A0A096NNC1_PAPAN Loading...

Multiple C2 and transmembrane domain-containing protein 2

Might play a role in the development of cardiac outflow tract.

AlphaFold DB , UniProt , Accession A0A096NNC1, Species PAPAN (Papio anubis, Olive baboon), Gene MCTP2, Length 877 aa.

						>A0A096NNC1_PAPAN|A0A096NNC1|MCTP2
MDLEKPSVWGSLKQRTRPLLINLSKKKVKKNPSKPPDLRARHHLDRRLSLSVPDLLEAEALAPEGRPYSGPQSSYTSVPSSLSTAGIFPKSSSSSLKQSEEELDWSQEEASHLHVVETDSEEAYASPEQRRVSSNGIFDLQKTSLGGDAPEEPEKLCGSSDLNASMTSQRFEEQSVLGEASDGLSNLSSPFAYLLTIHLKEGRNLVVRDRCGTSDPYVKFKLNGKTLYKSKVIYKNLNPVWDEIVVLPIQSLDQKLRVKVYDRDLTTSDFMGSAFVILSDLELNRTTEHILKLEDPNSLEDDMGVIVLNLNLVVKQGDFKRHRWSNRKRLSASKSSLIRNLRLSESLKKNQLWNGIISITLLEGKNVSGGSMTEMFVQLKLGHQRYKSKTLCKSANPQWQEQFDFHYFSDRMGILDIEVWGKDSKKHEERLGTCKVDISALPLKQANCLELPLDSCLGALLMLVTLTPCAGVSISDLCVCPLADPSERKQITQRYCLRNSLKDMKDVGILQVKVLKAADLLAADFSGKSDPFCLLELGNDRLQTHTVYKNLNPEWNKVFTFPIKDIHDVLEVTVFDEDGDKPPDFLGKVAIPLLSIRDGQPNCYVLKNKDLEQAFKGVIYLEMDLIYNPVKASIRTFTPREKRFVEDSRKLSKKILSRDVDRVKRITMAIWNTMQFLKSCFQWESTLRSTIAFAVFLITVWNFELYMIPLALLLIFVYNFIRPVKGKVSSIQDSQESTDIDDEEDEDDKESEKKGLIERIYMVQDIVSTVQNILEEIASFGERIKNTFNWTVPFLSSLACLILAAATIILYFIPLRYIILIWGINKFTKKLRNPYSIDNNELLDFLSRVPSDVQKVQYAELKLCSGHSPLRKKRSAL
					

Structure Viewer

Loading PAE data...

(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	33	Very low	40.6	Very low	218 Å²	218	142.8 Å²	142.8	100%	1.074	76%	0.756	S	S	*	*				0	67.3	0	-61.5	-175.4	-171.6	0	0	107.6
2	D	31.9	Very low	40.9	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	75%	0.745	S	S	*	*				90.9	134.1	50.5	-54.5	-24.4	0	0	0	110.2
3	L	36.2	Very low	41.2	Very low	154 Å²	154	141.1 Å²	141.1	81%	0.806	74%	0.736	S	S	*	*			cis	-154.7	146.7	-3.9	-120.5	166	0	0	0	109.1
4	E	39.2	Very low	41.7	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.864	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.3	145.9	-178.6	-60.2	-179.7	134.5	0	0	112.8
5	K	40.5	Very low	42.3	Very low	203 Å²	203	145.8 Å²	145.8	88%	0.883	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-96.2	121.2	170.5	-71.1	179.5	-179.4	172.8	0	109.9
6	P	41.7	Very low	42.6	Very low	125 Å²	125	141.3 Å²	141.3	81%	0.812	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-76.1	141.7	-175.7	30.1	-35.2	0	0	0	112.6
7	S	47.3	Very low	42.8	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-77.2	145.5	175.8	69.9	0	0	0	0	112.4	W9 G10	S7-W9 PolarHBondContact O-N 3.37Å; S7-G10 PolarHBondContact O-N 3.25Å; S7-G10 VanDerWaalsContact O-N 3.12Å
8	V	49.3	Very low	42.7	Very low	130 Å²	130	139.7 Å²	139.7	79%	0.788	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-27.4	-170.7	179.3	0	0	0	0	113.3	G10 S11	V8-G10 VanDerWaalsContact C-N 3.27Å; V8-G10 PolarHBondContact O-N 3.38Å; V8-S11 PolarHBondContact O-N 3.18Å
9	W	39.6	Very low	42.8	Very low	218 Å²	218	140.1 Å²	140.1	83%	0.826	71%	0.708	S	S	*	*	H	α-helix	trans	-62.7	-28.2	179.4	-115.8	52.7	0	0	0	114.1	S7 S11 K13	S7-W9 PolarHBondContact O-N 3.37Å; W9-S11 PolarHBondContact O-N 2.74Å; W9-K13 PolarHBondContact O-N 2.86Å
10	G	44	Very low	42.9	Very low	40 Å²	40	139.7 Å²	139.7	41%	0.412	71%	0.706	S	S	.	*	H	α-helix	trans	-63.9	-39.4	178.1	0	0	0	0	0	113.3	S7 V8 L12 K13 Q14	S7-G10 PolarHBondContact O-N 3.25Å; S7-G10 VanDerWaalsContact O-N 3.12Å; V8-G10 VanDerWaalsContact C-N 3.27Å; V8-G10 PolarHBondContact O-N 3.38Å; G10-L12 PolarHBondContact O-N 2.57Å; G10-K13 PolarHBondContact O-N 3.25Å; G10-Q14 PolarHBondContact O-N 3.03Å
11	S	44.3	Very low	42.8	Very low	63 Å²	63	138.6 Å²	138.6	44%	0.441	70%	0.701	S	S	.	*	H	α-helix	trans	-65.7	-41.1	-176.4	-170.1	0	0	0	0	112.5	V8 W9 K13 Q14 R15	V8-S11 PolarHBondContact O-N 3.18Å; W9-S11 PolarHBondContact O-N 2.74Å; S11-K13 VanDerWaalsContact C-N 3.34Å; S11-K13 PolarHBondContact O-N 2.97Å; S11-Q14 PolarHBondContact O-N 3.44Å; S11-R15 PolarHBondContact O-N 2.91Å
12	L	43.8	Very low	43.1	Very low	118 Å²	118	135.5 Å²	135.5	62%	0.618	69%	0.689	S	S	*	*	H	α-helix	trans	-66.5	-35.1	179.7	-120.9	158.7	0	0	0	112.2	G10 Q14 T16	G10-L12 PolarHBondContact O-N 2.57Å; L12-Q14 VanDerWaalsContact C-N 3.34Å; L12-T16 PolarHBondContact O-OG1 3.47Å
13	K	44.6	Very low	43.5	Very low	145 Å²	145	136.5 Å²	136.5	63%	0.63	69%	0.694	S	S	*	*	H	α-helix	trans	-75.1	-19	175.6	-161	171.7	-173.6	174.5	0	113.6	W9 G10 S11	W9-K13 PolarHBondContact O-N 2.86Å; G10-K13 PolarHBondContact O-N 3.25Å; S11-K13 VanDerWaalsContact C-N 3.34Å; S11-K13 PolarHBondContact O-N 2.97Å
14	Q	48.7	Very low	43.5	Very low	143 Å²	143	133.8 Å²	133.8	67%	0.668	69%	0.688	S	S	*	*	H	α-helix	trans	-84.8	-47.4	171.4	-74.2	-174.5	-13.5	0	0	112.2	G10 S11 L12 T16 R17	G10-Q14 PolarHBondContact O-N 3.03Å; S11-Q14 PolarHBondContact O-N 3.44Å; L12-Q14 VanDerWaalsContact C-N 3.34Å; Q14-T16 PolarHBondContact O-N 2.87Å; Q14-T16 VanDerWaalsContact O-N 3.14Å; Q14-R17 PolarHBondContact O-N 3.46Å
15	R	50.3	Low	43.2	Very low	210 Å²	210	134.6 Å²	134.6	79%	0.792	69%	0.688	S	S	*	*	H	α-helix	trans	-63.2	-20.1	-177.1	-84.2	-177.1	165	168.4	-3.2	115	S11	S11-R15 PolarHBondContact O-N 2.91Å
16	T	47.5	Very low	42.7	Very low	73 Å²	73	134 Å²	134	45%	0.448	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-12.5	-179	43.9	0	0	0	0	114.6	L12 Q14 P18	L12-T16 PolarHBondContact O-OG1 3.47Å; Q14-T16 PolarHBondContact O-N 2.87Å; Q14-T16 VanDerWaalsContact O-N 3.14Å; T16-P18 VanDerWaalsContact C-CD 3.49Å
17	R	45.2	Very low	42.1	Very low	167 Å²	167	138.4 Å²	138.4	63%	0.63	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-61.8	-37.5	-176.1	-82.8	177.3	167.6	-170.1	-5.8	117.1	Q14 L19 L20	Q14-R17 PolarHBondContact O-N 3.46Å; R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 2.81Å; R17-L20 PolarHBondContact O-N 3.48Å
18	P	42.4	Very low	41.3	Very low	87 Å²	87	140.1 Å²	140.1	57%	0.565	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-69.8	-23.1	-173.7	25.8	-33.4	0	0	0	113.9	T16	T16-P18 VanDerWaalsContact C-CD 3.49Å
19	L	44.5	Very low	40.5	Very low	148 Å²	148	143.4 Å²	143.4	78%	0.775	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-75.4	-21.5	-178.3	-73.5	168.3	0	0	0	114.1	R17	R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 2.81Å
20	L	44.2	Very low	40	Very low	131 Å²	131	142.9 Å²	142.9	69%	0.686	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-92.1	-10.1	-176.2	-68.1	172.3	0	0	0	114	R17 N22	R17-L20 PolarHBondContact O-N 3.48Å; L20-N22 PolarHBondContact O-N 3.26Å
21	I	41.6	Very low	39.2	Very low	117 Å²	117	148.7 Å²	148.7	60%	0.6	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-76.6	-21.8	-171	-72	172.8	0	0	0	113.1	L23	I21-L23 PolarHBondContact O-N 3.23Å
22	N	37.9	Very low	39.5	Very low	154 Å²	154	151.4 Å²	151.4	82%	0.824	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-83.5	-0.5	-177.2	-77.3	-19	0	0	0	115.2	L20	L20-N22 PolarHBondContact O-N 3.26Å
23	L	40.7	Very low	38.7	Very low	161 Å²	161	151.7 Å²	151.7	84%	0.843	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-110.1	7.2	-175.8	-78.2	168.2	0	0	0	115.4	I21	I21-L23 PolarHBondContact O-N 3.23Å
24	S	37	Very low	37.8	Very low	98 Å²	98	154.3 Å²	154.3	69%	0.685	77%	0.767	S	S	*	*			trans	-127	52	-174.8	74.7	0	0	0	0	115.9
25	K	32	Very low	37.8	Very low	201 Å²	201	153 Å²	153	87%	0.874	77%	0.771	S	S	*	*			trans	-140.6	132.7	162.2	-68.1	179.5	-176	170.9	0	107.8
26	K	29.8	Very low	37.7	Very low	191 Å²	191	147.9 Å²	147.9	83%	0.83	77%	0.765	S	S	*	*			cis	-135.1	144.1	3.5	-91	170	170.3	172.5	0	109.3	V28	K26-V28 HydrophobicContact CB-CG2 4.39Å
27	K	29.5	Very low	36.6	Very low	217 Å²	217	151.1 Å²	151.1	94%	0.943	78%	0.779	S	S	*	*			trans	-91.5	132.3	151.5	-84.4	-175.5	174.9	178.5	0	108.7
28	V	29.7	Very low	35.9	Very low	131 Å²	131	149 Å²	149	79%	0.794	78%	0.78	S	S	*	*			trans	-127.7	139.6	168.3	179.4	0	0	0	0	107.7	K26	K26-V28 HydrophobicContact CB-CG2 4.39Å
29	K	33.7	Very low	35	Very low	199 Å²	199	156 Å²	156	87%	0.865	80%	0.795	S	S	*	*			trans	-126.9	118.7	-172.6	178	-172.4	-179.6	-175	0	109.1
30	K	29.5	Very low	34.2	Very low	207 Å²	207	153.3 Å²	153.3	90%	0.9	79%	0.794	S	S	*	*			trans	-159.2	161	161.1	-115.2	174	-176.8	-175.6	0	111.3
31	N	25.6	Very low	33.5	Very low	162 Å²	162	157.6 Å²	157.6	87%	0.866	80%	0.801	S	S	*	*			trans	-99.7	175.5	-168.7	-105.6	22.4	0	0	0	112.3
32	P	51.4	Low	32.9	Very low	119 Å²	119	159.1 Å²	159.1	77%	0.773	81%	0.805	S	S	*	*			trans	-98.7	157.8	-147.8	37.2	-37.9	0	0	0	116.8
33	S	26.1	Very low	32.3	Very low	125 Å²	125	159.5 Å²	159.5	87%	0.874	80%	0.802	S	S	*	*			trans	-155.8	158.9	152.1	54.5	0	0	0	0	111.5
34	K	27.4	Very low	31.8	Very low	199 Å²	199	157.7 Å²	157.7	87%	0.865	79%	0.792	S	S	*	*			trans	-109.9	176.3	170.6	-87.2	-175.2	176.8	-177.8	0	108.2
35	P	49	Very low	31.4	Very low	116 Å²	116	158.3 Å²	158.3	75%	0.753	79%	0.788	S	S	*	*			cis	-122	-137.9	-38.4	37.6	-17.6	0	0	0	107.2
36	P	46.5	Very low	31.3	Very low	102 Å²	102	158.2 Å²	158.2	66%	0.662	78%	0.782	S	S	*	*			cis	-133.2	178.8	-24	39.2	-20.7	0	0	0	115.9
37	D	25.8	Very low	31.2	Very low	141 Å²	141	159 Å²	159	75%	0.754	78%	0.78	S	S	*	*			trans	76.8	149.5	136.4	-95	-43.3	0	0	0	128.4
38	L	29	Very low	31.3	Very low	124 Å²	124	154.3 Å²	154.3	65%	0.649	77%	0.765	S	S	*	*			trans	59.9	99.3	146.5	-70.6	165.3	0	0	0	124.7
39	R	24.6	Very low	31.4	Very low	233 Å²	233	152.9 Å²	152.9	88%	0.879	76%	0.76	S	S	*	*				64.5	160.3	120.1	-75.7	-175.5	-176.8	171.1	0.6	123.3
40	A	28	Very low	31.3	Very low	91 Å²	91	151.1 Å²	151.1	75%	0.752	76%	0.759	S	S	*	*			trans	76.7	122.1	174.6	0	0	0	0	0	115.6
41	R	28.6	Very low	31.4	Very low	222 Å²	222	146.5 Å²	146.5	84%	0.838	75%	0.753	S	S	*	*				72	133.7	61.5	-75.7	-179.9	168.3	-176	-3.5	112
42	H	29.9	Very low	31.7	Very low	148 Å²	148	145 Å²	145	69%	0.685	75%	0.75	S	S	*	*			cis	-152.6	-164.2	13.5	-121.6	-56.3	0	0	0	112.6
43	H	24.5	Very low	31	Very low	163 Å²	163	145.4 Å²	145.4	76%	0.755	75%	0.752	S	S	*	*			trans	72.8	125.3	-179	-97.7	-100.7	0	0	0	117
44	L	30.6	Very low	31.1	Very low	122 Å²	122	146.5 Å²	146.5	64%	0.639	75%	0.749	S	S	*	*			cis	73.3	128.2	34.6	-58.1	170.6	0	0	0	114
45	D	27.5	Very low	31.3	Very low	112 Å²	112	143.8 Å²	143.8	60%	0.599	74%	0.743	S	S	*	*			cis	-158.8	133.7	-7.9	-139.1	26.7	0	0	0	107.1
46	R	29.9	Very low	30.3	Very low	199 Å²	199	145.2 Å²	145.2	75%	0.751	74%	0.743	S	S	*	*				85.4	156.3	95	-175.9	-176.3	178.2	-172.5	2.4	116.4
47	R	29.2	Very low	29.5	Very low	207 Å²	207	149 Å²	149	78%	0.781	75%	0.752	S	S	*	*			trans	96.3	138.2	170.5	-58.4	-162.9	166.9	-131.3	-0.5	115.8
48	L	31	Very low	29.6	Very low	119 Å²	119	147.3 Å²	147.3	62%	0.623	76%	0.757	S	S	*	*			cis	-154.5	155.7	-14.3	-117.6	175.7	0	0	0	111.6
49	S	31.9	Very low	29.4	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	77%	0.769	S	S	*	*			trans	-99.9	141.9	161.3	44.4	0	0	0	0	110.4
50	L	32.3	Very low	29.5	Very low	161 Å²	161	143.4 Å²	143.4	84%	0.843	76%	0.76	S	S	*	*			trans	-142.6	158.2	170.3	-72.1	174.1	0	0	0	107.4
51	S	30.6	Very low	29.4	Very low	110 Å²	110	147.4 Å²	147.4	77%	0.769	77%	0.768	S	S	*	*			cis	-145.5	165.2	20.3	47.8	0	0	0	0	113.2
52	V	31.6	Very low	29.6	Very low	131 Å²	131	140.7 Å²	140.7	79%	0.794	76%	0.76	S	S	*	*			trans	-137.3	145.9	168	175.9	0	0	0	0	106.8
53	P	36.5	Very low	29.9	Very low	127 Å²	127	139.3 Å²	139.3	83%	0.825	76%	0.764	S	S	*	*			trans	-82.9	155.7	172.1	4.6	14	0	0	0	111.9
54	D	28.5	Very low	30	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	77%	0.772	S	S	*	*			trans	-123.3	-179.3	-155.2	-145.9	-22.4	0	0	0	114
55	L	31.6	Very low	29.8	Very low	142 Å²	142	138.8 Å²	138.8	74%	0.743	78%	0.779	S	S	*	*			trans	74.5	144.9	175.7	-87.4	64.4	0	0	0	116.4
56	L	29.3	Very low	29.7	Very low	146 Å²	146	145.1 Å²	145.1	76%	0.764	80%	0.795	S	S	*	*			cis	-141.9	176.9	11.5	-118.7	175.1	0	0	0	112.9
57	E	29	Very low	30.3	Very low	182 Å²	182	140.8 Å²	140.8	85%	0.85	79%	0.793	S	S	*	*			trans	-86.5	160.6	-171.3	-60.7	160.1	105.9	0	0	116.3
58	A	26.6	Very low	30.2	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	80%	0.796	S	S	*	*			trans	-158.8	152.5	146.8	0	0	0	0	0	111.3
59	E	25.1	Very low	30	Very low	192 Å²	192	140.7 Å²	140.7	90%	0.897	80%	0.802	S	S	*	*			trans	-92.1	165.3	-162.6	-71.1	178.3	89	0	0	118
60	A	26.8	Very low	29.8	Very low	83 Å²	83	139.1 Å²	139.1	69%	0.686	80%	0.801	S	S	*	*			trans	96.3	132.4	131.1	0	0	0	0	0	123.2
61	L	27.1	Very low	30.3	Very low	175 Å²	175	137.2 Å²	137.2	92%	0.916	80%	0.799	S	S	*	*			trans	77.1	131.4	146.2	-71.5	164.1	0	0	0	121.8
62	A	31.7	Very low	30.1	Very low	82 Å²	82	140.5 Å²	140.5	68%	0.678	80%	0.802	S	S	*	*			trans	-134.5	162.7	162.5	0	0	0	0	0	108.6
63	P	35.9	Very low	29.9	Very low	118 Å²	118	139 Å²	139	77%	0.766	80%	0.798	S	S	*	*			trans	-112	142.8	130.6	-7.5	27.3	0	0	0	109.4
64	E	27.7	Very low	29.4	Very low	197 Å²	197	137.2 Å²	137.2	92%	0.921	79%	0.788	S	S	*	*				57.4	125.9	72.6	-59	-148.2	137.5	0	0	114.1
65	G	25.8	Very low	29.4	Very low	77 Å²	77	140 Å²	140	79%	0.794	79%	0.788	S	S	*	*			cis	-164.2	-170.8	6.4	0	0	0	0	0	116.8
66	R	26.5	Very low	29.2	Very low	246 Å²	246	139.6 Å²	139.6	93%	0.928	79%	0.792	S	S	*	*			trans	-85	176	178.7	-78.3	-177.1	179.3	-175.6	1	110.5
67	P	41.8	Very low	29	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	79%	0.792	S	S	*	*			cis	-137.5	-156.8	26	42.5	-19.1	0	0	0	113.5
68	Y	27.4	Very low	29.1	Very low	218 Å²	218	135.3 Å²	135.3	86%	0.855	79%	0.789	S	S	*	*			cis	-153.1	-152.9	9.4	-138	-27.4	0	0	0	113.5
69	S	26.4	Very low	29.6	Very low	106 Å²	106	135.6 Å²	135.6	74%	0.741	78%	0.782	S	S	*	*			trans	-85.3	172.2	177.5	49.5	0	0	0	0	113.1
70	G	27.1	Very low	29.7	Very low	68 Å²	68	131.3 Å²	131.3	70%	0.701	77%	0.773	S	S	*	*			cis	-166.8	-163.1	22.8	0	0	0	0	0	116
71	P	43.4	Very low	29.7	Very low	121 Å²	121	131.5 Å²	131.5	79%	0.786	77%	0.769	S	S	*	*			trans	-124.6	-163.3	-146.8	42.8	-29.7	0	0	0	116.4
72	Q	26.6	Very low	29.7	Very low	178 Å²	178	130.7 Å²	130.7	83%	0.832	77%	0.765	S	S	*	*			trans	92.1	120	175	-66	179.5	-9.7	0	0	114.5
73	S	26.8	Very low	29.4	Very low	101 Å²	101	131 Å²	131	71%	0.706	76%	0.762	S	S	*	*				84.7	139.9	59.2	83	0	0	0	0	113.2
74	S	26.9	Very low	29	Very low	88 Å²	88	131.4 Å²	131.4	62%	0.615	76%	0.763	S	S	*	*			cis	-178.1	161.7	-7.5	45.8	0	0	0	0	111.8
75	Y	28.3	Very low	28.9	Very low	208 Å²	208	126.8 Å²	126.8	82%	0.816	76%	0.758	S	S	*	*			trans	72	142.4	159.4	-68.6	-67.9	0	0	0	121.8
76	T	26.6	Very low	28.8	Very low	134 Å²	134	126.2 Å²	126.2	82%	0.822	75%	0.752	S	S	*	*			trans	65.4	146.9	152.6	40	0	0	0	0	119.4
77	S	25.8	Very low	28.8	Very low	109 Å²	109	122.7 Å²	122.7	76%	0.762	75%	0.75	S	S	*	*			cis	-157.9	161.4	-2	40.4	0	0	0	0	112.6
78	V	31.3	Very low	27.9	Very low	129 Å²	129	127 Å²	127	78%	0.782	76%	0.758	S	S	*	*			trans	-67.9	154.3	168.6	-130.2	0	0	0	0	111.4
79	P	36.9	Very low	28.3	Very low	109 Å²	109	121.2 Å²	121.2	71%	0.708	75%	0.747	S	S	*	*				-124.9	155.7	85.2	4.6	18.7	0	0	0	112.6
80	S	26.3	Very low	28.2	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	75%	0.75	S	S	*	*				65	136.9	62	111.4	0	0	0	0	112.8
81	S	26.8	Very low	28.1	Very low	87 Å²	87	126.7 Å²	126.7	61%	0.608	75%	0.751	S	S	*	*			cis	-169.8	161.4	8	61.5	0	0	0	0	112.4
82	L	28.6	Very low	27.2	Very low	159 Å²	159	126.6 Å²	126.6	83%	0.832	75%	0.753	S	S	*	*			trans	65.3	156.6	148.2	-70	163.3	0	0	0	118
83	S	25	Very low	27.1	Very low	87 Å²	87	123.8 Å²	123.8	61%	0.608	75%	0.753	S	S	*	*			cis	-167.6	146.5	-18	-173.3	0	0	0	0	111.5
84	T	26.2	Very low	27	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	76%	0.761	S	S	*	*			trans	67	141.6	146.7	-64.1	0	0	0	0	121.3
85	A	26.6	Very low	26.9	Very low	100 Å²	100	125.9 Å²	125.9	83%	0.826	77%	0.768	S	S	*	*			trans	66.5	141.9	169.9	0	0	0	0	0	117.4
86	G	23.7	Very low	26.7	Very low	64 Å²	64	123.9 Å²	123.9	66%	0.66	77%	0.771	S	S	*	*			cis	149.7	168	-7.5	0	0	0	0	0	113.2
87	I	25.4	Very low	26.7	Very low	173 Å²	173	126.8 Å²	126.8	89%	0.887	77%	0.772	S	S	*	*			trans	77.9	130.9	172.4	-46.7	173.8	0	0	0	114.9
88	F	23.9	Very low	26.6	Very low	199 Å²	199	130.2 Å²	130.2	87%	0.873	78%	0.776	S	S	*	*			trans	-64.5	-166.1	168.1	-86.8	-98.3	0	0	0	111.5
89	P	36.6	Very low	26.2	Very low	95 Å²	95	128.4 Å²	128.4	62%	0.617	77%	0.769	S	S	*	*			cis	-139.2	-160.9	2.2	44	-24.4	0	0	0	114.5
90	K	23.6	Very low	25.7	Very low	184 Å²	184	131.9 Å²	131.9	80%	0.8	78%	0.776	S	S	*	*			trans	63.2	109.3	150.9	-72.1	172.3	-173.4	176.6	0	117.2
91	S	24.3	Very low	25.6	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	78%	0.783	S	S	*	*				71.4	116	64.8	79.9	0	0	0	0	115.3
92	S	23.9	Very low	25.4	Very low	119 Å²	119	140.2 Å²	140.2	83%	0.832	79%	0.794	S	S	*	*			trans	-160.6	146.6	130.6	51.4	0	0	0	0	110.3
93	S	25.5	Very low	25.2	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	79%	0.792	S	S	*	*			trans	-89.6	143.1	163.8	47.2	0	0	0	0	109.5
94	S	24.3	Very low	25	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	79%	0.793	S	S	*	*			trans	-157.4	157.9	151.7	59.1	0	0	0	0	110.1
95	S	26.1	Very low	24.9	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	80%	0.797	S	S	*	*			trans	-138.1	125.7	-171.6	55.8	0	0	0	0	110.8
96	L	23.7	Very low	24.7	Very low	167 Å²	167	145.7 Å²	145.7	87%	0.874	79%	0.788	S	S	*	*			trans	-152.1	134.4	159.2	-89.2	129	0	0	0	105.7
97	K	25.3	Very low	24.7	Very low	194 Å²	194	151.2 Å²	151.2	84%	0.843	80%	0.797	S	S	*	*			cis	68.8	92.6	39.1	-82.2	-156.6	169.6	-164.1	0	115.6
98	Q	24.2	Very low	24.7	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	79%	0.791	S	S	*	*			trans	-157.1	122.6	140.1	-96.1	165	-32	0	0	104
99	S	23.3	Very low	24.7	Very low	91 Å²	91	150.4 Å²	150.4	64%	0.636	79%	0.792	S	S	*	*				56.9	134.4	74	72.4	0	0	0	0	112.5
100	E	25.5	Very low	24.2	Very low	182 Å²	182	149.7 Å²	149.7	85%	0.85	79%	0.794	S	S	*	*			cis	-176.9	-159.6	-15.3	-120.8	166.3	141.4	0	0	103.3
101	E	24.5	Very low	24.2	Very low	186 Å²	186	146 Å²	146	87%	0.869	79%	0.792	S	S	*	*			trans	71.8	143.1	-176.9	-56.8	168.7	174.9	0	0	113
102	E	24.2	Very low	24.4	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.794	S	S	*	*			cis	-145.3	165.1	7.5	-141.5	173.9	178.3	0	0	111.3
103	L	22.9	Very low	24.4	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	78%	0.781	S	S	*	*			trans	-95.4	172.7	159.6	-58.7	97.2	0	0	0	108.1
104	D	21.4	Very low	24.3	Very low	118 Å²	118	150.5 Å²	150.5	63%	0.631	78%	0.777	S	S	*	*			cis	-156.5	-171.1	13	-159.2	-7	0	0	0	109.1
105	W	24.1	Very low	24.4	Very low	227 Å²	227	149.2 Å²	149.2	86%	0.86	76%	0.764	S	S	*	*			trans	133.6	151	137.4	-68.8	112.6	0	0	0	116.8
106	S	23.2	Very low	24.3	Very low	92 Å²	92	150.8 Å²	150.8	64%	0.643	77%	0.768	S	S	*	*			trans	-128.5	141.9	-165.1	56	0	0	0	0	112.4
107	Q	23.2	Very low	24.3	Very low	179 Å²	179	150.5 Å²	150.5	84%	0.836	76%	0.762	S	S	*	*			trans	179.9	143.3	144.4	-97	171.4	-42	0	0	106.8
108	E	24.4	Very low	24.3	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	76%	0.762	S	S	*	*			cis	100.7	148.5	29.2	-161.6	168	-128.1	0	0	113
109	E	25	Very low	24.3	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	76%	0.759	S	S	*	*			trans	65	161.9	-177.3	-57	-160.1	131.7	0	0	117.5
110	A	26.4	Very low	24.6	Very low	81 Å²	81	145.6 Å²	145.6	67%	0.669	76%	0.755	S	S	*	*			cis	-163.7	147.6	-38.4	0	0	0	0	0	108.1
111	S	23.6	Very low	24.7	Very low	107 Å²	107	145 Å²	145	75%	0.748	75%	0.753	S	S	*	*				166.8	134.1	97.6	42.9	0	0	0	0	108.2
112	H	26.6	Very low	24.8	Very low	168 Å²	168	143.2 Å²	143.2	78%	0.778	74%	0.744	S	S	*	*				73.4	141.5	68.8	-86.8	-128.3	0	0	0	115.1
113	L	26	Very low	24.9	Very low	107 Å²	107	138 Å²	138	56%	0.56	73%	0.732	S	S	*	*			cis	-166	150.3	-16	-155.5	69.8	0	0	0	108.4	V115	L113-V115 HydrophobicContact CD2-CG2 4.31Å; L113-V115 HydrophobicContact CG-CG2 4.29Å
114	H	23.3	Very low	25	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.745	73%	0.733	S	S	*	*				174.4	131.1	98.5	-97.1	-89.1	0	0	0	107.3
115	V	25.3	Very low	25.2	Very low	96 Å²	96	139.4 Å²	139.4	58%	0.582	74%	0.738	S	S	*	*				80.2	120.7	62.3	171	0	0	0	0	114.3	L113	L113-V115 HydrophobicContact CD2-CG2 4.31Å; L113-V115 HydrophobicContact CG-CG2 4.29Å
116	V	23.7	Very low	25.3	Very low	143 Å²	143	134 Å²	134	87%	0.867	74%	0.735	S	S	*	*			trans	-162	143.7	132.7	142.2	0	0	0	0	107.8
117	E	24.5	Very low	26.4	Very low	161 Å²	161	135.2 Å²	135.2	75%	0.752	74%	0.74	S	S	*	*			trans	-112.8	159.2	-173	-64.5	157.9	117.4	0	0	113.1
118	T	25.1	Very low	26.4	Very low	135 Å²	135	134 Å²	134	83%	0.828	74%	0.735	S	S	*	*			trans	174.1	123.7	138.6	23.3	0	0	0	0	107.4
119	D	25.2	Very low	26.4	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	73%	0.731	S	S	*	*				73.3	137.9	56	-79.2	-12.4	0	0	0	114.7
120	S	28	Very low	26.3	Very low	79 Å²	79	136 Å²	136	55%	0.552	73%	0.734	S	S	*	*			cis	-162.3	167.1	-5.4	57.1	0	0	0	0	113.1
121	E	27.2	Very low	26.1	Very low	171 Å²	171	143 Å²	143	80%	0.799	74%	0.743	S	S	*	*			trans	60.8	162.8	148.6	-69.8	158	149.2	0	0	120.2
122	E	27.6	Very low	26.1	Very low	147 Å²	147	144.5 Å²	144.5	69%	0.687	75%	0.747	S	S	*	*			cis	-164.4	172.3	-15.7	-105.4	-108	123.2	0	0	106.9	Y124	E122-Y124 WeakPolarHBondContact OE2-CE2 2.91Å
123	A	26.5	Very low	25.9	Very low	69 Å²	69	141 Å²	141	57%	0.57	74%	0.742	S	S	*	*			cis	-175.6	-157.2	-42.9	0	0	0	0	0	110.2
124	Y	25.8	Very low	26.1	Very low	211 Å²	211	140.3 Å²	140.3	83%	0.827	75%	0.746	S	S	*	*			trans	67.8	173.2	167.3	-72	-77.9	0	0	0	120.5	E122	E122-Y124 WeakPolarHBondContact OE2-CE2 2.91Å
125	A	24.7	Very low	26.2	Very low	89 Å²	89	140.8 Å²	140.8	74%	0.736	75%	0.754	S	S	*	*			trans	-142.6	175	-153.5	0	0	0	0	0	115.5
126	S	26	Very low	26.2	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	76%	0.757	S	S	*	*			trans	-12.5	154.5	164.2	-51.9	0	0	0	0	119.2
127	P	45.4	Very low	26.5	Very low	118 Å²	118	139.5 Å²	139.5	77%	0.766	75%	0.752	S	S	*	*			cis	-155.8	-167.6	41.7	34.2	-6.9	0	0	0	119.3
128	E	23.7	Very low	26.7	Very low	154 Å²	154	140 Å²	140	72%	0.72	75%	0.752	S	S	*	*			trans	93.9	117.5	149.4	-63.9	-142.7	114.7	0	0	126
129	Q	24.8	Very low	26.7	Very low	150 Å²	150	139.1 Å²	139.1	70%	0.701	74%	0.742	S	S	*	*			trans	47.7	113.9	130.1	-54.9	-161.9	45.9	0	0	124.6
130	R	23.9	Very low	27	Very low	248 Å²	248	138.7 Å²	138.7	94%	0.936	74%	0.739	S	S	*	*				-175.4	139.1	127	-95.3	155.1	-165.2	-171.9	5.8	107.8
131	R	21.7	Very low	27.1	Very low	226 Å²	226	142.8 Å²	142.8	85%	0.853	75%	0.75	S	S	*	*			cis	88.9	129.1	24.1	-140.7	-171.3	-146.3	-170.2	10.3	114.5
132	V	22.7	Very low	27	Very low	140 Å²	140	143.5 Å²	143.5	85%	0.848	75%	0.75	S	S	*	*			trans	88.8	142.6	167.6	-171.6	0	0	0	0	118
133	S	23.3	Very low	26.9	Very low	94 Å²	94	142.5 Å²	142.5	66%	0.657	75%	0.754	S	S	*	*			trans	-105.3	171.7	-152.3	54.3	0	0	0	0	116.4
134	S	28.9	Very low	26.8	Very low	93 Å²	93	144.2 Å²	144.2	65%	0.65	76%	0.762	S	S	*	*			trans	56.9	126.1	136.8	63.3	0	0	0	0	122.2
135	N	25.8	Very low	26.8	Very low	171 Å²	171	142.7 Å²	142.7	91%	0.914	77%	0.767	S	S	*	*			trans	-178.3	143.4	131.8	-86.5	-26	0	0	0	108.2
136	G	26.6	Very low	26.9	Very low	62 Å²	62	142.1 Å²	142.1	64%	0.639	77%	0.77	S	S	*	*			cis	160.1	161.9	-9.4	0	0	0	0	0	111.6
137	I	29	Very low	26.9	Very low	149 Å²	149	140.1 Å²	140.1	76%	0.764	77%	0.767	S	S	*	*			trans	69.1	134.8	159.3	-80.1	153.8	0	0	0	117.2
138	F	28.9	Very low	26	Very low	173 Å²	173	142.9 Å²	142.9	76%	0.759	78%	0.776	S	S	*	*			cis	-153.6	179.9	-8.3	-97.6	-37.2	0	0	0	106.4
139	D	24.6	Very low	26.1	Very low	116 Å²	116	139.9 Å²	139.9	62%	0.62	78%	0.778	S	S	*	*			cis	-153.2	175.5	2.9	-112.6	-8.4	0	0	0	107.1
140	L	31.8	Very low	27.7	Very low	140 Å²	140	138.5 Å²	138.5	73%	0.733	78%	0.781	S	S	*	*			cis	74.1	136.5	39.7	-65.5	177.1	0	0	0	115.6
141	Q	30.2	Very low	27.7	Very low	165 Å²	165	136.1 Å²	136.1	77%	0.771	78%	0.781	S	S	*	*			cis	-165.2	146.8	-9.4	-170.2	-174.9	49.8	0	0	113
142	K	25.8	Very low	28.1	Very low	185 Å²	185	133.9 Å²	133.9	80%	0.804	78%	0.78	S	S	*	*			trans	162	146.4	142.1	-99.3	-171.6	175.4	-177.9	0	112.2
143	T	24.6	Very low	28.9	Very low	126 Å²	126	132.2 Å²	132.2	77%	0.773	77%	0.772	S	S	*	*			cis	-151.2	173.6	-14.5	-15.1	0	0	0	0	109.3
144	S	24.2	Very low	28.9	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	77%	0.772	S	S	*	*			trans	-120.1	173.1	-170.6	54.7	0	0	0	0	115.6
145	L	26.6	Very low	28.7	Very low	179 Å²	179	137.2 Å²	137.2	94%	0.937	77%	0.772	S	S	*	*			trans	133.6	142.1	165.4	-75.3	159.8	0	0	0	110
146	G	25.4	Very low	28.5	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	77%	0.769	S	S	*	*			cis	134.1	128.7	-2.9	0	0	0	0	0	111.3
147	G	26.1	Very low	28.3	Very low	72 Å²	72	139.3 Å²	139.3	74%	0.742	78%	0.776	S	S	*	*			cis	-176.3	-169.5	-1.3	0	0	0	0	0	112.8
148	D	26.7	Very low	28.1	Very low	175 Å²	175	136.2 Å²	136.2	94%	0.936	78%	0.781	S	S	*	*			trans	61.6	178.7	169.3	-61.1	-31.3	0	0	0	120.7
149	A	26.7	Very low	28	Very low	92 Å²	92	132.7 Å²	132.7	76%	0.76	78%	0.778	S	S	*	*			trans	-158.2	-173.5	-174.9	0	0	0	0	0	108.8
150	P	57.2	Low	28.1	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	78%	0.783	S	S	*	*			cis	-119.4	168.6	-30.5	39.8	-27.8	0	0	0	112.3
151	E	24.7	Very low	27.9	Very low	198 Å²	198	132.2 Å²	132.2	93%	0.925	78%	0.784	S	S	*	*			trans	-165.1	149.5	158.7	-119.6	164.8	-149.2	0	0	115
152	E	30.4	Very low	27.9	Very low	180 Å²	180	130.1 Å²	130.1	84%	0.841	78%	0.777	S	S	*	*			trans	-110.1	152.5	154.6	-110.7	-172.4	-154.9	0	0	105.5
153	P	38.9	Very low	27.9	Very low	105 Å²	105	128.1 Å²	128.1	68%	0.682	78%	0.776	S	S	*	*				-165	-168.9	68.2	44.8	-22	0	0	0	118.7
154	E	23.5	Very low	28	Very low	138 Å²	138	126.2 Å²	126.2	65%	0.645	77%	0.772	S	S	*	*			trans	72.6	113.4	148.7	-60.6	-117.3	137.9	0	0	124.1
155	K	24.6	Very low	28	Very low	153 Å²	153	126.3 Å²	126.3	67%	0.665	77%	0.773	S	S	*	*				47	123.8	126.3	-54.4	176.9	-167.2	143.2	0	122.6
156	L	22.7	Very low	28	Very low	161 Å²	161	125.4 Å²	125.4	84%	0.843	77%	0.766	S	S	*	*				-165	121	102.1	-121.9	72.7	0	0	0	107.1
157	C	21.8	Very low	27.9	Very low	117 Å²	117	127.2 Å²	127.2	79%	0.791	76%	0.762	S	S	*	*				71.2	124.8	62	-145.3	0	0	0	0	114.2
158	G	24.8	Very low	27.8	Very low	83 Å²	83	128.4 Å²	128.4	86%	0.856	76%	0.759	S	S	*	*			trans	178.1	57.6	-171.5	0	0	0	0	0	112.5
159	S	27.6	Very low	27.6	Very low	100 Å²	100	127.9 Å²	127.9	70%	0.699	75%	0.751	S	S	*	*			trans	-141.5	121.5	-173.5	56.5	0	0	0	0	111.9
160	S	26.3	Very low	27.4	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	75%	0.752	S	S	*	*			trans	179.9	151.2	172.8	41.5	0	0	0	0	108.9
161	D	26.4	Very low	25.8	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	75%	0.75	S	S	*	*			cis	-168.5	162.2	-11.2	-93.2	-22.3	0	0	0	106.5
162	L	30.1	Very low	25.8	Very low	121 Å²	121	133.5 Å²	133.5	63%	0.634	74%	0.74	S	S	*	*			cis	-151.7	171.6	-9.4	-115.3	164.2	0	0	0	106.8
163	N	27.1	Very low	25.5	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	73%	0.733	S	S	*	*				-171.5	130.2	73.8	-71.4	-65.3	0	0	0	106.7
164	A	26.9	Very low	24.8	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	73%	0.734	S	S	*	*				61.5	131.2	82	0	0	0	0	0	114.4
165	S	23.3	Very low	24.8	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	74%	0.738	S	S	*	*			cis	-161.5	149.3	8	61	0	0	0	0	116
166	M	26	Very low	24.8	Very low	161 Å²	161	131.6 Å²	131.6	79%	0.793	74%	0.744	S	S	*	*			trans	57	133.6	135.4	-71.6	-75.1	104.6	0	0	125.3
167	T	23.3	Very low	25	Very low	114 Å²	114	132.4 Å²	132.4	70%	0.699	75%	0.749	S	S	*	*			trans	74.4	111.1	139.8	48.3	0	0	0	0	124.8
168	S	24.8	Very low	25.1	Very low	98 Å²	98	130.3 Å²	130.3	69%	0.685	75%	0.747	S	S	*	*				86.1	110.4	115.5	-62.9	0	0	0	0	124.4
169	Q	23.3	Very low	25.1	Very low	163 Å²	163	135.8 Å²	135.8	76%	0.762	75%	0.75	S	S	*	*			trans	80.4	122.6	130.7	-63.9	-170.8	18.1	0	0	123.5
170	R	22.6	Very low	24.9	Very low	209 Å²	209	135.2 Å²	135.2	79%	0.789	75%	0.751	S	S	*	*			trans	94	139.5	130.1	-104.8	177.7	176.7	170.6	-0.9	121.9
171	F	22.8	Very low	25	Very low	167 Å²	167	135.6 Å²	135.6	73%	0.732	75%	0.754	S	S	*	*			trans	60.2	160	171.4	-78.7	-101.9	0	0	0	117.3
172	E	24.8	Very low	25	Very low	152 Å²	152	137 Å²	137	71%	0.71	76%	0.762	S	S	*	*				-160.4	168	-50.8	-155.4	163.3	-137.7	0	0	108.7
173	E	24.5	Very low	24.7	Very low	151 Å²	151	134.1 Å²	134.1	71%	0.706	76%	0.761	S	S	*	*			trans	70.8	136.8	160	-67.6	-131.5	87.6	0	0	123.4
174	Q	24	Very low	24.9	Very low	148 Å²	148	135.2 Å²	135.2	69%	0.692	77%	0.766	S	S	*	*			trans	66.5	93.6	141.9	-66.4	178.4	38.5	0	0	123.7
175	S	23.8	Very low	25	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	76%	0.764	S	S	*	*				104.8	153.2	106.6	80.7	0	0	0	0	122.6
176	V	24.1	Very low	25.4	Very low	131 Å²	131	138.2 Å²	138.2	79%	0.794	77%	0.769	S	S	*	*			trans	70	95.5	164.1	-165.5	0	0	0	0	120.4
177	L	27.2	Very low	25.4	Very low	178 Å²	178	138.3 Å²	138.3	93%	0.932	77%	0.772	S	S	*	*			trans	51.4	113.3	132.5	-143.2	78.2	0	0	0	121.2
178	G	22.6	Very low	25.9	Very low	73 Å²	73	138.2 Å²	138.2	75%	0.753	78%	0.776	S	S	*	*			trans	-158.2	152.5	165.7	0	0	0	0	0	111.1
179	E	25.8	Very low	26.3	Very low	198 Å²	198	137.3 Å²	137.3	93%	0.925	77%	0.77	S	S	*	*			trans	-91.1	163.2	-158.5	-61.2	-178	118.2	0	0	117.7
180	A	24.2	Very low	27.4	Very low	88 Å²	88	133.4 Å²	133.4	73%	0.727	76%	0.759	S	S	*	*			trans	78.9	129.8	146.6	0	0	0	0	0	121.6
181	S	27.4	Very low	28.9	Very low	114 Å²	114	127.4 Å²	127.4	80%	0.797	74%	0.738	S	S	*	*			trans	33.4	128	153.6	54.2	0	0	0	0	119.6
182	D	25.6	Very low	30.8	Very low	170 Å²	170	121.4 Å²	121.4	91%	0.909	72%	0.72	S	S	*	*				-156.2	177.7	50	-148.3	-18.8	0	0	0	113.7
183	G	25.5	Very low	33.3	Very low	60 Å²	60	117.2 Å²	117.2	62%	0.619	70%	0.698	S	S	*	*			trans	112	31.7	162.6	0	0	0	0	0	118.2	S185	G183-S185 PolarHBondContact O-N 3.46Å
184	L	30	Very low	36.1	Very low	167 Å²	167	113.3 Å²	113.3	87%	0.874	68%	0.682	S	S	*	*			trans	-78.3	80.1	179.4	-164	75.8	0	0	0	113.5	L187	L184-L187 HydrophobicContact CD1-CD1 4.43Å
185	S	29.1	Very low	38.8	Very low	95 Å²	95	106.2 Å²	106.2	66%	0.664	65%	0.649	S	S	*	*			trans	-140.2	143.8	160.8	70.7	0	0	0	0	111.3	G183	G183-S185 PolarHBondContact O-N 3.46Å
186	N	31.3	Very low	41.6	Very low	159 Å²	159	102.1 Å²	102.1	85%	0.85	62%	0.619	S	S	*	*			trans	65.9	75.7	-175.8	-52.3	-49.2	0	0	0	116.4
187	L	26.6	Very low	44.6	Very low	163 Å²	163	95.9 Å²	95.9	85%	0.853	58%	0.581	S	S	*	*			trans	-109.5	134.4	151.9	-82.1	172.1	0	0	0	110.4	L184	L184-L187 HydrophobicContact CD1-CD1 4.43Å
188	S	33.3	Very low	47.5	Very low	112 Å²	112	89.1 Å²	89.1	78%	0.783	55%	0.545	S	S	*	.			trans	-72.2	163.1	177.7	-168.3	0	0	0	0	111.8
189	S	33.2	Very low	50.7	Low	80 Å²	80	85.7 Å²	85.7	56%	0.559	51%	0.509	S	S	*	.			trans	-64	123.5	-171.9	84.9	0	0	0	0	111.6	F191	S189-F191 VanDerWaalsContact C-N 3.33Å; S189-F191 PolarHBondContact O-N 1.98Å; S189-F191 VanDerWaalsContact O-N 3.1Å
190	P	47.6	Very low	53.8	Low	80 Å²	80	79 Å²	79	52%	0.519	48%	0.477	S	S	.	.	S	Bend	trans	-81	8.3	-158	28.5	-36.2	0	0	0	117	Q250	P190-Q250 WeakPolarHBondContact O-CG 3.37Å; P190-Q250 PolarHBondContact O-NE2 2.81Å
191	F	52.8	Low	57	Low	83 Å²	83	77 Å²	77	36%	0.364	45%	0.453	S	S	.	.			trans	-141.8	127.9	-177.7	-54.1	-75.3	0	0	0	111.7	S189 P248 Q250 K315	S189-F191 VanDerWaalsContact C-N 3.33Å; S189-F191 PolarHBondContact O-N 1.98Å; S189-F191 VanDerWaalsContact O-N 3.1Å; F191-P248 HydrophobicContact CB-CB 4.1Å; F191-P248 HydrophobicContact CD1-CB 3.78Å; F191-P248 HydrophobicContact CD1-CG 4.26Å; F191-P248 HydrophobicContact CD2-CB 4.22Å; F191-P248 HydrophobicContact CE1-CB 4.27Å; F191-P248 HydrophobicContact CE1-CG 4.24Å; F191-P248 HydrophobicContact CG-CB 3.77Å; F191-P248 HydrophobicContact CG-CG 4.5Å; F191-P248 HydrophobicContact CZ-CG 4.44Å; F191-Q250 HydrophobicContact CD1-CG 3.69Å; F191-Q250 HydrophobicContact CE1-CG 3.92Å; F191-K315 VanDerWaalsContact O-CD 3.25Å; F191-K315 WeakPolarHBondContact O-CD 3.26Å
192	A	62.9	Low	60.1	Low	42 Å²	42	71.6 Å²	71.6	35%	0.347	42%	0.415	S	S	.	.			trans	-105.3	-22.7	-175.3	0	0	0	0	0	113.7	I249 K315	A192-I249 PolarHBondContact N-O 3.48Å; A192-I249 VanDerWaalsContact N-O 3.09Å; A192-K315 VanDerWaalsContact O-CB 3.24Å; A192-K315 WeakPolarHBondContact O-CB 3.41Å; A192-K315 PolarHBondContact O-N 3.22Å
193	Y	77.3	Confident	63.2	Low	63 Å²	63	69.2 Å²	69.2	25%	0.247	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	158.7	-177.4	-55.2	-90	0	0	0	111.4	I249 L252 L283 V313 V314	Y193-I249 PolarHBondContact N-O 2.87Å; Y193-I249 PolarHBondContact O-N 3.35Å; Y193-L252 HydrophobicContact CD1-CD1 4.36Å; Y193-L252 HydrophobicContact CD1-CD2 3.92Å; Y193-L252 HydrophobicContact CD1-CG 4.45Å; Y193-L252 HydrophobicContact CD2-CD2 3.65Å; Y193-L252 HydrophobicContact CD2-CG 4.08Å; Y193-L252 HydrophobicContact CE1-CD1 3.82Å; Y193-L252 HydrophobicContact CE1-CD2 4.14Å; Y193-L252 HydrophobicContact CE1-CG 4.16Å; Y193-L252 HydrophobicContact CE2-CD1 4.27Å; Y193-L252 HydrophobicContact CE2-CD2 3.9Å; Y193-L252 HydrophobicContact CE2-CG 3.79Å; Y193-L252 HydrophobicContact CG-CD2 3.67Å; Y193-L252 HydrophobicContact CG-CG 4.42Å; Y193-L283 HydrophobicContact CD1-CD2 4.27Å; Y193-L283 HydrophobicContact CE1-CD2 4.27Å; Y193-V313 CarbonylContact C-O 3.52Å; Y193-V313 WeakPolarHBondContact CA-O 3.22Å; Y193-V314 HydrophobicContact CD1-CG2 4.17Å; Y193-V314 HydrophobicContact CE1-CG1 4.36Å; Y193-V314 HydrophobicContact CE1-CG2 4.02Å
194	L	83	Confident	66.2	Low	69 Å²	69	71 Å²	71	36%	0.361	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	108.3	179	-168.1	74.3	0	0	0	108.9	V246 P248 V313	L194-V246 HydrophobicContact CD1-CG1 3.55Å; L194-V246 HydrophobicContact CD2-CG1 3.89Å; L194-V246 HydrophobicContact CG-CG1 3.57Å; L194-P248 HydrophobicContact CD1-CB 4.49Å; L194-V313 PolarHBondContact N-O 3.23Å; L194-V313 PolarHBondContact O-N 3.21Å
195	L	81.4	Confident	69	Low	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119	178	-178.4	70.4	0	0	0	109.8	I197 V246 L247 I249 L256 L278 L281 L310 L312	L195-I197 HydrophobicContact CD2-CD1 4.03Å; L195-I197 HydrophobicContact CD2-CG1 3.81Å; L195-I197 HydrophobicContact CG-CG1 3.98Å; L195-V246 CarbonylContact O-C 3.55Å; L195-V246 WeakPolarHBondContact O-CA 3.48Å; L195-L247 PolarHBondContact N-O 2.66Å; L195-L247 PolarHBondContact O-N 2.96Å; L195-I249 HydrophobicContact CB-CD1 3.54Å; L195-I249 HydrophobicContact CB-CG1 4.17Å; L195-I249 HydrophobicContact CD2-CD1 3.77Å; L195-I249 HydrophobicContact CG-CD1 4.28Å; L195-L256 HydrophobicContact CD2-CD2 4.02Å; L195-L278 HydrophobicContact CD2-CD2 3.77Å; L195-L281 HydrophobicContact CD1-CD1 3.75Å; L195-L310 HydrophobicContact CD1-CB 4.35Å; L195-L310 HydrophobicContact CD1-CD2 4.28Å; L195-L310 HydrophobicContact CD2-CD2 4.4Å; L195-L312 HydrophobicContact CB-CD1 4.25Å; L195-L312 HydrophobicContact CD1-CB 4.18Å; L195-L312 HydrophobicContact CD1-CD1 4.2Å
196	T	83.7	Confident	71.8	Confident	19 Å²	19	59.3 Å²	59.3	12%	0.117	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.4	164	-53.1	0	0	0	0	108.5	I244 V246 L310 N311	T196-I244 HydrophobicContact CG2-CG2 3.72Å; T196-V246 HydrophobicContact CG2-CG2 4.22Å; T196-L310 WeakPolarHBondContact O-CA 3.08Å; T196-N311 PolarHBondContact N-O 3.01Å; T196-N311 PolarHBondContact O-N 2.52Å
197	I	86.1	Confident	74.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.8	171	-48.2	176.2	0	0	0	107.4	L195 F220 I244 V245 L247 L256 N309 L310	L195-I197 HydrophobicContact CD2-CD1 4.03Å; L195-I197 HydrophobicContact CD2-CG1 3.81Å; L195-I197 HydrophobicContact CG-CG1 3.98Å; I197-F220 HydrophobicContact CD1-CD1 3.82Å; I197-F220 HydrophobicContact CD1-CE1 4.03Å; I197-F220 HydrophobicContact CD1-CG 4.22Å; I197-F220 HydrophobicContact CG2-CE1 3.91Å; I197-F220 HydrophobicContact CG2-CZ 3.85Å; I197-I244 WeakPolarHBondContact O-CA 3.36Å; I197-V245 HydrophobicContact CB-CG1 3.77Å; I197-V245 HydrophobicContact CD1-CG1 4.26Å; I197-V245 HydrophobicContact CG1-CG1 4.32Å; I197-V245 PolarHBondContact N-O 3.18Å; I197-V245 PolarHBondContact O-N 2.85Å; I197-L247 HydrophobicContact CD1-CD1 3.68Å; I197-L247 HydrophobicContact CD1-CG 4.45Å; I197-L256 HydrophobicContact CD1-CD1 4.3Å; I197-L256 HydrophobicContact CD1-CD2 3.73Å; I197-N309 CarbonylContact C-O 3.59Å; I197-N309 WeakPolarHBondContact CA-O 3.35Å; I197-L310 HydrophobicContact CB-CD2 4.05Å; I197-L310 HydrophobicContact CD1-CD2 4.47Å; I197-L310 HydrophobicContact CG1-CD2 3.69Å; I197-L310 HydrophobicContact CG2-CD2 3.83Å
198	H	87.9	Confident	77	Confident	37 Å²	37	50 Å²	50	17%	0.171	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	100.9	168.4	-175.4	-141.1	0	0	0	108.9	K200 D242 E243 I244 L308 N309	H198-K200 PolarHBondContact O-N 3.39Å; H198-D242 IonicContact CE1-OD1 2.73Å; H198-D242 PolarHBondContact CE1-OD1 3.05Å; H198-D242 VanDerWaalsContact CE1-OD1 3.31Å; H198-D242 IonicContact NE2-OD1 2.91Å; H198-D242 PolarHBondContact NE2-OD1 3.06Å; H198-E243 CarbonylContact C-O 3.56Å; H198-E243 WeakPolarHBondContact CA-O 3.49Å; H198-I244 HydrophobicContact CB-CG1 4.36Å; H198-I244 WeakPolarHBondContact CD2-CG1 3.1Å; H198-L308 CarbonylContact O-C 3.57Å; H198-L308 WeakPolarHBondContact O-CA 3.41Å; H198-L308 WeakPolarHBondContact O-CB 3.1Å; H198-N309 HydrophobicContact CB-CB 4.1Å; H198-N309 PolarHBondContact N-O 2.85Å; H198-N309 PolarHBondContact O-N 2.89Å
199	L	90.4	Very high	79.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	102.4	174.3	176.3	63.3	0	0	0	108.4	V218 F220 W241 D242 E243 I306	L199-V218 HydrophobicContact CD1-CG2 4.16Å; L199-V218 HydrophobicContact CD2-CB 3.82Å; L199-V218 HydrophobicContact CD2-CG1 4.39Å; L199-V218 HydrophobicContact CD2-CG2 3.75Å; L199-F220 HydrophobicContact CB-CZ 4.34Å; L199-F220 HydrophobicContact CD1-CZ 4.43Å; L199-F220 HydrophobicContact CD2-CE2 4.3Å; L199-F220 HydrophobicContact CD2-CZ 4.48Å; L199-W241 HydrophobicContact CD1-CE3 3.68Å; L199-W241 HydrophobicContact CD1-CZ3 3.9Å; L199-W241 HydrophobicContact CD2-CB 4.1Å; L199-W241 HydrophobicContact CD2-CD2 3.82Å; L199-W241 HydrophobicContact CD2-CE3 3.79Å; L199-W241 HydrophobicContact CD2-CG 3.97Å; L199-W241 HydrophobicContact CD2-CZ3 4.45Å; L199-W241 HydrophobicContact CG-CB 4.12Å; L199-W241 HydrophobicContact CG-CD2 4.07Å; L199-W241 HydrophobicContact CG-CE3 3.61Å; L199-W241 HydrophobicContact CG-CG 4.31Å; L199-W241 HydrophobicContact CG-CZ3 4.31Å; L199-D242 WeakPolarHBondContact O-CA 3.33Å; L199-D242 PolarHBondContact O-N 3.1Å; L199-E243 HydrophobicContact CB-CB 4.47Å; L199-E243 PolarHBondContact N-O 2.86Å; L199-E243 PolarHBondContact O-N 3.2Å; L199-I306 HydrophobicContact CD1-CG2 3.45Å; L199-I306 VanDerWaalsContact CD1-CG2 3.45Å
200	K	89.8	Confident	80.6	Confident	58 Å²	58	54.7 Å²	54.7	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-70	178.8	-70.2	-177.9	174.6	-179	0	110.4	H198 V240 W241 D242 E288 V307 N309	H198-K200 PolarHBondContact O-N 3.39Å; K200-V240 CarbonylContact O-C 3.51Å; K200-W241 PolarHBondContact O-N 3.09Å; K200-D242 PolarHBondContact O-N 3.02Å; K200-D242 VanDerWaalsContact O-N 3.1Å; K200-E288 IonicContact NZ-OE1 3.18Å; K200-E288 PolarHBondContact NZ-OE1 2.81Å; K200-E288 IonicContact NZ-OE2 3.06Å; K200-V307 WeakPolarHBondContact CB-O 3Å; K200-V307 HydrophobicContact CD-CG1 4.09Å; K200-V307 PolarHBondContact N-O 2.76Å; K200-V307 VanDerWaalsContact N-O 3.14Å; K200-N309 WeakPolarHBondContact CE-OD1 3.2Å
201	E	91.6	Very high	81.3	Confident	45 Å²	45	55.2 Å²	55.2	21%	0.21	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	157.4	-164.1	61	-176.7	-157.9	0	0	112.8	R203 P239 V240 V307	E201-R203 IonicContact OE1-CZ 3.69Å; E201-R203 IonicContact OE1-NE 2.74Å; E201-R203 PolarHBondContact OE1-NE 2.87Å; E201-R203 IonicContact OE1-NH2 3.61Å; E201-R203 PolarHBondContact OE1-NH2 3.38Å; E201-P239 CarbonylContact C-O 3.46Å; E201-P239 WeakPolarHBondContact CA-O 3.08Å; E201-P239 WeakPolarHBondContact CB-O 3.22Å; E201-V240 HydrophobicContact CB-CB 4.45Å; E201-V240 HydrophobicContact CB-CG2 4.05Å; E201-V307 HydrophobicContact CG-CB 3.94Å; E201-V307 HydrophobicContact CG-CG2 4.07Å; E201-V307 PolarHBondContact N-O 3.16Å; E201-V307 PolarHBondContact O-N 3.27Å
202	G	92	Very high	82	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	151.2	162.8	0	0	0	0	0	110.1	N238 P239 W241 V305	G202-N238 CarbonylContact O-C 3.54Å; G202-N238 VanDerWaalsContact O-CA 3.27Å; G202-N238 WeakPolarHBondContact O-CA 2.75Å; G202-P239 PolarHBondContact N-O 3.14Å; G202-W241 VanDerWaalsContact N-CZ3 3.25Å; G202-V305 CarbonylContact C-O 3.45Å; G202-V305 WeakPolarHBondContact CA-O 3.43Å
203	R	91.8	Very high	82.7	Confident	120 Å²	120	53.3 Å²	53.3	45%	0.453	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.8	176.8	-62.1	-177.5	-177.8	177.2	1.4	109.9	E201 L205 N238 G304 V305	E201-R203 IonicContact OE1-CZ 3.69Å; E201-R203 IonicContact OE1-NE 2.74Å; E201-R203 PolarHBondContact OE1-NE 2.87Å; E201-R203 IonicContact OE1-NH2 3.61Å; E201-R203 PolarHBondContact OE1-NH2 3.38Å; R203-L205 PolarHBondContact O-N 2.86Å; R203-N238 WeakPolarHBondContact CA-OD1 3.37Å; R203-G304 WeakPolarHBondContact O-CA 3.32Å; R203-V305 PolarHBondContact N-O 3.05Å; R203-V305 PolarHBondContact O-N 3.31Å
204	N	88.6	Confident	83.1	Confident	97 Å²	97	50.3 Å²	50.3	52%	0.519	25%	0.251	S	S	.	.	S	Bend	trans	48.1	41.7	179	-158.8	51.4	0	0	0	113.9	L237 N238 D302 G304	N204-L237 PolarHBondContact N-O 2.84Å; N204-N238 PolarHBondContact N-OD1 2.86Å; N204-D302 PolarHBondContact ND2-OD2 2.86Å; N204-G304 WeakPolarHBondContact O-CA 3.19Å
205	L	89.1	Confident	83.4	Confident	3 Å²	3	48 Å²	48	2%	0.016	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-65.5	142.5	179.6	-61	-178.9	0	0	0	110.9	R203 P216 L237 P239 W241 V260 M271 L293	R203-L205 PolarHBondContact O-N 2.86Å; L205-P216 HydrophobicContact CD1-CB 3.64Å; L205-P216 HydrophobicContact CD1-CG 3.88Å; L205-L237 WeakPolarHBondContact CB-O 3.36Å; L205-L237 PolarHBondContact N-O 3.06Å; L205-P239 HydrophobicContact CD1-CG 3.55Å; L205-W241 HydrophobicContact CD1-CH2 4.21Å; L205-V260 HydrophobicContact CD1-CG1 4.36Å; L205-M271 HydrophobicContact CB-CE 4.21Å; L205-L293 HydrophobicContact CD2-CD1 3.57Å
206	V	86.7	Confident	83.8	Confident	13 Å²	13	48 Å²	48	8%	0.079	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-55.5	146.1	178.9	66.5	0	0	0	0	112.8	R208 M271 E300 M303	V206-R208 HydrophobicContact CG1-CG 4.37Å; V206-M271 HydrophobicContact CG1-CB 3.89Å; V206-M271 HydrophobicContact CG1-CE 4.31Å; V206-M271 HydrophobicContact CG1-CG 4.25Å; V206-M271 WeakPolarHBondContact O-CE 3.25Å; V206-E300 WeakPolarHBondContact CG2-OE1 3.26Å; V206-M303 HydrophobicContact CB-SD 4.5Å; V206-M303 HydrophobicContact CG1-CE 3.86Å; V206-M303 HydrophobicContact CG1-SD 4.41Å; V206-M303 PolarHBondContact N-O 2.84Å
207	V	84.6	Confident	84.2	Confident	60 Å²	60	47.5 Å²	47.5	36%	0.364	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-87.3	124	171.6	-180	0	0	0	0	109.2	D209 L237	V207-D209 WeakPolarHBondContact CG1-O 3.43Å; V207-L237 HydrophobicContact CG2-CD1 3.49Å; V207-L237 VanDerWaalsContact CG2-CD1 3.49Å; V207-L237 HydrophobicContact CG2-CD2 3.91Å; V207-L237 HydrophobicContact CG2-CG 4.34Å
208	R	82.6	Confident	84.5	Confident	66 Å²	66	47.5 Å²	47.5	25%	0.249	24%	0.235	C	C	.	.			trans	-114	-26.6	167.5	-63.1	-59.3	178.5	81.9	-6.4	113.4	V206 S214 D269 F270 S298 E300	V206-R208 HydrophobicContact CG1-CG 4.37Å; R208-S214 PolarHBondContact N-OG 3.4Å; R208-D269 HydrophobicContact CB-CB 4.29Å; R208-F270 PolarHBondContact NH1-O 2.87Å; R208-S298 PolarHBondContact NH2-OG 2.95Å; R208-E300 IonicContact CZ-OE2 3.1Å; R208-E300 IonicContact NE-OE1 3.92Å; R208-E300 IonicContact NE-OE2 2.72Å; R208-E300 PolarHBondContact NE-OE2 3.38Å; R208-E300 IonicContact NH2-OE2 3.15Å; R208-E300 PolarHBondContact NH2-OE2 3.05Å
209	D	78.4	Confident	84.6	Confident	45 Å²	45	47.5 Å²	47.5	24%	0.241	24%	0.235	C	C	.	.	S	Bend	trans	-75.9	140.5	178.4	-166.3	7.8	0	0	0	113.3	V207 C211 G212	V207-D209 WeakPolarHBondContact CG1-O 3.43Å; D209-C211 PolarHBondContact O-N 2.84Å; D209-C211 VanDerWaalsContact O-N 3.08Å; D209-G212 PolarHBondContact O-N 2.89Å; D209-G212 VanDerWaalsContact O-N 3.11Å
210	R	64.1	Low	84.5	Confident	247 Å²	247	47.4 Å²	47.4	93%	0.932	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.9	-176.9	-64.4	-175.6	-177.8	-175	1	113.7	G212	R210-G212 VanDerWaalsContact C-N 3.32Å
211	C	61.8	Low	84.3	Confident	90 Å²	90	47.5 Å²	47.5	61%	0.608	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	0.6	175.8	-72.5	0	0	0	0	114.4	D209 T213	D209-C211 PolarHBondContact O-N 2.84Å; D209-C211 VanDerWaalsContact O-N 3.08Å; C211-T213 VanDerWaalsContact C-N 3.31Å
212	G	69	Low	83.8	Confident	41 Å²	41	46.1 Å²	46.1	42%	0.423	23%	0.229	S	C	.	.	S	Bend	trans	82.8	4.5	178.9	0	0	0	0	0	114.7	D209 R210	D209-G212 PolarHBondContact O-N 2.89Å; D209-G212 VanDerWaalsContact O-N 3.11Å; R210-G212 VanDerWaalsContact C-N 3.32Å
213	T	77	Confident	82.9	Confident	44 Å²	44	51.4 Å²	51.4	27%	0.27	26%	0.257	S	S	.	.			trans	-145.8	121.2	-179.2	57.9	0	0	0	0	109.9	C211 K235	C211-T213 VanDerWaalsContact C-N 3.31Å; T213-K235 WeakPolarHBondContact OG1-CB 3.33Å
214	S	85.7	Confident	81.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.			trans	-86	164.6	177.8	-75.6	0	0	0	0	113.6	R208 P216 K235 N236 D262 M271	R208-S214 PolarHBondContact N-OG 3.4Å; S214-P216 WeakPolarHBondContact O-CD 3.24Å; S214-K235 CarbonylContact O-C 3.57Å; S214-K235 VanDerWaalsContact O-CA 3.24Å; S214-K235 WeakPolarHBondContact O-CA 3.37Å; S214-K235 PolarHBondContact O-N 3.12Å; S214-N236 PolarHBondContact O-N 2.95Å; S214-D262 WeakPolarHBondContact CB-OD2 3.46Å; S214-D262 PolarHBondContact OG-OD2 3.16Å; S214-M271 VanDerWaalsContact CB-CE 3.45Å
215	D	88.1	Confident	81	Confident	20 Å²	20	51.4 Å²	51.4	11%	0.107	27%	0.274	C	S	.	.			trans	-108.2	62.9	176.1	-68.7	-15.8	0	0	0	111.8	V232 I233 Y234 K235 D262 R263	D215-V232 HydrophobicContact CB-CG1 4.01Å; D215-I233 CarbonylContact C-O 3.57Å; D215-I233 WeakPolarHBondContact CA-O 3.17Å; D215-Y234 HydrophobicContact CB-CD1 4.27Å; D215-Y234 WeakPolarHBondContact OD1-CA 3.5Å; D215-Y234 VanDerWaalsContact OD2-CD1 3.26Å; D215-Y234 WeakPolarHBondContact OD2-CD1 3.41Å; D215-K235 PolarHBondContact OD1-N 2.64Å; D215-D262 WeakPolarHBondContact CA-OD1 3.39Å; D215-D262 PolarHBondContact N-OD1 3.36Å; D215-R263 HydrophobicContact CB-CB 3.8Å; D215-R263 WeakPolarHBondContact O-CB 3.28Å; D215-R263 PolarHBondContact O-N 3.03Å
216	P	90.6	Very high	80.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.292	C	S	.	.			trans	-67.5	144.8	-167.2	26.9	-38.1	0	0	0	115.6	L205 S214 I233 N236 P239 W241 V260 Y261 M271	L205-P216 HydrophobicContact CD1-CB 3.64Å; L205-P216 HydrophobicContact CD1-CG 3.88Å; S214-P216 WeakPolarHBondContact O-CD 3.24Å; P216-I233 VanDerWaalsContact CD-O 3.3Å; P216-I233 WeakPolarHBondContact CD-O 3.45Å; P216-I233 PolarHBondContact O-N 2.89Å; P216-N236 WeakPolarHBondContact CD-O 3.43Å; P216-N236 WeakPolarHBondContact CG-O 3.49Å; P216-P239 HydrophobicContact CB-CG 4.3Å; P216-P239 HydrophobicContact CG-CB 3.91Å; P216-P239 HydrophobicContact CG-CG 3.63Å; P216-W241 HydrophobicContact CB-CZ2 4.24Å; P216-V260 HydrophobicContact CB-CG1 4.18Å; P216-Y261 CarbonylContact C-O 3.58Å; P216-Y261 WeakPolarHBondContact CA-O 3.45Å; P216-M271 HydrophobicContact CB-CE 4.13Å; P216-M271 HydrophobicContact CB-SD 3.86Å
217	Y	92.1	Very high	80	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.035	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157.8	167.7	74.1	-81.7	0	0	0	113	K219 K229 K231 V232 V260 Y261 D262 R263 S268	Y217-K219 HydrophobicContact CD2-CG 4.46Å; Y217-K219 HydrophobicContact CE2-CD 4.26Å; Y217-K219 HydrophobicContact CE2-CG 4.04Å; Y217-K219 WeakPolarHBondContact OH-CE 3.49Å; Y217-K219 PolarHBondContact OH-NZ 2.87Å; Y217-K229 HydrophobicContact CD2-CD 3.93Å; Y217-K229 VanDerWaalsContact CD2-CE 3.43Å; Y217-K229 HydrophobicContact CD2-CG 3.77Å; Y217-K229 HydrophobicContact CE2-CD 3.62Å; Y217-K229 HydrophobicContact CE2-CG 3.89Å; Y217-K231 WeakPolarHBondContact CB-O 3.47Å; Y217-V232 HydrophobicContact CD1-CG2 3.91Å; Y217-V232 HydrophobicContact CG-CG2 3.97Å; Y217-V260 WeakPolarHBondContact O-CA 3.31Å; Y217-Y261 WeakPolarHBondContact CD1-O 3.43Å; Y217-Y261 PolarHBondContact N-O 3.5Å; Y217-Y261 PolarHBondContact O-N 3.15Å; Y217-D262 WeakPolarHBondContact CE1-O 3.39Å; Y217-R263 HydrophobicContact CD1-CB 4.15Å; Y217-R263 HydrophobicContact CE1-CB 4.17Å; Y217-S268 WeakPolarHBondContact CE1-OG 3.27Å; Y217-S268 WeakPolarHBondContact OH-CB 3.46Å; Y217-S268 PolarHBondContact OH-OG 2.82Å
218	V	91.9	Very high	79.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.5	-170.8	-173.5	0	0	0	0	111.5	L199 F220 K229 S230 W241 V258 K259 V260 I306	L199-V218 HydrophobicContact CD1-CG2 4.16Å; L199-V218 HydrophobicContact CD2-CB 3.82Å; L199-V218 HydrophobicContact CD2-CG1 4.39Å; L199-V218 HydrophobicContact CD2-CG2 3.75Å; V218-F220 HydrophobicContact CG1-CD2 4.36Å; V218-F220 HydrophobicContact CG1-CE1 4.49Å; V218-F220 HydrophobicContact CG1-CE2 3.92Å; V218-F220 HydrophobicContact CG1-CZ 3.98Å; V218-K229 CarbonylContact O-C 3.6Å; V218-K229 WeakPolarHBondContact O-CA 3.42Å; V218-S230 PolarHBondContact N-OG 2.91Å; V218-S230 PolarHBondContact O-N 2.74Å; V218-W241 HydrophobicContact CG2-CE3 4.35Å; V218-W241 HydrophobicContact CG2-CH2 3.47Å; V218-W241 VanDerWaalsContact CG2-CH2 3.47Å; V218-W241 HydrophobicContact CG2-CZ2 3.67Å; V218-W241 HydrophobicContact CG2-CZ3 3.84Å; V218-V258 HydrophobicContact CG1-CG1 3.39Å; V218-K259 CarbonylContact C-O 3.57Å; V218-K259 WeakPolarHBondContact CA-O 3.38Å; V218-V260 HydrophobicContact CG2-CG2 4.38Å; V218-I306 HydrophobicContact CG1-CD1 4.37Å; V218-I306 HydrophobicContact CG2-CD1 4.35Å
219	K	90.9	Very high	80	Confident	37 Å²	37	58.9 Å²	58.9	16%	0.161	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.6	169.8	-60	176.8	-160.5	148.3	0	109.7	Y217 T226 Y228 K259 Y261	Y217-K219 HydrophobicContact CD2-CG 4.46Å; Y217-K219 HydrophobicContact CE2-CD 4.26Å; Y217-K219 HydrophobicContact CE2-CG 4.04Å; Y217-K219 WeakPolarHBondContact OH-CE 3.49Å; Y217-K219 PolarHBondContact OH-NZ 2.87Å; K219-T226 HydrophobicContact CB-CG2 4.19Å; K219-Y228 WeakPolarHBondContact CA-O 3.35Å; K219-K259 PolarHBondContact N-O 3.5Å; K219-K259 PolarHBondContact O-N 2.93Å; K219-Y261 HydrophobicContact CB-CE2 4.36Å; K219-Y261 HydrophobicContact CD-CD2 3.6Å; K219-Y261 HydrophobicContact CD-CE2 3.48Å; K219-Y261 VanDerWaalsContact CD-CE2 3.48Å; K219-Y261 HydrophobicContact CD-CG 4.5Å; K219-Y261 HydrophobicContact CG-CD2 3.98Å; K219-Y261 HydrophobicContact CG-CE2 4.13Å; K219-Y261 VanDerWaalsContact NZ-CE2 3.33Å
220	F	88.8	Confident	80.4	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.8	172	-65.1	-85.1	0	0	0	110.1	I197 L199 V218 L227 Y228 L256 V258 L308	I197-F220 HydrophobicContact CD1-CD1 3.82Å; I197-F220 HydrophobicContact CD1-CE1 4.03Å; I197-F220 HydrophobicContact CD1-CG 4.22Å; I197-F220 HydrophobicContact CG2-CE1 3.91Å; I197-F220 HydrophobicContact CG2-CZ 3.85Å; L199-F220 HydrophobicContact CB-CZ 4.34Å; L199-F220 HydrophobicContact CD1-CZ 4.43Å; L199-F220 HydrophobicContact CD2-CE2 4.3Å; L199-F220 HydrophobicContact CD2-CZ 4.48Å; V218-F220 HydrophobicContact CG1-CD2 4.36Å; V218-F220 HydrophobicContact CG1-CE1 4.49Å; V218-F220 HydrophobicContact CG1-CE2 3.92Å; V218-F220 HydrophobicContact CG1-CZ 3.98Å; F220-L227 PolarHBondContact O-N 2.81Å; F220-Y228 AromaticContact CD2-CD1 3.94Å; F220-Y228 HydrophobicContact CD2-CD1 3.94Å; F220-Y228 HydrophobicContact CE2-CD1 4.24Å; F220-Y228 PolarHBondContact N-O 2.99Å; F220-Y228 PolarHBondContact O-N 2.79Å; F220-L256 HydrophobicContact CB-CD1 4.31Å; F220-L256 HydrophobicContact CD1-CD1 4.26Å; F220-L256 HydrophobicContact CD1-CD2 4.35Å; F220-L256 HydrophobicContact CD1-CG 4.47Å; F220-V258 HydrophobicContact CD1-CG1 4.19Å; F220-V258 HydrophobicContact CD1-CG2 3.95Å; F220-V258 HydrophobicContact CE1-CB 4.44Å; F220-V258 HydrophobicContact CE1-CG1 3.83Å; F220-V258 HydrophobicContact CE1-CG2 3.83Å; F220-V258 HydrophobicContact CZ-CG1 4.36Å; F220-L308 HydrophobicContact CE1-CD2 4.08Å; F220-L308 HydrophobicContact CZ-CD2 4.38Å
221	K	84.4	Confident	81.3	Confident	59 Å²	59	51.5 Å²	51.5	26%	0.257	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.4	178.8	-56.9	-157.3	173	-156.1	0	112.1	K225 T226 R257	K221-K225 CarbonylContact C-O 3.55Å; K221-K225 WeakPolarHBondContact CA-O 3.49Å; K221-T226 VanDerWaalsContact CE-OG1 3.25Å; K221-T226 WeakPolarHBondContact CE-OG1 3.36Å; K221-T226 HydrophobicContact CG-CG2 4.38Å; K221-R257 HydrophobicContact CB-CB 4.46Å; K221-R257 PolarHBondContact N-O 2.84Å; K221-R257 PolarHBondContact O-N 3.14Å
222	L	81.7	Confident	82.6	Confident	17 Å²	17	48.6 Å²	48.6	9%	0.089	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.3	175.5	-164.3	78.8	0	0	0	107.5	G224 K225 L227 Q254 L278	L222-G224 PolarHBondContact O-N 2.96Å; L222-G224 VanDerWaalsContact O-N 3.14Å; L222-K225 PolarHBondContact N-O 2.84Å; L222-K225 PolarHBondContact O-N 2.91Å; L222-K225 VanDerWaalsContact O-O 3.14Å; L222-L227 HydrophobicContact CB-CD1 3.53Å; L222-L227 HydrophobicContact CB-CG 4.11Å; L222-L227 HydrophobicContact CD2-CD1 3.88Å; L222-L227 HydrophobicContact CG-CD1 4.35Å; L222-Q254 HydrophobicContact CD1-CB 4.12Å; L222-L278 HydrophobicContact CD1-CD1 3.89Å
223	N	72.9	Confident	83.3	Confident	111 Å²	111	48.5 Å²	48.5	59%	0.594	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	42.9	-176.7	-57.1	-10.7	0	0	0	113.3	K225 Q254	N223-K225 PolarHBondContact O-N 3.43Å; N223-Q254 PolarHBondContact ND2-OE1 2.8Å; N223-Q254 PolarHBondContact OD1-OE1 2.83Å
224	G	68.2	Low	83.7	Confident	65 Å²	65	54.1 Å²	54.1	67%	0.67	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	-29.7	-177.3	0	0	0	0	0	115.5	L222	L222-G224 PolarHBondContact O-N 2.96Å; L222-G224 VanDerWaalsContact O-N 3.14Å
225	K	72.5	Confident	83.5	Confident	153 Å²	153	60 Å²	60	67%	0.665	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	136.2	178.3	-169.7	173.1	-177.3	176.7	0	111.2	K221 L222 N223 L227	K221-K225 CarbonylContact C-O 3.55Å; K221-K225 WeakPolarHBondContact CA-O 3.49Å; L222-K225 PolarHBondContact N-O 2.84Å; L222-K225 PolarHBondContact O-N 2.91Å; L222-K225 VanDerWaalsContact O-O 3.14Å; N223-K225 PolarHBondContact O-N 3.43Å; K225-L227 HydrophobicContact CD-CD2 4.47Å; K225-L227 HydrophobicContact CG-CD2 4.41Å
226	T	80	Confident	83.4	Confident	63 Å²	63	61.9 Å²	61.9	39%	0.387	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.6	170.1	-43.1	0	0	0	0	109.2	K219 K221	K219-T226 HydrophobicContact CB-CG2 4.19Å; K221-T226 VanDerWaalsContact CE-OG1 3.25Å; K221-T226 WeakPolarHBondContact CE-OG1 3.36Å; K221-T226 HydrophobicContact CG-CG2 4.38Å
227	L	75.4	Confident	83.1	Confident	66 Å²	66	63.7 Å²	63.7	35%	0.346	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-29.2	179.8	-62.6	-173.4	0	0	0	113.2	F220 L222 K225 L247	F220-L227 PolarHBondContact O-N 2.81Å; L222-L227 HydrophobicContact CB-CD1 3.53Å; L222-L227 HydrophobicContact CB-CG 4.11Å; L222-L227 HydrophobicContact CD2-CD1 3.88Å; L222-L227 HydrophobicContact CG-CD1 4.35Å; K225-L227 HydrophobicContact CD-CD2 4.47Å; K225-L227 HydrophobicContact CG-CD2 4.41Å; L227-L247 HydrophobicContact CB-CD1 4.29Å; L227-L247 HydrophobicContact CB-CD2 4Å; L227-L247 HydrophobicContact CD1-CD1 4.06Å; L227-L247 HydrophobicContact CD1-CD2 4.4Å
228	Y	80.8	Confident	82.9	Confident	71 Å²	71	67.2 Å²	67.2	28%	0.278	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	152.6	178.8	-170	-105.8	0	0	0	111.7	K219 F220 E243 V245	K219-Y228 WeakPolarHBondContact CA-O 3.35Å; F220-Y228 AromaticContact CD2-CD1 3.94Å; F220-Y228 HydrophobicContact CD2-CD1 3.94Å; F220-Y228 HydrophobicContact CE2-CD1 4.24Å; F220-Y228 PolarHBondContact N-O 2.99Å; F220-Y228 PolarHBondContact O-N 2.79Å; Y228-E243 PolarHBondContact OH-OE2 2.9Å; Y228-V245 HydrophobicContact CD1-CB 4.25Å; Y228-V245 HydrophobicContact CD1-CG1 4.16Å; Y228-V245 HydrophobicContact CD1-CG2 4.36Å; Y228-V245 HydrophobicContact CD2-CB 4.15Å; Y228-V245 HydrophobicContact CD2-CG2 3.56Å; Y228-V245 HydrophobicContact CE1-CB 4.3Å; Y228-V245 HydrophobicContact CE1-CG1 4.48Å; Y228-V245 HydrophobicContact CE2-CB 4.21Å; Y228-V245 HydrophobicContact CE2-CG2 3.98Å; Y228-V245 HydrophobicContact CG-CB 4.16Å; Y228-V245 HydrophobicContact CG-CG1 4.3Å; Y228-V245 HydrophobicContact CG-CG2 3.77Å
229	K	85.9	Confident	82.8	Confident	98 Å²	98	67.2 Å²	67.2	43%	0.426	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.6	170.1	168.3	179.4	165.9	168.9	0	107.5	Y217 V218	Y217-K229 HydrophobicContact CD2-CD 3.93Å; Y217-K229 VanDerWaalsContact CD2-CE 3.43Å; Y217-K229 HydrophobicContact CD2-CG 3.77Å; Y217-K229 HydrophobicContact CE2-CD 3.62Å; Y217-K229 HydrophobicContact CE2-CG 3.89Å; V218-K229 CarbonylContact O-C 3.6Å; V218-K229 WeakPolarHBondContact O-CA 3.42Å
230	S	86.1	Confident	82.8	Confident	5 Å²	5	69.6 Å²	69.6	4%	0.035	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-73.4	171.8	176.4	72.4	0	0	0	0	112.8	V218 E243	V218-S230 PolarHBondContact N-OG 2.91Å; V218-S230 PolarHBondContact O-N 2.74Å; S230-E243 WeakPolarHBondContact CA-OE2 3.32Å; S230-E243 WeakPolarHBondContact CB-OE2 3.49Å
231	K	84.4	Confident	82.6	Confident	133 Å²	133	70.2 Å²	70.2	58%	0.578	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-57.8	156.6	158.3	-71.4	169.9	-139.6	121.7	0	111.7	Y217 W241 E243	Y217-K231 WeakPolarHBondContact CB-O 3.47Å; K231-W241 PolarHBondContact O-NE1 3.08Å; K231-E243 VanDerWaalsContact CB-OE1 3.28Å; K231-E243 WeakPolarHBondContact CB-OE1 3.41Å; K231-E243 WeakPolarHBondContact CD-OE1 3.45Å; K231-E243 WeakPolarHBondContact CE-OE1 3.38Å; K231-E243 WeakPolarHBondContact CG-OE1 3.43Å; K231-E243 PolarHBondContact N-OE1 2.82Å; K231-E243 PolarHBondContact N-OE2 3.23Å; K231-E243 IonicContact NZ-OE1 3.98Å; K231-E243 PolarHBondContact NZ-OE1 2.94Å
232	V	88.6	Confident	82.8	Confident	29 Å²	29	72.8 Å²	72.8	18%	0.176	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-88.7	135.6	168	175.1	0	0	0	0	107.8	D215 Y217 Y234 R263	D215-V232 HydrophobicContact CB-CG1 4.01Å; Y217-V232 HydrophobicContact CD1-CG2 3.91Å; Y217-V232 HydrophobicContact CG-CG2 3.97Å; V232-Y234 HydrophobicContact CG1-CD1 4.27Å; V232-Y234 HydrophobicContact CG1-CE1 3.94Å; V232-Y234 HydrophobicContact CG1-CE2 4.23Å; V232-R263 HydrophobicContact CB-CB 4.5Å; V232-R263 HydrophobicContact CB-CG 4.41Å; V232-R263 HydrophobicContact CG1-CB 3.62Å; V232-R263 HydrophobicContact CG1-CG 3.81Å; V232-R263 HydrophobicContact CG2-CB 4.03Å; V232-R263 HydrophobicContact CG2-CG 3.79Å
233	I	83.8	Confident	82.5	Confident	39 Å²	39	72.5 Å²	72.5	20%	0.2	37%	0.368	C	S	.	.			trans	-115.8	116.6	173	-66.8	-177.9	0	0	0	107.4	D215 P216 N236 P239 V240 W241	D215-I233 CarbonylContact C-O 3.57Å; D215-I233 WeakPolarHBondContact CA-O 3.17Å; P216-I233 VanDerWaalsContact CD-O 3.3Å; P216-I233 WeakPolarHBondContact CD-O 3.45Å; P216-I233 PolarHBondContact O-N 2.89Å; I233-N236 HydrophobicContact CG2-CB 4.07Å; I233-P239 HydrophobicContact CB-CB 3.89Å; I233-P239 HydrophobicContact CD1-CB 3.92Å; I233-P239 HydrophobicContact CG1-CB 4.41Å; I233-P239 HydrophobicContact CG2-CB 3.96Å; I233-V240 VanDerWaalsContact CD1-C 3.42Å; I233-V240 WeakPolarHBondContact CD1-O 3.07Å; I233-W241 HydrophobicContact CD1-CB 4.43Å; I233-W241 VanDerWaalsContact CD1-CD1 3.42Å; I233-W241 HydrophobicContact CD1-CD2 4.47Å; I233-W241 HydrophobicContact CD1-CG 3.87Å
234	Y	84.8	Confident	83.1	Confident	161 Å²	161	71.4 Å²	71.4	63%	0.631	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	137.6	-170.8	-63.1	-85.1	0	0	0	112.2	D215 V232 N236	D215-Y234 HydrophobicContact CB-CD1 4.27Å; D215-Y234 WeakPolarHBondContact OD1-CA 3.5Å; D215-Y234 VanDerWaalsContact OD2-CD1 3.26Å; D215-Y234 WeakPolarHBondContact OD2-CD1 3.41Å; V232-Y234 HydrophobicContact CG1-CD1 4.27Å; V232-Y234 HydrophobicContact CG1-CE1 3.94Å; V232-Y234 HydrophobicContact CG1-CE2 4.23Å; Y234-N236 PolarHBondContact O-N 3.23Å
235	K	82.3	Confident	83.6	Confident	125 Å²	125	69 Å²	69	54%	0.543	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	45.4	169.8	-57.4	-165	176.7	-166.7	0	114.7	T213 S214 D215	T213-K235 WeakPolarHBondContact OG1-CB 3.33Å; S214-K235 CarbonylContact O-C 3.57Å; S214-K235 VanDerWaalsContact O-CA 3.24Å; S214-K235 WeakPolarHBondContact O-CA 3.37Å; S214-K235 PolarHBondContact O-N 3.12Å; D215-K235 PolarHBondContact OD1-N 2.64Å
236	N	84.8	Confident	84	Confident	59 Å²	59	65.3 Å²	65.3	32%	0.316	32%	0.323	S	S	.	.			trans	-146.2	116.1	-176.8	-174.7	7.8	0	0	0	112.8	S214 P216 I233 Y234 N238	S214-N236 PolarHBondContact O-N 2.95Å; P216-N236 WeakPolarHBondContact CD-O 3.43Å; P216-N236 WeakPolarHBondContact CG-O 3.49Å; I233-N236 HydrophobicContact CG2-CB 4.07Å; Y234-N236 PolarHBondContact O-N 3.23Å; N236-N238 VanDerWaalsContact C-N 3.29Å; N236-N238 PolarHBondContact ND2-O 2.83Å; N236-N238 PolarHBondContact O-N 2.97Å; N236-N238 VanDerWaalsContact OD1-C 3.32Å; N236-N238 WeakPolarHBondContact OD1-CA 3.19Å; N236-N238 PolarHBondContact OD1-N 3.03Å; N236-N238 PolarHBondContact OD1-O 3.01Å
237	L	84.6	Confident	83.8	Confident	37 Å²	37	63 Å²	63	19%	0.194	31%	0.308	C	S	.	.	S	Bend	trans	-79.9	-8.2	177	-50.3	179.2	0	0	0	113.6	N204 L205 V207 P239	N204-L237 PolarHBondContact N-O 2.84Å; L205-L237 WeakPolarHBondContact CB-O 3.36Å; L205-L237 PolarHBondContact N-O 3.06Å; V207-L237 HydrophobicContact CG2-CD1 3.49Å; V207-L237 VanDerWaalsContact CG2-CD1 3.49Å; V207-L237 HydrophobicContact CG2-CD2 3.91Å; V207-L237 HydrophobicContact CG2-CG 4.34Å; L237-P239 WeakPolarHBondContact O-CD 3.42Å
238	N	88.7	Confident	83.9	Confident	83 Å²	83	62.7 Å²	62.7	44%	0.444	31%	0.31	S	S	.	.	S	Bend	trans	-122.9	64.2	172.4	-59.9	-82.1	0	0	0	109.9	G202 R203 N204 N236	G202-N238 CarbonylContact O-C 3.54Å; G202-N238 VanDerWaalsContact O-CA 3.27Å; G202-N238 WeakPolarHBondContact O-CA 2.75Å; R203-N238 WeakPolarHBondContact CA-OD1 3.37Å; N204-N238 PolarHBondContact N-OD1 2.86Å; N236-N238 VanDerWaalsContact C-N 3.29Å; N236-N238 PolarHBondContact ND2-O 2.83Å; N236-N238 PolarHBondContact O-N 2.97Å; N236-N238 VanDerWaalsContact OD1-C 3.32Å; N236-N238 WeakPolarHBondContact OD1-CA 3.19Å; N236-N238 PolarHBondContact OD1-N 3.03Å; N236-N238 PolarHBondContact OD1-O 3.01Å
239	P	89.5	Confident	83.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.297	C	S	.	.			trans	-71.9	135	-174.3	31.8	-38.3	0	0	0	111.7	E201 G202 L205 P216 I233 L237 W241	E201-P239 CarbonylContact C-O 3.46Å; E201-P239 WeakPolarHBondContact CA-O 3.08Å; E201-P239 WeakPolarHBondContact CB-O 3.22Å; G202-P239 PolarHBondContact N-O 3.14Å; L205-P239 HydrophobicContact CD1-CG 3.55Å; P216-P239 HydrophobicContact CB-CG 4.3Å; P216-P239 HydrophobicContact CG-CB 3.91Å; P216-P239 HydrophobicContact CG-CG 3.63Å; I233-P239 HydrophobicContact CB-CB 3.89Å; I233-P239 HydrophobicContact CD1-CB 3.92Å; I233-P239 HydrophobicContact CG1-CB 4.41Å; I233-P239 HydrophobicContact CG2-CB 3.96Å; L237-P239 WeakPolarHBondContact O-CD 3.42Å; P239-W241 HydrophobicContact CB-CD2 4.42Å; P239-W241 HydrophobicContact CB-CH2 4.25Å; P239-W241 HydrophobicContact CB-CZ2 3.87Å; P239-W241 HydrophobicContact CG-CE3 4.44Å; P239-W241 HydrophobicContact CG-CH2 3.42Å; P239-W241 VanDerWaalsContact CG-CH2 3.42Å; P239-W241 HydrophobicContact CG-CZ2 3.46Å; P239-W241 VanDerWaalsContact CG-CZ2 3.46Å; P239-W241 HydrophobicContact CG-CZ3 3.94Å
240	V	90.8	Very high	82.9	Confident	88 Å²	88	59.6 Å²	59.6	53%	0.533	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	106.6	173	-176.8	0	0	0	0	108.9	K200 E201 I233	K200-V240 CarbonylContact O-C 3.51Å; E201-V240 HydrophobicContact CB-CB 4.45Å; E201-V240 HydrophobicContact CB-CG2 4.05Å; I233-V240 VanDerWaalsContact CD1-C 3.42Å; I233-V240 WeakPolarHBondContact CD1-O 3.07Å
241	W	85.3	Confident	82.2	Confident	12 Å²	12	60.9 Å²	60.9	5%	0.045	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-40.8	-176.4	-65.1	-75.2	0	0	0	113	L199 K200 G202 L205 P216 V218 K231 I233 P239 E243	L199-W241 HydrophobicContact CD1-CE3 3.68Å; L199-W241 HydrophobicContact CD1-CZ3 3.9Å; L199-W241 HydrophobicContact CD2-CB 4.1Å; L199-W241 HydrophobicContact CD2-CD2 3.82Å; L199-W241 HydrophobicContact CD2-CE3 3.79Å; L199-W241 HydrophobicContact CD2-CG 3.97Å; L199-W241 HydrophobicContact CD2-CZ3 4.45Å; L199-W241 HydrophobicContact CG-CB 4.12Å; L199-W241 HydrophobicContact CG-CD2 4.07Å; L199-W241 HydrophobicContact CG-CE3 3.61Å; L199-W241 HydrophobicContact CG-CG 4.31Å; L199-W241 HydrophobicContact CG-CZ3 4.31Å; K200-W241 PolarHBondContact O-N 3.09Å; G202-W241 VanDerWaalsContact N-CZ3 3.25Å; L205-W241 HydrophobicContact CD1-CH2 4.21Å; P216-W241 HydrophobicContact CB-CZ2 4.24Å; V218-W241 HydrophobicContact CG2-CE3 4.35Å; V218-W241 HydrophobicContact CG2-CH2 3.47Å; V218-W241 VanDerWaalsContact CG2-CH2 3.47Å; V218-W241 HydrophobicContact CG2-CZ2 3.67Å; V218-W241 HydrophobicContact CG2-CZ3 3.84Å; K231-W241 PolarHBondContact O-NE1 3.08Å; I233-W241 HydrophobicContact CD1-CB 4.43Å; I233-W241 VanDerWaalsContact CD1-CD1 3.42Å; I233-W241 HydrophobicContact CD1-CD2 4.47Å; I233-W241 HydrophobicContact CD1-CG 3.87Å; P239-W241 HydrophobicContact CB-CD2 4.42Å; P239-W241 HydrophobicContact CB-CH2 4.25Å; P239-W241 HydrophobicContact CB-CZ2 3.87Å; P239-W241 HydrophobicContact CG-CE3 4.44Å; P239-W241 HydrophobicContact CG-CH2 3.42Å; P239-W241 VanDerWaalsContact CG-CH2 3.42Å; P239-W241 HydrophobicContact CG-CZ2 3.46Å; P239-W241 VanDerWaalsContact CG-CZ2 3.46Å; P239-W241 HydrophobicContact CG-CZ3 3.94Å; W241-E243 VanDerWaalsContact C-N 3.31Å; W241-E243 HydrophobicContact CB-CG 4.25Å; W241-E243 PolarHBondContact O-N 2.86Å
242	D	87.1	Confident	81.7	Confident	114 Å²	114	56 Å²	56	61%	0.61	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.5	47.3	-174.2	-153.1	58.7	0	0	0	113.1	H198 L199 K200	H198-D242 IonicContact CE1-OD1 2.73Å; H198-D242 PolarHBondContact CE1-OD1 3.05Å; H198-D242 VanDerWaalsContact CE1-OD1 3.31Å; H198-D242 IonicContact NE2-OD1 2.91Å; H198-D242 PolarHBondContact NE2-OD1 3.06Å; L199-D242 WeakPolarHBondContact O-CA 3.33Å; L199-D242 PolarHBondContact O-N 3.1Å; K200-D242 PolarHBondContact O-N 3.02Å; K200-D242 VanDerWaalsContact O-N 3.1Å
243	E	76.6	Confident	80.9	Confident	10 Å²	10	60.3 Å²	60.3	5%	0.047	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121	-173.5	-75.9	-176.4	176.9	0	0	113	H198 L199 Y228 S230 K231 W241	H198-E243 CarbonylContact C-O 3.56Å; H198-E243 WeakPolarHBondContact CA-O 3.49Å; L199-E243 HydrophobicContact CB-CB 4.47Å; L199-E243 PolarHBondContact N-O 2.86Å; L199-E243 PolarHBondContact O-N 3.2Å; Y228-E243 PolarHBondContact OH-OE2 2.9Å; S230-E243 WeakPolarHBondContact CA-OE2 3.32Å; S230-E243 WeakPolarHBondContact CB-OE2 3.49Å; K231-E243 VanDerWaalsContact CB-OE1 3.28Å; K231-E243 WeakPolarHBondContact CB-OE1 3.41Å; K231-E243 WeakPolarHBondContact CD-OE1 3.45Å; K231-E243 WeakPolarHBondContact CE-OE1 3.38Å; K231-E243 WeakPolarHBondContact CG-OE1 3.43Å; K231-E243 PolarHBondContact N-OE1 2.82Å; K231-E243 PolarHBondContact N-OE2 3.23Å; K231-E243 IonicContact NZ-OE1 3.98Å; K231-E243 PolarHBondContact NZ-OE1 2.94Å; W241-E243 VanDerWaalsContact C-N 3.31Å; W241-E243 HydrophobicContact CB-CG 4.25Å; W241-E243 PolarHBondContact O-N 2.86Å
244	I	85.2	Confident	80.6	Confident	89 Å²	89	59.3 Å²	59.3	46%	0.456	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.8	172.8	-56.5	172.1	0	0	0	109.5	T196 I197 H198	T196-I244 HydrophobicContact CG2-CG2 3.72Å; I197-I244 WeakPolarHBondContact O-CA 3.36Å; H198-I244 HydrophobicContact CB-CG1 4.36Å; H198-I244 WeakPolarHBondContact CD2-CG1 3.1Å
245	V	78.6	Confident	80.6	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.091	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	147	170.3	61.4	0	0	0	0	110.3	I197 Y228 L247	I197-V245 HydrophobicContact CB-CG1 3.77Å; I197-V245 HydrophobicContact CD1-CG1 4.26Å; I197-V245 HydrophobicContact CG1-CG1 4.32Å; I197-V245 PolarHBondContact N-O 3.18Å; I197-V245 PolarHBondContact O-N 2.85Å; Y228-V245 HydrophobicContact CD1-CB 4.25Å; Y228-V245 HydrophobicContact CD1-CG1 4.16Å; Y228-V245 HydrophobicContact CD1-CG2 4.36Å; Y228-V245 HydrophobicContact CD2-CB 4.15Å; Y228-V245 HydrophobicContact CD2-CG2 3.56Å; Y228-V245 HydrophobicContact CE1-CB 4.3Å; Y228-V245 HydrophobicContact CE1-CG1 4.48Å; Y228-V245 HydrophobicContact CE2-CB 4.21Å; Y228-V245 HydrophobicContact CE2-CG2 3.98Å; Y228-V245 HydrophobicContact CG-CB 4.16Å; Y228-V245 HydrophobicContact CG-CG1 4.3Å; Y228-V245 HydrophobicContact CG-CG2 3.77Å; V245-L247 HydrophobicContact CG2-CD2 3.84Å; V245-L247 HydrophobicContact CG2-CG 4.29Å
246	V	80.8	Confident	80.9	Confident	75 Å²	75	51.3 Å²	51.3	46%	0.455	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.2	178.5	-176	0	0	0	0	109	L194 L195 T196	L194-V246 HydrophobicContact CD1-CG1 3.55Å; L194-V246 HydrophobicContact CD2-CG1 3.89Å; L194-V246 HydrophobicContact CG-CG1 3.57Å; L195-V246 CarbonylContact O-C 3.55Å; L195-V246 WeakPolarHBondContact O-CA 3.48Å; T196-V246 HydrophobicContact CG2-CG2 4.22Å
247	L	75.9	Confident	81.1	Confident	13 Å²	13	55.2 Å²	55.2	7%	0.068	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.5	-175.6	-58.4	-178.7	0	0	0	110.4	L195 I197 L227 V245	L195-L247 PolarHBondContact N-O 2.66Å; L195-L247 PolarHBondContact O-N 2.96Å; I197-L247 HydrophobicContact CD1-CD1 3.68Å; I197-L247 HydrophobicContact CD1-CG 4.45Å; L227-L247 HydrophobicContact CB-CD1 4.29Å; L227-L247 HydrophobicContact CB-CD2 4Å; L227-L247 HydrophobicContact CD1-CD1 4.06Å; L227-L247 HydrophobicContact CD1-CD2 4.4Å; V245-L247 HydrophobicContact CG2-CD2 3.84Å; V245-L247 HydrophobicContact CG2-CG 4.29Å
248	P	77.4	Confident	81.4	Confident	60 Å²	60	53.5 Å²	53.5	39%	0.39	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.5	171.7	33	-33.8	0	0	0	110.2	F191 L194	F191-P248 HydrophobicContact CB-CB 4.1Å; F191-P248 HydrophobicContact CD1-CB 3.78Å; F191-P248 HydrophobicContact CD1-CG 4.26Å; F191-P248 HydrophobicContact CD2-CB 4.22Å; F191-P248 HydrophobicContact CE1-CB 4.27Å; F191-P248 HydrophobicContact CE1-CG 4.24Å; F191-P248 HydrophobicContact CG-CB 3.77Å; F191-P248 HydrophobicContact CG-CG 4.5Å; F191-P248 HydrophobicContact CZ-CG 4.44Å; L194-P248 HydrophobicContact CD1-CB 4.49Å
249	I	75.3	Confident	81.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.7	-172.6	-58	-163	0	0	0	110.7	A192 Y193 L195 S251 L278	A192-I249 PolarHBondContact N-O 3.48Å; A192-I249 VanDerWaalsContact N-O 3.09Å; Y193-I249 PolarHBondContact N-O 2.87Å; Y193-I249 PolarHBondContact O-N 3.35Å; L195-I249 HydrophobicContact CB-CD1 3.54Å; L195-I249 HydrophobicContact CB-CG1 4.17Å; L195-I249 HydrophobicContact CD2-CD1 3.77Å; L195-I249 HydrophobicContact CG-CD1 4.28Å; I249-S251 VanDerWaalsContact CG2-O 3.26Å; I249-S251 WeakPolarHBondContact CG2-O 3.17Å; I249-L278 HydrophobicContact CD1-CD1 3.55Å; I249-L278 HydrophobicContact CD1-CD2 4.41Å; I249-L278 HydrophobicContact CG2-CD1 4.16Å
250	Q	69.9	Low	81.7	Confident	103 Å²	103	51.4 Å²	51.4	48%	0.481	26%	0.263	S	S	.	.	S	Bend	trans	-91.9	-47.9	-174.1	-51.6	-165.2	-69.9	0	0	111.8	P190 F191	P190-Q250 WeakPolarHBondContact O-CG 3.37Å; P190-Q250 PolarHBondContact O-NE2 2.81Å; F191-Q250 HydrophobicContact CD1-CG 3.69Å; F191-Q250 HydrophobicContact CE1-CG 3.92Å
251	S	72.1	Confident	81.7	Confident	33 Å²	33	49 Å²	49	23%	0.231	24%	0.244	C	C	.	.			trans	-142.2	156.4	-178.9	68.7	0	0	0	0	111.1	I249 D253 Q254	I249-S251 VanDerWaalsContact CG2-O 3.26Å; I249-S251 WeakPolarHBondContact CG2-O 3.17Å; S251-D253 VanDerWaalsContact CB-OD1 3.22Å; S251-D253 WeakPolarHBondContact CB-OD1 3.49Å; S251-D253 VanDerWaalsContact CB-OD2 3.26Å; S251-D253 WeakPolarHBondContact CB-OD2 3.37Å; S251-D253 PolarHBondContact OG-OD1 2.8Å; S251-D253 PolarHBondContact OG-OD2 2.91Å; S251-Q254 WeakPolarHBondContact OG-CG 3.41Å; S251-Q254 PolarHBondContact OG-NE2 3.35Å
252	L	74.2	Confident	81.9	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	24%	0.242	C	C	.	.	S	Bend	trans	-93.3	-21.9	-169.8	-59.9	-172.6	0	0	0	113.6	Y193 Q254 L278 S279 L312	Y193-L252 HydrophobicContact CD1-CD1 4.36Å; Y193-L252 HydrophobicContact CD1-CD2 3.92Å; Y193-L252 HydrophobicContact CD1-CG 4.45Å; Y193-L252 HydrophobicContact CD2-CD2 3.65Å; Y193-L252 HydrophobicContact CD2-CG 4.08Å; Y193-L252 HydrophobicContact CE1-CD1 3.82Å; Y193-L252 HydrophobicContact CE1-CD2 4.14Å; Y193-L252 HydrophobicContact CE1-CG 4.16Å; Y193-L252 HydrophobicContact CE2-CD1 4.27Å; Y193-L252 HydrophobicContact CE2-CD2 3.9Å; Y193-L252 HydrophobicContact CE2-CG 3.79Å; Y193-L252 HydrophobicContact CG-CD2 3.67Å; Y193-L252 HydrophobicContact CG-CG 4.42Å; L252-Q254 PolarHBondContact O-N 3.23Å; L252-L278 CarbonylContact O-C 3.49Å; L252-L278 WeakPolarHBondContact O-CB 3.25Å; L252-S279 PolarHBondContact O-N 2.84Å; L252-S279 PolarHBondContact O-OG 2.96Å; L252-L312 HydrophobicContact CD1-CD2 4.26Å; L252-L312 HydrophobicContact CD2-CD1 4.09Å; L252-L312 HydrophobicContact CD2-CD2 3.68Å; L252-L312 HydrophobicContact CD2-CG 4.39Å
253	D	72.3	Confident	81.8	Confident	120 Å²	120	47.8 Å²	47.8	64%	0.642	23%	0.231	S	C	*	.	S	Bend	trans	-54.4	-4.8	166.5	36.4	-78.7	0	0	0	115	S251	S251-D253 VanDerWaalsContact CB-OD1 3.22Å; S251-D253 WeakPolarHBondContact CB-OD1 3.49Å; S251-D253 VanDerWaalsContact CB-OD2 3.26Å; S251-D253 WeakPolarHBondContact CB-OD2 3.37Å; S251-D253 PolarHBondContact OG-OD1 2.8Å; S251-D253 PolarHBondContact OG-OD2 2.91Å
254	Q	77	Confident	82	Confident	18 Å²	18	48.9 Å²	48.9	8%	0.084	24%	0.237	C	C	.	.			trans	-87	145.7	179.7	-56	-177	18.5	0	0	112.1	L222 N223 S251 L252 L278	L222-Q254 HydrophobicContact CD1-CB 4.12Å; N223-Q254 PolarHBondContact ND2-OE1 2.8Å; N223-Q254 PolarHBondContact OD1-OE1 2.83Å; S251-Q254 WeakPolarHBondContact OG-CG 3.41Å; S251-Q254 PolarHBondContact OG-NE2 3.35Å; L252-Q254 PolarHBondContact O-N 3.23Å; Q254-L278 HydrophobicContact CB-CD1 4.26Å; Q254-L278 WeakPolarHBondContact O-CG 3.37Å; Q254-L278 PolarHBondContact O-N 2.93Å
255	K	85.3	Confident	80.9	Confident	117 Å²	117	53.1 Å²	53.1	51%	0.509	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.3	175.8	-58.6	-167.8	-179.9	-172.4	0	110.8	R257 V276 I277	K255-R257 PolarHBondContact O-N 3.28Å; K255-V276 CarbonylContact C-O 3.57Å; K255-V276 WeakPolarHBondContact CA-O 3.01Å; K255-I277 HydrophobicContact CD-CG1 4.2Å; K255-I277 HydrophobicContact CG-CG1 4.22Å
256	L	87.3	Confident	79.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	113.3	170.2	176.2	70.6	0	0	0	108.5	L195 I197 F220 F275 V276 L278 L310	L195-L256 HydrophobicContact CD2-CD2 4.02Å; I197-L256 HydrophobicContact CD1-CD1 4.3Å; I197-L256 HydrophobicContact CD1-CD2 3.73Å; F220-L256 HydrophobicContact CB-CD1 4.31Å; F220-L256 HydrophobicContact CD1-CD1 4.26Å; F220-L256 HydrophobicContact CD1-CD2 4.35Å; F220-L256 HydrophobicContact CD1-CG 4.47Å; L256-F275 CarbonylContact O-C 3.57Å; L256-F275 WeakPolarHBondContact O-CA 3.25Å; L256-V276 PolarHBondContact N-O 2.58Å; L256-V276 PolarHBondContact O-N 3.35Å; L256-L278 HydrophobicContact CB-CD2 4.04Å; L256-L278 HydrophobicContact CB-CG 4.38Å; L256-L310 HydrophobicContact CD2-CD2 4.42Å
257	R	88.8	Confident	79.3	Confident	141 Å²	141	59.4 Å²	59.4	53%	0.532	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.2	176	-162.4	-174	-59.2	-142.7	6.8	110.2	K221 K255 A274	K221-R257 HydrophobicContact CB-CB 4.46Å; K221-R257 PolarHBondContact N-O 2.84Å; K221-R257 PolarHBondContact O-N 3.14Å; K255-R257 PolarHBondContact O-N 3.28Å; R257-A274 WeakPolarHBondContact CA-O 3.43Å; R257-A274 WeakPolarHBondContact CG-O 3.16Å
258	V	91.8	Very high	79.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132	174.9	-165	0	0	0	0	107.8	V218 F220 S273 A274 L291 I306 L308	V218-V258 HydrophobicContact CG1-CG1 3.39Å; F220-V258 HydrophobicContact CD1-CG1 4.19Å; F220-V258 HydrophobicContact CD1-CG2 3.95Å; F220-V258 HydrophobicContact CE1-CB 4.44Å; F220-V258 HydrophobicContact CE1-CG1 3.83Å; F220-V258 HydrophobicContact CE1-CG2 3.83Å; F220-V258 HydrophobicContact CZ-CG1 4.36Å; V258-S273 CarbonylContact O-C 3.59Å; V258-S273 WeakPolarHBondContact O-CA 3.21Å; V258-S273 WeakPolarHBondContact O-CB 3.44Å; V258-A274 PolarHBondContact N-O 3.4Å; V258-A274 PolarHBondContact O-N 2.83Å; V258-A274 VanDerWaalsContact O-O 3.14Å; V258-L291 HydrophobicContact CG2-CD1 4.07Å; V258-I306 HydrophobicContact CB-CD1 4.49Å; V258-I306 HydrophobicContact CG1-CD1 3.51Å; V258-L308 HydrophobicContact CG2-CD2 4.36Å
259	K	92	Very high	80	Confident	40 Å²	40	60.9 Å²	60.9	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.3	176.5	-71.1	-144.6	147.3	-140.4	0	110.7	V218 K219 Y261 F270	V218-K259 CarbonylContact C-O 3.57Å; V218-K259 WeakPolarHBondContact CA-O 3.38Å; K219-K259 PolarHBondContact N-O 3.5Å; K219-K259 PolarHBondContact O-N 2.93Å; K259-Y261 HydrophobicContact CB-CD2 4.21Å; K259-Y261 HydrophobicContact CB-CE2 3.52Å; K259-Y261 HydrophobicContact CD-CE2 4.16Å; K259-Y261 WeakPolarHBondContact CD-OH 2.99Å; K259-Y261 HydrophobicContact CG-CE2 4.45Å; K259-F270 HydrophobicContact CB-CE2 4.09Å; K259-F270 HydrophobicContact CD-CD2 4.34Å; K259-F270 HydrophobicContact CD-CE2 3.6Å; K259-F270 HydrophobicContact CD-CZ 4.17Å; K259-F270 HydrophobicContact CG-CE2 4.09Å
260	V	92.4	Very high	80.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	146.2	172.3	-166.4	0	0	0	0	109.7	L205 P216 Y217 V218 F270 M271 G272 L293 I306	L205-V260 HydrophobicContact CD1-CG1 4.36Å; P216-V260 HydrophobicContact CB-CG1 4.18Å; Y217-V260 WeakPolarHBondContact O-CA 3.31Å; V218-V260 HydrophobicContact CG2-CG2 4.38Å; V260-F270 VanDerWaalsContact O-CD2 3.31Å; V260-F270 WeakPolarHBondContact O-CD2 3.45Å; V260-M271 HydrophobicContact CB-CB 3.9Å; V260-M271 HydrophobicContact CG1-CB 3.86Å; V260-M271 HydrophobicContact CG1-CG 4.45Å; V260-M271 HydrophobicContact CG1-SD 3.89Å; V260-M271 PolarHBondContact O-N 3.11Å; V260-G272 PolarHBondContact N-O 3.49Å; V260-L293 HydrophobicContact CB-CD1 4.3Å; V260-L293 HydrophobicContact CG2-CD1 3.61Å; V260-L293 HydrophobicContact CG2-CD2 3.85Å; V260-L293 HydrophobicContact CG2-CG 4.41Å; V260-I306 HydrophobicContact CG2-CD1 3.53Å; V260-I306 HydrophobicContact CG2-CG1 4.04Å
261	Y	90.8	Very high	81.2	Confident	36 Å²	36	57.6 Å²	57.6	14%	0.141	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	147.2	179.5	-73	-89.3	0	0	0	110.4	P216 Y217 K219 K259 D269 F270	P216-Y261 CarbonylContact C-O 3.58Å; P216-Y261 WeakPolarHBondContact CA-O 3.45Å; Y217-Y261 WeakPolarHBondContact CD1-O 3.43Å; Y217-Y261 PolarHBondContact N-O 3.5Å; Y217-Y261 PolarHBondContact O-N 3.15Å; K219-Y261 HydrophobicContact CB-CE2 4.36Å; K219-Y261 HydrophobicContact CD-CD2 3.6Å; K219-Y261 HydrophobicContact CD-CE2 3.48Å; K219-Y261 VanDerWaalsContact CD-CE2 3.48Å; K219-Y261 HydrophobicContact CD-CG 4.5Å; K219-Y261 HydrophobicContact CG-CD2 3.98Å; K219-Y261 HydrophobicContact CG-CE2 4.13Å; K219-Y261 VanDerWaalsContact NZ-CE2 3.33Å; K259-Y261 HydrophobicContact CB-CD2 4.21Å; K259-Y261 HydrophobicContact CB-CE2 3.52Å; K259-Y261 HydrophobicContact CD-CE2 4.16Å; K259-Y261 WeakPolarHBondContact CD-OH 2.99Å; K259-Y261 HydrophobicContact CG-CE2 4.45Å; Y261-D269 CarbonylContact C-O 3.56Å; Y261-D269 WeakPolarHBondContact CA-O 3.21Å; Y261-D269 WeakPolarHBondContact CD1-O 3.2Å; Y261-F270 HydrophobicContact CD1-CB 4.41Å; Y261-F270 HydrophobicContact CD1-CD2 4.32Å; Y261-F270 HydrophobicContact CE1-CB 4.2Å; Y261-F270 AromaticContact CE1-CD2 3.89Å; Y261-F270 HydrophobicContact CE1-CD2 3.89Å; Y261-F270 HydrophobicContact CE1-CG 4.45Å; Y261-F270 HydrophobicContact CE2-CD2 4.37Å; Y261-F270 AromaticContact CZ-CD2 3.91Å
262	D	88.8	Confident	82	Confident	2 Å²	2	56 Å²	56	1%	0.011	28%	0.279	C	S	.	.			trans	-83.3	159	169.1	-149.7	-21.5	0	0	0	110.2	S214 D215 Y217 S268 D269 M271	S214-D262 WeakPolarHBondContact CB-OD2 3.46Å; S214-D262 PolarHBondContact OG-OD2 3.16Å; D215-D262 WeakPolarHBondContact CA-OD1 3.39Å; D215-D262 PolarHBondContact N-OD1 3.36Å; Y217-D262 WeakPolarHBondContact CE1-O 3.39Å; D262-S268 VanDerWaalsContact O-CA 3.25Å; D262-S268 WeakPolarHBondContact O-CA 3.46Å; D262-S268 WeakPolarHBondContact O-CB 3.35Å; D262-S268 PolarHBondContact O-OG 3.48Å; D262-D269 HydrophobicContact CB-CB 4.2Å; D262-D269 PolarHBondContact N-O 2.94Å; D262-M271 HydrophobicContact CB-CG 4.13Å; D262-M271 HydrophobicContact CB-SD 3.86Å; D262-M271 PolarHBondContact N-SD 2.96Å; D262-M271 VanDerWaalsContact N-SD 3.42Å
263	R	85.4	Confident	82.9	Confident	99 Å²	99	55.4 Å²	55.4	37%	0.374	28%	0.277	S	S	.	.			trans	-110.9	59.2	-174.2	-176.3	40	177.5	158.3	2.6	113.3	D215 Y217 V232	D215-R263 HydrophobicContact CB-CB 3.8Å; D215-R263 WeakPolarHBondContact O-CB 3.28Å; D215-R263 PolarHBondContact O-N 3.03Å; Y217-R263 HydrophobicContact CD1-CB 4.15Å; Y217-R263 HydrophobicContact CE1-CB 4.17Å; V232-R263 HydrophobicContact CB-CB 4.5Å; V232-R263 HydrophobicContact CB-CG 4.41Å; V232-R263 HydrophobicContact CG1-CB 3.62Å; V232-R263 HydrophobicContact CG1-CG 3.81Å; V232-R263 HydrophobicContact CG2-CB 4.03Å; V232-R263 HydrophobicContact CG2-CG 3.79Å
264	D	80.9	Confident	83.8	Confident	34 Å²	34	50 Å²	50	18%	0.182	25%	0.25	C	C	.	.			trans	-61.1	155	173.2	-44.8	-87.5	0	0	0	113.6	T266 T267 S268 D269	D264-T266 VanDerWaalsContact C-N 3.28Å; D264-T266 PolarHBondContact O-N 3.08Å; D264-T267 WeakPolarHBondContact CB-O 3.44Å; D264-S268 VanDerWaalsContact OD2-CA 3.32Å; D264-S268 WeakPolarHBondContact OD2-CA 3.1Å; D264-D269 PolarHBondContact OD2-N 2.74Å
265	L	61.2	Low	84.4	Confident	177 Å²	177	54.8 Å²	54.8	93%	0.927	27%	0.27	S	S	*	.	S	Bend	trans	-64.6	-30	179.9	-173.3	65.1	0	0	0	113
266	T	56.9	Low	84.5	Confident	123 Å²	123	49.6 Å²	49.6	76%	0.755	25%	0.249	S	C	*	.	S	Bend	trans	-108.8	-58.2	-175	48.3	0	0	0	0	112.5	D264	D264-T266 VanDerWaalsContact C-N 3.28Å; D264-T266 PolarHBondContact O-N 3.08Å
267	T	70.6	Confident	84.5	Confident	100 Å²	100	51.9 Å²	51.9	61%	0.613	26%	0.26	S	S	*	.	S	Bend	trans	-146	114	-174.4	46.2	0	0	0	0	110.1	D264 D269	D264-T267 WeakPolarHBondContact CB-O 3.44Å; T267-D269 PolarHBondContact O-N 2.68Å; T267-D269 VanDerWaalsContact O-N 3.14Å
268	S	82	Confident	84.2	Confident	32 Å²	32	45.2 Å²	45.2	22%	0.224	24%	0.235	C	C	.	.			trans	-53.7	113.1	176.4	-84.6	0	0	0	0	113.3	Y217 D262 D264	Y217-S268 WeakPolarHBondContact CE1-OG 3.27Å; Y217-S268 WeakPolarHBondContact OH-CB 3.46Å; Y217-S268 PolarHBondContact OH-OG 2.82Å; D262-S268 VanDerWaalsContact O-CA 3.25Å; D262-S268 WeakPolarHBondContact O-CA 3.46Å; D262-S268 WeakPolarHBondContact O-CB 3.35Å; D262-S268 PolarHBondContact O-OG 3.48Å; D264-S268 VanDerWaalsContact OD2-CA 3.32Å; D264-S268 WeakPolarHBondContact OD2-CA 3.1Å
269	D	84.2	Confident	83.5	Confident	72 Å²	72	48.6 Å²	48.6	39%	0.385	26%	0.259	S	S	.	.			trans	-65.4	155.6	172	-92.5	-1	0	0	0	111.9	R208 Y261 D262 D264 T267	R208-D269 HydrophobicContact CB-CB 4.29Å; Y261-D269 CarbonylContact C-O 3.56Å; Y261-D269 WeakPolarHBondContact CA-O 3.21Å; Y261-D269 WeakPolarHBondContact CD1-O 3.2Å; D262-D269 HydrophobicContact CB-CB 4.2Å; D262-D269 PolarHBondContact N-O 2.94Å; D264-D269 PolarHBondContact OD2-N 2.74Å; T267-D269 PolarHBondContact O-N 2.68Å; T267-D269 VanDerWaalsContact O-N 3.14Å
270	F	87.6	Confident	83	Confident	34 Å²	34	51.8 Å²	51.8	15%	0.149	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.6	-174.2	177.9	-123.6	0	0	0	111	R208 K259 V260 Y261 G272 D295	R208-F270 PolarHBondContact NH1-O 2.87Å; K259-F270 HydrophobicContact CB-CE2 4.09Å; K259-F270 HydrophobicContact CD-CD2 4.34Å; K259-F270 HydrophobicContact CD-CE2 3.6Å; K259-F270 HydrophobicContact CD-CZ 4.17Å; K259-F270 HydrophobicContact CG-CE2 4.09Å; V260-F270 VanDerWaalsContact O-CD2 3.31Å; V260-F270 WeakPolarHBondContact O-CD2 3.45Å; Y261-F270 HydrophobicContact CD1-CB 4.41Å; Y261-F270 HydrophobicContact CD1-CD2 4.32Å; Y261-F270 HydrophobicContact CE1-CB 4.2Å; Y261-F270 AromaticContact CE1-CD2 3.89Å; Y261-F270 HydrophobicContact CE1-CD2 3.89Å; Y261-F270 HydrophobicContact CE1-CG 4.45Å; Y261-F270 HydrophobicContact CE2-CD2 4.37Å; Y261-F270 AromaticContact CZ-CD2 3.91Å; F270-G272 VanDerWaalsContact CE2-C 3.4Å; F270-G272 WeakPolarHBondContact CE2-O 3.2Å; F270-G272 VanDerWaalsContact CZ-CA 3.41Å; F270-G272 WeakPolarHBondContact CZ-O 3.47Å; F270-D295 HydrophobicContact CD1-CB 4.38Å; F270-D295 WeakPolarHBondContact CD1-OD2 3.35Å; F270-D295 HydrophobicContact CE1-CB 3.89Å; F270-D295 VanDerWaalsContact CE1-CG 3.42Å; F270-D295 WeakPolarHBondContact CE1-OD1 3.26Å
271	M	84.4	Confident	82.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	30.7	-175.4	-54.9	173.6	87.1	0	0	111.9	L205 V206 S214 P216 V260 D262 M303	L205-M271 HydrophobicContact CB-CE 4.21Å; V206-M271 HydrophobicContact CG1-CB 3.89Å; V206-M271 HydrophobicContact CG1-CE 4.31Å; V206-M271 HydrophobicContact CG1-CG 4.25Å; V206-M271 WeakPolarHBondContact O-CE 3.25Å; S214-M271 VanDerWaalsContact CB-CE 3.45Å; P216-M271 HydrophobicContact CB-CE 4.13Å; P216-M271 HydrophobicContact CB-SD 3.86Å; V260-M271 HydrophobicContact CB-CB 3.9Å; V260-M271 HydrophobicContact CG1-CB 3.86Å; V260-M271 HydrophobicContact CG1-CG 4.45Å; V260-M271 HydrophobicContact CG1-SD 3.89Å; V260-M271 PolarHBondContact O-N 3.11Å; D262-M271 HydrophobicContact CB-CG 4.13Å; D262-M271 HydrophobicContact CB-SD 3.86Å; D262-M271 PolarHBondContact N-SD 2.96Å; D262-M271 VanDerWaalsContact N-SD 3.42Å; M271-M303 VanDerWaalsContact C-CE 3.42Å
272	G	89.2	Confident	81.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87.3	171.2	178.7	0	0	0	0	0	115.8	V260 F270	V260-G272 PolarHBondContact N-O 3.49Å; F270-G272 VanDerWaalsContact CE2-C 3.4Å; F270-G272 WeakPolarHBondContact CE2-O 3.2Å; F270-G272 VanDerWaalsContact CZ-CA 3.41Å; F270-G272 WeakPolarHBondContact CZ-O 3.47Å
273	S	91.6	Very high	81.1	Confident	17 Å²	17	59.4 Å²	59.4	12%	0.119	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	155.1	-174.6	57.5	0	0	0	0	114	V258 E294	V258-S273 CarbonylContact O-C 3.59Å; V258-S273 WeakPolarHBondContact O-CA 3.21Å; V258-S273 WeakPolarHBondContact O-CB 3.44Å; S273-E294 PolarHBondContact N-O 3.02Å; S273-E294 PolarHBondContact O-N 2.87Å; S273-E294 PolarHBondContact OG-O 2.69Å
274	A	91.4	Very high	80.5	Confident	8 Å²	8	59.6 Å²	59.6	7%	0.066	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	168.4	172.8	0	0	0	0	0	110.4	R257 V258 L291 K292 L293	R257-A274 WeakPolarHBondContact CA-O 3.43Å; R257-A274 WeakPolarHBondContact CG-O 3.16Å; V258-A274 PolarHBondContact N-O 3.4Å; V258-A274 PolarHBondContact O-N 2.83Å; V258-A274 VanDerWaalsContact O-O 3.14Å; A274-L291 HydrophobicContact CB-CB 3.79Å; A274-L291 HydrophobicContact CB-CD1 4.01Å; A274-L291 HydrophobicContact CB-CG 4.44Å; A274-K292 WeakPolarHBondContact CB-O 3.17Å; A274-L293 HydrophobicContact CB-CD2 4.36Å
275	F	89.6	Confident	80.5	Confident	117 Å²	117	64.7 Å²	64.7	51%	0.513	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.4	171.6	57.2	-89.8	0	0	0	111.1	L256	L256-F275 CarbonylContact O-C 3.57Å; L256-F275 WeakPolarHBondContact O-CA 3.25Å
276	V	88.6	Confident	81.5	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.9	171.7	-175.1	0	0	0	0	108.4	K255 L256 L281 L291 L310	K255-V276 CarbonylContact C-O 3.57Å; K255-V276 WeakPolarHBondContact CA-O 3.01Å; L256-V276 PolarHBondContact N-O 2.58Å; L256-V276 PolarHBondContact O-N 3.35Å; V276-L281 HydrophobicContact CG1-CD2 4.12Å; V276-L291 HydrophobicContact CG2-CD1 3.6Å; V276-L291 HydrophobicContact CG2-CD2 3.86Å; V276-L291 HydrophobicContact CG2-CG 4.37Å; V276-L310 HydrophobicContact CB-CD1 4.35Å; V276-L310 HydrophobicContact CG1-CD1 3.77Å; V276-L310 HydrophobicContact CG2-CD1 4.21Å
277	I	86.1	Confident	82.7	Confident	49 Å²	49	55.6 Å²	55.6	25%	0.251	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126	173.8	-52.8	-179.1	0	0	0	107.2	K255 S279 D280	K255-I277 HydrophobicContact CD-CG1 4.2Å; K255-I277 HydrophobicContact CG-CG1 4.22Å; I277-S279 VanDerWaalsContact C-N 3.32Å; I277-S279 PolarHBondContact O-N 2.88Å; I277-D280 WeakPolarHBondContact CB-OD2 3.42Å; I277-D280 PolarHBondContact O-N 2.96Å
278	L	82.8	Confident	83.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-77.5	-20	-171.3	-61.9	170.1	0	0	0	113.1	L195 L222 I249 L252 Q254 L256 D280 L281	L195-L278 HydrophobicContact CD2-CD2 3.77Å; L222-L278 HydrophobicContact CD1-CD1 3.89Å; I249-L278 HydrophobicContact CD1-CD1 3.55Å; I249-L278 HydrophobicContact CD1-CD2 4.41Å; I249-L278 HydrophobicContact CG2-CD1 4.16Å; L252-L278 CarbonylContact O-C 3.49Å; L252-L278 WeakPolarHBondContact O-CB 3.25Å; Q254-L278 HydrophobicContact CB-CD1 4.26Å; Q254-L278 WeakPolarHBondContact O-CG 3.37Å; Q254-L278 PolarHBondContact O-N 2.93Å; L256-L278 HydrophobicContact CB-CD2 4.04Å; L256-L278 HydrophobicContact CB-CG 4.38Å; L278-D280 PolarHBondContact O-N 3.32Å; L278-L281 HydrophobicContact CD2-CD1 3.65Å; L278-L281 PolarHBondContact O-N 2.8Å
279	S	78	Confident	83.7	Confident	72 Å²	72	56.7 Å²	56.7	50%	0.503	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-58.2	-28.9	167.1	-55.6	0	0	0	0	114	L252 I277 L281	L252-S279 PolarHBondContact O-N 2.84Å; L252-S279 PolarHBondContact O-OG 2.96Å; I277-S279 VanDerWaalsContact C-N 3.32Å; I277-S279 PolarHBondContact O-N 2.88Å; S279-L281 PolarHBondContact O-N 2.89Å
280	D	79.7	Confident	84.1	Confident	107 Å²	107	58.4 Å²	58.4	57%	0.572	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-86.4	2.2	-171.7	-54.9	-4.5	0	0	0	111.9	I277 L278	I277-D280 WeakPolarHBondContact CB-OD2 3.42Å; I277-D280 PolarHBondContact O-N 2.96Å; L278-D280 PolarHBondContact O-N 3.32Å
281	L	80.1	Confident	84.1	Confident	9 Å²	9	57.9 Å²	57.9	5%	0.047	30%	0.295	C	S	.	.	S	Bend	trans	-95.1	123.6	-176.9	-60.1	179.8	0	0	0	112.1	L195 V276 L278 S279 L283 H289 L310 L312	L195-L281 HydrophobicContact CD1-CD1 3.75Å; V276-L281 HydrophobicContact CG1-CD2 4.12Å; L278-L281 HydrophobicContact CD2-CD1 3.65Å; L278-L281 PolarHBondContact O-N 2.8Å; S279-L281 PolarHBondContact O-N 2.89Å; L281-L283 PolarHBondContact O-N 3.19Å; L281-H289 WeakPolarHBondContact CD2-NE2 3.37Å; L281-L310 HydrophobicContact CD1-CB 4.17Å; L281-L310 HydrophobicContact CD1-CD1 4.07Å; L281-L310 HydrophobicContact CD2-CB 4.02Å; L281-L310 HydrophobicContact CD2-CD1 3.72Å; L281-L312 HydrophobicContact CB-CB 4.21Å; L281-L312 HydrophobicContact CB-CD2 4.04Å; L281-L312 HydrophobicContact CD1-CB 4.46Å
282	E	75.7	Confident	84.4	Confident	102 Å²	102	65.4 Å²	65.4	48%	0.477	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-60.7	120.5	174.9	-74	-171.3	-137.9	0	0	112.4	N284 R285 T287	E282-N284 PolarHBondContact O-N 3.37Å; E282-R285 HydrophobicContact CB-CB 3.93Å; E282-R285 PolarHBondContact O-N 2.82Å; E282-R285 IonicContact OE1-CZ 3.19Å; E282-R285 IonicContact OE1-NH1 2.86Å; E282-R285 PolarHBondContact OE1-NH1 2.92Å; E282-R285 WeakPolarHBondContact OE2-CD 3.25Å; E282-R285 IonicContact OE2-CZ 3.3Å; E282-R285 IonicContact OE2-NE 2.68Å; E282-R285 IonicContact OE2-NH1 2.74Å; E282-R285 PolarHBondContact OE2-NH1 3.38Å; E282-T287 HydrophobicContact CB-CG2 4.36Å
283	L	77.4	Confident	84.5	Confident	86 Å²	86	65.8 Å²	65.8	45%	0.45	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-63.4	132.2	-178.4	-68.9	171.7	0	0	0	112.3	Y193 L281 R285 L312 V314	Y193-L283 HydrophobicContact CD1-CD2 4.27Å; Y193-L283 HydrophobicContact CE1-CD2 4.27Å; L281-L283 PolarHBondContact O-N 3.19Å; L283-R285 PolarHBondContact O-N 3.19Å; L283-L312 CarbonylContact C-O 3.6Å; L283-L312 WeakPolarHBondContact CA-O 3.28Å; L283-L312 HydrophobicContact CD2-CB 4.38Å; L283-L312 HydrophobicContact CD2-CD2 3.61Å; L283-L312 HydrophobicContact CD2-CG 3.75Å; L283-V314 HydrophobicContact CD1-CG2 4.11Å; L283-V314 HydrophobicContact CD2-CG2 3.93Å; L283-V314 HydrophobicContact CG-CG2 4.47Å
284	N	72.5	Confident	84.2	Confident	103 Å²	103	70.8 Å²	70.8	55%	0.551	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	6.6	-176.3	-50.6	-58	0	0	0	116	E282 L312	E282-N284 PolarHBondContact O-N 3.37Å; N284-L312 PolarHBondContact N-O 2.85Å
285	R	80.1	Confident	83.8	Confident	142 Å²	142	71.7 Å²	71.7	54%	0.536	36%	0.355	S	S	.	.			trans	-104.6	143.9	175.8	-165.6	179	-176.9	-178.9	-2.9	110.6	E282 L283 N311	E282-R285 HydrophobicContact CB-CB 3.93Å; E282-R285 PolarHBondContact O-N 2.82Å; E282-R285 IonicContact OE1-CZ 3.19Å; E282-R285 IonicContact OE1-NH1 2.86Å; E282-R285 PolarHBondContact OE1-NH1 2.92Å; E282-R285 WeakPolarHBondContact OE2-CD 3.25Å; E282-R285 IonicContact OE2-CZ 3.3Å; E282-R285 IonicContact OE2-NE 2.68Å; E282-R285 IonicContact OE2-NH1 2.74Å; E282-R285 PolarHBondContact OE2-NH1 3.38Å; L283-R285 PolarHBondContact O-N 3.19Å; R285-N311 WeakPolarHBondContact O-CA 3.33Å
286	T	83.3	Confident	83.1	Confident	82 Å²	82	71.8 Å²	71.8	50%	0.503	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.9	167.1	-53.7	0	0	0	0	108.6	N309 L310 N311	T286-N309 HydrophobicContact CG2-CB 3.73Å; T286-L310 CarbonylContact C-O 3.57Å; T286-L310 WeakPolarHBondContact CA-O 3.07Å; T286-N311 PolarHBondContact N-ND2 3.39Å; T286-N311 PolarHBondContact OG1-ND2 3.35Å
287	T	81.7	Confident	82.3	Confident	26 Å²	26	78.3 Å²	78.3	16%	0.16	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.2	175.3	49.5	0	0	0	0	109.4	E282 H289 N309 L310	E282-T287 HydrophobicContact CB-CG2 4.36Å; T287-H289 WeakPolarHBondContact CB-NE2 3.2Å; T287-H289 PolarHBondContact OG1-NE2 2.86Å; T287-N309 CarbonylContact O-C 3.49Å; T287-N309 WeakPolarHBondContact O-CA 3.05Å; T287-L310 PolarHBondContact N-O 3.42Å; T287-L310 PolarHBondContact O-N 2.88Å; T287-L310 PolarHBondContact OG1-O 3.1Å
288	E	88.6	Confident	81.6	Confident	106 Å²	106	77.6 Å²	77.6	50%	0.495	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.7	174.2	177.8	160.3	-138.3	0	0	109.3	K200 V307	K200-E288 IonicContact NZ-OE1 3.18Å; K200-E288 PolarHBondContact NZ-OE1 2.81Å; K200-E288 IonicContact NZ-OE2 3.06Å; E288-V307 HydrophobicContact CG-CG1 4.17Å; E288-V307 VanDerWaalsContact OE1-CG1 3.25Å; E288-V307 WeakPolarHBondContact OE1-CG1 3.4Å
289	H	85.7	Confident	80.7	Confident	49 Å²	49	86.2 Å²	86.2	23%	0.227	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127	-177.1	-68	-98.7	0	0	0	109.5	L281 T287 L291 L308	L281-H289 WeakPolarHBondContact CD2-NE2 3.37Å; T287-H289 WeakPolarHBondContact CB-NE2 3.2Å; T287-H289 PolarHBondContact OG1-NE2 2.86Å; H289-L291 HydrophobicContact CB-CD2 4.1Å; H289-L291 HydrophobicContact CB-CG 4.34Å; H289-L308 HydrophobicContact CB-CD1 4.05Å; H289-L308 PolarHBondContact N-O 3.02Å; H289-L308 PolarHBondContact O-N 2.81Å
290	I	91.5	Very high	80.4	Confident	108 Å²	108	86.5 Å²	86.5	55%	0.554	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	97.3	177.7	-60.8	-179.9	0	0	0	106.1	V305 V307	I290-V305 HydrophobicContact CG2-CG1 3.38Å; I290-V307 HydrophobicContact CG1-CG1 4.39Å; I290-V307 HydrophobicContact CG1-CG2 4.47Å
291	L	89.4	Confident	79.8	Confident	23 Å²	23	89.9 Å²	89.9	12%	0.12	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.1	-171.9	-57.4	-176.9	0	0	0	110.2	V258 A274 V276 H289 V305 I306 L308	V258-L291 HydrophobicContact CG2-CD1 4.07Å; A274-L291 HydrophobicContact CB-CB 3.79Å; A274-L291 HydrophobicContact CB-CD1 4.01Å; A274-L291 HydrophobicContact CB-CG 4.44Å; V276-L291 HydrophobicContact CG2-CD1 3.6Å; V276-L291 HydrophobicContact CG2-CD2 3.86Å; V276-L291 HydrophobicContact CG2-CG 4.37Å; H289-L291 HydrophobicContact CB-CD2 4.1Å; H289-L291 HydrophobicContact CB-CG 4.34Å; L291-V305 CarbonylContact O-C 3.59Å; L291-V305 WeakPolarHBondContact O-CA 3.24Å; L291-I306 PolarHBondContact N-O 3.3Å; L291-I306 PolarHBondContact O-N 2.8Å; L291-L308 HydrophobicContact CD1-CD1 4.38Å; L291-L308 HydrophobicContact CD1-CD2 3.89Å; L291-L308 HydrophobicContact CD1-CG 4.26Å
292	K	89.4	Confident	79.8	Confident	158 Å²	158	93.5 Å²	93.5	69%	0.687	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	146.1	165.6	-65.7	-168.3	172.8	-164	0	110.2	A274 V305	A274-K292 WeakPolarHBondContact CB-O 3.17Å; K292-V305 HydrophobicContact CG-CG2 4.34Å
293	L	90.5	Very high	80.1	Confident	9 Å²	9	89 Å²	89	5%	0.047	46%	0.456	C	S	.	.			trans	-96.1	139.5	176.4	-63.7	172.2	0	0	0	110.6	L205 V260 A274 M303 G304 I306	L205-L293 HydrophobicContact CD2-CD1 3.57Å; V260-L293 HydrophobicContact CB-CD1 4.3Å; V260-L293 HydrophobicContact CG2-CD1 3.61Å; V260-L293 HydrophobicContact CG2-CD2 3.85Å; V260-L293 HydrophobicContact CG2-CG 4.41Å; A274-L293 HydrophobicContact CB-CD2 4.36Å; L293-M303 HydrophobicContact CB-CB 3.8Å; L293-M303 WeakPolarHBondContact O-CB 3.39Å; L293-G304 WeakPolarHBondContact CB-O 3.45Å; L293-G304 PolarHBondContact N-O 3.21Å; L293-I306 HydrophobicContact CD1-CG1 4.28Å; L293-I306 HydrophobicContact CD2-CD1 3.91Å; L293-I306 HydrophobicContact CD2-CG1 4.05Å; L293-I306 HydrophobicContact CG-CG1 4.39Å
294	E	86.8	Confident	80.7	Confident	122 Å²	122	84.9 Å²	84.9	57%	0.57	44%	0.435	S	S	*	.	B	Isolated β-bridge	trans	-129.2	136.8	178.8	-65.2	172.6	-178.2	0	0	109.6	S273	S273-E294 PolarHBondContact N-O 3.02Å; S273-E294 PolarHBondContact O-N 2.87Å; S273-E294 PolarHBondContact OG-O 2.69Å
295	D	83.4	Confident	81.6	Confident	26 Å²	26	81.2 Å²	81.2	14%	0.139	42%	0.416	C	S	.	.			trans	-130.5	111.5	167.3	-174.5	6.4	0	0	0	109.5	F270 N297 S298 M303	F270-D295 HydrophobicContact CD1-CB 4.38Å; F270-D295 WeakPolarHBondContact CD1-OD2 3.35Å; F270-D295 HydrophobicContact CE1-CB 3.89Å; F270-D295 VanDerWaalsContact CE1-CG 3.42Å; F270-D295 WeakPolarHBondContact CE1-OD1 3.26Å; D295-N297 PolarHBondContact O-N 3.09Å; D295-N297 PolarHBondContact OD1-N 3.43Å; D295-N297 VanDerWaalsContact OD1-N 3.08Å; D295-S298 PolarHBondContact O-N 3.48Å; D295-M303 HydrophobicContact CB-CE 3.93Å; D295-M303 HydrophobicContact CB-SD 4.48Å
296	P	74.9	Confident	82.2	Confident	119 Å²	119	74.5 Å²	74.5	77%	0.773	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-5.9	178.2	30.3	-37.3	0	0	0	113.6
297	N	70.1	Confident	82.7	Confident	146 Å²	146	70.6 Å²	70.6	78%	0.781	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-1.8	178.5	-63.9	0.1	0	0	0	113.7	D295	D295-N297 PolarHBondContact O-N 3.09Å; D295-N297 PolarHBondContact OD1-N 3.43Å; D295-N297 VanDerWaalsContact OD1-N 3.08Å
298	S	71.4	Confident	83.2	Confident	34 Å²	34	69.4 Å²	69.4	24%	0.238	36%	0.36	C	S	.	.			trans	-97.7	161.6	178.1	-158.7	0	0	0	0	113	R208 D295 E300	R208-S298 PolarHBondContact NH2-OG 2.95Å; D295-S298 PolarHBondContact O-N 3.48Å; S298-E300 PolarHBondContact OG-N 3.31Å; S298-E300 PolarHBondContact OG-OE2 2.91Å
299	L	65.5	Low	83.3	Confident	181 Å²	181	65.8 Å²	65.8	95%	0.948	34%	0.344	S	S	*	.			trans	-106.8	17.4	172.7	-63.4	174.1	0	0	0	111.8
300	E	71.8	Confident	83.4	Confident	78 Å²	78	63.5 Å²	63.5	36%	0.364	33%	0.333	S	S	.	.			trans	-105.5	119.1	-173.6	-64.1	161.5	134.9	0	0	110.4	V206 R208 S298 D302 M303	V206-E300 WeakPolarHBondContact CG2-OE1 3.26Å; R208-E300 IonicContact CZ-OE2 3.1Å; R208-E300 IonicContact NE-OE1 3.92Å; R208-E300 IonicContact NE-OE2 2.72Å; R208-E300 PolarHBondContact NE-OE2 3.38Å; R208-E300 IonicContact NH2-OE2 3.15Å; R208-E300 PolarHBondContact NH2-OE2 3.05Å; S298-E300 PolarHBondContact OG-N 3.31Å; S298-E300 PolarHBondContact OG-OE2 2.91Å; E300-D302 VanDerWaalsContact C-N 3.34Å; E300-D302 PolarHBondContact O-N 2.65Å; E300-M303 HydrophobicContact CB-SD 4.04Å
301	D	67.2	Low	83.1	Confident	179 Å²	179	59.7 Å²	59.7	96%	0.957	31%	0.314	S	S	*	.	S	Bend	trans	-71.3	-21	-174.1	-69.4	-47.7	0	0	0	114.8
302	D	79.8	Confident	82.8	Confident	85 Å²	85	58.6 Å²	58.6	46%	0.455	31%	0.308	S	S	.	.			trans	-132.6	107.7	173.2	-175.3	22	0	0	0	110.7	N204 E300 G304	N204-D302 PolarHBondContact ND2-OD2 2.86Å; E300-D302 VanDerWaalsContact C-N 3.34Å; E300-D302 PolarHBondContact O-N 2.65Å; D302-G304 VanDerWaalsContact C-N 3.31Å; D302-G304 PolarHBondContact OD1-N 2.79Å
303	M	82.1	Confident	82.4	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.03	28%	0.284	C	S	.	.			trans	-86.1	-4.4	175.4	-63.9	-71.8	-63.8	0	0	112.6	V206 M271 L293 D295 E300	V206-M303 HydrophobicContact CB-SD 4.5Å; V206-M303 HydrophobicContact CG1-CE 3.86Å; V206-M303 HydrophobicContact CG1-SD 4.41Å; V206-M303 PolarHBondContact N-O 2.84Å; M271-M303 VanDerWaalsContact C-CE 3.42Å; L293-M303 HydrophobicContact CB-CB 3.8Å; L293-M303 WeakPolarHBondContact O-CB 3.39Å; D295-M303 HydrophobicContact CB-CE 3.93Å; D295-M303 HydrophobicContact CB-SD 4.48Å; E300-M303 HydrophobicContact CB-SD 4.04Å
304	G	88.7	Confident	81.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.299	C	S	.	.			trans	91.6	-173.6	-174.2	0	0	0	0	0	114.5	R203 N204 L293 D302	R203-G304 WeakPolarHBondContact O-CA 3.32Å; N204-G304 WeakPolarHBondContact O-CA 3.19Å; L293-G304 WeakPolarHBondContact CB-O 3.45Å; L293-G304 PolarHBondContact N-O 3.21Å; D302-G304 VanDerWaalsContact C-N 3.31Å; D302-G304 PolarHBondContact OD1-N 2.79Å
305	V	92.5	Very high	80.3	Confident	27 Å²	27	54.7 Å²	54.7	16%	0.164	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.4	-165.4	-178.7	0	0	0	0	111.2	G202 R203 I290 L291 K292	G202-V305 CarbonylContact C-O 3.45Å; G202-V305 WeakPolarHBondContact CA-O 3.43Å; R203-V305 PolarHBondContact N-O 3.05Å; R203-V305 PolarHBondContact O-N 3.31Å; I290-V305 HydrophobicContact CG2-CG1 3.38Å; L291-V305 CarbonylContact O-C 3.59Å; L291-V305 WeakPolarHBondContact O-CA 3.24Å; K292-V305 HydrophobicContact CG-CG2 4.34Å
306	I	93.1	Very high	78.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.6	167.1	-52.4	174.8	0	0	0	109.9	L199 V218 V258 V260 L291 L293 L308	L199-I306 HydrophobicContact CD1-CG2 3.45Å; L199-I306 VanDerWaalsContact CD1-CG2 3.45Å; V218-I306 HydrophobicContact CG1-CD1 4.37Å; V218-I306 HydrophobicContact CG2-CD1 4.35Å; V258-I306 HydrophobicContact CB-CD1 4.49Å; V258-I306 HydrophobicContact CG1-CD1 3.51Å; V260-I306 HydrophobicContact CG2-CD1 3.53Å; V260-I306 HydrophobicContact CG2-CG1 4.04Å; L291-I306 PolarHBondContact N-O 3.3Å; L291-I306 PolarHBondContact O-N 2.8Å; L293-I306 HydrophobicContact CD1-CG1 4.28Å; L293-I306 HydrophobicContact CD2-CD1 3.91Å; L293-I306 HydrophobicContact CD2-CG1 4.05Å; L293-I306 HydrophobicContact CG-CG1 4.39Å; I306-L308 HydrophobicContact CG2-CB 4.47Å; I306-L308 HydrophobicContact CG2-CD2 4.01Å; I306-L308 HydrophobicContact CG2-CG 4.47Å
307	V	92.5	Very high	76.9	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.4	166.5	-170.2	0	0	0	0	109.4	K200 E201 E288 I290	K200-V307 WeakPolarHBondContact CB-O 3Å; K200-V307 HydrophobicContact CD-CG1 4.09Å; K200-V307 PolarHBondContact N-O 2.76Å; K200-V307 VanDerWaalsContact N-O 3.14Å; E201-V307 HydrophobicContact CG-CB 3.94Å; E201-V307 HydrophobicContact CG-CG2 4.07Å; E201-V307 PolarHBondContact N-O 3.16Å; E201-V307 PolarHBondContact O-N 3.27Å; E288-V307 HydrophobicContact CG-CG1 4.17Å; E288-V307 VanDerWaalsContact OE1-CG1 3.25Å; E288-V307 WeakPolarHBondContact OE1-CG1 3.4Å; I290-V307 HydrophobicContact CG1-CG1 4.39Å; I290-V307 HydrophobicContact CG1-CG2 4.47Å
308	L	92.1	Very high	75.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	148.7	177.4	58.1	83.7	0	0	0	112.1	H198 F220 V258 H289 L291 I306 L310	H198-L308 CarbonylContact O-C 3.57Å; H198-L308 WeakPolarHBondContact O-CA 3.41Å; H198-L308 WeakPolarHBondContact O-CB 3.1Å; F220-L308 HydrophobicContact CE1-CD2 4.08Å; F220-L308 HydrophobicContact CZ-CD2 4.38Å; V258-L308 HydrophobicContact CG2-CD2 4.36Å; H289-L308 HydrophobicContact CB-CD1 4.05Å; H289-L308 PolarHBondContact N-O 3.02Å; H289-L308 PolarHBondContact O-N 2.81Å; L291-L308 HydrophobicContact CD1-CD1 4.38Å; L291-L308 HydrophobicContact CD1-CD2 3.89Å; L291-L308 HydrophobicContact CD1-CG 4.26Å; I306-L308 HydrophobicContact CG2-CB 4.47Å; I306-L308 HydrophobicContact CG2-CD2 4.01Å; I306-L308 HydrophobicContact CG2-CG 4.47Å; L308-L310 HydrophobicContact CD1-CD1 3.86Å; L308-L310 HydrophobicContact CD1-CD2 3.77Å; L308-L310 HydrophobicContact CD1-CG 3.57Å
309	N	90.4	Very high	73.4	Confident	30 Å²	30	67.8 Å²	67.8	16%	0.16	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	141	172.4	-55.8	3.4	0	0	0	110.7	I197 H198 K200 T286 T287	I197-N309 CarbonylContact C-O 3.59Å; I197-N309 WeakPolarHBondContact CA-O 3.35Å; H198-N309 HydrophobicContact CB-CB 4.1Å; H198-N309 PolarHBondContact N-O 2.85Å; H198-N309 PolarHBondContact O-N 2.89Å; K200-N309 WeakPolarHBondContact CE-OD1 3.2Å; T286-N309 HydrophobicContact CG2-CB 3.73Å; T287-N309 CarbonylContact O-C 3.49Å; T287-N309 WeakPolarHBondContact O-CA 3.05Å
310	L	88.2	Confident	71.8	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.5	178.2	-63.3	175.1	0	0	0	110.2	L195 T196 I197 L256 V276 L281 T286 T287 L308	L195-L310 HydrophobicContact CD1-CB 4.35Å; L195-L310 HydrophobicContact CD1-CD2 4.28Å; L195-L310 HydrophobicContact CD2-CD2 4.4Å; T196-L310 WeakPolarHBondContact O-CA 3.08Å; I197-L310 HydrophobicContact CB-CD2 4.05Å; I197-L310 HydrophobicContact CD1-CD2 4.47Å; I197-L310 HydrophobicContact CG1-CD2 3.69Å; I197-L310 HydrophobicContact CG2-CD2 3.83Å; L256-L310 HydrophobicContact CD2-CD2 4.42Å; V276-L310 HydrophobicContact CB-CD1 4.35Å; V276-L310 HydrophobicContact CG1-CD1 3.77Å; V276-L310 HydrophobicContact CG2-CD1 4.21Å; L281-L310 HydrophobicContact CD1-CB 4.17Å; L281-L310 HydrophobicContact CD1-CD1 4.07Å; L281-L310 HydrophobicContact CD2-CB 4.02Å; L281-L310 HydrophobicContact CD2-CD1 3.72Å; T286-L310 CarbonylContact C-O 3.57Å; T286-L310 WeakPolarHBondContact CA-O 3.07Å; T287-L310 PolarHBondContact N-O 3.42Å; T287-L310 PolarHBondContact O-N 2.88Å; T287-L310 PolarHBondContact OG1-O 3.1Å; L308-L310 HydrophobicContact CD1-CD1 3.86Å; L308-L310 HydrophobicContact CD1-CD2 3.77Å; L308-L310 HydrophobicContact CD1-CG 3.57Å
311	N	85.5	Confident	69.9	Low	28 Å²	28	76.2 Å²	76.2	15%	0.15	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	116.2	172.5	-173.6	-35.4	0	0	0	110	T196 R285 T286 V313	T196-N311 PolarHBondContact N-O 3.01Å; T196-N311 PolarHBondContact O-N 2.52Å; R285-N311 WeakPolarHBondContact O-CA 3.33Å; T286-N311 PolarHBondContact N-ND2 3.39Å; T286-N311 PolarHBondContact OG1-ND2 3.35Å; N311-V313 WeakPolarHBondContact OD1-CG2 3.2Å
312	L	83.6	Confident	68.3	Low	1 Å²	1	75.9 Å²	75.9	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	107.3	-174.1	-178.7	67.8	0	0	0	110.2	L195 L252 L281 L283 N284	L195-L312 HydrophobicContact CB-CD1 4.25Å; L195-L312 HydrophobicContact CD1-CB 4.18Å; L195-L312 HydrophobicContact CD1-CD1 4.2Å; L252-L312 HydrophobicContact CD1-CD2 4.26Å; L252-L312 HydrophobicContact CD2-CD1 4.09Å; L252-L312 HydrophobicContact CD2-CD2 3.68Å; L252-L312 HydrophobicContact CD2-CG 4.39Å; L281-L312 HydrophobicContact CB-CB 4.21Å; L281-L312 HydrophobicContact CB-CD2 4.04Å; L281-L312 HydrophobicContact CD1-CB 4.46Å; L283-L312 CarbonylContact C-O 3.6Å; L283-L312 WeakPolarHBondContact CA-O 3.28Å; L283-L312 HydrophobicContact CD2-CB 4.38Å; L283-L312 HydrophobicContact CD2-CD2 3.61Å; L283-L312 HydrophobicContact CD2-CG 3.75Å; N284-L312 PolarHBondContact N-O 2.85Å
313	V	80.9	Confident	65.7	Low	30 Å²	30	84 Å²	84	18%	0.182	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.7	-175.8	176.3	0	0	0	0	110.8	Y193 L194 N311	Y193-V313 CarbonylContact C-O 3.52Å; Y193-V313 WeakPolarHBondContact CA-O 3.22Å; L194-V313 PolarHBondContact N-O 3.23Å; L194-V313 PolarHBondContact O-N 3.21Å; N311-V313 WeakPolarHBondContact OD1-CG2 3.2Å
314	V	73.7	Confident	62.9	Low	58 Å²	58	95.1 Å²	95.1	35%	0.352	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132.3	174.2	-170.9	0	0	0	0	110.1	Y193 L283 Q316	Y193-V314 HydrophobicContact CD1-CG2 4.17Å; Y193-V314 HydrophobicContact CE1-CG1 4.36Å; Y193-V314 HydrophobicContact CE1-CG2 4.02Å; L283-V314 HydrophobicContact CD1-CG2 4.11Å; L283-V314 HydrophobicContact CD2-CG2 3.93Å; L283-V314 HydrophobicContact CG-CG2 4.47Å; V314-Q316 PolarHBondContact O-N 3.23Å
315	K	59.7	Low	60	Low	118 Å²	118	100.5 Å²	100.5	51%	0.513	47%	0.472	S	S	.	.			trans	-77.4	88.5	171.6	-170.1	-171.5	-179.7	-172.6	0	109.5	F191 A192 G317	F191-K315 VanDerWaalsContact O-CD 3.25Å; F191-K315 WeakPolarHBondContact O-CD 3.26Å; A192-K315 VanDerWaalsContact O-CB 3.24Å; A192-K315 WeakPolarHBondContact O-CB 3.41Å; A192-K315 PolarHBondContact O-N 3.22Å; K315-G317 PolarHBondContact O-N 3.48Å
316	Q	47.3	Very low	57.2	Low	176 Å²	176	106.2 Å²	106.2	82%	0.822	50%	0.501	S	S	*	.			trans	-59.5	110	174.6	-173.8	169.5	48.2	0	0	110.3	V314	V314-Q316 PolarHBondContact O-N 3.23Å
317	G	39.3	Very low	54.2	Low	51 Å²	51	117.6 Å²	117.6	53%	0.526	54%	0.544	S	S	.	.			trans	-87.5	136.3	174.9	0	0	0	0	0	111.8	K315 F319	K315-G317 PolarHBondContact O-N 3.48Å; G317-F319 VanDerWaalsContact C-N 3.31Å; G317-F319 PolarHBondContact O-N 3.11Å
318	D	34.6	Very low	51.5	Low	171 Å²	171	127.1 Å²	127.1	91%	0.914	59%	0.586	S	S	*	*			trans	-73.5	75	-177.1	-76.7	-54.3	0	0	0	113.4	K320	D318-K320 PolarHBondContact O-N 2.96Å
319	F	33.3	Very low	48.6	Very low	202 Å²	202	138.9 Å²	138.9	89%	0.886	63%	0.63	S	S	*	*			trans	-87.1	96.2	166.2	-82.9	-78	0	0	0	111.6	G317	G317-F319 VanDerWaalsContact C-N 3.31Å; G317-F319 PolarHBondContact O-N 3.11Å
320	K	32.2	Very low	46	Very low	205 Å²	205	145.8 Å²	145.8	89%	0.891	67%	0.666	S	S	*	*			trans	-165.3	117.8	149.5	-108.7	147.3	-169.7	173	0	113.8	D318	D318-K320 PolarHBondContact O-N 2.96Å
321	R	31.1	Very low	43.3	Very low	232 Å²	232	151.2 Å²	151.2	88%	0.875	70%	0.704	S	S	*	*			trans	-86.7	136.4	154	-93.8	-178.2	170.6	170.2	-2.4	109.2
322	H	32.9	Very low	40.6	Very low	172 Å²	172	154.9 Å²	154.9	80%	0.796	74%	0.739	S	S	*	*			trans	27.6	114.6	159.6	-54.6	-81.5	0	0	0	120.5
323	R	25.9	Very low	38	Very low	255 Å²	255	158 Å²	158	96%	0.962	76%	0.76	S	S	*	*				-155.9	152.4	114.2	-109.9	177.2	-171	-171.2	3.3	111.3
324	W	23.7	Very low	35.6	Very low	239 Å²	239	164.8 Å²	164.8	91%	0.905	79%	0.787	S	S	*	*			trans	-76.6	142.2	-176.1	-122.2	-62	0	0	0	112.2
325	S	27	Very low	33.6	Very low	114 Å²	114	165.6 Å²	165.6	80%	0.797	80%	0.796	S	S	*	*			trans	-161.9	139.5	136	56.2	0	0	0	0	110.7
326	N	33.2	Very low	32.3	Very low	146 Å²	146	163.1 Å²	163.1	78%	0.781	79%	0.793	S	S	*	*			trans	-84.5	121.8	178.3	-86.1	-23.3	0	0	0	111.2
327	R	31.4	Very low	31.6	Very low	239 Å²	239	160.1 Å²	160.1	90%	0.902	78%	0.782	S	S	*	*			trans	-154.3	120.6	148.6	-153.9	161	-72.1	-162.7	-2.1	111.8
328	K	35.7	Very low	31.3	Very low	201 Å²	201	162.9 Å²	162.9	87%	0.874	78%	0.784	S	S	*	*			trans	-65	132.1	170.2	-67.2	177.5	177.6	177.2	0	109.6
329	R	30.3	Very low	31	Very low	248 Å²	248	162.4 Å²	162.4	94%	0.936	77%	0.769	S	S	*	*			trans	-154.2	137.6	148.7	-110.3	177.1	-167.6	-159.7	1.3	110
330	L	36.5	Very low	31	Very low	175 Å²	175	157.8 Å²	157.8	92%	0.916	75%	0.754	S	S	*	*			trans	-81.1	120.7	179.6	-72.9	70.1	0	0	0	109.1
331	S	30.8	Very low	31	Very low	115 Å²	115	152.7 Å²	152.7	80%	0.804	74%	0.735	S	S	*	*			trans	-163.1	78.6	157.7	-166.5	0	0	0	0	109.4	S333	S331-S333 PolarHBondContact O-N 2.84Å
332	A	28.4	Very low	31.1	Very low	105 Å²	105	148.1 Å²	148.1	87%	0.868	72%	0.718	S	S	*	*			trans	-71.5	111.3	172.9	0	0	0	0	0	108.6
333	S	29.5	Very low	31.1	Very low	66 Å²	66	145 Å²	145	46%	0.462	71%	0.707	S	S	.	*			trans	-62.9	135.4	-168.6	-179.3	0	0	0	0	113.4	S331 S335 S336	S331-S333 PolarHBondContact O-N 2.84Å; S333-S335 PolarHBondContact O-N 3.25Å; S333-S335 VanDerWaalsContact O-N 3.08Å; S333-S335 WeakPolarHBondContact OG-CB 3.3Å; S333-S335 PolarHBondContact OG-N 3.46Å; S333-S335 VanDerWaalsContact OG-N 3.12Å; S333-S335 PolarHBondContact OG-OG 3.29Å; S333-S336 PolarHBondContact O-N 2.94Å; S333-S336 PolarHBondContact O-OG 2.75Å; S333-S336 VanDerWaalsContact O-OG 3.11Å
334	K	31.5	Very low	31.5	Very low	173 Å²	173	135.1 Å²	135.1	75%	0.752	68%	0.677	S	S	*	*	H	α-helix	trans	-57.8	-20	170	-63.8	-179	178.8	-179.2	0	113	S336 L337 I338	K334-S336 PolarHBondContact O-N 3.31Å; K334-L337 PolarHBondContact O-N 2.74Å; K334-I338 WeakPolarHBondContact O-CG1 3.06Å; K334-I338 PolarHBondContact O-N 3.06Å; K334-I338 VanDerWaalsContact O-N 3.15Å
335	S	31	Very low	32.1	Very low	75 Å²	75	128.5 Å²	128.5	52%	0.524	66%	0.656	S	S	.	*	H	α-helix	trans	-69.3	-27.2	-178.7	62.7	0	0	0	0	114.9	S333 R339	S333-S335 PolarHBondContact O-N 3.25Å; S333-S335 VanDerWaalsContact O-N 3.08Å; S333-S335 WeakPolarHBondContact OG-CB 3.3Å; S333-S335 PolarHBondContact OG-N 3.46Å; S333-S335 VanDerWaalsContact OG-N 3.12Å; S333-S335 PolarHBondContact OG-OG 3.29Å; S335-R339 PolarHBondContact O-N 3.02Å; S335-R339 VanDerWaalsContact O-N 3.16Å
336	S	32.7	Very low	32.5	Very low	66 Å²	66	126 Å²	126	46%	0.462	64%	0.639	S	S	.	*	H	α-helix	trans	-74.4	-39.5	176.5	60.5	0	0	0	0	111.7	S333 K334 R339 N340	S333-S336 PolarHBondContact O-N 2.94Å; S333-S336 PolarHBondContact O-OG 2.75Å; S333-S336 VanDerWaalsContact O-OG 3.11Å; K334-S336 PolarHBondContact O-N 3.31Å; S336-R339 PolarHBondContact O-N 2.74Å; S336-N340 PolarHBondContact O-N 2.65Å; S336-N340 VanDerWaalsContact O-N 3.09Å; S336-N340 PolarHBondContact O-ND2 2.63Å
337	L	31.7	Very low	32.7	Very low	113 Å²	113	122.1 Å²	122.1	59%	0.592	62%	0.617	S	S	*	*	H	α-helix	trans	-60.5	-46.8	171.4	-74.9	168.6	0	0	0	111.1	K334 R339 N340 L341	K334-L337 PolarHBondContact O-N 2.74Å; L337-R339 PolarHBondContact O-N 2.65Å; L337-N340 PolarHBondContact O-N 2.93Å; L337-L341 WeakPolarHBondContact O-CD1 3.45Å; L337-L341 PolarHBondContact O-N 2.73Å
338	I	33.7	Very low	33	Very low	108 Å²	108	116.3 Å²	116.3	55%	0.554	60%	0.599	S	S	*	*	H	α-helix	trans	-64.3	-38.7	-178.9	-66.4	165.5	0	0	0	112	K334 R342	K334-I338 WeakPolarHBondContact O-CG1 3.06Å; K334-I338 PolarHBondContact O-N 3.06Å; K334-I338 VanDerWaalsContact O-N 3.15Å; I338-R342 WeakPolarHBondContact O-CB 3.34Å; I338-R342 PolarHBondContact O-N 2.91Å
339	R	29.5	Very low	33.2	Very low	161 Å²	161	115.3 Å²	115.3	61%	0.608	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-43.8	172.9	-86.8	-174.1	175.6	154.9	1.5	112.3	S335 S336 L337 R342 L343	S335-R339 PolarHBondContact O-N 3.02Å; S335-R339 VanDerWaalsContact O-N 3.16Å; S336-R339 PolarHBondContact O-N 2.74Å; L337-R339 PolarHBondContact O-N 2.65Å; R339-R342 PolarHBondContact O-N 3.14Å; R339-L343 WeakPolarHBondContact O-CB 3.47Å; R339-L343 PolarHBondContact O-N 3.21Å
340	N	31.7	Very low	33.6	Very low	106 Å²	106	106.5 Å²	106.5	57%	0.567	57%	0.566	S	S	*	*	H	α-helix	trans	-69.2	-34.7	178.7	-73	-29.4	0	0	0	112.7	S336 L337 S344	S336-N340 PolarHBondContact O-N 2.65Å; S336-N340 VanDerWaalsContact O-N 3.09Å; S336-N340 PolarHBondContact O-ND2 2.63Å; L337-N340 PolarHBondContact O-N 2.93Å; N340-S344 VanDerWaalsContact O-CB 3.23Å; N340-S344 WeakPolarHBondContact O-CB 3.24Å; N340-S344 PolarHBondContact O-N 2.75Å; N340-S344 PolarHBondContact O-OG 2.89Å
341	L	32.4	Very low	34.2	Very low	97 Å²	97	100.5 Å²	100.5	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-53.3	168.9	-93.9	85.4	0	0	0	110.4	L337 L343 S344 E345	L337-L341 WeakPolarHBondContact O-CD1 3.45Å; L337-L341 PolarHBondContact O-N 2.73Å; L341-L343 VanDerWaalsContact C-N 3.34Å; L341-L343 PolarHBondContact O-N 2.87Å; L341-S344 CarbonylContact O-C 3.6Å; L341-S344 PolarHBondContact O-N 3.08Å; L341-S344 VanDerWaalsContact O-N 3.11Å; L341-S344 PolarHBondContact O-OG 3.11Å; L341-S344 VanDerWaalsContact O-OG 3.06Å; L341-E345 WeakPolarHBondContact O-CB 3.07Å; L341-E345 WeakPolarHBondContact O-CG 3.23Å; L341-E345 PolarHBondContact O-N 3.36Å
342	R	34.3	Very low	35.1	Very low	136 Å²	136	98.4 Å²	98.4	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-33.6	-173.8	-143.4	174.6	-164.6	-173.6	3	113.5	I338 R339 S346	I338-R342 WeakPolarHBondContact O-CB 3.34Å; I338-R342 PolarHBondContact O-N 2.91Å; R339-R342 PolarHBondContact O-N 3.14Å; R342-S346 PolarHBondContact O-N 3.43Å
343	L	32.3	Very low	36.4	Very low	106 Å²	106	94.1 Å²	94.1	56%	0.555	47%	0.474	S	S	*	.	H	α-helix	trans	-73.8	-39.6	171	-85.4	164.9	0	0	0	112.4	R339 L341 E345 S346 L347	R339-L343 WeakPolarHBondContact O-CB 3.47Å; R339-L343 PolarHBondContact O-N 3.21Å; L341-L343 VanDerWaalsContact C-N 3.34Å; L341-L343 PolarHBondContact O-N 2.87Å; L343-E345 VanDerWaalsContact C-N 3.31Å; L343-E345 PolarHBondContact O-N 3.04Å; L343-S346 WeakPolarHBondContact O-CB 3.43Å; L343-S346 PolarHBondContact O-N 3Å; L343-L347 WeakPolarHBondContact O-CB 3.36Å; L343-L347 WeakPolarHBondContact O-CG 3.36Å; L343-L347 PolarHBondContact O-N 3.31Å
344	S	35.2	Very low	37.9	Very low	48 Å²	48	93 Å²	93	34%	0.336	46%	0.463	S	S	.	.	H	α-helix	trans	-70.4	-25.2	173.8	63.6	0	0	0	0	113.1	N340 L341 K348	N340-S344 VanDerWaalsContact O-CB 3.23Å; N340-S344 WeakPolarHBondContact O-CB 3.24Å; N340-S344 PolarHBondContact O-N 2.75Å; N340-S344 PolarHBondContact O-OG 2.89Å; L341-S344 CarbonylContact O-C 3.6Å; L341-S344 PolarHBondContact O-N 3.08Å; L341-S344 VanDerWaalsContact O-N 3.11Å; L341-S344 PolarHBondContact O-OG 3.11Å; L341-S344 VanDerWaalsContact O-OG 3.06Å; S344-K348 VanDerWaalsContact O-CB 3.24Å; S344-K348 WeakPolarHBondContact O-CB 3.43Å; S344-K348 WeakPolarHBondContact O-CD 3.32Å; S344-K348 WeakPolarHBondContact O-CG 3.37Å; S344-K348 PolarHBondContact O-N 2.88Å
345	E	34.5	Very low	39.5	Very low	100 Å²	100	84.8 Å²	84.8	47%	0.467	43%	0.427	S	S	.	.	H	α-helix	trans	-70.8	-41.4	167.6	-74.8	175.1	151.6	0	0	111.6	L341 L343 L347 K348 K349	L341-E345 WeakPolarHBondContact O-CB 3.07Å; L341-E345 WeakPolarHBondContact O-CG 3.23Å; L341-E345 PolarHBondContact O-N 3.36Å; L343-E345 VanDerWaalsContact C-N 3.31Å; L343-E345 PolarHBondContact O-N 3.04Å; E345-L347 VanDerWaalsContact C-N 3.33Å; E345-K348 PolarHBondContact O-N 3.17Å; E345-K349 WeakPolarHBondContact O-CB 3.48Å; E345-K349 WeakPolarHBondContact O-CG 3.37Å; E345-K349 PolarHBondContact O-N 3.33Å
346	S	36.4	Very low	41.4	Very low	62 Å²	62	82.1 Å²	82.1	43%	0.434	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-41.1	172.3	-169.3	0	0	0	0	111.9	R342 L343 K349 N350	R342-S346 PolarHBondContact O-N 3.43Å; L343-S346 WeakPolarHBondContact O-CB 3.43Å; L343-S346 PolarHBondContact O-N 3Å; S346-K349 PolarHBondContact O-N 2.73Å; S346-N350 PolarHBondContact O-N 3.17Å
347	L	38.2	Very low	43.4	Very low	64 Å²	64	79 Å²	79	34%	0.335	39%	0.385	S	S	.	.	H	α-helix	trans	-73.2	-36.7	177.2	-70.1	169.8	0	0	0	111.8	L343 E345 N350 Q351	L343-L347 WeakPolarHBondContact O-CB 3.36Å; L343-L347 WeakPolarHBondContact O-CG 3.36Å; L343-L347 PolarHBondContact O-N 3.31Å; E345-L347 VanDerWaalsContact C-N 3.33Å; L347-N350 CarbonylContact O-C 3.56Å; L347-N350 PolarHBondContact O-N 3.24Å; L347-N350 VanDerWaalsContact O-N 3.15Å; L347-Q351 VanDerWaalsContact O-CG 3.31Å; L347-Q351 WeakPolarHBondContact O-CG 3.35Å; L347-Q351 PolarHBondContact O-N 2.91Å
348	K	37.2	Very low	45.5	Very low	117 Å²	117	73.6 Å²	73.6	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-41.3	169.8	-79.4	165.2	-177.5	176.2	0	112.1	S344 E345 N350 Q351	S344-K348 VanDerWaalsContact O-CB 3.24Å; S344-K348 WeakPolarHBondContact O-CB 3.43Å; S344-K348 WeakPolarHBondContact O-CD 3.32Å; S344-K348 WeakPolarHBondContact O-CG 3.37Å; S344-K348 PolarHBondContact O-N 2.88Å; E345-K348 PolarHBondContact O-N 3.17Å; K348-N350 PolarHBondContact O-N 2.97Å; K348-Q351 PolarHBondContact O-N 3.41Å
349	K	38.8	Very low	47.8	Very low	181 Å²	181	68.5 Å²	68.5	79%	0.787	33%	0.331	S	S	*	.	H	α-helix	trans	-65.8	-20.6	175.3	-77.5	-176.2	174.5	-174.6	0	113.6	E345 S346	E345-K349 WeakPolarHBondContact O-CB 3.48Å; E345-K349 WeakPolarHBondContact O-CG 3.37Å; E345-K349 PolarHBondContact O-N 3.33Å; S346-K349 PolarHBondContact O-N 2.73Å
350	N	39.9	Very low	50.3	Low	63 Å²	63	61.6 Å²	61.6	34%	0.337	31%	0.306	S	S	.	.	H	α-helix	trans	-100.7	-8.8	174.4	-75.8	16.9	0	0	0	113.6	S346 L347 K348 S473 I474	S346-N350 PolarHBondContact O-N 3.17Å; L347-N350 CarbonylContact O-C 3.56Å; L347-N350 PolarHBondContact O-N 3.24Å; L347-N350 VanDerWaalsContact O-N 3.15Å; K348-N350 PolarHBondContact O-N 2.97Å; N350-S473 WeakPolarHBondContact O-CA 3.32Å; N350-I474 WeakPolarHBondContact CB-O 3.28Å; N350-I474 PolarHBondContact ND2-O 2.83Å; N350-I474 PolarHBondContact O-N 2.8Å
351	Q	48.6	Very low	52.7	Low	48 Å²	48	56.5 Å²	56.5	22%	0.224	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-83.3	126.3	171.2	-81.8	173.1	-29.5	0	0	108.7	L347 K348 W353 V472	L347-Q351 VanDerWaalsContact O-CG 3.31Å; L347-Q351 WeakPolarHBondContact O-CG 3.35Å; L347-Q351 PolarHBondContact O-N 2.91Å; K348-Q351 PolarHBondContact O-N 3.41Å; Q351-W353 VanDerWaalsContact C-N 3.3Å; Q351-W353 PolarHBondContact O-N 2.85Å; Q351-V472 WeakPolarHBondContact CA-O 3.44Å
352	L	50.3	Low	55	Low	72 Å²	72	52.3 Å²	52.3	38%	0.377	26%	0.257	S	S	.	.	S	Bend	trans	-71.8	-28.5	178.6	-71.1	124.9	0	0	0	112.2	F408 V472 I474 L542	L352-F408 WeakPolarHBondContact O-CD1 3.42Å; L352-F408 WeakPolarHBondContact O-CE1 3.32Å; L352-V472 HydrophobicContact CD1-CG1 4.05Å; L352-V472 PolarHBondContact N-O 2.9Å; L352-V472 VanDerWaalsContact N-O 3.1Å; L352-I474 HydrophobicContact CD1-CD1 4.02Å; L352-I474 HydrophobicContact CD1-CG1 3.92Å; L352-L542 HydrophobicContact CD1-CD2 3.34Å
353	W	55.8	Low	57.4	Low	15 Å²	15	48 Å²	48	6%	0.057	24%	0.243	C	C	.	.			trans	-146.8	152.5	177.4	57.3	83.1	0	0	0	112.1	Q351 H406 Y407 F408 V472 D540	Q351-W353 VanDerWaalsContact C-N 3.3Å; Q351-W353 PolarHBondContact O-N 2.85Å; W353-H406 HydrophobicContact CB-CB 4.2Å; W353-H406 HydrophobicContact CD2-CB 3.96Å; W353-H406 AromaticContact CD2-CG 3.96Å; W353-H406 AromaticContact CD2-ND1 3.67Å; W353-H406 AromaticContact CE2-CE1 3.97Å; W353-H406 AromaticContact CE2-CG 3.91Å; W353-H406 AromaticContact CE2-ND1 3.52Å; W353-H406 HydrophobicContact CE3-CB 4.31Å; W353-H406 AromaticContact CE3-ND1 3.67Å; W353-H406 HydrophobicContact CG-CB 3.93Å; W353-H406 AromaticContact CH2-CE1 3.61Å; W353-H406 AromaticContact CH2-ND1 3.4Å; W353-H406 WeakPolarHBondContact CH2-ND1 3.44Å; W353-H406 AromaticContact CZ2-CE1 3.47Å; W353-H406 VanDerWaalsContact CZ2-CE1 3.47Å; W353-H406 WeakPolarHBondContact CZ2-CE1 3.13Å; W353-H406 AromaticContact CZ2-ND1 3.38Å; W353-H406 WeakPolarHBondContact CZ2-ND1 3.17Å; W353-H406 AromaticContact CZ3-ND1 3.55Å; W353-Y407 CarbonylContact C-O 3.43Å; W353-Y407 WeakPolarHBondContact CB-O 3.44Å; W353-F408 HydrophobicContact CB-CD1 4.28Å; W353-F408 HydrophobicContact CB-CE1 4.16Å; W353-F408 HydrophobicContact CB-CZ 4.31Å; W353-V472 HydrophobicContact CH2-CB 3.87Å; W353-V472 HydrophobicContact CH2-CG2 3.57Å; W353-V472 HydrophobicContact CZ2-CB 3.82Å; W353-V472 HydrophobicContact CZ2-CG2 3.29Å; W353-V472 HydrophobicContact CZ3-CB 4.42Å; W353-D540 HydrophobicContact CH2-CB 4.04Å; W353-D540 HydrophobicContact CZ2-CB 4.4Å; W353-D540 WeakPolarHBondContact CZ2-OD1 3.49Å
354	N	59.7	Low	59.7	Low	42 Å²	42	42.9 Å²	42.9	23%	0.225	22%	0.216	C	C	.	.	S	Bend	trans	-97.2	-6	-171.4	-62.6	-20.9	0	0	0	113.2	Y407 S409	N354-Y407 HydrophobicContact CB-CD1 4.49Å; N354-Y407 PolarHBondContact N-O 2.66Å; N354-S409 WeakPolarHBondContact ND2-CB 3.26Å; N354-S409 PolarHBondContact ND2-N 3.15Å; N354-S409 PolarHBondContact ND2-OG 3.28Å
355	G	66.1	Low	61.9	Low	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.2	-178.8	177.1	0	0	0	0	0	113.9	Y407 T467	G355-Y407 PolarHBondContact N-O 2.79Å; G355-Y407 PolarHBondContact O-N 3.29Å; G355-T467 CarbonylContact C-O 3.43Å; G355-T467 WeakPolarHBondContact CA-O 3.49Å
356	I	70.9	Confident	63.5	Low	19 Å²	19	43.4 Å²	43.4	10%	0.097	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.1	172.9	-61.7	167.7	0	0	0	108.7	D404 F405 T467	I356-D404 HydrophobicContact CG2-CB 3.91Å; I356-F405 CarbonylContact C-O 3.6Å; I356-F405 VanDerWaalsContact CA-O 3.29Å; I356-F405 WeakPolarHBondContact CA-O 3.32Å; I356-T467 PolarHBondContact N-O 2.93Å; I356-T467 WeakPolarHBondContact O-CA 3.43Å; I356-T467 WeakPolarHBondContact O-CB 3.44Å; I356-T467 PolarHBondContact O-N 3.48Å
357	I	74.4	Confident	65.2	Low	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.9	172.8	-51.6	133.8	0	0	0	107.7	I359 L381 D404 F405 Y407 I438 V464 T465 L466	I357-I359 HydrophobicContact CG2-CD1 4.22Å; I357-I359 HydrophobicContact CG2-CG1 3.74Å; I357-L381 HydrophobicContact CD1-CD2 3.4Å; I357-D404 WeakPolarHBondContact O-CA 3.33Å; I357-F405 HydrophobicContact CB-CB 4.33Å; I357-F405 HydrophobicContact CD1-CB 4.21Å; I357-F405 PolarHBondContact N-O 2.89Å; I357-F405 PolarHBondContact O-N 2.95Å; I357-Y407 HydrophobicContact CD1-CD2 3.97Å; I357-Y407 HydrophobicContact CD1-CG 4.15Å; I357-I438 HydrophobicContact CD1-CD1 3.65Å; I357-I438 HydrophobicContact CD1-CG2 4.09Å; I357-I438 HydrophobicContact CG1-CD1 4.31Å; I357-I438 HydrophobicContact CG1-CG2 3.98Å; I357-I438 HydrophobicContact CG2-CD1 4.34Å; I357-V464 HydrophobicContact CG2-CG1 3.58Å; I357-T465 WeakPolarHBondContact CA-O 3.31Å; I357-L466 HydrophobicContact CG1-CD1 3.51Å
358	S	75.6	Confident	66.3	Low	1 Å²	1	40.9 Å²	40.9	1%	0.007	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.8	169.5	-63.2	0	0	0	0	109.2	Q402 D404 T465 K505	S358-Q402 PolarHBondContact OG-NE2 3.27Å; S358-D404 WeakPolarHBondContact CA-OD1 3.46Å; S358-D404 WeakPolarHBondContact CB-OD1 3.42Å; S358-D404 PolarHBondContact OG-OD1 3.37Å; S358-D404 PolarHBondContact OG-OD2 3.46Å; S358-D404 VanDerWaalsContact OG-OD2 3.11Å; S358-T465 VanDerWaalsContact CB-OG1 3.29Å; S358-T465 WeakPolarHBondContact CB-OG1 3.27Å; S358-T465 PolarHBondContact N-O 3.29Å; S358-T465 PolarHBondContact O-N 2.74Å; S358-T465 PolarHBondContact O-OG1 2.57Å; S358-K505 PolarHBondContact OG-NZ 2.86Å
359	I	82.9	Confident	67.3	Low	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	115	-179.9	-56.1	-176.2	0	0	0	108.1	I357 L379 Q402 F403 F405 L415 M462 L463 V464	I357-I359 HydrophobicContact CG2-CD1 4.22Å; I357-I359 HydrophobicContact CG2-CG1 3.74Å; I359-L379 HydrophobicContact CG2-CD1 4.36Å; I359-Q402 CarbonylContact O-C 3.51Å; I359-Q402 WeakPolarHBondContact O-CA 3.17Å; I359-F403 PolarHBondContact N-O 2.79Å; I359-F403 PolarHBondContact O-N 3.12Å; I359-F405 HydrophobicContact CD1-CD2 3.71Å; I359-F405 HydrophobicContact CD1-CE2 3.72Å; I359-F405 HydrophobicContact CG1-CD2 4.21Å; I359-F405 HydrophobicContact CG1-CE2 4.46Å; I359-L415 HydrophobicContact CD1-CD1 3.75Å; I359-L415 HydrophobicContact CD1-CD2 3.52Å; I359-L415 HydrophobicContact CD1-CG 4.3Å; I359-M462 HydrophobicContact CG2-SD 4.28Å; I359-L463 WeakPolarHBondContact CA-O 3.35Å; I359-V464 HydrophobicContact CG1-CG1 4.41Å; I359-V464 HydrophobicContact CG1-CG2 4.41Å; I359-V464 HydrophobicContact CG2-CG2 4.35Å
360	T	80.5	Confident	68.5	Low	16 Å²	16	29.8 Å²	29.8	10%	0.098	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	109.9	173.4	-40	0	0	0	0	109.3	L362 E401 M462 L463 I837	T360-L362 HydrophobicContact CG2-CD2 3.83Å; T360-E401 CarbonylContact C-O 3.46Å; T360-E401 VanDerWaalsContact CA-O 3.3Å; T360-E401 WeakPolarHBondContact CA-O 3.4Å; T360-M462 CarbonylContact O-C 3.5Å; T360-M462 WeakPolarHBondContact O-CA 3.45Å; T360-M462 VanDerWaalsContact O-CB 3.29Å; T360-M462 WeakPolarHBondContact O-CB 3.28Å; T360-L463 PolarHBondContact N-O 3.34Å; T360-L463 PolarHBondContact O-N 2.53Å; T360-I837 HydrophobicContact CG2-CD1 4.5Å
361	L	82.7	Confident	69.4	Low	0 Å²	0	31 Å²	31	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.1	173.8	-175.9	68.7	0	0	0	108.8	V377 W399 Q400 E401 F403 L460 M462	L361-V377 HydrophobicContact CD1-CG1 4.42Å; L361-V377 HydrophobicContact CD1-CG2 4.37Å; L361-V377 HydrophobicContact CD2-CB 3.78Å; L361-V377 HydrophobicContact CD2-CG1 4.32Å; L361-V377 HydrophobicContact CD2-CG2 3.83Å; L361-W399 HydrophobicContact CD1-CE3 4.45Å; L361-W399 HydrophobicContact CD2-CB 3.76Å; L361-W399 HydrophobicContact CD2-CD2 3.85Å; L361-W399 HydrophobicContact CD2-CE3 4.01Å; L361-W399 HydrophobicContact CD2-CG 3.73Å; L361-W399 HydrophobicContact CG-CB 4.01Å; L361-W399 HydrophobicContact CG-CD2 4.33Å; L361-W399 HydrophobicContact CG-CE3 4.07Å; L361-W399 HydrophobicContact CG-CG 4.33Å; L361-Q400 CarbonylContact O-C 3.57Å; L361-Q400 VanDerWaalsContact O-CA 3.23Å; L361-Q400 WeakPolarHBondContact O-CA 3.26Å; L361-Q400 PolarHBondContact O-N 3.41Å; L361-E401 PolarHBondContact N-O 2.88Å; L361-E401 PolarHBondContact O-N 2.9Å; L361-F403 HydrophobicContact CB-CE2 3.93Å; L361-F403 HydrophobicContact CD2-CE2 4.24Å; L361-L460 HydrophobicContact CD1-CD1 3.92Å; L361-L460 HydrophobicContact CD1-CD2 3.97Å; L361-L460 HydrophobicContact CD1-CG 4Å; L361-M462 HydrophobicContact CD1-CE 4.09Å
362	L	80.7	Confident	70.1	Confident	9 Å²	9	29.2 Å²	29.2	5%	0.047	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	-72.7	-170.5	-58.9	169.8	0	0	0	110.6	T360 W399 Q400 L461 L463 Y835	T360-L362 HydrophobicContact CG2-CD2 3.83Å; L362-W399 PolarHBondContact O-N 2.9Å; L362-Q400 PolarHBondContact O-N 2.88Å; L362-L461 HydrophobicContact CB-CD2 4.44Å; L362-L461 WeakPolarHBondContact CB-O 3.48Å; L362-L461 HydrophobicContact CD1-CD2 4.16Å; L362-L461 HydrophobicContact CD1-CG 4.13Å; L362-L461 PolarHBondContact N-O 2.85Å; L362-L463 HydrophobicContact CD1-CB 4.37Å; L362-Y835 HydrophobicContact CD1-CD1 3.67Å; L362-Y835 HydrophobicContact CD1-CD2 4.14Å; L362-Y835 HydrophobicContact CD1-CE1 3.75Å; L362-Y835 HydrophobicContact CD1-CE2 4.2Å; L362-Y835 HydrophobicContact CD1-CG 3.88Å; L362-Y835 HydrophobicContact CD2-CD1 3.84Å; L362-Y835 HydrophobicContact CD2-CG 3.91Å; L362-Y835 HydrophobicContact CG-CD1 4.28Å
363	E	84.3	Confident	70.6	Confident	44 Å²	44	28.6 Å²	28.6	21%	0.206	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	152	-177.1	64.7	176.5	-160.3	0	0	112.4	K365 P397 Q398 L461	E363-K365 WeakPolarHBondContact OE1-CE 3.34Å; E363-P397 CarbonylContact C-O 3.52Å; E363-P397 VanDerWaalsContact CA-O 3.25Å; E363-P397 WeakPolarHBondContact CA-O 3.42Å; E363-Q398 HydrophobicContact CB-CB 4.49Å; E363-Q398 HydrophobicContact CB-CG 3.88Å; E363-Q398 PolarHBondContact OE2-NE2 2.9Å; E363-L461 HydrophobicContact CG-CB 3.93Å; E363-L461 HydrophobicContact CG-CD2 4.04Å; E363-L461 PolarHBondContact N-O 2.86Å; E363-L461 PolarHBondContact O-N 2.89Å
364	G	81.6	Confident	71.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	138.7	157.5	0	0	0	0	0	109.4	N396 P397 A459	G364-N396 CarbonylContact O-C 3.57Å; G364-N396 WeakPolarHBondContact O-CA 3.24Å; G364-P397 PolarHBondContact N-O 3.19Å; G364-P397 WeakPolarHBondContact O-CD 3.41Å; G364-A459 CarbonylContact C-O 3.55Å; G364-A459 WeakPolarHBondContact CA-O 3.38Å
365	K	79.9	Confident	72.6	Confident	68 Å²	68	28.7 Å²	28.7	30%	0.296	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.6	170.3	-59.9	-177.7	-166.4	169.1	0	109.1	E363 V367 N396 E450 G458 A459	E363-K365 WeakPolarHBondContact OE1-CE 3.34Å; K365-V367 VanDerWaalsContact C-N 3.29Å; K365-V367 PolarHBondContact O-N 2.84Å; K365-N396 WeakPolarHBondContact CA-OD1 3.37Å; K365-E450 WeakPolarHBondContact CD-OE1 3.43Å; K365-E450 WeakPolarHBondContact CE-OE1 3.12Å; K365-E450 IonicContact NZ-OE1 2.79Å; K365-E450 PolarHBondContact NZ-OE1 2.84Å; K365-E450 IonicContact NZ-OE2 3.78Å; K365-E450 PolarHBondContact NZ-OE2 3.09Å; K365-G458 CarbonylContact O-C 3.45Å; K365-G458 WeakPolarHBondContact O-CA 3.33Å; K365-A459 PolarHBondContact N-O 3.42Å; K365-A459 PolarHBondContact O-N 3.22Å
366	N	69.9	Low	73.6	Confident	90 Å²	90	28.9 Å²	28.9	48%	0.481	18%	0.178	S	C	.	.	S	Bend	trans	52.8	36.8	176.8	-160.3	59	0	0	0	115.2	S368 A395 N396 L457	N366-S368 PolarHBondContact O-N 3.39Å; N366-A395 CarbonylContact C-O 3.59Å; N366-A395 VanDerWaalsContact CA-O 3.3Å; N366-A395 WeakPolarHBondContact CA-O 3.44Å; N366-A395 PolarHBondContact N-O 2.84Å; N366-A395 VanDerWaalsContact N-O 3.12Å; N366-N396 PolarHBondContact N-OD1 3.48Å; N366-L457 PolarHBondContact ND2-O 2.89Å; N366-L457 VanDerWaalsContact O-O 3.09Å
367	V	70.4	Confident	74.3	Confident	2 Å²	2	28 Å²	28	1%	0.012	17%	0.174	C	C	.	.			trans	-73.6	88.9	179.9	-176.1	0	0	0	0	109.6	K365 G369 M375 A395 P397 V419 L453	K365-V367 VanDerWaalsContact C-N 3.29Å; K365-V367 PolarHBondContact O-N 2.84Å; V367-G369 VanDerWaalsContact C-N 3.33Å; V367-G369 PolarHBondContact O-N 3.06Å; V367-M375 HydrophobicContact CG1-CE 4.29Å; V367-M375 HydrophobicContact CG1-SD 4.23Å; V367-M375 WeakPolarHBondContact O-CE 3.31Å; V367-A395 PolarHBondContact N-O 2.92Å; V367-P397 HydrophobicContact CB-CG 4.37Å; V367-P397 HydrophobicContact CG2-CG 4.32Å; V367-V419 HydrophobicContact CG1-CG1 4.29Å; V367-L453 HydrophobicContact CG2-CD1 4.23Å
368	S	61.3	Low	74.9	Confident	72 Å²	72	28.4 Å²	28.4	50%	0.503	18%	0.176	S	C	.	.			trans	-78.2	68.9	-169.8	66	0	0	0	0	113.9	N366 G370	N366-S368 PolarHBondContact O-N 3.39Å; S368-G370 PolarHBondContact O-N 3Å
369	G	59.6	Low	75.4	Confident	7 Å²	7	28.5 Å²	28.5	7%	0.072	18%	0.176	C	C	.	.			trans	-66.7	122.5	171.8	0	0	0	0	0	112.6	V367 K393	V367-G369 VanDerWaalsContact C-N 3.33Å; V367-G369 PolarHBondContact O-N 3.06Å; G369-K393 WeakPolarHBondContact O-CE 3.5Å; G369-K393 PolarHBondContact O-NZ 3.33Å
370	G	64.3	Low	75.5	Confident	58 Å²	58	31.4 Å²	31.4	60%	0.598	19%	0.188	S	C	*	.	S	Bend	trans	-64.6	-96.5	-172.4	0	0	0	0	0	115.1	S368 K393	S368-G370 PolarHBondContact O-N 3Å; G370-K393 PolarHBondContact O-NZ 3.15Å
371	S	57.9	Low	75.5	Confident	87 Å²	87	31.2 Å²	31.2	61%	0.608	19%	0.187	S	C	*	.	S	Bend	trans	-79.3	-18.6	174.9	46.7	0	0	0	0	113.5
372	M	62.7	Low	75.1	Confident	11 Å²	11	33.8 Å²	33.8	5%	0.054	21%	0.213	C	C	.	.			trans	-60	138.8	-169.9	-55.4	-53	160.8	0	0	113.7	K393 D423 E429 L431	M372-K393 WeakPolarHBondContact O-CD 3.19Å; M372-D423 HydrophobicContact SD-CB 3.71Å; M372-E429 HydrophobicContact CE-CB 4.11Å; M372-E429 WeakPolarHBondContact CE-OE2 3.43Å; M372-L431 HydrophobicContact CG-CD2 4.48Å
373	T	61.6	Low	74.3	Confident	59 Å²	59	39 Å²	39	36%	0.362	24%	0.237	S	C	.	.	S	Bend	trans	-95.1	-24.6	-179.1	46.1	0	0	0	0	113	C392 K393 K422 S424	T373-C392 WeakPolarHBondContact O-CA 3.48Å; T373-K393 PolarHBondContact O-N 3.27Å; T373-K422 PolarHBondContact N-O 2.92Å; T373-K422 VanDerWaalsContact N-O 3.17Å; T373-K422 PolarHBondContact OG1-O 2.84Å; T373-S424 PolarHBondContact OG1-N 2.86Å
374	E	78.3	Confident	73.6	Confident	58 Å²	58	37.8 Å²	37.8	27%	0.271	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151.1	-172.7	-81.7	176.9	-148.4	0	0	111.3	T390 L391 G421 K422	E374-T390 HydrophobicContact CB-CG2 3.58Å; E374-T390 HydrophobicContact CG-CG2 3.87Å; E374-T390 WeakPolarHBondContact OE2-CG2 3.48Å; E374-L391 CarbonylContact C-O 3.57Å; E374-L391 WeakPolarHBondContact CA-O 3.35Å; E374-G421 CarbonylContact O-C 3.53Å; E374-G421 WeakPolarHBondContact O-CA 3.44Å; E374-K422 HydrophobicContact CB-CB 3.91Å; E374-K422 HydrophobicContact CB-CG 4.44Å; E374-K422 PolarHBondContact N-O 3.42Å; E374-K422 PolarHBondContact O-N 3.14Å; E374-K422 IonicContact OE1-NZ 3.74Å; E374-K422 WeakPolarHBondContact OE2-CD 3.24Å; E374-K422 WeakPolarHBondContact OE2-CE 3.42Å; E374-K422 IonicContact OE2-NZ 3.41Å; E374-K422 PolarHBondContact OE2-NZ 3.49Å
375	M	79.8	Confident	73.5	Confident	2 Å²	2	45 Å²	45	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	138.2	179.2	-67.1	174.5	175.4	0	0	112.1	V367 T390 L391 P397 W399 W420 L431	V367-M375 HydrophobicContact CG1-CE 4.29Å; V367-M375 HydrophobicContact CG1-SD 4.23Å; V367-M375 WeakPolarHBondContact O-CE 3.31Å; M375-T390 CarbonylContact O-C 3.4Å; M375-T390 WeakPolarHBondContact O-CA 3.15Å; M375-L391 PolarHBondContact N-O 3.08Å; M375-L391 PolarHBondContact O-N 2.93Å; M375-P397 HydrophobicContact SD-CG 4.36Å; M375-W399 HydrophobicContact CB-CZ2 4.48Å; M375-W420 CarbonylContact C-O 3.58Å; M375-W420 WeakPolarHBondContact CA-O 3.23Å; M375-L431 HydrophobicContact CE-CD1 4.15Å; M375-L431 HydrophobicContact CG-CD1 4.12Å
376	F	85.4	Confident	73.4	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.4	169.6	65.6	-88.9	0	0	0	111.2	K387 T390 W420 E428	F376-K387 HydrophobicContact CD2-CB 4.37Å; F376-K387 HydrophobicContact CD2-CD 4.09Å; F376-K387 HydrophobicContact CD2-CG 4.22Å; F376-K387 HydrophobicContact CE2-CD 3.66Å; F376-K387 HydrophobicContact CE2-CG 4.09Å; F376-K387 HydrophobicContact CZ-CD 4.31Å; F376-T390 HydrophobicContact CD1-CG2 4.49Å; F376-W420 HydrophobicContact CD1-CB 4.11Å; F376-W420 HydrophobicContact CD2-CB 4.03Å; F376-W420 HydrophobicContact CE1-CB 3.63Å; F376-W420 HydrophobicContact CE2-CB 3.53Å; F376-W420 AromaticContact CE2-CD1 3.94Å; F376-W420 AromaticContact CE2-CG 3.79Å; F376-W420 HydrophobicContact CE2-CG 3.79Å; F376-W420 HydrophobicContact CG-CB 4.29Å; F376-W420 HydrophobicContact CZ-CB 3.3Å; F376-W420 HydrophobicContact CZ-CD2 4.4Å; F376-W420 AromaticContact CZ-CG 3.74Å; F376-W420 HydrophobicContact CZ-CG 3.74Å; F376-W420 PolarHBondContact N-O 3.44Å; F376-W420 PolarHBondContact O-N 3Å; F376-E428 HydrophobicContact CE1-CG 4.29Å; F376-E428 HydrophobicContact CZ-CG 4.5Å; F376-E428 WeakPolarHBondContact CZ-OE2 3.37Å
377	V	86	Confident	73.9	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.1	173.9	-174.4	0	0	0	0	109.1	L361 L379 K387 S388 W399 I417 V419 L460	L361-V377 HydrophobicContact CD1-CG1 4.42Å; L361-V377 HydrophobicContact CD1-CG2 4.37Å; L361-V377 HydrophobicContact CD2-CB 3.78Å; L361-V377 HydrophobicContact CD2-CG1 4.32Å; L361-V377 HydrophobicContact CD2-CG2 3.83Å; V377-L379 HydrophobicContact CG1-CD2 4.3Å; V377-L379 HydrophobicContact CG1-CG 4.36Å; V377-K387 CarbonylContact O-C 3.55Å; V377-K387 WeakPolarHBondContact O-CA 3.04Å; V377-S388 PolarHBondContact N-OG 2.94Å; V377-S388 PolarHBondContact O-N 3.12Å; V377-S388 PolarHBondContact O-OG 3.09Å; V377-W399 HydrophobicContact CG2-CD2 4.12Å; V377-W399 HydrophobicContact CG2-CE3 4.1Å; V377-W399 HydrophobicContact CG2-CH2 3.53Å; V377-W399 HydrophobicContact CG2-CZ2 3.56Å; V377-W399 HydrophobicContact CG2-CZ3 3.81Å; V377-I417 HydrophobicContact CG1-CG2 3.77Å; V377-V419 HydrophobicContact CG2-CG2 4.28Å; V377-L460 HydrophobicContact CG1-CD2 4.21Å; V377-L460 HydrophobicContact CG2-CD1 4.48Å
378	Q	87.2	Confident	74.6	Confident	9 Å²	9	44.3 Å²	44.3	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.1	172	-176	-174.8	-110	0	0	109.2	Y386 K387 E418	Q378-Y386 CarbonylContact C-O 3.6Å; Q378-Y386 VanDerWaalsContact CA-O 3.23Å; Q378-Y386 WeakPolarHBondContact CA-O 3.49Å; Q378-Y386 WeakPolarHBondContact CG-O 3.47Å; Q378-K387 HydrophobicContact CB-CG 4.44Å; Q378-K387 HydrophobicContact CG-CG 4.29Å; Q378-E418 HydrophobicContact CB-CB 4.4Å; Q378-E418 PolarHBondContact N-O 3.43Å; Q378-E418 PolarHBondContact NE2-OE2 2.97Å; Q378-E418 PolarHBondContact O-N 3.18Å
379	L	87.2	Confident	75.4	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135	177.7	-62.9	165.3	0	0	0	109	I359 V377 R385 Y386 F403 F405 I417	I359-L379 HydrophobicContact CG2-CD1 4.36Å; V377-L379 HydrophobicContact CG1-CD2 4.3Å; V377-L379 HydrophobicContact CG1-CG 4.36Å; L379-R385 CarbonylContact O-C 3.58Å; L379-R385 WeakPolarHBondContact O-CA 3.47Å; L379-Y386 PolarHBondContact N-O 3.04Å; L379-Y386 PolarHBondContact O-N 2.87Å; L379-F403 HydrophobicContact CD1-CB 4.31Å; L379-F403 HydrophobicContact CD1-CD2 3.37Å; L379-F403 HydrophobicContact CD1-CE2 3.78Å; L379-F403 HydrophobicContact CD1-CG 3.86Å; L379-F405 HydrophobicContact CB-CE2 4.1Å; L379-F405 HydrophobicContact CB-CZ 3.66Å; L379-F405 HydrophobicContact CD1-CE2 4.46Å; L379-I417 HydrophobicContact CD2-CB 4.29Å; L379-I417 HydrophobicContact CD2-CD1 3.96Å; L379-I417 HydrophobicContact CD2-CG1 3.85Å; L379-I417 HydrophobicContact CD2-CG2 3.8Å
380	K	84.4	Confident	76.3	Confident	61 Å²	61	49.8 Å²	49.8	27%	0.265	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.6	-177.2	166.2	176.9	168.8	-106.2	0	111.4	Q384 R385 L415 D416	K380-Q384 CarbonylContact C-O 3.46Å; K380-Q384 VanDerWaalsContact CA-O 3.31Å; K380-Q384 WeakPolarHBondContact CA-O 3.42Å; K380-R385 HydrophobicContact CB-CG 4.07Å; K380-R385 HydrophobicContact CD-CG 4.23Å; K380-R385 HydrophobicContact CG-CG 4Å; K380-L415 CarbonylContact O-C 3.49Å; K380-L415 WeakPolarHBondContact O-CA 3.1Å; K380-D416 HydrophobicContact CB-CB 4.06Å; K380-D416 HydrophobicContact CD-CB 4.39Å; K380-D416 HydrophobicContact CG-CB 4.27Å; K380-D416 PolarHBondContact N-O 2.79Å; K380-D416 IonicContact NZ-OD2 2.65Å; K380-D416 PolarHBondContact NZ-OD2 2.84Å; K380-D416 PolarHBondContact O-N 2.98Å
381	L	80.7	Confident	76.5	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	104.9	174	-175	64.5	0	0	0	109.3	I357 H383 Q384 F405 I414 L415 I438	I357-L381 HydrophobicContact CD1-CD2 3.4Å; L381-H383 PolarHBondContact O-N 3.39Å; L381-Q384 PolarHBondContact N-O 2.91Å; L381-Q384 PolarHBondContact O-N 3.16Å; L381-F405 HydrophobicContact CB-CD1 3.47Å; L381-F405 VanDerWaalsContact CB-CD1 3.47Å; L381-F405 HydrophobicContact CB-CE1 3.63Å; L381-F405 HydrophobicContact CB-CG 4.33Å; L381-F405 HydrophobicContact CD2-CB 3.92Å; L381-F405 HydrophobicContact CD2-CD1 4.13Å; L381-F405 HydrophobicContact CD2-CG 4.28Å; L381-F405 HydrophobicContact CG-CD1 4.44Å; L381-I414 WeakPolarHBondContact CD1-O 3.24Å; L381-L415 HydrophobicContact CB-CD1 4.27Å; L381-L415 HydrophobicContact CD1-CB 4.48Å; L381-I438 HydrophobicContact CD1-CD1 3.85Å; L381-I438 HydrophobicContact CD2-CD1 3.94Å
382	G	73.9	Confident	76.4	Confident	53 Å²	53	50 Å²	50	55%	0.546	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-107.2	-172.1	0	0	0	0	0	111.8
383	H	64.4	Low	76.5	Confident	119 Å²	119	55 Å²	55	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-20.3	179	63.9	-94.1	0	0	0	114	L381 F408	L381-H383 PolarHBondContact O-N 3.39Å; H383-F408 AromaticContact CE1-CE2 3.88Å; H383-F408 AromaticContact CE1-CZ 3.83Å
384	Q	68.8	Low	76.8	Confident	19 Å²	19	54.7 Å²	54.7	9%	0.089	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	135.8	178.8	-71.9	162.7	76.1	0	0	110.1	K380 L381 Y386 F405 H406	K380-Q384 CarbonylContact C-O 3.46Å; K380-Q384 VanDerWaalsContact CA-O 3.31Å; K380-Q384 WeakPolarHBondContact CA-O 3.42Å; L381-Q384 PolarHBondContact N-O 2.91Å; L381-Q384 PolarHBondContact O-N 3.16Å; Q384-Y386 HydrophobicContact CB-CE2 4.38Å; Q384-F405 HydrophobicContact CB-CD1 3.76Å; Q384-F405 HydrophobicContact CB-CE1 3.96Å; Q384-F405 VanDerWaalsContact OE1-CA 3.32Å; Q384-H406 PolarHBondContact NE2-O 3.09Å
385	R	80.1	Confident	76.2	Confident	151 Å²	151	54.7 Å²	54.7	57%	0.57	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.4	136.7	179.3	-67.9	176.6	67.8	175.2	-0.5	110.4	L379 K380	L379-R385 CarbonylContact O-C 3.58Å; L379-R385 WeakPolarHBondContact O-CA 3.47Å; K380-R385 HydrophobicContact CB-CG 4.07Å; K380-R385 HydrophobicContact CD-CG 4.23Å; K380-R385 HydrophobicContact CG-CG 4Å
386	Y	77	Confident	75.9	Confident	30 Å²	30	58.7 Å²	58.7	12%	0.118	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.8	174.1	-62.3	-96.9	0	0	0	109.7	Q378 L379 Q384 F403 D404 F405 F644	Q378-Y386 CarbonylContact C-O 3.6Å; Q378-Y386 VanDerWaalsContact CA-O 3.23Å; Q378-Y386 WeakPolarHBondContact CA-O 3.49Å; Q378-Y386 WeakPolarHBondContact CG-O 3.47Å; L379-Y386 PolarHBondContact N-O 3.04Å; L379-Y386 PolarHBondContact O-N 2.87Å; Q384-Y386 HydrophobicContact CB-CE2 4.38Å; Y386-F403 AromaticContact CD1-CD1 3.78Å; Y386-F403 HydrophobicContact CD1-CD1 3.78Å; Y386-F403 HydrophobicContact CG-CB 4.44Å; Y386-F403 AromaticContact CG-CD1 3.88Å; Y386-F403 HydrophobicContact CG-CD1 3.88Å; Y386-F403 HydrophobicContact CG-CG 4.5Å; Y386-D404 PolarHBondContact OH-O 2.91Å; Y386-F405 HydrophobicContact CD2-CD1 4.17Å; Y386-F405 HydrophobicContact CD2-CD2 4.38Å; Y386-F405 AromaticContact CD2-CE1 3.48Å; Y386-F405 HydrophobicContact CD2-CE1 3.48Å; Y386-F405 VanDerWaalsContact CD2-CE1 3.48Å; Y386-F405 AromaticContact CD2-CE2 3.69Å; Y386-F405 HydrophobicContact CD2-CE2 3.69Å; Y386-F405 AromaticContact CD2-CZ 3.22Å; Y386-F405 HydrophobicContact CD2-CZ 3.22Å; Y386-F405 AromaticContact CE2-CD1 3.65Å; Y386-F405 HydrophobicContact CE2-CD1 3.65Å; Y386-F405 HydrophobicContact CE2-CD2 4.06Å; Y386-F405 AromaticContact CE2-CE1 3.44Å; Y386-F405 HydrophobicContact CE2-CE1 3.44Å; Y386-F405 VanDerWaalsContact CE2-CE1 3.44Å; Y386-F405 AromaticContact CE2-CE2 3.84Å; Y386-F405 HydrophobicContact CE2-CE2 3.84Å; Y386-F405 AromaticContact CE2-CG 3.99Å; Y386-F405 HydrophobicContact CE2-CG 3.99Å; Y386-F405 AromaticContact CE2-CZ 3.56Å; Y386-F405 HydrophobicContact CE2-CZ 3.56Å; Y386-F405 HydrophobicContact CG-CZ 4.33Å; Y386-F644 AromaticContact CE1-CD1 3.5Å; Y386-F644 HydrophobicContact CE1-CD1 3.5Å; Y386-F644 AromaticContact CE1-CE1 3.75Å; Y386-F644 HydrophobicContact CE1-CE1 3.75Å; Y386-F644 HydrophobicContact CE1-CG 4.08Å; Y386-F644 HydrophobicContact CE1-CZ 4.48Å; Y386-F644 AromaticContact CZ-CD1 3.86Å; Y386-F644 AromaticContact CZ-CE1 3.85Å; Y386-F644 WeakPolarHBondContact OH-CD1 3.23Å; Y386-F644 WeakPolarHBondContact OH-CE1 3.44Å; Y386-F644 WeakPolarHBondContact OH-CE2 3.39Å; Y386-F644 WeakPolarHBondContact OH-CZ 3.43Å
387	K	81.1	Confident	75.5	Confident	106 Å²	106	58.6 Å²	58.6	46%	0.461	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.4	163.4	-70.7	-169.4	170.8	-159	0	108.1	F376 V377 Q378 E428	F376-K387 HydrophobicContact CD2-CB 4.37Å; F376-K387 HydrophobicContact CD2-CD 4.09Å; F376-K387 HydrophobicContact CD2-CG 4.22Å; F376-K387 HydrophobicContact CE2-CD 3.66Å; F376-K387 HydrophobicContact CE2-CG 4.09Å; F376-K387 HydrophobicContact CZ-CD 4.31Å; V377-K387 CarbonylContact O-C 3.55Å; V377-K387 WeakPolarHBondContact O-CA 3.04Å; Q378-K387 HydrophobicContact CB-CG 4.44Å; Q378-K387 HydrophobicContact CG-CG 4.29Å; K387-E428 IonicContact NZ-OE1 2.77Å; K387-E428 IonicContact NZ-OE2 3.86Å; K387-E428 PolarHBondContact NZ-OE2 3.15Å
388	S	84	Confident	75.2	Confident	10 Å²	10	63.6 Å²	63.6	7%	0.07	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-74.4	170.4	171.6	76.3	0	0	0	0	111.2	V377 T390 W399 E401	V377-S388 PolarHBondContact N-OG 2.94Å; V377-S388 PolarHBondContact O-N 3.12Å; V377-S388 PolarHBondContact O-OG 3.09Å; S388-T390 PolarHBondContact O-N 2.99Å; S388-W399 PolarHBondContact OG-NE1 3.42Å; S388-E401 VanDerWaalsContact CA-OE2 3.25Å; S388-E401 WeakPolarHBondContact CA-OE2 3.24Å; S388-E401 VanDerWaalsContact CB-OE2 3.27Å; S388-E401 WeakPolarHBondContact CB-OE2 3.49Å
389	K	79	Confident	74.7	Confident	123 Å²	123	63.7 Å²	63.7	54%	0.535	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-53.3	138.2	165.2	-74.1	-175.1	-157.8	81.6	0	110.6	W399 E401	K389-W399 VanDerWaalsContact O-CD1 3.24Å; K389-W399 PolarHBondContact O-NE1 3.31Å; K389-W399 VanDerWaalsContact O-NE1 3.1Å; K389-E401 WeakPolarHBondContact CG-OE1 3.47Å; K389-E401 PolarHBondContact N-OE2 2.86Å; K389-E401 IonicContact NZ-OE1 2.71Å; K389-E401 PolarHBondContact NZ-OE1 3.06Å
390	T	78.2	Confident	74.3	Confident	70 Å²	70	67.4 Å²	67.4	43%	0.429	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-76.1	123.9	167.7	-46.8	0	0	0	0	109.8	E374 M375 F376 S388	E374-T390 HydrophobicContact CB-CG2 3.58Å; E374-T390 HydrophobicContact CG-CG2 3.87Å; E374-T390 WeakPolarHBondContact OE2-CG2 3.48Å; M375-T390 CarbonylContact O-C 3.4Å; M375-T390 WeakPolarHBondContact O-CA 3.15Å; F376-T390 HydrophobicContact CD1-CG2 4.49Å; S388-T390 PolarHBondContact O-N 2.99Å
391	L	69.8	Low	73.8	Confident	44 Å²	44	66 Å²	66	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	147.5	177.6	-62.4	177.5	0	0	0	110.4	E374 M375 P397 Q398 W399	E374-L391 CarbonylContact C-O 3.57Å; E374-L391 WeakPolarHBondContact CA-O 3.35Å; M375-L391 PolarHBondContact N-O 3.08Å; M375-L391 PolarHBondContact O-N 2.93Å; L391-P397 HydrophobicContact CD1-CB 4Å; L391-Q398 VanDerWaalsContact CD1-O 3.3Å; L391-Q398 WeakPolarHBondContact CD1-O 3.25Å; L391-W399 HydrophobicContact CD1-CD2 4.1Å; L391-W399 HydrophobicContact CD1-CG 3.87Å
392	C	55.9	Low	73.6	Confident	105 Å²	105	69.8 Å²	69.8	71%	0.709	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	152.5	170.8	-59.6	0	0	0	0	111.1	T373 S394	T373-C392 WeakPolarHBondContact O-CA 3.48Å; C392-S394 PolarHBondContact O-N 3.1Å
393	K	64.8	Low	73.8	Confident	116 Å²	116	68.2 Å²	68.2	50%	0.504	34%	0.341	S	S	.	.			trans	-46.2	107.1	-175.3	-170.4	-174.3	-166.3	163.5	0	114.2	G369 G370 M372 T373	G369-K393 WeakPolarHBondContact O-CE 3.5Å; G369-K393 PolarHBondContact O-NZ 3.33Å; G370-K393 PolarHBondContact O-NZ 3.15Å; M372-K393 WeakPolarHBondContact O-CD 3.19Å; T373-K393 PolarHBondContact O-N 3.27Å
394	S	67.8	Low	74.3	Confident	53 Å²	53	63.2 Å²	63.2	37%	0.371	32%	0.319	S	S	.	.			trans	-124.7	147.9	164.2	178.1	0	0	0	0	108.3	C392 N396	C392-S394 PolarHBondContact O-N 3.1Å; S394-N396 PolarHBondContact OG-N 2.7Å; S394-N396 VanDerWaalsContact OG-N 3.11Å; S394-N396 PolarHBondContact OG-O 2.97Å
395	A	64.1	Low	74.5	Confident	59 Å²	59	62.3 Å²	62.3	49%	0.488	31%	0.314	S	S	.	.	S	Bend	trans	-68.2	-28.5	168.9	0	0	0	0	0	111.5	N366 V367	N366-A395 CarbonylContact C-O 3.59Å; N366-A395 VanDerWaalsContact CA-O 3.3Å; N366-A395 WeakPolarHBondContact CA-O 3.44Å; N366-A395 PolarHBondContact N-O 2.84Å; N366-A395 VanDerWaalsContact N-O 3.12Å; V367-A395 PolarHBondContact N-O 2.92Å
396	N	75.1	Confident	74	Confident	86 Å²	86	55.6 Å²	55.6	46%	0.46	29%	0.29	S	S	.	.	S	Bend	trans	-120.8	85.2	172.8	-62.7	-23	0	0	0	109.2	G364 K365 N366 S394	G364-N396 CarbonylContact O-C 3.57Å; G364-N396 WeakPolarHBondContact O-CA 3.24Å; K365-N396 WeakPolarHBondContact CA-OD1 3.37Å; N366-N396 PolarHBondContact N-OD1 3.48Å; S394-N396 PolarHBondContact OG-N 2.7Å; S394-N396 VanDerWaalsContact OG-N 3.11Å; S394-N396 PolarHBondContact OG-O 2.97Å
397	P	76.6	Confident	73.7	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.013	29%	0.291	C	S	.	.			trans	-73.1	126.6	174.9	27.9	-33.4	0	0	0	110.9	E363 G364 V367 M375 L391 W399	E363-P397 CarbonylContact C-O 3.52Å; E363-P397 VanDerWaalsContact CA-O 3.25Å; E363-P397 WeakPolarHBondContact CA-O 3.42Å; G364-P397 PolarHBondContact N-O 3.19Å; G364-P397 WeakPolarHBondContact O-CD 3.41Å; V367-P397 HydrophobicContact CB-CG 4.37Å; V367-P397 HydrophobicContact CG2-CG 4.32Å; M375-P397 HydrophobicContact SD-CG 4.36Å; L391-P397 HydrophobicContact CD1-CB 4Å; P397-W399 HydrophobicContact CB-CH2 3.8Å; P397-W399 HydrophobicContact CB-CZ2 3.89Å; P397-W399 HydrophobicContact CB-CZ3 4.11Å; P397-W399 HydrophobicContact CG-CH2 3.37Å; P397-W399 HydrophobicContact CG-CZ2 3.95Å; P397-W399 HydrophobicContact CG-CZ3 3.72Å
398	Q	79.4	Confident	73.1	Confident	104 Å²	104	53 Å²	53	49%	0.486	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.5	175	-61.2	-161.8	-35.3	0	0	110.2	E363 L391	E363-Q398 HydrophobicContact CB-CB 4.49Å; E363-Q398 HydrophobicContact CB-CG 3.88Å; E363-Q398 PolarHBondContact OE2-NE2 2.9Å; L391-Q398 VanDerWaalsContact CD1-O 3.3Å; L391-Q398 WeakPolarHBondContact CD1-O 3.25Å
399	W	76.8	Confident	71.9	Confident	11 Å²	11	55.6 Å²	55.6	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-45.2	-178.5	-72.4	-79	0	0	0	112.2	L361 L362 M375 V377 S388 K389 L391 P397 E401 L460	L361-W399 HydrophobicContact CD1-CE3 4.45Å; L361-W399 HydrophobicContact CD2-CB 3.76Å; L361-W399 HydrophobicContact CD2-CD2 3.85Å; L361-W399 HydrophobicContact CD2-CE3 4.01Å; L361-W399 HydrophobicContact CD2-CG 3.73Å; L361-W399 HydrophobicContact CG-CB 4.01Å; L361-W399 HydrophobicContact CG-CD2 4.33Å; L361-W399 HydrophobicContact CG-CE3 4.07Å; L361-W399 HydrophobicContact CG-CG 4.33Å; L362-W399 PolarHBondContact O-N 2.9Å; M375-W399 HydrophobicContact CB-CZ2 4.48Å; V377-W399 HydrophobicContact CG2-CD2 4.12Å; V377-W399 HydrophobicContact CG2-CE3 4.1Å; V377-W399 HydrophobicContact CG2-CH2 3.53Å; V377-W399 HydrophobicContact CG2-CZ2 3.56Å; V377-W399 HydrophobicContact CG2-CZ3 3.81Å; S388-W399 PolarHBondContact OG-NE1 3.42Å; K389-W399 VanDerWaalsContact O-CD1 3.24Å; K389-W399 PolarHBondContact O-NE1 3.31Å; K389-W399 VanDerWaalsContact O-NE1 3.1Å; L391-W399 HydrophobicContact CD1-CD2 4.1Å; L391-W399 HydrophobicContact CD1-CG 3.87Å; P397-W399 HydrophobicContact CB-CH2 3.8Å; P397-W399 HydrophobicContact CB-CZ2 3.89Å; P397-W399 HydrophobicContact CB-CZ3 4.11Å; P397-W399 HydrophobicContact CG-CH2 3.37Å; P397-W399 HydrophobicContact CG-CZ2 3.95Å; P397-W399 HydrophobicContact CG-CZ3 3.72Å; W399-E401 HydrophobicContact CB-CG 4.31Å; W399-E401 VanDerWaalsContact O-CG 3.29Å; W399-E401 WeakPolarHBondContact O-CG 3.34Å; W399-E401 PolarHBondContact O-N 2.88Å; W399-L460 HydrophobicContact CE3-CD1 4.27Å; W399-L460 HydrophobicContact CH2-CD1 4.37Å; W399-L460 HydrophobicContact CZ3-CD1 3.57Å
400	Q	77.6	Confident	70.8	Confident	81 Å²	81	57.2 Å²	57.2	38%	0.379	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.6	52.1	-179.3	-58.5	179.2	9.8	0	0	112.7	L361 L362 I837	L361-Q400 CarbonylContact O-C 3.57Å; L361-Q400 VanDerWaalsContact O-CA 3.23Å; L361-Q400 WeakPolarHBondContact O-CA 3.26Å; L361-Q400 PolarHBondContact O-N 3.41Å; L362-Q400 PolarHBondContact O-N 2.88Å; Q400-I837 WeakPolarHBondContact O-CD1 3.27Å
401	E	75.4	Confident	69.9	Low	30 Å²	30	61.7 Å²	61.7	14%	0.14	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.6	-176.7	-57	-156.1	104.1	0	0	112.2	T360 L361 S388 K389 W399 F403	T360-E401 CarbonylContact C-O 3.46Å; T360-E401 VanDerWaalsContact CA-O 3.3Å; T360-E401 WeakPolarHBondContact CA-O 3.4Å; L361-E401 PolarHBondContact N-O 2.88Å; L361-E401 PolarHBondContact O-N 2.9Å; S388-E401 VanDerWaalsContact CA-OE2 3.25Å; S388-E401 WeakPolarHBondContact CA-OE2 3.24Å; S388-E401 VanDerWaalsContact CB-OE2 3.27Å; S388-E401 WeakPolarHBondContact CB-OE2 3.49Å; K389-E401 WeakPolarHBondContact CG-OE1 3.47Å; K389-E401 PolarHBondContact N-OE2 2.86Å; K389-E401 IonicContact NZ-OE1 2.71Å; K389-E401 PolarHBondContact NZ-OE1 3.06Å; W399-E401 HydrophobicContact CB-CG 4.31Å; W399-E401 VanDerWaalsContact O-CG 3.29Å; W399-E401 WeakPolarHBondContact O-CG 3.34Å; W399-E401 PolarHBondContact O-N 2.88Å; E401-F403 HydrophobicContact CB-CE2 3.66Å; E401-F403 HydrophobicContact CB-CZ 3.67Å; E401-F403 HydrophobicContact CG-CZ 4.49Å
402	Q	76.6	Confident	69.2	Low	94 Å²	94	67.1 Å²	67.1	44%	0.439	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.7	174.7	-167.2	-167.8	-52.5	0	0	111	S358 I359 D404	S358-Q402 PolarHBondContact OG-NE2 3.27Å; I359-Q402 CarbonylContact O-C 3.51Å; I359-Q402 WeakPolarHBondContact O-CA 3.17Å; Q402-D404 PolarHBondContact NE2-OD1 2.95Å
403	F	78.5	Confident	69.8	Low	19 Å²	19	62.6 Å²	62.6	8%	0.083	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.4	177.3	-52.5	-86.6	0	0	0	109.6	I359 L361 L379 Y386 E401 F405	I359-F403 PolarHBondContact N-O 2.79Å; I359-F403 PolarHBondContact O-N 3.12Å; L361-F403 HydrophobicContact CB-CE2 3.93Å; L361-F403 HydrophobicContact CD2-CE2 4.24Å; L379-F403 HydrophobicContact CD1-CB 4.31Å; L379-F403 HydrophobicContact CD1-CD2 3.37Å; L379-F403 HydrophobicContact CD1-CE2 3.78Å; L379-F403 HydrophobicContact CD1-CG 3.86Å; Y386-F403 AromaticContact CD1-CD1 3.78Å; Y386-F403 HydrophobicContact CD1-CD1 3.78Å; Y386-F403 HydrophobicContact CG-CB 4.44Å; Y386-F403 AromaticContact CG-CD1 3.88Å; Y386-F403 HydrophobicContact CG-CD1 3.88Å; Y386-F403 HydrophobicContact CG-CG 4.5Å; E401-F403 HydrophobicContact CB-CE2 3.66Å; E401-F403 HydrophobicContact CB-CZ 3.67Å; E401-F403 HydrophobicContact CG-CZ 4.49Å; F403-F405 HydrophobicContact CB-CD2 4.42Å; F403-F405 HydrophobicContact CB-CE2 4.02Å
404	D	74.9	Confident	70.7	Confident	14 Å²	14	59.9 Å²	59.9	8%	0.075	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.1	-175.9	-80.5	16.5	0	0	0	110.4	I356 I357 S358 Y386 Q402 F644	I356-D404 HydrophobicContact CG2-CB 3.91Å; I357-D404 WeakPolarHBondContact O-CA 3.33Å; S358-D404 WeakPolarHBondContact CA-OD1 3.46Å; S358-D404 WeakPolarHBondContact CB-OD1 3.42Å; S358-D404 PolarHBondContact OG-OD1 3.37Å; S358-D404 PolarHBondContact OG-OD2 3.46Å; S358-D404 VanDerWaalsContact OG-OD2 3.11Å; Y386-D404 PolarHBondContact OH-O 2.91Å; Q402-D404 PolarHBondContact NE2-OD1 2.95Å; D404-F644 WeakPolarHBondContact O-CZ 3.3Å
405	F	71.8	Confident	71.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.9	-178.2	-74.8	-99	0	0	0	112.2	I356 I357 I359 L379 L381 Q384 Y386 F403 L415	I356-F405 CarbonylContact C-O 3.6Å; I356-F405 VanDerWaalsContact CA-O 3.29Å; I356-F405 WeakPolarHBondContact CA-O 3.32Å; I357-F405 HydrophobicContact CB-CB 4.33Å; I357-F405 HydrophobicContact CD1-CB 4.21Å; I357-F405 PolarHBondContact N-O 2.89Å; I357-F405 PolarHBondContact O-N 2.95Å; I359-F405 HydrophobicContact CD1-CD2 3.71Å; I359-F405 HydrophobicContact CD1-CE2 3.72Å; I359-F405 HydrophobicContact CG1-CD2 4.21Å; I359-F405 HydrophobicContact CG1-CE2 4.46Å; L379-F405 HydrophobicContact CB-CE2 4.1Å; L379-F405 HydrophobicContact CB-CZ 3.66Å; L379-F405 HydrophobicContact CD1-CE2 4.46Å; L381-F405 HydrophobicContact CB-CD1 3.47Å; L381-F405 VanDerWaalsContact CB-CD1 3.47Å; L381-F405 HydrophobicContact CB-CE1 3.63Å; L381-F405 HydrophobicContact CB-CG 4.33Å; L381-F405 HydrophobicContact CD2-CB 3.92Å; L381-F405 HydrophobicContact CD2-CD1 4.13Å; L381-F405 HydrophobicContact CD2-CG 4.28Å; L381-F405 HydrophobicContact CG-CD1 4.44Å; Q384-F405 HydrophobicContact CB-CD1 3.76Å; Q384-F405 HydrophobicContact CB-CE1 3.96Å; Q384-F405 VanDerWaalsContact OE1-CA 3.32Å; Y386-F405 HydrophobicContact CD2-CD1 4.17Å; Y386-F405 HydrophobicContact CD2-CD2 4.38Å; Y386-F405 AromaticContact CD2-CE1 3.48Å; Y386-F405 HydrophobicContact CD2-CE1 3.48Å; Y386-F405 VanDerWaalsContact CD2-CE1 3.48Å; Y386-F405 AromaticContact CD2-CE2 3.69Å; Y386-F405 HydrophobicContact CD2-CE2 3.69Å; Y386-F405 AromaticContact CD2-CZ 3.22Å; Y386-F405 HydrophobicContact CD2-CZ 3.22Å; Y386-F405 AromaticContact CE2-CD1 3.65Å; Y386-F405 HydrophobicContact CE2-CD1 3.65Å; Y386-F405 HydrophobicContact CE2-CD2 4.06Å; Y386-F405 AromaticContact CE2-CE1 3.44Å; Y386-F405 HydrophobicContact CE2-CE1 3.44Å; Y386-F405 VanDerWaalsContact CE2-CE1 3.44Å; Y386-F405 AromaticContact CE2-CE2 3.84Å; Y386-F405 HydrophobicContact CE2-CE2 3.84Å; Y386-F405 AromaticContact CE2-CG 3.99Å; Y386-F405 HydrophobicContact CE2-CG 3.99Å; Y386-F405 AromaticContact CE2-CZ 3.56Å; Y386-F405 HydrophobicContact CE2-CZ 3.56Å; Y386-F405 HydrophobicContact CG-CZ 4.33Å; F403-F405 HydrophobicContact CB-CD2 4.42Å; F403-F405 HydrophobicContact CB-CE2 4.02Å; F405-L415 HydrophobicContact CE2-CD1 4.38Å; F405-L415 HydrophobicContact CZ-CD1 4.11Å
406	H	70.4	Confident	72.7	Confident	11 Å²	11	55.9 Å²	55.9	5%	0.051	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.8	174.9	-58.5	178.9	0	0	0	110.2	W353 Q384 F408 D540	W353-H406 HydrophobicContact CB-CB 4.2Å; W353-H406 HydrophobicContact CD2-CB 3.96Å; W353-H406 AromaticContact CD2-CG 3.96Å; W353-H406 AromaticContact CD2-ND1 3.67Å; W353-H406 AromaticContact CE2-CE1 3.97Å; W353-H406 AromaticContact CE2-CG 3.91Å; W353-H406 AromaticContact CE2-ND1 3.52Å; W353-H406 HydrophobicContact CE3-CB 4.31Å; W353-H406 AromaticContact CE3-ND1 3.67Å; W353-H406 HydrophobicContact CG-CB 3.93Å; W353-H406 AromaticContact CH2-CE1 3.61Å; W353-H406 AromaticContact CH2-ND1 3.4Å; W353-H406 WeakPolarHBondContact CH2-ND1 3.44Å; W353-H406 AromaticContact CZ2-CE1 3.47Å; W353-H406 VanDerWaalsContact CZ2-CE1 3.47Å; W353-H406 WeakPolarHBondContact CZ2-CE1 3.13Å; W353-H406 AromaticContact CZ2-ND1 3.38Å; W353-H406 WeakPolarHBondContact CZ2-ND1 3.17Å; W353-H406 AromaticContact CZ3-ND1 3.55Å; Q384-H406 PolarHBondContact NE2-O 3.09Å; H406-F408 HydrophobicContact CB-CE2 4.11Å; H406-F408 HydrophobicContact CB-CZ 4.4Å; H406-F408 WeakPolarHBondContact O-CD2 3.4Å; H406-F408 VanDerWaalsContact O-CE2 3.27Å; H406-F408 WeakPolarHBondContact O-CE2 3.21Å; H406-D540 IonicContact CE1-OD1 2.65Å; H406-D540 PolarHBondContact CE1-OD1 3.36Å; H406-D540 IonicContact NE2-OD1 2.75Å
407	Y	71	Confident	73.3	Confident	35 Å²	35	51.8 Å²	51.8	14%	0.137	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.2	-173.7	177.1	-116.1	0	0	0	112.5	W353 N354 G355 I357 L466	W353-Y407 CarbonylContact C-O 3.43Å; W353-Y407 WeakPolarHBondContact CB-O 3.44Å; N354-Y407 HydrophobicContact CB-CD1 4.49Å; N354-Y407 PolarHBondContact N-O 2.66Å; G355-Y407 PolarHBondContact N-O 2.79Å; G355-Y407 PolarHBondContact O-N 3.29Å; I357-Y407 HydrophobicContact CD1-CD2 3.97Å; I357-Y407 HydrophobicContact CD1-CG 4.15Å; Y407-L466 HydrophobicContact CD1-CD1 3.9Å; Y407-L466 HydrophobicContact CG-CD1 3.95Å
408	F	68.3	Low	73.9	Confident	47 Å²	47	52.9 Å²	52.9	21%	0.206	26%	0.257	C	S	.	.			trans	-117	118	-179.7	-52.5	-105.6	0	0	0	107.7	L352 W353 H383 H406 D410 R411	L352-F408 WeakPolarHBondContact O-CD1 3.42Å; L352-F408 WeakPolarHBondContact O-CE1 3.32Å; W353-F408 HydrophobicContact CB-CD1 4.28Å; W353-F408 HydrophobicContact CB-CE1 4.16Å; W353-F408 HydrophobicContact CB-CZ 4.31Å; H383-F408 AromaticContact CE1-CE2 3.88Å; H383-F408 AromaticContact CE1-CZ 3.83Å; H406-F408 HydrophobicContact CB-CE2 4.11Å; H406-F408 HydrophobicContact CB-CZ 4.4Å; H406-F408 WeakPolarHBondContact O-CD2 3.4Å; H406-F408 VanDerWaalsContact O-CE2 3.27Å; H406-F408 WeakPolarHBondContact O-CE2 3.21Å; F408-D410 PolarHBondContact O-N 3.4Å; F408-R411 HydrophobicContact CB-CB 4.26Å; F408-R411 HydrophobicContact CB-CG 4.23Å; F408-R411 PolarHBondContact O-N 3.05Å
409	S	59.1	Low	74.3	Confident	64 Å²	64	48 Å²	48	45%	0.448	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.2	179.6	-58.5	0	0	0	0	113	N354 R411	N354-S409 WeakPolarHBondContact ND2-CB 3.26Å; N354-S409 PolarHBondContact ND2-N 3.15Å; N354-S409 PolarHBondContact ND2-OG 3.28Å; S409-R411 VanDerWaalsContact C-N 3.26Å; S409-R411 PolarHBondContact O-N 3.07Å
410	D	55.3	Low	74.7	Confident	157 Å²	157	49.8 Å²	49.8	84%	0.84	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-0.7	-177	-56.5	13.9	0	0	0	112.7	F408	F408-D410 PolarHBondContact O-N 3.4Å
411	R	58.9	Low	75	Confident	163 Å²	163	46 Å²	46	62%	0.615	22%	0.223	S	C	*	.	S	Bend	trans	-124.2	146	179	-62.2	-173.7	-177.8	-124.5	4	110.1	F408 S409 G413	F408-R411 HydrophobicContact CB-CB 4.26Å; F408-R411 HydrophobicContact CB-CG 4.23Å; F408-R411 PolarHBondContact O-N 3.05Å; S409-R411 VanDerWaalsContact C-N 3.26Å; S409-R411 PolarHBondContact O-N 3.07Å; R411-G413 PolarHBondContact O-N 3.49Å; R411-G413 VanDerWaalsContact O-N 3.09Å
412	M	55.2	Low	75.2	Confident	159 Å²	159	46.4 Å²	46.4	78%	0.783	22%	0.224	S	C	*	.			trans	-54	117.1	179.4	-61.9	-179.1	76.5	0	0	110.6	I414	M412-I414 HydrophobicContact CE-CD1 3.95Å; M412-I414 PolarHBondContact O-N 3.04Å
413	G	68.8	Low	75.2	Confident	9 Å²	9	43.8 Å²	43.8	9%	0.093	21%	0.213	C	C	.	.			trans	-74.7	26	-173.6	0	0	0	0	0	115	R411 L415 I438	R411-G413 PolarHBondContact O-N 3.49Å; R411-G413 VanDerWaalsContact O-N 3.09Å; G413-L415 PolarHBondContact O-N 2.84Å; G413-I438 VanDerWaalsContact O-CB 3.32Å; G413-I438 WeakPolarHBondContact O-CB 3.48Å; G413-I438 WeakPolarHBondContact O-CG1 3.44Å; G413-I438 PolarHBondContact O-N 3.38Å
414	I	83.8	Confident	74.5	Confident	59 Å²	59	47 Å²	47	30%	0.303	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	115.6	-175.4	-56	176.4	0	0	0	109.6	L381 M412 K435 V436	L381-I414 WeakPolarHBondContact CD1-O 3.24Å; M412-I414 HydrophobicContact CE-CD1 3.95Å; M412-I414 PolarHBondContact O-N 3.04Å; I414-K435 HydrophobicContact CG2-CB 4.16Å; I414-K435 HydrophobicContact CG2-CG 4.42Å; I414-V436 WeakPolarHBondContact CA-O 3.49Å
415	L	85.3	Confident	74.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.5	168.1	-179.3	71.7	0	0	0	109	I359 K380 L381 F405 G413 I417 K435 V436 I438	I359-L415 HydrophobicContact CD1-CD1 3.75Å; I359-L415 HydrophobicContact CD1-CD2 3.52Å; I359-L415 HydrophobicContact CD1-CG 4.3Å; K380-L415 CarbonylContact O-C 3.49Å; K380-L415 WeakPolarHBondContact O-CA 3.1Å; L381-L415 HydrophobicContact CB-CD1 4.27Å; L381-L415 HydrophobicContact CD1-CB 4.48Å; F405-L415 HydrophobicContact CE2-CD1 4.38Å; F405-L415 HydrophobicContact CZ-CD1 4.11Å; G413-L415 PolarHBondContact O-N 2.84Å; L415-I417 HydrophobicContact CD2-CD1 3.66Å; L415-I417 HydrophobicContact CD2-CG1 3.95Å; L415-I417 HydrophobicContact CG-CD1 4.11Å; L415-I417 HydrophobicContact CG-CG1 3.81Å; L415-K435 WeakPolarHBondContact O-CA 3.23Å; L415-V436 HydrophobicContact CB-CB 4.23Å; L415-V436 HydrophobicContact CD2-CB 4.32Å; L415-V436 HydrophobicContact CD2-CG2 4.42Å; L415-V436 PolarHBondContact N-O 2.72Å; L415-V436 PolarHBondContact O-N 2.9Å; L415-I438 HydrophobicContact CB-CD1 4Å; L415-I438 HydrophobicContact CB-CG1 4.24Å
416	D	87.4	Confident	73.7	Confident	28 Å²	28	61.3 Å²	61.3	15%	0.15	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.6	165.8	-70.7	-38.9	0	0	0	108.9	K380 K435	K380-D416 HydrophobicContact CB-CB 4.06Å; K380-D416 HydrophobicContact CD-CB 4.39Å; K380-D416 HydrophobicContact CG-CB 4.27Å; K380-D416 PolarHBondContact N-O 2.79Å; K380-D416 IonicContact NZ-OD2 2.65Å; K380-D416 PolarHBondContact NZ-OD2 2.84Å; K380-D416 PolarHBondContact O-N 2.98Å; D416-K435 IonicContact OD1-NZ 3.91Å; D416-K435 PolarHBondContact OD1-NZ 2.76Å
417	I	89.4	Confident	73.7	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.5	177.6	-49.2	-172.2	0	0	0	108.4	V377 L379 L415 T433 C434 V436 L451 L460 M462	V377-I417 HydrophobicContact CG1-CG2 3.77Å; L379-I417 HydrophobicContact CD2-CB 4.29Å; L379-I417 HydrophobicContact CD2-CD1 3.96Å; L379-I417 HydrophobicContact CD2-CG1 3.85Å; L379-I417 HydrophobicContact CD2-CG2 3.8Å; L415-I417 HydrophobicContact CD2-CD1 3.66Å; L415-I417 HydrophobicContact CD2-CG1 3.95Å; L415-I417 HydrophobicContact CG-CD1 4.11Å; L415-I417 HydrophobicContact CG-CG1 3.81Å; I417-T433 CarbonylContact O-C 3.56Å; I417-T433 VanDerWaalsContact O-CA 3.26Å; I417-T433 WeakPolarHBondContact O-CA 3.29Å; I417-C434 HydrophobicContact CB-CB 4.47Å; I417-C434 PolarHBondContact N-O 3.01Å; I417-C434 PolarHBondContact O-N 2.84Å; I417-V436 HydrophobicContact CD1-CG2 4.05Å; I417-L451 HydrophobicContact CD1-CD1 3.93Å; I417-L460 HydrophobicContact CG2-CD2 3.75Å; I417-M462 HydrophobicContact CD1-CE 3.57Å; I417-M462 HydrophobicContact CD1-SD 3.63Å
418	E	89.2	Confident	74.2	Confident	25 Å²	25	69.1 Å²	69.1	12%	0.117	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.3	-179.3	-50.8	-175.9	177.7	0	0	110.2	Q378 W420 R430 G432 T433	Q378-E418 HydrophobicContact CB-CB 4.4Å; Q378-E418 PolarHBondContact N-O 3.43Å; Q378-E418 PolarHBondContact NE2-OE2 2.97Å; Q378-E418 PolarHBondContact O-N 3.18Å; E418-W420 WeakPolarHBondContact OE2-CZ2 3.3Å; E418-W420 PolarHBondContact OE2-NE1 2.88Å; E418-R430 IonicContact OE1-CZ 3.08Å; E418-R430 IonicContact OE1-NE 3.36Å; E418-R430 IonicContact OE1-NH2 2.67Å; E418-R430 PolarHBondContact OE1-NH2 2.91Å; E418-R430 IonicContact OE2-CZ 3.95Å; E418-R430 IonicContact OE2-NE 2.97Å; E418-R430 PolarHBondContact OE2-NE 3.35Å; E418-R430 VanDerWaalsContact OE2-NE 3.1Å; E418-R430 IonicContact OE2-NH2 2.73Å; E418-R430 PolarHBondContact OE2-NH2 2.87Å; E418-G432 CarbonylContact C-O 3.56Å; E418-G432 WeakPolarHBondContact CA-O 3.49Å; E418-T433 HydrophobicContact CG-CG2 4.32Å
419	V	87.8	Confident	74.8	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.7	170.6	-173.9	0	0	0	0	108.3	V367 V377 L431 G432 L453 L460	V367-V419 HydrophobicContact CG1-CG1 4.29Å; V377-V419 HydrophobicContact CG2-CG2 4.28Å; V419-L431 HydrophobicContact CG1-CB 4.29Å; V419-L431 HydrophobicContact CG1-CD1 4.43Å; V419-L431 PolarHBondContact O-N 2.93Å; V419-G432 PolarHBondContact N-O 2.54Å; V419-G432 PolarHBondContact O-N 2.8Å; V419-L453 HydrophobicContact CG2-CD1 3.99Å; V419-L453 HydrophobicContact CG2-CD2 3.65Å; V419-L460 HydrophobicContact CG2-CD2 4.36Å
420	W	84.6	Confident	75.8	Confident	49 Å²	49	74.4 Å²	74.4	19%	0.186	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.1	-178.3	-73.2	83.5	0	0	0	110.4	M375 F376 E418 E428 E429 R430	M375-W420 CarbonylContact C-O 3.58Å; M375-W420 WeakPolarHBondContact CA-O 3.23Å; F376-W420 HydrophobicContact CD1-CB 4.11Å; F376-W420 HydrophobicContact CD2-CB 4.03Å; F376-W420 HydrophobicContact CE1-CB 3.63Å; F376-W420 HydrophobicContact CE2-CB 3.53Å; F376-W420 AromaticContact CE2-CD1 3.94Å; F376-W420 AromaticContact CE2-CG 3.79Å; F376-W420 HydrophobicContact CE2-CG 3.79Å; F376-W420 HydrophobicContact CG-CB 4.29Å; F376-W420 HydrophobicContact CZ-CB 3.3Å; F376-W420 HydrophobicContact CZ-CD2 4.4Å; F376-W420 AromaticContact CZ-CG 3.74Å; F376-W420 HydrophobicContact CZ-CG 3.74Å; F376-W420 PolarHBondContact N-O 3.44Å; F376-W420 PolarHBondContact O-N 3Å; E418-W420 WeakPolarHBondContact OE2-CZ2 3.3Å; E418-W420 PolarHBondContact OE2-NE1 2.88Å; W420-E428 HydrophobicContact CE3-CB 4.01Å; W420-E428 HydrophobicContact CZ3-CB 4.33Å; W420-E429 WeakPolarHBondContact CA-O 3.4Å; W420-E429 VanDerWaalsContact CE3-C 3.49Å; W420-R430 HydrophobicContact CD2-CB 4.19Å; W420-R430 HydrophobicContact CE3-CB 4.13Å; W420-R430 HydrophobicContact CH2-CB 4.15Å; W420-R430 HydrophobicContact CZ2-CB 4.2Å; W420-R430 HydrophobicContact CZ2-CG 4.46Å; W420-R430 HydrophobicContact CZ3-CB 4.11Å
421	G	83.4	Confident	76.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	149.7	170.9	0	0	0	0	0	110	E374 E428 E429	E374-G421 CarbonylContact O-C 3.53Å; E374-G421 WeakPolarHBondContact O-CA 3.44Å; G421-E428 WeakPolarHBondContact O-CA 3.2Å; G421-E429 PolarHBondContact N-O 2.83Å; G421-E429 PolarHBondContact O-N 2.83Å
422	K	80.8	Confident	77.9	Confident	39 Å²	39	60.3 Å²	60.3	17%	0.17	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.9	178.2	175.4	171	161.4	-119.9	0	110.5	T373 E374 H427 E428	T373-K422 PolarHBondContact N-O 2.92Å; T373-K422 VanDerWaalsContact N-O 3.17Å; T373-K422 PolarHBondContact OG1-O 2.84Å; E374-K422 HydrophobicContact CB-CB 3.91Å; E374-K422 HydrophobicContact CB-CG 4.44Å; E374-K422 PolarHBondContact N-O 3.42Å; E374-K422 PolarHBondContact O-N 3.14Å; E374-K422 IonicContact OE1-NZ 3.74Å; E374-K422 WeakPolarHBondContact OE2-CD 3.24Å; E374-K422 WeakPolarHBondContact OE2-CE 3.42Å; E374-K422 IonicContact OE2-NZ 3.41Å; E374-K422 PolarHBondContact OE2-NZ 3.49Å; K422-H427 WeakPolarHBondContact CA-O 3.21Å; K422-E428 HydrophobicContact CB-CG 4.49Å; K422-E428 HydrophobicContact CD-CG 4.29Å; K422-E428 HydrophobicContact CG-CG 4.45Å
423	D	75.2	Confident	79.4	Confident	39 Å²	39	54.7 Å²	54.7	21%	0.209	26%	0.261	C	S	.	.			trans	-80.9	158.6	176.2	-170.1	13.6	0	0	0	110.7	M372 K425 K426 H427	M372-D423 HydrophobicContact SD-CB 3.71Å; D423-K425 PolarHBondContact O-N 2.94Å; D423-K426 PolarHBondContact O-N 2.77Å; D423-H427 PolarHBondContact N-O 3.45Å
424	S	64.7	Low	80.3	Confident	86 Å²	86	54.7 Å²	54.7	60%	0.601	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.8	-26.6	166.2	59.1	0	0	0	0	115.3	T373	T373-S424 PolarHBondContact OG1-N 2.86Å
425	K	65	Low	80.5	Confident	175 Å²	175	58.2 Å²	58.2	76%	0.761	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	15.1	177.5	-63.6	-179.7	-179.1	174.5	0	114.8	D423 H427	D423-K425 PolarHBondContact O-N 2.94Å; K425-H427 PolarHBondContact O-N 3.11Å
426	K	65.1	Low	80.5	Confident	141 Å²	141	58.8 Å²	58.8	61%	0.613	28%	0.277	S	S	*	.	S	Bend	trans	58.4	21.1	-172.8	-57.9	-173.8	179.4	-177.5	0	114.4	D423 D765	D423-K426 PolarHBondContact O-N 2.77Å; K426-D765 IonicContact NZ-OD2 3.52Å
427	H	68.8	Low	80.4	Confident	127 Å²	127	60.9 Å²	60.9	59%	0.588	29%	0.288	S	S	*	.			trans	-79.7	126.2	171.2	-167.3	64.1	0	0	0	109.6	K422 D423 K425	K422-H427 WeakPolarHBondContact CA-O 3.21Å; D423-H427 PolarHBondContact N-O 3.45Å; K425-H427 PolarHBondContact O-N 3.11Å
428	E	81.9	Confident	79.9	Confident	82 Å²	82	60.9 Å²	60.9	38%	0.383	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.3	178.1	-64	-171.7	175.9	0	0	109.9	F376 K387 W420 G421 K422	F376-E428 HydrophobicContact CE1-CG 4.29Å; F376-E428 HydrophobicContact CZ-CG 4.5Å; F376-E428 WeakPolarHBondContact CZ-OE2 3.37Å; K387-E428 IonicContact NZ-OE1 2.77Å; K387-E428 IonicContact NZ-OE2 3.86Å; K387-E428 PolarHBondContact NZ-OE2 3.15Å; W420-E428 HydrophobicContact CE3-CB 4.01Å; W420-E428 HydrophobicContact CZ3-CB 4.33Å; G421-E428 WeakPolarHBondContact O-CA 3.2Å; K422-E428 HydrophobicContact CB-CG 4.49Å; K422-E428 HydrophobicContact CD-CG 4.29Å; K422-E428 HydrophobicContact CG-CG 4.45Å
429	E	80.4	Confident	79.2	Confident	103 Å²	103	63.2 Å²	63.2	48%	0.481	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.9	177	-176.9	172.5	-154.8	0	0	110	M372 W420 G421 L431	M372-E429 HydrophobicContact CE-CB 4.11Å; M372-E429 WeakPolarHBondContact CE-OE2 3.43Å; W420-E429 WeakPolarHBondContact CA-O 3.4Å; W420-E429 VanDerWaalsContact CE3-C 3.49Å; G421-E429 PolarHBondContact N-O 2.83Å; G421-E429 PolarHBondContact O-N 2.83Å; E429-L431 PolarHBondContact O-N 2.65Å
430	R	80.6	Confident	78.5	Confident	119 Å²	119	67.1 Å²	67.1	45%	0.449	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	113.7	-179.7	-171.4	-175.2	-73.2	149.2	-11.5	110.1	E418 W420	E418-R430 IonicContact OE1-CZ 3.08Å; E418-R430 IonicContact OE1-NE 3.36Å; E418-R430 IonicContact OE1-NH2 2.67Å; E418-R430 PolarHBondContact OE1-NH2 2.91Å; E418-R430 IonicContact OE2-CZ 3.95Å; E418-R430 IonicContact OE2-NE 2.97Å; E418-R430 PolarHBondContact OE2-NE 3.35Å; E418-R430 VanDerWaalsContact OE2-NE 3.1Å; E418-R430 IonicContact OE2-NH2 2.73Å; E418-R430 PolarHBondContact OE2-NH2 2.87Å; W420-R430 HydrophobicContact CD2-CB 4.19Å; W420-R430 HydrophobicContact CE3-CB 4.13Å; W420-R430 HydrophobicContact CH2-CB 4.15Å; W420-R430 HydrophobicContact CZ2-CB 4.2Å; W420-R430 HydrophobicContact CZ2-CG 4.46Å; W420-R430 HydrophobicContact CZ3-CB 4.11Å
431	L	77.8	Confident	78.2	Confident	25 Å²	25	66 Å²	66	13%	0.131	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-28.8	178.3	-63	176.2	0	0	0	112.6	M372 M375 V419 E429 S455 C456	M372-L431 HydrophobicContact CG-CD2 4.48Å; M375-L431 HydrophobicContact CE-CD1 4.15Å; M375-L431 HydrophobicContact CG-CD1 4.12Å; V419-L431 HydrophobicContact CG1-CB 4.29Å; V419-L431 HydrophobicContact CG1-CD1 4.43Å; V419-L431 PolarHBondContact O-N 2.93Å; E429-L431 PolarHBondContact O-N 2.65Å; L431-S455 PolarHBondContact O-OG 2.96Å; L431-C456 PolarHBondContact O-SG 3.02Å
432	G	81	Confident	77.6	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.6	176.5	164.9	0	0	0	0	0	116.1	E418 V419 S455	E418-G432 CarbonylContact C-O 3.56Å; E418-G432 WeakPolarHBondContact CA-O 3.49Å; V419-G432 PolarHBondContact N-O 2.54Å; V419-G432 PolarHBondContact O-N 2.8Å; G432-S455 WeakPolarHBondContact CA-OG 2.97Å
433	T	87.6	Confident	77	Confident	40 Å²	40	72.4 Å²	72.4	25%	0.245	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	159.8	178.8	48.2	0	0	0	0	111.6	I417 E418 L453 D454	I417-T433 CarbonylContact O-C 3.56Å; I417-T433 VanDerWaalsContact O-CA 3.26Å; I417-T433 WeakPolarHBondContact O-CA 3.29Å; E418-T433 HydrophobicContact CG-CG2 4.32Å; T433-L453 WeakPolarHBondContact O-CA 3.17Å; T433-D454 VanDerWaalsContact C-OD2 3.25Å; T433-D454 WeakPolarHBondContact CB-OD2 2.96Å; T433-D454 PolarHBondContact O-N 2.73Å; T433-D454 VanDerWaalsContact O-OD2 3.06Å; T433-D454 PolarHBondContact OG1-OD2 3.28Å
434	C	87	Confident	76.4	Confident	10 Å²	10	77.3 Å²	77.3	7%	0.068	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.1	156.8	-164.1	0	0	0	0	108.6	I417 P452 L453	I417-C434 HydrophobicContact CB-CB 4.47Å; I417-C434 PolarHBondContact N-O 3.01Å; I417-C434 PolarHBondContact O-N 2.84Å; C434-P452 PolarHBondContact SG-O 2.97Å; C434-L453 HydrophobicContact CB-CD2 4.46Å
435	K	87.7	Confident	76.8	Confident	132 Å²	132	79 Å²	79	57%	0.574	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.9	176.9	-67.6	173.8	-177.1	-84.9	0	110.4	I414 L415 D416	I414-K435 HydrophobicContact CG2-CB 4.16Å; I414-K435 HydrophobicContact CG2-CG 4.42Å; L415-K435 WeakPolarHBondContact O-CA 3.23Å; D416-K435 IonicContact OD1-NZ 3.91Å; D416-K435 PolarHBondContact OD1-NZ 2.76Å
436	V	85.9	Confident	77.1	Confident	12 Å²	12	73.2 Å²	73.2	7%	0.073	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.9	176.1	-174.9	0	0	0	0	109.2	I414 L415 I417 I438 L441 L449 L451	I414-V436 WeakPolarHBondContact CA-O 3.49Å; L415-V436 HydrophobicContact CB-CB 4.23Å; L415-V436 HydrophobicContact CD2-CB 4.32Å; L415-V436 HydrophobicContact CD2-CG2 4.42Å; L415-V436 PolarHBondContact N-O 2.72Å; L415-V436 PolarHBondContact O-N 2.9Å; I417-V436 HydrophobicContact CD1-CG2 4.05Å; V436-I438 PolarHBondContact O-N 3.32Å; V436-L441 HydrophobicContact CG1-CD1 4.31Å; V436-L449 HydrophobicContact CG1-CD1 3.63Å; V436-L449 HydrophobicContact CG2-CD1 4.23Å; V436-L451 HydrophobicContact CG2-CD1 3.38Å; V436-L451 HydrophobicContact CG2-CD2 3.9Å; V436-L451 HydrophobicContact CG2-CG 4.31Å
437	D	83.7	Confident	77.8	Confident	73 Å²	73	67.3 Å²	67.3	39%	0.39	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	111.1	165.8	-167.3	-19.2	0	0	0	109.7	S439	D437-S439 VanDerWaalsContact C-N 3.28Å; D437-S439 VanDerWaalsContact CG-OG 3.23Å; D437-S439 PolarHBondContact O-N 3.49Å; D437-S439 VanDerWaalsContact OD1-CB 3.28Å; D437-S439 WeakPolarHBondContact OD1-CB 3.3Å; D437-S439 PolarHBondContact OD1-N 2.8Å; D437-S439 PolarHBondContact OD1-OG 2.87Å; D437-S439 PolarHBondContact OD2-OG 2.8Å
438	I	80.8	Confident	78.4	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-72.8	-23.4	179.9	-59.7	175.1	0	0	0	111.2	I357 L381 G413 L415 V436 A440 L441	I357-I438 HydrophobicContact CD1-CD1 3.65Å; I357-I438 HydrophobicContact CD1-CG2 4.09Å; I357-I438 HydrophobicContact CG1-CD1 4.31Å; I357-I438 HydrophobicContact CG1-CG2 3.98Å; I357-I438 HydrophobicContact CG2-CD1 4.34Å; L381-I438 HydrophobicContact CD1-CD1 3.85Å; L381-I438 HydrophobicContact CD2-CD1 3.94Å; G413-I438 VanDerWaalsContact O-CB 3.32Å; G413-I438 WeakPolarHBondContact O-CB 3.48Å; G413-I438 WeakPolarHBondContact O-CG1 3.44Å; G413-I438 PolarHBondContact O-N 3.38Å; L415-I438 HydrophobicContact CB-CD1 4Å; L415-I438 HydrophobicContact CB-CG1 4.24Å; V436-I438 PolarHBondContact O-N 3.32Å; I438-A440 PolarHBondContact O-N 3.27Å; I438-L441 WeakPolarHBondContact O-CB 3.29Å; I438-L441 PolarHBondContact O-N 2.86Å; I438-L441 VanDerWaalsContact O-N 3.09Å
439	S	72.9	Confident	78.3	Confident	74 Å²	74	62.1 Å²	62.1	52%	0.517	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-67.3	-22.5	-178.8	72.4	0	0	0	0	113.3	D437 L441	D437-S439 VanDerWaalsContact C-N 3.28Å; D437-S439 VanDerWaalsContact CG-OG 3.23Å; D437-S439 PolarHBondContact O-N 3.49Å; D437-S439 VanDerWaalsContact OD1-CB 3.28Å; D437-S439 WeakPolarHBondContact OD1-CB 3.3Å; D437-S439 PolarHBondContact OD1-N 2.8Å; D437-S439 PolarHBondContact OD1-OG 2.87Å; D437-S439 PolarHBondContact OD2-OG 2.8Å; S439-L441 VanDerWaalsContact C-N 3.34Å
440	A	74.8	Confident	78.5	Confident	83 Å²	83	62.1 Å²	62.1	69%	0.686	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-81.4	-6.7	174.5	0	0	0	0	0	114	I438	I438-A440 PolarHBondContact O-N 3.27Å
441	L	77.4	Confident	78.6	Confident	27 Å²	27	57.5 Å²	57.5	14%	0.141	32%	0.321	C	S	.	.	S	Bend	trans	-92.7	136.9	-173.9	-60.3	178.9	0	0	0	112.4	V436 I438 S439 N447 L449 V464	V436-L441 HydrophobicContact CG1-CD1 4.31Å; I438-L441 WeakPolarHBondContact O-CB 3.29Å; I438-L441 PolarHBondContact O-N 2.86Å; I438-L441 VanDerWaalsContact O-N 3.09Å; S439-L441 VanDerWaalsContact C-N 3.34Å; L441-N447 HydrophobicContact CD2-CB 4.29Å; L441-L449 HydrophobicContact CD1-CD1 4.29Å; L441-L449 HydrophobicContact CD2-CD2 4.18Å; L441-V464 HydrophobicContact CD1-CB 3.96Å; L441-V464 HydrophobicContact CD1-CG1 3.57Å
442	P	69.9	Low	78.9	Confident	61 Å²	61	60.7 Å²	60.7	40%	0.396	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-68.8	137.4	-178	26.9	-34.1	0	0	0	112.9	Q445 N447	P442-Q445 HydrophobicContact CG-CB 4.26Å; P442-N447 WeakPolarHBondContact CD-OD1 3.28Å; P442-N447 WeakPolarHBondContact CG-OD1 3.35Å; P442-N447 PolarHBondContact O-ND2 3.09Å
443	L	68.3	Low	79	Confident	111 Å²	111	61.1 Å²	61.1	58%	0.581	35%	0.346	S	S	*	.	B	Isolated β-bridge	trans	-63.2	140.3	179.3	-74.3	154.5	0	0	0	112.3	Q445 L466 P468	L443-Q445 PolarHBondContact O-N 3.37Å; L443-L466 HydrophobicContact CD2-CD2 3.55Å; L443-L466 HydrophobicContact CD2-CG 3.77Å; L443-L466 HydrophobicContact CG-CD2 4.12Å; L443-P468 HydrophobicContact CD2-CB 4.11Å; L443-P468 HydrophobicContact CD2-CG 3.92Å
444	K	63.6	Low	78.5	Confident	143 Å²	143	64.6 Å²	64.6	62%	0.622	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	0.1	178.7	-60.5	-168.8	178.5	-160.3	0	116.5	L466 P468	K444-L466 PolarHBondContact N-O 2.94Å; K444-P468 HydrophobicContact CD-CG 4.4Å; K444-P468 VanDerWaalsContact CE-CG 3.48Å; K444-P468 HydrophobicContact CG-CG 4.05Å
445	Q	72.4	Confident	77.4	Confident	122 Å²	122	68 Å²	68	57%	0.57	39%	0.387	S	S	*	.	S	Bend	trans	-94.9	155.5	174.2	-172.7	162.8	-8.9	0	0	111.5	P442 L443 N447	P442-Q445 HydrophobicContact CG-CB 4.26Å; L443-Q445 PolarHBondContact O-N 3.37Å; Q445-N447 PolarHBondContact O-ND2 3.04Å
446	A	72.1	Confident	76.3	Confident	52 Å²	52	63.1 Å²	63.1	43%	0.43	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	105.5	175	0	0	0	0	0	110.4	L463 T465	A446-L463 HydrophobicContact CB-CD1 3.86Å; A446-L463 HydrophobicContact CB-CD2 4.17Å; A446-L463 HydrophobicContact CB-CG 4.06Å; A446-T465 HydrophobicContact CB-CG2 3.45Å; A446-T465 VanDerWaalsContact CB-CG2 3.45Å
447	N	79.3	Confident	75.2	Confident	18 Å²	18	69.6 Å²	69.6	10%	0.096	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	107.4	-171.5	-55.3	-56.8	0	0	0	109	L441 P442 Q445 L449 L463 V464	L441-N447 HydrophobicContact CD2-CB 4.29Å; P442-N447 WeakPolarHBondContact CD-OD1 3.28Å; P442-N447 WeakPolarHBondContact CG-OD1 3.35Å; P442-N447 PolarHBondContact O-ND2 3.09Å; Q445-N447 PolarHBondContact O-ND2 3.04Å; N447-L449 PolarHBondContact O-N 3.49Å; N447-L463 WeakPolarHBondContact O-CA 3.45Å; N447-V464 WeakPolarHBondContact CB-O 3.2Å; N447-V464 PolarHBondContact N-O 3.36Å; N447-V464 PolarHBondContact ND2-O 3.09Å; N447-V464 PolarHBondContact O-N 3.28Å
448	C	80.8	Confident	74.8	Confident	67 Å²	67	66.6 Å²	66.6	45%	0.453	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	119.6	176.9	-165	0	0	0	0	108.7	M462 L463	C448-M462 CarbonylContact C-O 3.57Å; C448-M462 WeakPolarHBondContact CA-O 3.25Å; C448-L463 HydrophobicContact CB-CD1 3.96Å
449	L	81.1	Confident	74.9	Confident	33 Å²	33	67.5 Å²	67.5	17%	0.173	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.4	-178	-55.6	-179.5	0	0	0	108.8	V436 L441 N447 L451 L461 M462 V464	V436-L449 HydrophobicContact CG1-CD1 3.63Å; V436-L449 HydrophobicContact CG2-CD1 4.23Å; L441-L449 HydrophobicContact CD1-CD1 4.29Å; L441-L449 HydrophobicContact CD2-CD2 4.18Å; N447-L449 PolarHBondContact O-N 3.49Å; L449-L451 HydrophobicContact CB-CD1 4.29Å; L449-L451 HydrophobicContact CB-CD2 4.09Å; L449-L451 HydrophobicContact CB-CG 3.97Å; L449-L461 WeakPolarHBondContact O-CA 3.36Å; L449-M462 HydrophobicContact CB-CG 4.17Å; L449-M462 PolarHBondContact N-O 2.84Å; L449-M462 PolarHBondContact O-N 3.1Å; L449-V464 HydrophobicContact CD1-CB 4.36Å; L449-V464 HydrophobicContact CD1-CG2 3.74Å; L449-V464 HydrophobicContact CG-CG2 4.45Å
450	E	84.8	Confident	75.5	Confident	102 Å²	102	64 Å²	64	48%	0.477	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.2	167.8	-179.3	153.6	-167.1	0	0	107.8	K365 A459 L461	K365-E450 WeakPolarHBondContact CD-OE1 3.43Å; K365-E450 WeakPolarHBondContact CE-OE1 3.12Å; K365-E450 IonicContact NZ-OE1 2.79Å; K365-E450 PolarHBondContact NZ-OE1 2.84Å; K365-E450 IonicContact NZ-OE2 3.78Å; K365-E450 PolarHBondContact NZ-OE2 3.09Å; E450-A459 HydrophobicContact CG-CB 4Å; E450-L461 HydrophobicContact CB-CD1 3.98Å
451	L	82.1	Confident	76.1	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.115	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.1	-163.1	-66.3	176.3	0	0	0	110.9	I417 V436 L449 A459 L460 M462	I417-L451 HydrophobicContact CD1-CD1 3.93Å; V436-L451 HydrophobicContact CG2-CD1 3.38Å; V436-L451 HydrophobicContact CG2-CD2 3.9Å; V436-L451 HydrophobicContact CG2-CG 4.31Å; L449-L451 HydrophobicContact CB-CD1 4.29Å; L449-L451 HydrophobicContact CB-CD2 4.09Å; L449-L451 HydrophobicContact CB-CG 3.97Å; L451-A459 CarbonylContact O-C 3.58Å; L451-A459 VanDerWaalsContact O-CA 3.28Å; L451-A459 WeakPolarHBondContact O-CA 3.37Å; L451-L460 PolarHBondContact N-O 2.79Å; L451-L460 PolarHBondContact O-N 3.46Å; L451-M462 HydrophobicContact CD1-CE 3.71Å; L451-M462 HydrophobicContact CD1-CG 4.13Å; L451-M462 HydrophobicContact CD1-SD 3.59Å; L451-M462 VanDerWaalsContact CD1-SD 3.59Å
452	P	83.6	Confident	76.5	Confident	92 Å²	92	59.3 Å²	59.3	60%	0.597	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	147	175.4	28.4	-34.3	0	0	0	110.9	C434	C434-P452 PolarHBondContact SG-O 2.97Å
453	L	83.6	Confident	77.1	Confident	10 Å²	10	58 Å²	58	5%	0.052	32%	0.324	C	S	.	.			trans	-94.6	126.7	177.3	-64.4	170.7	0	0	0	110.5	V367 V419 T433 C434 S455 C456 G458 L460	V367-L453 HydrophobicContact CG2-CD1 4.23Å; V419-L453 HydrophobicContact CG2-CD1 3.99Å; V419-L453 HydrophobicContact CG2-CD2 3.65Å; T433-L453 WeakPolarHBondContact O-CA 3.17Å; C434-L453 HydrophobicContact CB-CD2 4.46Å; L453-S455 PolarHBondContact O-N 3.28Å; L453-C456 PolarHBondContact O-N 2.64Å; L453-C456 VanDerWaalsContact O-O 3.12Å; L453-G458 PolarHBondContact N-O 3.5Å; L453-L460 HydrophobicContact CD2-CB 4.49Å
454	D	77.2	Confident	77.8	Confident	112 Å²	112	52.8 Å²	52.8	60%	0.599	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.5	-168.7	-59.8	-48	0	0	0	114.7	T433	T433-D454 VanDerWaalsContact C-OD2 3.25Å; T433-D454 WeakPolarHBondContact CB-OD2 2.96Å; T433-D454 PolarHBondContact O-N 2.73Å; T433-D454 VanDerWaalsContact O-OD2 3.06Å; T433-D454 PolarHBondContact OG1-OD2 3.28Å
455	S	63.6	Low	78.4	Confident	83 Å²	83	47.3 Å²	47.3	58%	0.58	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	9.2	-172.1	65.2	0	0	0	0	115.6	L431 G432 L453	L431-S455 PolarHBondContact O-OG 2.96Å; G432-S455 WeakPolarHBondContact CA-OG 2.97Å; L453-S455 PolarHBondContact O-N 3.28Å
456	C	64.1	Low	78.5	Confident	29 Å²	29	41.8 Å²	41.8	20%	0.196	25%	0.25	C	S	.	.	S	Bend	trans	-148.8	156.8	171.9	57.4	0	0	0	0	112	L431 L453 G458	L431-C456 PolarHBondContact O-SG 3.02Å; L453-C456 PolarHBondContact O-N 2.64Å; L453-C456 VanDerWaalsContact O-O 3.12Å; C456-G458 PolarHBondContact O-N 3.3Å
457	L	63.9	Low	78	Confident	147 Å²	147	40.7 Å²	40.7	77%	0.77	24%	0.238	S	C	*	.	S	Bend	trans	-77	50	-173.9	-69	173.3	0	0	0	113.4	N366	N366-L457 PolarHBondContact ND2-O 2.89Å; N366-L457 VanDerWaalsContact O-O 3.09Å
458	G	74.7	Confident	77	Confident	10 Å²	10	42.1 Å²	42.1	10%	0.103	25%	0.248	C	C	.	.			trans	-137.3	161.8	179.5	0	0	0	0	0	113.3	K365 L453 C456	K365-G458 CarbonylContact O-C 3.45Å; K365-G458 WeakPolarHBondContact O-CA 3.33Å; L453-G458 PolarHBondContact N-O 3.5Å; C456-G458 PolarHBondContact O-N 3.3Å
459	A	83.4	Confident	75.7	Confident	19 Å²	19	40.5 Å²	40.5	16%	0.157	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	148.4	174.5	0	0	0	0	0	110.4	G364 K365 E450 L451	G364-A459 CarbonylContact C-O 3.55Å; G364-A459 WeakPolarHBondContact CA-O 3.38Å; K365-A459 PolarHBondContact N-O 3.42Å; K365-A459 PolarHBondContact O-N 3.22Å; E450-A459 HydrophobicContact CG-CB 4Å; L451-A459 CarbonylContact O-C 3.58Å; L451-A459 VanDerWaalsContact O-CA 3.28Å; L451-A459 WeakPolarHBondContact O-CA 3.37Å
460	L	85.7	Confident	74.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.1	-178.7	-167.4	63.5	0	0	0	109.7	L361 V377 W399 I417 V419 L451 L453 M462	L361-L460 HydrophobicContact CD1-CD1 3.92Å; L361-L460 HydrophobicContact CD1-CD2 3.97Å; L361-L460 HydrophobicContact CD1-CG 4Å; V377-L460 HydrophobicContact CG1-CD2 4.21Å; V377-L460 HydrophobicContact CG2-CD1 4.48Å; W399-L460 HydrophobicContact CE3-CD1 4.27Å; W399-L460 HydrophobicContact CH2-CD1 4.37Å; W399-L460 HydrophobicContact CZ3-CD1 3.57Å; I417-L460 HydrophobicContact CG2-CD2 3.75Å; V419-L460 HydrophobicContact CG2-CD2 4.36Å; L451-L460 PolarHBondContact N-O 2.79Å; L451-L460 PolarHBondContact O-N 3.46Å; L453-L460 HydrophobicContact CD2-CB 4.49Å; L460-M462 HydrophobicContact CB-CE 4.37Å; L460-M462 HydrophobicContact CD2-CE 3.47Å; L460-M462 VanDerWaalsContact CD2-CE 3.47Å; L460-M462 HydrophobicContact CG-CE 3.68Å
461	L	86	Confident	72.7	Confident	12 Å²	12	36.9 Å²	36.9	6%	0.063	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.3	179.7	-167.4	72.4	0	0	0	110.3	L362 E363 L449 E450 Y835	L362-L461 HydrophobicContact CB-CD2 4.44Å; L362-L461 WeakPolarHBondContact CB-O 3.48Å; L362-L461 HydrophobicContact CD1-CD2 4.16Å; L362-L461 HydrophobicContact CD1-CG 4.13Å; L362-L461 PolarHBondContact N-O 2.85Å; E363-L461 HydrophobicContact CG-CB 3.93Å; E363-L461 HydrophobicContact CG-CD2 4.04Å; E363-L461 PolarHBondContact N-O 2.86Å; E363-L461 PolarHBondContact O-N 2.89Å; L449-L461 WeakPolarHBondContact O-CA 3.36Å; E450-L461 HydrophobicContact CB-CD1 3.98Å; L461-Y835 HydrophobicContact CD2-CE1 4.34Å
462	M	85.8	Confident	71.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	163.4	177	63.4	-172.5	65	0	0	113.2	I359 T360 L361 I417 C448 L449 L451 L460 V464	I359-M462 HydrophobicContact CG2-SD 4.28Å; T360-M462 CarbonylContact O-C 3.5Å; T360-M462 WeakPolarHBondContact O-CA 3.45Å; T360-M462 VanDerWaalsContact O-CB 3.29Å; T360-M462 WeakPolarHBondContact O-CB 3.28Å; L361-M462 HydrophobicContact CD1-CE 4.09Å; I417-M462 HydrophobicContact CD1-CE 3.57Å; I417-M462 HydrophobicContact CD1-SD 3.63Å; C448-M462 CarbonylContact C-O 3.57Å; C448-M462 WeakPolarHBondContact CA-O 3.25Å; L449-M462 HydrophobicContact CB-CG 4.17Å; L449-M462 PolarHBondContact N-O 2.84Å; L449-M462 PolarHBondContact O-N 3.1Å; L451-M462 HydrophobicContact CD1-CE 3.71Å; L451-M462 HydrophobicContact CD1-CG 4.13Å; L451-M462 HydrophobicContact CD1-SD 3.59Å; L451-M462 VanDerWaalsContact CD1-SD 3.59Å; L460-M462 HydrophobicContact CB-CE 4.37Å; L460-M462 HydrophobicContact CD2-CE 3.47Å; L460-M462 VanDerWaalsContact CD2-CE 3.47Å; L460-M462 HydrophobicContact CG-CE 3.68Å; M462-V464 HydrophobicContact CG-CG2 4.34Å; M462-V464 HydrophobicContact SD-CG2 4.46Å
463	L	83.8	Confident	69.9	Low	34 Å²	34	32 Å²	32	18%	0.178	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	111.5	179.3	-169.3	70.7	0	0	0	109.7	I359 T360 L362 A446 N447 C448	I359-L463 WeakPolarHBondContact CA-O 3.35Å; T360-L463 PolarHBondContact N-O 3.34Å; T360-L463 PolarHBondContact O-N 2.53Å; L362-L463 HydrophobicContact CD1-CB 4.37Å; A446-L463 HydrophobicContact CB-CD1 3.86Å; A446-L463 HydrophobicContact CB-CD2 4.17Å; A446-L463 HydrophobicContact CB-CG 4.06Å; N447-L463 WeakPolarHBondContact O-CA 3.45Å; C448-L463 HydrophobicContact CB-CD1 3.96Å
464	V	82.3	Confident	68.4	Low	1 Å²	1	34 Å²	34	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.8	-177.7	-177.1	0	0	0	0	110.2	I357 I359 L441 N447 L449 M462	I357-V464 HydrophobicContact CG2-CG1 3.58Å; I359-V464 HydrophobicContact CG1-CG1 4.41Å; I359-V464 HydrophobicContact CG1-CG2 4.41Å; I359-V464 HydrophobicContact CG2-CG2 4.35Å; L441-V464 HydrophobicContact CD1-CB 3.96Å; L441-V464 HydrophobicContact CD1-CG1 3.57Å; N447-V464 WeakPolarHBondContact CB-O 3.2Å; N447-V464 PolarHBondContact N-O 3.36Å; N447-V464 PolarHBondContact ND2-O 3.09Å; N447-V464 PolarHBondContact O-N 3.28Å; L449-V464 HydrophobicContact CD1-CB 4.36Å; L449-V464 HydrophobicContact CD1-CG2 3.74Å; L449-V464 HydrophobicContact CG-CG2 4.45Å; M462-V464 HydrophobicContact CG-CG2 4.34Å; M462-V464 HydrophobicContact SD-CG2 4.46Å
465	T	77.2	Confident	67.1	Low	28 Å²	28	28.9 Å²	28.9	17%	0.172	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	107.5	178.8	43.1	0	0	0	0	111.2	I357 S358 A446 T467	I357-T465 WeakPolarHBondContact CA-O 3.31Å; S358-T465 VanDerWaalsContact CB-OG1 3.29Å; S358-T465 WeakPolarHBondContact CB-OG1 3.27Å; S358-T465 PolarHBondContact N-O 3.29Å; S358-T465 PolarHBondContact O-N 2.74Å; S358-T465 PolarHBondContact O-OG1 2.57Å; A446-T465 HydrophobicContact CB-CG2 3.45Å; A446-T465 VanDerWaalsContact CB-CG2 3.45Å; T465-T467 PolarHBondContact O-N 3.12Å
466	L	72.8	Confident	66.3	Low	7 Å²	7	29 Å²	29	4%	0.037	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	105	176.6	178.9	63.3	0	0	0	110.3	I357 Y407 L443 K444 P468	I357-L466 HydrophobicContact CG1-CD1 3.51Å; Y407-L466 HydrophobicContact CD1-CD1 3.9Å; Y407-L466 HydrophobicContact CG-CD1 3.95Å; L443-L466 HydrophobicContact CD2-CD2 3.55Å; L443-L466 HydrophobicContact CD2-CG 3.77Å; L443-L466 HydrophobicContact CG-CD2 4.12Å; K444-L466 PolarHBondContact N-O 2.94Å; L466-P468 WeakPolarHBondContact O-CD 3.17Å
467	T	62.7	Low	65.5	Low	29 Å²	29	31.5 Å²	31.5	18%	0.178	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	103.3	-178.9	-50	0	0	0	0	109.8	G355 I356 T465 C469	G355-T467 CarbonylContact C-O 3.43Å; G355-T467 WeakPolarHBondContact CA-O 3.49Å; I356-T467 PolarHBondContact N-O 2.93Å; I356-T467 WeakPolarHBondContact O-CA 3.43Å; I356-T467 WeakPolarHBondContact O-CB 3.44Å; I356-T467 PolarHBondContact O-N 3.48Å; T465-T467 PolarHBondContact O-N 3.12Å; T467-C469 PolarHBondContact O-N 3.05Å
468	P	57.8	Low	64	Low	48 Å²	48	30.5 Å²	30.5	31%	0.312	19%	0.192	S	C	.	.			trans	-68.5	121.6	173.9	29.6	-33.6	0	0	0	109	L443 K444 L466	L443-P468 HydrophobicContact CD2-CB 4.11Å; L443-P468 HydrophobicContact CD2-CG 3.92Å; K444-P468 HydrophobicContact CD-CG 4.4Å; K444-P468 VanDerWaalsContact CE-CG 3.48Å; K444-P468 HydrophobicContact CG-CG 4.05Å; L466-P468 WeakPolarHBondContact O-CD 3.17Å
469	C	53.5	Low	62.5	Low	33 Å²	33	34.3 Å²	34.3	22%	0.223	21%	0.213	C	C	.	.			trans	-115.1	153.9	-177.7	-167.4	0	0	0	0	109.1	T467 G471	T467-C469 PolarHBondContact O-N 3.05Å; C469-G471 VanDerWaalsContact C-N 3.25Å; C469-G471 PolarHBondContact O-N 2.94Å
470	A	51.5	Low	60.9	Low	52 Å²	52	34 Å²	34	43%	0.43	21%	0.209	S	C	.	.			trans	-73.1	91.4	162	0	0	0	0	0	106.6
471	G	51.2	Low	59.2	Low	6 Å²	6	34.9 Å²	34.9	6%	0.062	22%	0.216	C	C	.	.			trans	-63.2	165.5	-170.3	0	0	0	0	0	113.6	C469 S473	C469-G471 VanDerWaalsContact C-N 3.25Å; C469-G471 PolarHBondContact O-N 2.94Å; G471-S473 PolarHBondContact O-N 3.22Å
472	V	54.3	Low	57.6	Low	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.215	C	C	.	.			trans	-52.7	128.6	174.2	174.7	0	0	0	0	110	Q351 L352 W353 D540 L542 T560 F561 P562	Q351-V472 WeakPolarHBondContact CA-O 3.44Å; L352-V472 HydrophobicContact CD1-CG1 4.05Å; L352-V472 PolarHBondContact N-O 2.9Å; L352-V472 VanDerWaalsContact N-O 3.1Å; W353-V472 HydrophobicContact CH2-CB 3.87Å; W353-V472 HydrophobicContact CH2-CG2 3.57Å; W353-V472 HydrophobicContact CZ2-CB 3.82Å; W353-V472 HydrophobicContact CZ2-CG2 3.29Å; W353-V472 HydrophobicContact CZ3-CB 4.42Å; V472-D540 HydrophobicContact CG2-CB 4.19Å; V472-D540 VanDerWaalsContact CG2-OD2 3.28Å; V472-D540 WeakPolarHBondContact CG2-OD2 3.42Å; V472-L542 HydrophobicContact CG1-CD1 3.33Å; V472-L542 HydrophobicContact CG1-CD2 3.59Å; V472-L542 HydrophobicContact CG1-CG 3.91Å; V472-T560 WeakPolarHBondContact CA-O 3.09Å; V472-F561 HydrophobicContact CG1-CD1 4.47Å; V472-F561 HydrophobicContact CG2-CD1 4.36Å; V472-P562 HydrophobicContact CG2-CG 4.12Å
473	S	52.4	Low	55.9	Low	12 Å²	12	38.3 Å²	38.3	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.8	-179.7	66	0	0	0	0	112.6	N350 G471 T560	N350-S473 WeakPolarHBondContact O-CA 3.32Å; G471-S473 PolarHBondContact O-N 3.22Å; S473-T560 PolarHBondContact N-O 2.7Å; S473-T560 VanDerWaalsContact N-O 3.15Å; S473-T560 PolarHBondContact O-N 3.44Å
474	I	52.6	Low	54.7	Low	53 Å²	53	40.3 Å²	40.3	27%	0.272	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.8	168.6	-52.1	-179.9	0	0	0	107	N350 L352 L542 F559	N350-I474 WeakPolarHBondContact CB-O 3.28Å; N350-I474 PolarHBondContact ND2-O 2.83Å; N350-I474 PolarHBondContact O-N 2.8Å; L352-I474 HydrophobicContact CD1-CD1 4.02Å; L352-I474 HydrophobicContact CD1-CG1 3.92Å; I474-L542 HydrophobicContact CD1-CD2 4.37Å; I474-L542 HydrophobicContact CG1-CD2 4.45Å; I474-F559 HydrophobicContact CD1-CD1 4.4Å; I474-F559 HydrophobicContact CD1-CE1 4.09Å; I474-F559 HydrophobicContact CG1-CD1 3.94Å; I474-F559 HydrophobicContact CG1-CE1 4.08Å; I474-F559 HydrophobicContact CG2-CD1 4.22Å; I474-F559 HydrophobicContact CG2-CE1 3.99Å
475	S	49.9	Very low	53.6	Low	4 Å²	4	44.4 Å²	44.4	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	153.2	175.5	-69.4	0	0	0	0	111.6	V479 V558	S475-V479 VanDerWaalsContact CB-O 3.28Å; S475-V479 WeakPolarHBondContact CB-O 3.23Å; S475-V558 PolarHBondContact N-O 3.07Å; S475-V558 PolarHBondContact O-N 3.33Å; S475-V558 VanDerWaalsContact O-O 3.06Å
476	D	46.5	Very low	52.7	Low	86 Å²	86	45.9 Å²	45.9	46%	0.46	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	156.7	170.6	-72.7	-52.6	0	0	0	111	C478 V479 K557	D476-C478 PolarHBondContact O-N 2.88Å; D476-V479 PolarHBondContact O-N 2.76Å; D476-K557 IonicContact OD1-NZ 2.71Å; D476-K557 PolarHBondContact OD1-NZ 2.8Å
477	L	48.3	Very low	52.3	Low	81 Å²	81	49.4 Å²	49.4	42%	0.424	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.7	178.9	-163.4	66.1	0	0	0	114	C480 K513 N556 V558	L477-C480 PolarHBondContact O-SG 2.86Å; L477-C480 VanDerWaalsContact O-SG 3.38Å; L477-K513 HydrophobicContact CD1-CD 3.85Å; L477-N556 HydrophobicContact CD2-CB 4.42Å; L477-V558 HydrophobicContact CD1-CG2 3.71Å
478	C	31	Very low	52.6	Low	125 Å²	125	52.3 Å²	52.3	85%	0.845	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.1	175.8	-61	0	0	0	0	114.2	D476	D476-C478 PolarHBondContact O-N 2.88Å
479	V	44.6	Very low	52.9	Low	90 Å²	90	56.7 Å²	56.7	55%	0.545	33%	0.331	S	S	.	.	S	Bend	trans	-138.7	57.7	-175.6	-164.7	0	0	0	0	110.1	S475 D476 P481	S475-V479 VanDerWaalsContact CB-O 3.28Å; S475-V479 WeakPolarHBondContact CB-O 3.23Å; D476-V479 PolarHBondContact O-N 2.76Å; V479-P481 WeakPolarHBondContact O-CD 3.45Å
480	C	49.3	Very low	53.6	Low	12 Å²	12	61.2 Å²	61.2	8%	0.081	35%	0.349	C	S	.	.			trans	-92.6	120.5	179.8	-50.3	0	0	0	0	111.4	L477 L482 A483	L477-C480 PolarHBondContact O-SG 2.86Å; L477-C480 VanDerWaalsContact O-SG 3.38Å; C480-L482 PolarHBondContact O-N 3.32Å; C480-A483 HydrophobicContact CB-CB 3.87Å; C480-A483 WeakPolarHBondContact O-CB 3.46Å; C480-A483 PolarHBondContact O-N 3.08Å
481	P	50	Low	54.4	Low	20 Å²	20	60 Å²	60	13%	0.13	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-12	-178.6	-28.6	36.4	0	0	0	116.9	V479 E487	V479-P481 WeakPolarHBondContact O-CD 3.45Å; P481-E487 WeakPolarHBondContact CA-OE2 3.41Å; P481-E487 VanDerWaalsContact O-CB 3.26Å; P481-E487 WeakPolarHBondContact O-CB 2.97Å
482	L	52.4	Low	55.4	Low	11 Å²	11	63 Å²	63	6%	0.058	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-6	174.7	-80.5	72.9	0	0	0	113.1	C480 I491 Q511 D624 I626	C480-L482 PolarHBondContact O-N 3.32Å; L482-I491 HydrophobicContact CD1-CD1 3.97Å; L482-Q511 HydrophobicContact CD1-CB 4.46Å; L482-Q511 HydrophobicContact CD2-CB 4.38Å; L482-D624 HydrophobicContact CD2-CB 3.96Å; L482-I626 HydrophobicContact CD2-CD1 3.74Å; L482-I626 HydrophobicContact CD2-CG1 4.26Å; L482-I626 HydrophobicContact CG-CD1 4.34Å
483	A	50.2	Low	56.2	Low	73 Å²	73	69.3 Å²	69.3	60%	0.603	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-26.2	175.1	0	0	0	0	0	112.6	C480 P485	C480-A483 HydrophobicContact CB-CB 3.87Å; C480-A483 WeakPolarHBondContact O-CB 3.46Å; C480-A483 PolarHBondContact O-N 3.08Å; A483-P485 WeakPolarHBondContact O-CD 3.31Å
484	D	58.3	Low	57	Low	75 Å²	75	73.9 Å²	73.9	40%	0.401	40%	0.397	S	S	.	.	S	Bend	trans	-79.2	119.7	167.9	-167.4	-60.2	0	0	0	109.9	S486 E487 R488	D484-S486 PolarHBondContact O-N 2.89Å; D484-S486 VanDerWaalsContact O-N 3.16Å; D484-S486 WeakPolarHBondContact OD1-CA 3Å; D484-S486 WeakPolarHBondContact OD1-CB 3.15Å; D484-S486 PolarHBondContact OD1-N 3.04Å; D484-S486 PolarHBondContact OD1-OG 3.49Å; D484-E487 HydrophobicContact CB-CB 4.33Å; D484-E487 HydrophobicContact CB-CG 4.31Å; D484-E487 PolarHBondContact O-N 3.34Å; D484-R488 PolarHBondContact O-N 2.86Å
485	P	60.2	Low	58	Low	88 Å²	88	72 Å²	72	57%	0.571	39%	0.387	S	S	*	.	H	α-helix	trans	-69.5	-10.6	-177.7	29.6	-36.1	0	0	0	113.5	A483 K489	A483-P485 WeakPolarHBondContact O-CD 3.31Å; P485-K489 VanDerWaalsContact O-CD 3.24Å; P485-K489 WeakPolarHBondContact O-CD 3.49Å; P485-K489 WeakPolarHBondContact O-CG 3.43Å
486	S	57	Low	59.3	Low	59 Å²	59	74 Å²	74	41%	0.413	40%	0.4	S	S	.	.	H	α-helix	trans	-84.4	-42.6	172.2	76.3	0	0	0	0	111.9	D484 K489 Q490	D484-S486 PolarHBondContact O-N 2.89Å; D484-S486 VanDerWaalsContact O-N 3.16Å; D484-S486 WeakPolarHBondContact OD1-CA 3Å; D484-S486 WeakPolarHBondContact OD1-CB 3.15Å; D484-S486 PolarHBondContact OD1-N 3.04Å; D484-S486 PolarHBondContact OD1-OG 3.49Å; S486-K489 PolarHBondContact O-N 2.86Å; S486-Q490 WeakPolarHBondContact O-CG 3.48Å; S486-Q490 PolarHBondContact O-N 3.25Å
487	E	63.9	Low	60.5	Low	81 Å²	81	75.4 Å²	75.4	38%	0.379	41%	0.407	S	S	.	.	H	α-helix	trans	-66.7	-44.7	174.1	-67.6	-164.7	171.6	0	0	110.9	P481 D484 K489 Q490 I491	P481-E487 WeakPolarHBondContact CA-OE2 3.41Å; P481-E487 VanDerWaalsContact O-CB 3.26Å; P481-E487 WeakPolarHBondContact O-CB 2.97Å; D484-E487 HydrophobicContact CB-CB 4.33Å; D484-E487 HydrophobicContact CB-CG 4.31Å; D484-E487 PolarHBondContact O-N 3.34Å; E487-K489 PolarHBondContact O-N 3.12Å; E487-Q490 PolarHBondContact O-N 3.08Å; E487-I491 WeakPolarHBondContact O-CG1 3.26Å; E487-I491 PolarHBondContact O-N 3.4Å
488	R	70.1	Confident	61.6	Low	89 Å²	89	83 Å²	83	34%	0.336	43%	0.43	S	S	.	.	H	α-helix	trans	-54.1	-40	173	-168.2	-176.9	-173.5	113.1	14.4	112.2	D484 T492 D624 I626	D484-R488 PolarHBondContact O-N 2.86Å; R488-T492 WeakPolarHBondContact O-CB 3.38Å; R488-T492 PolarHBondContact O-N 3.4Å; R488-T492 PolarHBondContact O-OG1 2.78Å; R488-D624 IonicContact CZ-OD1 2.68Å; R488-D624 IonicContact CZ-OD2 3.12Å; R488-D624 IonicContact NH1-OD1 3.44Å; R488-D624 IonicContact NH1-OD2 2.74Å; R488-D624 PolarHBondContact NH1-OD2 3.37Å; R488-D624 VanDerWaalsContact NH2-CG 3.29Å; R488-D624 IonicContact NH2-OD1 3.77Å; R488-D624 PolarHBondContact NH2-OD1 3.49Å; R488-D624 IonicContact NH2-OD2 3.4Å; R488-D624 PolarHBondContact NH2-OD2 3.1Å; R488-I626 HydrophobicContact CG-CD1 4.23Å
489	K	64.6	Low	63.5	Low	141 Å²	141	79.1 Å²	79.1	61%	0.613	40%	0.401	S	S	*	.	H	α-helix	trans	-67.7	-41.6	176	-78.8	171.3	-171.7	173.2	0	112.5	P485 S486 E487 T492 Q493	P485-K489 VanDerWaalsContact O-CD 3.24Å; P485-K489 WeakPolarHBondContact O-CD 3.49Å; P485-K489 WeakPolarHBondContact O-CG 3.43Å; S486-K489 PolarHBondContact O-N 2.86Å; E487-K489 PolarHBondContact O-N 3.12Å; K489-T492 PolarHBondContact O-N 2.78Å; K489-Q493 WeakPolarHBondContact O-CB 3.42Å; K489-Q493 VanDerWaalsContact O-CG 3.32Å; K489-Q493 WeakPolarHBondContact O-CG 3.26Å; K489-Q493 PolarHBondContact O-N 3.02Å
490	Q	67.5	Low	64.9	Low	128 Å²	128	75.3 Å²	75.3	60%	0.598	38%	0.378	S	S	*	.	H	α-helix	trans	-63.9	-43.3	175.6	-69.3	178.4	49.9	0	0	111.7	S486 E487 Q493 R494	S486-Q490 WeakPolarHBondContact O-CG 3.48Å; S486-Q490 PolarHBondContact O-N 3.25Å; E487-Q490 PolarHBondContact O-N 3.08Å; Q490-Q493 PolarHBondContact O-N 3.43Å; Q490-R494 PolarHBondContact O-N 2.89Å
491	I	68.7	Low	65.8	Low	27 Å²	27	82.2 Å²	82.2	14%	0.138	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-46.8	175.5	-68.2	168.8	0	0	0	110.5	L482 E487 Q493 R494 Y495 I509 I626	L482-I491 HydrophobicContact CD1-CD1 3.97Å; E487-I491 WeakPolarHBondContact O-CG1 3.26Å; E487-I491 PolarHBondContact O-N 3.4Å; I491-Q493 VanDerWaalsContact C-N 3.29Å; I491-Q493 PolarHBondContact O-N 2.93Å; I491-R494 WeakPolarHBondContact O-CB 3.49Å; I491-R494 PolarHBondContact O-N 3.4Å; I491-R494 VanDerWaalsContact O-N 3.17Å; I491-Y495 HydrophobicContact CG2-CD2 3.95Å; I491-Y495 HydrophobicContact CG2-CE2 4Å; I491-Y495 VanDerWaalsContact O-CD2 3.26Å; I491-Y495 WeakPolarHBondContact O-CD2 3.43Å; I491-Y495 PolarHBondContact O-N 2.92Å; I491-Y495 VanDerWaalsContact O-N 3.08Å; I491-I509 HydrophobicContact CG2-CG2 3.66Å; I491-I626 HydrophobicContact CG2-CB 4.42Å; I491-I626 HydrophobicContact CG2-CD1 4Å; I491-I626 HydrophobicContact CG2-CG2 4.21Å
492	T	71.9	Confident	66.6	Low	68 Å²	68	87.9 Å²	87.9	42%	0.417	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-35.6	176.1	-53.9	0	0	0	0	111.9	R488 K489 C496	R488-T492 WeakPolarHBondContact O-CB 3.38Å; R488-T492 PolarHBondContact O-N 3.4Å; R488-T492 PolarHBondContact O-OG1 2.78Å; K489-T492 PolarHBondContact O-N 2.78Å; T492-C496 WeakPolarHBondContact O-CB 3.45Å; T492-C496 PolarHBondContact O-N 3.03Å
493	Q	70.6	Confident	67.3	Low	133 Å²	133	90.6 Å²	90.6	62%	0.621	45%	0.451	S	S	*	.	H	α-helix	trans	-71.7	-34	174.4	-75.6	179.3	-3.7	0	0	113.2	K489 Q490 I491 C496 N499	K489-Q493 WeakPolarHBondContact O-CB 3.42Å; K489-Q493 VanDerWaalsContact O-CG 3.32Å; K489-Q493 WeakPolarHBondContact O-CG 3.26Å; K489-Q493 PolarHBondContact O-N 3.02Å; Q490-Q493 PolarHBondContact O-N 3.43Å; I491-Q493 VanDerWaalsContact C-N 3.29Å; I491-Q493 PolarHBondContact O-N 2.93Å; Q493-C496 PolarHBondContact O-SG 3.23Å; Q493-N499 PolarHBondContact O-ND2 2.91Å
494	R	70.2	Confident	68.1	Low	108 Å²	108	90.5 Å²	90.5	41%	0.408	44%	0.438	S	S	.	.	H	α-helix	trans	-59.4	-48.4	171.1	176.4	-178.5	178.5	152.5	-4.1	110.8	Q490 I491 N499 D506	Q490-R494 PolarHBondContact O-N 2.89Å; I491-R494 WeakPolarHBondContact O-CB 3.49Å; I491-R494 PolarHBondContact O-N 3.4Å; I491-R494 VanDerWaalsContact O-N 3.17Å; R494-N499 WeakPolarHBondContact O-CB 3.01Å; R494-D506 IonicContact CZ-OD2 3.31Å; R494-D506 VanDerWaalsContact CZ-OD2 3.23Å; R494-D506 IonicContact NE-OD2 3.19Å; R494-D506 PolarHBondContact NE-OD2 3.27Å; R494-D506 IonicContact NH2-OD1 2.85Å; R494-D506 IonicContact NH2-OD2 2.74Å; R494-D506 PolarHBondContact NH2-OD2 3.46Å
495	Y	73.7	Confident	68.5	Low	14 Å²	14	91 Å²	91	6%	0.055	44%	0.437	C	S	.	.	S	Bend	trans	-89.4	5.1	-177.3	-61.5	-65.8	0	0	0	114.8	I491 D506 I509 I626 N628	I491-Y495 HydrophobicContact CG2-CD2 3.95Å; I491-Y495 HydrophobicContact CG2-CE2 4Å; I491-Y495 VanDerWaalsContact O-CD2 3.26Å; I491-Y495 WeakPolarHBondContact O-CD2 3.43Å; I491-Y495 PolarHBondContact O-N 2.92Å; I491-Y495 VanDerWaalsContact O-N 3.08Å; Y495-D506 VanDerWaalsContact CE1-OD1 3.3Å; Y495-D506 WeakPolarHBondContact CE1-OD1 3.13Å; Y495-D506 WeakPolarHBondContact CE1-OD2 3.45Å; Y495-D506 PolarHBondContact OH-OD1 2.84Å; Y495-D506 PolarHBondContact OH-OD2 3.47Å; Y495-I509 HydrophobicContact CD2-CG2 4.45Å; Y495-I509 HydrophobicContact CE2-CB 4.17Å; Y495-I509 HydrophobicContact CE2-CG2 3.89Å; Y495-I626 HydrophobicContact CD2-CG2 4.13Å; Y495-N628 VanDerWaalsContact O-CB 3.29Å; Y495-N628 WeakPolarHBondContact O-CB 3.22Å; Y495-N628 PolarHBondContact O-ND2 2.58Å
496	C	75.6	Confident	69.2	Low	45 Å²	45	87.5 Å²	87.5	30%	0.304	41%	0.414	S	S	.	.	S	Bend	trans	-66.4	156.8	179.1	78.9	0	0	0	0	113.3	T492 Q493 R498 N499 N628	T492-C496 WeakPolarHBondContact O-CB 3.45Å; T492-C496 PolarHBondContact O-N 3.03Å; Q493-C496 PolarHBondContact O-SG 3.23Å; C496-R498 PolarHBondContact O-N 3.02Å; C496-N499 PolarHBondContact O-N 2.97Å; C496-N628 PolarHBondContact O-ND2 3.12Å; C496-N628 VanDerWaalsContact O-ND2 3.12Å
497	L	72.6	Confident	70.3	Confident	116 Å²	116	84.7 Å²	84.7	61%	0.607	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-55.3	-26.7	-178.2	-61.5	175.5	0	0	0	114.3	N499 S500 P629 V630	L497-N499 VanDerWaalsContact C-N 3.28Å; L497-N499 PolarHBondContact O-N 3.5Å; L497-S500 PolarHBondContact O-N 3.29Å; L497-S500 PolarHBondContact O-OG 2.7Å; L497-S500 VanDerWaalsContact O-OG 3.14Å; L497-P629 HydrophobicContact CD2-CG 3.94Å; L497-V630 HydrophobicContact CD2-CG2 3.81Å
498	R	70.9	Confident	71.1	Confident	239 Å²	239	80.9 Å²	80.9	90%	0.902	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-72.9	-18.1	177.5	-64.8	-176.1	177.7	-175.8	-1.1	113.7	C496	C496-R498 PolarHBondContact O-N 3.02Å
499	N	71.6	Confident	71.8	Confident	44 Å²	44	78 Å²	78	24%	0.235	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-105.1	7	178.3	-80	-42.7	0	0	0	113.1	Q493 R494 C496 L497 L501 K502	Q493-N499 PolarHBondContact O-ND2 2.91Å; R494-N499 WeakPolarHBondContact O-CB 3.01Å; C496-N499 PolarHBondContact O-N 2.97Å; L497-N499 VanDerWaalsContact C-N 3.28Å; L497-N499 PolarHBondContact O-N 3.5Å; N499-L501 PolarHBondContact O-N 2.9Å; N499-K502 PolarHBondContact O-N 3.39Å; N499-K502 PolarHBondContact OD1-NZ 3.33Å
500	S	73.5	Confident	72.8	Confident	10 Å²	10	71.3 Å²	71.3	7%	0.07	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.6	-174	-67.7	0	0	0	0	115.1	L497 N628 K631	L497-S500 PolarHBondContact O-N 3.29Å; L497-S500 PolarHBondContact O-OG 2.7Å; L497-S500 VanDerWaalsContact O-OG 3.14Å; S500-N628 VanDerWaalsContact OG-CG 3.29Å; S500-N628 PolarHBondContact OG-ND2 3.22Å; S500-N628 PolarHBondContact OG-OD1 2.83Å; S500-K631 WeakPolarHBondContact O-CE 3.4Å; S500-K631 WeakPolarHBondContact O-CG 3.35Å
501	L	68.6	Low	73.7	Confident	158 Å²	158	65.4 Å²	65.4	83%	0.827	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.7	-179.7	-60.5	176.4	0	0	0	114.6	N499	N499-L501 PolarHBondContact O-N 2.9Å
502	K	66.7	Low	74.7	Confident	139 Å²	139	64.1 Å²	64.1	60%	0.604	30%	0.304	S	S	*	.	S	Bend	trans	-98.8	121.7	-179.8	-65.6	175.7	-173	160.6	0	110.6	N499 K631	N499-K502 PolarHBondContact O-N 3.39Å; N499-K502 PolarHBondContact OD1-NZ 3.33Å; K502-K631 VanDerWaalsContact O-CE 3.25Å; K502-K631 WeakPolarHBondContact O-CE 3.29Å; K502-K631 PolarHBondContact O-NZ 2.83Å
503	D	66.5	Low	75.4	Confident	67 Å²	67	62.5 Å²	62.5	36%	0.358	29%	0.291	S	S	.	.			trans	56.9	85.7	179.6	-157.6	-26.8	0	0	0	113.7	K505 D506 K631	D503-K505 VanDerWaalsContact C-N 3.26Å; D503-K505 PolarHBondContact O-N 2.79Å; D503-K505 PolarHBondContact OD1-N 2.96Å; D503-D506 HydrophobicContact CB-CB 4.41Å; D503-D506 PolarHBondContact O-N 3.24Å; D503-K631 PolarHBondContact O-NZ 2.82Å
504	M	68.1	Low	76.3	Confident	71 Å²	71	56.2 Å²	56.2	35%	0.35	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-8.9	-175	-64.5	-59.3	-61.6	0	0	114.5	I634	M504-I634 HydrophobicContact CE-CB 3.8Å; M504-I634 HydrophobicContact CE-CD1 3.81Å; M504-I634 HydrophobicContact CE-CG1 4.42Å; M504-I634 HydrophobicContact CE-CG2 3.58Å
505	K	66.2	Low	77.2	Confident	86 Å²	86	52.6 Å²	52.6	37%	0.374	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-27.2	174.3	-70.3	-171.2	174.4	-174.6	0	112.2	S358 D503 V507	S358-K505 PolarHBondContact OG-NZ 2.86Å; D503-K505 VanDerWaalsContact C-N 3.26Å; D503-K505 PolarHBondContact O-N 2.79Å; D503-K505 PolarHBondContact OD1-N 2.96Å; K505-V507 PolarHBondContact O-N 2.77Å
506	D	75	Confident	78	Confident	15 Å²	15	55.7 Å²	55.7	8%	0.08	26%	0.264	C	S	.	.			trans	-92.1	91.7	-177.2	175	35.6	0	0	0	111.5	R494 Y495 D503 K631	R494-D506 IonicContact CZ-OD2 3.31Å; R494-D506 VanDerWaalsContact CZ-OD2 3.23Å; R494-D506 IonicContact NE-OD2 3.19Å; R494-D506 PolarHBondContact NE-OD2 3.27Å; R494-D506 IonicContact NH2-OD1 2.85Å; R494-D506 IonicContact NH2-OD2 2.74Å; R494-D506 PolarHBondContact NH2-OD2 3.46Å; Y495-D506 VanDerWaalsContact CE1-OD1 3.3Å; Y495-D506 WeakPolarHBondContact CE1-OD1 3.13Å; Y495-D506 WeakPolarHBondContact CE1-OD2 3.45Å; Y495-D506 PolarHBondContact OH-OD1 2.84Å; Y495-D506 PolarHBondContact OH-OD2 3.47Å; D503-D506 HydrophobicContact CB-CB 4.41Å; D503-D506 PolarHBondContact O-N 3.24Å; D506-K631 WeakPolarHBondContact O-CD 3.3Å; D506-K631 PolarHBondContact O-NZ 3.08Å
507	V	80.8	Confident	78.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.25	C	C	.	.			trans	-85.2	-33.6	-173.6	-179.1	0	0	0	0	112.5	K505 I563 K564 N628 K631 A632 R635	K505-V507 PolarHBondContact O-N 2.77Å; V507-I563 WeakPolarHBondContact CB-O 3.42Å; V507-I563 PolarHBondContact N-O 2.85Å; V507-I563 VanDerWaalsContact N-O 3.1Å; V507-K564 WeakPolarHBondContact CG2-O 3.28Å; V507-N628 PolarHBondContact O-N 3.28Å; V507-K631 HydrophobicContact CG1-CB 4.33Å; V507-A632 HydrophobicContact CG1-CB 3.73Å; V507-R635 HydrophobicContact CG2-CB 4.21Å; V507-R635 HydrophobicContact CG2-CG 4.15Å
508	G	80.6	Confident	79.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-180	-168.5	-176.2	0	0	0	0	0	113.5	I563 I626	G508-I563 PolarHBondContact N-O 3.48Å; G508-I563 PolarHBondContact O-N 2.94Å; G508-I626 CarbonylContact C-O 3.57Å; G508-I626 WeakPolarHBondContact CA-O 3.17Å
509	I	83.7	Confident	80.4	Confident	29 Å²	29	42.4 Å²	42.4	15%	0.149	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.2	177.6	-165.7	170.7	0	0	0	109.9	I491 Y495 T560 F561 I626	I491-I509 HydrophobicContact CG2-CG2 3.66Å; Y495-I509 HydrophobicContact CD2-CG2 4.45Å; Y495-I509 HydrophobicContact CE2-CB 4.17Å; Y495-I509 HydrophobicContact CE2-CG2 3.89Å; I509-T560 HydrophobicContact CD1-CG2 3.49Å; I509-T560 VanDerWaalsContact CD1-CG2 3.49Å; I509-T560 HydrophobicContact CG1-CG2 3.61Å; I509-F561 WeakPolarHBondContact CA-O 3.26Å; I509-I626 HydrophobicContact CG2-CB 4.06Å; I509-I626 PolarHBondContact N-O 2.91Å; I509-I626 PolarHBondContact O-N 2.95Å
510	L	86.3	Confident	81.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.5	175	174.4	71.2	0	0	0	108.7	V512 L537 T560 F561 I563 L570 L593 I596 L625	L510-V512 HydrophobicContact CD1-CG2 4.38Å; L510-V512 HydrophobicContact CD2-CG2 3.58Å; L510-V512 HydrophobicContact CG-CG2 3.76Å; L510-L537 HydrophobicContact CD2-CD2 3.98Å; L510-T560 CarbonylContact O-C 3.5Å; L510-T560 WeakPolarHBondContact O-CA 3.04Å; L510-F561 HydrophobicContact CB-CB 4.43Å; L510-F561 HydrophobicContact CD2-CD2 4.38Å; L510-F561 PolarHBondContact N-O 3.23Å; L510-F561 PolarHBondContact O-N 2.93Å; L510-I563 HydrophobicContact CB-CD1 4.01Å; L510-I563 HydrophobicContact CB-CG1 4.05Å; L510-L570 HydrophobicContact CD2-CD1 4.48Å; L510-L570 HydrophobicContact CD2-CD2 4.46Å; L510-L593 HydrophobicContact CD1-CD2 4.36Å; L510-L593 HydrophobicContact CD2-CD2 3.69Å; L510-I596 HydrophobicContact CD1-CD1 3.61Å; L510-L625 HydrophobicContact CD1-CB 4.36Å
511	Q	86.3	Confident	81.8	Confident	4 Å²	4	43 Å²	43	2%	0.019	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133	163.6	-175.5	152.5	103.1	0	0	110	L482 V558 F559 T560 M623 D624	L482-Q511 HydrophobicContact CD1-CB 4.46Å; L482-Q511 HydrophobicContact CD2-CB 4.38Å; Q511-V558 VanDerWaalsContact CD-CG1 3.49Å; Q511-V558 HydrophobicContact CG-CG1 3.53Å; Q511-F559 WeakPolarHBondContact CA-O 3.42Å; Q511-T560 PolarHBondContact NE2-OG1 2.79Å; Q511-T560 VanDerWaalsContact NE2-OG1 3.16Å; Q511-M623 VanDerWaalsContact O-CA 3.29Å; Q511-M623 WeakPolarHBondContact O-CA 3.32Å; Q511-D624 HydrophobicContact CB-CB 4.47Å; Q511-D624 PolarHBondContact N-O 2.9Å; Q511-D624 PolarHBondContact O-N 2.9Å
512	V	88.4	Confident	82.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.2	176.1	-171.2	0	0	0	0	108.4	L510 V514 L535 V558 F559 F561 L570 M623	L510-V512 HydrophobicContact CD1-CG2 4.38Å; L510-V512 HydrophobicContact CD2-CG2 3.58Å; L510-V512 HydrophobicContact CG-CG2 3.76Å; V512-V514 HydrophobicContact CG1-CG2 4.43Å; V512-L535 HydrophobicContact CB-CD2 4.17Å; V512-L535 HydrophobicContact CG1-CD2 3.8Å; V512-V558 WeakPolarHBondContact O-CA 3.2Å; V512-F559 PolarHBondContact N-O 3.28Å; V512-F559 PolarHBondContact O-N 2.87Å; V512-F561 HydrophobicContact CG2-CD2 4.18Å; V512-F561 HydrophobicContact CG2-CE2 4.1Å; V512-L570 HydrophobicContact CG1-CD2 4.1Å; V512-L570 HydrophobicContact CG2-CD1 4.43Å; V512-L570 HydrophobicContact CG2-CD2 3.73Å; V512-M623 HydrophobicContact CB-CG 4.41Å; V512-M623 HydrophobicContact CG1-CG 4.04Å; V512-M623 HydrophobicContact CG2-CG 4.26Å
513	K	87.8	Confident	82.9	Confident	35 Å²	35	32.7 Å²	32.7	15%	0.152	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	114.8	171	-39.6	-169.4	-158.5	154	0	108.5	L477 L515 K557 V558 L621 E622	L477-K513 HydrophobicContact CD1-CD 3.85Å; K513-L515 HydrophobicContact CB-CD2 4.25Å; K513-L515 PolarHBondContact O-N 3.49Å; K513-K557 CarbonylContact C-O 3.55Å; K513-K557 WeakPolarHBondContact CA-O 2.96Å; K513-V558 HydrophobicContact CB-CG2 3.98Å; K513-V558 HydrophobicContact CD-CG2 4Å; K513-V558 HydrophobicContact CG-CG1 4.13Å; K513-V558 HydrophobicContact CG-CG2 3.75Å; K513-L621 WeakPolarHBondContact O-CA 3.2Å; K513-E622 HydrophobicContact CB-CB 4.14Å; K513-E622 HydrophobicContact CD-CB 4.45Å; K513-E622 WeakPolarHBondContact CD-OE2 3.34Å; K513-E622 VanDerWaalsContact CE-OE1 3.24Å; K513-E622 WeakPolarHBondContact CE-OE1 3.39Å; K513-E622 WeakPolarHBondContact CE-OE2 3.37Å; K513-E622 HydrophobicContact CG-CB 4.32Å; K513-E622 PolarHBondContact N-O 2.88Å; K513-E622 IonicContact NZ-OE1 2.64Å; K513-E622 PolarHBondContact NZ-OE1 2.82Å; K513-E622 IonicContact NZ-OE2 3.81Å; K513-E622 PolarHBondContact NZ-OE2 2.85Å; K513-E622 PolarHBondContact O-N 2.85Å
514	V	89.7	Confident	83.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	103.9	175.2	-177.8	0	0	0	0	107.1	V512 C533 L535 T544 W555 N556 K557 F559 L621	V512-V514 HydrophobicContact CG1-CG2 4.43Å; V514-C533 HydrophobicContact CG1-CB 4.48Å; V514-L535 HydrophobicContact CG2-CD1 3.85Å; V514-L535 HydrophobicContact CG2-CD2 3.77Å; V514-L535 HydrophobicContact CG2-CG 4.38Å; V514-T544 HydrophobicContact CB-CG2 4.4Å; V514-T544 HydrophobicContact CG1-CG2 4.13Å; V514-W555 HydrophobicContact CG1-CB 4.38Å; V514-W555 HydrophobicContact CG1-CD2 4.25Å; V514-W555 HydrophobicContact CG1-CE3 3.65Å; V514-W555 HydrophobicContact CG1-CZ3 4.28Å; V514-N556 VanDerWaalsContact O-CA 3.25Å; V514-N556 WeakPolarHBondContact O-CA 3.46Å; V514-N556 PolarHBondContact O-N 2.86Å; V514-K557 PolarHBondContact N-O 3.46Å; V514-K557 PolarHBondContact O-N 3.45Å; V514-K557 VanDerWaalsContact O-N 3.09Å; V514-F559 HydrophobicContact CB-CE2 4.19Å; V514-F559 HydrophobicContact CG2-CD2 3.8Å; V514-F559 HydrophobicContact CG2-CE2 3.63Å; V514-L621 HydrophobicContact CB-CD2 4.27Å; V514-L621 HydrophobicContact CG1-CD2 4.23Å; V514-L621 HydrophobicContact CG2-CD2 3.96Å
515	L	88.6	Confident	83.2	Confident	33 Å²	33	38.3 Å²	38.3	17%	0.173	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-68.7	-175.4	-55.8	177.6	0	0	0	109.4	K513 W555 N556 P601 Y620	K513-L515 HydrophobicContact CB-CD2 4.25Å; K513-L515 PolarHBondContact O-N 3.49Å; L515-W555 PolarHBondContact O-N 3.05Å; L515-N556 PolarHBondContact O-N 2.8Å; L515-P601 HydrophobicContact CD1-CB 3.94Å; L515-Y620 WeakPolarHBondContact CB-O 3.39Å; L515-Y620 PolarHBondContact N-O 2.85Å; L515-Y620 VanDerWaalsContact N-O 3.12Å
516	K	90.6	Very high	83.3	Confident	78 Å²	78	37.3 Å²	37.3	34%	0.339	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	166.9	-176.2	63.7	-174.6	178.7	179.7	0	113.8	P553 E554 Y620	K516-P553 CarbonylContact C-O 3.55Å; K516-P553 WeakPolarHBondContact CA-O 3.48Å; K516-P553 WeakPolarHBondContact CB-O 3.36Å; K516-E554 HydrophobicContact CB-CB 4.1Å; K516-E554 HydrophobicContact CB-CG 3.8Å; K516-E554 HydrophobicContact CD-CG 3.83Å; K516-E554 WeakPolarHBondContact CD-OE1 3.44Å; K516-E554 WeakPolarHBondContact CE-OE1 3.39Å; K516-E554 IonicContact NZ-OE1 2.69Å; K516-E554 PolarHBondContact NZ-OE1 3.31Å; K516-Y620 HydrophobicContact CG-CD2 3.74Å; K516-Y620 HydrophobicContact CG-CG 4.12Å; K516-Y620 PolarHBondContact O-N 2.89Å
517	A	92.3	Very high	83.3	Confident	1 Å²	1	39 Å²	39	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	165	161.7	0	0	0	0	0	111	L520 N552 P553 W555 V618	A517-L520 HydrophobicContact CB-CD1 4.17Å; A517-L520 HydrophobicContact CB-CD2 4.07Å; A517-L520 HydrophobicContact CB-CG 4.21Å; A517-N552 CarbonylContact O-C 3.57Å; A517-N552 WeakPolarHBondContact O-CA 3.32Å; A517-P553 HydrophobicContact CB-CG 3.92Å; A517-P553 PolarHBondContact N-O 2.78Å; A517-W555 HydrophobicContact CB-CH2 3.73Å; A517-W555 HydrophobicContact CB-CZ3 3.67Å; A517-V618 CarbonylContact C-O 3.46Å; A517-V618 WeakPolarHBondContact CA-O 3.13Å; A517-V618 VanDerWaalsContact CB-O 3.31Å; A517-V618 WeakPolarHBondContact CB-O 3.33Å
518	A	90.3	Very high	83.3	Confident	17 Å²	17	43.4 Å²	43.4	14%	0.14	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	156.4	173.9	0	0	0	0	0	112.1	L520 N552 G617 V618 Y620	A518-L520 PolarHBondContact O-N 3.3Å; A518-N552 WeakPolarHBondContact CA-OD1 3.23Å; A518-N552 WeakPolarHBondContact CB-OD1 3.4Å; A518-G617 CarbonylContact O-C 3.48Å; A518-G617 VanDerWaalsContact O-CA 3.23Å; A518-G617 WeakPolarHBondContact O-CA 3.47Å; A518-V618 HydrophobicContact CB-CG2 3.93Å; A518-V618 PolarHBondContact N-O 3.03Å; A518-V618 PolarHBondContact O-N 2.81Å; A518-Y620 HydrophobicContact CB-CE2 4.28Å
519	D	87.8	Confident	83.4	Confident	104 Å²	104	43.4 Å²	43.4	56%	0.556	24%	0.242	S	C	*	.	S	Bend	trans	54	32.1	176.7	-67.5	-44.3	0	0	0	115.3	L551 N552 K616 G617	D519-L551 PolarHBondContact N-O 2.83Å; D519-N552 PolarHBondContact N-OD1 2.64Å; D519-K616 WeakPolarHBondContact O-CD 3.4Å; D519-K616 WeakPolarHBondContact O-CE 3.47Å; D519-K616 WeakPolarHBondContact O-CG 3.38Å; D519-K616 PolarHBondContact O-NZ 3.45Å; D519-G617 VanDerWaalsContact O-CA 3.32Å; D519-G617 WeakPolarHBondContact O-CA 3.46Å; D519-G617 PolarHBondContact O-N 2.68Å
520	L	88.4	Confident	83.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-56.1	158.6	178.1	-64.9	177.4	0	0	0	112.7	A517 A518 P531 L551 P553 V574 L606 K616	A517-L520 HydrophobicContact CB-CD1 4.17Å; A517-L520 HydrophobicContact CB-CD2 4.07Å; A517-L520 HydrophobicContact CB-CG 4.21Å; A518-L520 PolarHBondContact O-N 3.3Å; L520-P531 HydrophobicContact CD1-CB 3.73Å; L520-P531 HydrophobicContact CD1-CG 3.8Å; L520-L551 HydrophobicContact CB-CD2 4.42Å; L520-L551 WeakPolarHBondContact CG-O 3.31Å; L520-L551 PolarHBondContact N-O 2.65Å; L520-P553 HydrophobicContact CD1-CG 3.86Å; L520-V574 HydrophobicContact CD1-CG1 4.24Å; L520-V574 HydrophobicContact CD2-CG1 4.24Å; L520-L606 HydrophobicContact CD2-CD1 3.54Å; L520-K616 PolarHBondContact O-NZ 2.74Å
521	L	84.4	Confident	83.8	Confident	66 Å²	66	43.1 Å²	43.1	35%	0.346	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-61.1	146.1	163.1	-163.8	76.7	0	0	0	109.3	S529 L551 L586 F615 K616	L521-S529 PolarHBondContact O-OG 3.09Å; L521-S529 VanDerWaalsContact O-OG 3.1Å; L521-L551 WeakPolarHBondContact O-CD2 3.37Å; L521-L586 HydrophobicContact CB-CD2 4.21Å; L521-F615 HydrophobicContact CB-CE1 4.1Å; L521-F615 HydrophobicContact CD2-CE1 4.08Å; L521-F615 HydrophobicContact CD2-CZ 3.93Å; L521-K616 HydrophobicContact CD1-CB 4.43Å; L521-K616 HydrophobicContact CD1-CD 4.32Å
522	A	83.3	Confident	83.9	Confident	40 Å²	40	44 Å²	44	33%	0.331	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-95.9	117.1	164.6	0	0	0	0	0	107.8	G527 K528 L551	A522-G527 VanDerWaalsContact CB-C 3.49Å; A522-K528 CarbonylContact C-O 3.58Å; A522-K528 VanDerWaalsContact CA-O 3.26Å; A522-K528 WeakPolarHBondContact CA-O 3.41Å; A522-K528 WeakPolarHBondContact CB-O 3.29Å; A522-L551 HydrophobicContact CB-CD1 4.37Å; A522-L551 HydrophobicContact CB-CD2 3.98Å
523	A	75.8	Confident	83.9	Confident	40 Å²	40	44 Å²	44	33%	0.331	24%	0.244	S	C	.	.			trans	-93.8	-27.4	172.8	0	0	0	0	0	112	K528 S529 D576 D584 L586	A523-K528 PolarHBondContact N-O 3.44Å; A523-S529 PolarHBondContact N-OG 3.18Å; A523-D576 WeakPolarHBondContact CB-OD2 3.27Å; A523-D584 HydrophobicContact CB-CB 4.5Å; A523-L586 HydrophobicContact CB-CD2 4.25Å
524	D	75.1	Confident	83.8	Confident	46 Å²	46	43.7 Å²	43.7	25%	0.246	24%	0.244	C	C	.	.	S	Bend	trans	-68.7	139	-174.3	-156.4	14.3	0	0	0	111.2	S526 G527 K528	D524-S526 PolarHBondContact O-N 2.86Å; D524-S526 WeakPolarHBondContact OD2-CB 3.41Å; D524-S526 PolarHBondContact OD2-OG 3.06Å; D524-G527 PolarHBondContact O-N 3.1Å; D524-K528 WeakPolarHBondContact CB-O 3.41Å; D524-K528 PolarHBondContact N-O 2.75Å; D524-K528 VanDerWaalsContact N-O 3.09Å
525	F	66.3	Low	83.6	Confident	211 Å²	211	43.7 Å²	43.7	93%	0.925	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.5	171.4	-67.4	-83.4	0	0	0	112.8	G527	F525-G527 VanDerWaalsContact C-N 3.29Å
526	S	68.2	Low	83.4	Confident	65 Å²	65	43 Å²	43	46%	0.455	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2	174.3	87.6	0	0	0	0	114.7	D524 K528	D524-S526 PolarHBondContact O-N 2.86Å; D524-S526 WeakPolarHBondContact OD2-CB 3.41Å; D524-S526 PolarHBondContact OD2-OG 3.06Å; S526-K528 VanDerWaalsContact C-N 3.34Å
527	G	73.8	Confident	83	Confident	49 Å²	49	39.8 Å²	39.8	51%	0.505	23%	0.227	S	C	.	.	S	Bend	trans	74.4	25.4	-175.7	0	0	0	0	0	113.3	A522 D524 F525	A522-G527 VanDerWaalsContact CB-C 3.49Å; D524-G527 PolarHBondContact O-N 3.1Å; F525-G527 VanDerWaalsContact C-N 3.29Å
528	K	80.8	Confident	82.2	Confident	93 Å²	93	40.3 Å²	40.3	40%	0.404	23%	0.233	S	C	.	.			trans	-137.2	-165.3	-177.9	-62.9	-175.4	155.5	-150.6	0	110.4	A522 A523 D524 S526 K549	A522-K528 CarbonylContact C-O 3.58Å; A522-K528 VanDerWaalsContact CA-O 3.26Å; A522-K528 WeakPolarHBondContact CA-O 3.41Å; A522-K528 WeakPolarHBondContact CB-O 3.29Å; A523-K528 PolarHBondContact N-O 3.44Å; D524-K528 WeakPolarHBondContact CB-O 3.41Å; D524-K528 PolarHBondContact N-O 2.75Å; D524-K528 VanDerWaalsContact N-O 3.09Å; S526-K528 VanDerWaalsContact C-N 3.34Å; K528-K549 HydrophobicContact CD-CB 3.83Å; K528-K549 WeakPolarHBondContact CD-O 3.36Å; K528-K549 PolarHBondContact NZ-O 3.4Å
529	S	84.6	Confident	81.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.			trans	-153.9	159.1	172.5	-76.4	0	0	0	0	109	L521 A523 P531 K549 N550 D576	L521-S529 PolarHBondContact O-OG 3.09Å; L521-S529 VanDerWaalsContact O-OG 3.1Å; A523-S529 PolarHBondContact N-OG 3.18Å; S529-P531 WeakPolarHBondContact O-CD 3.37Å; S529-K549 CarbonylContact O-C 3.5Å; S529-K549 VanDerWaalsContact O-CA 3.23Å; S529-K549 WeakPolarHBondContact O-CA 2.93Å; S529-K549 PolarHBondContact O-N 2.94Å; S529-K549 VanDerWaalsContact O-N 3.09Å; S529-N550 PolarHBondContact O-N 3Å; S529-D576 WeakPolarHBondContact CA-OD2 3.32Å; S529-D576 WeakPolarHBondContact CB-OD2 3.43Å; S529-D576 PolarHBondContact OG-OD2 3.35Å
530	D	86.9	Confident	80.5	Confident	23 Å²	23	35.8 Å²	35.8	12%	0.123	21%	0.206	C	C	.	.			trans	-109.2	66.8	170.7	-66.9	-15.6	0	0	0	109.5	T546 Y548 K549 D576 E577	D530-T546 HydrophobicContact CB-CG2 4.14Å; D530-T546 WeakPolarHBondContact O-CG2 3.49Å; D530-Y548 HydrophobicContact CB-CD1 4.02Å; D530-Y548 VanDerWaalsContact OD1-CA 3.24Å; D530-Y548 WeakPolarHBondContact OD1-CA 3.32Å; D530-Y548 WeakPolarHBondContact OD2-CD1 3.4Å; D530-K549 WeakPolarHBondContact OD1-CG 3.19Å; D530-K549 PolarHBondContact OD1-N 3.03Å; D530-D576 WeakPolarHBondContact CA-OD1 3.33Å; D530-D576 PolarHBondContact N-OD1 2.71Å; D530-E577 PolarHBondContact O-N 3.44Å
531	P	89.9	Confident	79.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	145.7	-167	29.8	-40.2	0	0	0	116.1	L520 S529 V547 N550 P553 W555 V574 F575 L586	L520-P531 HydrophobicContact CD1-CB 3.73Å; L520-P531 HydrophobicContact CD1-CG 3.8Å; S529-P531 WeakPolarHBondContact O-CD 3.37Å; P531-V547 VanDerWaalsContact CD-O 3.3Å; P531-V547 WeakPolarHBondContact CD-O 3.14Å; P531-V547 PolarHBondContact O-N 2.97Å; P531-N550 WeakPolarHBondContact CD-O 3.46Å; P531-N550 WeakPolarHBondContact CG-O 3.37Å; P531-P553 HydrophobicContact CB-CG 4.26Å; P531-P553 HydrophobicContact CG-CB 3.77Å; P531-P553 HydrophobicContact CG-CG 3.55Å; P531-W555 HydrophobicContact CB-CZ2 4.22Å; P531-W555 PolarHBondContact O-NE1 2.81Å; P531-V574 HydrophobicContact CB-CG1 4.16Å; P531-F575 CarbonylContact C-O 3.6Å; P531-F575 VanDerWaalsContact CA-O 3.26Å; P531-F575 WeakPolarHBondContact CA-O 3.35Å; P531-L586 HydrophobicContact CB-CD1 3.89Å
532	F	88.7	Confident	79.3	Confident	22 Å²	22	38.9 Å²	38.9	10%	0.096	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.7	165.1	69.1	-83.4	0	0	0	111.8	V574 F575 E577 P583	F532-V574 WeakPolarHBondContact O-CA 3.43Å; F532-F575 HydrophobicContact CD1-CB 4.07Å; F532-F575 WeakPolarHBondContact CD1-O 3.41Å; F532-F575 HydrophobicContact CD2-CB 4.42Å; F532-F575 HydrophobicContact CE1-CB 3.49Å; F532-F575 VanDerWaalsContact CE1-CB 3.49Å; F532-F575 HydrophobicContact CE2-CB 3.89Å; F532-F575 HydrophobicContact CE2-CD2 4.18Å; F532-F575 HydrophobicContact CE2-CG 4.4Å; F532-F575 HydrophobicContact CZ-CB 3.4Å; F532-F575 HydrophobicContact CZ-CD2 4.31Å; F532-F575 HydrophobicContact CZ-CG 4.09Å; F532-F575 PolarHBondContact N-O 2.75Å; F532-F575 PolarHBondContact O-N 2.72Å; F532-E577 HydrophobicContact CD1-CB 4.1Å; F532-E577 HydrophobicContact CE1-CB 4.08Å; F532-P583 HydrophobicContact CE1-CB 3.99Å; F532-P583 HydrophobicContact CZ-CB 3.97Å; F532-P583 HydrophobicContact CZ-CG 4.25Å
533	C	88.7	Confident	79.1	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130	174.6	-73	0	0	0	0	111.3	V514 L535 Q543 T544 W555 V572 T573 I619	V514-C533 HydrophobicContact CG1-CB 4.48Å; C533-L535 HydrophobicContact CB-CD1 3.99Å; C533-Q543 CarbonylContact O-C 3.51Å; C533-Q543 VanDerWaalsContact O-CA 3.28Å; C533-Q543 WeakPolarHBondContact O-CA 3.4Å; C533-T544 HydrophobicContact CB-CG2 3.8Å; C533-T544 PolarHBondContact N-OG1 2.81Å; C533-T544 PolarHBondContact O-N 2.62Å; C533-W555 WeakPolarHBondContact SG-CH2 3.43Å; C533-W555 WeakPolarHBondContact SG-CZ3 3.16Å; C533-V572 HydrophobicContact CB-CG1 4.43Å; C533-T573 CarbonylContact C-O 3.44Å; C533-T573 WeakPolarHBondContact CA-O 3.47Å; C533-I619 VanDerWaalsContact SG-CD1 3.56Å
534	L	85.4	Confident	79.3	Confident	29 Å²	29	41.5 Å²	41.5	15%	0.152	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.1	165.9	-175.7	73	0	0	0	109.4	E536 L542 Q543 V572 T573 F575	L534-E536 HydrophobicContact CD2-CG 4.3Å; L534-E536 WeakPolarHBondContact CD2-OE1 3.5Å; L534-E536 HydrophobicContact CG-CG 4.26Å; L534-L542 CarbonylContact C-O 3.53Å; L534-L542 WeakPolarHBondContact CA-O 3.27Å; L534-Q543 HydrophobicContact CD1-CB 4.28Å; L534-V572 CarbonylContact O-C 3.52Å; L534-V572 WeakPolarHBondContact O-CA 3.46Å; L534-T573 PolarHBondContact N-O 2.66Å; L534-T573 PolarHBondContact O-N 2.73Å; L534-F575 HydrophobicContact CB-CD2 4.1Å; L534-F575 HydrophobicContact CB-CE2 4.05Å; L534-F575 HydrophobicContact CD2-CE2 3.9Å
535	L	86.4	Confident	79.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.2	177.8	-72.9	75.5	0	0	0	108.7	V512 V514 C533 R541 L542 F559 F561 V572	V512-L535 HydrophobicContact CB-CD2 4.17Å; V512-L535 HydrophobicContact CG1-CD2 3.8Å; V514-L535 HydrophobicContact CG2-CD1 3.85Å; V514-L535 HydrophobicContact CG2-CD2 3.77Å; V514-L535 HydrophobicContact CG2-CG 4.38Å; C533-L535 HydrophobicContact CB-CD1 3.99Å; L535-R541 WeakPolarHBondContact O-CA 3.16Å; L535-L542 PolarHBondContact N-O 2.85Å; L535-L542 PolarHBondContact O-N 3.11Å; L535-F559 HydrophobicContact CD1-CE2 4.23Å; L535-F559 HydrophobicContact CD2-CB 4.44Å; L535-F559 HydrophobicContact CD2-CD2 3.83Å; L535-F559 HydrophobicContact CD2-CE2 4.36Å; L535-F559 HydrophobicContact CD2-CG 4.21Å; L535-F561 HydrophobicContact CB-CZ 3.89Å; L535-F561 HydrophobicContact CD2-CE2 4.24Å; L535-F561 HydrophobicContact CD2-CZ 4.42Å; L535-V572 HydrophobicContact CD1-CG1 4.13Å; L535-V572 HydrophobicContact CG-CG1 4.05Å; L535-V572 HydrophobicContact CG-CG2 4.08Å
536	E	82.8	Confident	80.3	Confident	18 Å²	18	34.4 Å²	34.4	8%	0.084	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.4	176.2	-45.1	-162.3	178.2	0	0	110.7	L534 D540 R541 E571	L534-E536 HydrophobicContact CD2-CG 4.3Å; L534-E536 WeakPolarHBondContact CD2-OE1 3.5Å; L534-E536 HydrophobicContact CG-CG 4.26Å; E536-D540 CarbonylContact C-O 3.57Å; E536-D540 VanDerWaalsContact CA-O 3.31Å; E536-D540 WeakPolarHBondContact CA-O 3.37Å; E536-R541 HydrophobicContact CB-CG 4.23Å; E536-R541 VanDerWaalsContact CD-CZ 3.48Å; E536-R541 VanDerWaalsContact CD-NH2 3.28Å; E536-R541 HydrophobicContact CG-CG 3.9Å; E536-R541 IonicContact OE1-CZ 2.83Å; E536-R541 IonicContact OE1-NE 2.69Å; E536-R541 PolarHBondContact OE1-NE 2.97Å; E536-R541 VanDerWaalsContact OE1-NE 3.1Å; E536-R541 IonicContact OE1-NH2 2.9Å; E536-R541 PolarHBondContact OE1-NH2 2.8Å; E536-R541 IonicContact OE2-CZ 3.92Å; E536-R541 IonicContact OE2-NE 3.64Å; E536-R541 PolarHBondContact OE2-NE 2.89Å; E536-R541 IonicContact OE2-NH2 2.71Å; E536-R541 PolarHBondContact OE2-NH2 2.71Å; E536-E571 HydrophobicContact CB-CB 4.36Å; E536-E571 PolarHBondContact N-O 2.9Å; E536-E571 PolarHBondContact O-N 3.28Å
537	L	83.1	Confident	81	Confident	11 Å²	11	32.6 Å²	32.6	6%	0.058	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	105.2	171.1	-173.4	66.9	0	0	0	110.3	L510 N539 D540 F561 D568 L570 L593	L510-L537 HydrophobicContact CD2-CD2 3.98Å; L537-N539 VanDerWaalsContact C-N 3.29Å; L537-N539 PolarHBondContact O-N 2.87Å; L537-D540 PolarHBondContact N-O 2.75Å; L537-D540 PolarHBondContact O-N 2.78Å; L537-F561 HydrophobicContact CB-CD1 3.83Å; L537-F561 HydrophobicContact CB-CE1 4.01Å; L537-F561 HydrophobicContact CB-CG 4.3Å; L537-F561 HydrophobicContact CD2-CB 3.65Å; L537-F561 HydrophobicContact CD2-CD1 4.27Å; L537-F561 HydrophobicContact CD2-CG 4.01Å; L537-D568 HydrophobicContact CD1-CB 4.3Å; L537-L570 HydrophobicContact CB-CD1 4.21Å; L537-L570 HydrophobicContact CD1-CB 4.17Å; L537-L570 HydrophobicContact CD1-CD1 4.49Å; L537-L593 HydrophobicContact CD1-CD1 4.25Å; L537-L593 HydrophobicContact CD1-CD2 3.93Å; L537-L593 HydrophobicContact CD1-CG 4.3Å
538	G	76	Confident	81.5	Confident	13 Å²	13	37.3 Å²	37.3	13%	0.134	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	-84.2	-177.4	0	0	0	0	0	111.9	R643	G538-R643 PolarHBondContact O-NE 2.73Å
539	N	71.4	Confident	81.6	Confident	20 Å²	20	38.3 Å²	38.3	11%	0.107	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-9.8	177.1	-84.2	-45.6	0	0	0	113.7	L537 K642 R643 F644	L537-N539 VanDerWaalsContact C-N 3.29Å; L537-N539 PolarHBondContact O-N 2.87Å; N539-K642 PolarHBondContact ND2-O 2.77Å; N539-R643 VanDerWaalsContact OD1-CA 3.25Å; N539-R643 WeakPolarHBondContact OD1-CA 3.37Å; N539-F644 HydrophobicContact CB-CD1 4.27Å; N539-F644 HydrophobicContact CB-CD2 3.93Å; N539-F644 HydrophobicContact CB-CE1 3.91Å; N539-F644 HydrophobicContact CB-CE2 3.55Å; N539-F644 HydrophobicContact CB-CG 4.29Å; N539-F644 HydrophobicContact CB-CZ 3.54Å; N539-F644 VanDerWaalsContact CG-CZ 3.48Å; N539-F644 WeakPolarHBondContact ND2-CE1 3.45Å; N539-F644 WeakPolarHBondContact OD1-CD1 3.43Å; N539-F644 WeakPolarHBondContact OD1-CG 3.41Å; N539-F644 PolarHBondContact OD1-N 2.87Å
540	D	71.3	Confident	81.6	Confident	5 Å²	5	41 Å²	41	3%	0.027	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.7	178.3	-64.2	-10.2	0	0	0	108.9	W353 H406 V472 E536 L537 F561	W353-D540 HydrophobicContact CH2-CB 4.04Å; W353-D540 HydrophobicContact CZ2-CB 4.4Å; W353-D540 WeakPolarHBondContact CZ2-OD1 3.49Å; H406-D540 IonicContact CE1-OD1 2.65Å; H406-D540 PolarHBondContact CE1-OD1 3.36Å; H406-D540 IonicContact NE2-OD1 2.75Å; V472-D540 HydrophobicContact CG2-CB 4.19Å; V472-D540 VanDerWaalsContact CG2-OD2 3.28Å; V472-D540 WeakPolarHBondContact CG2-OD2 3.42Å; E536-D540 CarbonylContact C-O 3.57Å; E536-D540 VanDerWaalsContact CA-O 3.31Å; E536-D540 WeakPolarHBondContact CA-O 3.37Å; L537-D540 PolarHBondContact N-O 2.75Å; L537-D540 PolarHBondContact O-N 2.78Å; D540-F561 HydrophobicContact CB-CD1 3.9Å; D540-F561 HydrophobicContact CB-CE1 4.11Å
541	R	72	Confident	81.5	Confident	124 Å²	124	42 Å²	42	47%	0.468	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.7	-177.7	-64.8	-174.7	161.6	-174.6	-16.4	111	L535 E536	L535-R541 WeakPolarHBondContact O-CA 3.16Å; E536-R541 HydrophobicContact CB-CG 4.23Å; E536-R541 VanDerWaalsContact CD-CZ 3.48Å; E536-R541 VanDerWaalsContact CD-NH2 3.28Å; E536-R541 HydrophobicContact CG-CG 3.9Å; E536-R541 IonicContact OE1-CZ 2.83Å; E536-R541 IonicContact OE1-NE 2.69Å; E536-R541 PolarHBondContact OE1-NE 2.97Å; E536-R541 VanDerWaalsContact OE1-NE 3.1Å; E536-R541 IonicContact OE1-NH2 2.9Å; E536-R541 PolarHBondContact OE1-NH2 2.8Å; E536-R541 IonicContact OE2-CZ 3.92Å; E536-R541 IonicContact OE2-NE 3.64Å; E536-R541 PolarHBondContact OE2-NE 2.89Å; E536-R541 IonicContact OE2-NH2 2.71Å; E536-R541 PolarHBondContact OE2-NH2 2.71Å
542	L	74.5	Confident	81.5	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.037	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.8	-176.7	-56.9	176.7	0	0	0	111.1	L352 V472 I474 L534 L535 F559 F561	L352-L542 HydrophobicContact CD1-CD2 3.34Å; V472-L542 HydrophobicContact CG1-CD1 3.33Å; V472-L542 HydrophobicContact CG1-CD2 3.59Å; V472-L542 HydrophobicContact CG1-CG 3.91Å; I474-L542 HydrophobicContact CD1-CD2 4.37Å; I474-L542 HydrophobicContact CG1-CD2 4.45Å; L534-L542 CarbonylContact C-O 3.53Å; L534-L542 WeakPolarHBondContact CA-O 3.27Å; L535-L542 PolarHBondContact N-O 2.85Å; L535-L542 PolarHBondContact O-N 3.11Å; L542-F559 HydrophobicContact CB-CD1 3.86Å; L542-F559 HydrophobicContact CB-CE1 4.02Å; L542-F559 HydrophobicContact CD1-CB 3.92Å; L542-F559 HydrophobicContact CD1-CD1 3.55Å; L542-F559 HydrophobicContact CD1-CE1 4.48Å; L542-F559 HydrophobicContact CD1-CG 4.13Å; L542-F559 HydrophobicContact CG-CD1 4.32Å; L542-F561 HydrophobicContact CB-CZ 4.37Å; L542-F561 HydrophobicContact CD1-CD1 4.17Å; L542-F561 HydrophobicContact CD1-CE1 3.48Å; L542-F561 VanDerWaalsContact CD1-CE1 3.48Å; L542-F561 HydrophobicContact CD1-CE2 3.89Å; L542-F561 HydrophobicContact CD1-CZ 3.31Å; L542-F561 HydrophobicContact CG-CE1 3.85Å; L542-F561 HydrophobicContact CG-CZ 3.92Å
543	Q	78.4	Confident	81.5	Confident	126 Å²	126	44.7 Å²	44.7	59%	0.589	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	150	176.4	64.9	-168.2	66.9	0	0	112.5	C533 L534	C533-Q543 CarbonylContact O-C 3.51Å; C533-Q543 VanDerWaalsContact O-CA 3.28Å; C533-Q543 WeakPolarHBondContact O-CA 3.4Å; L534-Q543 HydrophobicContact CD1-CB 4.28Å
544	T	81.2	Confident	81.5	Confident	9 Å²	9	49.5 Å²	49.5	6%	0.055	23%	0.234	C	C	.	.			trans	-73.5	179	164.4	63.1	0	0	0	0	110.7	V514 C533 W555 F559	V514-T544 HydrophobicContact CB-CG2 4.4Å; V514-T544 HydrophobicContact CG1-CG2 4.13Å; C533-T544 HydrophobicContact CB-CG2 3.8Å; C533-T544 PolarHBondContact N-OG1 2.81Å; C533-T544 PolarHBondContact O-N 2.62Å; T544-W555 HydrophobicContact CG2-CB 4.24Å; T544-W555 HydrophobicContact CG2-CD2 4.45Å; T544-W555 HydrophobicContact CG2-CG 4.05Å; T544-W555 PolarHBondContact OG1-NE1 2.82Å; T544-F559 HydrophobicContact CG2-CE2 3.9Å; T544-F559 HydrophobicContact CG2-CZ 3.76Å
545	H	76.6	Confident	81.4	Confident	85 Å²	85	48.5 Å²	48.5	39%	0.394	23%	0.228	S	C	.	.			trans	-76.5	158.8	157.4	65.4	-78.9	0	0	0	110.1	W555	H545-W555 AromaticContact CE1-CD1 3.93Å; H545-W555 PolarHBondContact CE1-O 3.5Å; H545-W555 PolarHBondContact O-NE1 3.37Å; H545-W555 VanDerWaalsContact O-NE1 3.07Å
546	T	84.7	Confident	81.2	Confident	24 Å²	24	51.5 Å²	51.5	15%	0.147	24%	0.244	C	C	.	.			trans	-81.9	142.1	175.3	-41.3	0	0	0	0	110.9	D530 Y548 E577	D530-T546 HydrophobicContact CB-CG2 4.14Å; D530-T546 WeakPolarHBondContact O-CG2 3.49Å; T546-Y548 HydrophobicContact CG2-CE1 4.28Å; T546-E577 WeakPolarHBondContact CB-OE2 3.45Å; T546-E577 HydrophobicContact CG2-CB 3.76Å; T546-E577 WeakPolarHBondContact CG2-OE2 3.28Å; T546-E577 PolarHBondContact OG1-OE2 2.85Å
547	V	83.7	Confident	80.8	Confident	27 Å²	27	53.1 Å²	53.1	16%	0.164	25%	0.251	C	S	.	.			trans	-118.7	95.4	180	178.9	0	0	0	0	109.7	P531 N550 P553 W555	P531-V547 VanDerWaalsContact CD-O 3.3Å; P531-V547 WeakPolarHBondContact CD-O 3.14Å; P531-V547 PolarHBondContact O-N 2.97Å; V547-N550 HydrophobicContact CG1-CB 4.16Å; V547-P553 HydrophobicContact CB-CB 3.78Å; V547-P553 HydrophobicContact CG1-CB 3.91Å; V547-P553 HydrophobicContact CG2-CB 4.15Å; V547-W555 HydrophobicContact CG2-CG 4.44Å
548	Y	85.1	Confident	80.7	Confident	148 Å²	148	52.6 Å²	52.6	58%	0.58	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	135.2	-172.7	-55.3	-77.4	0	0	0	114.3	D530 T546 N550	D530-Y548 HydrophobicContact CB-CD1 4.02Å; D530-Y548 VanDerWaalsContact OD1-CA 3.24Å; D530-Y548 WeakPolarHBondContact OD1-CA 3.32Å; D530-Y548 WeakPolarHBondContact OD2-CD1 3.4Å; T546-Y548 HydrophobicContact CG2-CE1 4.28Å; Y548-N550 PolarHBondContact O-N 2.84Å
549	K	83	Confident	80.9	Confident	113 Å²	113	52 Å²	52	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	45.1	164.8	-64.1	-172.7	176.5	170.7	0	113.8	K528 S529 D530	K528-K549 HydrophobicContact CD-CB 3.83Å; K528-K549 WeakPolarHBondContact CD-O 3.36Å; K528-K549 PolarHBondContact NZ-O 3.4Å; S529-K549 CarbonylContact O-C 3.5Å; S529-K549 VanDerWaalsContact O-CA 3.23Å; S529-K549 WeakPolarHBondContact O-CA 2.93Å; S529-K549 PolarHBondContact O-N 2.94Å; S529-K549 VanDerWaalsContact O-N 3.09Å; D530-K549 WeakPolarHBondContact OD1-CG 3.19Å; D530-K549 PolarHBondContact OD1-N 3.03Å
550	N	84	Confident	81.2	Confident	57 Å²	57	51.4 Å²	51.4	31%	0.305	24%	0.239	S	C	.	.			trans	-145.6	120	-175.3	-172.2	8.9	0	0	0	113.4	S529 P531 V547 Y548 N552	S529-N550 PolarHBondContact O-N 3Å; P531-N550 WeakPolarHBondContact CD-O 3.46Å; P531-N550 WeakPolarHBondContact CG-O 3.37Å; V547-N550 HydrophobicContact CG1-CB 4.16Å; Y548-N550 PolarHBondContact O-N 2.84Å; N550-N552 VanDerWaalsContact C-N 3.3Å; N550-N552 PolarHBondContact ND2-O 2.85Å; N550-N552 WeakPolarHBondContact OD1-CA 3.25Å; N550-N552 PolarHBondContact OD1-N 2.86Å; N550-N552 PolarHBondContact OD1-O 3.02Å
551	L	85.6	Confident	81.6	Confident	43 Å²	43	51.2 Å²	51.2	23%	0.225	24%	0.238	C	C	.	.	S	Bend	trans	-81	-8.7	174.6	-58.5	177.8	0	0	0	113.7	D519 L520 L521 A522 P553	D519-L551 PolarHBondContact N-O 2.83Å; L520-L551 HydrophobicContact CB-CD2 4.42Å; L520-L551 WeakPolarHBondContact CG-O 3.31Å; L520-L551 PolarHBondContact N-O 2.65Å; L521-L551 WeakPolarHBondContact O-CD2 3.37Å; A522-L551 HydrophobicContact CB-CD1 4.37Å; A522-L551 HydrophobicContact CB-CD2 3.98Å; L551-P553 WeakPolarHBondContact O-CD 3.31Å
552	N	88	Confident	81.9	Confident	80 Å²	80	46.1 Å²	46.1	43%	0.428	22%	0.221	S	C	.	.	S	Bend	trans	-123.8	62.2	177.2	-60.8	-43.7	0	0	0	110.5	A517 A518 D519 N550	A517-N552 CarbonylContact O-C 3.57Å; A517-N552 WeakPolarHBondContact O-CA 3.32Å; A518-N552 WeakPolarHBondContact CA-OD1 3.23Å; A518-N552 WeakPolarHBondContact CB-OD1 3.4Å; D519-N552 PolarHBondContact N-OD1 2.64Å; N550-N552 VanDerWaalsContact C-N 3.3Å; N550-N552 PolarHBondContact ND2-O 2.85Å; N550-N552 WeakPolarHBondContact OD1-CA 3.25Å; N550-N552 PolarHBondContact OD1-N 2.86Å; N550-N552 PolarHBondContact OD1-O 3.02Å
553	P	88.8	Confident	82.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.22	C	C	.	.			trans	-71.5	135.2	-174.4	32.3	-39.4	0	0	0	112.4	K516 A517 L520 P531 V547 L551 W555	K516-P553 CarbonylContact C-O 3.55Å; K516-P553 WeakPolarHBondContact CA-O 3.48Å; K516-P553 WeakPolarHBondContact CB-O 3.36Å; A517-P553 HydrophobicContact CB-CG 3.92Å; A517-P553 PolarHBondContact N-O 2.78Å; L520-P553 HydrophobicContact CD1-CG 3.86Å; P531-P553 HydrophobicContact CB-CG 4.26Å; P531-P553 HydrophobicContact CG-CB 3.77Å; P531-P553 HydrophobicContact CG-CG 3.55Å; V547-P553 HydrophobicContact CB-CB 3.78Å; V547-P553 HydrophobicContact CG1-CB 3.91Å; V547-P553 HydrophobicContact CG2-CB 4.15Å; L551-P553 WeakPolarHBondContact O-CD 3.31Å; P553-W555 HydrophobicContact CB-CD2 4.47Å; P553-W555 HydrophobicContact CB-CH2 4.1Å; P553-W555 HydrophobicContact CB-CZ2 3.78Å; P553-W555 HydrophobicContact CG-CH2 3.35Å; P553-W555 HydrophobicContact CG-CZ2 3.47Å; P553-W555 VanDerWaalsContact CG-CZ2 3.47Å; P553-W555 HydrophobicContact CG-CZ3 3.93Å
554	E	89.1	Confident	82.3	Confident	101 Å²	101	41.1 Å²	41.1	47%	0.472	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.4	170.3	-52.6	-157	148.9	0	0	109.9	K516	K516-E554 HydrophobicContact CB-CB 4.1Å; K516-E554 HydrophobicContact CB-CG 3.8Å; K516-E554 HydrophobicContact CD-CG 3.83Å; K516-E554 WeakPolarHBondContact CD-OE1 3.44Å; K516-E554 WeakPolarHBondContact CE-OE1 3.39Å; K516-E554 IonicContact NZ-OE1 2.69Å; K516-E554 PolarHBondContact NZ-OE1 3.31Å
555	W	84.1	Confident	82.4	Confident	8 Å²	8	40.8 Å²	40.8	3%	0.03	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-39	-177.2	-62.8	-74.9	0	0	0	112.8	V514 L515 A517 P531 C533 T544 H545 V547 P553 K557 V574	V514-W555 HydrophobicContact CG1-CB 4.38Å; V514-W555 HydrophobicContact CG1-CD2 4.25Å; V514-W555 HydrophobicContact CG1-CE3 3.65Å; V514-W555 HydrophobicContact CG1-CZ3 4.28Å; L515-W555 PolarHBondContact O-N 3.05Å; A517-W555 HydrophobicContact CB-CH2 3.73Å; A517-W555 HydrophobicContact CB-CZ3 3.67Å; P531-W555 HydrophobicContact CB-CZ2 4.22Å; P531-W555 PolarHBondContact O-NE1 2.81Å; C533-W555 WeakPolarHBondContact SG-CH2 3.43Å; C533-W555 WeakPolarHBondContact SG-CZ3 3.16Å; T544-W555 HydrophobicContact CG2-CB 4.24Å; T544-W555 HydrophobicContact CG2-CD2 4.45Å; T544-W555 HydrophobicContact CG2-CG 4.05Å; T544-W555 PolarHBondContact OG1-NE1 2.82Å; H545-W555 AromaticContact CE1-CD1 3.93Å; H545-W555 PolarHBondContact CE1-O 3.5Å; H545-W555 PolarHBondContact O-NE1 3.37Å; H545-W555 VanDerWaalsContact O-NE1 3.07Å; V547-W555 HydrophobicContact CG2-CG 4.44Å; P553-W555 HydrophobicContact CB-CD2 4.47Å; P553-W555 HydrophobicContact CB-CH2 4.1Å; P553-W555 HydrophobicContact CB-CZ2 3.78Å; P553-W555 HydrophobicContact CG-CH2 3.35Å; P553-W555 HydrophobicContact CG-CZ2 3.47Å; P553-W555 VanDerWaalsContact CG-CZ2 3.47Å; P553-W555 HydrophobicContact CG-CZ3 3.93Å; W555-K557 PolarHBondContact O-N 2.83Å; W555-V574 HydrophobicContact CH2-CG1 4.44Å
556	N	82	Confident	82.9	Confident	63 Å²	63	36.8 Å²	36.8	34%	0.337	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.1	42.3	-179.2	-63.6	-61.9	0	0	0	114.3	L477 V514 L515	L477-N556 HydrophobicContact CD2-CB 4.42Å; V514-N556 VanDerWaalsContact O-CA 3.25Å; V514-N556 WeakPolarHBondContact O-CA 3.46Å; V514-N556 PolarHBondContact O-N 2.86Å; L515-N556 PolarHBondContact O-N 2.8Å
557	K	74.8	Confident	82.9	Confident	52 Å²	52	36.3 Å²	36.3	23%	0.226	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	148	-179.9	-70.8	-63.2	-176.4	174.2	0	111.7	D476 K513 V514 W555 F559	D476-K557 IonicContact OD1-NZ 2.71Å; D476-K557 PolarHBondContact OD1-NZ 2.8Å; K513-K557 CarbonylContact C-O 3.55Å; K513-K557 WeakPolarHBondContact CA-O 2.96Å; V514-K557 PolarHBondContact N-O 3.46Å; V514-K557 PolarHBondContact O-N 3.45Å; V514-K557 VanDerWaalsContact O-N 3.09Å; W555-K557 PolarHBondContact O-N 2.83Å; K557-F559 HydrophobicContact CB-CE2 3.82Å; K557-F559 HydrophobicContact CB-CZ 4.05Å
558	V	81.4	Confident	83.1	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129	179.9	-176.1	0	0	0	0	110.8	S475 L477 Q511 V512 K513	S475-V558 PolarHBondContact N-O 3.07Å; S475-V558 PolarHBondContact O-N 3.33Å; S475-V558 VanDerWaalsContact O-O 3.06Å; L477-V558 HydrophobicContact CD1-CG2 3.71Å; Q511-V558 VanDerWaalsContact CD-CG1 3.49Å; Q511-V558 HydrophobicContact CG-CG1 3.53Å; V512-V558 WeakPolarHBondContact O-CA 3.2Å; K513-V558 HydrophobicContact CB-CG2 3.98Å; K513-V558 HydrophobicContact CD-CG2 4Å; K513-V558 HydrophobicContact CG-CG1 4.13Å; K513-V558 HydrophobicContact CG-CG2 3.75Å
559	F	78.6	Confident	83.3	Confident	1 Å²	1	29.3 Å²	29.3	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.3	-179.3	-58.8	-85.3	0	0	0	108.9	I474 Q511 V512 V514 L535 L542 T544 K557 F561	I474-F559 HydrophobicContact CD1-CD1 4.4Å; I474-F559 HydrophobicContact CD1-CE1 4.09Å; I474-F559 HydrophobicContact CG1-CD1 3.94Å; I474-F559 HydrophobicContact CG1-CE1 4.08Å; I474-F559 HydrophobicContact CG2-CD1 4.22Å; I474-F559 HydrophobicContact CG2-CE1 3.99Å; Q511-F559 WeakPolarHBondContact CA-O 3.42Å; V512-F559 PolarHBondContact N-O 3.28Å; V512-F559 PolarHBondContact O-N 2.87Å; V514-F559 HydrophobicContact CB-CE2 4.19Å; V514-F559 HydrophobicContact CG2-CD2 3.8Å; V514-F559 HydrophobicContact CG2-CE2 3.63Å; L535-F559 HydrophobicContact CD1-CE2 4.23Å; L535-F559 HydrophobicContact CD2-CB 4.44Å; L535-F559 HydrophobicContact CD2-CD2 3.83Å; L535-F559 HydrophobicContact CD2-CE2 4.36Å; L535-F559 HydrophobicContact CD2-CG 4.21Å; L542-F559 HydrophobicContact CB-CD1 3.86Å; L542-F559 HydrophobicContact CB-CE1 4.02Å; L542-F559 HydrophobicContact CD1-CB 3.92Å; L542-F559 HydrophobicContact CD1-CD1 3.55Å; L542-F559 HydrophobicContact CD1-CE1 4.48Å; L542-F559 HydrophobicContact CD1-CG 4.13Å; L542-F559 HydrophobicContact CG-CD1 4.32Å; T544-F559 HydrophobicContact CG2-CE2 3.9Å; T544-F559 HydrophobicContact CG2-CZ 3.76Å; K557-F559 HydrophobicContact CB-CE2 3.82Å; K557-F559 HydrophobicContact CB-CZ 4.05Å; F559-F561 HydrophobicContact CB-CD2 4.44Å; F559-F561 HydrophobicContact CB-CE2 3.82Å; F559-F561 HydrophobicContact CB-CZ 4.49Å
560	T	78.6	Confident	83.7	Confident	7 Å²	7	24 Å²	24	4%	0.043	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	116.8	179.7	-51.4	0	0	0	0	109.8	V472 S473 I509 L510 Q511	V472-T560 WeakPolarHBondContact CA-O 3.09Å; S473-T560 PolarHBondContact N-O 2.7Å; S473-T560 VanDerWaalsContact N-O 3.15Å; S473-T560 PolarHBondContact O-N 3.44Å; I509-T560 HydrophobicContact CD1-CG2 3.49Å; I509-T560 VanDerWaalsContact CD1-CG2 3.49Å; I509-T560 HydrophobicContact CG1-CG2 3.61Å; L510-T560 CarbonylContact O-C 3.5Å; L510-T560 WeakPolarHBondContact O-CA 3.04Å; Q511-T560 PolarHBondContact NE2-OG1 2.79Å; Q511-T560 VanDerWaalsContact NE2-OG1 3.16Å
561	F	79.4	Confident	84	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136.7	-176.4	-62.6	-97.8	0	0	0	111.6	V472 I509 L510 V512 L535 L537 D540 L542 F559 L570	V472-F561 HydrophobicContact CG1-CD1 4.47Å; V472-F561 HydrophobicContact CG2-CD1 4.36Å; I509-F561 WeakPolarHBondContact CA-O 3.26Å; L510-F561 HydrophobicContact CB-CB 4.43Å; L510-F561 HydrophobicContact CD2-CD2 4.38Å; L510-F561 PolarHBondContact N-O 3.23Å; L510-F561 PolarHBondContact O-N 2.93Å; V512-F561 HydrophobicContact CG2-CD2 4.18Å; V512-F561 HydrophobicContact CG2-CE2 4.1Å; L535-F561 HydrophobicContact CB-CZ 3.89Å; L535-F561 HydrophobicContact CD2-CE2 4.24Å; L535-F561 HydrophobicContact CD2-CZ 4.42Å; L537-F561 HydrophobicContact CB-CD1 3.83Å; L537-F561 HydrophobicContact CB-CE1 4.01Å; L537-F561 HydrophobicContact CB-CG 4.3Å; L537-F561 HydrophobicContact CD2-CB 3.65Å; L537-F561 HydrophobicContact CD2-CD1 4.27Å; L537-F561 HydrophobicContact CD2-CG 4.01Å; D540-F561 HydrophobicContact CB-CD1 3.9Å; D540-F561 HydrophobicContact CB-CE1 4.11Å; L542-F561 HydrophobicContact CB-CZ 4.37Å; L542-F561 HydrophobicContact CD1-CD1 4.17Å; L542-F561 HydrophobicContact CD1-CE1 3.48Å; L542-F561 VanDerWaalsContact CD1-CE1 3.48Å; L542-F561 HydrophobicContact CD1-CE2 3.89Å; L542-F561 HydrophobicContact CD1-CZ 3.31Å; L542-F561 HydrophobicContact CG-CE1 3.85Å; L542-F561 HydrophobicContact CG-CZ 3.92Å; F559-F561 HydrophobicContact CB-CD2 4.44Å; F559-F561 HydrophobicContact CB-CE2 3.82Å; F559-F561 HydrophobicContact CB-CZ 4.49Å; F561-L570 HydrophobicContact CE2-CD1 4.3Å; F561-L570 HydrophobicContact CZ-CD1 4.42Å
562	P	77.8	Confident	84.3	Confident	17 Å²	17	20 Å²	20	11%	0.11	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.7	168	32.8	-30.9	0	0	0	110	V472	V472-P562 HydrophobicContact CG2-CG 4.12Å
563	I	83.1	Confident	84.4	Confident	2 Å²	2	16.3 Å²	16.3	1%	0.01	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.7	-177.8	-56.8	173.9	0	0	0	109.1	V507 G508 L510 D565 I566 L593 L625	V507-I563 WeakPolarHBondContact CB-O 3.42Å; V507-I563 PolarHBondContact N-O 2.85Å; V507-I563 VanDerWaalsContact N-O 3.1Å; G508-I563 PolarHBondContact N-O 3.48Å; G508-I563 PolarHBondContact O-N 2.94Å; L510-I563 HydrophobicContact CB-CD1 4.01Å; L510-I563 HydrophobicContact CB-CG1 4.05Å; I563-D565 VanDerWaalsContact CG2-O 3.26Å; I563-D565 WeakPolarHBondContact CG2-O 3.33Å; I563-I566 HydrophobicContact CD1-CD1 4.48Å; I563-I566 HydrophobicContact CG2-CD1 4.44Å; I563-L593 HydrophobicContact CD1-CD1 4.34Å; I563-L593 HydrophobicContact CG1-CD1 4.38Å; I563-L593 HydrophobicContact CG2-CD1 3.96Å; I563-L625 HydrophobicContact CD1-CD1 3.16Å
564	K	79	Confident	84.5	Confident	26 Å²	26	16.3 Å²	16.3	11%	0.113	8%	0.08	C	C	.	.	S	Bend	trans	-87.1	-28.7	173.6	-58	-175.9	-176.8	173.4	0	112.9	V507 R635 E641	V507-K564 WeakPolarHBondContact CG2-O 3.28Å; K564-R635 WeakPolarHBondContact O-CG 3.28Å; K564-R635 PolarHBondContact O-NE 2.85Å; K564-E641 WeakPolarHBondContact CD-OE1 3.44Å; K564-E641 WeakPolarHBondContact CD-OE2 3.31Å; K564-E641 IonicContact NZ-OE2 2.73Å; K564-E641 PolarHBondContact NZ-OE2 3.16Å
565	D	82.8	Confident	84.6	Confident	3 Å²	3	13.5 Å²	13.5	2%	0.016	7%	0.066	C	C	.	.			trans	-150.8	139.9	174.6	-157.2	-46.7	0	0	0	110.1	I563 H567 R848	I563-D565 VanDerWaalsContact CG2-O 3.26Å; I563-D565 WeakPolarHBondContact CG2-O 3.33Å; D565-H567 VanDerWaalsContact C-N 3.25Å; D565-H567 PolarHBondContact O-N 3.24Å; D565-H567 IonicContact OD1-CE1 2.65Å; D565-H567 IonicContact OD1-CG 3.71Å; D565-H567 PolarHBondContact OD1-N 2.91Å; D565-H567 IonicContact OD1-ND1 3.2Å; D565-H567 PolarHBondContact OD1-ND1 3.13Å; D565-R848 IonicContact OD1-NE 3.52Å; D565-R848 IonicContact OD2-CZ 2.66Å; D565-R848 IonicContact OD2-NE 3.1Å; D565-R848 PolarHBondContact OD2-NE 2.78Å; D565-R848 IonicContact OD2-NH2 2.73Å; D565-R848 PolarHBondContact OD2-NH2 3.18Å
566	I	87.1	Confident	84.8	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.9	179.4	-157.5	63.5	0	0	0	112.5	I563 L593 L594 L625 Y627 A632 F794	I563-I566 HydrophobicContact CD1-CD1 4.48Å; I563-I566 HydrophobicContact CG2-CD1 4.44Å; I566-L593 HydrophobicContact CD1-CB 4.23Å; I566-L593 HydrophobicContact CD1-CD1 4.47Å; I566-L594 HydrophobicContact CG1-CD2 3.65Å; I566-L594 HydrophobicContact CG1-CG 4.07Å; I566-L594 HydrophobicContact CG2-CD1 4.49Å; I566-L594 HydrophobicContact CG2-CD2 4.29Å; I566-L594 HydrophobicContact CG2-CG 4.5Å; I566-L625 HydrophobicContact CD1-CD1 3.95Å; I566-L625 HydrophobicContact CD1-CD2 4.26Å; I566-Y627 HydrophobicContact CD1-CD1 3.79Å; I566-Y627 HydrophobicContact CD1-CD2 3.85Å; I566-Y627 HydrophobicContact CD1-CE1 4.15Å; I566-Y627 HydrophobicContact CD1-CE2 4.21Å; I566-Y627 HydrophobicContact CD1-CG 3.63Å; I566-Y627 HydrophobicContact CG1-CD2 3.98Å; I566-Y627 HydrophobicContact CG1-CE2 3.96Å; I566-Y627 HydrophobicContact CG1-CG 4.27Å; I566-A632 HydrophobicContact CB-CB 4.14Å; I566-A632 HydrophobicContact CG2-CB 3.76Å; I566-F794 HydrophobicContact CG2-CE1 4.27Å
567	H	86	Confident	85	Confident	15 Å²	15	14.1 Å²	14.1	7%	0.069	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	9.3	178.8	-48.6	91.8	0	0	0	113.1	D565 T636 R640 F794 L795 R848	D565-H567 VanDerWaalsContact C-N 3.25Å; D565-H567 PolarHBondContact O-N 3.24Å; D565-H567 IonicContact OD1-CE1 2.65Å; D565-H567 IonicContact OD1-CG 3.71Å; D565-H567 PolarHBondContact OD1-N 2.91Å; D565-H567 IonicContact OD1-ND1 3.2Å; D565-H567 PolarHBondContact OD1-ND1 3.13Å; H567-T636 PolarHBondContact CE1-OG1 2.83Å; H567-T636 VanDerWaalsContact CE1-OG1 3.31Å; H567-R640 PolarHBondContact O-NH2 3.17Å; H567-F794 AromaticContact CE1-CE1 3.82Å; H567-F794 AromaticContact NE2-CD1 3.46Å; H567-F794 WeakPolarHBondContact NE2-CD1 3.31Å; H567-F794 AromaticContact NE2-CE1 3.74Å; H567-L795 VanDerWaalsContact NE2-CD2 3.31Å; H567-L795 WeakPolarHBondContact NE2-CD2 3.29Å; H567-L795 WeakPolarHBondContact NE2-CG 3.24Å; H567-R848 HydrophobicContact CB-CB 3.82Å; H567-R848 HydrophobicContact CB-CG 3.98Å
568	D	87.3	Confident	85.2	Confident	24 Å²	24	13.6 Å²	13.6	13%	0.128	7%	0.068	C	C	.	.			trans	-75.1	168.2	165.7	-76.7	-36.4	0	0	0	111.7	L537 L593 R640	L537-D568 HydrophobicContact CD1-CB 4.3Å; D568-L593 PolarHBondContact O-N 2.9Å; D568-R640 IonicContact OD1-CZ 2.66Å; D568-R640 IonicContact OD1-NE 2.75Å; D568-R640 PolarHBondContact OD1-NE 3.41Å; D568-R640 IonicContact OD1-NH2 3.19Å; D568-R640 PolarHBondContact OD1-NH2 2.96Å
569	V	89.3	Confident	84.9	Confident	4 Å²	4	16.6 Å²	16.6	2%	0.024	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.7	-171.6	179.5	0	0	0	0	106.8	E571 A590 P592 Y858	V569-E571 HydrophobicContact CG1-CG 4.42Å; V569-E571 PolarHBondContact O-N 2.9Å; V569-A590 HydrophobicContact CG1-CB 3.87Å; V569-P592 HydrophobicContact CG2-CB 4.43Å; V569-P592 HydrophobicContact CG2-CG 4.43Å; V569-Y858 HydrophobicContact CB-CE1 4.48Å; V569-Y858 HydrophobicContact CG1-CD1 4.09Å; V569-Y858 HydrophobicContact CG1-CE1 3.82Å; V569-Y858 HydrophobicContact CG2-CE1 4.1Å; V569-Y858 HydrophobicContact CG2-CE2 4.02Å
570	L	90.6	Very high	84.4	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.9	172	179.8	71.1	0	0	0	108.1	L510 V512 L537 F561 V572 A590 I591 M623	L510-L570 HydrophobicContact CD2-CD1 4.48Å; L510-L570 HydrophobicContact CD2-CD2 4.46Å; V512-L570 HydrophobicContact CG1-CD2 4.1Å; V512-L570 HydrophobicContact CG2-CD1 4.43Å; V512-L570 HydrophobicContact CG2-CD2 3.73Å; L537-L570 HydrophobicContact CB-CD1 4.21Å; L537-L570 HydrophobicContact CD1-CB 4.17Å; L537-L570 HydrophobicContact CD1-CD1 4.49Å; F561-L570 HydrophobicContact CE2-CD1 4.3Å; F561-L570 HydrophobicContact CZ-CD1 4.42Å; L570-V572 HydrophobicContact CD2-CG2 4Å; L570-V572 HydrophobicContact CG-CG2 3.91Å; L570-A590 WeakPolarHBondContact O-CA 3.4Å; L570-I591 PolarHBondContact N-O 3.49Å; L570-I591 PolarHBondContact O-N 2.96Å; L570-M623 HydrophobicContact CD2-SD 3.9Å
571	E	90.9	Very high	84.3	Confident	16 Å²	16	30.2 Å²	30.2	8%	0.075	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	111.5	175.9	-75.5	175.2	-140.1	0	0	108.9	E536 V569 K588 V589 A590 R643	E536-E571 HydrophobicContact CB-CB 4.36Å; E536-E571 PolarHBondContact N-O 2.9Å; E536-E571 PolarHBondContact O-N 3.28Å; V569-E571 HydrophobicContact CG1-CG 4.42Å; V569-E571 PolarHBondContact O-N 2.9Å; E571-K588 WeakPolarHBondContact OE2-CE 3.5Å; E571-K588 IonicContact OE2-NZ 3.36Å; E571-K588 PolarHBondContact OE2-NZ 3.24Å; E571-V589 CarbonylContact C-O 3.59Å; E571-V589 WeakPolarHBondContact CA-O 3.18Å; E571-A590 HydrophobicContact CG-CB 4.03Å; E571-R643 IonicContact OE1-CZ 3.64Å; E571-R643 IonicContact OE1-NH1 3.66Å; E571-R643 PolarHBondContact OE1-NH1 2.9Å; E571-R643 IonicContact OE1-NH2 2.77Å; E571-R643 PolarHBondContact OE1-NH2 3.05Å; E571-R643 IonicContact OE2-NH1 2.65Å
572	V	91.6	Very high	84.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.3	176.7	-169.3	0	0	0	0	108.6	C533 L534 L535 L570 K588 V589 I619 L621	C533-V572 HydrophobicContact CB-CG1 4.43Å; L534-V572 CarbonylContact O-C 3.52Å; L534-V572 WeakPolarHBondContact O-CA 3.46Å; L535-V572 HydrophobicContact CD1-CG1 4.13Å; L535-V572 HydrophobicContact CG-CG1 4.05Å; L535-V572 HydrophobicContact CG-CG2 4.08Å; L570-V572 HydrophobicContact CD2-CG2 4Å; L570-V572 HydrophobicContact CG-CG2 3.91Å; V572-K588 CarbonylContact O-C 3.56Å; V572-K588 WeakPolarHBondContact O-CA 3.42Å; V572-V589 HydrophobicContact CB-CG1 3.83Å; V572-V589 HydrophobicContact CG2-CG1 4.43Å; V572-V589 PolarHBondContact N-O 3.37Å; V572-V589 PolarHBondContact O-N 2.97Å; V572-I619 HydrophobicContact CG1-CD1 3.85Å; V572-L621 HydrophobicContact CG2-CD1 4.02Å
573	T	90.3	Very high	84.4	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.2	-174.3	-40.9	0	0	0	0	109	C533 L534 F575 F585 G587 K588	C533-T573 CarbonylContact C-O 3.44Å; C533-T573 WeakPolarHBondContact CA-O 3.47Å; L534-T573 PolarHBondContact N-O 2.66Å; L534-T573 PolarHBondContact O-N 2.73Å; T573-F575 HydrophobicContact CG2-CD2 3.98Å; T573-F575 HydrophobicContact CG2-CE1 4.31Å; T573-F575 HydrophobicContact CG2-CE2 3.36Å; T573-F575 HydrophobicContact CG2-CZ 3.55Å; T573-F585 HydrophobicContact CG2-CD2 4.03Å; T573-F585 HydrophobicContact CG2-CE2 3.68Å; T573-G587 CarbonylContact C-O 3.59Å; T573-G587 WeakPolarHBondContact CA-O 3.18Å; T573-G587 WeakPolarHBondContact CG2-O 3.43Å; T573-K588 HydrophobicContact CG2-CB 4.14Å; T573-K588 HydrophobicContact CG2-CD 4.15Å; T573-K588 HydrophobicContact CG2-CG 4.06Å; T573-K588 WeakPolarHBondContact OG1-CE 3.33Å
574	V	91.6	Very high	84.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.9	175.2	-166.6	0	0	0	0	108.3	L520 P531 F532 W555 L586 G587 L606 I619	L520-V574 HydrophobicContact CD1-CG1 4.24Å; L520-V574 HydrophobicContact CD2-CG1 4.24Å; P531-V574 HydrophobicContact CB-CG1 4.16Å; F532-V574 WeakPolarHBondContact O-CA 3.43Å; W555-V574 HydrophobicContact CH2-CG1 4.44Å; V574-L586 HydrophobicContact CB-CB 4.16Å; V574-L586 HydrophobicContact CG1-CB 4.02Å; V574-L586 HydrophobicContact CG1-CD1 4.29Å; V574-L586 PolarHBondContact O-N 3.35Å; V574-G587 PolarHBondContact N-O 3.35Å; V574-G587 PolarHBondContact O-N 2.89Å; V574-L606 HydrophobicContact CG2-CD1 4.02Å; V574-L606 HydrophobicContact CG2-CD2 3.92Å; V574-I619 HydrophobicContact CG2-CD1 4.32Å
575	F	90.2	Very high	85	Confident	41 Å²	41	42.5 Å²	42.5	18%	0.18	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.4	-178.4	-74.2	-78	0	0	0	110.3	P531 F532 L534 T573 P583 D584 F585	P531-F575 CarbonylContact C-O 3.6Å; P531-F575 VanDerWaalsContact CA-O 3.26Å; P531-F575 WeakPolarHBondContact CA-O 3.35Å; F532-F575 HydrophobicContact CD1-CB 4.07Å; F532-F575 WeakPolarHBondContact CD1-O 3.41Å; F532-F575 HydrophobicContact CD2-CB 4.42Å; F532-F575 HydrophobicContact CE1-CB 3.49Å; F532-F575 VanDerWaalsContact CE1-CB 3.49Å; F532-F575 HydrophobicContact CE2-CB 3.89Å; F532-F575 HydrophobicContact CE2-CD2 4.18Å; F532-F575 HydrophobicContact CE2-CG 4.4Å; F532-F575 HydrophobicContact CZ-CB 3.4Å; F532-F575 HydrophobicContact CZ-CD2 4.31Å; F532-F575 HydrophobicContact CZ-CG 4.09Å; F532-F575 PolarHBondContact N-O 2.75Å; F532-F575 PolarHBondContact O-N 2.72Å; L534-F575 HydrophobicContact CB-CD2 4.1Å; L534-F575 HydrophobicContact CB-CE2 4.05Å; L534-F575 HydrophobicContact CD2-CE2 3.9Å; T573-F575 HydrophobicContact CG2-CD2 3.98Å; T573-F575 HydrophobicContact CG2-CE1 4.31Å; T573-F575 HydrophobicContact CG2-CE2 3.36Å; T573-F575 HydrophobicContact CG2-CZ 3.55Å; F575-P583 HydrophobicContact CB-CB 4.26Å; F575-P583 HydrophobicContact CD1-CB 4.4Å; F575-P583 HydrophobicContact CD1-CG 4.47Å; F575-D584 CarbonylContact C-O 3.57Å; F575-D584 VanDerWaalsContact CA-O 3.28Å; F575-D584 WeakPolarHBondContact CA-O 3.04Å; F575-F585 HydrophobicContact CE1-CD2 4.21Å
576	D	88.8	Confident	85.2	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.027	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	147.1	170.5	-136.7	-30.9	0	0	0	110.4	A523 S529 D530 P583 D584 L586	A523-D576 WeakPolarHBondContact CB-OD2 3.27Å; S529-D576 WeakPolarHBondContact CA-OD2 3.32Å; S529-D576 WeakPolarHBondContact CB-OD2 3.43Å; S529-D576 PolarHBondContact OG-OD2 3.35Å; D530-D576 WeakPolarHBondContact CA-OD1 3.33Å; D530-D576 PolarHBondContact N-OD1 2.71Å; D576-P583 WeakPolarHBondContact O-CA 3.41Å; D576-P583 WeakPolarHBondContact O-CB 3.22Å; D576-D584 HydrophobicContact CB-CB 4.22Å; D576-D584 PolarHBondContact N-O 2.88Å; D576-D584 PolarHBondContact O-N 3.15Å; D576-L586 HydrophobicContact CB-CD1 3.89Å; D576-L586 HydrophobicContact CB-CD2 4.29Å; D576-L586 HydrophobicContact CB-CG 4.03Å
577	E	85.8	Confident	85.3	Confident	79 Å²	79	42.4 Å²	42.4	37%	0.369	24%	0.238	S	C	.	.			trans	-107.4	76.8	179.8	-163.4	-179.7	-171.9	0	0	112.8	D530 F532 T546 G579	D530-E577 PolarHBondContact O-N 3.44Å; F532-E577 HydrophobicContact CD1-CB 4.1Å; F532-E577 HydrophobicContact CE1-CB 4.08Å; T546-E577 WeakPolarHBondContact CB-OE2 3.45Å; T546-E577 HydrophobicContact CG2-CB 3.76Å; T546-E577 WeakPolarHBondContact CG2-OE2 3.28Å; T546-E577 PolarHBondContact OG1-OE2 2.85Å; E577-G579 PolarHBondContact O-N 2.9Å
578	D	79.8	Confident	85.5	Confident	42 Å²	42	43.2 Å²	43.2	23%	0.225	24%	0.242	C	C	.	.			trans	-63.7	17.2	176	-75.1	-101.7	0	0	0	116.6	D580 K581	D578-D580 PolarHBondContact O-N 3.39Å; D578-K581 HydrophobicContact CB-CB 3.71Å; D578-K581 HydrophobicContact CB-CD 4Å; D578-K581 HydrophobicContact CB-CG 4.11Å; D578-K581 IonicContact OD1-NZ 2.64Å; D578-K581 PolarHBondContact OD1-NZ 2.86Å
579	G	74.6	Confident	85.7	Confident	62 Å²	62	42.6 Å²	42.6	64%	0.639	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	-100.2	-179.9	0	0	0	0	0	113.7	E577	E577-G579 PolarHBondContact O-N 2.9Å
580	D	68.1	Low	85.8	Confident	179 Å²	179	42.6 Å²	42.6	96%	0.957	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.7	-176.6	-72.8	-44.1	0	0	0	114	D578	D578-D580 PolarHBondContact O-N 3.39Å
581	K	75.9	Confident	85.8	Confident	115 Å²	115	42.7 Å²	42.7	50%	0.5	24%	0.24	S	C	.	.	S	Bend	trans	-85.1	158.9	175.8	-56	-174.1	-150.5	144.6	0	111.3	D578	D578-K581 HydrophobicContact CB-CB 3.71Å; D578-K581 HydrophobicContact CB-CD 4Å; D578-K581 HydrophobicContact CB-CG 4.11Å; D578-K581 IonicContact OD1-NZ 2.64Å; D578-K581 PolarHBondContact OD1-NZ 2.86Å
582	P	76.1	Confident	85.7	Confident	112 Å²	112	43.4 Å²	43.4	73%	0.727	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-57.5	138.9	161.4	27.2	-35.7	0	0	0	110.2	D584	P582-D584 PolarHBondContact O-N 3.34Å
583	P	83	Confident	85.6	Confident	62 Å²	62	43.4 Å²	43.4	40%	0.403	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.9	129.7	-172.5	26.6	-35.7	0	0	0	112.5	F532 F575 D576	F532-P583 HydrophobicContact CE1-CB 3.99Å; F532-P583 HydrophobicContact CZ-CB 3.97Å; F532-P583 HydrophobicContact CZ-CG 4.25Å; F575-P583 HydrophobicContact CB-CB 4.26Å; F575-P583 HydrophobicContact CD1-CB 4.4Å; F575-P583 HydrophobicContact CD1-CG 4.47Å; D576-P583 WeakPolarHBondContact O-CA 3.41Å; D576-P583 WeakPolarHBondContact O-CB 3.22Å
584	D	86.6	Confident	85.3	Confident	85 Å²	85	46.1 Å²	46.1	46%	0.455	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-73.5	151.1	-177.2	-100.3	-15	0	0	0	112.8	A523 F575 D576 P582	A523-D584 HydrophobicContact CB-CB 4.5Å; F575-D584 CarbonylContact C-O 3.57Å; F575-D584 VanDerWaalsContact CA-O 3.28Å; F575-D584 WeakPolarHBondContact CA-O 3.04Å; D576-D584 HydrophobicContact CB-CB 4.22Å; D576-D584 PolarHBondContact N-O 2.88Å; D576-D584 PolarHBondContact O-N 3.15Å; P582-D584 PolarHBondContact O-N 3.34Å
585	F	88.6	Confident	85	Confident	45 Å²	45	48.5 Å²	48.5	20%	0.197	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.6	-170.5	176.7	-90.8	0	0	0	112.1	T573 F575 G587 K588 K609	T573-F585 HydrophobicContact CG2-CD2 4.03Å; T573-F585 HydrophobicContact CG2-CE2 3.68Å; F575-F585 HydrophobicContact CE1-CD2 4.21Å; F585-G587 VanDerWaalsContact CZ-C 3.46Å; F585-K588 HydrophobicContact CE2-CB 3.93Å; F585-K588 HydrophobicContact CZ-CB 3.78Å; F585-K609 HydrophobicContact CE1-CB 4.23Å; F585-K609 HydrophobicContact CE2-CB 4.25Å; F585-K609 HydrophobicContact CZ-CB 4Å
586	L	86.3	Confident	84.7	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-10.4	-179.9	-60.2	179.7	0	0	0	114	L521 A523 P531 V574 D576 F615	L521-L586 HydrophobicContact CB-CD2 4.21Å; A523-L586 HydrophobicContact CB-CD2 4.25Å; P531-L586 HydrophobicContact CB-CD1 3.89Å; V574-L586 HydrophobicContact CB-CB 4.16Å; V574-L586 HydrophobicContact CG1-CB 4.02Å; V574-L586 HydrophobicContact CG1-CD1 4.29Å; V574-L586 PolarHBondContact O-N 3.35Å; D576-L586 HydrophobicContact CB-CD1 3.89Å; D576-L586 HydrophobicContact CB-CD2 4.29Å; D576-L586 HydrophobicContact CB-CG 4.03Å; L586-F615 WeakPolarHBondContact O-CD1 3.34Å; L586-F615 VanDerWaalsContact O-CE1 3.27Å; L586-F615 WeakPolarHBondContact O-CE1 3.25Å
587	G	89.2	Confident	84.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.1	167	170.6	0	0	0	0	0	114.4	T573 V574 F585	T573-G587 CarbonylContact C-O 3.59Å; T573-G587 WeakPolarHBondContact CA-O 3.18Å; T573-G587 WeakPolarHBondContact CG2-O 3.43Å; V574-G587 PolarHBondContact N-O 3.35Å; V574-G587 PolarHBondContact O-N 2.89Å; F585-G587 VanDerWaalsContact CZ-C 3.46Å
588	K	91.3	Very high	83.7	Confident	32 Å²	32	55 Å²	55	14%	0.139	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.5	179.3	-163.5	169.7	179.8	171.2	0	113.2	E571 V572 T573 F585 K607 L611	E571-K588 WeakPolarHBondContact OE2-CE 3.5Å; E571-K588 IonicContact OE2-NZ 3.36Å; E571-K588 PolarHBondContact OE2-NZ 3.24Å; V572-K588 CarbonylContact O-C 3.56Å; V572-K588 WeakPolarHBondContact O-CA 3.42Å; T573-K588 HydrophobicContact CG2-CB 4.14Å; T573-K588 HydrophobicContact CG2-CD 4.15Å; T573-K588 HydrophobicContact CG2-CG 4.06Å; T573-K588 WeakPolarHBondContact OG1-CE 3.33Å; F585-K588 HydrophobicContact CE2-CB 3.93Å; F585-K588 HydrophobicContact CZ-CB 3.78Å; K588-K607 PolarHBondContact N-O 2.7Å; K588-K607 WeakPolarHBondContact O-CA 3.41Å; K588-K607 WeakPolarHBondContact O-CB 3.25Å; K588-K607 PolarHBondContact O-N 2.77Å; K588-L611 HydrophobicContact CB-CD2 3.93Å; K588-L611 HydrophobicContact CD-CD2 4.3Å; K588-L611 HydrophobicContact CG-CD2 3.93Å
589	V	91.8	Very high	83.3	Confident	10 Å²	10	54.8 Å²	54.8	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.8	167	63.3	0	0	0	0	109.8	E571 V572 I591 Y604 I619	E571-V589 CarbonylContact C-O 3.59Å; E571-V589 WeakPolarHBondContact CA-O 3.18Å; V572-V589 HydrophobicContact CB-CG1 3.83Å; V572-V589 HydrophobicContact CG2-CG1 4.43Å; V572-V589 PolarHBondContact N-O 3.37Å; V572-V589 PolarHBondContact O-N 2.97Å; V589-I591 HydrophobicContact CG1-CD1 4.35Å; V589-I591 HydrophobicContact CG2-CD1 4.27Å; V589-I591 HydrophobicContact CG2-CG1 3.84Å; V589-Y604 HydrophobicContact CG2-CD1 4.23Å; V589-Y604 HydrophobicContact CG2-CG 4.28Å; V589-I619 HydrophobicContact CG1-CG2 4.12Å
590	A	91	Very high	83.5	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.033	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	114.8	178	0	0	0	0	0	109.6	V569 L570 E571 L611 Y858	V569-A590 HydrophobicContact CG1-CB 3.87Å; L570-A590 WeakPolarHBondContact O-CA 3.4Å; E571-A590 HydrophobicContact CG-CB 4.03Å; A590-L611 HydrophobicContact CB-CD1 3.62Å; A590-L611 HydrophobicContact CB-CD2 4.26Å; A590-Y858 HydrophobicContact CB-CD1 3.8Å; A590-Y858 HydrophobicContact CB-CE1 4.04Å
591	I	90.2	Very high	84.2	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.015	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	107.9	-168.7	-52.9	175.6	0	0	0	109	L570 V589 I596 Y604 L621 M623	L570-I591 PolarHBondContact N-O 3.49Å; L570-I591 PolarHBondContact O-N 2.96Å; V589-I591 HydrophobicContact CG1-CD1 4.35Å; V589-I591 HydrophobicContact CG2-CD1 4.27Å; V589-I591 HydrophobicContact CG2-CG1 3.84Å; I591-I596 HydrophobicContact CG2-CG1 4.13Å; I591-Y604 HydrophobicContact CD1-CD1 4.13Å; I591-Y604 HydrophobicContact CD1-CD2 3.88Å; I591-Y604 HydrophobicContact CD1-CE1 3.96Å; I591-Y604 HydrophobicContact CD1-CE2 3.68Å; I591-Y604 HydrophobicContact CD1-CG 4.11Å; I591-Y604 HydrophobicContact CG1-CD1 4.43Å; I591-Y604 HydrophobicContact CG1-CE1 4.25Å; I591-L621 HydrophobicContact CD1-CD1 3.8Å; I591-M623 HydrophobicContact CD1-CE 4.02Å; I591-M623 HydrophobicContact CD1-SD 4.37Å; I591-M623 HydrophobicContact CG2-CE 4.34Å
592	P	89.7	Confident	84.8	Confident	30 Å²	30	48.6 Å²	48.6	20%	0.195	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	135.6	174.3	-23	33.8	0	0	0	111.4	V569 L594 S595 Y858	V569-P592 HydrophobicContact CG2-CB 4.43Å; V569-P592 HydrophobicContact CG2-CG 4.43Å; P592-L594 PolarHBondContact O-N 3.47Å; P592-S595 WeakPolarHBondContact CD-OG 3.37Å; P592-S595 PolarHBondContact O-N 3.35Å; P592-S595 PolarHBondContact O-OG 3.46Å; P592-Y858 HydrophobicContact CG-CD1 4.45Å; P592-Y858 HydrophobicContact CG-CD2 3.74Å; P592-Y858 HydrophobicContact CG-CG 3.7Å
593	L	88.3	Confident	85.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-57.8	-39.6	-177.8	-60.3	-177.6	0	0	0	112.1	L510 L537 I563 I566 D568 S595 I596 L625	L510-L593 HydrophobicContact CD1-CD2 4.36Å; L510-L593 HydrophobicContact CD2-CD2 3.69Å; L537-L593 HydrophobicContact CD1-CD1 4.25Å; L537-L593 HydrophobicContact CD1-CD2 3.93Å; L537-L593 HydrophobicContact CD1-CG 4.3Å; I563-L593 HydrophobicContact CD1-CD1 4.34Å; I563-L593 HydrophobicContact CG1-CD1 4.38Å; I563-L593 HydrophobicContact CG2-CD1 3.96Å; I566-L593 HydrophobicContact CD1-CB 4.23Å; I566-L593 HydrophobicContact CD1-CD1 4.47Å; D568-L593 PolarHBondContact O-N 2.9Å; L593-S595 PolarHBondContact O-N 3.09Å; L593-I596 HydrophobicContact CD2-CD1 3.82Å; L593-I596 WeakPolarHBondContact O-CB 3.36Å; L593-I596 WeakPolarHBondContact O-CG1 3.49Å; L593-I596 PolarHBondContact O-N 2.87Å; L593-I596 VanDerWaalsContact O-N 3.12Å; L593-L625 HydrophobicContact CB-CD2 4.3Å; L593-L625 WeakPolarHBondContact O-CD2 3.25Å
594	L	85.6	Confident	85.7	Confident	61 Å²	61	43.1 Å²	43.1	32%	0.319	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-64.7	-4.4	176	-68.9	171.1	0	0	0	115.5	I566 P592 V792 F794	I566-L594 HydrophobicContact CG1-CD2 3.65Å; I566-L594 HydrophobicContact CG1-CG 4.07Å; I566-L594 HydrophobicContact CG2-CD1 4.49Å; I566-L594 HydrophobicContact CG2-CD2 4.29Å; I566-L594 HydrophobicContact CG2-CG 4.5Å; P592-L594 PolarHBondContact O-N 3.47Å; L594-V792 HydrophobicContact CD1-CG1 3.76Å; L594-F794 HydrophobicContact CD1-CB 4.35Å; L594-F794 HydrophobicContact CD2-CB 4.46Å
595	S	84.1	Confident	85.9	Confident	49 Å²	49	40.3 Å²	40.3	34%	0.343	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-104.6	-4.6	174.6	66.5	0	0	0	0	114.2	P592 L593	P592-S595 WeakPolarHBondContact CD-OG 3.37Å; P592-S595 PolarHBondContact O-N 3.35Å; P592-S595 PolarHBondContact O-OG 3.46Å; L593-S595 PolarHBondContact O-N 3.09Å
596	I	84.3	Confident	85.9	Confident	20 Å²	20	38.1 Å²	38.1	10%	0.103	21%	0.21	C	C	.	.			trans	-66.6	145.6	179.8	-66.8	176.8	0	0	0	110.6	L510 I591 L593 M623 L625	L510-I596 HydrophobicContact CD1-CD1 3.61Å; I591-I596 HydrophobicContact CG2-CG1 4.13Å; L593-I596 HydrophobicContact CD2-CD1 3.82Å; L593-I596 WeakPolarHBondContact O-CB 3.36Å; L593-I596 WeakPolarHBondContact O-CG1 3.49Å; L593-I596 PolarHBondContact O-N 2.87Å; L593-I596 VanDerWaalsContact O-N 3.12Å; I596-M623 HydrophobicContact CD1-CB 4.33Å; I596-M623 HydrophobicContact CD1-SD 3.8Å; I596-M623 HydrophobicContact CG1-CE 4.41Å; I596-M623 HydrophobicContact CG1-SD 4.04Å; I596-M623 HydrophobicContact CG2-CB 3.6Å; I596-L625 HydrophobicContact CB-CD2 4.21Å; I596-L625 HydrophobicContact CG2-CB 4.24Å
597	R	76.3	Confident	86.1	Confident	152 Å²	152	38.5 Å²	38.5	57%	0.574	21%	0.212	S	C	*	.			trans	-115.9	120.2	172.3	-57.7	-177.7	-173.6	-159.4	2	108.5	G599	R597-G599 PolarHBondContact O-N 3.09Å
598	D	77.7	Confident	85.9	Confident	91 Å²	91	41.1 Å²	41.1	49%	0.487	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	127.1	-170.3	-58.7	-51.3	0	0	0	112.9	Q600 M623 L625	D598-Q600 VanDerWaalsContact C-N 3.32Å; D598-Q600 PolarHBondContact O-N 2.93Å; D598-M623 CarbonylContact C-O 3.56Å; D598-M623 WeakPolarHBondContact CA-O 3.4Å; D598-L625 WeakPolarHBondContact OD1-CB 3.47Å; D598-L625 PolarHBondContact OD1-N 3.23Å
599	G	70.7	Confident	85.4	Confident	37 Å²	37	46.5 Å²	46.5	38%	0.381	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	14.2	169.1	0	0	0	0	0	116	R597 M623	R597-G599 PolarHBondContact O-N 3.09Å; G599-M623 PolarHBondContact N-O 3.5Å
600	Q	79.4	Confident	84.6	Confident	106 Å²	106	51.1 Å²	51.1	50%	0.495	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.7	174.4	-67	-165.4	-30.9	0	0	111.8	D598 N602	D598-Q600 VanDerWaalsContact C-N 3.32Å; D598-Q600 PolarHBondContact O-N 2.93Å; Q600-N602 PolarHBondContact O-N 3.17Å
601	P	83.1	Confident	84.1	Confident	86 Å²	86	51.5 Å²	51.5	56%	0.558	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	107.2	173.9	30.9	-33	0	0	0	110.2	L515 E622	L515-P601 HydrophobicContact CD1-CB 3.94Å; P601-E622 HydrophobicContact CB-CB 4.48Å
602	N	87.4	Confident	83.4	Confident	33 Å²	33	55.3 Å²	55.3	18%	0.176	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	146.8	179	-68.5	-24.1	0	0	0	110.8	Q600 Y604 Y620 L621	Q600-N602 PolarHBondContact O-N 3.17Å; N602-Y604 HydrophobicContact CB-CD2 4.27Å; N602-Y604 HydrophobicContact CB-CE2 3.42Å; N602-Y604 VanDerWaalsContact CB-CE2 3.42Å; N602-Y604 PolarHBondContact ND2-OH 2.84Å; N602-Y620 WeakPolarHBondContact O-CA 3.44Å; N602-L621 PolarHBondContact N-O 2.93Å; N602-L621 PolarHBondContact O-N 3.47Å
603	C	88.1	Confident	82.7	Confident	48 Å²	48	60.1 Å²	60.1	32%	0.324	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124	174.7	-176	0	0	0	0	109.8	Y620	C603-Y620 HydrophobicContact CB-CD1 3.92Å; C603-Y620 HydrophobicContact CB-CE1 3.71Å
604	Y	89.6	Confident	82.4	Confident	11 Å²	11	63.2 Å²	63.2	4%	0.043	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.8	-177	-65.9	-79.8	0	0	0	111.1	V589 I591 N602 V618 I619 L621 M623 E860	V589-Y604 HydrophobicContact CG2-CD1 4.23Å; V589-Y604 HydrophobicContact CG2-CG 4.28Å; I591-Y604 HydrophobicContact CD1-CD1 4.13Å; I591-Y604 HydrophobicContact CD1-CD2 3.88Å; I591-Y604 HydrophobicContact CD1-CE1 3.96Å; I591-Y604 HydrophobicContact CD1-CE2 3.68Å; I591-Y604 HydrophobicContact CD1-CG 4.11Å; I591-Y604 HydrophobicContact CG1-CD1 4.43Å; I591-Y604 HydrophobicContact CG1-CE1 4.25Å; N602-Y604 HydrophobicContact CB-CD2 4.27Å; N602-Y604 HydrophobicContact CB-CE2 3.42Å; N602-Y604 VanDerWaalsContact CB-CE2 3.42Å; N602-Y604 PolarHBondContact ND2-OH 2.84Å; Y604-V618 CarbonylContact O-C 3.51Å; Y604-V618 VanDerWaalsContact O-CA 3.27Å; Y604-V618 WeakPolarHBondContact O-CA 3.47Å; Y604-I619 PolarHBondContact N-O 2.84Å; Y604-I619 PolarHBondContact O-N 2.87Å; Y604-L621 HydrophobicContact CD2-CB 4.3Å; Y604-L621 HydrophobicContact CD2-CD1 4.05Å; Y604-L621 HydrophobicContact CD2-CG 4.35Å; Y604-L621 HydrophobicContact CE2-CB 4.23Å; Y604-L621 HydrophobicContact CE2-CD1 4.39Å; Y604-M623 HydrophobicContact CE2-CE 3.73Å; Y604-M623 WeakPolarHBondContact OH-CE 3.21Å; Y604-E860 HydrophobicContact CE1-CG 4.36Å; Y604-E860 WeakPolarHBondContact CE1-OE1 3.4Å
605	V	90.8	Very high	82.3	Confident	26 Å²	26	62.9 Å²	62.9	16%	0.158	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.1	172.3	-176.8	0	0	0	0	109.5	V618 L861 L863	V605-V618 HydrophobicContact CG2-CG1 4.23Å; V605-L861 HydrophobicContact CB-CB 4.25Å; V605-L861 HydrophobicContact CG2-CB 4.49Å; V605-L861 WeakPolarHBondContact CG2-O 3.44Å; V605-L863 HydrophobicContact CG2-CD2 4.28Å; V605-L863 HydrophobicContact CG2-CG 4.06Å
606	L	89.9	Confident	82.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	150	176.4	-63.6	176.5	0	0	0	110.8	L520 V574 F615 G617 I619	L520-L606 HydrophobicContact CD2-CD1 3.54Å; V574-L606 HydrophobicContact CG2-CD1 4.02Å; V574-L606 HydrophobicContact CG2-CD2 3.92Å; L606-F615 PolarHBondContact O-N 2.86Å; L606-G617 WeakPolarHBondContact CB-O 3.33Å; L606-G617 PolarHBondContact N-O 2.76Å; L606-I619 HydrophobicContact CD2-CB 4.28Å; L606-I619 HydrophobicContact CD2-CG2 3.9Å
607	K	89.1	Confident	82.4	Confident	8 Å²	8	64.9 Å²	64.9	4%	0.035	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	162.8	177.7	-57.9	-169.9	-174.9	178.7	0	111.3	K588 L611 Q613 V856 Q857 A859 L861	K588-K607 PolarHBondContact N-O 2.7Å; K588-K607 WeakPolarHBondContact O-CA 3.41Å; K588-K607 WeakPolarHBondContact O-CB 3.25Å; K588-K607 PolarHBondContact O-N 2.77Å; K607-L611 HydrophobicContact CB-CD2 4.12Å; K607-L611 HydrophobicContact CD-CB 4.42Å; K607-L611 HydrophobicContact CD-CD2 4.43Å; K607-L611 WeakPolarHBondContact CD-O 3.46Å; K607-Q613 CarbonylContact C-O 3.49Å; K607-Q613 WeakPolarHBondContact CA-O 3.44Å; K607-Q613 VanDerWaalsContact CB-O 3.25Å; K607-Q613 WeakPolarHBondContact CB-O 3.39Å; K607-V856 PolarHBondContact NZ-O 3.34Å; K607-Q857 PolarHBondContact NZ-O 2.98Å; K607-A859 WeakPolarHBondContact CE-O 3.28Å; K607-A859 PolarHBondContact NZ-O 3.48Å; K607-L861 HydrophobicContact CD-CD1 4.42Å; K607-L861 HydrophobicContact CG-CD1 4.25Å
608	N	85	Confident	83.1	Confident	56 Å²	56	58.3 Å²	58.3	30%	0.299	32%	0.315	S	S	.	.			trans	-66.1	168.7	173.8	-159.8	-7.8	0	0	0	110.9	D610 L611 Q613 F615	N608-D610 VanDerWaalsContact C-N 3.25Å; N608-D610 PolarHBondContact O-N 2.89Å; N608-D610 VanDerWaalsContact O-N 3.13Å; N608-L611 WeakPolarHBondContact O-CA 3.32Å; N608-L611 PolarHBondContact O-N 3.36Å; N608-Q613 PolarHBondContact N-O 2.83Å; N608-F615 HydrophobicContact CB-CD2 4.26Å
609	K	81.4	Confident	83.9	Confident	145 Å²	145	54 Å²	54	63%	0.63	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-36.2	-173	-173	169.5	-179.3	169.6	0	114.4	F585 L611	F585-K609 HydrophobicContact CE1-CB 4.23Å; F585-K609 HydrophobicContact CE2-CB 4.25Å; F585-K609 HydrophobicContact CZ-CB 4Å; K609-L611 VanDerWaalsContact C-N 3.29Å; K609-L611 PolarHBondContact O-N 3.19Å
610	D	75.8	Confident	84.9	Confident	107 Å²	107	56 Å²	56	57%	0.572	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.9	177.6	-56.9	-57.1	0	0	0	114.1	N608 E612 Q857	N608-D610 VanDerWaalsContact C-N 3.25Å; N608-D610 PolarHBondContact O-N 2.89Å; N608-D610 VanDerWaalsContact O-N 3.13Å; D610-E612 HydrophobicContact CB-CG 4.19Å; D610-E612 PolarHBondContact O-N 3.46Å; D610-Q857 PolarHBondContact O-NE2 2.85Å
611	L	79.8	Confident	85.5	Confident	11 Å²	11	51 Å²	51	6%	0.058	27%	0.265	C	S	.	.	S	Bend	trans	61.7	12	-177.6	-60.4	165.1	0	0	0	115.5	K588 A590 K607 N608 K609 Q857	K588-L611 HydrophobicContact CB-CD2 3.93Å; K588-L611 HydrophobicContact CD-CD2 4.3Å; K588-L611 HydrophobicContact CG-CD2 3.93Å; A590-L611 HydrophobicContact CB-CD1 3.62Å; A590-L611 HydrophobicContact CB-CD2 4.26Å; K607-L611 HydrophobicContact CB-CD2 4.12Å; K607-L611 HydrophobicContact CD-CB 4.42Å; K607-L611 HydrophobicContact CD-CD2 4.43Å; K607-L611 WeakPolarHBondContact CD-O 3.46Å; N608-L611 WeakPolarHBondContact O-CA 3.32Å; N608-L611 PolarHBondContact O-N 3.36Å; K609-L611 VanDerWaalsContact C-N 3.29Å; K609-L611 PolarHBondContact O-N 3.19Å; L611-Q857 HydrophobicContact CB-CB 3.7Å; L611-Q857 HydrophobicContact CB-CG 3.8Å; L611-Q857 HydrophobicContact CD1-CB 4.18Å
612	E	74.6	Confident	85.8	Confident	84 Å²	84	48.4 Å²	48.4	39%	0.393	25%	0.246	S	C	.	.	S	Bend	trans	-86.3	-29.6	-177.5	-56.1	-165.1	170.3	0	0	114.1	D610 R658	D610-E612 HydrophobicContact CB-CG 4.19Å; D610-E612 PolarHBondContact O-N 3.46Å; E612-R658 IonicContact OE1-CZ 3.23Å; E612-R658 IonicContact OE1-NH1 2.7Å; E612-R658 PolarHBondContact OE1-NH1 3.45Å; E612-R658 IonicContact OE1-NH2 3.78Å; E612-R658 PolarHBondContact OE1-NH2 3.18Å; E612-R658 VanDerWaalsContact OE1-NH2 3.08Å; E612-R658 IonicContact OE2-NH1 3.71Å; E612-R658 PolarHBondContact OE2-NH1 3.45Å
613	Q	76.8	Confident	85.9	Confident	131 Å²	131	47 Å²	47	61%	0.612	24%	0.238	S	C	*	.	S	Bend	trans	-124.7	149.7	-174.4	-68.9	179.9	-19.2	0	0	111.7	K607 N608	K607-Q613 CarbonylContact C-O 3.49Å; K607-Q613 WeakPolarHBondContact CA-O 3.44Å; K607-Q613 VanDerWaalsContact CB-O 3.25Å; K607-Q613 WeakPolarHBondContact CB-O 3.39Å; N608-Q613 PolarHBondContact N-O 2.83Å
614	A	81.1	Confident	85.8	Confident	65 Å²	65	45.2 Å²	45.2	54%	0.537	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	145.6	169.2	0	0	0	0	0	111	L861	A614-L861 HydrophobicContact CB-CD1 3.83Å
615	F	83.1	Confident	85.8	Confident	54 Å²	54	45.5 Å²	45.5	24%	0.237	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	169.8	172.1	-156.7	-101.4	0	0	0	109.3	L521 L586 L606 N608 G617	L521-F615 HydrophobicContact CB-CE1 4.1Å; L521-F615 HydrophobicContact CD2-CE1 4.08Å; L521-F615 HydrophobicContact CD2-CZ 3.93Å; L586-F615 WeakPolarHBondContact O-CD1 3.34Å; L586-F615 VanDerWaalsContact O-CE1 3.27Å; L586-F615 WeakPolarHBondContact O-CE1 3.25Å; L606-F615 PolarHBondContact O-N 2.86Å; N608-F615 HydrophobicContact CB-CD2 4.26Å; F615-G617 PolarHBondContact O-N 3.24Å
616	K	83.7	Confident	85.5	Confident	102 Å²	102	45.2 Å²	45.2	44%	0.443	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	120.8	-177.2	-161.1	-152.7	167.8	-152.1	0	110.7	D519 L520 L521	D519-K616 WeakPolarHBondContact O-CD 3.4Å; D519-K616 WeakPolarHBondContact O-CE 3.47Å; D519-K616 WeakPolarHBondContact O-CG 3.38Å; D519-K616 PolarHBondContact O-NZ 3.45Å; L520-K616 PolarHBondContact O-NZ 2.74Å; L521-K616 HydrophobicContact CD1-CB 4.43Å; L521-K616 HydrophobicContact CD1-CD 4.32Å
617	G	86.4	Confident	85.4	Confident	9 Å²	9	48.7 Å²	48.7	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.9	165.5	172.8	0	0	0	0	0	114.5	A518 D519 L606 F615	A518-G617 CarbonylContact O-C 3.48Å; A518-G617 VanDerWaalsContact O-CA 3.23Å; A518-G617 WeakPolarHBondContact O-CA 3.47Å; D519-G617 VanDerWaalsContact O-CA 3.32Å; D519-G617 WeakPolarHBondContact O-CA 3.46Å; D519-G617 PolarHBondContact O-N 2.68Å; L606-G617 WeakPolarHBondContact CB-O 3.33Å; L606-G617 PolarHBondContact N-O 2.76Å; F615-G617 PolarHBondContact O-N 3.24Å
618	V	92.6	Very high	85.3	Confident	15 Å²	15	48.3 Å²	48.3	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.1	-179.2	-60	0	0	0	0	111.2	A517 A518 Y604 V605 Y620 L863	A517-V618 CarbonylContact C-O 3.46Å; A517-V618 WeakPolarHBondContact CA-O 3.13Å; A517-V618 VanDerWaalsContact CB-O 3.31Å; A517-V618 WeakPolarHBondContact CB-O 3.33Å; A518-V618 HydrophobicContact CB-CG2 3.93Å; A518-V618 PolarHBondContact N-O 3.03Å; A518-V618 PolarHBondContact O-N 2.81Å; Y604-V618 CarbonylContact O-C 3.51Å; Y604-V618 VanDerWaalsContact O-CA 3.27Å; Y604-V618 WeakPolarHBondContact O-CA 3.47Å; V605-V618 HydrophobicContact CG2-CG1 4.23Å; V618-Y620 HydrophobicContact CG2-CE2 3.79Å; V618-L863 HydrophobicContact CG1-CD2 4.12Å
619	I	92.7	Very high	85.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.5	176.8	-169	172.3	0	0	0	111.5	C533 V572 V574 V589 Y604 L606 L621	C533-I619 VanDerWaalsContact SG-CD1 3.56Å; V572-I619 HydrophobicContact CG1-CD1 3.85Å; V574-I619 HydrophobicContact CG2-CD1 4.32Å; V589-I619 HydrophobicContact CG1-CG2 4.12Å; Y604-I619 PolarHBondContact N-O 2.84Å; Y604-I619 PolarHBondContact O-N 2.87Å; L606-I619 HydrophobicContact CD2-CB 4.28Å; L606-I619 HydrophobicContact CD2-CG2 3.9Å; I619-L621 HydrophobicContact CD1-CD2 3.95Å; I619-L621 HydrophobicContact CD1-CG 4.44Å; I619-L621 HydrophobicContact CG1-CD2 4Å; I619-L621 HydrophobicContact CG1-CG 4.19Å; I619-L621 HydrophobicContact CG2-CD1 4.39Å; I619-L621 HydrophobicContact CG2-CG 4.47Å
620	Y	92.3	Very high	85.4	Confident	79 Å²	79	44.3 Å²	44.3	31%	0.31	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.2	-178.8	-66.2	-96.5	0	0	0	110	L515 K516 A518 N602 C603 V618	L515-Y620 WeakPolarHBondContact CB-O 3.39Å; L515-Y620 PolarHBondContact N-O 2.85Å; L515-Y620 VanDerWaalsContact N-O 3.12Å; K516-Y620 HydrophobicContact CG-CD2 3.74Å; K516-Y620 HydrophobicContact CG-CG 4.12Å; K516-Y620 PolarHBondContact O-N 2.89Å; A518-Y620 HydrophobicContact CB-CE2 4.28Å; N602-Y620 WeakPolarHBondContact O-CA 3.44Å; C603-Y620 HydrophobicContact CB-CD1 3.92Å; C603-Y620 HydrophobicContact CB-CE1 3.71Å; V618-Y620 HydrophobicContact CG2-CE2 3.79Å
621	L	91.5	Very high	85.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.9	-174.7	-59	176.3	0	0	0	110.1	K513 V514 V572 I591 N602 Y604 I619 M623	K513-L621 WeakPolarHBondContact O-CA 3.2Å; V514-L621 HydrophobicContact CB-CD2 4.27Å; V514-L621 HydrophobicContact CG1-CD2 4.23Å; V514-L621 HydrophobicContact CG2-CD2 3.96Å; V572-L621 HydrophobicContact CG2-CD1 4.02Å; I591-L621 HydrophobicContact CD1-CD1 3.8Å; N602-L621 PolarHBondContact N-O 2.93Å; N602-L621 PolarHBondContact O-N 3.47Å; Y604-L621 HydrophobicContact CD2-CB 4.3Å; Y604-L621 HydrophobicContact CD2-CD1 4.05Å; Y604-L621 HydrophobicContact CD2-CG 4.35Å; Y604-L621 HydrophobicContact CE2-CB 4.23Å; Y604-L621 HydrophobicContact CE2-CD1 4.39Å; I619-L621 HydrophobicContact CD1-CD2 3.95Å; I619-L621 HydrophobicContact CD1-CG 4.44Å; I619-L621 HydrophobicContact CG1-CD2 4Å; I619-L621 HydrophobicContact CG1-CG 4.19Å; I619-L621 HydrophobicContact CG2-CD1 4.39Å; I619-L621 HydrophobicContact CG2-CG 4.47Å; L621-M623 HydrophobicContact CB-CE 4.25Å
622	E	90.2	Very high	86	Confident	33 Å²	33	38.9 Å²	38.9	15%	0.154	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.9	166.4	-164.7	-155.3	136.6	0	0	108.5	K513 P601	K513-E622 HydrophobicContact CB-CB 4.14Å; K513-E622 HydrophobicContact CD-CB 4.45Å; K513-E622 WeakPolarHBondContact CD-OE2 3.34Å; K513-E622 VanDerWaalsContact CE-OE1 3.24Å; K513-E622 WeakPolarHBondContact CE-OE1 3.39Å; K513-E622 WeakPolarHBondContact CE-OE2 3.37Å; K513-E622 HydrophobicContact CG-CB 4.32Å; K513-E622 PolarHBondContact N-O 2.88Å; K513-E622 IonicContact NZ-OE1 2.64Å; K513-E622 PolarHBondContact NZ-OE1 2.82Å; K513-E622 IonicContact NZ-OE2 3.81Å; K513-E622 PolarHBondContact NZ-OE2 2.85Å; K513-E622 PolarHBondContact O-N 2.85Å; P601-E622 HydrophobicContact CB-CB 4.48Å
623	M	89.9	Confident	86.5	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.2	-176.3	-70.6	170.3	-74.3	0	0	111.4	Q511 V512 L570 I591 I596 D598 G599 Y604 L621	Q511-M623 VanDerWaalsContact O-CA 3.29Å; Q511-M623 WeakPolarHBondContact O-CA 3.32Å; V512-M623 HydrophobicContact CB-CG 4.41Å; V512-M623 HydrophobicContact CG1-CG 4.04Å; V512-M623 HydrophobicContact CG2-CG 4.26Å; L570-M623 HydrophobicContact CD2-SD 3.9Å; I591-M623 HydrophobicContact CD1-CE 4.02Å; I591-M623 HydrophobicContact CD1-SD 4.37Å; I591-M623 HydrophobicContact CG2-CE 4.34Å; I596-M623 HydrophobicContact CD1-CB 4.33Å; I596-M623 HydrophobicContact CD1-SD 3.8Å; I596-M623 HydrophobicContact CG1-CE 4.41Å; I596-M623 HydrophobicContact CG1-SD 4.04Å; I596-M623 HydrophobicContact CG2-CB 3.6Å; D598-M623 CarbonylContact C-O 3.56Å; D598-M623 WeakPolarHBondContact CA-O 3.4Å; G599-M623 PolarHBondContact N-O 3.5Å; Y604-M623 HydrophobicContact CE2-CE 3.73Å; Y604-M623 WeakPolarHBondContact OH-CE 3.21Å; L621-M623 HydrophobicContact CB-CE 4.25Å
624	D	86.4	Confident	86.9	Confident	10 Å²	10	33.9 Å²	33.9	5%	0.053	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	123.7	-179.9	-162.5	-22.4	0	0	0	108.9	L482 R488 Q511	L482-D624 HydrophobicContact CD2-CB 3.96Å; R488-D624 IonicContact CZ-OD1 2.68Å; R488-D624 IonicContact CZ-OD2 3.12Å; R488-D624 IonicContact NH1-OD1 3.44Å; R488-D624 IonicContact NH1-OD2 2.74Å; R488-D624 PolarHBondContact NH1-OD2 3.37Å; R488-D624 VanDerWaalsContact NH2-CG 3.29Å; R488-D624 IonicContact NH2-OD1 3.77Å; R488-D624 PolarHBondContact NH2-OD1 3.49Å; R488-D624 IonicContact NH2-OD2 3.4Å; R488-D624 PolarHBondContact NH2-OD2 3.1Å; Q511-D624 HydrophobicContact CB-CB 4.47Å; Q511-D624 PolarHBondContact N-O 2.9Å; Q511-D624 PolarHBondContact O-N 2.9Å
625	L	88.3	Confident	87	Confident	18 Å²	18	32.5 Å²	32.5	9%	0.094	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	104.7	-162.9	169.1	55.4	0	0	0	111.2	L510 I563 I566 L593 I596 D598 Y627	L510-L625 HydrophobicContact CD1-CB 4.36Å; I563-L625 HydrophobicContact CD1-CD1 3.16Å; I566-L625 HydrophobicContact CD1-CD1 3.95Å; I566-L625 HydrophobicContact CD1-CD2 4.26Å; L593-L625 HydrophobicContact CB-CD2 4.3Å; L593-L625 WeakPolarHBondContact O-CD2 3.25Å; I596-L625 HydrophobicContact CB-CD2 4.21Å; I596-L625 HydrophobicContact CG2-CB 4.24Å; D598-L625 WeakPolarHBondContact OD1-CB 3.47Å; D598-L625 PolarHBondContact OD1-N 3.23Å; L625-Y627 HydrophobicContact CD1-CD1 4.1Å; L625-Y627 HydrophobicContact CD2-CD1 4.47Å; L625-Y627 HydrophobicContact CG-CD1 3.96Å; L625-Y627 HydrophobicContact CG-CE1 4.4Å
626	I	85.7	Confident	87.1	Confident	19 Å²	19	29.9 Å²	29.9	10%	0.097	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.3	178.5	-55.2	179.2	0	0	0	109.7	L482 R488 I491 Y495 G508 I509	L482-I626 HydrophobicContact CD2-CD1 3.74Å; L482-I626 HydrophobicContact CD2-CG1 4.26Å; L482-I626 HydrophobicContact CG-CD1 4.34Å; R488-I626 HydrophobicContact CG-CD1 4.23Å; I491-I626 HydrophobicContact CG2-CB 4.42Å; I491-I626 HydrophobicContact CG2-CD1 4Å; I491-I626 HydrophobicContact CG2-CG2 4.21Å; Y495-I626 HydrophobicContact CD2-CG2 4.13Å; G508-I626 CarbonylContact C-O 3.57Å; G508-I626 WeakPolarHBondContact CA-O 3.17Å; I509-I626 HydrophobicContact CG2-CB 4.06Å; I509-I626 PolarHBondContact N-O 2.91Å; I509-I626 PolarHBondContact O-N 2.95Å
627	Y	87.9	Confident	87	Confident	73 Å²	73	27.6 Å²	27.6	29%	0.286	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	159.8	179.5	74.1	-77.4	0	0	0	112.9	I566 L625 P629 A632	I566-Y627 HydrophobicContact CD1-CD1 3.79Å; I566-Y627 HydrophobicContact CD1-CD2 3.85Å; I566-Y627 HydrophobicContact CD1-CE1 4.15Å; I566-Y627 HydrophobicContact CD1-CE2 4.21Å; I566-Y627 HydrophobicContact CD1-CG 3.63Å; I566-Y627 HydrophobicContact CG1-CD2 3.98Å; I566-Y627 HydrophobicContact CG1-CE2 3.96Å; I566-Y627 HydrophobicContact CG1-CG 4.27Å; L625-Y627 HydrophobicContact CD1-CD1 4.1Å; L625-Y627 HydrophobicContact CD2-CD1 4.47Å; L625-Y627 HydrophobicContact CG-CD1 3.96Å; L625-Y627 HydrophobicContact CG-CE1 4.4Å; Y627-P629 HydrophobicContact CE2-CB 4.17Å; Y627-A632 HydrophobicContact CD2-CB 4.18Å; Y627-A632 HydrophobicContact CE2-CB 4.42Å
628	N	86.8	Confident	86.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.			trans	-94.3	115.7	172.7	-174.1	-66.9	0	0	0	110	Y495 C496 S500 V507 V630 K631 A632	Y495-N628 VanDerWaalsContact O-CB 3.29Å; Y495-N628 WeakPolarHBondContact O-CB 3.22Å; Y495-N628 PolarHBondContact O-ND2 2.58Å; C496-N628 PolarHBondContact O-ND2 3.12Å; C496-N628 VanDerWaalsContact O-ND2 3.12Å; S500-N628 VanDerWaalsContact OG-CG 3.29Å; S500-N628 PolarHBondContact OG-ND2 3.22Å; S500-N628 PolarHBondContact OG-OD1 2.83Å; V507-N628 PolarHBondContact O-N 3.28Å; N628-V630 VanDerWaalsContact C-N 3.34Å; N628-V630 PolarHBondContact O-N 2.91Å; N628-V630 WeakPolarHBondContact OD1-CB 3.41Å; N628-V630 PolarHBondContact OD1-N 2.83Å; N628-V630 VanDerWaalsContact OD1-N 3.11Å; N628-K631 HydrophobicContact CB-CB 4.01Å; N628-K631 HydrophobicContact CB-CD 4.08Å; N628-K631 HydrophobicContact CB-CG 3.93Å; N628-K631 PolarHBondContact O-N 2.97Å; N628-K631 PolarHBondContact OD1-N 2.7Å; N628-A632 PolarHBondContact O-N 3.39Å
629	P	84.6	Confident	85.8	Confident	55 Å²	55	32 Å²	32	36%	0.357	17%	0.166	S	C	.	.	H	α-helix	trans	-67	-33.3	-174.9	25.7	-34.2	0	0	0	112.6	L497 Y627 A632 S633 F794	L497-P629 HydrophobicContact CD2-CG 3.94Å; Y627-P629 HydrophobicContact CE2-CB 4.17Å; P629-A632 PolarHBondContact O-N 2.83Å; P629-S633 PolarHBondContact O-N 2.98Å; P629-S633 PolarHBondContact O-OG 2.89Å; P629-S633 VanDerWaalsContact O-OG 3.08Å; P629-F794 HydrophobicContact CB-CE2 4.36Å
630	V	83.6	Confident	84.8	Confident	63 Å²	63	35.6 Å²	35.6	38%	0.382	18%	0.18	S	C	.	.	H	α-helix	trans	-68.6	-41.9	178.3	177.6	0	0	0	0	111.1	L497 N628 A632 S633 I634	L497-V630 HydrophobicContact CD2-CG2 3.81Å; N628-V630 VanDerWaalsContact C-N 3.34Å; N628-V630 PolarHBondContact O-N 2.91Å; N628-V630 WeakPolarHBondContact OD1-CB 3.41Å; N628-V630 PolarHBondContact OD1-N 2.83Å; N628-V630 VanDerWaalsContact OD1-N 3.11Å; V630-A632 VanDerWaalsContact C-N 3.34Å; V630-S633 PolarHBondContact O-N 3.4Å; V630-I634 HydrophobicContact CG1-CD1 4.07Å; V630-I634 WeakPolarHBondContact O-CG1 3.35Å; V630-I634 PolarHBondContact O-N 3.22Å; V630-I634 VanDerWaalsContact O-N 3.08Å
631	K	83.9	Confident	83.8	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.017	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-45.1	171.8	-70.3	-168.6	179.5	-166.9	0	111.2	S500 K502 D503 D506 V507 N628 S633 I634 R635	S500-K631 WeakPolarHBondContact O-CE 3.4Å; S500-K631 WeakPolarHBondContact O-CG 3.35Å; K502-K631 VanDerWaalsContact O-CE 3.25Å; K502-K631 WeakPolarHBondContact O-CE 3.29Å; K502-K631 PolarHBondContact O-NZ 2.83Å; D503-K631 PolarHBondContact O-NZ 2.82Å; D506-K631 WeakPolarHBondContact O-CD 3.3Å; D506-K631 PolarHBondContact O-NZ 3.08Å; V507-K631 HydrophobicContact CG1-CB 4.33Å; N628-K631 HydrophobicContact CB-CB 4.01Å; N628-K631 HydrophobicContact CB-CD 4.08Å; N628-K631 HydrophobicContact CB-CG 3.93Å; N628-K631 PolarHBondContact O-N 2.97Å; N628-K631 PolarHBondContact OD1-N 2.7Å; K631-S633 PolarHBondContact O-N 3.4Å; K631-I634 PolarHBondContact O-N 2.97Å; K631-R635 WeakPolarHBondContact O-CB 3.35Å; K631-R635 PolarHBondContact O-N 3.39Å
632	A	85	Confident	82.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-44.2	178.3	0	0	0	0	0	112.2	V507 I566 Y627 N628 P629 V630 I634 R635 T636 F794	V507-A632 HydrophobicContact CG1-CB 3.73Å; I566-A632 HydrophobicContact CB-CB 4.14Å; I566-A632 HydrophobicContact CG2-CB 3.76Å; Y627-A632 HydrophobicContact CD2-CB 4.18Å; Y627-A632 HydrophobicContact CE2-CB 4.42Å; N628-A632 PolarHBondContact O-N 3.39Å; P629-A632 PolarHBondContact O-N 2.83Å; V630-A632 VanDerWaalsContact C-N 3.34Å; A632-I634 VanDerWaalsContact C-N 3.35Å; A632-I634 PolarHBondContact O-N 3.07Å; A632-R635 PolarHBondContact O-N 3.43Å; A632-T636 PolarHBondContact O-N 2.87Å; A632-T636 VanDerWaalsContact O-N 3.09Å; A632-T636 PolarHBondContact O-OG1 3.16Å; A632-F794 HydrophobicContact CB-CE1 4.46Å; A632-F794 HydrophobicContact CB-CZ 3.94Å
633	S	85.1	Confident	81.2	Confident	28 Å²	28	44.9 Å²	44.9	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-41.7	174.9	-62.1	0	0	0	0	112.3	P629 V630 K631 T636 F637 F794	P629-S633 PolarHBondContact O-N 2.98Å; P629-S633 PolarHBondContact O-OG 2.89Å; P629-S633 VanDerWaalsContact O-OG 3.08Å; V630-S633 PolarHBondContact O-N 3.4Å; K631-S633 PolarHBondContact O-N 3.4Å; S633-T636 VanDerWaalsContact O-CB 3.25Å; S633-T636 WeakPolarHBondContact O-CB 3.19Å; S633-T636 PolarHBondContact O-N 3.18Å; S633-T636 PolarHBondContact O-OG1 3.31Å; S633-F637 VanDerWaalsContact O-CD2 3.32Å; S633-F637 WeakPolarHBondContact O-CD2 3.26Å; S633-F637 VanDerWaalsContact O-CE2 3.23Å; S633-F637 WeakPolarHBondContact O-CE2 3.47Å; S633-F794 WeakPolarHBondContact OG-CZ 3.34Å
634	I	84.9	Confident	79.4	Confident	82 Å²	82	48.1 Å²	48.1	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-71.4	-40.7	178.5	-64.1	165.4	0	0	0	111.2	M504 V630 K631 A632 T636 F637	M504-I634 HydrophobicContact CE-CB 3.8Å; M504-I634 HydrophobicContact CE-CD1 3.81Å; M504-I634 HydrophobicContact CE-CG1 4.42Å; M504-I634 HydrophobicContact CE-CG2 3.58Å; V630-I634 HydrophobicContact CG1-CD1 4.07Å; V630-I634 WeakPolarHBondContact O-CG1 3.35Å; V630-I634 PolarHBondContact O-N 3.22Å; V630-I634 VanDerWaalsContact O-N 3.08Å; K631-I634 PolarHBondContact O-N 2.97Å; A632-I634 VanDerWaalsContact C-N 3.35Å; A632-I634 PolarHBondContact O-N 3.07Å; I634-T636 PolarHBondContact O-N 3.14Å; I634-F637 PolarHBondContact O-N 3.29Å
635	R	83.3	Confident	77.7	Confident	35 Å²	35	51.2 Å²	51.2	13%	0.132	25%	0.252	C	S	.	.	H	α-helix	trans	-57.3	-30.7	175.2	-170.5	70.2	168.1	120.1	-5.5	112.3	V507 K564 K631 A632 F637 T638 E641 R848	V507-R635 HydrophobicContact CG2-CB 4.21Å; V507-R635 HydrophobicContact CG2-CG 4.15Å; K564-R635 WeakPolarHBondContact O-CG 3.28Å; K564-R635 PolarHBondContact O-NE 2.85Å; K631-R635 WeakPolarHBondContact O-CB 3.35Å; K631-R635 PolarHBondContact O-N 3.39Å; A632-R635 PolarHBondContact O-N 3.43Å; R635-F637 PolarHBondContact O-N 3.43Å; R635-F637 VanDerWaalsContact O-N 3.09Å; R635-T638 WeakPolarHBondContact CD-OG1 3.45Å; R635-T638 PolarHBondContact NH1-OG1 2.87Å; R635-T638 PolarHBondContact O-N 3.18Å; R635-T638 PolarHBondContact O-OG1 3.48Å; R635-E641 IonicContact CZ-OE1 3.38Å; R635-E641 IonicContact NH2-OE1 2.83Å; R635-E641 PolarHBondContact NH2-OE1 3.18Å; R635-R848 PolarHBondContact O-NH2 3.29Å
636	T	84	Confident	75.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.9	-180	-54.7	0	0	0	0	113.8	H567 A632 S633 I634 L795 L798 D844 F845 R848	H567-T636 PolarHBondContact CE1-OG1 2.83Å; H567-T636 VanDerWaalsContact CE1-OG1 3.31Å; A632-T636 PolarHBondContact O-N 2.87Å; A632-T636 VanDerWaalsContact O-N 3.09Å; A632-T636 PolarHBondContact O-OG1 3.16Å; S633-T636 VanDerWaalsContact O-CB 3.25Å; S633-T636 WeakPolarHBondContact O-CB 3.19Å; S633-T636 PolarHBondContact O-N 3.18Å; S633-T636 PolarHBondContact O-OG1 3.31Å; I634-T636 PolarHBondContact O-N 3.14Å; T636-L795 HydrophobicContact CG2-CD2 3.54Å; T636-L798 HydrophobicContact CG2-CD2 4.15Å; T636-D844 CarbonylContact O-C 3.53Å; T636-F845 HydrophobicContact CG2-CB 4.49Å; T636-F845 HydrophobicContact CG2-CD2 3.57Å; T636-F845 HydrophobicContact CG2-CE2 4.19Å; T636-F845 HydrophobicContact CG2-CG 4.36Å; T636-F845 PolarHBondContact O-N 3.38Å; T636-R848 PolarHBondContact O-NH1 2.89Å
637	F	81.5	Confident	73.8	Confident	54 Å²	54	62.9 Å²	62.9	24%	0.237	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	4.1	179	-55.6	-73.3	0	0	0	114.2	S633 I634 R635 L798 I802 N839 E841 F845	S633-F637 VanDerWaalsContact O-CD2 3.32Å; S633-F637 WeakPolarHBondContact O-CD2 3.26Å; S633-F637 VanDerWaalsContact O-CE2 3.23Å; S633-F637 WeakPolarHBondContact O-CE2 3.47Å; I634-F637 PolarHBondContact O-N 3.29Å; R635-F637 PolarHBondContact O-N 3.43Å; R635-F637 VanDerWaalsContact O-N 3.09Å; F637-L798 HydrophobicContact CE2-CD2 3.97Å; F637-L798 HydrophobicContact CE2-CG 4.41Å; F637-L798 HydrophobicContact CZ-CD2 3.99Å; F637-L798 HydrophobicContact CZ-CG 4.22Å; F637-I802 HydrophobicContact CE1-CD1 4.07Å; F637-I802 HydrophobicContact CE2-CD1 3.82Å; F637-I802 HydrophobicContact CZ-CD1 3.26Å; F637-N839 PolarHBondContact O-ND2 3.36Å; F637-E841 HydrophobicContact CB-CB 4.41Å; F637-E841 HydrophobicContact CB-CG 4.45Å; F637-E841 HydrophobicContact CD1-CB 4.33Å; F637-F845 HydrophobicContact CD1-CB 4.24Å; F637-F845 HydrophobicContact CE1-CB 3.94Å; F637-F845 AromaticContact CE1-CD2 3.65Å; F637-F845 HydrophobicContact CE1-CD2 3.65Å; F637-F845 HydrophobicContact CE1-CG 4.14Å; F637-F845 AromaticContact CZ-CD2 3.84Å; F637-F845 HydrophobicContact CZ-CD2 3.84Å; F637-F845 HydrophobicContact CZ-CE2 4.48Å
638	T	78.8	Confident	71.9	Confident	46 Å²	46	64.8 Å²	64.8	28%	0.282	33%	0.334	S	S	.	.	S	Bend	trans	-97.3	150.4	173.4	66.4	0	0	0	0	110.2	R635 R640 R848	R635-T638 WeakPolarHBondContact CD-OG1 3.45Å; R635-T638 PolarHBondContact NH1-OG1 2.87Å; R635-T638 PolarHBondContact O-N 3.18Å; R635-T638 PolarHBondContact O-OG1 3.48Å; T638-R640 PolarHBondContact O-N 3.02Å; T638-R848 VanDerWaalsContact O-CZ 3.23Å; T638-R848 PolarHBondContact O-NH1 3.42Å; T638-R848 PolarHBondContact O-NH2 3.31Å
639	P	76.1	Confident	70.6	Confident	69 Å²	69	72.3 Å²	72.3	45%	0.448	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-57.7	139.4	178.7	22.6	-33.6	0	0	0	111.9	D844	P639-D844 WeakPolarHBondContact CA-OD1 3.1Å
640	R	72.1	Confident	69.5	Low	77 Å²	77	78.7 Å²	78.7	29%	0.291	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-71.8	139	176.6	-167.3	-179.7	-169.8	154.6	6.8	109.8	H567 D568 T638 K642	H567-R640 PolarHBondContact O-NH2 3.17Å; D568-R640 IonicContact OD1-CZ 2.66Å; D568-R640 IonicContact OD1-NE 2.75Å; D568-R640 PolarHBondContact OD1-NE 3.41Å; D568-R640 IonicContact OD1-NH2 3.19Å; D568-R640 PolarHBondContact OD1-NH2 2.96Å; T638-R640 PolarHBondContact O-N 3.02Å; R640-K642 PolarHBondContact O-N 3.43Å
641	E	69.8	Low	68.5	Low	55 Å²	55	78.8 Å²	78.8	26%	0.257	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-62.5	132.8	172	-81.3	162.6	-119.5	0	0	110.5	K564 R635	K564-E641 WeakPolarHBondContact CD-OE1 3.44Å; K564-E641 WeakPolarHBondContact CD-OE2 3.31Å; K564-E641 IonicContact NZ-OE2 2.73Å; K564-E641 PolarHBondContact NZ-OE2 3.16Å; R635-E641 IonicContact CZ-OE1 3.38Å; R635-E641 IonicContact NH2-OE1 2.83Å; R635-E641 PolarHBondContact NH2-OE1 3.18Å
642	K	66.3	Low	67.8	Low	151 Å²	151	80.6 Å²	80.6	66%	0.657	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-73.8	148	173.4	-72.6	-166.5	164.1	-145.1	0	110.5	N539 R640	N539-K642 PolarHBondContact ND2-O 2.77Å; R640-K642 PolarHBondContact O-N 3.43Å
643	R	61.8	Low	67.3	Low	101 Å²	101	89.7 Å²	89.7	38%	0.381	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-72.4	138.8	173.9	-71.7	-167.3	171.8	174.9	0.5	110.8	G538 N539 E571 V645	G538-R643 PolarHBondContact O-NE 2.73Å; N539-R643 VanDerWaalsContact OD1-CA 3.25Å; N539-R643 WeakPolarHBondContact OD1-CA 3.37Å; E571-R643 IonicContact OE1-CZ 3.64Å; E571-R643 IonicContact OE1-NH1 3.66Å; E571-R643 PolarHBondContact OE1-NH1 2.9Å; E571-R643 IonicContact OE1-NH2 2.77Å; E571-R643 PolarHBondContact OE1-NH2 3.05Å; E571-R643 IonicContact OE2-NH1 2.65Å; R643-V645 VanDerWaalsContact C-N 3.26Å; R643-V645 PolarHBondContact O-N 2.69Å
644	F	52.6	Low	67	Low	71 Å²	71	96.3 Å²	96.3	31%	0.311	46%	0.461	S	S	.	.	S	Bend	trans	-70.5	-21.3	-176	-56.1	-18	0	0	0	113.5	Y386 D404 N539	Y386-F644 AromaticContact CE1-CD1 3.5Å; Y386-F644 HydrophobicContact CE1-CD1 3.5Å; Y386-F644 AromaticContact CE1-CE1 3.75Å; Y386-F644 HydrophobicContact CE1-CE1 3.75Å; Y386-F644 HydrophobicContact CE1-CG 4.08Å; Y386-F644 HydrophobicContact CE1-CZ 4.48Å; Y386-F644 AromaticContact CZ-CD1 3.86Å; Y386-F644 AromaticContact CZ-CE1 3.85Å; Y386-F644 WeakPolarHBondContact OH-CD1 3.23Å; Y386-F644 WeakPolarHBondContact OH-CE1 3.44Å; Y386-F644 WeakPolarHBondContact OH-CE2 3.39Å; Y386-F644 WeakPolarHBondContact OH-CZ 3.43Å; D404-F644 WeakPolarHBondContact O-CZ 3.3Å; N539-F644 HydrophobicContact CB-CD1 4.27Å; N539-F644 HydrophobicContact CB-CD2 3.93Å; N539-F644 HydrophobicContact CB-CE1 3.91Å; N539-F644 HydrophobicContact CB-CE2 3.55Å; N539-F644 HydrophobicContact CB-CG 4.29Å; N539-F644 HydrophobicContact CB-CZ 3.54Å; N539-F644 VanDerWaalsContact CG-CZ 3.48Å; N539-F644 WeakPolarHBondContact ND2-CE1 3.45Å; N539-F644 WeakPolarHBondContact OD1-CD1 3.43Å; N539-F644 WeakPolarHBondContact OD1-CG 3.41Å; N539-F644 PolarHBondContact OD1-N 2.87Å
645	V	49.1	Very low	66.6	Low	75 Å²	75	94.8 Å²	94.8	46%	0.455	45%	0.453	S	S	.	.			trans	-120	97.8	173.2	-176.2	0	0	0	0	108.3	R643	R643-V645 VanDerWaalsContact C-N 3.26Å; R643-V645 PolarHBondContact O-N 2.69Å
646	E	44.5	Very low	66.5	Low	153 Å²	153	95.4 Å²	95.4	72%	0.715	46%	0.458	S	S	*	.			trans	-98.2	83.5	174.1	-171.1	155.7	-125.1	0	0	108.4	S648	E646-S648 PolarHBondContact O-N 3.22Å
647	D	47.7	Very low	66.4	Low	129 Å²	129	98.5 Å²	98.5	69%	0.69	48%	0.48	S	S	*	.			trans	-56.2	118.7	176.5	-84.3	-16	0	0	0	109.9	R649	D647-R649 PolarHBondContact O-N 3.03Å
648	S	49.4	Very low	66.5	Low	112 Å²	112	100 Å²	100	78%	0.783	48%	0.484	S	S	*	.			trans	-66.5	103.5	179.3	49.2	0	0	0	0	110.2	E646 K650	E646-S648 PolarHBondContact O-N 3.22Å; S648-K650 PolarHBondContact O-N 2.91Å
649	R	57.9	Low	66.7	Low	158 Å²	158	97.9 Å²	97.9	60%	0.596	47%	0.471	S	S	*	.			trans	-55.5	113.4	-179.2	-70.3	-177	176.6	-178.1	-0.9	110.1	D647 E775	D647-R649 PolarHBondContact O-N 3.03Å; R649-E775 IonicContact CZ-OE1 3.49Å; R649-E775 IonicContact CZ-OE2 3.64Å; R649-E775 IonicContact NH1-OE1 2.76Å; R649-E775 PolarHBondContact NH1-OE1 3.02Å; R649-E775 IonicContact NH1-OE2 3.12Å; R649-E775 PolarHBondContact NH1-OE2 3.33Å
650	K	61.2	Low	67.2	Low	190 Å²	190	98 Å²	98	83%	0.826	47%	0.47	S	S	*	.			trans	-61.9	136.5	175.1	-63.3	-179.4	-178.2	178.8	0	109	S648 S652	S648-K650 PolarHBondContact O-N 2.91Å; K650-S652 PolarHBondContact O-N 3.38Å
651	L	64.1	Low	67.7	Low	64 Å²	64	97 Å²	97	34%	0.335	47%	0.471	S	S	.	.			trans	-52.3	133.2	177	-78.1	-178.3	0	0	0	111.1	Q764 V767 Q771	L651-Q764 HydrophobicContact CD1-CB 4.48Å; L651-Q764 HydrophobicContact CD1-CG 3.5Å; L651-Q764 VanDerWaalsContact CD1-CG 3.5Å; L651-V767 HydrophobicContact CD1-CB 4.29Å; L651-V767 HydrophobicContact CD1-CG1 4.04Å; L651-V767 HydrophobicContact CD2-CG1 4.01Å; L651-Q771 VanDerWaalsContact CD2-OE1 3.24Å
652	S	68.9	Low	68.5	Low	42 Å²	42	94.7 Å²	94.7	29%	0.294	46%	0.46	S	S	.	.			trans	-137.9	118.1	176.8	176	0	0	0	0	110	K650 K654 I655 L656	K650-S652 PolarHBondContact O-N 3.38Å; S652-K654 PolarHBondContact O-N 3.21Å; S652-K654 VanDerWaalsContact O-N 3.16Å; S652-I655 PolarHBondContact O-N 3.15Å; S652-L656 PolarHBondContact O-N 3.37Å
653	K	74.8	Confident	69.6	Low	192 Å²	192	88.5 Å²	88.5	84%	0.835	43%	0.434	S	S	*	.	H	α-helix	trans	-52	-36.5	176.2	-174.8	-178.3	175.8	-173.1	0	111.6	S657	K653-S657 WeakPolarHBondContact O-CB 3.31Å; K653-S657 PolarHBondContact O-N 2.85Å
654	K	78.1	Confident	70.8	Confident	167 Å²	167	88.9 Å²	88.9	73%	0.726	44%	0.439	S	S	*	.	H	α-helix	trans	-66.1	-43.1	177.8	-171.1	179.5	-178	-177.8	0	112.5	S652 R658	S652-K654 PolarHBondContact O-N 3.21Å; S652-K654 VanDerWaalsContact O-N 3.16Å; K654-R658 WeakPolarHBondContact O-CB 3.23Å; K654-R658 PolarHBondContact O-N 3.22Å; K654-R658 VanDerWaalsContact O-N 3.17Å
655	I	77.5	Confident	72.4	Confident	50 Å²	50	92.8 Å²	92.8	26%	0.256	45%	0.451	S	S	.	.	H	α-helix	trans	-68.8	-49.5	178.1	-59.2	177.8	0	0	0	109.7	S652 S657 R658 D659	S652-I655 PolarHBondContact O-N 3.15Å; I655-S657 VanDerWaalsContact C-N 3.34Å; I655-S657 PolarHBondContact O-N 3.17Å; I655-R658 WeakPolarHBondContact O-CB 3.39Å; I655-R658 PolarHBondContact O-N 2.84Å; I655-R658 VanDerWaalsContact O-N 3.14Å; I655-D659 WeakPolarHBondContact CG2-OD2 3.15Å; I655-D659 VanDerWaalsContact O-CG 3.31Å; I655-D659 PolarHBondContact O-N 3.47Å
656	L	81.3	Confident	74.1	Confident	47 Å²	47	91.4 Å²	91.4	25%	0.246	44%	0.441	C	S	.	.	H	α-helix	trans	-56.7	-44.8	178.4	179.5	61.9	0	0	0	112.4	S652 D659 V660 V767 Q771 L774	S652-L656 PolarHBondContact O-N 3.37Å; L656-D659 PolarHBondContact O-N 2.93Å; L656-V660 WeakPolarHBondContact O-CG2 3.47Å; L656-V660 PolarHBondContact O-N 2.95Å; L656-V767 HydrophobicContact CD2-CG1 4.14Å; L656-Q771 HydrophobicContact CB-CG 4.41Å; L656-Q771 HydrophobicContact CD1-CB 4.04Å; L656-Q771 HydrophobicContact CD1-CG 4.04Å; L656-L774 HydrophobicContact CD1-CD2 4.04Å
657	S	81.8	Confident	76	Confident	65 Å²	65	87.6 Å²	87.6	46%	0.455	43%	0.428	S	S	.	.	H	α-helix	trans	-61.7	-45.5	176.8	-161.9	0	0	0	0	111.8	K653 I655 D659 V660 D661	K653-S657 WeakPolarHBondContact O-CB 3.31Å; K653-S657 PolarHBondContact O-N 2.85Å; I655-S657 VanDerWaalsContact C-N 3.34Å; I655-S657 PolarHBondContact O-N 3.17Å; S657-D659 VanDerWaalsContact C-N 3.26Å; S657-D659 PolarHBondContact O-N 2.77Å; S657-V660 PolarHBondContact O-N 2.98Å; S657-D661 PolarHBondContact O-N 3.41Å
658	R	82.9	Confident	77.9	Confident	87 Å²	87	86.7 Å²	86.7	33%	0.328	42%	0.421	S	S	.	.	H	α-helix	trans	-57.8	-40	176.1	178.6	173.6	73.4	-177.6	1.6	111.8	E612 K654 I655 D661 R662	E612-R658 IonicContact OE1-CZ 3.23Å; E612-R658 IonicContact OE1-NH1 2.7Å; E612-R658 PolarHBondContact OE1-NH1 3.45Å; E612-R658 IonicContact OE1-NH2 3.78Å; E612-R658 PolarHBondContact OE1-NH2 3.18Å; E612-R658 VanDerWaalsContact OE1-NH2 3.08Å; E612-R658 IonicContact OE2-NH1 3.71Å; E612-R658 PolarHBondContact OE2-NH1 3.45Å; K654-R658 WeakPolarHBondContact O-CB 3.23Å; K654-R658 PolarHBondContact O-N 3.22Å; K654-R658 VanDerWaalsContact O-N 3.17Å; I655-R658 WeakPolarHBondContact O-CB 3.39Å; I655-R658 PolarHBondContact O-N 2.84Å; I655-R658 VanDerWaalsContact O-N 3.14Å; R658-D661 PolarHBondContact O-N 3.47Å; R658-R662 VanDerWaalsContact O-CG 3.28Å; R658-R662 WeakPolarHBondContact O-CG 3.36Å; R658-R662 PolarHBondContact O-N 3.26Å
659	D	83.4	Confident	79.7	Confident	1 Å²	1	84 Å²	84	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-75.7	-33.3	-178.1	-63.8	-25.6	0	0	0	112.3	I655 L656 S657 R662 V663 L774	I655-D659 WeakPolarHBondContact CG2-OD2 3.15Å; I655-D659 VanDerWaalsContact O-CG 3.31Å; I655-D659 PolarHBondContact O-N 3.47Å; L656-D659 PolarHBondContact O-N 2.93Å; S657-D659 VanDerWaalsContact C-N 3.26Å; S657-D659 PolarHBondContact O-N 2.77Å; D659-R662 PolarHBondContact O-N 3.13Å; D659-R662 WeakPolarHBondContact OD1-CD 3.49Å; D659-R662 IonicContact OD1-CZ 2.78Å; D659-R662 IonicContact OD1-NE 3.52Å; D659-R662 IonicContact OD1-NH1 2.64Å; D659-R662 PolarHBondContact OD1-NH1 3.18Å; D659-V663 WeakPolarHBondContact O-CG2 3.47Å; D659-V663 PolarHBondContact O-N 3.17Å; D659-L774 HydrophobicContact CB-CD2 4.01Å; D659-L774 HydrophobicContact CB-CG 4.31Å
660	V	85.2	Confident	81	Confident	72 Å²	72	81 Å²	81	44%	0.436	40%	0.401	S	S	.	.	H	α-helix	trans	-58.5	-47.5	166.7	171.2	0	0	0	0	110.5	L656 S657 R662 V663 K664 L774	L656-V660 WeakPolarHBondContact O-CG2 3.47Å; L656-V660 PolarHBondContact O-N 2.95Å; S657-V660 PolarHBondContact O-N 2.98Å; V660-R662 PolarHBondContact O-N 3.17Å; V660-V663 PolarHBondContact O-N 3.29Å; V660-K664 WeakPolarHBondContact O-CB 3.49Å; V660-K664 PolarHBondContact O-N 3.21Å; V660-L774 HydrophobicContact CB-CD2 4.33Å; V660-L774 HydrophobicContact CG2-CD2 3.57Å
661	D	84.5	Confident	82.4	Confident	56 Å²	56	79.7 Å²	79.7	30%	0.299	39%	0.391	S	S	.	.	H	α-helix	trans	-69.6	-30.8	179.1	-75.8	-53.1	0	0	0	113.4	S657 R658 K664 R665	S657-D661 PolarHBondContact O-N 3.41Å; R658-D661 PolarHBondContact O-N 3.47Å; D661-K664 WeakPolarHBondContact OD1-CD 3.39Å; D661-K664 IonicContact OD1-NZ 3.22Å; D661-K664 PolarHBondContact OD1-NZ 2.88Å; D661-R665 WeakPolarHBondContact O-CG 3.44Å; D661-R665 PolarHBondContact O-N 3.34Å; D661-R665 PolarHBondContact O-NH1 3.48Å
662	R	86.7	Confident	83.7	Confident	6 Å²	6	81.4 Å²	81.4	2%	0.023	40%	0.4	C	S	.	.	H	α-helix	trans	-61.6	-50.8	170.2	-73	164.1	71.6	-152.4	3.3	111.1	R658 D659 V660 R665 I666 A778 E782	R658-R662 VanDerWaalsContact O-CG 3.28Å; R658-R662 WeakPolarHBondContact O-CG 3.36Å; R658-R662 PolarHBondContact O-N 3.26Å; D659-R662 PolarHBondContact O-N 3.13Å; D659-R662 WeakPolarHBondContact OD1-CD 3.49Å; D659-R662 IonicContact OD1-CZ 2.78Å; D659-R662 IonicContact OD1-NE 3.52Å; D659-R662 IonicContact OD1-NH1 2.64Å; D659-R662 PolarHBondContact OD1-NH1 3.18Å; V660-R662 PolarHBondContact O-N 3.17Å; R662-R665 VanDerWaalsContact CG-NH2 3.33Å; R662-R665 PolarHBondContact O-N 2.97Å; R662-I666 PolarHBondContact O-N 2.92Å; R662-A778 HydrophobicContact CB-CB 3.9Å; R662-E782 IonicContact CZ-OE1 3.9Å; R662-E782 IonicContact CZ-OE2 3.05Å; R662-E782 IonicContact NE-OE1 2.7Å; R662-E782 PolarHBondContact NE-OE1 2.65Å; R662-E782 IonicContact NE-OE2 3.13Å; R662-E782 VanDerWaalsContact NH2-CD 3.32Å; R662-E782 IonicContact NH2-OE1 3.7Å; R662-E782 PolarHBondContact NH2-OE1 2.87Å; R662-E782 IonicContact NH2-OE2 3.11Å; R662-E782 PolarHBondContact NH2-OE2 2.93Å
663	V	87.8	Confident	84.5	Confident	21 Å²	21	83.3 Å²	83.3	13%	0.127	41%	0.41	C	S	.	.	H	α-helix	trans	-66.1	-39.6	178.2	176.4	0	0	0	0	111.5	D659 V660 R665 I666 T667 L774 I777 A778	D659-V663 WeakPolarHBondContact O-CG2 3.47Å; D659-V663 PolarHBondContact O-N 3.17Å; V660-V663 PolarHBondContact O-N 3.29Å; V663-R665 VanDerWaalsContact C-N 3.33Å; V663-R665 PolarHBondContact O-N 2.86Å; V663-I666 PolarHBondContact O-N 3.4Å; V663-I666 VanDerWaalsContact O-N 3.08Å; V663-T667 HydrophobicContact CG1-CG2 4.01Å; V663-T667 PolarHBondContact O-N 3.36Å; V663-T667 PolarHBondContact O-OG1 2.81Å; V663-L774 HydrophobicContact CB-CD1 4.03Å; V663-L774 HydrophobicContact CG1-CD1 4.26Å; V663-L774 HydrophobicContact CG2-CD1 3.63Å; V663-L774 HydrophobicContact CG2-CG 3.94Å; V663-I777 HydrophobicContact CG1-CG2 4.33Å; V663-I777 HydrophobicContact CG2-CG2 4.1Å; V663-A778 HydrophobicContact CG2-CB 3.81Å
664	K	87.3	Confident	85.1	Confident	108 Å²	108	78.7 Å²	78.7	47%	0.47	39%	0.393	S	S	.	.	H	α-helix	trans	-57.3	-40.8	174.7	179.9	179.8	165.4	-164.9	0	112.5	V660 D661 T667 M668	V660-K664 WeakPolarHBondContact O-CB 3.49Å; V660-K664 PolarHBondContact O-N 3.21Å; D661-K664 WeakPolarHBondContact OD1-CD 3.39Å; D661-K664 IonicContact OD1-NZ 3.22Å; D661-K664 PolarHBondContact OD1-NZ 2.88Å; K664-T667 WeakPolarHBondContact CA-OG1 3.33Å; K664-T667 PolarHBondContact O-OG1 2.92Å; K664-M668 HydrophobicContact CG-CG 4.44Å; K664-M668 VanDerWaalsContact O-CB 3.27Å; K664-M668 WeakPolarHBondContact O-CB 3.5Å; K664-M668 WeakPolarHBondContact O-CG 3.4Å; K664-M668 PolarHBondContact O-N 2.94Å
665	R	85.4	Confident	85.5	Confident	153 Å²	153	73.9 Å²	73.9	58%	0.577	37%	0.373	S	S	*	.	H	α-helix	trans	-62.6	-41.7	173.8	-73.8	-173.8	-63.9	-93.5	7.6	112.2	D661 R662 V663 A669	D661-R665 WeakPolarHBondContact O-CG 3.44Å; D661-R665 PolarHBondContact O-N 3.34Å; D661-R665 PolarHBondContact O-NH1 3.48Å; R662-R665 VanDerWaalsContact CG-NH2 3.33Å; R662-R665 PolarHBondContact O-N 2.97Å; V663-R665 VanDerWaalsContact C-N 3.33Å; V663-R665 PolarHBondContact O-N 2.86Å; R665-A669 PolarHBondContact O-N 3.06Å; R665-A669 VanDerWaalsContact O-N 3.13Å
666	I	84.9	Confident	86	Confident	46 Å²	46	76.9 Å²	76.9	24%	0.236	38%	0.384	C	S	.	.	H	α-helix	trans	-67.7	-47.1	178.5	-63.1	161.8	0	0	0	110.8	R662 V663 A669 I670	R662-I666 PolarHBondContact O-N 2.92Å; V663-I666 PolarHBondContact O-N 3.4Å; V663-I666 VanDerWaalsContact O-N 3.08Å; I666-A669 PolarHBondContact O-N 2.76Å; I666-I670 HydrophobicContact CG2-CD1 4.03Å; I666-I670 WeakPolarHBondContact O-CG1 3.5Å; I666-I670 PolarHBondContact O-N 3.36Å
667	T	85.6	Confident	86.2	Confident	74 Å²	74	78.6 Å²	78.6	45%	0.454	39%	0.393	S	S	.	.	H	α-helix	trans	-70.2	-34.2	-179.2	56.5	0	0	0	0	112.6	V663 K664 I670 W671	V663-T667 HydrophobicContact CG1-CG2 4.01Å; V663-T667 PolarHBondContact O-N 3.36Å; V663-T667 PolarHBondContact O-OG1 2.81Å; K664-T667 WeakPolarHBondContact CA-OG1 3.33Å; K664-T667 PolarHBondContact O-OG1 2.92Å; T667-I670 PolarHBondContact O-N 2.84Å; T667-W671 VanDerWaalsContact O-CB 3.29Å; T667-W671 WeakPolarHBondContact O-CB 3.15Å; T667-W671 PolarHBondContact O-N 3.15Å
668	M	88.1	Confident	86.5	Confident	109 Å²	109	80.2 Å²	80.2	54%	0.537	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-38	170.7	-71.6	-124.2	-68.4	0	0	112.2	K664 W671 N672	K664-M668 HydrophobicContact CG-CG 4.44Å; K664-M668 VanDerWaalsContact O-CB 3.27Å; K664-M668 WeakPolarHBondContact O-CB 3.5Å; K664-M668 WeakPolarHBondContact O-CG 3.4Å; K664-M668 PolarHBondContact O-N 2.94Å; M668-W671 PolarHBondContact O-N 3.5Å; M668-N672 WeakPolarHBondContact O-CB 3.28Å; M668-N672 PolarHBondContact O-N 3.32Å; M668-N672 PolarHBondContact O-ND2 2.88Å; M668-N672 PolarHBondContact O-OD1 3.34Å
669	A	85.5	Confident	86.7	Confident	55 Å²	55	77 Å²	77	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-44.7	174.6	0	0	0	0	0	111.9	R665 I666 N672 T673	R665-A669 PolarHBondContact O-N 3.06Å; R665-A669 VanDerWaalsContact O-N 3.13Å; I666-A669 PolarHBondContact O-N 2.76Å; A669-N672 PolarHBondContact O-N 2.89Å; A669-T673 PolarHBondContact O-N 3.18Å; A669-T673 VanDerWaalsContact O-N 3.09Å; A669-T673 PolarHBondContact O-OG1 2.95Å
670	I	86.9	Confident	86.9	Confident	96 Å²	96	77.6 Å²	77.6	49%	0.492	39%	0.387	S	S	.	.	H	α-helix	trans	-64.3	-43.1	175	-64.6	165.2	0	0	0	111	I666 T667 N672 T673 M674	I666-I670 HydrophobicContact CG2-CD1 4.03Å; I666-I670 WeakPolarHBondContact O-CG1 3.5Å; I666-I670 PolarHBondContact O-N 3.36Å; T667-I670 PolarHBondContact O-N 2.84Å; I670-N672 VanDerWaalsContact C-N 3.34Å; I670-N672 PolarHBondContact O-N 2.78Å; I670-T673 PolarHBondContact O-N 2.76Å; I670-T673 PolarHBondContact O-OG1 2.9Å; I670-M674 HydrophobicContact CG2-CG 4.4Å; I670-M674 VanDerWaalsContact O-CG 3.29Å; I670-M674 WeakPolarHBondContact O-CG 3.48Å; I670-M674 PolarHBondContact O-N 3.32Å
671	W	89.8	Confident	86.9	Confident	163 Å²	163	81.5 Å²	81.5	62%	0.617	40%	0.398	S	S	*	.	H	α-helix	trans	-61.7	-43.2	177.6	-173.4	-104.2	0	0	0	111.5	T667 M668 T673 M674 Q675	T667-W671 VanDerWaalsContact O-CB 3.29Å; T667-W671 WeakPolarHBondContact O-CB 3.15Å; T667-W671 PolarHBondContact O-N 3.15Å; M668-W671 PolarHBondContact O-N 3.5Å; W671-T673 PolarHBondContact O-N 2.66Å; W671-M674 PolarHBondContact O-N 3.4Å; W671-Q675 VanDerWaalsContact CE2-NE2 3.28Å; W671-Q675 HydrophobicContact CG-CG 4.49Å; W671-Q675 WeakPolarHBondContact O-CG 3.31Å; W671-Q675 PolarHBondContact O-N 3.32Å
672	N	91.1	Very high	87.1	Confident	100 Å²	100	83.9 Å²	83.9	54%	0.535	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-37.6	178.3	-70.2	-11	0	0	0	112.4	M668 A669 I670 F676	M668-N672 WeakPolarHBondContact O-CB 3.28Å; M668-N672 PolarHBondContact O-N 3.32Å; M668-N672 PolarHBondContact O-ND2 2.88Å; M668-N672 PolarHBondContact O-OD1 3.34Å; A669-N672 PolarHBondContact O-N 2.89Å; I670-N672 VanDerWaalsContact C-N 3.34Å; I670-N672 PolarHBondContact O-N 2.78Å; N672-F676 WeakPolarHBondContact O-CB 3.39Å; N672-F676 PolarHBondContact O-N 2.8Å
673	T	86.3	Confident	87.1	Confident	81 Å²	81	89.6 Å²	89.6	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-69.5	-36.9	173.3	56.8	0	0	0	0	112.1	A669 I670 W671 F676 L677	A669-T673 PolarHBondContact O-N 3.18Å; A669-T673 VanDerWaalsContact O-N 3.09Å; A669-T673 PolarHBondContact O-OG1 2.95Å; I670-T673 PolarHBondContact O-N 2.76Å; I670-T673 PolarHBondContact O-OG1 2.9Å; W671-T673 PolarHBondContact O-N 2.66Å; T673-F676 PolarHBondContact O-N 3.48Å; T673-L677 WeakPolarHBondContact O-CB 3.26Å; T673-L677 PolarHBondContact O-N 3.46Å
674	M	87.2	Confident	87.1	Confident	96 Å²	96	94.7 Å²	94.7	47%	0.473	45%	0.452	S	S	.	.	H	α-helix	trans	-66.6	-39.6	173.6	-68.6	-64.2	100.2	0	0	112.7	I670 W671 L677 K678	I670-M674 HydrophobicContact CG2-CG 4.4Å; I670-M674 VanDerWaalsContact O-CG 3.29Å; I670-M674 WeakPolarHBondContact O-CG 3.48Å; I670-M674 PolarHBondContact O-N 3.32Å; W671-M674 PolarHBondContact O-N 3.4Å; M674-L677 HydrophobicContact CE-CD2 4.34Å; M674-L677 PolarHBondContact O-N 3.43Å; M674-K678 VanDerWaalsContact O-CB 3.29Å; M674-K678 WeakPolarHBondContact O-CB 3.44Å; M674-K678 PolarHBondContact O-N 2.73Å
675	Q	87.2	Confident	87.1	Confident	66 Å²	66	91.3 Å²	91.3	31%	0.308	44%	0.442	S	S	.	.	H	α-helix	trans	-67.5	-37.6	173.2	-67.1	-54.9	-31.7	0	0	111.8	W671 K678 S679	W671-Q675 VanDerWaalsContact CE2-NE2 3.28Å; W671-Q675 HydrophobicContact CG-CG 4.49Å; W671-Q675 WeakPolarHBondContact O-CG 3.31Å; W671-Q675 PolarHBondContact O-N 3.32Å; Q675-K678 PolarHBondContact O-N 3.1Å; Q675-S679 VanDerWaalsContact O-CB 3.24Å; Q675-S679 WeakPolarHBondContact O-CB 3.43Å; Q675-S679 PolarHBondContact O-N 3.45Å
676	F	86.5	Confident	87.3	Confident	113 Å²	113	88.9 Å²	88.9	50%	0.496	44%	0.444	S	S	.	.	H	α-helix	trans	-62	-43.8	172.1	177	-96	0	0	0	112.1	N672 T673 S679 C680	N672-F676 WeakPolarHBondContact O-CB 3.39Å; N672-F676 PolarHBondContact O-N 2.8Å; T673-F676 PolarHBondContact O-N 3.48Å; F676-S679 WeakPolarHBondContact O-CB 3.33Å; F676-S679 PolarHBondContact O-N 2.76Å; F676-C680 PolarHBondContact O-N 3.37Å; F676-C680 PolarHBondContact O-SG 3.03Å
677	L	86.1	Confident	87.5	Confident	83 Å²	83	92.1 Å²	92.1	44%	0.435	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-43	177	-144.9	74.1	0	0	0	111.4	T673 M674 C680 F681	T673-L677 WeakPolarHBondContact O-CB 3.26Å; T673-L677 PolarHBondContact O-N 3.46Å; M674-L677 HydrophobicContact CE-CD2 4.34Å; M674-L677 PolarHBondContact O-N 3.43Å; L677-C680 WeakPolarHBondContact O-CB 3.25Å; L677-C680 PolarHBondContact O-N 2.77Å; L677-F681 HydrophobicContact CD2-CE2 4.07Å; L677-F681 HydrophobicContact CD2-CZ 4.39Å; L677-F681 HydrophobicContact CG-CE2 3.95Å; L677-F681 HydrophobicContact CG-CZ 4.23Å; L677-F681 VanDerWaalsContact O-CD2 3.29Å; L677-F681 WeakPolarHBondContact O-CD2 3.29Å; L677-F681 WeakPolarHBondContact O-CG 3.42Å; L677-F681 PolarHBondContact O-N 2.66Å
678	K	88.1	Confident	87.5	Confident	98 Å²	98	95.6 Å²	95.6	43%	0.426	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-42.5	174.6	178.2	171.2	169.6	-73.2	0	112.3	M674 Q675 C680 F681 Q682	M674-K678 VanDerWaalsContact O-CB 3.29Å; M674-K678 WeakPolarHBondContact O-CB 3.44Å; M674-K678 PolarHBondContact O-N 2.73Å; Q675-K678 PolarHBondContact O-N 3.1Å; K678-C680 VanDerWaalsContact C-N 3.29Å; K678-C680 PolarHBondContact O-N 3.47Å; K678-F681 CarbonylContact O-C 3.54Å; K678-F681 PolarHBondContact O-N 2.89Å; K678-F681 VanDerWaalsContact O-N 3.15Å; K678-Q682 HydrophobicContact CG-CG 4.28Å; K678-Q682 VanDerWaalsContact CG-OE1 3.24Å; K678-Q682 WeakPolarHBondContact O-CB 3.44Å; K678-Q682 WeakPolarHBondContact O-CG 3.47Å; K678-Q682 PolarHBondContact O-N 3.33Å
679	S	88.1	Confident	87.6	Confident	21 Å²	21	90.5 Å²	90.5	15%	0.147	44%	0.441	C	S	.	.	H	α-helix	trans	-57.5	-41.5	173.7	-176.3	0	0	0	0	111.7	Q675 F676 Q682 W683 E684	Q675-S679 VanDerWaalsContact O-CB 3.24Å; Q675-S679 WeakPolarHBondContact O-CB 3.43Å; Q675-S679 PolarHBondContact O-N 3.45Å; F676-S679 WeakPolarHBondContact O-CB 3.33Å; F676-S679 PolarHBondContact O-N 2.76Å; S679-Q682 PolarHBondContact O-N 3.03Å; S679-W683 PolarHBondContact O-N 3.27Å; S679-E684 WeakPolarHBondContact CA-OE2 3.26Å; S679-E684 WeakPolarHBondContact CB-OE2 3.27Å; S679-E684 PolarHBondContact O-N 2.99Å; S679-E684 PolarHBondContact OG-OE2 2.82Å
680	C	86.1	Confident	87.9	Confident	12 Å²	12	91.2 Å²	91.2	8%	0.081	44%	0.44	C	S	.	.	H	α-helix	trans	-63.9	-44.6	173.8	-63.9	0	0	0	0	112.2	F676 L677 K678 W683 S689 A692	F676-C680 PolarHBondContact O-N 3.37Å; F676-C680 PolarHBondContact O-SG 3.03Å; L677-C680 WeakPolarHBondContact O-CB 3.25Å; L677-C680 PolarHBondContact O-N 2.77Å; K678-C680 VanDerWaalsContact C-N 3.29Å; K678-C680 PolarHBondContact O-N 3.47Å; C680-W683 PolarHBondContact O-N 2.85Å; C680-S689 WeakPolarHBondContact CA-OG 3.46Å; C680-S689 WeakPolarHBondContact O-CB 3.27Å; C680-S689 PolarHBondContact O-OG 2.77Å; C680-A692 HydrophobicContact CB-CB 4.33Å
681	F	85.6	Confident	88	Confident	154 Å²	154	91.4 Å²	91.4	68%	0.675	44%	0.441	S	S	*	.	H	α-helix	trans	-70.9	-27	177.2	-63.1	-40.6	0	0	0	114.2	L677 K678 W683	L677-F681 HydrophobicContact CD2-CE2 4.07Å; L677-F681 HydrophobicContact CD2-CZ 4.39Å; L677-F681 HydrophobicContact CG-CE2 3.95Å; L677-F681 HydrophobicContact CG-CZ 4.23Å; L677-F681 VanDerWaalsContact O-CD2 3.29Å; L677-F681 WeakPolarHBondContact O-CD2 3.29Å; L677-F681 WeakPolarHBondContact O-CG 3.42Å; L677-F681 PolarHBondContact O-N 2.66Å; K678-F681 CarbonylContact O-C 3.54Å; K678-F681 PolarHBondContact O-N 2.89Å; K678-F681 VanDerWaalsContact O-N 3.15Å; F681-W683 VanDerWaalsContact C-N 3.33Å; F681-W683 VanDerWaalsContact O-CD1 3.3Å
682	Q	88.3	Confident	87.8	Confident	106 Å²	106	85.6 Å²	85.6	50%	0.495	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	3.4	177.2	-67.8	-165.3	-96	0	0	113.7	K678 S679 E684	K678-Q682 HydrophobicContact CG-CG 4.28Å; K678-Q682 VanDerWaalsContact CG-OE1 3.24Å; K678-Q682 WeakPolarHBondContact O-CB 3.44Å; K678-Q682 WeakPolarHBondContact O-CG 3.47Å; K678-Q682 PolarHBondContact O-N 3.33Å; S679-Q682 PolarHBondContact O-N 3.03Å; Q682-E684 HydrophobicContact CB-CG 4.16Å; Q682-E684 PolarHBondContact O-N 3.02Å
683	W	87.9	Confident	87.7	Confident	127 Å²	127	85.8 Å²	85.8	48%	0.481	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	24.8	176.8	-65.2	79.8	0	0	0	115.2	S679 C680 F681 S685 S689 T690	S679-W683 PolarHBondContact O-N 3.27Å; C680-W683 PolarHBondContact O-N 2.85Å; F681-W683 VanDerWaalsContact C-N 3.33Å; F681-W683 VanDerWaalsContact O-CD1 3.3Å; W683-S685 PolarHBondContact O-N 3.28Å; W683-S685 VanDerWaalsContact O-N 3.07Å; W683-S689 WeakPolarHBondContact CA-OG 3.3Å; W683-S689 VanDerWaalsContact CE3-CB 3.46Å; W683-T690 HydrophobicContact CH2-CG2 4.33Å; W683-T690 HydrophobicContact CZ3-CG2 3.79Å
684	E	86.5	Confident	87.9	Confident	128 Å²	128	84 Å²	84	60%	0.598	42%	0.418	S	S	*	.	S	Bend	trans	-59.9	-22.4	-180	-62.7	178.9	167	0	0	113.1	S679 Q682	S679-E684 WeakPolarHBondContact CA-OE2 3.26Å; S679-E684 WeakPolarHBondContact CB-OE2 3.27Å; S679-E684 PolarHBondContact O-N 2.99Å; S679-E684 PolarHBondContact OG-OE2 2.82Å; Q682-E684 HydrophobicContact CB-CG 4.16Å; Q682-E684 PolarHBondContact O-N 3.02Å
685	S	86.9	Confident	87.9	Confident	37 Å²	37	83.5 Å²	83.5	26%	0.259	42%	0.419	S	S	.	.	S	Bend	trans	-136.9	103.4	170.2	-178.6	0	0	0	0	109.5	W683 L687 R688 S689	W683-S685 PolarHBondContact O-N 3.28Å; W683-S685 VanDerWaalsContact O-N 3.07Å; S685-L687 VanDerWaalsContact C-N 3.31Å; S685-L687 PolarHBondContact O-N 2.98Å; S685-R688 PolarHBondContact O-N 3.1Å; S685-S689 PolarHBondContact O-N 3.25Å; S685-S689 PolarHBondContact O-OG 3.09Å
686	T	89.7	Confident	88	Confident	102 Å²	102	86.1 Å²	86.1	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-50.9	-45.8	-176.4	52.1	0	0	0	0	113.1	R688 S689 T690	T686-R688 PolarHBondContact O-N 2.83Å; T686-S689 PolarHBondContact O-N 3.41Å; T686-T690 WeakPolarHBondContact O-CB 3.42Å; T686-T690 WeakPolarHBondContact O-CG2 3.23Å; T686-T690 PolarHBondContact O-N 3.02Å; T686-T690 PolarHBondContact O-OG1 2.93Å
687	L	89.4	Confident	88.1	Confident	114 Å²	114	85 Å²	85	60%	0.597	43%	0.429	S	S	*	.	H	α-helix	trans	-64.2	-39.6	178.5	-177.6	149.2	0	0	0	112.7	S685 T690 I691	S685-L687 VanDerWaalsContact C-N 3.31Å; S685-L687 PolarHBondContact O-N 2.98Å; L687-T690 WeakPolarHBondContact CA-OG1 3.36Å; L687-T690 PolarHBondContact O-OG1 2.73Å; L687-T690 VanDerWaalsContact O-OG1 3.07Å; L687-I691 HydrophobicContact CD2-CD1 3.74Å; L687-I691 HydrophobicContact CG-CD1 4.25Å; L687-I691 WeakPolarHBondContact O-CD1 3.3Å; L687-I691 VanDerWaalsContact O-CG1 3.25Å; L687-I691 WeakPolarHBondContact O-CG1 3.32Å; L687-I691 PolarHBondContact O-N 2.81Å
688	R	86.3	Confident	88.1	Confident	146 Å²	146	86.3 Å²	86.3	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-71.8	-42.2	177.7	-65	179.1	-177.7	159	2.4	111.2	S685 T686 I691 A692	S685-R688 PolarHBondContact O-N 3.1Å; T686-R688 PolarHBondContact O-N 2.83Å; R688-I691 PolarHBondContact O-N 3.03Å; R688-A692 WeakPolarHBondContact O-CB 3.31Å; R688-A692 PolarHBondContact O-N 3.13Å
689	S	90.8	Very high	88	Confident	3 Å²	3	85 Å²	85	2%	0.021	44%	0.435	C	S	.	.	H	α-helix	trans	-68.2	-40.1	179.9	-62.9	0	0	0	0	112.7	C680 W683 S685 T686 A692 F693	C680-S689 WeakPolarHBondContact CA-OG 3.46Å; C680-S689 WeakPolarHBondContact O-CB 3.27Å; C680-S689 PolarHBondContact O-OG 2.77Å; W683-S689 WeakPolarHBondContact CA-OG 3.3Å; W683-S689 VanDerWaalsContact CE3-CB 3.46Å; S685-S689 PolarHBondContact O-N 3.25Å; S685-S689 PolarHBondContact O-OG 3.09Å; T686-S689 PolarHBondContact O-N 3.41Å; S689-A692 PolarHBondContact O-N 3.5Å; S689-F693 WeakPolarHBondContact O-CB 3.24Å; S689-F693 PolarHBondContact O-N 2.8Å
690	T	90.3	Very high	87.9	Confident	70 Å²	70	88 Å²	88	43%	0.429	45%	0.453	S	S	.	.	H	α-helix	trans	-62.7	-43.7	173	45.1	0	0	0	0	112.1	W683 T686 L687 F693 A694	W683-T690 HydrophobicContact CH2-CG2 4.33Å; W683-T690 HydrophobicContact CZ3-CG2 3.79Å; T686-T690 WeakPolarHBondContact O-CB 3.42Å; T686-T690 WeakPolarHBondContact O-CG2 3.23Å; T686-T690 PolarHBondContact O-N 3.02Å; T686-T690 PolarHBondContact O-OG1 2.93Å; L687-T690 WeakPolarHBondContact CA-OG1 3.36Å; L687-T690 PolarHBondContact O-OG1 2.73Å; L687-T690 VanDerWaalsContact O-OG1 3.07Å; T690-F693 PolarHBondContact O-N 2.77Å; T690-A694 WeakPolarHBondContact O-CB 3.39Å; T690-A694 PolarHBondContact O-N 2.89Å
691	I	89.3	Confident	88	Confident	99 Å²	99	98.1 Å²	98.1	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-47.5	175.8	-67.7	169.2	0	0	0	110.7	L687 R688 F693 A694 V695	L687-I691 HydrophobicContact CD2-CD1 3.74Å; L687-I691 HydrophobicContact CG-CD1 4.25Å; L687-I691 WeakPolarHBondContact O-CD1 3.3Å; L687-I691 VanDerWaalsContact O-CG1 3.25Å; L687-I691 WeakPolarHBondContact O-CG1 3.32Å; L687-I691 PolarHBondContact O-N 2.81Å; R688-I691 PolarHBondContact O-N 3.03Å; I691-F693 VanDerWaalsContact C-N 3.32Å; I691-F693 PolarHBondContact O-N 3.02Å; I691-A694 PolarHBondContact O-N 3.48Å; I691-V695 HydrophobicContact CG2-CG2 4.46Å; I691-V695 WeakPolarHBondContact O-CB 3.23Å; I691-V695 VanDerWaalsContact O-CG2 3.31Å; I691-V695 WeakPolarHBondContact O-CG2 3.29Å; I691-V695 PolarHBondContact O-N 2.99Å
692	A	87.1	Confident	87.9	Confident	42 Å²	42	95.1 Å²	95.1	35%	0.347	48%	0.481	S	S	.	.	H	α-helix	trans	-61.2	-39.4	177.9	0	0	0	0	0	112.4	C680 R688 S689 F696	C680-A692 HydrophobicContact CB-CB 4.33Å; R688-A692 WeakPolarHBondContact O-CB 3.31Å; R688-A692 PolarHBondContact O-N 3.13Å; S689-A692 PolarHBondContact O-N 3.5Å; A692-F696 VanDerWaalsContact O-CB 3.3Å; A692-F696 WeakPolarHBondContact O-CB 3.44Å; A692-F696 PolarHBondContact O-N 2.8Å
693	F	88.6	Confident	87.7	Confident	104 Å²	104	95.6 Å²	95.6	46%	0.456	48%	0.481	S	S	.	.	H	α-helix	trans	-69.4	-41.9	176.6	-177.2	-114.3	0	0	0	112.5	S689 T690 I691 F696 L697	S689-F693 WeakPolarHBondContact O-CB 3.24Å; S689-F693 PolarHBondContact O-N 2.8Å; T690-F693 PolarHBondContact O-N 2.77Å; I691-F693 VanDerWaalsContact C-N 3.32Å; I691-F693 PolarHBondContact O-N 3.02Å; F693-F696 PolarHBondContact O-N 3.12Å; F693-L697 HydrophobicContact CD1-CD1 4.03Å; F693-L697 HydrophobicContact CE1-CD1 3.56Å; F693-L697 HydrophobicContact CE1-CG 4.26Å; F693-L697 HydrophobicContact CE2-CD1 4.42Å; F693-L697 HydrophobicContact CE2-CD2 4.37Å; F693-L697 HydrophobicContact CE2-CG 4.28Å; F693-L697 HydrophobicContact CZ-CD1 3.78Å; F693-L697 HydrophobicContact CZ-CD2 4.23Å; F693-L697 HydrophobicContact CZ-CG 4.1Å; F693-L697 WeakPolarHBondContact O-CG 3.43Å; F693-L697 PolarHBondContact O-N 2.65Å
694	A	89.6	Confident	87.6	Confident	44 Å²	44	94.4 Å²	94.4	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-44.7	174.4	0	0	0	0	0	111.6	T690 I691 F696 L697 I698	T690-A694 WeakPolarHBondContact O-CB 3.39Å; T690-A694 PolarHBondContact O-N 2.89Å; I691-A694 PolarHBondContact O-N 3.48Å; A694-F696 VanDerWaalsContact C-N 3.34Å; A694-F696 PolarHBondContact O-N 3.36Å; A694-L697 PolarHBondContact O-N 3.11Å; A694-I698 WeakPolarHBondContact O-CB 3.39Å; A694-I698 WeakPolarHBondContact O-CD1 3.39Å; A694-I698 VanDerWaalsContact O-CG1 3.29Å; A694-I698 WeakPolarHBondContact O-CG1 3.07Å; A694-I698 PolarHBondContact O-N 3.15Å
695	V	88.3	Confident	87.5	Confident	84 Å²	84	92.1 Å²	92.1	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-60.7	-43.1	173.7	169.7	0	0	0	0	110.9	I691 T699	I691-V695 HydrophobicContact CG2-CG2 4.46Å; I691-V695 WeakPolarHBondContact O-CB 3.23Å; I691-V695 VanDerWaalsContact O-CG2 3.31Å; I691-V695 WeakPolarHBondContact O-CG2 3.29Å; I691-V695 PolarHBondContact O-N 2.99Å; V695-T699 VanDerWaalsContact O-CB 3.23Å; V695-T699 WeakPolarHBondContact O-CB 3.43Å; V695-T699 PolarHBondContact O-N 3.22Å; V695-T699 PolarHBondContact O-OG1 3.32Å
696	F	87.8	Confident	87.5	Confident	122 Å²	122	92.1 Å²	92.1	54%	0.535	47%	0.467	S	S	.	.	H	α-helix	trans	-60.1	-49.9	175.5	172.6	-99.7	0	0	0	112.1	A692 F693 A694 I698 T699 V700	A692-F696 VanDerWaalsContact O-CB 3.3Å; A692-F696 WeakPolarHBondContact O-CB 3.44Å; A692-F696 PolarHBondContact O-N 2.8Å; F693-F696 PolarHBondContact O-N 3.12Å; A694-F696 VanDerWaalsContact C-N 3.34Å; A694-F696 PolarHBondContact O-N 3.36Å; F696-I698 PolarHBondContact O-N 3.33Å; F696-T699 PolarHBondContact O-N 2.9Å; F696-V700 HydrophobicContact CD1-CG2 4.46Å; F696-V700 HydrophobicContact CD2-CG2 3.9Å; F696-V700 HydrophobicContact CE1-CG2 4.15Å; F696-V700 HydrophobicContact CE2-CG2 3.55Å; F696-V700 HydrophobicContact CG-CG2 4.35Å; F696-V700 HydrophobicContact CZ-CG2 3.69Å; F696-V700 WeakPolarHBondContact O-CB 3.37Å; F696-V700 VanDerWaalsContact O-CG2 3.29Å; F696-V700 WeakPolarHBondContact O-CG2 3.47Å; F696-V700 PolarHBondContact O-N 3.46Å
697	L	88.8	Confident	87.4	Confident	89 Å²	89	90.3 Å²	90.3	47%	0.466	45%	0.452	S	S	.	.	H	α-helix	trans	-59.1	-47.8	178.2	-72.7	177.2	0	0	0	112.1	F693 A694 T699 V700 W701	F693-L697 HydrophobicContact CD1-CD1 4.03Å; F693-L697 HydrophobicContact CE1-CD1 3.56Å; F693-L697 HydrophobicContact CE1-CG 4.26Å; F693-L697 HydrophobicContact CE2-CD1 4.42Å; F693-L697 HydrophobicContact CE2-CD2 4.37Å; F693-L697 HydrophobicContact CE2-CG 4.28Å; F693-L697 HydrophobicContact CZ-CD1 3.78Å; F693-L697 HydrophobicContact CZ-CD2 4.23Å; F693-L697 HydrophobicContact CZ-CG 4.1Å; F693-L697 WeakPolarHBondContact O-CG 3.43Å; F693-L697 PolarHBondContact O-N 2.65Å; A694-L697 PolarHBondContact O-N 3.11Å; L697-T699 VanDerWaalsContact C-N 3.32Å; L697-T699 PolarHBondContact O-N 2.77Å; L697-V700 PolarHBondContact O-N 3.18Å; L697-W701 VanDerWaalsContact O-CB 3.28Å; L697-W701 WeakPolarHBondContact O-CB 3.38Å; L697-W701 PolarHBondContact O-N 3.42Å
698	I	86.9	Confident	87.3	Confident	110 Å²	110	89 Å²	89	56%	0.564	45%	0.445	S	S	*	.	H	α-helix	trans	-62.4	-41.5	177.6	-67.4	164.4	0	0	0	110.7	A694 F696 N702	A694-I698 WeakPolarHBondContact O-CB 3.39Å; A694-I698 WeakPolarHBondContact O-CD1 3.39Å; A694-I698 VanDerWaalsContact O-CG1 3.29Å; A694-I698 WeakPolarHBondContact O-CG1 3.07Å; A694-I698 PolarHBondContact O-N 3.15Å; F696-I698 PolarHBondContact O-N 3.33Å; I698-N702 PolarHBondContact O-N 3.44Å; I698-N702 PolarHBondContact O-ND2 3.29Å
699	T	85	Confident	87.4	Confident	70 Å²	70	82.5 Å²	82.5	43%	0.429	42%	0.422	S	S	.	.	H	α-helix	trans	-66	-47.9	179.9	-57.4	0	0	0	0	111.3	V695 F696 L697 N702 F703	V695-T699 VanDerWaalsContact O-CB 3.23Å; V695-T699 WeakPolarHBondContact O-CB 3.43Å; V695-T699 PolarHBondContact O-N 3.22Å; V695-T699 PolarHBondContact O-OG1 3.32Å; F696-T699 PolarHBondContact O-N 2.9Å; L697-T699 VanDerWaalsContact C-N 3.32Å; L697-T699 PolarHBondContact O-N 2.77Å; T699-N702 CarbonylContact O-C 3.59Å; T699-N702 PolarHBondContact O-N 3.08Å; T699-F703 HydrophobicContact CG2-CD2 4.26Å; T699-F703 WeakPolarHBondContact O-CA 3.33Å; T699-F703 VanDerWaalsContact O-CB 3.31Å; T699-F703 WeakPolarHBondContact O-CB 3.22Å; T699-F703 PolarHBondContact O-N 2.67Å
700	V	87.3	Confident	87.3	Confident	85 Å²	85	85.3 Å²	85.3	52%	0.515	44%	0.436	S	S	.	.	H	α-helix	trans	-66.4	-39.4	-179.4	173.3	0	0	0	0	111.6	F696 L697 N702 F703	F696-V700 HydrophobicContact CD1-CG2 4.46Å; F696-V700 HydrophobicContact CD2-CG2 3.9Å; F696-V700 HydrophobicContact CE1-CG2 4.15Å; F696-V700 HydrophobicContact CE2-CG2 3.55Å; F696-V700 HydrophobicContact CG-CG2 4.35Å; F696-V700 HydrophobicContact CZ-CG2 3.69Å; F696-V700 WeakPolarHBondContact O-CB 3.37Å; F696-V700 VanDerWaalsContact O-CG2 3.29Å; F696-V700 WeakPolarHBondContact O-CG2 3.47Å; F696-V700 PolarHBondContact O-N 3.46Å; L697-V700 PolarHBondContact O-N 3.18Å; V700-N702 VanDerWaalsContact C-N 3.26Å; V700-N702 PolarHBondContact O-N 3.44Å; V700-F703 PolarHBondContact O-N 2.85Å
701	W	88.9	Confident	87.2	Confident	224 Å²	224	84.4 Å²	84.4	85%	0.848	44%	0.436	S	S	*	.	H	α-helix	trans	-64.2	-30.2	177.7	-169.6	-81.4	0	0	0	113	L697	L697-W701 VanDerWaalsContact O-CB 3.28Å; L697-W701 WeakPolarHBondContact O-CB 3.38Å; L697-W701 PolarHBondContact O-N 3.42Å
702	N	82.8	Confident	87.2	Confident	92 Å²	92	82.9 Å²	82.9	49%	0.492	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	27.6	-178.3	-57	-86.9	0	0	0	112	I698 T699 V700 E704	I698-N702 PolarHBondContact O-N 3.44Å; I698-N702 PolarHBondContact O-ND2 3.29Å; T699-N702 CarbonylContact O-C 3.59Å; T699-N702 PolarHBondContact O-N 3.08Å; V700-N702 VanDerWaalsContact C-N 3.26Å; V700-N702 PolarHBondContact O-N 3.44Å; N702-E704 PolarHBondContact O-N 3.13Å; N702-E704 VanDerWaalsContact O-N 3.12Å
703	F	84.6	Confident	87.4	Confident	115 Å²	115	82.3 Å²	82.3	50%	0.504	42%	0.419	S	S	.	.			trans	-81.6	95.6	-171	-167.4	-102.7	0	0	0	113.1	T699 V700 I708	T699-F703 HydrophobicContact CG2-CD2 4.26Å; T699-F703 WeakPolarHBondContact O-CA 3.33Å; T699-F703 VanDerWaalsContact O-CB 3.31Å; T699-F703 WeakPolarHBondContact O-CB 3.22Å; T699-F703 PolarHBondContact O-N 2.67Å; V700-F703 PolarHBondContact O-N 2.85Å; F703-I708 HydrophobicContact CE2-CG1 4.36Å; F703-I708 HydrophobicContact CZ-CD1 3.95Å; F703-I708 HydrophobicContact CZ-CG1 3.83Å
704	E	85.9	Confident	87.4	Confident	103 Å²	103	82.3 Å²	82.3	48%	0.481	42%	0.423	S	S	.	.			trans	-103.6	149.8	169	-64.9	-164.7	-92.2	0	0	112.4	N702 Y706 M707	N702-E704 PolarHBondContact O-N 3.13Å; N702-E704 VanDerWaalsContact O-N 3.12Å; E704-Y706 VanDerWaalsContact C-N 3.29Å; E704-Y706 HydrophobicContact CB-CD1 3.82Å; E704-Y706 HydrophobicContact CB-CE1 3.38Å; E704-Y706 HydrophobicContact CG-CE1 3.99Å; E704-Y706 PolarHBondContact O-N 3.04Å; E704-Y706 VanDerWaalsContact OE1-CE1 3.24Å; E704-Y706 WeakPolarHBondContact OE1-CE1 3.44Å; E704-Y706 VanDerWaalsContact OE1-CZ 3.31Å; E704-Y706 PolarHBondContact OE1-OH 3.49Å; E704-M707 HydrophobicContact CB-CG 4.45Å; E704-M707 WeakPolarHBondContact O-CB 3.44Å; E704-M707 VanDerWaalsContact O-CG 3.27Å; E704-M707 WeakPolarHBondContact O-CG 3.31Å; E704-M707 PolarHBondContact O-N 3.5Å
705	L	83.1	Confident	87.3	Confident	80 Å²	80	84 Å²	84	42%	0.419	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.5	-170.7	-74.5	155.2	0	0	0	114.4	M707 I708 L810 L815	L705-M707 PolarHBondContact O-N 3.02Å; L705-I708 HydrophobicContact CD2-CD1 4.49Å; L705-I708 PolarHBondContact O-N 3.48Å; L705-L810 HydrophobicContact CB-CD2 4.41Å; L705-L815 HydrophobicContact CD1-CB 3.77Å; L705-L815 HydrophobicContact CD1-CD1 3.69Å; L705-L815 HydrophobicContact CD1-CG 4.21Å; L705-L815 HydrophobicContact CD2-CD1 4.18Å; L705-L815 HydrophobicContact CG-CD1 4.49Å
706	Y	86.4	Confident	87.2	Confident	36 Å²	36	80.3 Å²	80.3	14%	0.141	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.2	173.6	64.7	-100.8	0	0	0	112.7	E704 I708 P709 L710 Y811	E704-Y706 VanDerWaalsContact C-N 3.29Å; E704-Y706 HydrophobicContact CB-CD1 3.82Å; E704-Y706 HydrophobicContact CB-CE1 3.38Å; E704-Y706 HydrophobicContact CG-CE1 3.99Å; E704-Y706 PolarHBondContact O-N 3.04Å; E704-Y706 VanDerWaalsContact OE1-CE1 3.24Å; E704-Y706 WeakPolarHBondContact OE1-CE1 3.44Å; E704-Y706 VanDerWaalsContact OE1-CZ 3.31Å; E704-Y706 PolarHBondContact OE1-OH 3.49Å; Y706-I708 PolarHBondContact O-N 3.26Å; Y706-P709 WeakPolarHBondContact O-CD 3.43Å; Y706-P709 WeakPolarHBondContact O-CG 3.46Å; Y706-L710 WeakPolarHBondContact O-CB 3.44Å; Y706-L710 PolarHBondContact O-N 2.83Å; Y706-L710 VanDerWaalsContact O-N 3.14Å; Y706-Y811 AromaticContact CD1-CD2 4Å; Y706-Y811 HydrophobicContact CD1-CD2 4Å; Y706-Y811 AromaticContact CE1-CD2 3.73Å; Y706-Y811 HydrophobicContact CE1-CD2 3.73Å; Y706-Y811 HydrophobicContact CE1-CE2 4.41Å
707	M	88.1	Confident	87.2	Confident	65 Å²	65	76.9 Å²	76.9	32%	0.32	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-25.1	177.2	-62.7	-65.9	-169.9	0	0	112.3	E704 L705 L710 A711	E704-M707 HydrophobicContact CB-CG 4.45Å; E704-M707 WeakPolarHBondContact O-CB 3.44Å; E704-M707 VanDerWaalsContact O-CG 3.27Å; E704-M707 WeakPolarHBondContact O-CG 3.31Å; E704-M707 PolarHBondContact O-N 3.5Å; L705-M707 PolarHBondContact O-N 3.02Å; M707-L710 HydrophobicContact SD-CD2 4Å; M707-A711 VanDerWaalsContact O-CB 3.26Å; M707-A711 WeakPolarHBondContact O-CB 3.49Å; M707-A711 PolarHBondContact O-N 2.71Å
708	I	88.3	Confident	87.1	Confident	85 Å²	85	78.6 Å²	78.6	44%	0.436	39%	0.393	S	S	.	.	H	α-helix	trans	-66.3	-60.6	179.5	-57	172.7	0	0	0	111.3	F703 L705 Y706 L710 A711 L712	F703-I708 HydrophobicContact CE2-CG1 4.36Å; F703-I708 HydrophobicContact CZ-CD1 3.95Å; F703-I708 HydrophobicContact CZ-CG1 3.83Å; L705-I708 HydrophobicContact CD2-CD1 4.49Å; L705-I708 PolarHBondContact O-N 3.48Å; Y706-I708 PolarHBondContact O-N 3.26Å; I708-L710 PolarHBondContact O-N 2.84Å; I708-A711 PolarHBondContact O-N 2.73Å; I708-L712 PolarHBondContact O-N 2.63Å
709	P	88.1	Confident	86.9	Confident	11 Å²	11	75.6 Å²	75.6	7%	0.071	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-26	174.9	23.6	-31.4	0	0	0	113	Y706 L712 L713 L803 A806 T807 L810	Y706-P709 WeakPolarHBondContact O-CD 3.43Å; Y706-P709 WeakPolarHBondContact O-CG 3.46Å; P709-L712 PolarHBondContact O-N 2.93Å; P709-L713 WeakPolarHBondContact O-CB 3.33Å; P709-L713 PolarHBondContact O-N 3.14Å; P709-L803 HydrophobicContact CB-CD2 3.72Å; P709-A806 HydrophobicContact CB-CB 4.36Å; P709-A806 HydrophobicContact CG-CB 4.43Å; P709-T807 HydrophobicContact CB-CG2 3.93Å; P709-T807 HydrophobicContact CG-CG2 3.79Å; P709-L810 HydrophobicContact CG-CD1 3.9Å
710	L	88.6	Confident	86.8	Confident	61 Å²	61	78.8 Å²	78.8	32%	0.319	39%	0.386	S	S	.	.	H	α-helix	trans	-65.6	-44.4	173.1	-174	63.9	0	0	0	111.8	Y706 M707 I708 L712 L713 L714 T807	Y706-L710 WeakPolarHBondContact O-CB 3.44Å; Y706-L710 PolarHBondContact O-N 2.83Å; Y706-L710 VanDerWaalsContact O-N 3.14Å; M707-L710 HydrophobicContact SD-CD2 4Å; I708-L710 PolarHBondContact O-N 2.84Å; L710-L712 VanDerWaalsContact C-N 3.33Å; L710-L712 PolarHBondContact O-N 3.33Å; L710-L713 PolarHBondContact O-N 3.24Å; L710-L714 WeakPolarHBondContact O-CG 3.26Å; L710-L714 PolarHBondContact O-N 3.39Å; L710-T807 HydrophobicContact CB-CG2 3.78Å; L710-T807 HydrophobicContact CD1-CG2 4.4Å; L710-T807 VanDerWaalsContact N-CG2 3.33Å
711	A	88.3	Confident	86.4	Confident	51 Å²	51	80.4 Å²	80.4	42%	0.421	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-37.7	175.9	0	0	0	0	0	112.1	M707 I708 L714 I715	M707-A711 VanDerWaalsContact O-CB 3.26Å; M707-A711 WeakPolarHBondContact O-CB 3.49Å; M707-A711 PolarHBondContact O-N 2.71Å; I708-A711 PolarHBondContact O-N 2.73Å; A711-L714 PolarHBondContact O-N 3.48Å; A711-I715 WeakPolarHBondContact O-CG1 3.47Å; A711-I715 PolarHBondContact O-N 2.95Å; A711-I715 VanDerWaalsContact O-N 3.15Å
712	L	89.6	Confident	85.8	Confident	68 Å²	68	77.2 Å²	77.2	36%	0.356	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-44.1	171.7	-66.3	176.8	0	0	0	111.6	I708 P709 L710 L714 I715 F716 F788 L803	I708-L712 PolarHBondContact O-N 2.63Å; P709-L712 PolarHBondContact O-N 2.93Å; L710-L712 VanDerWaalsContact C-N 3.33Å; L710-L712 PolarHBondContact O-N 3.33Å; L712-L714 VanDerWaalsContact C-N 3.32Å; L712-L714 PolarHBondContact O-N 3.13Å; L712-I715 WeakPolarHBondContact O-CB 3.31Å; L712-I715 PolarHBondContact O-N 3.03Å; L712-I715 VanDerWaalsContact O-N 3.11Å; L712-F716 WeakPolarHBondContact O-CD2 3.26Å; L712-F716 PolarHBondContact O-N 2.91Å; L712-F716 VanDerWaalsContact O-N 3.14Å; L712-F788 HydrophobicContact CD2-CZ 4.28Å; L712-L803 HydrophobicContact CB-CD1 4Å; L712-L803 HydrophobicContact CB-CD2 4.28Å; L712-L803 HydrophobicContact CD1-CD2 4.13Å
713	L	90.3	Very high	84.3	Confident	29 Å²	29	77.5 Å²	77.5	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-62.6	-38.2	176	-171.1	152	0	0	0	111.6	P709 L710 I715 F716 V717 L803 A804	P709-L713 WeakPolarHBondContact O-CB 3.33Å; P709-L713 PolarHBondContact O-N 3.14Å; L710-L713 PolarHBondContact O-N 3.24Å; L713-I715 VanDerWaalsContact C-N 3.29Å; L713-I715 PolarHBondContact O-N 3.35Å; L713-F716 WeakPolarHBondContact O-CB 3.08Å; L713-F716 PolarHBondContact O-N 3.28Å; L713-V717 HydrophobicContact CD2-CG2 3.8Å; L713-V717 WeakPolarHBondContact O-CG2 3.28Å; L713-V717 PolarHBondContact O-N 3.02Å; L713-L803 HydrophobicContact CB-CB 4.46Å; L713-L803 HydrophobicContact CD1-CB 4.37Å; L713-A804 HydrophobicContact CD1-CB 3.87Å
714	L	88.8	Confident	82.9	Confident	104 Å²	104	78.6 Å²	78.6	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-31.3	173.1	-71.9	173.1	0	0	0	112.8	L710 A711 L712 Y718	L710-L714 WeakPolarHBondContact O-CG 3.26Å; L710-L714 PolarHBondContact O-N 3.39Å; A711-L714 PolarHBondContact O-N 3.48Å; L712-L714 VanDerWaalsContact C-N 3.32Å; L712-L714 PolarHBondContact O-N 3.13Å; L714-Y718 VanDerWaalsContact O-CB 3.22Å; L714-Y718 WeakPolarHBondContact O-CB 3.19Å; L714-Y718 PolarHBondContact O-N 2.89Å
715	I	88.2	Confident	80.5	Confident	79 Å²	79	83 Å²	83	41%	0.405	42%	0.419	S	S	.	.	H	α-helix	trans	-68.7	-43.6	171.9	-64.9	165.8	0	0	0	110.8	A711 L712 L713 V717 Y718 N719 F788	A711-I715 WeakPolarHBondContact O-CG1 3.47Å; A711-I715 PolarHBondContact O-N 2.95Å; A711-I715 VanDerWaalsContact O-N 3.15Å; L712-I715 WeakPolarHBondContact O-CB 3.31Å; L712-I715 PolarHBondContact O-N 3.03Å; L712-I715 VanDerWaalsContact O-N 3.11Å; L713-I715 VanDerWaalsContact C-N 3.29Å; L713-I715 PolarHBondContact O-N 3.35Å; I715-V717 VanDerWaalsContact C-N 3.35Å; I715-V717 PolarHBondContact O-N 2.89Å; I715-Y718 PolarHBondContact O-N 3.48Å; I715-N719 WeakPolarHBondContact O-CB 3.24Å; I715-N719 PolarHBondContact O-N 3.45Å; I715-F788 HydrophobicContact CG2-CD1 3.84Å; I715-F788 HydrophobicContact CG2-CE1 4.2Å; I715-F788 HydrophobicContact CG2-CG 4.5Å
716	F	86.8	Confident	78.6	Confident	7 Å²	7	83 Å²	83	3%	0.031	44%	0.438	C	S	.	.	H	α-helix	trans	-58.4	-46	172.6	-83	-84.4	0	0	0	111.7	L712 L713 N719 F720 T787 F788 W790 A799 L803	L712-F716 WeakPolarHBondContact O-CD2 3.26Å; L712-F716 PolarHBondContact O-N 2.91Å; L712-F716 VanDerWaalsContact O-N 3.14Å; L713-F716 WeakPolarHBondContact O-CB 3.08Å; L713-F716 PolarHBondContact O-N 3.28Å; F716-N719 PolarHBondContact O-N 3.05Å; F716-F720 WeakPolarHBondContact O-CB 3.16Å; F716-F720 PolarHBondContact O-N 2.88Å; F716-T787 HydrophobicContact CE1-CG2 4.04Å; F716-T787 VanDerWaalsContact CE1-O 3.3Å; F716-T787 WeakPolarHBondContact CE1-O 3.39Å; F716-T787 HydrophobicContact CZ-CG2 3.89Å; F716-F788 HydrophobicContact CD1-CD1 4.37Å; F716-F788 AromaticContact CD2-CD1 3.79Å; F716-F788 HydrophobicContact CD2-CD1 3.79Å; F716-F788 AromaticContact CD2-CE1 3.74Å; F716-F788 HydrophobicContact CD2-CE1 3.74Å; F716-F788 HydrophobicContact CE1-CD1 4.18Å; F716-F788 AromaticContact CE2-CD1 3.55Å; F716-F788 HydrophobicContact CE2-CD1 3.55Å; F716-F788 AromaticContact CE2-CE1 3.33Å; F716-F788 HydrophobicContact CE2-CE1 3.33Å; F716-F788 HydrophobicContact CE2-CZ 4.24Å; F716-F788 HydrophobicContact CG-CD1 4.18Å; F716-F788 AromaticContact CZ-CD1 3.77Å; F716-F788 HydrophobicContact CZ-CD1 3.77Å; F716-F788 AromaticContact CZ-CE1 3.91Å; F716-F788 HydrophobicContact CZ-CE1 3.91Å; F716-F788 HydrophobicContact CZ-CG 4.44Å; F716-W790 HydrophobicContact CB-CZ2 4.18Å; F716-W790 HydrophobicContact CD1-CZ2 4.2Å; F716-W790 PolarHBondContact O-NE1 2.89Å; F716-A799 HydrophobicContact CE1-CB 4.39Å; F716-A799 HydrophobicContact CZ-CB 3.92Å; F716-L803 HydrophobicContact CD2-CD1 3.87Å; F716-L803 HydrophobicContact CE2-CD1 3.63Å
717	V	85.8	Confident	75.9	Confident	50 Å²	50	89.1 Å²	89.1	30%	0.303	47%	0.465	S	S	.	.	H	α-helix	trans	-67.2	-39.9	179	170.5	0	0	0	0	111.5	L713 I715 F720 I721	L713-V717 HydrophobicContact CD2-CG2 3.8Å; L713-V717 WeakPolarHBondContact O-CG2 3.28Å; L713-V717 PolarHBondContact O-N 3.02Å; I715-V717 VanDerWaalsContact C-N 3.35Å; I715-V717 PolarHBondContact O-N 2.89Å; V717-F720 PolarHBondContact O-N 3.36Å; V717-I721 HydrophobicContact CG1-CD1 3.49Å; V717-I721 VanDerWaalsContact CG1-CD1 3.49Å; V717-I721 HydrophobicContact CG1-CG1 4.1Å; V717-I721 WeakPolarHBondContact O-CB 3.32Å; V717-I721 WeakPolarHBondContact O-CG1 3.3Å; V717-I721 PolarHBondContact O-N 2.89Å
718	Y	87.5	Confident	73.3	Confident	126 Å²	126	92.4 Å²	92.4	49%	0.494	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-45	174	176.5	-100.4	0	0	0	111.8	L714 I715 F720 R722	L714-Y718 VanDerWaalsContact O-CB 3.22Å; L714-Y718 WeakPolarHBondContact O-CB 3.19Å; L714-Y718 PolarHBondContact O-N 2.89Å; I715-Y718 PolarHBondContact O-N 3.48Å; Y718-F720 VanDerWaalsContact C-N 3.27Å; Y718-F720 PolarHBondContact O-N 2.79Å; Y718-R722 WeakPolarHBondContact O-CB 3.37Å; Y718-R722 PolarHBondContact O-N 3.13Å; Y718-R722 PolarHBondContact OH-NH1 2.87Å; Y718-R722 VanDerWaalsContact OH-NH1 3.13Å
719	N	83.5	Confident	70.4	Confident	47 Å²	47	91 Å²	91	25%	0.251	49%	0.487	S	S	.	.	H	α-helix	trans	-71.7	-18.4	177.2	-70	-11.5	0	0	0	113.7	I715 F716 F788	I715-N719 WeakPolarHBondContact O-CB 3.24Å; I715-N719 PolarHBondContact O-N 3.45Å; F716-N719 PolarHBondContact O-N 3.05Å; N719-F788 VanDerWaalsContact CB-O 3.23Å; N719-F788 WeakPolarHBondContact CB-O 3.27Å; N719-F788 PolarHBondContact ND2-O 3.27Å
720	F	81.6	Confident	67.8	Low	136 Å²	136	94.8 Å²	94.8	60%	0.596	51%	0.513	S	S	*	.	H	α-helix	trans	-83.1	-49.9	172	-175	-95.4	0	0	0	111.7	F716 V717 Y718 W790	F716-F720 WeakPolarHBondContact O-CB 3.16Å; F716-F720 PolarHBondContact O-N 2.88Å; V717-F720 PolarHBondContact O-N 3.36Å; Y718-F720 VanDerWaalsContact C-N 3.27Å; Y718-F720 PolarHBondContact O-N 2.79Å; F720-W790 HydrophobicContact CB-CZ2 4.23Å; F720-W790 HydrophobicContact CD2-CD2 4.01Å; F720-W790 AromaticContact CD2-CE2 3.92Å; F720-W790 HydrophobicContact CD2-CE3 4.3Å; F720-W790 HydrophobicContact CD2-CG 4.45Å; F720-W790 HydrophobicContact CD2-CH2 4.47Å; F720-W790 HydrophobicContact CD2-CZ2 4.16Å; F720-W790 HydrophobicContact CG-CZ2 4.47Å
721	I	79.6	Confident	65.3	Low	120 Å²	120	99 Å²	99	62%	0.615	53%	0.534	S	S	*	.	H	α-helix	trans	-70	-36.7	-176.9	-70	178.3	0	0	0	111.4	V717 P723	V717-I721 HydrophobicContact CG1-CD1 3.49Å; V717-I721 VanDerWaalsContact CG1-CD1 3.49Å; V717-I721 HydrophobicContact CG1-CG1 4.1Å; V717-I721 WeakPolarHBondContact O-CB 3.32Å; V717-I721 WeakPolarHBondContact O-CG1 3.3Å; V717-I721 PolarHBondContact O-N 2.89Å; I721-P723 WeakPolarHBondContact O-CD 3.5Å
722	R	75.8	Confident	62.4	Low	157 Å²	157	104.7 Å²	104.7	59%	0.592	55%	0.552	S	S	*	*	S	Bend	trans	-75.6	99	171.9	-172.3	-177.3	-164.7	-174	4.8	107.6	Y718	Y718-R722 WeakPolarHBondContact O-CB 3.37Å; Y718-R722 PolarHBondContact O-N 3.13Å; Y718-R722 PolarHBondContact OH-NH1 2.87Å; Y718-R722 VanDerWaalsContact OH-NH1 3.13Å
723	P	52.1	Low	59.5	Low	98 Å²	98	108.5 Å²	108.5	64%	0.636	57%	0.573	S	S	*	*			trans	-65.6	152.9	-179.4	-8.9	28.4	0	0	0	107.2	I721 K725	I721-P723 WeakPolarHBondContact O-CD 3.5Å; P723-K725 PolarHBondContact O-N 3.11Å
724	V	54.2	Low	56.8	Low	138 Å²	138	112 Å²	112	84%	0.836	60%	0.6	S	S	*	*			trans	-65.9	88	168.4	-179.4	0	0	0	0	107.4	G726	V724-G726 WeakPolarHBondContact O-CA 3.48Å; V724-G726 PolarHBondContact O-N 3.1Å
725	K	36.8	Very low	54.1	Low	195 Å²	195	115 Å²	115	85%	0.848	61%	0.611	S	S	*	*			trans	-55.2	111.1	-178.4	-143.6	-175.5	-172.6	-172.3	0	106.4	P723 K727	P723-K725 PolarHBondContact O-N 3.11Å; K725-K727 PolarHBondContact O-N 3.29Å
726	G	41.8	Very low	51.2	Low	80 Å²	80	120.1 Å²	120.1	83%	0.825	63%	0.633	S	S	*	*			trans	-53.5	98.1	-151.9	0	0	0	0	0	113.7	V724	V724-G726 WeakPolarHBondContact O-CA 3.48Å; V724-G726 PolarHBondContact O-N 3.1Å
727	K	30.3	Very low	48.4	Very low	164 Å²	164	123.8 Å²	123.8	71%	0.713	66%	0.66	S	S	*	*			trans	-104.7	94.7	167.7	-152.2	-175.5	-175.4	-162	0	108.3	K725 S729	K725-K727 PolarHBondContact O-N 3.29Å; K727-S729 PolarHBondContact O-N 2.89Å
728	V	34.1	Very low	45.6	Very low	134 Å²	134	126.4 Å²	126.4	81%	0.812	68%	0.676	S	S	*	*			trans	-66.2	84.6	152.5	179.7	0	0	0	0	106.2
729	S	27.7	Very low	42.8	Very low	57 Å²	57	127.3 Å²	127.3	40%	0.399	69%	0.69	S	S	.	*			trans	-117.2	46.8	157.9	62	0	0	0	0	108.7	K727	K727-S729 PolarHBondContact O-N 2.89Å
730	S	32.8	Very low	40.5	Very low	89 Å²	89	132 Å²	132	62%	0.622	71%	0.713	S	S	*	*	S	Bend	trans	-92	151.5	146.9	-173.2	0	0	0	0	106.5
731	I	35.8	Very low	38.1	Very low	149 Å²	149	132.4 Å²	132.4	76%	0.764	72%	0.722	S	S	*	*	S	Bend	trans	81.6	2.8	178.1	-47.8	158	0	0	0	115.6
732	Q	27.3	Very low	36.2	Very low	172 Å²	172	135 Å²	135	80%	0.804	74%	0.737	S	S	*	*	S	Bend	trans	-143.5	30.3	177.3	-139.6	169.6	14.1	0	0	117.6
733	D	29.4	Very low	34.3	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	75%	0.747	S	S	*	*	S	Bend	trans	-127.2	24.5	165.4	-81.1	-51.8	0	0	0	110.8
734	S	33.8	Very low	33.5	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	76%	0.756	S	S	*	*	S	Bend	trans	-134.2	23.5	-174.9	63.4	0	0	0	0	113.2
735	Q	31.3	Very low	32.5	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	76%	0.755	S	S	*	*			trans	-147	45.7	178.5	-158.8	173.3	-4.9	0	0	111.9
736	E	28.1	Very low	32.7	Very low	185 Å²	185	139.7 Å²	139.7	86%	0.864	76%	0.756	S	S	*	*			trans	-95.5	79.7	142	-80.4	-170.8	146	0	0	107.2	T738	E736-T738 PolarHBondContact O-N 2.84Å; E736-T738 VanDerWaalsContact O-N 3.14Å
737	S	26.3	Very low	32.3	Very low	84 Å²	84	144 Å²	144	59%	0.587	76%	0.76	S	S	*	*			trans	-69.7	89.6	148.6	48.5	0	0	0	0	106.4	D739	S737-D739 VanDerWaalsContact C-N 3.34Å; S737-D739 PolarHBondContact O-N 2.89Å; S737-D739 VanDerWaalsContact O-N 3.12Å
738	T	27.7	Very low	32.8	Very low	105 Å²	105	141.6 Å²	141.6	64%	0.644	76%	0.755	S	S	*	*			trans	-65.7	105.8	154.2	48	0	0	0	0	106	E736 I740	E736-T738 PolarHBondContact O-N 2.84Å; E736-T738 VanDerWaalsContact O-N 3.14Å; T738-I740 PolarHBondContact O-N 2.79Å; T738-I740 VanDerWaalsContact O-N 3.11Å
739	D	29.9	Very low	33.1	Very low	146 Å²	146	143.4 Å²	143.4	78%	0.781	75%	0.752	S	S	*	*			trans	-54.8	117	162.7	-55.6	-54	0	0	0	106.8	S737	S737-D739 VanDerWaalsContact C-N 3.34Å; S737-D739 PolarHBondContact O-N 2.89Å; S737-D739 VanDerWaalsContact O-N 3.12Å
740	I	34.2	Very low	33.4	Very low	144 Å²	144	149.4 Å²	149.4	74%	0.738	77%	0.773	S	S	*	*			trans	-120.4	117	166.6	-65.4	177.1	0	0	0	102.3	T738	T738-I740 PolarHBondContact O-N 2.79Å; T738-I740 VanDerWaalsContact O-N 3.11Å
741	D	32.1	Very low	34.1	Very low	146 Å²	146	150.6 Å²	150.6	78%	0.781	78%	0.782	S	S	*	*			trans	-55.4	140.4	-169.4	-62.2	-75.5	0	0	0	112.6	E743	D741-E743 PolarHBondContact O-N 2.84Å; D741-E743 VanDerWaalsContact O-N 3.14Å
742	D	38.4	Very low	34.2	Very low	175 Å²	175	148.9 Å²	148.9	94%	0.936	77%	0.77	S	S	*	*			trans	-72.7	91.5	163.8	-76	-57.2	0	0	0	108.4
743	E	37.2	Very low	35	Very low	173 Å²	173	147.8 Å²	147.8	81%	0.808	76%	0.763	S	S	*	*			trans	-148.5	149.1	167.2	-126.6	166.6	-139	0	0	111.8	D741	D741-E743 PolarHBondContact O-N 2.84Å; D741-E743 VanDerWaalsContact O-N 3.14Å
744	E	33.6	Very low	36.1	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.813	77%	0.769	S	S	*	*			trans	61.7	124.1	179.4	-56.9	-176	175.7	0	0	117.8
745	D	33.6	Very low	37	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	76%	0.758	S	S	*	*			cis	-162.1	167.3	-17	-128.4	-22.7	0	0	0	110.6
746	E	40.9	Very low	38.2	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	74%	0.743	S	S	*	*			trans	-74.3	132.4	160.9	-72.8	-167.5	128.4	0	0	110
747	D	34	Very low	39.7	Very low	171 Å²	171	140.4 Å²	140.4	91%	0.914	73%	0.726	S	S	*	*			trans	-148.8	141.9	145.6	-142.1	-14.3	0	0	0	111.6
748	D	40	Very low	41.2	Very low	112 Å²	112	143.2 Å²	143.2	60%	0.599	73%	0.73	S	S	*	*			trans	-120.1	145.2	-159.3	-172.3	24.6	0	0	0	112.4
749	K	40.9	Very low	42.9	Very low	173 Å²	173	146.4 Å²	146.4	75%	0.752	73%	0.73	S	S	*	*			trans	59.5	127	174.5	-54.2	165.1	-169.4	93	0	117.4
750	E	34	Very low	44.6	Very low	183 Å²	183	144.4 Å²	144.4	86%	0.855	72%	0.718	S	S	*	*				-146.6	135.7	98.6	-157.9	170.7	-149.5	0	0	111.8
751	S	48.3	Very low	46.1	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	71%	0.709	S	S	*	*			trans	-107.6	101.3	-176.4	62.2	0	0	0	0	111.7
752	E	38.3	Very low	47.6	Very low	112 Å²	112	142.9 Å²	142.9	52%	0.523	70%	0.7	S	S	.	*			trans	-130.6	133.6	175.6	-88.6	-125.9	103.9	0	0	115.5
753	K	42.7	Very low	49.4	Very low	149 Å²	149	138.6 Å²	138.6	65%	0.648	68%	0.68	S	S	*	*			trans	65.5	111	156.2	-70.6	149.8	179.3	148.2	0	117.4	G755 L756	K753-G755 PolarHBondContact O-N 3.39Å; K753-L756 PolarHBondContact O-N 3.2Å
754	K	53.5	Low	51	Low	213 Å²	213	134.5 Å²	134.5	93%	0.926	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	27.5	-178.1	-59.1	179.4	177.9	178.7	0	116.1
755	G	51.5	Low	52.9	Low	47 Å²	47	130 Å²	130	49%	0.485	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.2	-3.1	171.6	0	0	0	0	0	114.2	K753	K753-G755 PolarHBondContact O-N 3.39Å
756	L	56.3	Low	55.1	Low	87 Å²	87	127.6 Å²	127.6	46%	0.455	63%	0.629	S	S	.	*	S	Bend	trans	-87	-25.7	178.1	-65.7	177.5	0	0	0	113.3	K753 E758 R759 I760	K753-L756 PolarHBondContact O-N 3.2Å; L756-E758 PolarHBondContact O-N 2.81Å; L756-R759 CarbonylContact O-C 3.55Å; L756-R759 WeakPolarHBondContact O-CA 3.32Å; L756-R759 WeakPolarHBondContact O-CB 3.17Å; L756-R759 PolarHBondContact O-N 2.88Å; L756-I760 HydrophobicContact CB-CD1 4.46Å; L756-I760 WeakPolarHBondContact O-CG1 3.23Å; L756-I760 PolarHBondContact O-N 2.82Å
757	I	59.6	Low	57	Low	101 Å²	101	121.1 Å²	121.1	52%	0.518	60%	0.602	S	S	.	*	H	α-helix	trans	-61.5	-41.6	-176.6	-74.4	171.4	0	0	0	112.2	R759 I760 Y761	I757-R759 VanDerWaalsContact C-N 3.29Å; I757-R759 PolarHBondContact O-N 2.78Å; I757-I760 PolarHBondContact O-N 3.24Å; I757-Y761 HydrophobicContact CG2-CD2 3.71Å; I757-Y761 HydrophobicContact CG2-CE2 3.36Å; I757-Y761 VanDerWaalsContact O-CD2 3.25Å; I757-Y761 WeakPolarHBondContact O-CD2 3.43Å; I757-Y761 PolarHBondContact O-N 2.8Å
758	E	59.2	Low	59	Low	143 Å²	143	114.5 Å²	114.5	67%	0.668	57%	0.568	S	S	*	*	H	α-helix	trans	-62.5	-36.2	173	-67.1	-174.1	149.4	0	0	112.3	L756 M762	L756-E758 PolarHBondContact O-N 2.81Å; E758-M762 WeakPolarHBondContact O-CB 3.13Å; E758-M762 VanDerWaalsContact O-CG 3.27Å; E758-M762 WeakPolarHBondContact O-CG 3.3Å; E758-M762 PolarHBondContact O-N 3.26Å
759	R	63	Low	60.9	Low	172 Å²	172	112.7 Å²	112.7	65%	0.649	56%	0.562	S	S	*	*	H	α-helix	trans	-71.1	-36.5	176	-65.6	-175.8	177.5	178.6	0.1	112.2	L756 I757 M762 V763	L756-R759 CarbonylContact O-C 3.55Å; L756-R759 WeakPolarHBondContact O-CA 3.32Å; L756-R759 WeakPolarHBondContact O-CB 3.17Å; L756-R759 PolarHBondContact O-N 2.88Å; I757-R759 VanDerWaalsContact C-N 3.29Å; I757-R759 PolarHBondContact O-N 2.78Å; R759-M762 PolarHBondContact O-N 2.89Å; R759-V763 WeakPolarHBondContact O-CB 3.4Å; R759-V763 VanDerWaalsContact O-CG2 3.28Å; R759-V763 WeakPolarHBondContact O-CG2 3.25Å; R759-V763 PolarHBondContact O-N 2.76Å
760	I	65.9	Low	63	Low	104 Å²	104	108.2 Å²	108.2	53%	0.533	55%	0.549	S	S	.	.	H	α-helix	trans	-64.2	-46.5	174.6	-68.6	163.9	0	0	0	109.2	L756 I757 V763 Q764	L756-I760 HydrophobicContact CB-CD1 4.46Å; L756-I760 WeakPolarHBondContact O-CG1 3.23Å; L756-I760 PolarHBondContact O-N 2.82Å; I757-I760 PolarHBondContact O-N 3.24Å; I760-V763 CarbonylContact O-C 3.58Å; I760-V763 PolarHBondContact O-N 3.34Å; I760-Q764 WeakPolarHBondContact O-CB 3.34Å; I760-Q764 PolarHBondContact O-N 3.14Å
761	Y	65.3	Low	65.3	Low	140 Å²	140	99.8 Å²	99.8	55%	0.549	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.8	-70.9	-50.9	0	0	0	113	I757 Q764 D765	I757-Y761 HydrophobicContact CG2-CD2 3.71Å; I757-Y761 HydrophobicContact CG2-CE2 3.36Å; I757-Y761 VanDerWaalsContact O-CD2 3.25Å; I757-Y761 WeakPolarHBondContact O-CD2 3.43Å; I757-Y761 PolarHBondContact O-N 2.8Å; Y761-Q764 WeakPolarHBondContact O-CB 3.48Å; Y761-Q764 PolarHBondContact O-N 3.34Å; Y761-D765 WeakPolarHBondContact O-CB 3.42Å; Y761-D765 PolarHBondContact O-N 2.95Å
762	M	63.9	Low	67	Low	119 Å²	119	98.2 Å²	98.2	59%	0.586	49%	0.492	S	S	*	.	H	α-helix	trans	-63.8	-40.1	173.3	-74.6	177.4	-175.3	0	0	112.2	E758 R759 Q764 D765 I766	E758-M762 WeakPolarHBondContact O-CB 3.13Å; E758-M762 VanDerWaalsContact O-CG 3.27Å; E758-M762 WeakPolarHBondContact O-CG 3.3Å; E758-M762 PolarHBondContact O-N 3.26Å; R759-M762 PolarHBondContact O-N 2.89Å; M762-Q764 VanDerWaalsContact C-N 3.3Å; M762-D765 PolarHBondContact O-N 3.03Å; M762-I766 WeakPolarHBondContact O-CB 3.18Å; M762-I766 WeakPolarHBondContact O-CD1 3.4Å; M762-I766 WeakPolarHBondContact O-CG1 3.49Å; M762-I766 PolarHBondContact O-N 2.82Å
763	V	76.5	Confident	69.3	Low	85 Å²	85	97.3 Å²	97.3	52%	0.515	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-34	173.1	169.3	0	0	0	0	110.8	R759 I760 I766 V767	R759-V763 WeakPolarHBondContact O-CB 3.4Å; R759-V763 VanDerWaalsContact O-CG2 3.28Å; R759-V763 WeakPolarHBondContact O-CG2 3.25Å; R759-V763 PolarHBondContact O-N 2.76Å; I760-V763 CarbonylContact O-C 3.58Å; I760-V763 PolarHBondContact O-N 3.34Å; V763-I766 PolarHBondContact O-N 2.7Å; V763-V767 HydrophobicContact CG1-CG2 4.18Å; V763-V767 WeakPolarHBondContact O-CB 3.1Å; V763-V767 WeakPolarHBondContact O-CG2 3.28Å; V763-V767 PolarHBondContact O-N 3.04Å
764	Q	70.4	Confident	71.3	Confident	87 Å²	87	91.7 Å²	91.7	41%	0.407	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-44.8	174.9	-159	179.2	-7.7	0	0	111.9	L651 I760 Y761 M762 I766 V767 S768	L651-Q764 HydrophobicContact CD1-CB 4.48Å; L651-Q764 HydrophobicContact CD1-CG 3.5Å; L651-Q764 VanDerWaalsContact CD1-CG 3.5Å; I760-Q764 WeakPolarHBondContact O-CB 3.34Å; I760-Q764 PolarHBondContact O-N 3.14Å; Y761-Q764 WeakPolarHBondContact O-CB 3.48Å; Y761-Q764 PolarHBondContact O-N 3.34Å; M762-Q764 VanDerWaalsContact C-N 3.3Å; Q764-I766 VanDerWaalsContact C-N 3.34Å; Q764-V767 PolarHBondContact O-N 3.5Å; Q764-S768 WeakPolarHBondContact O-CB 3.35Å; Q764-S768 PolarHBondContact O-N 2.84Å; Q764-S768 PolarHBondContact O-OG 3.47Å
765	D	73.3	Confident	72.7	Confident	78 Å²	78	83.6 Å²	83.6	42%	0.417	43%	0.432	S	S	.	.	H	α-helix	trans	-64.5	-37.5	174.5	-73.3	-8.8	0	0	0	110.5	K426 Y761 M762 S768 T769	K426-D765 IonicContact NZ-OD2 3.52Å; Y761-D765 WeakPolarHBondContact O-CB 3.42Å; Y761-D765 PolarHBondContact O-N 2.95Å; M762-D765 PolarHBondContact O-N 3.03Å; D765-S768 WeakPolarHBondContact CA-OG 3.44Å; D765-S768 PolarHBondContact O-OG 3.17Å; D765-S768 VanDerWaalsContact O-OG 3.12Å; D765-T769 WeakPolarHBondContact O-CB 3.47Å; D765-T769 WeakPolarHBondContact O-CG2 3.23Å; D765-T769 PolarHBondContact O-N 2.88Å; D765-T769 PolarHBondContact O-OG1 3.48Å
766	I	79	Confident	74.3	Confident	103 Å²	103	87.8 Å²	87.8	53%	0.528	44%	0.439	S	S	.	.	H	α-helix	trans	-69.9	-44.2	174.7	-70.6	163.9	0	0	0	111.7	M762 V763 Q764 T769 V770	M762-I766 WeakPolarHBondContact O-CB 3.18Å; M762-I766 WeakPolarHBondContact O-CD1 3.4Å; M762-I766 WeakPolarHBondContact O-CG1 3.49Å; M762-I766 PolarHBondContact O-N 2.82Å; V763-I766 PolarHBondContact O-N 2.7Å; Q764-I766 VanDerWaalsContact C-N 3.34Å; I766-T769 WeakPolarHBondContact CA-OG1 3.36Å; I766-T769 PolarHBondContact O-N 2.82Å; I766-T769 PolarHBondContact O-OG1 3.37Å; I766-V770 HydrophobicContact CG2-CG2 4.49Å; I766-V770 WeakPolarHBondContact O-CB 3.13Å; I766-V770 VanDerWaalsContact O-CG2 3.27Å; I766-V770 WeakPolarHBondContact O-CG2 3.43Å; I766-V770 PolarHBondContact O-N 3.12Å
767	V	80.6	Confident	75.7	Confident	51 Å²	51	87.8 Å²	87.8	31%	0.309	44%	0.438	S	S	.	.	H	α-helix	trans	-68.3	-35.1	178.9	170.5	0	0	0	0	111.2	L651 L656 V763 Q764 Q771	L651-V767 HydrophobicContact CD1-CB 4.29Å; L651-V767 HydrophobicContact CD1-CG1 4.04Å; L651-V767 HydrophobicContact CD2-CG1 4.01Å; L656-V767 HydrophobicContact CD2-CG1 4.14Å; V763-V767 HydrophobicContact CG1-CG2 4.18Å; V763-V767 WeakPolarHBondContact O-CB 3.1Å; V763-V767 WeakPolarHBondContact O-CG2 3.28Å; V763-V767 PolarHBondContact O-N 3.04Å; Q764-V767 PolarHBondContact O-N 3.5Å; V767-Q771 VanDerWaalsContact O-CB 3.31Å; V767-Q771 WeakPolarHBondContact O-CB 3.5Å; V767-Q771 PolarHBondContact O-N 3.43Å
768	S	76.3	Confident	77	Confident	31 Å²	31	83 Å²	83	22%	0.217	41%	0.414	C	S	.	.	H	α-helix	trans	-72.8	-39.3	175.4	53.3	0	0	0	0	112.7	Q764 D765 Q771 N772	Q764-S768 WeakPolarHBondContact O-CB 3.35Å; Q764-S768 PolarHBondContact O-N 2.84Å; Q764-S768 PolarHBondContact O-OG 3.47Å; D765-S768 WeakPolarHBondContact CA-OG 3.44Å; D765-S768 PolarHBondContact O-OG 3.17Å; D765-S768 VanDerWaalsContact O-OG 3.12Å; S768-Q771 PolarHBondContact O-N 3.36Å; S768-N772 WeakPolarHBondContact O-CB 3.45Å; S768-N772 PolarHBondContact O-N 3.2Å; S768-N772 PolarHBondContact O-OD1 2.86Å
769	T	81.1	Confident	78.3	Confident	75 Å²	75	76.7 Å²	76.7	46%	0.46	39%	0.386	S	S	.	.	H	α-helix	trans	-64.9	-40.4	171.8	47.1	0	0	0	0	112.2	D765 I766 N772 I773	D765-T769 WeakPolarHBondContact O-CB 3.47Å; D765-T769 WeakPolarHBondContact O-CG2 3.23Å; D765-T769 PolarHBondContact O-N 2.88Å; D765-T769 PolarHBondContact O-OG1 3.48Å; I766-T769 WeakPolarHBondContact CA-OG1 3.36Å; I766-T769 PolarHBondContact O-N 2.82Å; I766-T769 PolarHBondContact O-OG1 3.37Å; T769-N772 PolarHBondContact O-N 2.95Å; T769-I773 WeakPolarHBondContact O-CB 3.47Å; T769-I773 WeakPolarHBondContact O-CD1 3.37Å; T769-I773 VanDerWaalsContact O-CG1 3.24Å; T769-I773 WeakPolarHBondContact O-CG1 3.32Å; T769-I773 PolarHBondContact O-N 3.25Å
770	V	85.2	Confident	79.4	Confident	78 Å²	78	72.6 Å²	72.6	47%	0.473	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-42.5	171.9	169.3	0	0	0	0	111.8	I766 I773 L774	I766-V770 HydrophobicContact CG2-CG2 4.49Å; I766-V770 WeakPolarHBondContact O-CB 3.13Å; I766-V770 VanDerWaalsContact O-CG2 3.27Å; I766-V770 WeakPolarHBondContact O-CG2 3.43Å; I766-V770 PolarHBondContact O-N 3.12Å; V770-I773 PolarHBondContact O-N 2.87Å; V770-L774 VanDerWaalsContact O-CB 3.26Å; V770-L774 WeakPolarHBondContact O-CB 3.33Å; V770-L774 PolarHBondContact O-N 3.35Å
771	Q	81.6	Confident	80.2	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.028	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-44.9	176.8	-172.3	-178.6	-32.6	0	0	111.2	L651 L656 V767 S768 L774 E775	L651-Q771 VanDerWaalsContact CD2-OE1 3.24Å; L656-Q771 HydrophobicContact CB-CG 4.41Å; L656-Q771 HydrophobicContact CD1-CB 4.04Å; L656-Q771 HydrophobicContact CD1-CG 4.04Å; V767-Q771 VanDerWaalsContact O-CB 3.31Å; V767-Q771 WeakPolarHBondContact O-CB 3.5Å; V767-Q771 PolarHBondContact O-N 3.43Å; S768-Q771 PolarHBondContact O-N 3.36Å; Q771-L774 PolarHBondContact O-N 3.31Å; Q771-E775 PolarHBondContact O-N 2.85Å
772	N	84.4	Confident	81.3	Confident	81 Å²	81	62.5 Å²	62.5	43%	0.433	33%	0.334	S	S	.	.	H	α-helix	trans	-62.2	-47.1	178.2	-67.6	-6.6	0	0	0	111.6	S768 T769 L774 E775 E776	S768-N772 WeakPolarHBondContact O-CB 3.45Å; S768-N772 PolarHBondContact O-N 3.2Å; S768-N772 PolarHBondContact O-OD1 2.86Å; T769-N772 PolarHBondContact O-N 2.95Å; N772-L774 VanDerWaalsContact C-N 3.26Å; N772-L774 PolarHBondContact O-N 3.48Å; N772-E775 PolarHBondContact O-N 2.83Å; N772-E776 WeakPolarHBondContact O-CB 3.42Å; N772-E776 WeakPolarHBondContact O-CG 3.43Å; N772-E776 PolarHBondContact O-N 2.83Å
773	I	85.4	Confident	82.5	Confident	94 Å²	94	59 Å²	59	48%	0.482	31%	0.314	S	S	.	.	H	α-helix	trans	-60.3	-38.2	176.1	-68.9	163.9	0	0	0	110.9	T769 V770 E776 I777	T769-I773 WeakPolarHBondContact O-CB 3.47Å; T769-I773 WeakPolarHBondContact O-CD1 3.37Å; T769-I773 VanDerWaalsContact O-CG1 3.24Å; T769-I773 WeakPolarHBondContact O-CG1 3.32Å; T769-I773 PolarHBondContact O-N 3.25Å; V770-I773 PolarHBondContact O-N 2.87Å; I773-E776 PolarHBondContact O-N 2.87Å; I773-I777 HydrophobicContact CG2-CD1 3.82Å; I773-I777 WeakPolarHBondContact O-CB 3.32Å; I773-I777 VanDerWaalsContact O-CG1 3.25Å; I773-I777 WeakPolarHBondContact O-CG1 3.38Å; I773-I777 PolarHBondContact O-N 2.86Å
774	L	84.6	Confident	83	Confident	30 Å²	30	57.7 Å²	57.7	16%	0.157	30%	0.304	C	S	.	.	H	α-helix	trans	-70.2	-39.4	178.4	-162.9	73.7	0	0	0	112.2	L656 D659 V660 V663 V770 Q771 N772 I777 A778	L656-L774 HydrophobicContact CD1-CD2 4.04Å; D659-L774 HydrophobicContact CB-CD2 4.01Å; D659-L774 HydrophobicContact CB-CG 4.31Å; V660-L774 HydrophobicContact CB-CD2 4.33Å; V660-L774 HydrophobicContact CG2-CD2 3.57Å; V663-L774 HydrophobicContact CB-CD1 4.03Å; V663-L774 HydrophobicContact CG1-CD1 4.26Å; V663-L774 HydrophobicContact CG2-CD1 3.63Å; V663-L774 HydrophobicContact CG2-CG 3.94Å; V770-L774 VanDerWaalsContact O-CB 3.26Å; V770-L774 WeakPolarHBondContact O-CB 3.33Å; V770-L774 PolarHBondContact O-N 3.35Å; Q771-L774 PolarHBondContact O-N 3.31Å; N772-L774 VanDerWaalsContact C-N 3.26Å; N772-L774 PolarHBondContact O-N 3.48Å; L774-I777 PolarHBondContact O-N 2.64Å; L774-A778 VanDerWaalsContact O-CB 3.23Å; L774-A778 WeakPolarHBondContact O-CB 3.3Å; L774-A778 PolarHBondContact O-N 3.11Å
775	E	83.2	Confident	83.8	Confident	44 Å²	44	58.4 Å²	58.4	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-67	-38.8	173.1	-172.5	177.7	176.1	0	0	111.7	R649 Q771 N772 S779	R649-E775 IonicContact CZ-OE1 3.49Å; R649-E775 IonicContact CZ-OE2 3.64Å; R649-E775 IonicContact NH1-OE1 2.76Å; R649-E775 PolarHBondContact NH1-OE1 3.02Å; R649-E775 IonicContact NH1-OE2 3.12Å; R649-E775 PolarHBondContact NH1-OE2 3.33Å; Q771-E775 PolarHBondContact O-N 2.85Å; N772-E775 PolarHBondContact O-N 2.83Å; E775-S779 WeakPolarHBondContact O-CB 3.39Å; E775-S779 PolarHBondContact O-N 3.12Å; E775-S779 PolarHBondContact O-OG 3Å
776	E	84.8	Confident	84.5	Confident	134 Å²	134	54.7 Å²	54.7	63%	0.626	29%	0.286	S	S	*	.	H	α-helix	trans	-60.5	-50	172.4	-77.6	-178.8	-170.6	0	0	111.2	N772 I773 S779 F780	N772-E776 WeakPolarHBondContact O-CB 3.42Å; N772-E776 WeakPolarHBondContact O-CG 3.43Å; N772-E776 PolarHBondContact O-N 2.83Å; I773-E776 PolarHBondContact O-N 2.87Å; E776-S779 PolarHBondContact O-N 2.86Å; E776-S779 PolarHBondContact O-OG 2.9Å; E776-S779 VanDerWaalsContact O-OG 3.13Å; E776-F780 WeakPolarHBondContact O-CB 3.48Å; E776-F780 PolarHBondContact O-N 3.12Å
777	I	86.4	Confident	84.8	Confident	87 Å²	87	50.2 Å²	50.2	45%	0.446	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-45.3	178	-69.1	166.6	0	0	0	111.5	V663 I773 L774 F780 G781	V663-I777 HydrophobicContact CG1-CG2 4.33Å; V663-I777 HydrophobicContact CG2-CG2 4.1Å; I773-I777 HydrophobicContact CG2-CD1 3.82Å; I773-I777 WeakPolarHBondContact O-CB 3.32Å; I773-I777 VanDerWaalsContact O-CG1 3.25Å; I773-I777 WeakPolarHBondContact O-CG1 3.38Å; I773-I777 PolarHBondContact O-N 2.86Å; L774-I777 PolarHBondContact O-N 2.64Å; I777-F780 PolarHBondContact O-N 3.14Å; I777-G781 PolarHBondContact O-N 3.48Å
778	A	86.6	Confident	85.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-49.7	178	0	0	0	0	0	111.6	R662 V663 L774 G781 E782	R662-A778 HydrophobicContact CB-CB 3.9Å; V663-A778 HydrophobicContact CG2-CB 3.81Å; L774-A778 VanDerWaalsContact O-CB 3.23Å; L774-A778 WeakPolarHBondContact O-CB 3.3Å; L774-A778 PolarHBondContact O-N 3.11Å; A778-G781 PolarHBondContact O-N 3.22Å; A778-E782 WeakPolarHBondContact O-CB 3.49Å; A778-E782 VanDerWaalsContact O-CG 3.31Å; A778-E782 WeakPolarHBondContact O-CG 3.29Å; A778-E782 PolarHBondContact O-N 3.37Å
779	S	86.1	Confident	85.4	Confident	12 Å²	12	52.6 Å²	52.6	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-35.8	-179.8	66.5	0	0	0	0	112.2	E775 E776 E782 R783	E775-S779 WeakPolarHBondContact O-CB 3.39Å; E775-S779 PolarHBondContact O-N 3.12Å; E775-S779 PolarHBondContact O-OG 3Å; E776-S779 PolarHBondContact O-N 2.86Å; E776-S779 PolarHBondContact O-OG 2.9Å; E776-S779 VanDerWaalsContact O-OG 3.13Å; S779-E782 PolarHBondContact O-N 2.98Å; S779-R783 VanDerWaalsContact O-CB 3.26Å; S779-R783 WeakPolarHBondContact O-CB 3.23Å; S779-R783 VanDerWaalsContact O-CD 3.28Å; S779-R783 WeakPolarHBondContact O-CD 3.41Å; S779-R783 WeakPolarHBondContact O-CG 3.41Å; S779-R783 PolarHBondContact O-N 3.45Å; S779-R783 PolarHBondContact OG-NH1 3.42Å
780	F	87.3	Confident	85.6	Confident	85 Å²	85	51.6 Å²	51.6	37%	0.373	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-47.6	175.5	-179.7	-106.5	0	0	0	112.2	E776 I777 E782 R783 I784 L843 L846	E776-F780 WeakPolarHBondContact O-CB 3.48Å; E776-F780 PolarHBondContact O-N 3.12Å; I777-F780 PolarHBondContact O-N 3.14Å; F780-E782 PolarHBondContact O-N 3.48Å; F780-R783 PolarHBondContact O-N 3.07Å; F780-I784 HydrophobicContact CD1-CD1 3.99Å; F780-I784 HydrophobicContact CE1-CD1 3.52Å; F780-I784 HydrophobicContact CE2-CD1 4.18Å; F780-I784 HydrophobicContact CZ-CD1 3.63Å; F780-I784 WeakPolarHBondContact O-CG1 3.21Å; F780-I784 PolarHBondContact O-N 3.42Å; F780-L843 HydrophobicContact CD2-CD2 4.24Å; F780-L843 HydrophobicContact CE2-CD2 3.59Å; F780-L843 HydrophobicContact CZ-CD2 4.38Å; F780-L846 HydrophobicContact CD2-CD1 4.23Å; F780-L846 HydrophobicContact CE2-CD1 3.53Å; F780-L846 HydrophobicContact CZ-CD1 4.2Å
781	G	83.2	Confident	85.3	Confident	20 Å²	20	50.4 Å²	50.4	21%	0.206	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-40.8	175.9	0	0	0	0	0	112.9	I777 A778 K785	I777-G781 PolarHBondContact O-N 3.48Å; A778-G781 PolarHBondContact O-N 3.22Å; G781-K785 WeakPolarHBondContact O-CB 3.49Å; G781-K785 PolarHBondContact O-N 3.09Å; G781-K785 VanDerWaalsContact O-N 3.13Å
782	E	87.8	Confident	85.4	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-62.9	-43.7	172.4	-74.3	169.7	-171.5	0	0	112.1	R662 A778 S779 F780 I784 K785 N786 S851 D852	R662-E782 IonicContact CZ-OE1 3.9Å; R662-E782 IonicContact CZ-OE2 3.05Å; R662-E782 IonicContact NE-OE1 2.7Å; R662-E782 PolarHBondContact NE-OE1 2.65Å; R662-E782 IonicContact NE-OE2 3.13Å; R662-E782 VanDerWaalsContact NH2-CD 3.32Å; R662-E782 IonicContact NH2-OE1 3.7Å; R662-E782 PolarHBondContact NH2-OE1 2.87Å; R662-E782 IonicContact NH2-OE2 3.11Å; R662-E782 PolarHBondContact NH2-OE2 2.93Å; A778-E782 WeakPolarHBondContact O-CB 3.49Å; A778-E782 VanDerWaalsContact O-CG 3.31Å; A778-E782 WeakPolarHBondContact O-CG 3.29Å; A778-E782 PolarHBondContact O-N 3.37Å; S779-E782 PolarHBondContact O-N 2.98Å; F780-E782 PolarHBondContact O-N 3.48Å; E782-I784 PolarHBondContact O-N 2.89Å; E782-K785 WeakPolarHBondContact O-CB 3.39Å; E782-K785 PolarHBondContact O-N 3.29Å; E782-N786 WeakPolarHBondContact O-CB 3.39Å; E782-N786 PolarHBondContact O-N 3.13Å; E782-N786 PolarHBondContact O-ND2 3.38Å; E782-N786 PolarHBondContact O-OD1 3.15Å; E782-S851 WeakPolarHBondContact OE2-CB 3.48Å; E782-D852 HydrophobicContact CG-CB 4.26Å; E782-D852 PolarHBondContact OE2-N 3.39Å
783	R	89.5	Confident	85.5	Confident	45 Å²	45	51.7 Å²	51.7	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-59.5	-43.2	177.4	-79.2	163.4	157.4	153.6	-9.8	112.7	S779 F780 N786 T787 L846 S847 V849	S779-R783 VanDerWaalsContact O-CB 3.26Å; S779-R783 WeakPolarHBondContact O-CB 3.23Å; S779-R783 VanDerWaalsContact O-CD 3.28Å; S779-R783 WeakPolarHBondContact O-CD 3.41Å; S779-R783 WeakPolarHBondContact O-CG 3.41Å; S779-R783 PolarHBondContact O-N 3.45Å; S779-R783 PolarHBondContact OG-NH1 3.42Å; F780-R783 PolarHBondContact O-N 3.07Å; R783-N786 PolarHBondContact O-N 2.83Å; R783-T787 PolarHBondContact O-N 2.83Å; R783-T787 PolarHBondContact O-OG1 2.93Å; R783-L846 HydrophobicContact CB-CD2 4.47Å; R783-L846 WeakPolarHBondContact CD-O 3.49Å; R783-L846 PolarHBondContact NE-O 3.24Å; R783-S847 PolarHBondContact NH2-O 3.25Å; R783-V849 HydrophobicContact CB-CB 4.17Å; R783-V849 HydrophobicContact CB-CG1 4.35Å; R783-V849 HydrophobicContact CG-CB 4.06Å; R783-V849 HydrophobicContact CG-CG1 4.39Å; R783-V849 WeakPolarHBondContact CG-O 3.47Å; R783-V849 PolarHBondContact NE-O 3.42Å; R783-V849 WeakPolarHBondContact O-CG1 3.37Å
784	I	87.4	Confident	85.5	Confident	59 Å²	59	49.2 Å²	49.2	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-53.7	175.4	-68.8	170.9	0	0	0	110.3	F780 E782 N786 T787 F788 L846	F780-I784 HydrophobicContact CD1-CD1 3.99Å; F780-I784 HydrophobicContact CE1-CD1 3.52Å; F780-I784 HydrophobicContact CE2-CD1 4.18Å; F780-I784 HydrophobicContact CZ-CD1 3.63Å; F780-I784 WeakPolarHBondContact O-CG1 3.21Å; F780-I784 PolarHBondContact O-N 3.42Å; E782-I784 PolarHBondContact O-N 2.89Å; I784-N786 PolarHBondContact O-N 3.08Å; I784-T787 WeakPolarHBondContact O-CB 3.28Å; I784-T787 PolarHBondContact O-N 3.36Å; I784-F788 HydrophobicContact CG2-CD2 3.93Å; I784-F788 HydrophobicContact CG2-CE2 3.75Å; I784-F788 VanDerWaalsContact O-CD2 3.31Å; I784-F788 WeakPolarHBondContact O-CD2 3.49Å; I784-F788 PolarHBondContact O-N 3.38Å; I784-F788 VanDerWaalsContact O-N 3.17Å; I784-L846 HydrophobicContact CD1-CD1 4.36Å; I784-L846 HydrophobicContact CG1-CD1 3.89Å; I784-L846 HydrophobicContact CG1-CD2 4Å
785	K	86.8	Confident	85.7	Confident	101 Å²	101	47.9 Å²	47.9	44%	0.439	24%	0.242	S	C	.	.	H	α-helix	trans	-50.7	-42.6	174.1	166	-162.9	170.1	-164.7	0	112	G781 E782 F788 N789 D852	G781-K785 WeakPolarHBondContact O-CB 3.49Å; G781-K785 PolarHBondContact O-N 3.09Å; G781-K785 VanDerWaalsContact O-N 3.13Å; E782-K785 WeakPolarHBondContact O-CB 3.39Å; E782-K785 PolarHBondContact O-N 3.29Å; K785-F788 PolarHBondContact O-N 3.03Å; K785-N789 VanDerWaalsContact O-CB 3.31Å; K785-N789 WeakPolarHBondContact O-CB 3.29Å; K785-N789 PolarHBondContact O-N 2.95Å; K785-N789 PolarHBondContact O-ND2 2.99Å; K785-D852 IonicContact NZ-OD2 2.92Å; K785-D852 PolarHBondContact NZ-OD2 3.26Å
786	N	86.8	Confident	86	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72.7	-34.3	-176.1	-72.3	-14.8	0	0	0	112.9	E782 R783 I784 N789 W790 T791 V849 P850 D852 K855	E782-N786 WeakPolarHBondContact O-CB 3.39Å; E782-N786 PolarHBondContact O-N 3.13Å; E782-N786 PolarHBondContact O-ND2 3.38Å; E782-N786 PolarHBondContact O-OD1 3.15Å; R783-N786 PolarHBondContact O-N 2.83Å; I784-N786 PolarHBondContact O-N 3.08Å; N786-N789 PolarHBondContact O-N 3.32Å; N786-W790 PolarHBondContact O-N 3Å; N786-T791 HydrophobicContact CB-CG2 4.13Å; N786-T791 WeakPolarHBondContact CB-OG1 3.48Å; N786-T791 WeakPolarHBondContact O-CG2 3.25Å; N786-T791 PolarHBondContact O-N 3.16Å; N786-T791 PolarHBondContact O-OG1 3.33Å; N786-V849 HydrophobicContact CB-CG1 3.8Å; N786-P850 PolarHBondContact ND2-O 3.34Å; N786-D852 PolarHBondContact ND2-OD1 3.06Å; N786-D852 PolarHBondContact OD1-OD1 3.15Å; N786-D852 VanDerWaalsContact OD1-OD1 3.12Å; N786-K855 WeakPolarHBondContact ND2-CE 3.29Å; N786-K855 PolarHBondContact ND2-NZ 3.41Å; N786-K855 VanDerWaalsContact ND2-NZ 3.16Å; N786-K855 PolarHBondContact OD1-NZ 3.19Å
787	T	86.9	Confident	86.2	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-51.3	170.3	-47.4	0	0	0	0	110.3	F716 R783 I784 N789 W790 S796 A799 F845 V849	F716-T787 HydrophobicContact CE1-CG2 4.04Å; F716-T787 VanDerWaalsContact CE1-O 3.3Å; F716-T787 WeakPolarHBondContact CE1-O 3.39Å; F716-T787 HydrophobicContact CZ-CG2 3.89Å; R783-T787 PolarHBondContact O-N 2.83Å; R783-T787 PolarHBondContact O-OG1 2.93Å; I784-T787 WeakPolarHBondContact O-CB 3.28Å; I784-T787 PolarHBondContact O-N 3.36Å; T787-N789 VanDerWaalsContact C-N 3.25Å; T787-N789 PolarHBondContact O-N 2.99Å; T787-W790 PolarHBondContact O-N 3.49Å; T787-S796 PolarHBondContact O-OG 3.34Å; T787-A799 HydrophobicContact CG2-CB 4.37Å; T787-F845 HydrophobicContact CG2-CE1 3.88Å; T787-F845 HydrophobicContact CG2-CZ 4.17Å; T787-V849 WeakPolarHBondContact OG1-CG2 3.31Å
788	F	85	Confident	86.3	Confident	51 Å²	51	39.1 Å²	39.1	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-66.7	-22.9	178.7	-74.6	-68.4	0	0	0	114.1	L712 I715 F716 N719 I784 K785	L712-F788 HydrophobicContact CD2-CZ 4.28Å; I715-F788 HydrophobicContact CG2-CD1 3.84Å; I715-F788 HydrophobicContact CG2-CE1 4.2Å; I715-F788 HydrophobicContact CG2-CG 4.5Å; F716-F788 HydrophobicContact CD1-CD1 4.37Å; F716-F788 AromaticContact CD2-CD1 3.79Å; F716-F788 HydrophobicContact CD2-CD1 3.79Å; F716-F788 AromaticContact CD2-CE1 3.74Å; F716-F788 HydrophobicContact CD2-CE1 3.74Å; F716-F788 HydrophobicContact CE1-CD1 4.18Å; F716-F788 AromaticContact CE2-CD1 3.55Å; F716-F788 HydrophobicContact CE2-CD1 3.55Å; F716-F788 AromaticContact CE2-CE1 3.33Å; F716-F788 HydrophobicContact CE2-CE1 3.33Å; F716-F788 HydrophobicContact CE2-CZ 4.24Å; F716-F788 HydrophobicContact CG-CD1 4.18Å; F716-F788 AromaticContact CZ-CD1 3.77Å; F716-F788 HydrophobicContact CZ-CD1 3.77Å; F716-F788 AromaticContact CZ-CE1 3.91Å; F716-F788 HydrophobicContact CZ-CE1 3.91Å; F716-F788 HydrophobicContact CZ-CG 4.44Å; N719-F788 VanDerWaalsContact CB-O 3.23Å; N719-F788 WeakPolarHBondContact CB-O 3.27Å; N719-F788 PolarHBondContact ND2-O 3.27Å; I784-F788 HydrophobicContact CG2-CD2 3.93Å; I784-F788 HydrophobicContact CG2-CE2 3.75Å; I784-F788 VanDerWaalsContact O-CD2 3.31Å; I784-F788 WeakPolarHBondContact O-CD2 3.49Å; I784-F788 PolarHBondContact O-N 3.38Å; I784-F788 VanDerWaalsContact O-N 3.17Å; K785-F788 PolarHBondContact O-N 3.03Å
789	N	84.4	Confident	86.4	Confident	82 Å²	82	39.8 Å²	39.8	44%	0.439	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	17.8	179.3	-71.6	-8.3	0	0	0	113.5	K785 N786 T787 T791	K785-N789 VanDerWaalsContact O-CB 3.31Å; K785-N789 WeakPolarHBondContact O-CB 3.29Å; K785-N789 PolarHBondContact O-N 2.95Å; K785-N789 PolarHBondContact O-ND2 2.99Å; N786-N789 PolarHBondContact O-N 3.32Å; T787-N789 VanDerWaalsContact C-N 3.25Å; T787-N789 PolarHBondContact O-N 2.99Å; N789-T791 HydrophobicContact CB-CG2 4.05Å; N789-T791 PolarHBondContact O-N 3.26Å; N789-T791 VanDerWaalsContact O-N 3.08Å
790	W	83.6	Confident	86.7	Confident	54 Å²	54	40.5 Å²	40.5	21%	0.205	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	24.4	174.1	-67.2	87.4	0	0	0	115.6	F716 F720 N786 T787 V792 S796 C800	F716-W790 HydrophobicContact CB-CZ2 4.18Å; F716-W790 HydrophobicContact CD1-CZ2 4.2Å; F716-W790 PolarHBondContact O-NE1 2.89Å; F720-W790 HydrophobicContact CB-CZ2 4.23Å; F720-W790 HydrophobicContact CD2-CD2 4.01Å; F720-W790 AromaticContact CD2-CE2 3.92Å; F720-W790 HydrophobicContact CD2-CE3 4.3Å; F720-W790 HydrophobicContact CD2-CG 4.45Å; F720-W790 HydrophobicContact CD2-CH2 4.47Å; F720-W790 HydrophobicContact CD2-CZ2 4.16Å; F720-W790 HydrophobicContact CG-CZ2 4.47Å; N786-W790 PolarHBondContact O-N 3Å; T787-W790 PolarHBondContact O-N 3.49Å; W790-V792 PolarHBondContact O-N 3.48Å; W790-S796 WeakPolarHBondContact CA-OG 3.26Å; W790-S796 VanDerWaalsContact CE3-CB 3.46Å; W790-C800 HydrophobicContact CH2-CB 4.38Å
791	T	80.6	Confident	86.9	Confident	52 Å²	52	41.8 Å²	41.8	32%	0.319	23%	0.227	S	C	.	.	S	Bend	trans	-70.8	-19	-169.5	69.8	0	0	0	0	113.7	N786 N789	N786-T791 HydrophobicContact CB-CG2 4.13Å; N786-T791 WeakPolarHBondContact CB-OG1 3.48Å; N786-T791 WeakPolarHBondContact O-CG2 3.25Å; N786-T791 PolarHBondContact O-N 3.16Å; N786-T791 PolarHBondContact O-OG1 3.33Å; N789-T791 HydrophobicContact CB-CG2 4.05Å; N789-T791 PolarHBondContact O-N 3.26Å; N789-T791 VanDerWaalsContact O-N 3.08Å
792	V	83.4	Confident	87.2	Confident	24 Å²	24	44.2 Å²	44.2	15%	0.145	24%	0.235	C	C	.	.	S	Bend	trans	-128.1	101.3	165.1	179.9	0	0	0	0	106.2	L594 W790 F794 L795 S796 P850	L594-V792 HydrophobicContact CD1-CG1 3.76Å; W790-V792 PolarHBondContact O-N 3.48Å; V792-F794 VanDerWaalsContact C-N 3.26Å; V792-F794 HydrophobicContact CG1-CB 4.42Å; V792-F794 PolarHBondContact O-N 3.33Å; V792-L795 HydrophobicContact CB-CB 4.33Å; V792-L795 HydrophobicContact CB-CD1 4.28Å; V792-L795 HydrophobicContact CG1-CB 4.23Å; V792-L795 HydrophobicContact CG1-CD1 4.1Å; V792-L795 HydrophobicContact CG1-CG 4.07Å; V792-L795 PolarHBondContact O-N 3.24Å; V792-S796 PolarHBondContact O-N 3.48Å; V792-S796 PolarHBondContact O-OG 2.98Å; V792-P850 HydrophobicContact CG2-CG 3.94Å
793	P	85.2	Confident	87.3	Confident	90 Å²	90	45.1 Å²	45.1	58%	0.584	24%	0.239	S	C	*	.	H	α-helix	trans	-57.6	-35.8	-173.9	-30	36.8	0	0	0	113.8	S796 S797	P793-S796 PolarHBondContact O-N 2.87Å; P793-S797 WeakPolarHBondContact O-CB 3.41Å; P793-S797 PolarHBondContact O-N 3.06Å
794	F	86.4	Confident	87.5	Confident	43 Å²	43	44.4 Å²	44.4	19%	0.189	24%	0.244	C	C	.	.	H	α-helix	trans	-58.3	-53.1	176.2	-177.3	-95.8	0	0	0	112.5	I566 H567 L594 P629 A632 S633 V792 L798	I566-F794 HydrophobicContact CG2-CE1 4.27Å; H567-F794 AromaticContact CE1-CE1 3.82Å; H567-F794 AromaticContact NE2-CD1 3.46Å; H567-F794 WeakPolarHBondContact NE2-CD1 3.31Å; H567-F794 AromaticContact NE2-CE1 3.74Å; L594-F794 HydrophobicContact CD1-CB 4.35Å; L594-F794 HydrophobicContact CD2-CB 4.46Å; P629-F794 HydrophobicContact CB-CE2 4.36Å; A632-F794 HydrophobicContact CB-CE1 4.46Å; A632-F794 HydrophobicContact CB-CZ 3.94Å; S633-F794 WeakPolarHBondContact OG-CZ 3.34Å; V792-F794 VanDerWaalsContact C-N 3.26Å; V792-F794 HydrophobicContact CG1-CB 4.42Å; V792-F794 PolarHBondContact O-N 3.33Å; F794-L798 VanDerWaalsContact O-CB 3.32Å; F794-L798 WeakPolarHBondContact O-CB 3.48Å; F794-L798 PolarHBondContact O-N 3.46Å
795	L	87.4	Confident	87.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-40.6	179.6	-72.6	173.8	0	0	0	112.1	H567 T636 V792 L798 A799 F845 R848 V849	H567-L795 VanDerWaalsContact NE2-CD2 3.31Å; H567-L795 WeakPolarHBondContact NE2-CD2 3.29Å; H567-L795 WeakPolarHBondContact NE2-CG 3.24Å; T636-L795 HydrophobicContact CG2-CD2 3.54Å; V792-L795 HydrophobicContact CB-CB 4.33Å; V792-L795 HydrophobicContact CB-CD1 4.28Å; V792-L795 HydrophobicContact CG1-CB 4.23Å; V792-L795 HydrophobicContact CG1-CD1 4.1Å; V792-L795 HydrophobicContact CG1-CG 4.07Å; V792-L795 PolarHBondContact O-N 3.24Å; L795-L798 PolarHBondContact O-N 2.93Å; L795-A799 WeakPolarHBondContact O-CB 3.42Å; L795-A799 PolarHBondContact O-N 3.26Å; L795-F845 HydrophobicContact CB-CE2 4.36Å; L795-F845 HydrophobicContact CB-CZ 4.04Å; L795-F845 HydrophobicContact CD2-CD2 4.24Å; L795-F845 HydrophobicContact CD2-CE2 3.76Å; L795-F845 HydrophobicContact CD2-CZ 4.18Å; L795-F845 WeakPolarHBondContact O-CZ 3.41Å; L795-R848 HydrophobicContact CD1-CB 4.21Å; L795-V849 HydrophobicContact CD1-CB 4.42Å; L795-V849 HydrophobicContact CD1-CG2 3.74Å
796	S	89.6	Confident	87.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-69.6	-37.9	-178.7	-46.9	0	0	0	0	111.4	T787 W790 V792 P793 C800	T787-S796 PolarHBondContact O-OG 3.34Å; W790-S796 WeakPolarHBondContact CA-OG 3.26Å; W790-S796 VanDerWaalsContact CE3-CB 3.46Å; V792-S796 PolarHBondContact O-N 3.48Å; V792-S796 PolarHBondContact O-OG 2.98Å; P793-S796 PolarHBondContact O-N 2.87Å; S796-C800 WeakPolarHBondContact O-CB 3.43Å; S796-C800 PolarHBondContact O-N 3.45Å
797	S	89.1	Confident	88	Confident	64 Å²	64	41.2 Å²	41.2	45%	0.448	24%	0.242	S	C	.	.	H	α-helix	trans	-68.3	-36.5	171.6	-170.5	0	0	0	0	112.4	P793 C800 L801	P793-S797 WeakPolarHBondContact O-CB 3.41Å; P793-S797 PolarHBondContact O-N 3.06Å; S797-C800 PolarHBondContact O-N 3Å; S797-L801 WeakPolarHBondContact O-CB 3.4Å; S797-L801 PolarHBondContact O-N 3.23Å
798	L	89.8	Confident	88.2	Confident	16 Å²	16	45.5 Å²	45.5	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-43.2	175.6	180	58.6	0	0	0	111.3	T636 F637 F794 L795 L801 I802 F845	T636-L798 HydrophobicContact CG2-CD2 4.15Å; F637-L798 HydrophobicContact CE2-CD2 3.97Å; F637-L798 HydrophobicContact CE2-CG 4.41Å; F637-L798 HydrophobicContact CZ-CD2 3.99Å; F637-L798 HydrophobicContact CZ-CG 4.22Å; F794-L798 VanDerWaalsContact O-CB 3.32Å; F794-L798 WeakPolarHBondContact O-CB 3.48Å; F794-L798 PolarHBondContact O-N 3.46Å; L795-L798 PolarHBondContact O-N 2.93Å; L798-L801 PolarHBondContact O-N 3.44Å; L798-I802 HydrophobicContact CD1-CD1 3.97Å; L798-I802 HydrophobicContact CD1-CG1 4.42Å; L798-I802 HydrophobicContact CG-CD1 4.06Å; L798-I802 WeakPolarHBondContact O-CG1 3.47Å; L798-I802 PolarHBondContact O-N 2.9Å; L798-F845 HydrophobicContact CD2-CE2 4.37Å
799	A	89.3	Confident	88.4	Confident	15 Å²	15	47 Å²	47	12%	0.124	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-43.8	172.5	0	0	0	0	0	111.8	F716 T787 L795 I802 L803 F845	F716-A799 HydrophobicContact CE1-CB 4.39Å; F716-A799 HydrophobicContact CZ-CB 3.92Å; T787-A799 HydrophobicContact CG2-CB 4.37Å; L795-A799 WeakPolarHBondContact O-CB 3.42Å; L795-A799 PolarHBondContact O-N 3.26Å; A799-I802 PolarHBondContact O-N 3.32Å; A799-L803 WeakPolarHBondContact O-CB 3.44Å; A799-L803 VanDerWaalsContact O-CG 3.32Å; A799-L803 WeakPolarHBondContact O-CG 3.49Å; A799-L803 PolarHBondContact O-N 2.83Å; A799-F845 HydrophobicContact CB-CZ 3.92Å
800	C	90.5	Very high	88.7	Confident	27 Å²	27	45.2 Å²	45.2	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-44.5	175.8	-170.4	0	0	0	0	112.2	W790 S796 S797 L803 A804	W790-C800 HydrophobicContact CH2-CB 4.38Å; S796-C800 WeakPolarHBondContact O-CB 3.43Å; S796-C800 PolarHBondContact O-N 3.45Å; S797-C800 PolarHBondContact O-N 3Å; C800-L803 PolarHBondContact O-N 2.91Å; C800-A804 WeakPolarHBondContact O-CB 3.08Å; C800-A804 PolarHBondContact O-N 2.78Å
801	L	91.4	Very high	88.9	Confident	111 Å²	111	49.6 Å²	49.6	58%	0.581	28%	0.281	S	S	*	.	H	α-helix	trans	-62.6	-42.8	176.7	-173.4	160.6	0	0	0	111.7	S797 L798 A804 A805	S797-L801 WeakPolarHBondContact O-CB 3.4Å; S797-L801 PolarHBondContact O-N 3.23Å; L798-L801 PolarHBondContact O-N 3.44Å; L801-A804 PolarHBondContact O-N 3.03Å; L801-A805 WeakPolarHBondContact O-CB 3.4Å; L801-A805 PolarHBondContact O-N 3.12Å
802	I	90.4	Very high	89.3	Confident	72 Å²	72	54.2 Å²	54.2	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-67.9	-39.3	177.6	-70.2	167.2	0	0	0	111.4	F637 L798 A799 A805 A806	F637-I802 HydrophobicContact CE1-CD1 4.07Å; F637-I802 HydrophobicContact CE2-CD1 3.82Å; F637-I802 HydrophobicContact CZ-CD1 3.26Å; L798-I802 HydrophobicContact CD1-CD1 3.97Å; L798-I802 HydrophobicContact CD1-CG1 4.42Å; L798-I802 HydrophobicContact CG-CD1 4.06Å; L798-I802 WeakPolarHBondContact O-CG1 3.47Å; L798-I802 PolarHBondContact O-N 2.9Å; A799-I802 PolarHBondContact O-N 3.32Å; I802-A805 PolarHBondContact O-N 2.85Å; I802-A806 VanDerWaalsContact O-CB 3.32Å; I802-A806 WeakPolarHBondContact O-CB 3.01Å; I802-A806 PolarHBondContact O-N 3.47Å
803	L	90.7	Very high	89.6	Confident	30 Å²	30	56.2 Å²	56.2	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-39.9	173.1	-72.9	170.3	0	0	0	111.8	P709 L712 L713 F716 A799 C800 A806 T807	P709-L803 HydrophobicContact CB-CD2 3.72Å; L712-L803 HydrophobicContact CB-CD1 4Å; L712-L803 HydrophobicContact CB-CD2 4.28Å; L712-L803 HydrophobicContact CD1-CD2 4.13Å; L713-L803 HydrophobicContact CB-CB 4.46Å; L713-L803 HydrophobicContact CD1-CB 4.37Å; F716-L803 HydrophobicContact CD2-CD1 3.87Å; F716-L803 HydrophobicContact CE2-CD1 3.63Å; A799-L803 WeakPolarHBondContact O-CB 3.44Å; A799-L803 VanDerWaalsContact O-CG 3.32Å; A799-L803 WeakPolarHBondContact O-CG 3.49Å; A799-L803 PolarHBondContact O-N 2.83Å; C800-L803 PolarHBondContact O-N 2.91Å; L803-A806 PolarHBondContact O-N 2.9Å; L803-T807 WeakPolarHBondContact O-CG2 3.32Å; L803-T807 PolarHBondContact O-N 2.83Å; L803-T807 PolarHBondContact O-OG1 3.24Å
804	A	92.4	Very high	89.7	Confident	31 Å²	31	55.1 Å²	55.1	26%	0.256	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-38.3	174.9	0	0	0	0	0	112.7	L713 C800 L801 A806 T807 I808	L713-A804 HydrophobicContact CD1-CB 3.87Å; C800-A804 WeakPolarHBondContact O-CB 3.08Å; C800-A804 PolarHBondContact O-N 2.78Å; L801-A804 PolarHBondContact O-N 3.03Å; A804-A806 VanDerWaalsContact C-N 3.33Å; A804-T807 PolarHBondContact O-OG1 3.02Å; A804-I808 WeakPolarHBondContact O-CD1 3.45Å; A804-I808 VanDerWaalsContact O-CG1 3.25Å; A804-I808 WeakPolarHBondContact O-CG1 3.31Å; A804-I808 PolarHBondContact O-N 3.49Å; A804-I808 VanDerWaalsContact O-N 3.15Å
805	A	91.2	Very high	89.5	Confident	39 Å²	39	56.4 Å²	56.4	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-40.3	171	0	0	0	0	0	111	L801 I802 I808 I809	L801-A805 WeakPolarHBondContact O-CB 3.4Å; L801-A805 PolarHBondContact O-N 3.12Å; I802-A805 PolarHBondContact O-N 2.85Å; A805-I808 PolarHBondContact O-N 3.26Å; A805-I809 WeakPolarHBondContact O-CB 3.44Å; A805-I809 WeakPolarHBondContact O-CD1 3.25Å; A805-I809 WeakPolarHBondContact O-CG1 3.41Å; A805-I809 PolarHBondContact O-N 3.28Å
806	A	90.2	Very high	89.5	Confident	33 Å²	33	64.4 Å²	64.4	27%	0.273	34%	0.338	S	S	.	.	H	α-helix	trans	-67.5	-38.3	177.8	0	0	0	0	0	113.2	P709 I802 L803 A804 L810	P709-A806 HydrophobicContact CB-CB 4.36Å; P709-A806 HydrophobicContact CG-CB 4.43Å; I802-A806 VanDerWaalsContact O-CB 3.32Å; I802-A806 WeakPolarHBondContact O-CB 3.01Å; I802-A806 PolarHBondContact O-N 3.47Å; L803-A806 PolarHBondContact O-N 2.9Å; A804-A806 VanDerWaalsContact C-N 3.33Å; A806-L810 VanDerWaalsContact O-CB 3.31Å; A806-L810 WeakPolarHBondContact O-CB 3.16Å; A806-L810 WeakPolarHBondContact O-CG 3.33Å; A806-L810 PolarHBondContact O-N 2.93Å
807	T	90.6	Very high	89.4	Confident	20 Å²	20	69.4 Å²	69.4	12%	0.123	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-46.4	173.3	53.2	0	0	0	0	111.2	P709 L710 L803 A804 I809 L810 Y811	P709-T807 HydrophobicContact CB-CG2 3.93Å; P709-T807 HydrophobicContact CG-CG2 3.79Å; L710-T807 HydrophobicContact CB-CG2 3.78Å; L710-T807 HydrophobicContact CD1-CG2 4.4Å; L710-T807 VanDerWaalsContact N-CG2 3.33Å; L803-T807 WeakPolarHBondContact O-CG2 3.32Å; L803-T807 PolarHBondContact O-N 2.83Å; L803-T807 PolarHBondContact O-OG1 3.24Å; A804-T807 PolarHBondContact O-OG1 3.02Å; T807-I809 PolarHBondContact O-N 2.87Å; T807-L810 PolarHBondContact O-N 2.91Å; T807-Y811 VanDerWaalsContact O-CB 3.28Å; T807-Y811 WeakPolarHBondContact O-CB 3.42Å; T807-Y811 PolarHBondContact O-N 2.64Å
808	I	91.3	Very high	89.3	Confident	99 Å²	99	69 Å²	69	51%	0.508	35%	0.35	S	S	.	.	H	α-helix	trans	-59.9	-45.8	177	-68.8	166.9	0	0	0	110.9	A804 A805 Y811 F812	A804-I808 WeakPolarHBondContact O-CD1 3.45Å; A804-I808 VanDerWaalsContact O-CG1 3.25Å; A804-I808 WeakPolarHBondContact O-CG1 3.31Å; A804-I808 PolarHBondContact O-N 3.49Å; A804-I808 VanDerWaalsContact O-N 3.15Å; A805-I808 PolarHBondContact O-N 3.26Å; I808-Y811 PolarHBondContact O-N 3.07Å; I808-F812 HydrophobicContact CG2-CD2 3.9Å; I808-F812 HydrophobicContact CG2-CE2 4.07Å; I808-F812 WeakPolarHBondContact O-CD2 3.4Å; I808-F812 PolarHBondContact O-N 3.17Å; I808-F812 VanDerWaalsContact O-N 3.09Å
809	I	89.6	Confident	89.1	Confident	82 Å²	82	72.8 Å²	72.8	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-45.6	178.4	-73.2	165.9	0	0	0	111.3	A805 T807 Y811 F812 I813 I818	A805-I809 WeakPolarHBondContact O-CB 3.44Å; A805-I809 WeakPolarHBondContact O-CD1 3.25Å; A805-I809 WeakPolarHBondContact O-CG1 3.41Å; A805-I809 PolarHBondContact O-N 3.28Å; T807-I809 PolarHBondContact O-N 2.87Å; I809-Y811 VanDerWaalsContact C-N 3.27Å; I809-Y811 PolarHBondContact O-N 3.18Å; I809-F812 PolarHBondContact O-N 3.41Å; I809-I813 HydrophobicContact CG2-CD1 4.42Å; I809-I813 WeakPolarHBondContact O-CA 3.34Å; I809-I813 VanDerWaalsContact O-CB 3.29Å; I809-I813 WeakPolarHBondContact O-CB 3.16Å; I809-I813 PolarHBondContact O-N 3.11Å; I809-I818 HydrophobicContact CG2-CD1 3.86Å
810	L	89.2	Confident	89.1	Confident	45 Å²	45	76.9 Å²	76.9	24%	0.236	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-19.5	179.1	-76.5	163.4	0	0	0	113.7	L705 P709 A806 T807 I818	L705-L810 HydrophobicContact CB-CD2 4.41Å; P709-L810 HydrophobicContact CG-CD1 3.9Å; A806-L810 VanDerWaalsContact O-CB 3.31Å; A806-L810 WeakPolarHBondContact O-CB 3.16Å; A806-L810 WeakPolarHBondContact O-CG 3.33Å; A806-L810 PolarHBondContact O-N 2.93Å; T807-L810 PolarHBondContact O-N 2.91Å; L810-I818 HydrophobicContact CD2-CD1 3.63Å; L810-I818 HydrophobicContact CG-CD1 4.25Å
811	Y	89.3	Confident	89	Confident	146 Å²	146	81 Å²	81	57%	0.573	41%	0.407	S	S	*	.	H	α-helix	trans	-77.7	-46.7	173	-179.4	-99.9	0	0	0	111.7	Y706 T807 I808 I809	Y706-Y811 AromaticContact CD1-CD2 4Å; Y706-Y811 HydrophobicContact CD1-CD2 4Å; Y706-Y811 AromaticContact CE1-CD2 3.73Å; Y706-Y811 HydrophobicContact CE1-CD2 3.73Å; Y706-Y811 HydrophobicContact CE1-CE2 4.41Å; T807-Y811 VanDerWaalsContact O-CB 3.28Å; T807-Y811 WeakPolarHBondContact O-CB 3.42Å; T807-Y811 PolarHBondContact O-N 2.64Å; I808-Y811 PolarHBondContact O-N 3.07Å; I809-Y811 VanDerWaalsContact C-N 3.27Å; I809-Y811 PolarHBondContact O-N 3.18Å
812	F	89	Confident	88.8	Confident	149 Å²	149	84.1 Å²	84.1	65%	0.654	41%	0.411	S	S	*	.	H	α-helix	trans	-86.2	-25.7	-178.6	-71.7	-66	0	0	0	114.7	I808 I809	I808-F812 HydrophobicContact CG2-CD2 3.9Å; I808-F812 HydrophobicContact CG2-CE2 4.07Å; I808-F812 WeakPolarHBondContact O-CD2 3.4Å; I808-F812 PolarHBondContact O-N 3.17Å; I808-F812 VanDerWaalsContact O-N 3.09Å; I809-F812 PolarHBondContact O-N 3.41Å
813	I	88.6	Confident	88.6	Confident	67 Å²	67	81.3 Å²	81.3	34%	0.344	40%	0.4	S	S	.	.	S	Bend	trans	-118.4	108.3	-173	-53.2	-175.9	0	0	0	110.2	I809 L815 Y817 I818	I809-I813 HydrophobicContact CG2-CD1 4.42Å; I809-I813 WeakPolarHBondContact O-CA 3.34Å; I809-I813 VanDerWaalsContact O-CB 3.29Å; I809-I813 WeakPolarHBondContact O-CB 3.16Å; I809-I813 PolarHBondContact O-N 3.11Å; I813-L815 PolarHBondContact O-N 2.78Å; I813-Y817 HydrophobicContact CG2-CD2 4.42Å; I813-I818 HydrophobicContact CB-CD1 4.5Å; I813-I818 HydrophobicContact CB-CG1 4.42Å; I813-I818 HydrophobicContact CG2-CD1 4.47Å; I813-I818 HydrophobicContact CG2-CG1 3.9Å
814	P	87.6	Confident	88.6	Confident	67 Å²	67	84.4 Å²	84.4	44%	0.435	42%	0.416	S	S	.	.			trans	-54.7	132.5	174.5	-28.2	35.4	0	0	0	112.2	R816 Y817	P814-R816 HydrophobicContact CB-CG 4.31Å; P814-R816 PolarHBondContact O-N 3.5Å; P814-Y817 HydrophobicContact CB-CD2 4.13Å; P814-Y817 HydrophobicContact CB-CE2 4.33Å; P814-Y817 HydrophobicContact CG-CD2 4.38Å; P814-Y817 HydrophobicContact CG-CE2 4.33Å; P814-Y817 PolarHBondContact O-N 3.26Å
815	L	82.1	Confident	88.1	Confident	70 Å²	70	87.5 Å²	87.5	37%	0.366	43%	0.428	S	S	.	.	H	α-helix	trans	-51.3	-25.8	-172	166.2	147.9	0	0	0	114.7	L705 I813 Y817 I818 I819	L705-L815 HydrophobicContact CD1-CB 3.77Å; L705-L815 HydrophobicContact CD1-CD1 3.69Å; L705-L815 HydrophobicContact CD1-CG 4.21Å; L705-L815 HydrophobicContact CD2-CD1 4.18Å; L705-L815 HydrophobicContact CG-CD1 4.49Å; I813-L815 PolarHBondContact O-N 2.78Å; L815-Y817 VanDerWaalsContact C-N 3.27Å; L815-Y817 PolarHBondContact O-N 2.88Å; L815-I818 PolarHBondContact O-N 2.89Å; L815-I818 VanDerWaalsContact O-N 3.15Å; L815-I819 HydrophobicContact CD2-CD1 3.5Å; L815-I819 VanDerWaalsContact CD2-CD1 3.5Å; L815-I819 HydrophobicContact CD2-CG1 4.11Å; L815-I819 HydrophobicContact CG-CD1 4.06Å; L815-I819 HydrophobicContact CG-CG1 4.22Å; L815-I819 PolarHBondContact O-N 3.07Å
816	R	86.9	Confident	87.6	Confident	169 Å²	169	90.1 Å²	90.1	64%	0.638	43%	0.432	S	S	*	.	H	α-helix	trans	-53.3	-39.8	171.7	71.8	-172.5	-174.9	-154.1	1.7	113.3	P814 L820	P814-R816 HydrophobicContact CB-CG 4.31Å; P814-R816 PolarHBondContact O-N 3.5Å; R816-L820 VanDerWaalsContact O-CB 3.32Å; R816-L820 WeakPolarHBondContact O-CB 3.27Å; R816-L820 PolarHBondContact O-N 3.03Å
817	Y	88.2	Confident	87.2	Confident	106 Å²	106	97.1 Å²	97.1	42%	0.416	46%	0.457	S	S	.	.	H	α-helix	trans	-76.4	-35.2	178.6	-61.6	-73.6	0	0	0	111.8	I813 P814 L815 L820 I821	I813-Y817 HydrophobicContact CG2-CD2 4.42Å; P814-Y817 HydrophobicContact CB-CD2 4.13Å; P814-Y817 HydrophobicContact CB-CE2 4.33Å; P814-Y817 HydrophobicContact CG-CD2 4.38Å; P814-Y817 HydrophobicContact CG-CE2 4.33Å; P814-Y817 PolarHBondContact O-N 3.26Å; L815-Y817 VanDerWaalsContact C-N 3.27Å; L815-Y817 PolarHBondContact O-N 2.88Å; Y817-L820 PolarHBondContact O-N 3.44Å; Y817-I821 WeakPolarHBondContact O-CB 3.42Å; Y817-I821 VanDerWaalsContact O-CG1 3.26Å; Y817-I821 WeakPolarHBondContact O-CG1 3.3Å; Y817-I821 PolarHBondContact O-N 3.44Å
818	I	86.1	Confident	86.7	Confident	55 Å²	55	98.9 Å²	98.9	28%	0.282	47%	0.468	S	S	.	.	H	α-helix	trans	-64.9	-45.7	176.3	-56.9	175.6	0	0	0	109.9	I809 L810 I813 L815 I821 W822	I809-I818 HydrophobicContact CG2-CD1 3.86Å; L810-I818 HydrophobicContact CD2-CD1 3.63Å; L810-I818 HydrophobicContact CG-CD1 4.25Å; I813-I818 HydrophobicContact CB-CD1 4.5Å; I813-I818 HydrophobicContact CB-CG1 4.42Å; I813-I818 HydrophobicContact CG2-CD1 4.47Å; I813-I818 HydrophobicContact CG2-CG1 3.9Å; L815-I818 PolarHBondContact O-N 2.89Å; L815-I818 VanDerWaalsContact O-N 3.15Å; I818-I821 PolarHBondContact O-N 3.4Å; I818-W822 WeakPolarHBondContact O-CB 3.47Å; I818-W822 PolarHBondContact O-N 3.33Å
819	I	87.4	Confident	85.9	Confident	96 Å²	96	96.8 Å²	96.8	49%	0.492	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-39.9	174.2	-70.8	-175.7	0	0	0	111.4	L815 G823	L815-I819 HydrophobicContact CD2-CD1 3.5Å; L815-I819 VanDerWaalsContact CD2-CD1 3.5Å; L815-I819 HydrophobicContact CD2-CG1 4.11Å; L815-I819 HydrophobicContact CG-CD1 4.06Å; L815-I819 HydrophobicContact CG-CG1 4.22Å; L815-I819 PolarHBondContact O-N 3.07Å; I819-G823 PolarHBondContact O-N 2.91Å
820	L	89	Confident	84.9	Confident	100 Å²	100	99.1 Å²	99.1	52%	0.524	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-49.1	176.9	-177.8	62.6	0	0	0	111.8	R816 Y817 G823 I824	R816-L820 VanDerWaalsContact O-CB 3.32Å; R816-L820 WeakPolarHBondContact O-CB 3.27Å; R816-L820 PolarHBondContact O-N 3.03Å; Y817-L820 PolarHBondContact O-N 3.44Å; L820-G823 PolarHBondContact O-N 3.44Å; L820-I824 HydrophobicContact CD1-CD1 3.96Å; L820-I824 HydrophobicContact CD1-CG1 4.36Å; L820-I824 HydrophobicContact CG-CD1 3.89Å; L820-I824 WeakPolarHBondContact O-CB 3.29Å; L820-I824 VanDerWaalsContact O-CG1 3.23Å; L820-I824 WeakPolarHBondContact O-CG1 3.29Å; L820-I824 PolarHBondContact O-N 2.84Å
821	I	88.4	Confident	84.2	Confident	115 Å²	115	104.3 Å²	104.3	59%	0.59	49%	0.489	S	S	*	.	H	α-helix	trans	-64.1	-43.6	178.2	-67.9	164.8	0	0	0	110.8	Y817 I818 N825	Y817-I821 WeakPolarHBondContact O-CB 3.42Å; Y817-I821 VanDerWaalsContact O-CG1 3.26Å; Y817-I821 WeakPolarHBondContact O-CG1 3.3Å; Y817-I821 PolarHBondContact O-N 3.44Å; I818-I821 PolarHBondContact O-N 3.4Å; I821-N825 VanDerWaalsContact O-CB 3.27Å; I821-N825 WeakPolarHBondContact O-CB 3.39Å; I821-N825 PolarHBondContact O-N 3.01Å
822	W	86.4	Confident	83.5	Confident	175 Å²	175	106.9 Å²	106.9	66%	0.663	50%	0.498	S	S	*	.	H	α-helix	trans	-63.4	-42.1	176.3	176.9	87.1	0	0	0	112.1	I818 N825 K826	I818-W822 WeakPolarHBondContact O-CB 3.47Å; I818-W822 PolarHBondContact O-N 3.33Å; W822-N825 PolarHBondContact O-N 2.93Å; W822-K826 WeakPolarHBondContact O-CB 3.47Å; W822-K826 PolarHBondContact O-N 2.89Å
823	G	86.5	Confident	82.4	Confident	13 Å²	13	104.4 Å²	104.4	13%	0.134	49%	0.492	C	S	.	.	H	α-helix	trans	-63.2	-52.9	176.1	0	0	0	0	0	111.7	I819 L820 N825 K826 F827	I819-G823 PolarHBondContact O-N 2.91Å; L820-G823 PolarHBondContact O-N 3.44Å; G823-N825 VanDerWaalsContact C-N 3.27Å; G823-N825 PolarHBondContact O-N 3.38Å; G823-K826 PolarHBondContact O-N 3.39Å; G823-K826 VanDerWaalsContact O-N 3.1Å; G823-F827 WeakPolarHBondContact O-CD2 3.27Å; G823-F827 PolarHBondContact O-N 3.2Å
824	I	89.8	Confident	81.2	Confident	95 Å²	95	105.4 Å²	105.4	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-53.4	-47	174.5	-69.3	165.5	0	0	0	110.1	L820 T828	L820-I824 HydrophobicContact CD1-CD1 3.96Å; L820-I824 HydrophobicContact CD1-CG1 4.36Å; L820-I824 HydrophobicContact CG-CD1 3.89Å; L820-I824 WeakPolarHBondContact O-CB 3.29Å; L820-I824 VanDerWaalsContact O-CG1 3.23Å; L820-I824 WeakPolarHBondContact O-CG1 3.29Å; L820-I824 PolarHBondContact O-N 2.84Å; I824-T828 HydrophobicContact CG2-CG2 4.39Å; I824-T828 VanDerWaalsContact O-CB 3.31Å; I824-T828 WeakPolarHBondContact O-CB 3.33Å; I824-T828 VanDerWaalsContact O-CG2 3.3Å; I824-T828 WeakPolarHBondContact O-CG2 3.37Å; I824-T828 PolarHBondContact O-N 3.33Å; I824-T828 PolarHBondContact O-OG1 2.95Å
825	N	83.4	Confident	80	Confident	96 Å²	96	107.3 Å²	107.3	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-45.5	176.8	-172.1	26	0	0	0	112.1	I821 W822 G823 F827 T828 K829	I821-N825 VanDerWaalsContact O-CB 3.27Å; I821-N825 WeakPolarHBondContact O-CB 3.39Å; I821-N825 PolarHBondContact O-N 3.01Å; W822-N825 PolarHBondContact O-N 2.93Å; G823-N825 VanDerWaalsContact C-N 3.27Å; G823-N825 PolarHBondContact O-N 3.38Å; N825-F827 PolarHBondContact O-N 3.47Å; N825-T828 PolarHBondContact O-N 3.41Å; N825-T828 PolarHBondContact O-OG1 2.89Å; N825-K829 WeakPolarHBondContact O-CA 3.22Å; N825-K829 VanDerWaalsContact O-CB 3.24Å; N825-K829 WeakPolarHBondContact O-CB 3.38Å; N825-K829 PolarHBondContact O-N 3.39Å
826	K	80	Confident	78.9	Confident	95 Å²	95	105.3 Å²	105.3	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-68.7	-35.6	-178	-170.9	60.2	177.5	176.6	0	112.7	W822 G823 D838	W822-K826 WeakPolarHBondContact O-CB 3.47Å; W822-K826 PolarHBondContact O-N 2.89Å; G823-K826 PolarHBondContact O-N 3.39Å; G823-K826 VanDerWaalsContact O-N 3.1Å; K826-D838 IonicContact NZ-OD1 3.67Å; K826-D838 PolarHBondContact NZ-OD1 3.42Å; K826-D838 VanDerWaalsContact NZ-OD1 3.11Å; K826-D838 IonicContact NZ-OD2 3.34Å; K826-D838 PolarHBondContact NZ-OD2 2.91Å; K826-D838 VanDerWaalsContact NZ-OD2 3.13Å
827	F	81	Confident	77.9	Confident	179 Å²	179	100.4 Å²	100.4	79%	0.785	48%	0.479	S	S	*	.	H	α-helix	trans	-71.9	-40.6	172.6	-71.5	-63.2	0	0	0	112.3	G823 N825	G823-F827 WeakPolarHBondContact O-CD2 3.27Å; G823-F827 PolarHBondContact O-N 3.2Å; N825-F827 PolarHBondContact O-N 3.47Å
828	T	81	Confident	76.7	Confident	57 Å²	57	98.9 Å²	98.9	35%	0.35	48%	0.478	S	S	.	.	H	α-helix	trans	-82.1	-18.7	180	59.1	0	0	0	0	114.5	I824 N825 K830 L831 R832	I824-T828 HydrophobicContact CG2-CG2 4.39Å; I824-T828 VanDerWaalsContact O-CB 3.31Å; I824-T828 WeakPolarHBondContact O-CB 3.33Å; I824-T828 VanDerWaalsContact O-CG2 3.3Å; I824-T828 WeakPolarHBondContact O-CG2 3.37Å; I824-T828 PolarHBondContact O-N 3.33Å; I824-T828 PolarHBondContact O-OG1 2.95Å; N825-T828 PolarHBondContact O-N 3.41Å; N825-T828 PolarHBondContact O-OG1 2.89Å; T828-K830 VanDerWaalsContact C-N 3.34Å; T828-K830 PolarHBondContact O-N 2.93Å; T828-L831 WeakPolarHBondContact O-CB 3.17Å; T828-L831 PolarHBondContact O-N 3.25Å; T828-R832 WeakPolarHBondContact O-CB 3.37Å; T828-R832 PolarHBondContact O-N 3.33Å
829	K	73.6	Confident	76	Confident	55 Å²	55	99 Å²	99	24%	0.239	48%	0.479	C	S	.	.	H	α-helix	trans	-51.8	-49.8	-178.6	-178.6	-178.7	179.5	-171.6	0	111.8	N825 R832 N833 S836 D838	N825-K829 WeakPolarHBondContact O-CA 3.22Å; N825-K829 VanDerWaalsContact O-CB 3.24Å; N825-K829 WeakPolarHBondContact O-CB 3.38Å; N825-K829 PolarHBondContact O-N 3.39Å; K829-R832 PolarHBondContact O-N 2.81Å; K829-N833 PolarHBondContact O-N 3.45Å; K829-S836 VanDerWaalsContact CE-OG 3.3Å; K829-S836 WeakPolarHBondContact CE-OG 3.25Å; K829-D838 IonicContact NZ-OD1 2.74Å; K829-D838 PolarHBondContact NZ-OD1 3.48Å
830	K	70.3	Confident	75.7	Confident	132 Å²	132	98.5 Å²	98.5	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-74.6	-23	-179.9	-66.8	-164.5	173.9	-167.9	0	113.7	T828 P834	T828-K830 VanDerWaalsContact C-N 3.34Å; T828-K830 PolarHBondContact O-N 2.93Å; K830-P834 WeakPolarHBondContact O-CA 3.34Å
831	L	73.8	Confident	75.4	Confident	153 Å²	153	99.6 Å²	99.6	80%	0.801	48%	0.48	S	S	*	.	H	α-helix	trans	-76.1	-38.9	173.5	-162.2	78.8	0	0	0	111.5	T828	T828-L831 WeakPolarHBondContact O-CB 3.17Å; T828-L831 PolarHBondContact O-N 3.25Å
832	R	73.4	Confident	75	Confident	201 Å²	201	99.3 Å²	99.3	76%	0.758	48%	0.479	S	S	*	.	H	α-helix	trans	-79.5	-40.1	-178.5	178.2	176.1	169	-176.3	-2.8	113	T828 K829	T828-R832 WeakPolarHBondContact O-CB 3.37Å; T828-R832 PolarHBondContact O-N 3.33Å; K829-R832 PolarHBondContact O-N 2.81Å
833	N	67.1	Low	74.7	Confident	97 Å²	97	95 Å²	95	52%	0.519	47%	0.469	S	S	.	.			trans	-133	89.9	178.2	-78	-16	0	0	0	109.1	K829 Y835 S836	K829-N833 PolarHBondContact O-N 3.45Å; N833-Y835 PolarHBondContact O-N 2.81Å; N833-Y835 VanDerWaalsContact O-N 3.09Å; N833-S836 PolarHBondContact O-N 2.9Å; N833-S836 PolarHBondContact O-OG 3.42Å
834	P	64.1	Low	74.6	Confident	87 Å²	87	95.5 Å²	95.5	57%	0.565	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.3	-178.1	24.8	-34.6	0	0	0	113.6	K830	K830-P834 WeakPolarHBondContact O-CA 3.34Å
835	Y	61	Low	74.5	Confident	108 Å²	108	91.7 Å²	91.7	42%	0.424	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	16.4	-176.9	-50.5	-44.6	0	0	0	114.1	L362 L461 N833 I837	L362-Y835 HydrophobicContact CD1-CD1 3.67Å; L362-Y835 HydrophobicContact CD1-CD2 4.14Å; L362-Y835 HydrophobicContact CD1-CE1 3.75Å; L362-Y835 HydrophobicContact CD1-CE2 4.2Å; L362-Y835 HydrophobicContact CD1-CG 3.88Å; L362-Y835 HydrophobicContact CD2-CD1 3.84Å; L362-Y835 HydrophobicContact CD2-CG 3.91Å; L362-Y835 HydrophobicContact CG-CD1 4.28Å; L461-Y835 HydrophobicContact CD2-CE1 4.34Å; N833-Y835 PolarHBondContact O-N 2.81Å; N833-Y835 VanDerWaalsContact O-N 3.09Å; Y835-I837 PolarHBondContact O-N 3.29Å
836	S	60	Low	74.5	Confident	27 Å²	27	87.7 Å²	87.7	19%	0.189	43%	0.427	C	S	.	.			trans	-73.2	112.7	176.7	70.1	0	0	0	0	111.2	K829 N833 D838	K829-S836 VanDerWaalsContact CE-OG 3.3Å; K829-S836 WeakPolarHBondContact CE-OG 3.25Å; N833-S836 PolarHBondContact O-N 2.9Å; N833-S836 PolarHBondContact O-OG 3.42Å; S836-D838 PolarHBondContact O-N 2.79Å
837	I	65.1	Low	74.6	Confident	67 Å²	67	84.5 Å²	84.5	34%	0.344	42%	0.417	S	S	.	.			trans	-58.1	126.7	167.4	-54.7	175	0	0	0	108	T360 Q400 Y835 N839	T360-I837 HydrophobicContact CG2-CD1 4.5Å; Q400-I837 WeakPolarHBondContact O-CD1 3.27Å; Y835-I837 PolarHBondContact O-N 3.29Å; I837-N839 PolarHBondContact O-N 3.18Å
838	D	64	Low	74.8	Confident	73 Å²	73	76.4 Å²	76.4	39%	0.39	38%	0.381	S	S	.	.			trans	-80.4	106.3	174.5	-98	-31.1	0	0	0	108.8	K826 K829 S836	K826-D838 IonicContact NZ-OD1 3.67Å; K826-D838 PolarHBondContact NZ-OD1 3.42Å; K826-D838 VanDerWaalsContact NZ-OD1 3.11Å; K826-D838 IonicContact NZ-OD2 3.34Å; K826-D838 PolarHBondContact NZ-OD2 2.91Å; K826-D838 VanDerWaalsContact NZ-OD2 3.13Å; K829-D838 IonicContact NZ-OD1 2.74Å; K829-D838 PolarHBondContact NZ-OD1 3.48Å; S836-D838 PolarHBondContact O-N 2.79Å
839	N	71.3	Confident	74.9	Confident	58 Å²	58	73.8 Å²	73.8	31%	0.31	37%	0.365	S	S	.	.			trans	-99	171.1	175.1	70.6	-57.5	0	0	0	111.8	F637 I837 D844	F637-N839 PolarHBondContact O-ND2 3.36Å; I837-N839 PolarHBondContact O-N 3.18Å; N839-D844 WeakPolarHBondContact CB-OD2 3.37Å; N839-D844 PolarHBondContact ND2-OD2 2.79Å
840	N	80.8	Confident	75.3	Confident	85 Å²	85	72.1 Å²	72.1	46%	0.455	36%	0.36	S	S	.	.			trans	-120.5	96.9	175.9	-176.4	-17.2	0	0	0	109.4	L842 L843 D844	N840-L842 PolarHBondContact O-N 2.84Å; N840-L842 PolarHBondContact OD1-N 3.26Å; N840-L843 HydrophobicContact CB-CB 4.22Å; N840-L843 HydrophobicContact CB-CD1 4.09Å; N840-L843 HydrophobicContact CB-CG 4.16Å; N840-L843 WeakPolarHBondContact O-CA 3.44Å; N840-L843 PolarHBondContact O-N 3.4Å; N840-D844 PolarHBondContact O-N 2.87Å
841	E	82.1	Confident	75.9	Confident	123 Å²	123	66.2 Å²	66.2	58%	0.575	34%	0.335	S	S	*	.	H	α-helix	trans	-52.7	-31.9	-174.1	-62.6	168.6	-163.2	0	0	113.5	F637 F845	F637-E841 HydrophobicContact CB-CB 4.41Å; F637-E841 HydrophobicContact CB-CG 4.45Å; F637-E841 HydrophobicContact CD1-CB 4.33Å; E841-F845 WeakPolarHBondContact O-CB 3.42Å; E841-F845 PolarHBondContact O-N 2.93Å
842	L	80.2	Confident	76.1	Confident	110 Å²	110	60.8 Å²	60.8	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-72.5	-39.5	176.6	-177.5	61.8	0	0	0	112.3	N840 L846	N840-L842 PolarHBondContact O-N 2.84Å; N840-L842 PolarHBondContact OD1-N 3.26Å; L842-L846 HydrophobicContact CD1-CD1 4.2Å; L842-L846 HydrophobicContact CD1-CG 4.49Å; L842-L846 HydrophobicContact CG-CD1 4.14Å; L842-L846 WeakPolarHBondContact O-CB 3.38Å; L842-L846 VanDerWaalsContact O-CG 3.3Å; L842-L846 WeakPolarHBondContact O-CG 3.44Å; L842-L846 PolarHBondContact O-N 3.4Å
843	L	80.9	Confident	76.4	Confident	85 Å²	85	52.4 Å²	52.4	45%	0.445	28%	0.278	S	S	.	.	H	α-helix	trans	-71.8	-38.6	174.3	-63.1	-178.3	0	0	0	110.7	F780 N840 F845 L846 S847	F780-L843 HydrophobicContact CD2-CD2 4.24Å; F780-L843 HydrophobicContact CE2-CD2 3.59Å; F780-L843 HydrophobicContact CZ-CD2 4.38Å; N840-L843 HydrophobicContact CB-CB 4.22Å; N840-L843 HydrophobicContact CB-CD1 4.09Å; N840-L843 HydrophobicContact CB-CG 4.16Å; N840-L843 WeakPolarHBondContact O-CA 3.44Å; N840-L843 PolarHBondContact O-N 3.4Å; L843-F845 PolarHBondContact O-N 3.26Å; L843-L846 PolarHBondContact O-N 3.14Å; L843-S847 VanDerWaalsContact O-CB 3.26Å; L843-S847 WeakPolarHBondContact O-CB 3.43Å; L843-S847 PolarHBondContact O-N 2.86Å
844	D	84.2	Confident	77	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-43.2	175.1	-69	-33.5	0	0	0	111.2	T636 P639 N839 N840 S847 R848	T636-D844 CarbonylContact O-C 3.53Å; P639-D844 WeakPolarHBondContact CA-OD1 3.1Å; N839-D844 WeakPolarHBondContact CB-OD2 3.37Å; N839-D844 PolarHBondContact ND2-OD2 2.79Å; N840-D844 PolarHBondContact O-N 2.87Å; D844-S847 PolarHBondContact O-OG 2.91Å; D844-R848 PolarHBondContact O-NH1 3.4Å
845	F	86.7	Confident	77.8	Confident	14 Å²	14	48.9 Å²	48.9	6%	0.061	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-53.3	171.8	175.4	-84.6	0	0	0	111.7	T636 F637 T787 L795 L798 A799 E841 L843 S847 R848 V849	T636-F845 HydrophobicContact CG2-CB 4.49Å; T636-F845 HydrophobicContact CG2-CD2 3.57Å; T636-F845 HydrophobicContact CG2-CE2 4.19Å; T636-F845 HydrophobicContact CG2-CG 4.36Å; T636-F845 PolarHBondContact O-N 3.38Å; F637-F845 HydrophobicContact CD1-CB 4.24Å; F637-F845 HydrophobicContact CE1-CB 3.94Å; F637-F845 AromaticContact CE1-CD2 3.65Å; F637-F845 HydrophobicContact CE1-CD2 3.65Å; F637-F845 HydrophobicContact CE1-CG 4.14Å; F637-F845 AromaticContact CZ-CD2 3.84Å; F637-F845 HydrophobicContact CZ-CD2 3.84Å; F637-F845 HydrophobicContact CZ-CE2 4.48Å; T787-F845 HydrophobicContact CG2-CE1 3.88Å; T787-F845 HydrophobicContact CG2-CZ 4.17Å; L795-F845 HydrophobicContact CB-CE2 4.36Å; L795-F845 HydrophobicContact CB-CZ 4.04Å; L795-F845 HydrophobicContact CD2-CD2 4.24Å; L795-F845 HydrophobicContact CD2-CE2 3.76Å; L795-F845 HydrophobicContact CD2-CZ 4.18Å; L795-F845 WeakPolarHBondContact O-CZ 3.41Å; L798-F845 HydrophobicContact CD2-CE2 4.37Å; A799-F845 HydrophobicContact CB-CZ 3.92Å; E841-F845 WeakPolarHBondContact O-CB 3.42Å; E841-F845 PolarHBondContact O-N 2.93Å; L843-F845 PolarHBondContact O-N 3.26Å; F845-S847 VanDerWaalsContact C-N 3.27Å; F845-S847 PolarHBondContact O-N 3.44Å; F845-R848 WeakPolarHBondContact O-CB 3.24Å; F845-R848 PolarHBondContact O-N 3.07Å; F845-V849 HydrophobicContact CE1-CG2 4.3Å
846	L	84.1	Confident	78.7	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.063	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-29	-176.6	-73.3	170.5	0	0	0	112.6	F780 R783 I784 L842 L843 R848 V849	F780-L846 HydrophobicContact CD2-CD1 4.23Å; F780-L846 HydrophobicContact CE2-CD1 3.53Å; F780-L846 HydrophobicContact CZ-CD1 4.2Å; R783-L846 HydrophobicContact CB-CD2 4.47Å; R783-L846 WeakPolarHBondContact CD-O 3.49Å; R783-L846 PolarHBondContact NE-O 3.24Å; I784-L846 HydrophobicContact CD1-CD1 4.36Å; I784-L846 HydrophobicContact CG1-CD1 3.89Å; I784-L846 HydrophobicContact CG1-CD2 4Å; L842-L846 HydrophobicContact CD1-CD1 4.2Å; L842-L846 HydrophobicContact CD1-CG 4.49Å; L842-L846 HydrophobicContact CG-CD1 4.14Å; L842-L846 WeakPolarHBondContact O-CB 3.38Å; L842-L846 VanDerWaalsContact O-CG 3.3Å; L842-L846 WeakPolarHBondContact O-CG 3.44Å; L842-L846 PolarHBondContact O-N 3.4Å; L843-L846 PolarHBondContact O-N 3.14Å; L846-R848 PolarHBondContact O-N 2.74Å; L846-V849 WeakPolarHBondContact O-CB 3.11Å; L846-V849 PolarHBondContact O-N 3.22Å; L846-V849 VanDerWaalsContact O-N 3.13Å
847	S	82.6	Confident	79.6	Confident	29 Å²	29	48.2 Å²	48.2	20%	0.203	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-24.5	176.9	78.8	0	0	0	0	113.7	R783 L843 D844 F845	R783-S847 PolarHBondContact NH2-O 3.25Å; L843-S847 VanDerWaalsContact O-CB 3.26Å; L843-S847 WeakPolarHBondContact O-CB 3.43Å; L843-S847 PolarHBondContact O-N 2.86Å; D844-S847 PolarHBondContact O-OG 2.91Å; F845-S847 VanDerWaalsContact C-N 3.27Å; F845-S847 PolarHBondContact O-N 3.44Å
848	R	83.5	Confident	80.3	Confident	9 Å²	9	47.3 Å²	47.3	3%	0.034	25%	0.245	C	C	.	.	H	α-helix	trans	-88.1	-17.4	-179.9	-68.8	169	167.4	90.6	0.7	113.4	D565 H567 R635 T636 T638 L795 D844 F845 L846	D565-R848 IonicContact OD1-NE 3.52Å; D565-R848 IonicContact OD2-CZ 2.66Å; D565-R848 IonicContact OD2-NE 3.1Å; D565-R848 PolarHBondContact OD2-NE 2.78Å; D565-R848 IonicContact OD2-NH2 2.73Å; D565-R848 PolarHBondContact OD2-NH2 3.18Å; H567-R848 HydrophobicContact CB-CB 3.82Å; H567-R848 HydrophobicContact CB-CG 3.98Å; R635-R848 PolarHBondContact O-NH2 3.29Å; T636-R848 PolarHBondContact O-NH1 2.89Å; T638-R848 VanDerWaalsContact O-CZ 3.23Å; T638-R848 PolarHBondContact O-NH1 3.42Å; T638-R848 PolarHBondContact O-NH2 3.31Å; L795-R848 HydrophobicContact CD1-CB 4.21Å; D844-R848 PolarHBondContact O-NH1 3.4Å; F845-R848 WeakPolarHBondContact O-CB 3.24Å; F845-R848 PolarHBondContact O-N 3.07Å; L846-R848 PolarHBondContact O-N 2.74Å
849	V	83.4	Confident	80.9	Confident	2 Å²	2	46 Å²	46	1%	0.012	25%	0.245	C	C	.	.	S	Bend	trans	-72.7	135.1	170.2	-173.9	0	0	0	0	108.2	R783 N786 T787 L795 F845 L846	R783-V849 HydrophobicContact CB-CB 4.17Å; R783-V849 HydrophobicContact CB-CG1 4.35Å; R783-V849 HydrophobicContact CG-CB 4.06Å; R783-V849 HydrophobicContact CG-CG1 4.39Å; R783-V849 WeakPolarHBondContact CG-O 3.47Å; R783-V849 PolarHBondContact NE-O 3.42Å; R783-V849 WeakPolarHBondContact O-CG1 3.37Å; N786-V849 HydrophobicContact CB-CG1 3.8Å; T787-V849 WeakPolarHBondContact OG1-CG2 3.31Å; L795-V849 HydrophobicContact CD1-CB 4.42Å; L795-V849 HydrophobicContact CD1-CG2 3.74Å; F845-V849 HydrophobicContact CE1-CG2 4.3Å; L846-V849 WeakPolarHBondContact O-CB 3.11Å; L846-V849 PolarHBondContact O-N 3.22Å; L846-V849 VanDerWaalsContact O-N 3.13Å
850	P	82.1	Confident	81.2	Confident	20 Å²	20	48.7 Å²	48.7	13%	0.13	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-72.2	138.3	175.3	27.9	-33.9	0	0	0	111.5	N786 V792 Q854 K855 Y858	N786-P850 PolarHBondContact ND2-O 3.34Å; V792-P850 HydrophobicContact CG2-CG 3.94Å; P850-Q854 HydrophobicContact CB-CB 4.02Å; P850-K855 HydrophobicContact CB-CG 4.3Å; P850-K855 HydrophobicContact CG-CG 4.32Å; P850-Y858 HydrophobicContact CB-CE2 4.42Å
851	S	82.7	Confident	80.8	Confident	7 Å²	7	48.2 Å²	48.2	5%	0.049	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-67	166.8	164.5	70.5	0	0	0	0	111.2	E782 V853 Q854 K855	E782-S851 WeakPolarHBondContact OE2-CB 3.48Å; S851-V853 PolarHBondContact O-N 2.56Å; S851-Q854 PolarHBondContact O-N 2.79Å; S851-Q854 WeakPolarHBondContact OG-CG 3.45Å; S851-Q854 PolarHBondContact OG-N 3.05Å; S851-Q854 PolarHBondContact OG-OE1 2.81Å; S851-K855 PolarHBondContact O-N 2.91Å
852	D	78.6	Confident	79.8	Confident	39 Å²	39	51.6 Å²	51.6	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-68.4	-28.2	178.8	-75.3	-19.3	0	0	0	111.9	E782 K785 N786 K855 V856	E782-D852 HydrophobicContact CG-CB 4.26Å; E782-D852 PolarHBondContact OE2-N 3.39Å; K785-D852 IonicContact NZ-OD2 2.92Å; K785-D852 PolarHBondContact NZ-OD2 3.26Å; N786-D852 PolarHBondContact ND2-OD1 3.06Å; N786-D852 PolarHBondContact OD1-OD1 3.15Å; N786-D852 VanDerWaalsContact OD1-OD1 3.12Å; D852-K855 WeakPolarHBondContact OD1-CE 3.29Å; D852-K855 IonicContact OD1-NZ 2.63Å; D852-K855 PolarHBondContact OD1-NZ 2.77Å; D852-V856 PolarHBondContact O-N 3.3Å
853	V	79.6	Confident	78.3	Confident	26 Å²	26	51.5 Å²	51.5	16%	0.158	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-48.7	169.6	179.8	0	0	0	0	110.7	S851 K855 V856 Q857	S851-V853 PolarHBondContact O-N 2.56Å; V853-K855 VanDerWaalsContact C-N 3.3Å; V853-K855 PolarHBondContact O-N 2.84Å; V853-V856 PolarHBondContact O-N 3.12Å; V853-V856 VanDerWaalsContact O-N 3.07Å; V853-Q857 PolarHBondContact O-N 3.36Å; V853-Q857 VanDerWaalsContact O-N 3.15Å
854	Q	80.4	Confident	76	Confident	44 Å²	44	53.6 Å²	53.6	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-37.3	179.4	-79.1	173.5	-37.8	0	0	112.3	P850 S851 V856 Q857 Y858	P850-Q854 HydrophobicContact CB-CB 4.02Å; S851-Q854 PolarHBondContact O-N 2.79Å; S851-Q854 WeakPolarHBondContact OG-CG 3.45Å; S851-Q854 PolarHBondContact OG-N 3.05Å; S851-Q854 PolarHBondContact OG-OE1 2.81Å; Q854-V856 VanDerWaalsContact C-N 3.32Å; Q854-V856 PolarHBondContact O-N 3.05Å; Q854-Q857 WeakPolarHBondContact O-CB 3.4Å; Q854-Q857 PolarHBondContact O-N 3.49Å; Q854-Y858 HydrophobicContact CB-CD2 4.34Å; Q854-Y858 HydrophobicContact CB-CE2 3.71Å; Q854-Y858 HydrophobicContact CG-CE2 4.32Å; Q854-Y858 WeakPolarHBondContact O-CD2 3.39Å; Q854-Y858 PolarHBondContact O-N 3.49Å
855	K	80.9	Confident	73.5	Confident	66 Å²	66	58.3 Å²	58.3	29%	0.287	32%	0.32	S	S	.	.	H	α-helix	trans	-58.5	-40.6	173.1	-69.3	178.1	-169.1	161.4	0	113.1	N786 P850 S851 D852 V853 Q857 Y858 A859	N786-K855 WeakPolarHBondContact ND2-CE 3.29Å; N786-K855 PolarHBondContact ND2-NZ 3.41Å; N786-K855 VanDerWaalsContact ND2-NZ 3.16Å; N786-K855 PolarHBondContact OD1-NZ 3.19Å; P850-K855 HydrophobicContact CB-CG 4.3Å; P850-K855 HydrophobicContact CG-CG 4.32Å; S851-K855 PolarHBondContact O-N 2.91Å; D852-K855 WeakPolarHBondContact OD1-CE 3.29Å; D852-K855 IonicContact OD1-NZ 2.63Å; D852-K855 PolarHBondContact OD1-NZ 2.77Å; V853-K855 VanDerWaalsContact C-N 3.3Å; V853-K855 PolarHBondContact O-N 2.84Å; K855-Q857 VanDerWaalsContact C-N 3.35Å; K855-Y858 CarbonylContact O-C 3.4Å; K855-Y858 PolarHBondContact O-N 3Å; K855-A859 WeakPolarHBondContact O-CB 3.35Å; K855-A859 PolarHBondContact O-N 3.4Å
856	V	79.1	Confident	70.8	Confident	83 Å²	83	60.6 Å²	60.6	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-66.9	-40.5	178	175.9	0	0	0	0	110.4	K607 D852 V853 Q854 Y858 A859	K607-V856 PolarHBondContact NZ-O 3.34Å; D852-V856 PolarHBondContact O-N 3.3Å; V853-V856 PolarHBondContact O-N 3.12Å; V853-V856 VanDerWaalsContact O-N 3.07Å; Q854-V856 VanDerWaalsContact C-N 3.32Å; Q854-V856 PolarHBondContact O-N 3.05Å; V856-Y858 VanDerWaalsContact C-N 3.33Å; V856-Y858 PolarHBondContact O-N 3.46Å; V856-A859 PolarHBondContact O-N 3.14Å
857	Q	79.1	Confident	68.1	Low	37 Å²	37	69.4 Å²	69.4	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-61.9	-39.5	175	-63.6	-178.8	-51.3	0	0	112.1	K607 D610 L611 V853 Q854 K855	K607-Q857 PolarHBondContact NZ-O 2.98Å; D610-Q857 PolarHBondContact O-NE2 2.85Å; L611-Q857 HydrophobicContact CB-CB 3.7Å; L611-Q857 HydrophobicContact CB-CG 3.8Å; L611-Q857 HydrophobicContact CD1-CB 4.18Å; V853-Q857 PolarHBondContact O-N 3.36Å; V853-Q857 VanDerWaalsContact O-N 3.15Å; Q854-Q857 WeakPolarHBondContact O-CB 3.4Å; Q854-Q857 PolarHBondContact O-N 3.49Å; K855-Q857 VanDerWaalsContact C-N 3.35Å
858	Y	80.3	Confident	65.3	Low	48 Å²	48	72.9 Å²	72.9	19%	0.188	41%	0.412	C	S	.	.	H	α-helix	trans	-88.4	-6.3	179.2	-50.5	-27.3	0	0	0	114.7	V569 A590 P592 P850 Q854 K855 V856 E860	V569-Y858 HydrophobicContact CB-CE1 4.48Å; V569-Y858 HydrophobicContact CG1-CD1 4.09Å; V569-Y858 HydrophobicContact CG1-CE1 3.82Å; V569-Y858 HydrophobicContact CG2-CE1 4.1Å; V569-Y858 HydrophobicContact CG2-CE2 4.02Å; A590-Y858 HydrophobicContact CB-CD1 3.8Å; A590-Y858 HydrophobicContact CB-CE1 4.04Å; P592-Y858 HydrophobicContact CG-CD1 4.45Å; P592-Y858 HydrophobicContact CG-CD2 3.74Å; P592-Y858 HydrophobicContact CG-CG 3.7Å; P850-Y858 HydrophobicContact CB-CE2 4.42Å; Q854-Y858 HydrophobicContact CB-CD2 4.34Å; Q854-Y858 HydrophobicContact CB-CE2 3.71Å; Q854-Y858 HydrophobicContact CG-CE2 4.32Å; Q854-Y858 WeakPolarHBondContact O-CD2 3.39Å; Q854-Y858 PolarHBondContact O-N 3.49Å; K855-Y858 CarbonylContact O-C 3.4Å; K855-Y858 PolarHBondContact O-N 3Å; V856-Y858 VanDerWaalsContact C-N 3.33Å; V856-Y858 PolarHBondContact O-N 3.46Å; Y858-E860 PolarHBondContact O-N 3.21Å
859	A	76.6	Confident	63.1	Low	46 Å²	46	78.5 Å²	78.5	38%	0.38	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-67.1	124.4	-178.7	0	0	0	0	0	111.1	K607 K855 V856 L861	K607-A859 WeakPolarHBondContact CE-O 3.28Å; K607-A859 PolarHBondContact NZ-O 3.48Å; K855-A859 WeakPolarHBondContact O-CB 3.35Å; K855-A859 PolarHBondContact O-N 3.4Å; V856-A859 PolarHBondContact O-N 3.14Å; A859-L861 PolarHBondContact O-N 3.22Å
860	E	76.6	Confident	60.6	Low	114 Å²	114	85.8 Å²	85.8	53%	0.533	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-64.7	118.8	172.6	-65.4	-178.3	156	0	0	110	Y604 Y858 K862	Y604-E860 HydrophobicContact CE1-CG 4.36Å; Y604-E860 WeakPolarHBondContact CE1-OE1 3.4Å; Y858-E860 PolarHBondContact O-N 3.21Å; E860-K862 PolarHBondContact O-N 3.05Å
861	L	73.3	Confident	58.2	Low	76 Å²	76	96.2 Å²	96.2	40%	0.398	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-82.4	116.1	171.3	-61	178.1	0	0	0	108.1	V605 K607 A614 A859	V605-L861 HydrophobicContact CB-CB 4.25Å; V605-L861 HydrophobicContact CG2-CB 4.49Å; V605-L861 WeakPolarHBondContact CG2-O 3.44Å; K607-L861 HydrophobicContact CD-CD1 4.42Å; K607-L861 HydrophobicContact CG-CD1 4.25Å; A614-L861 HydrophobicContact CB-CD1 3.83Å; A859-L861 PolarHBondContact O-N 3.22Å
862	K	60.4	Low	55.7	Low	194 Å²	194	106.5 Å²	106.5	84%	0.843	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-67.2	135.1	174.7	-67.4	-174.5	177.7	-176.2	0	109.8	E860 C864	E860-K862 PolarHBondContact O-N 3.05Å; K862-C864 PolarHBondContact O-N 3.25Å
863	L	49.4	Very low	53.6	Low	108 Å²	108	114.4 Å²	114.4	57%	0.565	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-56.6	121.3	165.1	-84.8	159.9	0	0	0	109.6	V605 V618 S865	V605-L863 HydrophobicContact CG2-CD2 4.28Å; V605-L863 HydrophobicContact CG2-CG 4.06Å; V618-L863 HydrophobicContact CG1-CD2 4.12Å; L863-S865 PolarHBondContact O-N 3.31Å; L863-S865 VanDerWaalsContact O-N 3.12Å
864	C	33.2	Very low	51.4	Low	129 Å²	129	125 Å²	125	87%	0.872	64%	0.638	S	S	*	*			trans	-65.9	110.4	170.8	-70.6	0	0	0	0	108.9	K862 G866	K862-C864 PolarHBondContact O-N 3.25Å; C864-G866 PolarHBondContact O-N 3.47Å
865	S	30.6	Very low	48.9	Very low	122 Å²	122	129 Å²	129	85%	0.853	67%	0.67	S	S	*	*			trans	-68.2	97.2	-179	55.5	0	0	0	0	111.2	L863	L863-S865 PolarHBondContact O-N 3.31Å; L863-S865 VanDerWaalsContact O-N 3.12Å
866	G	29.9	Very low	46.8	Very low	62 Å²	62	130.6 Å²	130.6	64%	0.639	70%	0.696	S	S	*	*			trans	54.4	100.6	160	0	0	0	0	0	117.1	C864 S868	C864-G866 PolarHBondContact O-N 3.47Å; G866-S868 PolarHBondContact O-N 3.47Å
867	H	28.2	Very low	44.7	Very low	197 Å²	197	138.6 Å²	138.6	91%	0.912	74%	0.735	S	S	*	*			trans	-61	103.5	151.7	-100.8	-74.3	0	0	0	108.7	P869	H867-P869 VanDerWaalsContact O-CD 3.31Å; H867-P869 WeakPolarHBondContact O-CD 3.39Å
868	S	24.3	Very low	43	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	76%	0.763	S	S	*	*			trans	-81.5	110.9	171	55.5	0	0	0	0	109.8	G866 L870	G866-S868 PolarHBondContact O-N 3.47Å; S868-L870 VanDerWaalsContact C-N 3.3Å; S868-L870 PolarHBondContact O-N 3.44Å
869	P	36.6	Very low	41	Very low	128 Å²	128	148.7 Å²	148.7	83%	0.831	79%	0.793	S	S	*	*			trans	-89.7	54.7	-168.3	37.4	-36	0	0	0	112.1	H867	H867-P869 VanDerWaalsContact O-CD 3.31Å; H867-P869 WeakPolarHBondContact O-CD 3.39Å
870	L	30.9	Very low	39	Very low	155 Å²	155	154.4 Å²	154.4	81%	0.812	82%	0.816	S	S	*	*			trans	-133.7	134.4	-176.3	-86	171.3	0	0	0	114.5	S868	S868-L870 VanDerWaalsContact C-N 3.3Å; S868-L870 PolarHBondContact O-N 3.44Å
871	R	32.4	Very low	36.8	Very low	239 Å²	239	156.8 Å²	156.8	90%	0.902	83%	0.833	S	S	*	*			trans	59	91.1	169.6	-72.4	-176.9	165.1	175.3	-4	117.8
872	K	30.3	Very low	34.5	Very low	223 Å²	223	161.8 Å²	161.8	97%	0.97	86%	0.86	S	S	*	*				-142.9	92.7	122.8	-114.6	177.5	-176.2	-179.3	0	111.5
873	K	34.2	Very low	32.8	Very low	205 Å²	205	159.7 Å²	159.7	89%	0.891	86%	0.861	S	S	*	*			trans	-142.5	138.7	165.6	-153.1	173.6	-170.1	176.6	0	107.1
874	R	33.1	Very low	31.6	Very low	249 Å²	249	163.4 Å²	163.4	94%	0.94	88%	0.882	S	S	*	*			trans	67.6	95.9	-166.6	-62	-178.8	170.1	169.8	-3.4	115.6
875	S	28.3	Very low	31.5	Very low	126 Å²	126	166 Å²	166	88%	0.881	88%	0.883	S	S	*	*				-141.5	130.3	101.6	54.2	0	0	0	0	107.3
876	A	36.3	Very low	31.6	Very low	100 Å²	100	169.7 Å²	169.7	83%	0.826	89%	0.885	S	S	*	*			trans	-116.3	128.2	172.9	0	0	0	0	0	107.9
877	L	34.6	Very low	31.7	Very low	251 Å²	251	179.5 Å²	179.5	100%	1.314	91%	0.908	S	S	*	*			trans	-165.3	0	161.9	-106.3	166.6	0	0	0	106.8

Retrieved 877 of 877 residues in 2318.7 ms (Link to these results)

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