydrophobicContact CD2-CD2 3.95Å; L406-L447 HydrophobicContact CG-CD2 4.49Å; L406-L447 WeakPolarHBondContact O-CA 3.48Å; L418-L447 HydrophobicContact CD2-CD1 4.17Å; L418-L447 HydrophobicContact CG-CD1 4.14Å; N419-L447 HydrophobicContact CB-CD1 3.86Å; I422-L447 HydrophobicContact CD1-CD2 4.04Å; L445-L447 HydrophobicContact CB-CD2 4Å; L445-L447 WeakPolarHBondContact O-CD2 3.35Å; L445-L447 PolarHBondContact O-N 2.78Å
448	F	95.5	Very high	85.5	Confident	45 Å²	45	63.5 Å²	63.5	20%	0.197	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	139	-179.9	-60.4	-92.4	0	0	0	111.1	L14 H189 E190 L406 V407 L408 H446	L14-F448 HydrophobicContact CD1-CE1 4.02Å; L14-F448 HydrophobicContact CD1-CZ 3.7Å; L14-F448 HydrophobicContact CD2-CE2 4.25Å; L14-F448 HydrophobicContact CD2-CZ 3.76Å; L14-F448 HydrophobicContact CG-CZ 4.36Å; H189-F448 AromaticContact CD2-CE2 3.89Å; E190-F448 HydrophobicContact CB-CB 4.03Å; L406-F448 PolarHBondContact O-N 2.94Å; V407-F448 WeakPolarHBondContact CA-O 3.02Å; V407-F448 HydrophobicContact CG2-CB 4.29Å; L408-F448 PolarHBondContact N-O 2.76Å; H446-F448 HydrophobicContact CB-CE2 3.62Å; H446-F448 HydrophobicContact CB-CZ 4.08Å; H446-F448 WeakPolarHBondContact O-CD2 3.15Å; H446-F448 WeakPolarHBondContact O-CE2 3.36Å
449	T	94.6	Very high	84	Confident	92 Å²	92	63.8 Å²	63.8	56%	0.564	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.6	164.8	-53	0	0	0	0	108.8	L408 H413	L408-T449 WeakPolarHBondContact O-CA 3.19Å; H413-T449 PolarHBondContact CE1-OG1 2.88Å
450	G	92.3	Very high	82.2	Confident	11 Å²	11	66.5 Å²	66.5	11%	0.113	39%	0.389	C	S	.	.			trans	-112.4	171.5	178.8	0	0	0	0	0	113.7	L408 A409	L408-G450 PolarHBondContact O-N 2.77Å; A409-G450 WeakPolarHBondContact CA-O 3.49Å
451	P	93.6	Very high	80.5	Confident	61 Å²	61	69.5 Å²	69.5	40%	0.396	41%	0.412	S	S	.	.			trans	-77.3	152.7	173.7	31.4	-32.9	0	0	0	112.2	A194 Y319 A409	A194-P451 HydrophobicContact CB-CG 3.57Å; Y319-P451 PolarHBondContact OH-O 2.84Å; A409-P451 WeakPolarHBondContact CB-O 3.41Å
452	L	91.8	Very high	79.1	Confident	100 Å²	100	70.5 Å²	70.5	52%	0.524	42%	0.418	S	S	.	.			trans	-68.9	144.1	173.2	-69.4	83.9	0	0	0	110.6	A409	A409-L452 HydrophobicContact CB-CG 4.43Å; A409-L452 WeakPolarHBondContact O-CD1 3.47Å; A409-L452 WeakPolarHBondContact O-CG 3.5Å
453	V	89.3	Confident	78.1	Confident	16 Å²	16	68.2 Å²	68.2	10%	0.097	41%	0.411	C	S	.	.			trans	-106.6	-9.3	174.3	170.4	0	0	0	0	112	A194 V197 S198 L201 Y319	A194-V453 HydrophobicContact CB-CG2 3.97Å; A194-V453 VanDerWaalsContact O-CG2 3.28Å; A194-V453 WeakPolarHBondContact O-CG2 3.43Å; V197-V453 HydrophobicContact CG1-CG1 4.25Å; V197-V453 HydrophobicContact CG1-CG2 4.48Å; S198-V453 VanDerWaalsContact CA-CG1 3.46Å; L201-V453 HydrophobicContact CD1-CG1 3.59Å; Y319-V453 HydrophobicContact CE1-CB 4.45Å; Y319-V453 HydrophobicContact CE1-CG2 4.25Å; Y319-V453 HydrophobicContact CE2-CG2 4.34Å; Y319-V453 WeakPolarHBondContact OH-CG2 3.46Å; Y319-V453 PolarHBondContact OH-N 3.33Å
454	A	82.3	Confident	77.5	Confident	20 Å²	20	73.5 Å²	73.5	17%	0.165	43%	0.433	C	S	.	.	S	Bend	trans	-84.3	148.1	169.6	0	0	0	0	0	110.4	K215	K215-A454 HydrophobicContact CB-CB 4.2Å
455	P	71.2	Confident	77.4	Confident	76 Å²	76	71.2 Å²	71.2	49%	0.494	43%	0.426	S	S	.	.			trans	-55.7	147.3	166.7	-22.7	33.8	0	0	0	111.5	D457	P455-D457 VanDerWaalsContact C-N 3.27Å; P455-D457 PolarHBondContact O-N 2.92Å
456	S	58	Low	77.5	Confident	123 Å²	123	72 Å²	72	86%	0.86	43%	0.43	S	S	*	.	S	Bend	trans	-68.7	-25.4	178.2	-53.5	0	0	0	0	113.3
457	D	57.5	Low	77.6	Confident	127 Å²	127	69 Å²	69	68%	0.679	42%	0.416	S	S	*	.	S	Bend	trans	-80.2	138.5	-176.1	-62.5	-57	0	0	0	112.2	P455 M459	P455-D457 VanDerWaalsContact C-N 3.27Å; P455-D457 PolarHBondContact O-N 2.92Å; D457-M459 PolarHBondContact O-N 2.75Å
458	P	53.4	Low	77.7	Confident	127 Å²	127	66.6 Å²	66.6	83%	0.825	40%	0.404	S	S	*	.			trans	-73.3	87.5	-177.2	30.2	-35.4	0	0	0	111.5
459	M	55.7	Low	77.8	Confident	108 Å²	108	64.5 Å²	64.5	53%	0.532	39%	0.394	S	S	.	.			trans	-55.2	139.5	172.9	-74.5	-63.3	-67.8	0	0	111.7	A213 D457	A213-M459 HydrophobicContact CB-CB 4.07Å; D457-M459 PolarHBondContact O-N 2.75Å
460	P	52.1	Low	78	Confident	91 Å²	91	60.6 Å²	60.6	59%	0.591	37%	0.369	S	S	*	.			trans	-51.1	143	179.8	-30.4	36.3	0	0	0	114.1	T462	P460-T462 PolarHBondContact O-N 2.61Å
461	S	57.8	Low	78.3	Confident	77 Å²	77	60 Å²	60	54%	0.538	36%	0.364	S	S	.	.	S	Bend	trans	-73.7	21.7	-163.7	50	0	0	0	0	116.5	C463 H464	S461-C463 PolarHBondContact O-N 3.48Å; S461-H464 PolarHBondContact O-N 3Å; S461-H464 VanDerWaalsContact O-N 3.08Å
462	T	60.2	Low	78.5	Confident	104 Å²	104	59.3 Å²	59.3	64%	0.638	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.7	-175.5	59.4	0	0	0	0	114.7	P460	P460-T462 PolarHBondContact O-N 2.61Å
463	C	70.8	Confident	78.6	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.074	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3.4	-180	-68.5	0	0	0	0	114.6	P210 A213 S461 G465 L466	P210-C463 PolarHBondContact O-SG 2.73Å; A213-C463 HydrophobicContact CB-CB 3.99Å; S461-C463 PolarHBondContact O-N 3.48Å; C463-G465 PolarHBondContact O-N 2.85Å; C463-L466 PolarHBondContact O-N 3.02Å; C463-L466 VanDerWaalsContact O-N 3.08Å
464	H	77.4	Confident	79	Confident	151 Å²	151	57 Å²	57	70%	0.699	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	130.9	171.7	-73.5	-8.8	0	0	0	110.8	S461 L466	S461-H464 PolarHBondContact O-N 3Å; S461-H464 VanDerWaalsContact O-N 3.08Å; H464-L466 VanDerWaalsContact C-N 3.33Å
465	G	89.6	Confident	79.5	Confident	36 Å²	36	62.2 Å²	62.2	37%	0.371	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	3.8	-174.5	0	0	0	0	0	115.1	C463 V482	C463-G465 PolarHBondContact O-N 2.85Å; G465-V482 WeakPolarHBondContact O-CB 3.45Å; G465-V482 VanDerWaalsContact O-CG2 3.28Å; G465-V482 WeakPolarHBondContact O-CG2 3.42Å; G465-V482 PolarHBondContact O-N 2.81Å
466	L	94.5	Very high	80.6	Confident	23 Å²	23	63 Å²	63	12%	0.12	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	155.9	171.5	-59.2	-176	0	0	0	112.5	Y211 C463 H464 V479 V480 K488	Y211-L466 HydrophobicContact CD1-CD1 3.9Å; Y211-L466 HydrophobicContact CE1-CD1 3.79Å; C463-L466 PolarHBondContact O-N 3.02Å; C463-L466 VanDerWaalsContact O-N 3.08Å; H464-L466 VanDerWaalsContact C-N 3.33Å; L466-V479 HydrophobicContact CD1-CG1 4.44Å; L466-V479 HydrophobicContact CD2-CG1 4.36Å; L466-V480 CarbonylContact C-O 3.59Å; L466-V480 WeakPolarHBondContact CA-O 3.43Å; L466-K488 HydrophobicContact CD2-CD 4.15Å; L466-K488 HydrophobicContact CD2-CG 4.45Å
467	S	96.5	Very high	82.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	118.1	175.6	176.3	0	0	0	0	109.4	T245 C264 V480	T245-S467 WeakPolarHBondContact O-CB 3.4Å; T245-S467 PolarHBondContact O-OG 3.43Å; C264-S467 PolarHBondContact O-OG 2.82Å; S467-V480 PolarHBondContact N-O 2.86Å; S467-V480 WeakPolarHBondContact O-CB 3.39Å; S467-V480 PolarHBondContact O-N 2.87Å
468	L	97.4	Very high	84.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	149.2	176.4	-49.9	-179.4	0	0	0	109.6	L205 Y211 C214 G244 T245 I477 V479	L205-L468 HydrophobicContact CD1-CD1 3.96Å; L205-L468 HydrophobicContact CD2-CD1 4.07Å; Y211-L468 HydrophobicContact CD1-CD2 4.34Å; Y211-L468 HydrophobicContact CD2-CD2 4.47Å; Y211-L468 HydrophobicContact CG-CD2 4.05Å; C214-L468 HydrophobicContact CB-CD1 3.47Å; C214-L468 VanDerWaalsContact CB-CD1 3.47Å; C214-L468 HydrophobicContact CB-CG 3.87Å; G244-L468 CarbonylContact C-O 3.43Å; G244-L468 VanDerWaalsContact CA-O 3.3Å; G244-L468 WeakPolarHBondContact CA-O 3.24Å; T245-L468 HydrophobicContact CG2-CB 4.09Å; T245-L468 HydrophobicContact CG2-CD1 4.31Å; T245-L468 HydrophobicContact CG2-CG 4.4Å; T245-L468 PolarHBondContact N-O 2.95Å; T245-L468 WeakPolarHBondContact OG1-CB 3.25Å; T245-L468 WeakPolarHBondContact OG1-CG 3.46Å; T245-L468 PolarHBondContact OG1-N 2.87Å; L468-I477 HydrophobicContact CB-CG2 3.88Å; L468-I477 HydrophobicContact CD1-CD1 4.25Å; L468-I477 HydrophobicContact CD2-CG2 3.98Å; L468-I477 HydrophobicContact CG-CG2 4.34Å; L468-V479 HydrophobicContact CD2-CB 4.32Å; L468-V479 HydrophobicContact CD2-CG1 4.11Å; L468-V479 HydrophobicContact CD2-CG2 3.88Å
469	N	98.3	Very high	86.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	147.2	167.2	75.9	87.6	0	0	0	113.3	L243 I269 I477 E478 R498 L499	L243-N469 WeakPolarHBondContact O-CA 3.42Å; I269-N469 HydrophobicContact CG2-CB 3.35Å; N469-I477 WeakPolarHBondContact O-CA 3.13Å; N469-E478 PolarHBondContact N-O 3.18Å; N469-E478 WeakPolarHBondContact ND2-CB 3.46Å; N469-E478 PolarHBondContact ND2-O 2.79Å; N469-E478 PolarHBondContact ND2-OE1 3.36Å; N469-E478 PolarHBondContact O-N 3.27Å; N469-R498 PolarHBondContact O-NH2 2.85Å; N469-R498 PolarHBondContact OD1-NE 2.97Å; N469-L499 HydrophobicContact CB-CD1 3.54Å; N469-L499 VanDerWaalsContact CG-CD1 3.41Å; N469-L499 WeakPolarHBondContact OD1-CD1 3.43Å
470	W	98.6	Very high	88.4	Confident	10 Å²	10	43 Å²	43	4%	0.038	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.8	172.2	178.2	89.2	0	0	0	111.1	L204 L240 A242 L243 A273 L472 D474 I477	L204-W470 HydrophobicContact CD1-CB 4Å; L204-W470 HydrophobicContact CD1-CD2 3.71Å; L204-W470 HydrophobicContact CD1-CE3 4.12Å; L204-W470 HydrophobicContact CD1-CG 3.66Å; L204-W470 HydrophobicContact CD2-CD2 4.49Å; L204-W470 HydrophobicContact CD2-CG 4.26Å; L240-W470 HydrophobicContact CD2-CE3 4.48Å; L240-W470 HydrophobicContact CD2-CZ3 4.18Å; L240-W470 HydrophobicContact CG-CZ3 4Å; L240-W470 WeakPolarHBondContact O-CZ3 3.41Å; A242-W470 CarbonylContact C-O 3.59Å; A242-W470 WeakPolarHBondContact CA-O 3.47Å; L243-W470 PolarHBondContact N-O 2.85Å; L243-W470 PolarHBondContact O-N 2.89Å; A273-W470 VanDerWaalsContact CB-O 3.28Å; A273-W470 WeakPolarHBondContact CB-O 3.33Å; W470-L472 HydrophobicContact CH2-CB 3.86Å; W470-L472 HydrophobicContact CH2-CD1 3.78Å; W470-L472 HydrophobicContact CH2-CG 4.44Å; W470-L472 HydrophobicContact CZ2-CB 4.43Å; W470-L472 HydrophobicContact CZ2-CD1 4.11Å; W470-L472 HydrophobicContact CZ3-CB 4.32Å; W470-D474 PolarHBondContact NE1-O 3.26Å; W470-D474 VanDerWaalsContact NE1-O 3.12Å; W470-I477 HydrophobicContact CB-CG1 4.08Å
471	S	98.4	Very high	90.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.8	172.7	174.7	0	0	0	0	108.7	V241 A273 F277 G473 D474	V241-S471 WeakPolarHBondContact O-CA 3.4Å; A273-S471 WeakPolarHBondContact O-CB 3.36Å; A273-S471 PolarHBondContact O-OG 3.49Å; A273-S471 VanDerWaalsContact O-OG 3.05Å; F277-S471 WeakPolarHBondContact CB-OG 3.49Å; F277-S471 PolarHBondContact N-OG 2.98Å; S471-G473 PolarHBondContact O-N 3.33Å; S471-D474 WeakPolarHBondContact CB-OD2 3.1Å; S471-D474 PolarHBondContact N-OD2 2.57Å; S471-D474 VanDerWaalsContact O-CB 3.29Å; S471-D474 WeakPolarHBondContact O-CB 3.48Å; S471-D474 PolarHBondContact O-N 2.58Å
472	L	97.6	Very high	92.2	Very high	46 Å²	46	37 Å²	37	24%	0.241	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	128.8	179.5	-178	62.6	0	0	0	110.9	E239 V241 F277 R280 W470	E239-L472 VanDerWaalsContact CD-CD2 3.47Å; E239-L472 HydrophobicContact CG-CD2 4.09Å; E239-L472 VanDerWaalsContact OE1-CD2 3.29Å; E239-L472 WeakPolarHBondContact OE1-CD2 3.26Å; V241-L472 HydrophobicContact CG1-CD2 4.12Å; V241-L472 PolarHBondContact O-N 3.08Å; F277-L472 HydrophobicContact CD2-CB 4.12Å; F277-L472 HydrophobicContact CE2-CB 4.3Å; F277-L472 HydrophobicContact CE2-CD2 4.1Å; R280-L472 PolarHBondContact NH1-O 2.94Å; W470-L472 HydrophobicContact CH2-CB 3.86Å; W470-L472 HydrophobicContact CH2-CD1 3.78Å; W470-L472 HydrophobicContact CH2-CG 4.44Å; W470-L472 HydrophobicContact CZ2-CB 4.43Å; W470-L472 HydrophobicContact CZ2-CD1 4.11Å; W470-L472 HydrophobicContact CZ3-CB 4.32Å
473	G	94.4	Very high	93.7	Very high	55 Å²	55	35.7 Å²	35.7	57%	0.567	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	88	3.1	-170.1	0	0	0	0	0	115.4	R280 S471	R280-G473 VanDerWaalsContact CZ-O 3.27Å; R280-G473 VanDerWaalsContact NH2-C 3.32Å; R280-G473 PolarHBondContact NH2-O 2.96Å; S471-G473 PolarHBondContact O-N 3.33Å
474	D	97.2	Very high	94.8	Very high	11 Å²	11	37.5 Å²	37.5	6%	0.059	24%	0.235	C	C	.	.			trans	-82.1	139.7	156.6	-75.2	-54.7	0	0	0	109.8	R276 R280 W470 S471 D476 R498	R276-D474 WeakPolarHBondContact CD-OD2 3.38Å; R276-D474 IonicContact CZ-OD1 3Å; R276-D474 VanDerWaalsContact CZ-OD1 3.28Å; R276-D474 IonicContact CZ-OD2 2.77Å; R276-D474 IonicContact NE-OD1 2.95Å; R276-D474 PolarHBondContact NE-OD1 3.29Å; R276-D474 IonicContact NE-OD2 3.36Å; R276-D474 PolarHBondContact NE-OD2 2.74Å; R276-D474 IonicContact NH2-OD1 3.02Å; R276-D474 PolarHBondContact NH2-OD1 2.76Å; R280-D474 IonicContact CZ-OD1 3.91Å; R280-D474 IonicContact CZ-OD2 3.93Å; R280-D474 VanDerWaalsContact NH1-CG 3.3Å; R280-D474 IonicContact NH1-OD1 3.27Å; R280-D474 IonicContact NH1-OD2 3.25Å; R280-D474 PolarHBondContact NH1-OD2 3.44Å; R280-D474 VanDerWaalsContact NH2-CG 3.25Å; R280-D474 IonicContact NH2-OD1 2.91Å; R280-D474 PolarHBondContact NH2-OD1 3.15Å; R280-D474 IonicContact NH2-OD2 3.28Å; W470-D474 PolarHBondContact NE1-O 3.26Å; W470-D474 VanDerWaalsContact NE1-O 3.12Å; S471-D474 WeakPolarHBondContact CB-OD2 3.1Å; S471-D474 PolarHBondContact N-OD2 2.57Å; S471-D474 VanDerWaalsContact O-CB 3.29Å; S471-D474 WeakPolarHBondContact O-CB 3.48Å; S471-D474 PolarHBondContact O-N 2.58Å; D474-D476 VanDerWaalsContact C-N 3.32Å; D474-D476 PolarHBondContact O-N 3.38Å; D474-R498 IonicContact OD1-CZ 3.58Å; D474-R498 IonicContact OD1-NH1 2.73Å; D474-R498 PolarHBondContact OD1-NH1 3.06Å; D474-R498 IonicContact OD2-CZ 3.69Å; D474-R498 IonicContact OD2-NE 3.58Å
475	P	93.9	Very high	95.6	Very high	130 Å²	130	30.3 Å²	30.3	84%	0.844	20%	0.202	S	C	*	.	S	Bend	trans	-68.6	-32.8	-178.8	28.2	-34.8	0	0	0	112.2
476	D	94.1	Very high	95.9	Very high	94 Å²	94	30.9 Å²	30.9	50%	0.503	19%	0.193	S	C	.	.	S	Bend	trans	-153.9	169.5	-176.3	-162.4	4.4	0	0	0	111.2	D474 R498	D474-D476 VanDerWaalsContact C-N 3.32Å; D474-D476 PolarHBondContact O-N 3.38Å; D476-R498 PolarHBondContact O-NH1 2.99Å; D476-R498 PolarHBondContact O-NH2 2.79Å
477	I	96.1	Very high	96.1	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.108	20%	0.196	C	C	.	.			trans	-57.4	145.4	168.9	-77.1	176.7	0	0	0	111	L204 L205 L468 N469 W470 V479	L204-I477 HydrophobicContact CB-CD1 3.66Å; L204-I477 HydrophobicContact CB-CG1 4.09Å; L204-I477 HydrophobicContact CD1-CD1 4.39Å; L204-I477 HydrophobicContact CD1-CG1 4.26Å; L205-I477 HydrophobicContact CD2-CD1 3.75Å; L205-I477 HydrophobicContact CG-CD1 3.94Å; L468-I477 HydrophobicContact CB-CG2 3.88Å; L468-I477 HydrophobicContact CD1-CD1 4.25Å; L468-I477 HydrophobicContact CD2-CG2 3.98Å; L468-I477 HydrophobicContact CG-CG2 4.34Å; N469-I477 WeakPolarHBondContact O-CA 3.13Å; W470-I477 HydrophobicContact CB-CG1 4.08Å; I477-V479 HydrophobicContact CG2-CG2 4.3Å
478	E	97.7	Very high	96	Very high	23 Å²	23	34.5 Å²	34.5	11%	0.107	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.9	164.2	173.9	-167.6	86.2	0	0	108	N469 V480 V487 S497 R498	N469-E478 PolarHBondContact N-O 3.18Å; N469-E478 WeakPolarHBondContact ND2-CB 3.46Å; N469-E478 PolarHBondContact ND2-O 2.79Å; N469-E478 PolarHBondContact ND2-OE1 3.36Å; N469-E478 PolarHBondContact O-N 3.27Å; E478-V480 HydrophobicContact CG-CG2 4.4Å; E478-V487 HydrophobicContact CG-CG1 4.34Å; E478-V487 HydrophobicContact CG-CG2 3.78Å; E478-S497 WeakPolarHBondContact OE1-CB 2.97Å; E478-S497 PolarHBondContact OE1-OG 3.38Å; E478-R498 VanDerWaalsContact CB-CZ 3.46Å; E478-R498 VanDerWaalsContact N-NH2 3.11Å; E478-R498 PolarHBondContact OE1-N 3.08Å; E478-R498 WeakPolarHBondContact OE2-CB 3.2Å; E478-R498 WeakPolarHBondContact OE2-CD 3.32Å; E478-R498 WeakPolarHBondContact OE2-CG 3.44Å; E478-R498 PolarHBondContact OE2-N 2.83Å
479	V	96.8	Very high	95.6	Very high	20 Å²	20	37.1 Å²	37.1	12%	0.121	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.6	176.7	-172.3	0	0	0	0	108.7	Y211 L466 L468 I477 V487 K488	Y211-V479 HydrophobicContact CD2-CG2 4.25Å; Y211-V479 HydrophobicContact CE1-CG1 4.01Å; Y211-V479 HydrophobicContact CE1-CG2 4.29Å; Y211-V479 HydrophobicContact CE2-CG2 3.71Å; L466-V479 HydrophobicContact CD1-CG1 4.44Å; L466-V479 HydrophobicContact CD2-CG1 4.36Å; L468-V479 HydrophobicContact CD2-CB 4.32Å; L468-V479 HydrophobicContact CD2-CG1 4.11Å; L468-V479 HydrophobicContact CD2-CG2 3.88Å; I477-V479 HydrophobicContact CG2-CG2 4.3Å; V479-V487 CarbonylContact O-C 3.5Å; V479-V487 VanDerWaalsContact O-CA 3.31Å; V479-V487 WeakPolarHBondContact O-CA 3.39Å; V479-K488 HydrophobicContact CB-CB 4.29Å; V479-K488 HydrophobicContact CG1-CB 3.92Å; V479-K488 HydrophobicContact CG1-CD 4.36Å; V479-K488 PolarHBondContact O-N 3.29Å
480	V	97	Very high	94.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131	176.8	168.4	0	0	0	0	109.7	L261 L466 S467 E478 R486	L261-V480 HydrophobicContact CD1-CB 4.47Å; L261-V480 HydrophobicContact CD1-CG1 3.92Å; L261-V480 HydrophobicContact CD1-CG2 3.95Å; L466-V480 CarbonylContact C-O 3.59Å; L466-V480 WeakPolarHBondContact CA-O 3.43Å; S467-V480 PolarHBondContact N-O 2.86Å; S467-V480 WeakPolarHBondContact O-CB 3.39Å; S467-V480 PolarHBondContact O-N 2.87Å; E478-V480 HydrophobicContact CG-CG2 4.4Å; V480-R486 CarbonylContact C-O 3.59Å; V480-R486 VanDerWaalsContact CA-O 3.3Å; V480-R486 WeakPolarHBondContact CA-O 3.17Å; V480-R486 WeakPolarHBondContact CG1-O 3.35Å
481	D	95.1	Very high	93.6	Very high	36 Å²	36	49 Å²	49	19%	0.193	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.8	162.9	159	43.5	0	0	0	109.3	A483 T484 G485 R486	D481-A483 WeakPolarHBondContact OD1-CB 3.28Å; D481-A483 PolarHBondContact OD1-N 2.8Å; D481-T484 WeakPolarHBondContact OD2-CB 3.35Å; D481-T484 VanDerWaalsContact OD2-CG2 3.22Å; D481-T484 WeakPolarHBondContact OD2-CG2 3.45Å; D481-T484 PolarHBondContact OD2-N 3.38Å; D481-T484 PolarHBondContact OD2-OG1 3.34Å; D481-G485 WeakPolarHBondContact O-CA 3.21Å; D481-G485 PolarHBondContact O-N 2.78Å; D481-R486 PolarHBondContact N-O 2.78Å; D481-R486 PolarHBondContact O-N 2.76Å
482	V	94.5	Very high	92.9	Very high	6 Å²	6	53 Å²	53	4%	0.036	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.9	-177.8	-177.4	0	0	0	0	112.1	C250 C264 G465	C250-V482 VanDerWaalsContact CA-O 3.32Å; C250-V482 WeakPolarHBondContact CA-O 3.45Å; C250-V482 PolarHBondContact SG-O 3.45Å; C264-V482 HydrophobicContact CB-CB 4.25Å; C264-V482 HydrophobicContact CB-CG1 3.88Å; C264-V482 HydrophobicContact CB-CG2 3.52Å; G465-V482 WeakPolarHBondContact O-CB 3.45Å; G465-V482 VanDerWaalsContact O-CG2 3.28Å; G465-V482 WeakPolarHBondContact O-CG2 3.42Å; G465-V482 PolarHBondContact O-N 2.81Å
483	A	92.7	Very high	92.3	Very high	77 Å²	77	56.8 Å²	56.8	64%	0.636	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-53.5	175.3	0	0	0	0	0	111.4	D481	D481-A483 WeakPolarHBondContact OD1-CB 3.28Å; D481-A483 PolarHBondContact OD1-N 2.8Å
484	T	93.3	Very high	92.1	Very high	49 Å²	49	54.4 Å²	54.4	30%	0.301	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-18.4	176.5	61.8	0	0	0	0	113.9	R260 D481 R486	R260-T484 WeakPolarHBondContact CD-O 3.23Å; R260-T484 WeakPolarHBondContact CG-O 3.45Å; D481-T484 WeakPolarHBondContact OD2-CB 3.35Å; D481-T484 VanDerWaalsContact OD2-CG2 3.22Å; D481-T484 WeakPolarHBondContact OD2-CG2 3.45Å; D481-T484 PolarHBondContact OD2-N 3.38Å; D481-T484 PolarHBondContact OD2-OG1 3.34Å; T484-R486 VanDerWaalsContact C-N 3.26Å; T484-R486 PolarHBondContact O-N 3.18Å
485	G	94.9	Very high	92.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	30.3	-176.8	0	0	0	0	0	113.5	L261 D481	L261-G485 PolarHBondContact N-O 3.46Å; D481-G485 WeakPolarHBondContact O-CA 3.21Å; D481-G485 PolarHBondContact O-N 2.78Å
486	R	96	Very high	92.2	Very high	47 Å²	47	53.4 Å²	53.4	18%	0.177	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	170.6	-173.9	-73.5	169.3	176.3	-119.8	3.9	110.2	E255 R260 V480 D481 T484 K488	E255-R486 IonicContact OE1-NH2 3.23Å; E255-R486 PolarHBondContact OE1-NH2 3.2Å; E255-R486 IonicContact OE2-NE 2.78Å; E255-R486 IonicContact OE2-NH2 2.64Å; E255-R486 PolarHBondContact OE2-NH2 2.86Å; R260-R486 HydrophobicContact CG-CG 4.37Å; V480-R486 CarbonylContact C-O 3.59Å; V480-R486 VanDerWaalsContact CA-O 3.3Å; V480-R486 WeakPolarHBondContact CA-O 3.17Å; V480-R486 WeakPolarHBondContact CG1-O 3.35Å; D481-R486 PolarHBondContact N-O 2.78Å; D481-R486 PolarHBondContact O-N 2.76Å; T484-R486 VanDerWaalsContact C-N 3.26Å; T484-R486 PolarHBondContact O-N 3.18Å; R486-K488 PolarHBondContact O-N 2.85Å
487	V	96.9	Very high	92.4	Very high	29 Å²	29	48.9 Å²	48.9	18%	0.176	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	136.1	179	-178.4	0	0	0	0	109.6	E478 V479 T489 G494 P495	E478-V487 HydrophobicContact CG-CG1 4.34Å; E478-V487 HydrophobicContact CG-CG2 3.78Å; V479-V487 CarbonylContact O-C 3.5Å; V479-V487 VanDerWaalsContact O-CA 3.31Å; V479-V487 WeakPolarHBondContact O-CA 3.39Å; V487-T489 PolarHBondContact O-N 3.34Å; V487-G494 WeakPolarHBondContact O-CA 3.38Å; V487-P495 HydrophobicContact CB-CG 3.97Å; V487-P495 HydrophobicContact CG1-CG 4.46Å; V487-P495 HydrophobicContact CG2-CG 4.16Å; V487-P495 WeakPolarHBondContact CG2-O 3.28Å; V487-P495 PolarHBondContact N-O 3.27Å; V487-P495 VanDerWaalsContact N-O 3.09Å
488	K	94.3	Very high	92.5	Very high	71 Å²	71	49.7 Å²	49.7	31%	0.309	29%	0.294	S	S	.	.			trans	-67.4	130.5	178.3	-166.1	-154.6	178.3	-138.2	0	109.9	L466 V479 R486 E490	L466-K488 HydrophobicContact CD2-CD 4.15Å; L466-K488 HydrophobicContact CD2-CG 4.45Å; V479-K488 HydrophobicContact CB-CB 4.29Å; V479-K488 HydrophobicContact CG1-CB 3.92Å; V479-K488 HydrophobicContact CG1-CD 4.36Å; V479-K488 PolarHBondContact O-N 3.29Å; R486-K488 PolarHBondContact O-N 2.85Å; K488-E490 WeakPolarHBondContact CE-OE1 3.27Å; K488-E490 IonicContact NZ-OE1 2.8Å; K488-E490 PolarHBondContact NZ-OE1 3.1Å; K488-E490 IonicContact NZ-OE2 2.64Å; K488-E490 PolarHBondContact NZ-OE2 3.23Å
489	T	90.4	Very high	92.5	Very high	55 Å²	55	48.6 Å²	48.6	34%	0.337	29%	0.289	S	S	.	.			trans	-143.9	134	172.8	41.9	0	0	0	0	109.2	V487 A491 S492 G494	V487-T489 PolarHBondContact O-N 3.34Å; T489-A491 VanDerWaalsContact C-N 3.3Å; T489-A491 PolarHBondContact O-N 2.87Å; T489-S492 PolarHBondContact OG1-O 3.42Å; T489-G494 WeakPolarHBondContact OG1-CA 3.18Å; T489-G494 PolarHBondContact OG1-N 3.43Å; T489-G494 VanDerWaalsContact OG1-N 3.15Å
490	E	79.9	Confident	92.5	Very high	155 Å²	155	47.9 Å²	47.9	72%	0.724	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-22.9	-167.2	-51.4	-49.5	126.5	0	0	115.1	K488	K488-E490 WeakPolarHBondContact CE-OE1 3.27Å; K488-E490 IonicContact NZ-OE1 2.8Å; K488-E490 PolarHBondContact NZ-OE1 3.1Å; K488-E490 IonicContact NZ-OE2 2.64Å; K488-E490 PolarHBondContact NZ-OE2 3.23Å
491	A	75.2	Confident	92.6	Very high	103 Å²	103	49 Å²	49	85%	0.851	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-5.2	-169.3	0	0	0	0	0	115.6	T489	T489-A491 VanDerWaalsContact C-N 3.3Å; T489-A491 PolarHBondContact O-N 2.87Å
492	S	83.4	Confident	92.6	Very high	86 Å²	86	48 Å²	48	60%	0.601	29%	0.287	S	S	*	.	S	Bend	trans	-163.7	173.8	-173.9	66.5	0	0	0	0	113	T489 G494	T489-S492 PolarHBondContact OG1-O 3.42Å; S492-G494 PolarHBondContact O-N 2.85Å; S492-G494 VanDerWaalsContact O-N 3.16Å
493	I	84.1	Confident	92.8	Very high	124 Å²	124	49.1 Å²	49.1	64%	0.636	30%	0.296	S	S	*	.			trans	-69.4	108	170.2	-59.1	175.4	0	0	0	108.8
494	G	91.7	Very high	93	Very high	5 Å²	5	45.8 Å²	45.8	5%	0.052	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-67.7	173.9	-175.3	0	0	0	0	0	115.5	V487 T489 S492	V487-G494 WeakPolarHBondContact O-CA 3.38Å; T489-G494 WeakPolarHBondContact OG1-CA 3.18Å; T489-G494 PolarHBondContact OG1-N 3.43Å; T489-G494 VanDerWaalsContact OG1-N 3.15Å; S492-G494 PolarHBondContact O-N 2.85Å; S492-G494 VanDerWaalsContact O-N 3.16Å
495	P	95.9	Very high	93.3	Very high	73 Å²	73	43.4 Å²	43.4	47%	0.474	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-64.4	161.3	-175.2	24.6	-33.3	0	0	0	113.2	V487 S497	V487-P495 HydrophobicContact CB-CG 3.97Å; V487-P495 HydrophobicContact CG1-CG 4.46Å; V487-P495 HydrophobicContact CG2-CG 4.16Å; V487-P495 WeakPolarHBondContact CG2-O 3.28Å; V487-P495 PolarHBondContact N-O 3.27Å; V487-P495 VanDerWaalsContact N-O 3.09Å; P495-S497 PolarHBondContact O-N 3.34Å
496	P	96.9	Very high	93.4	Very high	47 Å²	47	45.2 Å²	45.2	31%	0.305	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-56.9	127.5	169	-22.7	35.1	0	0	0	111	R259	R259-P496 HydrophobicContact CB-CB 3.93Å; R259-P496 HydrophobicContact CB-CG 3.87Å; R259-P496 HydrophobicContact CG-CB 4.37Å; R259-P496 HydrophobicContact CG-CG 4.09Å; R259-P496 WeakPolarHBondContact O-CB 3.42Å
497	S	97.8	Very high	93.5	Very high	0 Å²	0	44 Å²	44	0%	0	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-54	144.8	175.4	161.3	0	0	0	0	112	E478 P495 L499 C500	E478-S497 WeakPolarHBondContact OE1-CB 2.97Å; E478-S497 PolarHBondContact OE1-OG 3.38Å; P495-S497 PolarHBondContact O-N 3.34Å; S497-L499 PolarHBondContact O-N 3.35Å; S497-L499 PolarHBondContact OG-N 2.92Å; S497-C500 VanDerWaalsContact O-CB 3.27Å; S497-C500 WeakPolarHBondContact O-CB 3.42Å; S497-C500 PolarHBondContact O-N 3.42Å; S497-C500 PolarHBondContact O-SG 2.86Å
498	R	97.8	Very high	93.5	Very high	38 Å²	38	42.6 Å²	42.6	14%	0.143	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-11.6	171.1	73.7	-159.6	178.3	179.4	-0.1	114.1	N469 D474 D476 E478 A503	N469-R498 PolarHBondContact O-NH2 2.85Å; N469-R498 PolarHBondContact OD1-NE 2.97Å; D474-R498 IonicContact OD1-CZ 3.58Å; D474-R498 IonicContact OD1-NH1 2.73Å; D474-R498 PolarHBondContact OD1-NH1 3.06Å; D474-R498 IonicContact OD2-CZ 3.69Å; D474-R498 IonicContact OD2-NE 3.58Å; D476-R498 PolarHBondContact O-NH1 2.99Å; D476-R498 PolarHBondContact O-NH2 2.79Å; E478-R498 VanDerWaalsContact CB-CZ 3.46Å; E478-R498 VanDerWaalsContact N-NH2 3.11Å; E478-R498 PolarHBondContact OE1-N 3.08Å; E478-R498 WeakPolarHBondContact OE2-CB 3.2Å; E478-R498 WeakPolarHBondContact OE2-CD 3.32Å; E478-R498 WeakPolarHBondContact OE2-CG 3.44Å; E478-R498 PolarHBondContact OE2-N 2.83Å; R498-A503 WeakPolarHBondContact O-CB 3.18Å
499	L	98.4	Very high	93.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	5.9	174.7	-56.2	-172.6	0	0	0	113.6	L261 I269 R272 A273 R276 N469 S497 F504	L261-L499 HydrophobicContact CD2-CB 4.19Å; L261-L499 WeakPolarHBondContact CD2-O 3.09Å; I269-L499 HydrophobicContact CG2-CD1 4Å; R272-L499 HydrophobicContact CB-CB 4.13Å; R272-L499 HydrophobicContact CB-CD1 3.96Å; R272-L499 HydrophobicContact CB-CD2 4.41Å; R272-L499 HydrophobicContact CB-CG 4.41Å; R272-L499 PolarHBondContact NE-O 3.08Å; R272-L499 PolarHBondContact NH2-O 3.05Å; A273-L499 HydrophobicContact CB-CD1 4.33Å; A273-L499 HydrophobicContact CB-CD2 4.46Å; R276-L499 HydrophobicContact CB-CD2 4.09Å; N469-L499 HydrophobicContact CB-CD1 3.54Å; N469-L499 VanDerWaalsContact CG-CD1 3.41Å; N469-L499 WeakPolarHBondContact OD1-CD1 3.43Å; S497-L499 PolarHBondContact O-N 3.35Å; S497-L499 PolarHBondContact OG-N 2.92Å; L499-F504 HydrophobicContact CB-CZ 4.39Å; L499-F504 HydrophobicContact CD2-CZ 4.18Å; L499-F504 WeakPolarHBondContact O-CE2 3.22Å
500	C	97.4	Very high	94.1	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.027	26%	0.256	C	S	.	.	S	Bend	trans	-67.2	169	177.5	75.7	0	0	0	0	112.6	R259 S497 A502 A503 F504	R259-C500 VanDerWaalsContact O-CB 3.25Å; R259-C500 WeakPolarHBondContact O-CB 3.43Å; S497-C500 VanDerWaalsContact O-CB 3.27Å; S497-C500 WeakPolarHBondContact O-CB 3.42Å; S497-C500 PolarHBondContact O-N 3.42Å; S497-C500 PolarHBondContact O-SG 2.86Å; C500-A502 VanDerWaalsContact C-N 3.34Å; C500-A503 PolarHBondContact O-N 2.99Å; C500-A503 PolarHBondContact SG-N 3.49Å; C500-A503 VanDerWaalsContact SG-N 3.36Å; C500-F504 VanDerWaalsContact O-CD2 3.29Å; C500-F504 WeakPolarHBondContact O-CD2 3.2Å; C500-F504 PolarHBondContact O-N 3.27Å
501	K	97.3	Very high	94.9	Very high	25 Å²	25	35.5 Å²	35.5	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-69.4	-34.6	-178.7	-50	-173.2	-162.1	78.5	0	111.7	G258 F504 L505 Y526 V559 F562	G258-K501 WeakPolarHBondContact O-CA 3.37Å; G258-K501 WeakPolarHBondContact O-CB 3.43Å; G258-K501 PolarHBondContact O-N 2.79Å; K501-F504 PolarHBondContact O-N 3.3Å; K501-L505 PolarHBondContact O-N 3.34Å; K501-Y526 HydrophobicContact CB-CD2 4.12Å; K501-Y526 HydrophobicContact CB-CE1 4.48Å; K501-Y526 HydrophobicContact CB-CE2 3.79Å; K501-Y526 HydrophobicContact CD-CE1 4.31Å; K501-Y526 WeakPolarHBondContact O-CD2 3.33Å; K501-Y526 VanDerWaalsContact O-CE2 3.24Å; K501-Y526 WeakPolarHBondContact O-CE2 3.33Å; K501-V559 HydrophobicContact CD-CG1 4.37Å; K501-V559 VanDerWaalsContact NZ-CG1 3.34Å; K501-F562 HydrophobicContact CB-CE1 3.96Å; K501-F562 HydrophobicContact CB-CZ 3.59Å; K501-F562 HydrophobicContact CD-CE1 4.23Å
502	A	97	Very high	96	Very high	15 Å²	15	30.6 Å²	30.6	12%	0.124	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-41.8	175.6	0	0	0	0	0	111.9	G258 R259 C500 F504 L505 A506 F562	G258-A502 PolarHBondContact O-N 3.05Å; G258-A502 VanDerWaalsContact O-N 3.13Å; R259-A502 HydrophobicContact CG-CB 4.17Å; C500-A502 VanDerWaalsContact C-N 3.34Å; A502-F504 PolarHBondContact O-N 3.06Å; A502-L505 WeakPolarHBondContact O-CB 3.45Å; A502-L505 PolarHBondContact O-N 3.15Å; A502-L505 VanDerWaalsContact O-N 3.13Å; A502-A506 PolarHBondContact O-N 2.9Å; A502-F562 HydrophobicContact CB-CE2 4.31Å
503	A	97.6	Very high	96.7	Very high	29 Å²	29	34 Å²	34	24%	0.24	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-41.5	175.4	0	0	0	0	0	112.5	R498 C500 L505 A506 A507	R498-A503 WeakPolarHBondContact O-CB 3.18Å; C500-A503 PolarHBondContact O-N 2.99Å; C500-A503 PolarHBondContact SG-N 3.49Å; C500-A503 VanDerWaalsContact SG-N 3.36Å; A503-L505 VanDerWaalsContact C-N 3.34Å; A503-L505 PolarHBondContact O-N 3.07Å; A503-A506 WeakPolarHBondContact O-CB 3.33Å; A503-A506 PolarHBondContact O-N 3.5Å; A503-A507 PolarHBondContact O-N 3.45Å
504	F	98.1	Very high	97.3	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-28.6	174	-64.9	-50	0	0	0	113.5	R272 L275 R276 F279 L393 L499 C500 K501 A502 F508 Y526	R272-F504 HydrophobicContact CB-CE2 4.26Å; R272-F504 HydrophobicContact CB-CZ 4.02Å; R272-F504 HydrophobicContact CG-CE2 4.34Å; R272-F504 VanDerWaalsContact O-CZ 3.27Å; R272-F504 WeakPolarHBondContact O-CZ 3.49Å; L275-F504 HydrophobicContact CB-CD1 4.26Å; L275-F504 HydrophobicContact CB-CE1 3.69Å; L275-F504 HydrophobicContact CB-CZ 3.98Å; L275-F504 HydrophobicContact CD1-CE2 4.27Å; L275-F504 HydrophobicContact CD1-CZ 4.29Å; R276-F504 HydrophobicContact CB-CE1 4.24Å; F279-F504 HydrophobicContact CD2-CD1 4.16Å; F279-F504 HydrophobicContact CE2-CB 4.48Å; F279-F504 HydrophobicContact CE2-CD1 4.02Å; L393-F504 HydrophobicContact CD1-CB 3.99Å; L499-F504 HydrophobicContact CB-CZ 4.39Å; L499-F504 HydrophobicContact CD2-CZ 4.18Å; L499-F504 WeakPolarHBondContact O-CE2 3.22Å; C500-F504 VanDerWaalsContact O-CD2 3.29Å; C500-F504 WeakPolarHBondContact O-CD2 3.2Å; C500-F504 PolarHBondContact O-N 3.27Å; K501-F504 PolarHBondContact O-N 3.3Å; A502-F504 PolarHBondContact O-N 3.06Å; F504-F508 VanDerWaalsContact O-CB 3.26Å; F504-F508 WeakPolarHBondContact O-CB 3.34Å; F504-F508 PolarHBondContact O-N 3.11Å; F504-Y526 HydrophobicContact CB-CE2 4.44Å
505	L	97.6	Very high	97.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-70.1	-37.3	172.4	-166.8	52.8	0	0	0	111.9	K501 A502 A503 F508 R509 Y526 A529 F562 H564	K501-L505 PolarHBondContact O-N 3.34Å; A502-L505 WeakPolarHBondContact O-CB 3.45Å; A502-L505 PolarHBondContact O-N 3.15Å; A502-L505 VanDerWaalsContact O-N 3.13Å; A503-L505 VanDerWaalsContact C-N 3.34Å; A503-L505 PolarHBondContact O-N 3.07Å; L505-F508 HydrophobicContact CD1-CD1 4.22Å; L505-R509 WeakPolarHBondContact O-CB 3.46Å; L505-R509 WeakPolarHBondContact O-CG 3.4Å; L505-R509 PolarHBondContact O-N 3.32Å; L505-Y526 HydrophobicContact CB-CD2 4.11Å; L505-A529 HydrophobicContact CD1-CB 3.82Å; L505-F562 HydrophobicContact CD2-CE2 4.01Å; L505-H564 HydrophobicContact CD2-CB 3.74Å; L505-H564 HydrophobicContact CG-CB 4.21Å
506	A	97.5	Very high	97.5	Very high	37 Å²	37	35.8 Å²	35.8	31%	0.306	18%	0.184	S	C	.	.	H	α-helix	trans	-62.1	-49.9	172.7	0	0	0	0	0	111.2	A502 A503 F508 R509 Q510	A502-A506 PolarHBondContact O-N 2.9Å; A503-A506 WeakPolarHBondContact O-CB 3.33Å; A503-A506 PolarHBondContact O-N 3.5Å; A506-F508 PolarHBondContact O-N 3.27Å; A506-R509 CarbonylContact O-C 3.58Å; A506-R509 PolarHBondContact O-N 2.98Å; A506-Q510 PolarHBondContact O-N 3.27Å
507	A	97.9	Very high	97.4	Very high	21 Å²	21	36.1 Å²	36.1	17%	0.174	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-41.5	178.1	0	0	0	0	0	112.7	F279 A503 Q510 V511	F279-A507 HydrophobicContact CB-CB 3.99Å; F279-A507 HydrophobicContact CD1-CB 4.03Å; F279-A507 HydrophobicContact CD2-CB 3.88Å; F279-A507 HydrophobicContact CE2-CB 4.38Å; F279-A507 HydrophobicContact CG-CB 3.71Å; A503-A507 PolarHBondContact O-N 3.45Å; A507-Q510 PolarHBondContact O-N 3.45Å; A507-V511 PolarHBondContact O-N 3Å
508	F	98.4	Very high	97.3	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-47.3	172.1	170.9	-97.1	0	0	0	112	F279 L393 H396 F397 F504 L505 A506 Q510 V511 A512 L520 L523 A529	F279-F508 HydrophobicContact CE1-CB 4.14Å; F279-F508 HydrophobicContact CZ-CB 4.18Å; L393-F508 HydrophobicContact CB-CD2 4.14Å; L393-F508 HydrophobicContact CD1-CB 4.28Å; L393-F508 HydrophobicContact CD2-CD2 4.18Å; L393-F508 HydrophobicContact CD2-CG 4.22Å; H396-F508 HydrophobicContact CB-CE2 4.33Å; H396-F508 AromaticContact CD2-CE2 3.44Å; H396-F508 VanDerWaalsContact CD2-CE2 3.44Å; H396-F508 WeakPolarHBondContact CD2-CE2 3.39Å; H396-F508 AromaticContact CD2-CZ 3.96Å; H396-F508 AromaticContact NE2-CE2 3.97Å; F397-F508 AromaticContact CE2-CD2 3.55Å; F397-F508 HydrophobicContact CE2-CD2 3.55Å; F397-F508 AromaticContact CE2-CE2 3.81Å; F397-F508 HydrophobicContact CE2-CE2 3.81Å; F397-F508 AromaticContact CZ-CD2 3.93Å; F397-F508 HydrophobicContact CZ-CD2 3.93Å; F397-F508 AromaticContact CZ-CE2 3.8Å; F397-F508 HydrophobicContact CZ-CE2 3.8Å; F504-F508 VanDerWaalsContact O-CB 3.26Å; F504-F508 WeakPolarHBondContact O-CB 3.34Å; F504-F508 PolarHBondContact O-N 3.11Å; L505-F508 HydrophobicContact CD1-CD1 4.22Å; A506-F508 PolarHBondContact O-N 3.27Å; F508-Q510 VanDerWaalsContact C-N 3.3Å; F508-Q510 PolarHBondContact O-N 3.18Å; F508-V511 PolarHBondContact O-N 3.04Å; F508-A512 VanDerWaalsContact O-CB 3.31Å; F508-A512 WeakPolarHBondContact O-CB 3.38Å; F508-A512 PolarHBondContact O-N 3.22Å; F508-L520 HydrophobicContact CE1-CB 4.37Å; F508-L520 HydrophobicContact CE2-CD1 4.44Å; F508-L520 HydrophobicContact CZ-CB 3.93Å; F508-L520 HydrophobicContact CZ-CD1 4.26Å; F508-L520 HydrophobicContact CZ-CD2 4.33Å; F508-L520 HydrophobicContact CZ-CG 4.4Å; F508-L523 HydrophobicContact CZ-CD1 4.46Å; F508-A529 HydrophobicContact CD1-CB 4.25Å; F508-A529 HydrophobicContact CE1-CB 3.96Å; F508-A529 HydrophobicContact CZ-CB 4.46Å
509	R	97.8	Very high	97.2	Very high	40 Å²	40	44.1 Å²	44.1	15%	0.151	23%	0.227	C	C	.	.	H	α-helix	trans	-68.4	-25.8	176.6	-73.6	177.2	174.7	175.5	-0.7	113.2	L505 A506 R513 L521 H564	L505-R509 WeakPolarHBondContact O-CB 3.46Å; L505-R509 WeakPolarHBondContact O-CG 3.4Å; L505-R509 PolarHBondContact O-N 3.32Å; A506-R509 CarbonylContact O-C 3.58Å; A506-R509 PolarHBondContact O-N 2.98Å; R509-R513 WeakPolarHBondContact O-CG 3.41Å; R509-R513 PolarHBondContact O-N 3.37Å; R509-R513 PolarHBondContact O-NH1 3.46Å; R509-L521 HydrophobicContact CB-CD2 4.18Å; R509-L521 HydrophobicContact CG-CD2 4.29Å; R509-H564 VanDerWaalsContact NH1-C 3.34Å; R509-H564 PolarHBondContact NH1-O 2.61Å; R509-H564 PolarHBondContact NH2-O 2.73Å
510	Q	97.9	Very high	97.1	Very high	92 Å²	92	44.8 Å²	44.8	43%	0.43	23%	0.231	S	C	.	.	H	α-helix	trans	-69	-53	173.1	-168.7	177.7	-7.8	0	0	110.6	L283 A506 A507 F508 A512 R513 A514	L283-Q510 HydrophobicContact CD1-CG 4.1Å; L283-Q510 HydrophobicContact CD2-CG 3.97Å; A506-Q510 PolarHBondContact O-N 3.27Å; A507-Q510 PolarHBondContact O-N 3.45Å; F508-Q510 VanDerWaalsContact C-N 3.3Å; F508-Q510 PolarHBondContact O-N 3.18Å; Q510-A512 VanDerWaalsContact C-N 3.29Å; Q510-A512 PolarHBondContact O-N 3.4Å; Q510-R513 PolarHBondContact O-N 3.47Å; Q510-R513 VanDerWaalsContact O-N 3.08Å; Q510-A514 PolarHBondContact O-N 3.31Å
511	V	98.2	Very high	97	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-37.3	176.1	176.4	0	0	0	0	111.8	F279 L282 L283 I286 F397 A507 F508 R513 A514 L515	F279-V511 HydrophobicContact CD1-CG2 4Å; L282-V511 HydrophobicContact CB-CG1 4.23Å; L282-V511 HydrophobicContact CB-CG2 3.99Å; L282-V511 HydrophobicContact CD1-CG1 4.3Å; L282-V511 HydrophobicContact CD1-CG2 4.44Å; L283-V511 HydrophobicContact CD2-CG2 3.76Å; L283-V511 HydrophobicContact CG-CG2 3.87Å; I286-V511 HydrophobicContact CD1-CG1 4.12Å; F397-V511 HydrophobicContact CD1-CG1 3.93Å; F397-V511 HydrophobicContact CD2-CB 4.41Å; F397-V511 HydrophobicContact CD2-CG1 3.85Å; F397-V511 HydrophobicContact CE1-CG1 3.82Å; F397-V511 HydrophobicContact CE2-CB 3.93Å; F397-V511 HydrophobicContact CE2-CG1 3.71Å; F397-V511 HydrophobicContact CG-CG1 3.95Å; F397-V511 HydrophobicContact CZ-CB 4.05Å; F397-V511 HydrophobicContact CZ-CG1 3.71Å; A507-V511 PolarHBondContact O-N 3Å; F508-V511 PolarHBondContact O-N 3.04Å; V511-R513 VanDerWaalsContact C-N 3.29Å; V511-R513 PolarHBondContact O-N 2.8Å; V511-A514 PolarHBondContact O-N 3.21Å; V511-L515 HydrophobicContact CG1-CD1 3.85Å; V511-L515 HydrophobicContact CG1-CG 4.27Å; V511-L515 WeakPolarHBondContact O-CB 3.48Å; V511-L515 WeakPolarHBondContact O-CG 3.35Å; V511-L515 PolarHBondContact O-N 3.02Å
512	A	97.6	Very high	96.9	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-26.9	175.9	0	0	0	0	0	114	F397 F508 Q510 E516 K517 L520 L521	F397-A512 HydrophobicContact CZ-CB 4.3Å; F508-A512 VanDerWaalsContact O-CB 3.31Å; F508-A512 WeakPolarHBondContact O-CB 3.38Å; F508-A512 PolarHBondContact O-N 3.22Å; Q510-A512 VanDerWaalsContact C-N 3.29Å; Q510-A512 PolarHBondContact O-N 3.4Å; A512-E516 PolarHBondContact O-N 3.32Å; A512-K517 PolarHBondContact O-N 3.46Å; A512-L520 HydrophobicContact CB-CB 3.87Å; A512-L520 HydrophobicContact CB-CD1 4.37Å; A512-L521 HydrophobicContact CB-CD2 3.64Å; A512-L521 HydrophobicContact CB-CG 4.16Å
513	R	97.8	Very high	96.8	Very high	157 Å²	157	51.3 Å²	51.3	59%	0.592	27%	0.27	S	S	*	.	H	α-helix	trans	-76.1	-46.6	169.1	-72	-179.5	-163.1	103.7	-11.7	111.4	R509 Q510 V511 L515 E516 L521	R509-R513 WeakPolarHBondContact O-CG 3.41Å; R509-R513 PolarHBondContact O-N 3.37Å; R509-R513 PolarHBondContact O-NH1 3.46Å; Q510-R513 PolarHBondContact O-N 3.47Å; Q510-R513 VanDerWaalsContact O-N 3.08Å; V511-R513 VanDerWaalsContact C-N 3.29Å; V511-R513 PolarHBondContact O-N 2.8Å; R513-L515 PolarHBondContact O-N 3.4Å; R513-E516 PolarHBondContact O-N 2.87Å; R513-L521 HydrophobicContact CG-CD1 3.74Å; R513-L521 HydrophobicContact CG-CD2 3.96Å
514	A	97.2	Very high	96.6	Very high	25 Å²	25	56.5 Å²	56.5	21%	0.207	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-22.9	179.6	0	0	0	0	0	113.4	L283 I286 E287 Q510 V511	L283-A514 HydrophobicContact CD2-CB 4.04Å; I286-A514 HydrophobicContact CD1-CB 4.21Å; I286-A514 HydrophobicContact CG2-CB 3.94Å; I286-A514 WeakPolarHBondContact CG2-O 3.23Å; E287-A514 HydrophobicContact CG-CB 4.19Å; E287-A514 WeakPolarHBondContact OE1-CB 3.45Å; Q510-A514 PolarHBondContact O-N 3.31Å; V511-A514 PolarHBondContact O-N 3.21Å
515	L	95.8	Very high	96.5	Very high	40 Å²	40	56.7 Å²	56.7	21%	0.209	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	9.6	172.5	-65.2	-180	0	0	0	114.3	I286 P307 F308 F397 V511 R513 K517	I286-L515 HydrophobicContact CD1-CD1 4.2Å; I286-L515 HydrophobicContact CD1-CD2 3.54Å; I286-L515 HydrophobicContact CD1-CG 3.65Å; I286-L515 HydrophobicContact CG1-CD2 3.71Å; I286-L515 HydrophobicContact CG1-CG 4.39Å; I286-L515 HydrophobicContact CG2-CD2 4.38Å; P307-L515 HydrophobicContact CG-CD1 4.12Å; F308-L515 HydrophobicContact CE2-CD1 4.15Å; F308-L515 HydrophobicContact CE2-CD2 3.94Å; F308-L515 HydrophobicContact CZ-CD2 4.31Å; F397-L515 HydrophobicContact CD1-CD1 3.66Å; F397-L515 HydrophobicContact CE1-CD1 3.88Å; V511-L515 HydrophobicContact CG1-CD1 3.85Å; V511-L515 HydrophobicContact CG1-CG 4.27Å; V511-L515 WeakPolarHBondContact O-CB 3.48Å; V511-L515 WeakPolarHBondContact O-CG 3.35Å; V511-L515 PolarHBondContact O-N 3.02Å; R513-L515 PolarHBondContact O-N 3.4Å; L515-K517 VanDerWaalsContact C-N 3.28Å; L515-K517 HydrophobicContact CB-CD 4.47Å; L515-K517 HydrophobicContact CB-CG 4.08Å; L515-K517 VanDerWaalsContact O-CG 3.28Å; L515-K517 WeakPolarHBondContact O-CG 3.32Å; L515-K517 PolarHBondContact O-N 2.98Å
516	E	96.3	Very high	96.4	Very high	174 Å²	174	58.1 Å²	58.1	81%	0.813	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	43.4	177.3	-58.3	-174.8	168.1	0	0	113.5	A512 R513 P518	A512-E516 PolarHBondContact O-N 3.32Å; R513-E516 PolarHBondContact O-N 2.87Å; E516-P518 VanDerWaalsContact C-CD 3.47Å; E516-P518 WeakPolarHBondContact O-CD 3.32Å
517	K	95.2	Very high	96.2	Very high	54 Å²	54	57.9 Å²	57.9	24%	0.235	29%	0.287	C	S	.	.			trans	-103.4	78.2	-178.4	-62	-161.3	177.5	-173.3	0	112.3	A512 L515 Q519 L520 L521	A512-K517 PolarHBondContact O-N 3.46Å; L515-K517 VanDerWaalsContact C-N 3.28Å; L515-K517 HydrophobicContact CB-CD 4.47Å; L515-K517 HydrophobicContact CB-CG 4.08Å; L515-K517 VanDerWaalsContact O-CG 3.28Å; L515-K517 WeakPolarHBondContact O-CG 3.32Å; L515-K517 PolarHBondContact O-N 2.98Å; K517-Q519 PolarHBondContact O-N 3.38Å; K517-L520 HydrophobicContact CB-CB 4.22Å; K517-L520 HydrophobicContact CB-CD1 3.94Å; K517-L520 HydrophobicContact CB-CG 3.94Å; K517-L520 HydrophobicContact CD-CD1 3.75Å; K517-L520 HydrophobicContact CD-CG 4.38Å; K517-L520 HydrophobicContact CG-CD1 4.42Å; K517-L520 PolarHBondContact O-N 3.37Å; K517-L521 PolarHBondContact O-N 3.45Å
518	P	94.9	Very high	96	Very high	91 Å²	91	59 Å²	59	59%	0.591	29%	0.29	S	S	*	.	H	α-helix	trans	-59.7	-29.6	-178.6	26.1	-35.8	0	0	0	113.3	E516 L520 L521 S522	E516-P518 VanDerWaalsContact C-CD 3.47Å; E516-P518 WeakPolarHBondContact O-CD 3.32Å; P518-L520 PolarHBondContact O-N 3.5Å; P518-L521 PolarHBondContact O-N 2.9Å; P518-L521 VanDerWaalsContact O-N 3.08Å; P518-S522 PolarHBondContact O-N 3.26Å
519	Q	95.6	Very high	95.9	Very high	115 Å²	115	59 Å²	59	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-21.2	174.9	75.3	-79.2	42.1	0	0	113.9	K517 S522	K517-Q519 PolarHBondContact O-N 3.38Å; Q519-S522 PolarHBondContact O-OG 3.12Å; Q519-S522 VanDerWaalsContact O-OG 3.12Å
520	L	95.9	Very high	95.8	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-88.1	-27	171.1	-62.3	-173.7	0	0	0	112.2	H396 F397 F508 A512 K517 P518 L523	H396-L520 HydrophobicContact CB-CD1 4.21Å; H396-L520 WeakPolarHBondContact ND1-CD2 3.27Å; F397-L520 HydrophobicContact CE1-CD1 3.69Å; F397-L520 HydrophobicContact CZ-CD1 3.94Å; F508-L520 HydrophobicContact CE1-CB 4.37Å; F508-L520 HydrophobicContact CE2-CD1 4.44Å; F508-L520 HydrophobicContact CZ-CB 3.93Å; F508-L520 HydrophobicContact CZ-CD1 4.26Å; F508-L520 HydrophobicContact CZ-CD2 4.33Å; F508-L520 HydrophobicContact CZ-CG 4.4Å; A512-L520 HydrophobicContact CB-CB 3.87Å; A512-L520 HydrophobicContact CB-CD1 4.37Å; K517-L520 HydrophobicContact CB-CB 4.22Å; K517-L520 HydrophobicContact CB-CD1 3.94Å; K517-L520 HydrophobicContact CB-CG 3.94Å; K517-L520 HydrophobicContact CD-CD1 3.75Å; K517-L520 HydrophobicContact CD-CG 4.38Å; K517-L520 HydrophobicContact CG-CD1 4.42Å; K517-L520 PolarHBondContact O-N 3.37Å; P518-L520 PolarHBondContact O-N 3.5Å; L520-L523 HydrophobicContact CD2-CD1 4.06Å; L520-L523 WeakPolarHBondContact O-CB 3.25Å
521	L	95.6	Very high	95.7	Very high	61 Å²	61	54.4 Å²	54.4	32%	0.319	27%	0.271	S	S	.	.	H	α-helix	trans	-76.7	-26.5	177.7	-60.8	176.1	0	0	0	112.6	R509 A512 R513 K517 P518 L523	R509-L521 HydrophobicContact CB-CD2 4.18Å; R509-L521 HydrophobicContact CG-CD2 4.29Å; A512-L521 HydrophobicContact CB-CD2 3.64Å; A512-L521 HydrophobicContact CB-CG 4.16Å; R513-L521 HydrophobicContact CG-CD1 3.74Å; R513-L521 HydrophobicContact CG-CD2 3.96Å; K517-L521 PolarHBondContact O-N 3.45Å; P518-L521 PolarHBondContact O-N 2.9Å; P518-L521 VanDerWaalsContact O-N 3.08Å; L521-L523 PolarHBondContact O-N 3Å
522	S	95.6	Very high	95.6	Very high	77 Å²	77	57.8 Å²	57.8	54%	0.538	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.4	174.7	70.2	0	0	0	0	114	P518 Q519 K524	P518-S522 PolarHBondContact O-N 3.26Å; Q519-S522 PolarHBondContact O-OG 3.12Å; Q519-S522 VanDerWaalsContact O-OG 3.12Å; S522-K524 WeakPolarHBondContact O-CG 3.48Å; S522-K524 PolarHBondContact O-N 3.21Å
523	L	95.4	Very high	95.3	Very high	42 Å²	42	60.4 Å²	60.4	22%	0.22	31%	0.308	C	S	.	.			trans	-70.3	109.4	-177.2	-58.5	175.7	0	0	0	110.8	F508 L520 L521 A529	F508-L523 HydrophobicContact CZ-CD1 4.46Å; L520-L523 HydrophobicContact CD2-CD1 4.06Å; L520-L523 WeakPolarHBondContact O-CB 3.25Å; L521-L523 PolarHBondContact O-N 3Å; L523-A529 HydrophobicContact CB-CB 4.4Å
524	K	92.8	Very high	95.2	Very high	138 Å²	138	54.1 Å²	54.1	60%	0.6	29%	0.285	S	S	*	.			trans	-74.8	-41.6	-164.6	-62.3	-176.5	-178.6	174.9	0	113.8	S522 R563	S522-K524 WeakPolarHBondContact O-CG 3.48Å; S522-K524 PolarHBondContact O-N 3.21Å; K524-R563 WeakPolarHBondContact O-CG 3.3Å
525	T	95.1	Very high	95.1	Very high	10 Å²	10	55.9 Å²	55.9	6%	0.061	29%	0.286	C	S	.	.	S	Bend	trans	-115.2	162.8	-178.5	80.2	0	0	0	0	113.6	E527 D528 A529 G560 K561 F562 R563	T525-E527 PolarHBondContact O-N 2.86Å; T525-D528 VanDerWaalsContact CB-OD2 3.3Å; T525-D528 WeakPolarHBondContact CB-OD2 3.32Å; T525-D528 WeakPolarHBondContact CG2-OD2 3.4Å; T525-D528 PolarHBondContact N-OD2 3.04Å; T525-D528 PolarHBondContact O-N 3.08Å; T525-D528 VanDerWaalsContact O-N 3.14Å; T525-D528 PolarHBondContact OG1-N 3.19Å; T525-D528 PolarHBondContact OG1-OD1 3.47Å; T525-D528 PolarHBondContact OG1-OD2 3.34Å; T525-A529 WeakPolarHBondContact O-CB 3.44Å; T525-A529 PolarHBondContact O-N 3.19Å; T525-G560 PolarHBondContact OG1-O 2.9Å; T525-K561 HydrophobicContact CG2-CD 4.3Å; T525-K561 VanDerWaalsContact CG2-O 3.27Å; T525-K561 WeakPolarHBondContact CG2-O 3.48Å; T525-F562 VanDerWaalsContact CA-O 3.29Å; T525-F562 WeakPolarHBondContact CA-O 3.27Å; T525-F562 WeakPolarHBondContact CB-O 3.49Å; T525-R563 HydrophobicContact CG2-CG 4.18Å
526	Y	95.5	Very high	95	Very high	31 Å²	31	58 Å²	58	12%	0.122	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.1	177.2	-175.4	-88.3	0	0	0	114	L393 K501 F504 L505 G560 F562	L393-Y526 HydrophobicContact CD1-CD2 4.31Å; L393-Y526 HydrophobicContact CD1-CE2 3.6Å; K501-Y526 HydrophobicContact CB-CD2 4.12Å; K501-Y526 HydrophobicContact CB-CE1 4.48Å; K501-Y526 HydrophobicContact CB-CE2 3.79Å; K501-Y526 HydrophobicContact CD-CE1 4.31Å; K501-Y526 WeakPolarHBondContact O-CD2 3.33Å; K501-Y526 VanDerWaalsContact O-CE2 3.24Å; K501-Y526 WeakPolarHBondContact O-CE2 3.33Å; F504-Y526 HydrophobicContact CB-CE2 4.44Å; L505-Y526 HydrophobicContact CB-CD2 4.11Å; Y526-G560 CarbonylContact C-O 3.54Å; Y526-G560 WeakPolarHBondContact CB-O 3.35Å; Y526-G560 PolarHBondContact N-O 3.21Å; Y526-F562 VanDerWaalsContact CB-CE1 3.5Å; Y526-F562 HydrophobicContact CD1-CE1 4.34Å; Y526-F562 HydrophobicContact CD1-CZ 4.45Å; Y526-F562 HydrophobicContact CD2-CE1 4.26Å; Y526-F562 HydrophobicContact CD2-CE2 4.4Å; Y526-F562 AromaticContact CD2-CZ 3.58Å; Y526-F562 HydrophobicContact CD2-CZ 3.58Å; Y526-F562 HydrophobicContact CE2-CZ 4.47Å; Y526-F562 AromaticContact CG-CE1 3.8Å; Y526-F562 HydrophobicContact CG-CE1 3.8Å; Y526-F562 AromaticContact CG-CZ 3.56Å; Y526-F562 HydrophobicContact CG-CZ 3.56Å; Y526-F562 PolarHBondContact N-O 3.13Å
527	E	93.9	Very high	94.9	Very high	31 Å²	31	49.7 Å²	49.7	15%	0.145	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-30.8	176.7	-158	62.3	-146.8	0	0	112.1	T525 K530 R535 R538 G560	T525-E527 PolarHBondContact O-N 2.86Å; E527-K530 IonicContact OE1-NZ 2.76Å; E527-K530 PolarHBondContact OE1-NZ 3.11Å; E527-K530 IonicContact OE2-NZ 2.8Å; E527-K530 PolarHBondContact OE2-NZ 2.81Å; E527-R535 PolarHBondContact O-NH1 3.09Å; E527-R538 IonicContact OE1-CZ 3.58Å; E527-R538 VanDerWaalsContact OE1-CZ 3.23Å; E527-R538 IonicContact OE1-NH1 3.21Å; E527-R538 PolarHBondContact OE1-NH1 3.23Å; E527-R538 IonicContact OE1-NH2 2.74Å; E527-R538 PolarHBondContact OE1-NH2 2.91Å; E527-G560 PolarHBondContact N-O 2.56Å
528	D	94.3	Very high	94.8	Very high	46 Å²	46	50.1 Å²	50.1	25%	0.246	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-32.9	178.5	-42.4	-35.9	0	0	0	110.7	T525 K530 K561	T525-D528 VanDerWaalsContact CB-OD2 3.3Å; T525-D528 WeakPolarHBondContact CB-OD2 3.32Å; T525-D528 WeakPolarHBondContact CG2-OD2 3.4Å; T525-D528 PolarHBondContact N-OD2 3.04Å; T525-D528 PolarHBondContact O-N 3.08Å; T525-D528 VanDerWaalsContact O-N 3.14Å; T525-D528 PolarHBondContact OG1-N 3.19Å; T525-D528 PolarHBondContact OG1-OD1 3.47Å; T525-D528 PolarHBondContact OG1-OD2 3.34Å; D528-K530 PolarHBondContact O-N 3.39Å; D528-K530 VanDerWaalsContact O-N 3.17Å; D528-K561 IonicContact OD1-NZ 2.81Å; D528-K561 PolarHBondContact OD1-NZ 2.79Å
529	A	96.3	Very high	94.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.1	174.8	0	0	0	0	0	114.6	L393 H396 L505 F508 L523 T525	L393-A529 HydrophobicContact CD2-CB 3.73Å; L393-A529 WeakPolarHBondContact CD2-O 3.44Å; H396-A529 PolarHBondContact CD2-O 2.75Å; H396-A529 PolarHBondContact NE2-O 3.01Å; L505-A529 HydrophobicContact CD1-CB 3.82Å; F508-A529 HydrophobicContact CD1-CB 4.25Å; F508-A529 HydrophobicContact CE1-CB 3.96Å; F508-A529 HydrophobicContact CZ-CB 4.46Å; L523-A529 HydrophobicContact CB-CB 4.4Å; T525-A529 WeakPolarHBondContact O-CB 3.44Å; T525-A529 PolarHBondContact O-N 3.19Å
530	K	95.9	Very high	94.4	Very high	29 Å²	29	49 Å²	49	13%	0.126	24%	0.243	C	C	.	.	S	Bend	trans	-81.6	133.7	178.4	-68.6	166.9	-176.5	175.1	0	111.7	G392 L393 E527 D528 R535	G392-K530 CarbonylContact O-C 3.54Å; G392-K530 VanDerWaalsContact O-CA 3.32Å; G392-K530 WeakPolarHBondContact O-CA 3.47Å; L393-K530 HydrophobicContact CD2-CG 4.25Å; E527-K530 IonicContact OE1-NZ 2.76Å; E527-K530 PolarHBondContact OE1-NZ 3.11Å; E527-K530 IonicContact OE2-NZ 2.8Å; E527-K530 PolarHBondContact OE2-NZ 2.81Å; D528-K530 PolarHBondContact O-N 3.39Å; D528-K530 VanDerWaalsContact O-N 3.17Å; K530-R535 HydrophobicContact CB-CG 3.88Å; K530-R535 PolarHBondContact O-NE 3.43Å
531	A	95.7	Very high	94.2	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	24%	0.24	C	C	.	.			trans	-53.1	139.3	176.3	0	0	0	0	0	112.1	G392 A395 H396 Y534 R535	G392-A531 PolarHBondContact O-N 2.79Å; A395-A531 HydrophobicContact CB-CB 3.79Å; H396-A531 PolarHBondContact NE2-N 3.42Å; H396-A531 VanDerWaalsContact NE2-N 3.17Å; A531-Y534 PolarHBondContact O-N 3.01Å; A531-R535 PolarHBondContact O-N 2.95Å
532	V	94.3	Very high	94	Very high	71 Å²	71	46.5 Å²	46.5	43%	0.43	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-52.3	-177.3	168.7	0	0	0	0	112.2	Y534 R535 E536	V532-Y534 VanDerWaalsContact C-N 3.27Å; V532-Y534 PolarHBondContact O-N 2.82Å; V532-Y534 VanDerWaalsContact O-N 3.16Å; V532-R535 WeakPolarHBondContact O-CA 3.37Å; V532-R535 WeakPolarHBondContact O-CB 3.35Å; V532-R535 PolarHBondContact O-N 2.9Å; V532-E536 VanDerWaalsContact CG1-CD 3.45Å; V532-E536 HydrophobicContact CG1-CG 4.41Å; V532-E536 VanDerWaalsContact CG1-OE1 3.26Å; V532-E536 WeakPolarHBondContact CG1-OE1 3.41Å; V532-E536 WeakPolarHBondContact CG1-OE2 3.33Å; V532-E536 PolarHBondContact O-N 3.38Å
533	P	93.4	Very high	93.8	Very high	55 Å²	55	47.7 Å²	47.7	36%	0.357	23%	0.232	S	C	.	.	H	α-helix	trans	-58.2	-35.7	-179.9	-27.4	36.3	0	0	0	113.8	Y440 E536 A537	Y440-P533 HydrophobicContact CE2-CB 4.11Å; P533-E536 WeakPolarHBondContact CA-OE2 3.46Å; P533-E536 PolarHBondContact O-N 2.71Å; P533-A537 WeakPolarHBondContact O-CB 3.19Å; P533-A537 PolarHBondContact O-N 3.22Å
534	Y	95.2	Very high	93.4	Very high	26 Å²	26	46.2 Å²	46.2	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-36.9	174.6	-178.8	-91.9	0	0	0	112.3	L387 G391 Y440 A531 V532 R538	L387-Y534 HydrophobicContact CB-CE2 3.96Å; L387-Y534 HydrophobicContact CD1-CE2 4.41Å; G391-Y534 VanDerWaalsContact CA-CE2 3.49Å; Y440-Y534 HydrophobicContact CE1-CD2 4.07Å; Y440-Y534 AromaticContact CZ-CD2 3.99Å; Y440-Y534 WeakPolarHBondContact OH-CB 3.29Å; A531-Y534 PolarHBondContact O-N 3.01Å; V532-Y534 VanDerWaalsContact C-N 3.27Å; V532-Y534 PolarHBondContact O-N 2.82Å; V532-Y534 VanDerWaalsContact O-N 3.16Å; Y534-R538 WeakPolarHBondContact O-CB 3.33Å; Y534-R538 PolarHBondContact O-N 3.49Å
535	R	93.9	Very high	93.3	Very high	62 Å²	62	40.1 Å²	40.1	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-70.4	-38.2	179.2	-70.8	-171.3	-67.6	-172.2	8.8	111.4	E527 K530 A531 V532 R538 Q539	E527-R535 PolarHBondContact O-NH1 3.09Å; K530-R535 HydrophobicContact CB-CG 3.88Å; K530-R535 PolarHBondContact O-NE 3.43Å; A531-R535 PolarHBondContact O-N 2.95Å; V532-R535 WeakPolarHBondContact O-CA 3.37Å; V532-R535 WeakPolarHBondContact O-CB 3.35Å; V532-R535 PolarHBondContact O-N 2.9Å; R535-R538 WeakPolarHBondContact O-CB 3.3Å; R535-R538 PolarHBondContact O-N 2.9Å; R535-Q539 WeakPolarHBondContact O-CG 3.46Å; R535-Q539 PolarHBondContact O-N 3.4Å; R535-Q539 PolarHBondContact O-OE1 3.16Å
536	E	93.8	Very high	93	Very high	84 Å²	84	43.7 Å²	43.7	39%	0.393	22%	0.217	S	C	.	.	H	α-helix	trans	-70.1	-52.3	178.1	-69.6	158.6	158.1	0	0	111.7	P437 V532 P533 R538 Q539 Q540	P437-E536 HydrophobicContact CG-CB 4.22Å; V532-E536 VanDerWaalsContact CG1-CD 3.45Å; V532-E536 HydrophobicContact CG1-CG 4.41Å; V532-E536 VanDerWaalsContact CG1-OE1 3.26Å; V532-E536 WeakPolarHBondContact CG1-OE1 3.41Å; V532-E536 WeakPolarHBondContact CG1-OE2 3.33Å; V532-E536 PolarHBondContact O-N 3.38Å; P533-E536 WeakPolarHBondContact CA-OE2 3.46Å; P533-E536 PolarHBondContact O-N 2.71Å; E536-R538 PolarHBondContact O-N 3.16Å; E536-Q539 WeakPolarHBondContact O-CA 3.44Å; E536-Q539 WeakPolarHBondContact O-CB 3.37Å; E536-Q539 PolarHBondContact O-N 3.42Å; E536-Q540 PolarHBondContact O-N 2.94Å
537	A	93.7	Very high	92.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.9	-36.4	172.2	0	0	0	0	0	111.5	L387 P437 Y440 P533 L541	L387-A537 HydrophobicContact CD2-CB 3.56Å; P437-A537 HydrophobicContact CG-CB 3.8Å; Y440-A537 HydrophobicContact CD1-CB 4.48Å; Y440-A537 HydrophobicContact CD2-CB 3.5Å; Y440-A537 HydrophobicContact CE2-CB 4.13Å; Y440-A537 HydrophobicContact CG-CB 3.72Å; P533-A537 WeakPolarHBondContact O-CB 3.19Å; P533-A537 PolarHBondContact O-N 3.22Å; A537-L541 WeakPolarHBondContact O-CB 3.3Å; A537-L541 PolarHBondContact O-N 2.7Å
538	R	93.5	Very high	92.2	Very high	62 Å²	62	48.5 Å²	48.5	23%	0.234	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-40.6	172.6	175.9	-170.6	67.1	164	-9.2	112.5	R383 L387 E527 Y534 R535 E536 S542	R383-R538 VanDerWaalsContact NH2-CA 3.28Å; R383-R538 PolarHBondContact NH2-O 3.05Å; L387-R538 HydrophobicContact CD1-CB 4.13Å; E527-R538 IonicContact OE1-CZ 3.58Å; E527-R538 VanDerWaalsContact OE1-CZ 3.23Å; E527-R538 IonicContact OE1-NH1 3.21Å; E527-R538 PolarHBondContact OE1-NH1 3.23Å; E527-R538 IonicContact OE1-NH2 2.74Å; E527-R538 PolarHBondContact OE1-NH2 2.91Å; Y534-R538 WeakPolarHBondContact O-CB 3.33Å; Y534-R538 PolarHBondContact O-N 3.49Å; R535-R538 WeakPolarHBondContact O-CB 3.3Å; R535-R538 PolarHBondContact O-N 2.9Å; E536-R538 PolarHBondContact O-N 3.16Å; R538-S542 PolarHBondContact O-N 3.4Å; R538-S542 PolarHBondContact O-OG 2.93Å
539	Q	92.1	Very high	91.8	Very high	121 Å²	121	48.4 Å²	48.4	57%	0.565	25%	0.254	S	S	*	.	H	α-helix	trans	-68.5	-54.4	179.5	-77.8	161.5	-44.1	0	0	110.8	R535 E536 L541 S542 L543	R535-Q539 WeakPolarHBondContact O-CG 3.46Å; R535-Q539 PolarHBondContact O-N 3.4Å; R535-Q539 PolarHBondContact O-OE1 3.16Å; E536-Q539 WeakPolarHBondContact O-CA 3.44Å; E536-Q539 WeakPolarHBondContact O-CB 3.37Å; E536-Q539 PolarHBondContact O-N 3.42Å; Q539-L541 PolarHBondContact O-N 3.49Å; Q539-S542 WeakPolarHBondContact O-CA 3.23Å; Q539-S542 WeakPolarHBondContact O-CB 3.48Å; Q539-S542 PolarHBondContact O-N 3.32Å; Q539-L543 PolarHBondContact O-N 3.16Å
540	Q	91.4	Very high	91.3	Very high	62 Å²	62	48.7 Å²	48.7	29%	0.29	26%	0.255	S	S	.	.	H	α-helix	trans	-57.9	-45.3	178.7	-70.7	176.6	-27.1	0	0	113.1	C435 L436 E536 S542 L543 L544	C435-Q540 VanDerWaalsContact O-CD 3.27Å; C435-Q540 PolarHBondContact O-NE2 3.09Å; C435-Q540 PolarHBondContact O-OE1 3.43Å; L436-Q540 VanDerWaalsContact CA-OE1 3.31Å; L436-Q540 HydrophobicContact CD2-CB 4.48Å; E536-Q540 PolarHBondContact O-N 2.94Å; Q540-S542 PolarHBondContact O-N 2.97Å; Q540-S542 VanDerWaalsContact O-N 3.16Å; Q540-L543 WeakPolarHBondContact O-CB 3.28Å; Q540-L543 PolarHBondContact O-N 3.01Å; Q540-L544 WeakPolarHBondContact O-CG 3.36Å; Q540-L544 PolarHBondContact O-N 3.49Å
541	L	91.3	Very high	90.8	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-27.6	176.7	-176.5	63	0	0	0	112.5	R383 V386 L387 P426 L428 L436 A537 Q539 L545	R383-L541 HydrophobicContact CG-CD2 3.94Å; V386-L541 HydrophobicContact CB-CD1 4.49Å; V386-L541 HydrophobicContact CB-CD2 3.92Å; V386-L541 HydrophobicContact CG1-CD1 4.06Å; V386-L541 HydrophobicContact CG1-CD2 3.87Å; L387-L541 HydrophobicContact CD1-CD2 3.87Å; L387-L541 HydrophobicContact CD2-CD2 4.16Å; L387-L541 HydrophobicContact CG-CD2 3.72Å; P426-L541 HydrophobicContact CG-CD1 3.59Å; L428-L541 HydrophobicContact CD2-CD1 4.33Å; L436-L541 HydrophobicContact CD2-CB 4.44Å; A537-L541 WeakPolarHBondContact O-CB 3.3Å; A537-L541 PolarHBondContact O-N 2.7Å; Q539-L541 PolarHBondContact O-N 3.49Å; L541-L545 WeakPolarHBondContact O-CD1 3.32Å; L541-L545 WeakPolarHBondContact O-CG 3.03Å; L541-L545 PolarHBondContact O-N 3.48Å
542	S	91.6	Very high	90.4	Very high	22 Å²	22	50 Å²	50	15%	0.154	27%	0.272	C	S	.	.	H	α-helix	trans	-80.8	-32.1	175.8	-49.3	0	0	0	0	112.3	R383 R538 Q539 Q540 D546	R383-S542 PolarHBondContact NH1-OG 3.05Å; R383-S542 PolarHBondContact NH2-OG 3.39Å; R538-S542 PolarHBondContact O-N 3.4Å; R538-S542 PolarHBondContact O-OG 2.93Å; Q539-S542 WeakPolarHBondContact O-CA 3.23Å; Q539-S542 WeakPolarHBondContact O-CB 3.48Å; Q539-S542 PolarHBondContact O-N 3.32Å; Q540-S542 PolarHBondContact O-N 2.97Å; Q540-S542 VanDerWaalsContact O-N 3.16Å; S542-D546 PolarHBondContact O-N 3.47Å
543	L	89.7	Confident	90.1	Very high	101 Å²	101	49.3 Å²	49.3	53%	0.529	26%	0.262	S	S	.	.	H	α-helix	trans	-67.5	-44.9	171.5	178.1	63.9	0	0	0	111.2	Q539 Q540 L545 D546 L547	Q539-L543 PolarHBondContact O-N 3.16Å; Q540-L543 WeakPolarHBondContact O-CB 3.28Å; Q540-L543 PolarHBondContact O-N 3.01Å; L543-L545 VanDerWaalsContact C-N 3.3Å; L543-L545 PolarHBondContact O-N 3.24Å; L543-D546 PolarHBondContact O-N 2.88Å; L543-D546 VanDerWaalsContact O-N 3.09Å; L543-L547 HydrophobicContact CD1-CD1 4.11Å; L543-L547 HydrophobicContact CD1-CG 4.05Å; L543-L547 HydrophobicContact CD2-CD1 4.45Å; L543-L547 HydrophobicContact CG-CD1 3.83Å; L543-L547 HydrophobicContact CG-CG 4.22Å; L543-L547 WeakPolarHBondContact O-CB 3.26Å; L543-L547 WeakPolarHBondContact O-CG 3.35Å; L543-L547 PolarHBondContact O-N 3.26Å
544	L	88.6	Confident	89.6	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.063	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-35.4	176.7	-71.2	171.6	0	0	0	112.8	P426 L428 Q540 Q548	P426-L544 HydrophobicContact CB-CB 4.19Å; P426-L544 HydrophobicContact CG-CB 3.98Å; L428-L544 HydrophobicContact CD2-CD1 4.03Å; Q540-L544 WeakPolarHBondContact O-CG 3.36Å; Q540-L544 PolarHBondContact O-N 3.49Å; L544-Q548 WeakPolarHBondContact O-CB 3.28Å; L544-Q548 VanDerWaalsContact O-CG 3.24Å; L544-Q548 WeakPolarHBondContact O-CG 3.43Å; L544-Q548 PolarHBondContact O-N 3.49Å
545	L	89.4	Confident	88.7	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.047	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-40	172.9	-77.4	163.5	0	0	0	112.1	L349 P426 L541 L543 L550 G551 W553	L349-L545 HydrophobicContact CD1-CD1 4.26Å; L349-L545 HydrophobicContact CD2-CD1 4.28Å; L349-L545 HydrophobicContact CD2-CD2 4.18Å; P426-L545 HydrophobicContact CB-CD2 4.17Å; P426-L545 HydrophobicContact CB-CG 4.37Å; P426-L545 HydrophobicContact CG-CD2 4.23Å; P426-L545 HydrophobicContact CG-CG 4.13Å; L541-L545 WeakPolarHBondContact O-CD1 3.32Å; L541-L545 WeakPolarHBondContact O-CG 3.03Å; L541-L545 PolarHBondContact O-N 3.48Å; L543-L545 VanDerWaalsContact C-N 3.3Å; L543-L545 PolarHBondContact O-N 3.24Å; L545-L550 HydrophobicContact CD2-CB 3.98Å; L545-L550 HydrophobicContact CD2-CD1 3.82Å; L545-L550 CarbonylContact O-C 3.59Å; L545-L550 WeakPolarHBondContact O-CA 3.37Å; L545-L550 WeakPolarHBondContact O-CB 3.25Å; L545-L550 PolarHBondContact O-N 3.37Å; L545-G551 PolarHBondContact O-N 2.98Å; L545-W553 HydrophobicContact CD1-CE3 4.06Å
546	D	88.4	Confident	88	Confident	85 Å²	85	50.7 Å²	50.7	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-74.3	-46.5	-178.8	-150.8	32.5	0	0	0	111.7	S542 L543 Q548 G549 G551 A552	S542-D546 PolarHBondContact O-N 3.47Å; L543-D546 PolarHBondContact O-N 2.88Å; L543-D546 VanDerWaalsContact O-N 3.09Å; D546-Q548 PolarHBondContact O-N 3.11Å; D546-Q548 VanDerWaalsContact O-N 3.17Å; D546-G549 PolarHBondContact O-N 3.14Å; D546-G551 WeakPolarHBondContact OD1-CA 3.44Å; D546-A552 HydrophobicContact CB-CB 4.35Å; D546-A552 WeakPolarHBondContact OD1-CA 3.46Å; D546-A552 PolarHBondContact OD1-N 3.34Å
547	L	87.4	Confident	86.9	Confident	112 Å²	112	51 Å²	51	59%	0.586	29%	0.289	S	S	*	.	H	α-helix	trans	-58	-28	175.2	-71	174.9	0	0	0	113.5	L543	L543-L547 HydrophobicContact CD1-CD1 4.11Å; L543-L547 HydrophobicContact CD1-CG 4.05Å; L543-L547 HydrophobicContact CD2-CD1 4.45Å; L543-L547 HydrophobicContact CG-CD1 3.83Å; L543-L547 HydrophobicContact CG-CG 4.22Å; L543-L547 WeakPolarHBondContact O-CB 3.26Å; L543-L547 WeakPolarHBondContact O-CG 3.35Å; L543-L547 PolarHBondContact O-N 3.26Å
548	Q	86.1	Confident	86.5	Confident	51 Å²	51	55.9 Å²	55.9	24%	0.238	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	8.9	177.4	-67	176.1	19.9	0	0	113.4	K427 L544 D546 L550	K427-Q548 PolarHBondContact O-NE2 3.11Å; L544-Q548 WeakPolarHBondContact O-CB 3.28Å; L544-Q548 VanDerWaalsContact O-CG 3.24Å; L544-Q548 WeakPolarHBondContact O-CG 3.43Å; L544-Q548 PolarHBondContact O-N 3.49Å; D546-Q548 PolarHBondContact O-N 3.11Å; D546-Q548 VanDerWaalsContact O-N 3.17Å; Q548-L550 HydrophobicContact CB-CD1 4.32Å; Q548-L550 HydrophobicContact CB-CG 4.28Å; Q548-L550 PolarHBondContact O-N 3.4Å; Q548-L550 VanDerWaalsContact O-N 3.16Å
549	G	85.1	Confident	86.1	Confident	45 Å²	45	53.6 Å²	53.6	46%	0.464	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	7.2	179.7	0	0	0	0	0	114.7	D546 G551	D546-G549 PolarHBondContact O-N 3.14Å; G549-G551 VanDerWaalsContact C-N 3.27Å
550	L	86.8	Confident	85.8	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.031	28%	0.282	C	S	.	.	S	Bend	trans	-76.2	-22.2	172.5	-54.3	172.4	0	0	0	110.7	R348 L349 R425 P426 L545 Q548	R348-L550 WeakPolarHBondContact CA-O 3.29Å; R348-L550 WeakPolarHBondContact CB-O 3.48Å; L349-L550 PolarHBondContact N-O 3.18Å; R425-L550 HydrophobicContact CB-CD1 4.03Å; R425-L550 HydrophobicContact CG-CD1 4.06Å; P426-L550 HydrophobicContact CB-CD1 4.3Å; L545-L550 HydrophobicContact CD2-CB 3.98Å; L545-L550 HydrophobicContact CD2-CD1 3.82Å; L545-L550 CarbonylContact O-C 3.59Å; L545-L550 WeakPolarHBondContact O-CA 3.37Å; L545-L550 WeakPolarHBondContact O-CB 3.25Å; L545-L550 PolarHBondContact O-N 3.37Å; Q548-L550 HydrophobicContact CB-CD1 4.32Å; Q548-L550 HydrophobicContact CB-CG 4.28Å; Q548-L550 PolarHBondContact O-N 3.4Å; Q548-L550 VanDerWaalsContact O-N 3.16Å
551	G	86.4	Confident	85.8	Confident	16 Å²	16	50 Å²	50	17%	0.165	29%	0.29	C	S	.	.			trans	100.9	150.7	166	0	0	0	0	0	114.6	L349 L545 D546 G549 W553	L349-G551 WeakPolarHBondContact CD1-O 3.4Å; L545-G551 PolarHBondContact O-N 2.98Å; D546-G551 WeakPolarHBondContact OD1-CA 3.44Å; G549-G551 VanDerWaalsContact C-N 3.27Å; G551-W553 PolarHBondContact O-N 2.87Å
552	A	86.3	Confident	85.9	Confident	45 Å²	45	51 Å²	51	37%	0.372	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-56.7	126.5	-178	0	0	0	0	0	113.2	D546 P554	D546-A552 HydrophobicContact CB-CB 4.35Å; D546-A552 WeakPolarHBondContact OD1-CA 3.46Å; D546-A552 PolarHBondContact OD1-N 3.34Å; A552-P554 VanDerWaalsContact O-CD 3.31Å; A552-P554 WeakPolarHBondContact O-CD 3.49Å
553	W	88.3	Confident	85.8	Confident	57 Å²	57	58.8 Å²	58.8	22%	0.216	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-68.2	118	171.3	-174	-74	0	0	0	110.2	L349 L375 D379 K380 R383 L545 G551 S555	L349-W553 HydrophobicContact CD1-CB 4.04Å; L349-W553 HydrophobicContact CD1-CE3 3.99Å; L349-W553 HydrophobicContact CD2-CE3 4.34Å; L375-W553 HydrophobicContact CD1-CD2 3.14Å; L375-W553 HydrophobicContact CD1-CE3 3.46Å; L375-W553 VanDerWaalsContact CD1-CE3 3.46Å; L375-W553 HydrophobicContact CD1-CG 3.74Å; L375-W553 HydrophobicContact CD1-CH2 3.58Å; L375-W553 HydrophobicContact CD1-CZ2 3.31Å; L375-W553 HydrophobicContact CD1-CZ3 3.66Å; D379-W553 HydrophobicContact CB-CZ3 4.31Å; K380-W553 HydrophobicContact CG-CH2 4.23Å; R383-W553 HydrophobicContact CB-CH2 3.87Å; R383-W553 HydrophobicContact CB-CZ3 3.94Å; R383-W553 VanDerWaalsContact CD-CZ3 3.48Å; R383-W553 HydrophobicContact CG-CH2 4.14Å; R383-W553 HydrophobicContact CG-CZ3 4.32Å; R383-W553 VanDerWaalsContact NH1-CE3 3.27Å; L545-W553 HydrophobicContact CD1-CE3 4.06Å; G551-W553 PolarHBondContact O-N 2.87Å; W553-S555 PolarHBondContact O-N 3.04Å; W553-S555 VanDerWaalsContact O-N 3.13Å
554	P	81.8	Confident	84.6	Confident	37 Å²	37	60.5 Å²	60.5	24%	0.24	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-59.1	119.4	-172	-29.4	38.3	0	0	0	113.8	V360 A552	V360-P554 HydrophobicContact CG1-CG 3.69Å; V360-P554 HydrophobicContact CG2-CG 4.28Å; A552-P554 VanDerWaalsContact O-CD 3.31Å; A552-P554 WeakPolarHBondContact O-CD 3.49Å
555	S	76.6	Confident	84.4	Confident	92 Å²	92	62.9 Å²	62.9	64%	0.643	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-75.1	149.2	168.2	-169.9	0	0	0	0	110.2	W553	W553-S555 PolarHBondContact O-N 3.04Å; W553-S555 VanDerWaalsContact O-N 3.13Å
556	K	79.6	Confident	84.1	Confident	44 Å²	44	65.7 Å²	65.7	19%	0.191	35%	0.354	C	S	.	.			trans	-135.3	73.2	175.1	-61.4	-157.4	179.6	-152.9	0	109.5	L254 H371 G373 L558 V559	L254-K556 HydrophobicContact CD1-CD 4.28Å; L254-K556 HydrophobicContact CD2-CD 3.96Å; H371-K556 PolarHBondContact O-NZ 3.37Å; H371-K556 VanDerWaalsContact O-NZ 3.15Å; G373-K556 WeakPolarHBondContact O-CE 3.38Å; G373-K556 PolarHBondContact O-NZ 3.43Å; K556-L558 VanDerWaalsContact C-N 3.34Å; K556-L558 PolarHBondContact O-N 3.25Å; K556-V559 HydrophobicContact CB-CB 3.97Å; K556-V559 HydrophobicContact CB-CG2 3.81Å; K556-V559 HydrophobicContact CD-CG2 4.42Å; K556-V559 PolarHBondContact O-N 2.9Å; K556-V559 VanDerWaalsContact O-N 3.09Å
557	P	71.7	Confident	83.9	Confident	89 Å²	89	64.7 Å²	64.7	58%	0.578	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-58.2	-41.7	-162.9	20	-32.2	0	0	0	113.3	V559 K561	P557-V559 PolarHBondContact O-N 3.06Å; P557-K561 WeakPolarHBondContact O-CG 3.43Å
558	L	83.9	Confident	83.7	Confident	104 Å²	104	61.9 Å²	61.9	55%	0.545	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-71.8	-26.3	-178.8	-58	-179.3	0	0	0	113.6	F256 K556 G560 K561	F256-L558 HydrophobicContact CD1-CB 3.51Å; F256-L558 HydrophobicContact CE1-CB 3.62Å; F256-L558 HydrophobicContact CE1-CD1 4.18Å; F256-L558 HydrophobicContact CG-CB 4.19Å; F256-L558 HydrophobicContact CZ-CB 4.37Å; F256-L558 HydrophobicContact CZ-CD1 4.13Å; K556-L558 VanDerWaalsContact C-N 3.34Å; K556-L558 PolarHBondContact O-N 3.25Å; L558-G560 PolarHBondContact O-N 2.96Å; L558-G560 VanDerWaalsContact O-N 3.11Å; L558-K561 PolarHBondContact O-N 3.09Å
559	V	85.6	Confident	83.6	Confident	13 Å²	13	62.6 Å²	62.6	8%	0.079	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-70.2	-11	-172.8	177.3	0	0	0	0	113.1	L254 F256 K501 K556 P557	L254-V559 HydrophobicContact CD1-CG2 4.21Å; L254-V559 HydrophobicContact CD2-CG2 4.28Å; F256-V559 HydrophobicContact CD1-CG2 3.73Å; F256-V559 HydrophobicContact CE1-CG2 3.85Å; K501-V559 HydrophobicContact CD-CG1 4.37Å; K501-V559 VanDerWaalsContact NZ-CG1 3.34Å; K556-V559 HydrophobicContact CB-CB 3.97Å; K556-V559 HydrophobicContact CB-CG2 3.81Å; K556-V559 HydrophobicContact CD-CG2 4.42Å; K556-V559 PolarHBondContact O-N 2.9Å; K556-V559 VanDerWaalsContact O-N 3.09Å; P557-V559 PolarHBondContact O-N 3.06Å
560	G	86	Confident	83.5	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.021	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-106.8	-2.4	170.5	0	0	0	0	0	115.1	T525 Y526 E527 L558	T525-G560 PolarHBondContact OG1-O 2.9Å; Y526-G560 CarbonylContact C-O 3.54Å; Y526-G560 WeakPolarHBondContact CB-O 3.35Å; Y526-G560 PolarHBondContact N-O 3.21Å; E527-G560 PolarHBondContact N-O 2.56Å; L558-G560 PolarHBondContact O-N 2.96Å; L558-G560 VanDerWaalsContact O-N 3.11Å
561	K	92.1	Very high	83.2	Confident	106 Å²	106	67.9 Å²	67.9	46%	0.461	35%	0.353	S	S	.	.			trans	-92.5	2.6	-170.6	-71.1	-69.2	177.1	-175.2	0	115.3	T525 D528 P557 L558	T525-K561 HydrophobicContact CG2-CD 4.3Å; T525-K561 VanDerWaalsContact CG2-O 3.27Å; T525-K561 WeakPolarHBondContact CG2-O 3.48Å; D528-K561 IonicContact OD1-NZ 2.81Å; D528-K561 PolarHBondContact OD1-NZ 2.79Å; P557-K561 WeakPolarHBondContact O-CG 3.43Å; L558-K561 PolarHBondContact O-N 3.09Å
562	F	93.4	Very high	83	Confident	22 Å²	22	71.8 Å²	71.8	10%	0.096	37%	0.367	C	S	.	.			trans	-65	152.2	167.9	69.2	-83.2	0	0	0	112	F256 S257 G258 K501 A502 L505 T525 Y526	F256-F562 WeakPolarHBondContact O-CB 3.45Å; F256-F562 VanDerWaalsContact O-CD1 3.31Å; F256-F562 WeakPolarHBondContact O-CD1 3.45Å; S257-F562 WeakPolarHBondContact O-CD2 3.25Å; G258-F562 VanDerWaalsContact CA-CE1 3.49Å; K501-F562 HydrophobicContact CB-CE1 3.96Å; K501-F562 HydrophobicContact CB-CZ 3.59Å; K501-F562 HydrophobicContact CD-CE1 4.23Å; A502-F562 HydrophobicContact CB-CE2 4.31Å; L505-F562 HydrophobicContact CD2-CE2 4.01Å; T525-F562 VanDerWaalsContact CA-O 3.29Å; T525-F562 WeakPolarHBondContact CA-O 3.27Å; T525-F562 WeakPolarHBondContact CB-O 3.49Å; Y526-F562 VanDerWaalsContact CB-CE1 3.5Å; Y526-F562 HydrophobicContact CD1-CE1 4.34Å; Y526-F562 HydrophobicContact CD1-CZ 4.45Å; Y526-F562 HydrophobicContact CD2-CE1 4.26Å; Y526-F562 HydrophobicContact CD2-CE2 4.4Å; Y526-F562 AromaticContact CD2-CZ 3.58Å; Y526-F562 HydrophobicContact CD2-CZ 3.58Å; Y526-F562 HydrophobicContact CE2-CZ 4.47Å; Y526-F562 AromaticContact CG-CE1 3.8Å; Y526-F562 HydrophobicContact CG-CE1 3.8Å; Y526-F562 AromaticContact CG-CZ 3.56Å; Y526-F562 HydrophobicContact CG-CZ 3.56Å; Y526-F562 PolarHBondContact N-O 3.13Å
563	R	88.5	Confident	82.7	Confident	187 Å²	187	74.1 Å²	74.1	71%	0.706	37%	0.367	S	S	*	.			trans	-102.2	154	167	-51.6	-174.2	-175.8	160.1	4.4	108.4	K524 T525	K524-R563 WeakPolarHBondContact O-CG 3.3Å; T525-R563 HydrophobicContact CG2-CG 4.18Å
564	H	64.9	Low	82.2	Confident	136 Å²	136	75.6 Å²	75.6	63%	0.63	38%	0.381	S	S	*	.			trans	-105.4	0	160.4	178.4	-19.8	0	0	0	107.2	L505 R509	L505-H564 HydrophobicContact CD2-CB 3.74Å; L505-H564 HydrophobicContact CG-CB 4.21Å; R509-H564 VanDerWaalsContact NH1-C 3.34Å; R509-H564 PolarHBondContact NH1-O 2.61Å; R509-H564 PolarHBondContact NH2-O 2.73Å

Retrieved 564 of 564 residues in 121.2 ms (Link to these results)

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