A0A087X8D7_POEFO Loading...

Proliferation-associated SNF2-like protein

Plays an essential role in normal development and survival. Involved in regulation of the expansion or survival of lymphoid cells. Required for de novo or maintenance DNA methylation. May control silencing of the imprinted CDKN1C gene through DNA methylation. May play a role in formation and organization of heterochromatin, implying a functional role in the regulation of transcription and mitosis.

AlphaFold DB , UniProt , Accession A0A087X8D7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 854 aa.

						>A0A087X8D7_POEFO|A0A087X8D7
MSSIKEETRSVSPQCPKPDESEEPHGTAMETAGGQADGSVKSENIPEVVITKEMEEEENQLMEEGERKEKEMMKKAQESFKRDSQDVRFKRLQHLLQKSNIYSKFLLTKMEQQQNEEKLKKERLEKKAMKAGSGAETRTDAKKKKRRRDEDFKIADVMTKEEIMSQAKRSKVEKGKNDAPAQKKLDAEDIEKMSDSNEEIKSRLSETVRENAKHLLDPDRKVNGQPVPVQQPQLFTGGVMRWYQIEGVEWLRMLWENGINGILADEMGLGKTIQCIAHIAMMVEKKVMGPFLVVAPLSTVPNWISEFKRFAPEISVMLYHGTPPERSKLLKQVRRSQGPLNMFPVVITSFEISMIDRKFLQHLQWKYLIVDEGHRIKNLNCRLVRELKMLPTDNKLLLTGTPLQNNLAELWSLLNFLLPEVFDDLKSFESWFDINSLGEGDDVIVAEREQNILSMLHQILTPFLLRRLKTDVTLEVPPKKEIIVYAPLTTKQETLYSAVVNKTIEKVLGKEKKEAPVPVTPDGRPKRRTRRSVDYSETESDTQAALMKYLERVRKEAENSPSPPVLDISTPPDADITLKLQNVLMVLKRCCNHPYLVEYPLDPVTQQFKIDEQLVQSSGKFLILDRLLPALKIRGHKVLIFSQMTSILDILMDYCYLRDFRYSRLDGSMPYTERDKNIQKFFNDPEVFIFLLSTRAGGLGINLTAADTVIIFDSDWNPQADLQAQDRCHRIGQTKPVVVYRLVTANTIDQRILERATAKRKLEQMVIHKKKFKGGKAELNQSKSSIDLDELRDLLQARGPEKEVKSSKGKVISDKDLEILLDRSDLLGNGRSMKEKVGVFRVIDAKESSEITLT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.3	Very low	29.4	Very low	236 Å²	236	149.5 Å²	149.5	100%	1.163	78%	0.784	S	S	*	*				0	100.9	0	-78	-177.1	167.7	0	0	108.4
2	S	29.8	Very low	29.3	Very low	106 Å²	106	145.4 Å²	145.4	74%	0.741	78%	0.777	S	S	*	*				6.6	143.2	124.1	47.2	0	0	0	0	116.5
3	S	27.5	Very low	30	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	77%	0.773	S	S	*	*			cis	177.4	138.4	21.5	-95.1	0	0	0	0	107.6
4	I	32.5	Very low	29.9	Very low	138 Å²	138	145.7 Å²	145.7	71%	0.708	78%	0.779	S	S	*	*				92.4	119.5	101.8	-67.6	174	0	0	0	116.5
5	K	29.1	Very low	29.8	Very low	177 Å²	177	144.6 Å²	144.6	77%	0.77	79%	0.785	S	S	*	*			trans	54.3	153.2	141.2	-63.3	178.1	-179.3	-174.1	0	120.1
6	E	26.6	Very low	30	Very low	148 Å²	148	143.4 Å²	143.4	69%	0.692	79%	0.787	S	S	*	*			cis	-168.7	148.3	38.9	-144.8	151.3	-131.6	0	0	113.8
7	E	27.9	Very low	30	Very low	153 Å²	153	146.6 Å²	146.6	72%	0.715	79%	0.792	S	S	*	*			trans	39.2	123.4	144.9	-66.6	-175.9	166.9	0	0	125.5
8	T	28.4	Very low	30.3	Very low	119 Å²	119	145.1 Å²	145.1	73%	0.73	79%	0.79	S	S	*	*				84.3	148.3	95.1	79.3	0	0	0	0	115
9	R	27	Very low	30.3	Very low	229 Å²	229	145.4 Å²	145.4	86%	0.864	79%	0.791	S	S	*	*			cis	-168.4	169.2	6.4	-137.7	176.2	179	176.1	-0.2	109.9
10	S	29	Very low	30.5	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	79%	0.793	S	S	*	*			trans	94.8	136.9	148.3	89.1	0	0	0	0	117
11	V	28.2	Very low	30.7	Very low	138 Å²	138	145.3 Å²	145.3	84%	0.836	79%	0.793	S	S	*	*			cis	-155.8	152.6	17.6	-179.4	0	0	0	0	111
12	S	28.3	Very low	30.4	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	78%	0.782	S	S	*	*			trans	-68.2	-173.4	171.2	-38	0	0	0	0	114.9
13	P	38	Very low	30.6	Very low	112 Å²	112	147.6 Å²	147.6	73%	0.727	79%	0.788	S	S	*	*				-139.4	136.8	54.1	23.9	2.1	0	0	0	116.3
14	Q	28.4	Very low	31.1	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	80%	0.797	S	S	*	*				72.3	110.6	100.7	-78.7	164.1	-32	0	0	119.7
15	C	28.5	Very low	30.9	Very low	129 Å²	129	151.8 Å²	151.8	87%	0.872	81%	0.805	S	S	*	*			trans	-153.2	141.6	131.2	-98	0	0	0	0	109.4
16	P	33.4	Very low	31	Very low	126 Å²	126	146.8 Å²	146.8	82%	0.818	80%	0.804	S	S	*	*			trans	-92	149.2	-157.6	35.4	-33.6	0	0	0	114.2
17	K	30.5	Very low	31.3	Very low	198 Å²	198	146.7 Å²	146.7	86%	0.861	81%	0.814	S	S	*	*			trans	-119.1	159.1	163.9	-89.3	-174.3	-178.4	179.2	0	108.7
18	P	35.7	Very low	31.5	Very low	119 Å²	119	143.8 Å²	143.8	77%	0.773	82%	0.816	S	S	*	*			trans	-89.3	134.9	-160.1	34.5	-30.4	0	0	0	112.6
19	D	30.3	Very low	31.7	Very low	150 Å²	150	147.1 Å²	147.1	80%	0.802	83%	0.826	S	S	*	*			trans	-111.8	123.3	156.6	-87.5	-20.7	0	0	0	105.8
20	E	34.1	Very low	31.9	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	83%	0.829	S	S	*	*				73.3	133.1	80.4	-85.8	-166.5	-175.7	0	0	115.4
21	S	33.4	Very low	32	Very low	111 Å²	111	147 Å²	147	78%	0.776	83%	0.833	S	S	*	*			trans	73.6	97	167.2	81.9	0	0	0	0	119.6
22	E	31.6	Very low	32	Very low	201 Å²	201	145.4 Å²	145.4	94%	0.939	83%	0.834	S	S	*	*				-163.7	96.1	126.4	-105	175.8	-159.9	0	0	108
23	E	34	Very low	32	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	84%	0.843	S	S	*	*			trans	-82.2	132.1	171.4	-70.7	-173.9	160	0	0	109.7	H25	E23-H25 PolarHBondContact O-N 2.89Å
24	P	37.3	Very low	31.5	Very low	129 Å²	129	143.6 Å²	143.6	84%	0.838	85%	0.851	S	S	*	*			trans	-82.7	115.5	174	30.2	-29.1	0	0	0	110.3	G26	P24-G26 PolarHBondContact O-N 2.62Å
25	H	30.4	Very low	31.6	Very low	191 Å²	191	144.2 Å²	144.2	88%	0.884	85%	0.854	S	S	*	*			trans	-61.6	123.2	172.1	-90.4	-60.2	0	0	0	111.4	E23	E23-H25 PolarHBondContact O-N 2.89Å
26	G	31.1	Very low	31.7	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	85%	0.852	S	S	*	*			trans	-76.9	146	167.9	0	0	0	0	0	112	P24	P24-G26 PolarHBondContact O-N 2.62Å
27	T	32.8	Very low	31.6	Very low	146 Å²	146	145 Å²	145	90%	0.896	86%	0.856	S	S	*	*			trans	-110.2	105.7	170.4	-43	0	0	0	0	108.3
28	A	31.8	Very low	31.5	Very low	92 Å²	92	138.8 Å²	138.8	76%	0.76	85%	0.849	S	S	*	*			trans	-82.8	137.3	172	0	0	0	0	0	110.4
29	M	32.2	Very low	31.2	Very low	190 Å²	190	138.6 Å²	138.6	94%	0.936	85%	0.85	S	S	*	*			trans	-61.1	127.7	163.3	-94.5	174.2	155.5	0	0	110.6
30	E	31.1	Very low	31.3	Very low	197 Å²	197	137.7 Å²	137.7	92%	0.921	85%	0.85	S	S	*	*			trans	-115	128.4	156.5	-85.7	-168.3	158.4	0	0	110.2
31	T	30.1	Very low	31.4	Very low	136 Å²	136	138.3 Å²	138.3	83%	0.834	85%	0.85	S	S	*	*			trans	-93.5	124.5	171	47.2	0	0	0	0	109.8
32	A	29.4	Very low	31.5	Very low	104 Å²	104	137.6 Å²	137.6	86%	0.86	85%	0.845	S	S	*	*			trans	-170.9	118.1	148.7	0	0	0	0	0	113.5
33	G	28.6	Very low	31.6	Very low	87 Å²	87	137.4 Å²	137.4	90%	0.897	84%	0.844	S	S	*	*			trans	71	94.7	131.9	0	0	0	0	0	119.9
34	G	27.9	Very low	32.1	Very low	87 Å²	87	136.1 Å²	136.1	90%	0.897	84%	0.843	S	S	*	*			trans	-97.4	116.4	151.9	0	0	0	0	0	110.8
35	Q	29.1	Very low	31.9	Very low	197 Å²	197	138.1 Å²	138.1	92%	0.921	85%	0.845	S	S	*	*			trans	-110.2	131	154.5	-120.5	-179.5	-4.3	0	0	107.4
36	A	31.8	Very low	32.7	Very low	99 Å²	99	135 Å²	135	82%	0.818	84%	0.842	S	S	*	*			trans	-64.6	136.6	173.8	0	0	0	0	0	111.3
37	D	29.7	Very low	33.2	Very low	171 Å²	171	140.3 Å²	140.3	91%	0.914	85%	0.848	S	S	*	*				-169.1	143.2	100.1	-136.9	-9.2	0	0	0	110.5
38	G	28.5	Very low	33.9	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	85%	0.847	S	S	*	*			trans	149.5	86.2	176.6	0	0	0	0	0	114
39	S	30.3	Very low	34.8	Very low	114 Å²	114	141.8 Å²	141.8	80%	0.797	85%	0.846	S	S	*	*			trans	-61.5	144.4	176	50	0	0	0	0	113.9
40	V	32.4	Very low	35.9	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	84%	0.835	S	S	*	*				165.2	117.9	123.7	164.6	0	0	0	0	111
41	K	35.9	Very low	37.7	Very low	192 Å²	192	133.7 Å²	133.7	84%	0.835	82%	0.815	S	S	*	*			trans	5.7	152.5	147.3	-56.3	177.1	178.3	-178.4	0	119.3
42	S	34.8	Very low	39.3	Very low	97 Å²	97	135 Å²	135	68%	0.678	81%	0.809	S	S	*	*			cis	177.3	143.4	-16.2	47.8	0	0	0	0	105.8
43	E	33.7	Very low	41.1	Very low	196 Å²	196	137.7 Å²	137.7	92%	0.916	80%	0.803	S	S	*	*			trans	167.4	142.9	133.6	-91.2	176.3	-168.4	0	0	113.7
44	N	44.4	Very low	42.9	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	79%	0.788	S	S	*	*			trans	-96.9	154.6	-166.3	-79.4	-27.1	0	0	0	114.4
45	I	34.4	Very low	44.8	Very low	172 Å²	172	140.3 Å²	140.3	88%	0.882	77%	0.77	S	S	*	*			trans	-149.1	146.1	145.4	-61.2	-171.5	0	0	0	109.7
46	P	46.1	Very low	46.9	Very low	125 Å²	125	136.8 Å²	136.8	81%	0.812	75%	0.754	S	S	*	*			trans	-107.7	168.5	-149.2	40.3	-32.7	0	0	0	118.8
47	E	41.4	Very low	48.9	Very low	184 Å²	184	138.5 Å²	138.5	86%	0.86	75%	0.745	S	S	*	*			trans	-72.4	154	-175.8	-74.9	171.3	129.6	0	0	117.4
48	V	47.6	Very low	50.8	Low	145 Å²	145	136.1 Å²	136.1	88%	0.879	73%	0.728	S	S	*	*			trans	-107.2	130.6	159.8	175.9	0	0	0	0	108.6
49	V	51.9	Low	52.9	Low	123 Å²	123	137.1 Å²	137.1	75%	0.745	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-94.4	125.5	-169.3	179.1	0	0	0	0	111.3
50	I	53.8	Low	55.1	Low	138 Å²	138	138 Å²	138	71%	0.708	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-95.1	135	168.6	-61.9	171.4	0	0	0	108.6
51	T	70.2	Confident	57.2	Low	80 Å²	80	137.5 Å²	137.5	49%	0.491	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-89.8	144.3	-178	49.6	0	0	0	0	112.4	E53 M54	T51-E53 VanDerWaalsContact C-N 3.28Å; T51-E53 PolarHBondContact O-N 3.44Å; T51-M54 PolarHBondContact O-N 2.75Å
52	K	64.4	Low	58.8	Low	164 Å²	164	133.4 Å²	133.4	71%	0.713	69%	0.686	S	S	*	*	H	α-helix	trans	-57.6	-29.9	-175.7	-89.5	-177.1	170.1	-177	0	115.8	E55 E56	K52-E55 PolarHBondContact O-N 2.98Å; K52-E56 PolarHBondContact O-N 3.16Å
53	E	66.7	Low	60.7	Low	159 Å²	159	133.6 Å²	133.6	74%	0.743	68%	0.677	S	S	*	*	H	α-helix	trans	-70.5	-34.2	-179.2	-66.3	175.8	174	0	0	111.8	T51 E55 E56 E57	T51-E53 VanDerWaalsContact C-N 3.28Å; T51-E53 PolarHBondContact O-N 3.44Å; E53-E55 VanDerWaalsContact C-N 3.32Å; E53-E56 PolarHBondContact O-N 3.11Å; E53-E57 PolarHBondContact O-N 3.38Å; E53-E57 VanDerWaalsContact O-N 3.13Å
54	M	66.1	Low	62.7	Low	117 Å²	117	129 Å²	129	58%	0.576	66%	0.655	S	S	*	*	H	α-helix	trans	-68.1	-34.1	174.3	-72	-177.8	58.9	0	0	111.8	T51 E58	T51-M54 PolarHBondContact O-N 2.75Å; M54-E58 VanDerWaalsContact O-CB 3.27Å; M54-E58 WeakPolarHBondContact O-CB 3.47Å; M54-E58 PolarHBondContact O-N 3.49Å
55	E	67.4	Low	64.2	Low	112 Å²	112	122.9 Å²	122.9	52%	0.523	63%	0.631	S	S	.	*	H	α-helix	trans	-71.1	-33.3	178.4	-159.7	175.1	-162.4	0	0	111.7	K52 E53 N59	K52-E55 PolarHBondContact O-N 2.98Å; E53-E55 VanDerWaalsContact C-N 3.32Å; E55-N59 WeakPolarHBondContact O-CB 3.26Å; E55-N59 VanDerWaalsContact O-CG 3.24Å; E55-N59 PolarHBondContact O-N 2.98Å; E55-N59 VanDerWaalsContact O-N 3.1Å; E55-N59 PolarHBondContact O-ND2 2.61Å
56	E	72.9	Confident	65.9	Low	124 Å²	124	119.5 Å²	119.5	58%	0.579	61%	0.611	S	S	*	*	H	α-helix	trans	-74.1	-40	175.2	-73.4	-179	-175.9	0	0	112.7	K52 E53 N59 Q60	K52-E56 PolarHBondContact O-N 3.16Å; E53-E56 PolarHBondContact O-N 3.11Å; E56-N59 PolarHBondContact O-N 3.1Å; E56-Q60 WeakPolarHBondContact O-CG 3.46Å; E56-Q60 PolarHBondContact O-N 2.76Å
57	E	75.1	Confident	67.4	Low	135 Å²	135	121 Å²	121	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-65.8	-40.4	173.4	-79.1	-167.3	157.5	0	0	112.2	E53 Q60 L61	E53-E57 PolarHBondContact O-N 3.38Å; E53-E57 VanDerWaalsContact O-N 3.13Å; E57-Q60 PolarHBondContact O-N 3.47Å; E57-L61 WeakPolarHBondContact O-CG 3.45Å; E57-L61 PolarHBondContact O-N 2.84Å
58	E	69.5	Low	69	Low	120 Å²	120	117.9 Å²	117.9	56%	0.561	58%	0.584	S	S	*	*	H	α-helix	trans	-64.4	-40.9	177.2	-167.2	178.5	-178.8	0	0	111.5	M54 L61 M62	M54-E58 VanDerWaalsContact O-CB 3.27Å; M54-E58 WeakPolarHBondContact O-CB 3.47Å; M54-E58 PolarHBondContact O-N 3.49Å; E58-L61 PolarHBondContact O-N 3.18Å; E58-M62 HydrophobicContact CG-CE 3.91Å; E58-M62 WeakPolarHBondContact O-CB 3.34Å; E58-M62 PolarHBondContact O-N 3.37Å
59	N	72.8	Confident	70	Confident	91 Å²	91	117.3 Å²	117.3	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-65.2	-39.1	175	-80	-40.6	0	0	0	112.7	E55 E56 M62 E63	E55-N59 WeakPolarHBondContact O-CB 3.26Å; E55-N59 VanDerWaalsContact O-CG 3.24Å; E55-N59 PolarHBondContact O-N 2.98Å; E55-N59 VanDerWaalsContact O-N 3.1Å; E55-N59 PolarHBondContact O-ND2 2.61Å; E56-N59 PolarHBondContact O-N 3.1Å; N59-M62 PolarHBondContact O-N 2.6Å; N59-E63 WeakPolarHBondContact O-CB 3.43Å; N59-E63 PolarHBondContact O-N 2.93Å
60	Q	76.6	Confident	70.9	Confident	131 Å²	131	117.7 Å²	117.7	61%	0.612	56%	0.563	S	S	*	*	H	α-helix	trans	-67.3	-41.3	176.8	-73.5	177.8	26.8	0	0	112.3	E56 E57 E63 E64	E56-Q60 WeakPolarHBondContact O-CG 3.46Å; E56-Q60 PolarHBondContact O-N 2.76Å; E57-Q60 PolarHBondContact O-N 3.47Å; Q60-E63 PolarHBondContact O-N 3Å; Q60-E64 PolarHBondContact O-N 3.25Å
61	L	76.3	Confident	72	Confident	122 Å²	122	116 Å²	116	64%	0.639	55%	0.553	S	S	*	*	H	α-helix	trans	-66.3	-37.2	175.8	-75.4	168.2	0	0	0	112	E57 E58 G65	E57-L61 WeakPolarHBondContact O-CG 3.45Å; E57-L61 PolarHBondContact O-N 2.84Å; E58-L61 PolarHBondContact O-N 3.18Å; L61-G65 PolarHBondContact O-N 2.91Å
62	M	68.9	Low	72.3	Confident	105 Å²	105	119.2 Å²	119.2	52%	0.517	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-45.2	171.3	-92.1	-167.3	-91.4	0	0	111.8	E58 N59 E64 G65 E66	E58-M62 HydrophobicContact CG-CE 3.91Å; E58-M62 WeakPolarHBondContact O-CB 3.34Å; E58-M62 PolarHBondContact O-N 3.37Å; N59-M62 PolarHBondContact O-N 2.6Å; M62-E64 PolarHBondContact O-N 3.34Å; M62-G65 PolarHBondContact O-N 3.35Å; M62-E66 PolarHBondContact O-N 3.47Å
63	E	74.5	Confident	72.5	Confident	102 Å²	102	117 Å²	117	48%	0.477	56%	0.557	S	S	.	*	H	α-helix	trans	-66.7	-36.7	-178.8	-145.4	-166.5	152.2	0	0	112.2	N59 Q60 R67	N59-E63 WeakPolarHBondContact O-CB 3.43Å; N59-E63 PolarHBondContact O-N 2.93Å; Q60-E63 PolarHBondContact O-N 3Å; E63-R67 WeakPolarHBondContact O-CG 3.25Å; E63-R67 PolarHBondContact O-N 3.02Å; E63-R67 VanDerWaalsContact O-N 3.1Å; E63-R67 IonicContact OE1-CZ 2.95Å; E63-R67 IonicContact OE1-NE 3.42Å; E63-R67 IonicContact OE1-NH2 3.04Å; E63-R67 PolarHBondContact OE1-NH2 3.21Å
64	E	76.2	Confident	72.7	Confident	98 Å²	98	115.6 Å²	115.6	46%	0.458	55%	0.549	S	S	.	.	H	α-helix	trans	-71.1	-35.6	174.8	-148.2	-166.5	147.6	0	0	112.2	Q60 M62 R67 K68	Q60-E64 PolarHBondContact O-N 3.25Å; M62-E64 PolarHBondContact O-N 3.34Å; E64-R67 PolarHBondContact O-N 2.96Å; E64-K68 WeakPolarHBondContact O-CG 3.49Å; E64-K68 PolarHBondContact O-N 3.18Å; E64-K68 VanDerWaalsContact O-N 3.09Å; E64-K68 WeakPolarHBondContact OE1-CE 3.5Å; E64-K68 IonicContact OE1-NZ 3.73Å; E64-K68 PolarHBondContact OE1-NZ 3.3Å
65	G	76	Confident	73.1	Confident	34 Å²	34	115.9 Å²	115.9	35%	0.351	55%	0.547	S	S	.	.	H	α-helix	trans	-60.8	-48.7	171.1	0	0	0	0	0	112.2	L61 M62 R67 K68 E69	L61-G65 PolarHBondContact O-N 2.91Å; M62-G65 PolarHBondContact O-N 3.35Å; G65-R67 VanDerWaalsContact C-N 3.32Å; G65-R67 PolarHBondContact O-N 2.79Å; G65-K68 PolarHBondContact O-N 2.77Å; G65-E69 WeakPolarHBondContact O-CB 3.19Å; G65-E69 PolarHBondContact O-N 3.04Å
66	E	69.4	Low	73.3	Confident	101 Å²	101	113 Å²	113	47%	0.472	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-37.8	176.6	-79.6	-161.2	-178.4	0	0	112.9	M62 E69 K70	M62-E66 PolarHBondContact O-N 3.47Å; E66-E69 PolarHBondContact O-N 3.45Å; E66-K70 WeakPolarHBondContact O-CB 3.36Å; E66-K70 WeakPolarHBondContact O-CD 3.17Å; E66-K70 VanDerWaalsContact O-CG 3.27Å; E66-K70 WeakPolarHBondContact O-CG 3.49Å; E66-K70 PolarHBondContact O-N 2.87Å; E66-K70 IonicContact OE2-NZ 2.94Å; E66-K70 PolarHBondContact OE2-NZ 2.99Å
67	R	77.3	Confident	72.6	Confident	156 Å²	156	112.6 Å²	112.6	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-66.2	-43.2	177.1	-76.3	178.7	-171.3	170.4	8.4	111.5	E63 E64 G65 E69 K70 E71	E63-R67 WeakPolarHBondContact O-CG 3.25Å; E63-R67 PolarHBondContact O-N 3.02Å; E63-R67 VanDerWaalsContact O-N 3.1Å; E63-R67 IonicContact OE1-CZ 2.95Å; E63-R67 IonicContact OE1-NE 3.42Å; E63-R67 IonicContact OE1-NH2 3.04Å; E63-R67 PolarHBondContact OE1-NH2 3.21Å; E64-R67 PolarHBondContact O-N 2.96Å; G65-R67 VanDerWaalsContact C-N 3.32Å; G65-R67 PolarHBondContact O-N 2.79Å; R67-E69 VanDerWaalsContact C-N 3.35Å; R67-K70 PolarHBondContact O-N 2.79Å; R67-E71 PolarHBondContact O-N 3.32Å
68	K	75.9	Confident	72	Confident	118 Å²	118	110.3 Å²	110.3	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-38.8	176.3	-73.8	171.6	-175	158.1	0	111.7	E64 G65 E71 M72	E64-K68 WeakPolarHBondContact O-CG 3.49Å; E64-K68 PolarHBondContact O-N 3.18Å; E64-K68 VanDerWaalsContact O-N 3.09Å; E64-K68 WeakPolarHBondContact OE1-CE 3.5Å; E64-K68 IonicContact OE1-NZ 3.73Å; E64-K68 PolarHBondContact OE1-NZ 3.3Å; G65-K68 PolarHBondContact O-N 2.77Å; K68-E71 PolarHBondContact O-N 3.02Å; K68-M72 WeakPolarHBondContact O-CB 3.44Å; K68-M72 WeakPolarHBondContact O-CG 3.46Å; K68-M72 PolarHBondContact O-N 3.21Å
69	E	67.7	Low	71.7	Confident	134 Å²	134	107.2 Å²	107.2	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-66.8	-44.1	176.1	-166.9	176.4	-173.1	0	0	111.9	G65 E66 R67 E71 M72 M73	G65-E69 WeakPolarHBondContact O-CB 3.19Å; G65-E69 PolarHBondContact O-N 3.04Å; E66-E69 PolarHBondContact O-N 3.45Å; R67-E69 VanDerWaalsContact C-N 3.35Å; E69-E71 VanDerWaalsContact C-N 3.29Å; E69-E71 PolarHBondContact O-N 3.22Å; E69-M72 PolarHBondContact O-N 3.3Å; E69-M73 WeakPolarHBondContact O-CB 3.43Å; E69-M73 WeakPolarHBondContact O-CG 3.38Å; E69-M73 PolarHBondContact O-N 2.81Å
70	K	71.3	Confident	71	Confident	130 Å²	130	110.1 Å²	110.1	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-59.7	-38.7	173.4	-76.7	165.7	-175.5	150.5	0	111.8	E66 R67 K74	E66-K70 WeakPolarHBondContact O-CB 3.36Å; E66-K70 WeakPolarHBondContact O-CD 3.17Å; E66-K70 VanDerWaalsContact O-CG 3.27Å; E66-K70 WeakPolarHBondContact O-CG 3.49Å; E66-K70 PolarHBondContact O-N 2.87Å; E66-K70 IonicContact OE2-NZ 2.94Å; E66-K70 PolarHBondContact OE2-NZ 2.99Å; R67-K70 PolarHBondContact O-N 2.79Å; K70-K74 WeakPolarHBondContact O-CB 3.36Å; K70-K74 PolarHBondContact O-N 3.26Å
71	E	77.8	Confident	69.9	Low	104 Å²	104	110.5 Å²	110.5	49%	0.486	53%	0.529	S	S	.	.	H	α-helix	trans	-71.4	-40.1	178.5	-153.6	-169.2	148.2	0	0	112.7	R67 K68 E69 K74 K75	R67-E71 PolarHBondContact O-N 3.32Å; K68-E71 PolarHBondContact O-N 3.02Å; E69-E71 VanDerWaalsContact C-N 3.29Å; E69-E71 PolarHBondContact O-N 3.22Å; E71-K74 PolarHBondContact O-N 2.82Å; E71-K75 PolarHBondContact O-N 3.41Å; E71-K75 WeakPolarHBondContact OE1-CE 3.05Å; E71-K75 IonicContact OE1-NZ 3.83Å; E71-K75 PolarHBondContact OE1-NZ 3.45Å
72	M	74.8	Confident	69.1	Low	146 Å²	146	112.3 Å²	112.3	72%	0.719	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-44	173.7	-77.4	-110.2	-77.2	0	0	111.8	K68 E69 K74 K75 A76	K68-M72 WeakPolarHBondContact O-CB 3.44Å; K68-M72 WeakPolarHBondContact O-CG 3.46Å; K68-M72 PolarHBondContact O-N 3.21Å; E69-M72 PolarHBondContact O-N 3.3Å; M72-K74 VanDerWaalsContact C-N 3.32Å; M72-K74 PolarHBondContact O-N 2.63Å; M72-K75 PolarHBondContact O-N 3.12Å; M72-A76 WeakPolarHBondContact O-CB 3.3Å; M72-A76 PolarHBondContact O-N 3.21Å
73	M	69	Low	68.4	Low	117 Å²	117	112.1 Å²	112.1	58%	0.576	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-38.8	174.9	-78.6	-72.4	-92.1	0	0	111.9	E69 A76 Q77	E69-M73 WeakPolarHBondContact O-CB 3.43Å; E69-M73 WeakPolarHBondContact O-CG 3.38Å; E69-M73 PolarHBondContact O-N 2.81Å; M73-A76 PolarHBondContact O-N 3.32Å; M73-Q77 WeakPolarHBondContact O-CG 3.48Å; M73-Q77 PolarHBondContact O-N 3.35Å
74	K	71.1	Confident	67.4	Low	131 Å²	131	109 Å²	109	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-43.4	176.3	-164.2	175.7	179.7	-177.2	0	112	K70 E71 M72 Q77 E78	K70-K74 WeakPolarHBondContact O-CB 3.36Å; K70-K74 PolarHBondContact O-N 3.26Å; E71-K74 PolarHBondContact O-N 2.82Å; M72-K74 VanDerWaalsContact C-N 3.32Å; M72-K74 PolarHBondContact O-N 2.63Å; K74-Q77 PolarHBondContact O-N 3.09Å; K74-E78 WeakPolarHBondContact O-CG 3.42Å; K74-E78 PolarHBondContact O-N 2.94Å
75	K	75.3	Confident	66	Low	122 Å²	122	108 Å²	108	53%	0.53	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-38.6	174.7	-77.3	175.7	-174.6	157.7	0	112.5	E71 M72 E78 S79	E71-K75 PolarHBondContact O-N 3.41Å; E71-K75 WeakPolarHBondContact OE1-CE 3.05Å; E71-K75 IonicContact OE1-NZ 3.83Å; E71-K75 PolarHBondContact OE1-NZ 3.45Å; M72-K75 PolarHBondContact O-N 3.12Å; K75-E78 PolarHBondContact O-N 3.13Å; K75-S79 PolarHBondContact O-N 3.24Å; K75-S79 PolarHBondContact O-OG 3.23Å
76	A	70.6	Confident	64.7	Low	52 Å²	52	111 Å²	111	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-37.4	174.7	0	0	0	0	0	112.5	M72 M73 S79 F80	M72-A76 WeakPolarHBondContact O-CB 3.3Å; M72-A76 PolarHBondContact O-N 3.21Å; M73-A76 PolarHBondContact O-N 3.32Å; A76-S79 PolarHBondContact O-OG 3.07Å; A76-F80 VanDerWaalsContact O-CB 3.31Å; A76-F80 WeakPolarHBondContact O-CB 3.18Å; A76-F80 PolarHBondContact O-N 3.38Å
77	Q	59	Low	64.1	Low	115 Å²	115	110.9 Å²	110.9	54%	0.537	53%	0.528	S	S	.	.	H	α-helix	trans	-66.2	-37.2	172.3	-76.3	-179	-1.9	0	0	112.3	M73 K74 K81	M73-Q77 WeakPolarHBondContact O-CG 3.48Å; M73-Q77 PolarHBondContact O-N 3.35Å; K74-Q77 PolarHBondContact O-N 3.09Å; Q77-K81 WeakPolarHBondContact O-CB 3.36Å; Q77-K81 VanDerWaalsContact O-CG 3.27Å; Q77-K81 WeakPolarHBondContact O-CG 3.3Å; Q77-K81 PolarHBondContact O-N 2.91Å
78	E	61.9	Low	62.8	Low	88 Å²	88	109.1 Å²	109.1	41%	0.411	52%	0.521	S	S	.	.	H	α-helix	trans	-69.9	-40.5	177.4	-74.8	176.1	-171.1	0	0	112.7	K74 K75 K81 R82	K74-E78 WeakPolarHBondContact O-CG 3.42Å; K74-E78 PolarHBondContact O-N 2.94Å; K75-E78 PolarHBondContact O-N 3.13Å; E78-K81 PolarHBondContact O-N 3.22Å; E78-R82 PolarHBondContact O-N 3.34Å
79	S	64.2	Low	61.4	Low	55 Å²	55	109.7 Å²	109.7	39%	0.385	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-43.3	174.3	61.4	0	0	0	0	111.7	K75 A76 K81 R82 D83	K75-S79 PolarHBondContact O-N 3.24Å; K75-S79 PolarHBondContact O-OG 3.23Å; A76-S79 PolarHBondContact O-OG 3.07Å; S79-K81 VanDerWaalsContact C-N 3.3Å; S79-K81 PolarHBondContact O-N 2.99Å; S79-R82 PolarHBondContact O-N 3.14Å; S79-R82 VanDerWaalsContact O-N 3.13Å; S79-D83 PolarHBondContact O-N 3.5Å
80	F	56.9	Low	60.5	Low	152 Å²	152	110 Å²	110	67%	0.667	52%	0.523	S	S	*	.	H	α-helix	trans	-62.3	-36.7	175.9	-170	-97	0	0	0	112.5	A76 S84	A76-F80 VanDerWaalsContact O-CB 3.31Å; A76-F80 WeakPolarHBondContact O-CB 3.18Å; A76-F80 PolarHBondContact O-N 3.38Å; F80-S84 WeakPolarHBondContact O-CB 3.21Å; F80-S84 PolarHBondContact O-N 3.4Å
81	K	54.5	Low	59.5	Low	138 Å²	138	111.3 Å²	111.3	60%	0.6	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-41.9	173.1	-79.2	174.7	-178	177.5	0	112.1	Q77 E78 S79 Q85	Q77-K81 WeakPolarHBondContact O-CB 3.36Å; Q77-K81 VanDerWaalsContact O-CG 3.27Å; Q77-K81 WeakPolarHBondContact O-CG 3.3Å; Q77-K81 PolarHBondContact O-N 2.91Å; E78-K81 PolarHBondContact O-N 3.22Å; S79-K81 VanDerWaalsContact C-N 3.3Å; S79-K81 PolarHBondContact O-N 2.99Å; K81-Q85 WeakPolarHBondContact O-CG 3.28Å; K81-Q85 PolarHBondContact O-N 3.16Å; K81-Q85 VanDerWaalsContact O-N 3.08Å
82	R	58.9	Low	58	Low	160 Å²	160	108.2 Å²	108.2	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-46.2	175.7	-75.6	-175.7	-175.9	129.5	3.3	112.2	E78 S79 S84 Q85 D86	E78-R82 PolarHBondContact O-N 3.34Å; S79-R82 PolarHBondContact O-N 3.14Å; S79-R82 VanDerWaalsContact O-N 3.13Å; R82-S84 VanDerWaalsContact C-N 3.3Å; R82-S84 PolarHBondContact O-N 2.81Å; R82-Q85 WeakPolarHBondContact O-CA 3.28Å; R82-Q85 WeakPolarHBondContact O-CB 2.91Å; R82-Q85 PolarHBondContact O-N 3.5Å; R82-D86 PolarHBondContact O-N 3.37Å
83	D	54.9	Low	56.7	Low	101 Å²	101	105.1 Å²	105.1	54%	0.54	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-36.6	178.4	-72	-16.8	0	0	0	111.6	S79 Q85 D86 V87	S79-D83 PolarHBondContact O-N 3.5Å; D83-Q85 VanDerWaalsContact C-N 3.32Å; D83-Q85 PolarHBondContact O-N 3.38Å; D83-D86 PolarHBondContact O-N 3.25Å; D83-V87 VanDerWaalsContact O-CG2 3.31Å; D83-V87 WeakPolarHBondContact O-CG2 3.26Å; D83-V87 PolarHBondContact O-N 3.02Å
84	S	53.1	Low	55.6	Low	38 Å²	38	104 Å²	104	27%	0.266	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-38.3	171.6	-165.4	0	0	0	0	111.9	F80 R82 R88	F80-S84 WeakPolarHBondContact O-CB 3.21Å; F80-S84 PolarHBondContact O-N 3.4Å; R82-S84 VanDerWaalsContact C-N 3.3Å; R82-S84 PolarHBondContact O-N 2.81Å; S84-R88 WeakPolarHBondContact O-CB 3.17Å; S84-R88 WeakPolarHBondContact O-CD 3.45Å; S84-R88 WeakPolarHBondContact O-CG 3.4Å; S84-R88 PolarHBondContact O-N 3.27Å; S84-R88 VanDerWaalsContact O-N 3.1Å; S84-R88 PolarHBondContact O-NE 3Å; S84-R88 PolarHBondContact OG-NE 3.02Å; S84-R88 PolarHBondContact OG-NH2 2.9Å
85	Q	46.2	Very low	54.5	Low	77 Å²	77	100.2 Å²	100.2	36%	0.36	47%	0.474	S	S	.	.	H	α-helix	trans	-68.5	-39.9	176.6	-75.4	177.2	-20.2	0	0	112.4	K81 R82 D83 R88 F89 L437	K81-Q85 WeakPolarHBondContact O-CG 3.28Å; K81-Q85 PolarHBondContact O-N 3.16Å; K81-Q85 VanDerWaalsContact O-N 3.08Å; R82-Q85 WeakPolarHBondContact O-CA 3.28Å; R82-Q85 WeakPolarHBondContact O-CB 2.91Å; R82-Q85 PolarHBondContact O-N 3.5Å; D83-Q85 VanDerWaalsContact C-N 3.32Å; D83-Q85 PolarHBondContact O-N 3.38Å; Q85-R88 WeakPolarHBondContact O-CB 3.05Å; Q85-R88 PolarHBondContact O-N 3.49Å; Q85-F89 WeakPolarHBondContact O-CB 3.44Å; Q85-F89 PolarHBondContact O-N 3.37Å; Q85-L437 VanDerWaalsContact NE2-CD1 3.3Å
86	D	49.7	Very low	53.3	Low	95 Å²	95	96.2 Å²	96.2	51%	0.508	46%	0.458	S	S	.	.	H	α-helix	trans	-70.1	-37.2	178.7	-84	-5.8	0	0	0	112.8	R82 D83 R88 F89 K90	R82-D86 PolarHBondContact O-N 3.37Å; D83-D86 PolarHBondContact O-N 3.25Å; D86-R88 VanDerWaalsContact C-N 3.34Å; D86-F89 PolarHBondContact O-N 2.83Å; D86-K90 WeakPolarHBondContact O-CB 3.22Å; D86-K90 WeakPolarHBondContact O-CG 3.1Å; D86-K90 PolarHBondContact O-N 3.04Å
87	V	55.8	Low	52.2	Low	100 Å²	100	99 Å²	99	61%	0.606	46%	0.463	S	S	*	.	H	α-helix	trans	-65.9	-38.6	172.4	173.8	0	0	0	0	110.8	D83 R91	D83-V87 VanDerWaalsContact O-CG2 3.31Å; D83-V87 WeakPolarHBondContact O-CG2 3.26Å; D83-V87 PolarHBondContact O-N 3.02Å; V87-R91 WeakPolarHBondContact O-CB 3.32Å; V87-R91 PolarHBondContact O-N 3.15Å
88	R	49.8	Very low	51.6	Low	118 Å²	118	99.3 Å²	99.3	45%	0.445	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-45.1	173.6	-72.5	168	-154.1	-159.1	2.9	111.6	S84 Q85 D86 R91 L92	S84-R88 WeakPolarHBondContact O-CB 3.17Å; S84-R88 WeakPolarHBondContact O-CD 3.45Å; S84-R88 WeakPolarHBondContact O-CG 3.4Å; S84-R88 PolarHBondContact O-N 3.27Å; S84-R88 VanDerWaalsContact O-N 3.1Å; S84-R88 PolarHBondContact O-NE 3Å; S84-R88 PolarHBondContact OG-NE 3.02Å; S84-R88 PolarHBondContact OG-NH2 2.9Å; Q85-R88 WeakPolarHBondContact O-CB 3.05Å; Q85-R88 PolarHBondContact O-N 3.49Å; D86-R88 VanDerWaalsContact C-N 3.34Å; R88-R91 PolarHBondContact O-N 2.71Å; R88-L92 WeakPolarHBondContact O-CB 3.36Å; R88-L92 PolarHBondContact O-N 3.25Å
89	F	46.3	Very low	50.7	Low	130 Å²	130	96.6 Å²	96.6	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-63.3	-43.5	178.6	-171.5	-98.9	0	0	0	111.6	Q85 D86 R91 L92 Q93	Q85-F89 WeakPolarHBondContact O-CB 3.44Å; Q85-F89 PolarHBondContact O-N 3.37Å; D86-F89 PolarHBondContact O-N 2.83Å; F89-R91 VanDerWaalsContact C-N 3.35Å; F89-R91 PolarHBondContact O-N 3.32Å; F89-L92 PolarHBondContact O-N 2.69Å; F89-Q93 WeakPolarHBondContact O-CB 3.35Å; F89-Q93 PolarHBondContact O-N 3.46Å
90	K	50.8	Low	49.9	Very low	141 Å²	141	96.6 Å²	96.6	61%	0.613	45%	0.448	S	S	*	.	H	α-helix	trans	-62.9	-38.1	174.2	-75.9	173.1	-177.8	167.3	0	112.7	D86 Q93 H94	D86-K90 WeakPolarHBondContact O-CB 3.22Å; D86-K90 WeakPolarHBondContact O-CG 3.1Å; D86-K90 PolarHBondContact O-N 3.04Å; K90-Q93 PolarHBondContact O-N 3.33Å; K90-H94 VanDerWaalsContact O-CB 3.32Å; K90-H94 WeakPolarHBondContact O-CB 3.49Å; K90-H94 PolarHBondContact O-N 2.87Å
91	R	50	Low	49.5	Very low	157 Å²	157	94.7 Å²	94.7	59%	0.592	44%	0.444	S	S	*	.	H	α-helix	trans	-69	-39.6	177.1	-164.8	171.4	-176.5	175.8	-1.9	111.9	V87 R88 F89 H94 L95	V87-R91 WeakPolarHBondContact O-CB 3.32Å; V87-R91 PolarHBondContact O-N 3.15Å; R88-R91 PolarHBondContact O-N 2.71Å; F89-R91 VanDerWaalsContact C-N 3.35Å; F89-R91 PolarHBondContact O-N 3.32Å; R91-H94 PolarHBondContact O-N 3.1Å; R91-L95 PolarHBondContact O-N 3.46Å
92	L	46.1	Very low	49.2	Very low	39 Å²	39	92.5 Å²	92.5	20%	0.204	43%	0.432	C	S	.	.	H	α-helix	trans	-64.2	-45.2	173	-175.1	120.2	0	0	0	111.3	R88 F89 H94 L95 L96 W431	R88-L92 WeakPolarHBondContact O-CB 3.36Å; R88-L92 PolarHBondContact O-N 3.25Å; F89-L92 PolarHBondContact O-N 2.69Å; L92-H94 VanDerWaalsContact C-N 3.29Å; L92-H94 PolarHBondContact O-N 3.14Å; L92-L95 PolarHBondContact O-N 3.3Å; L92-L96 HydrophobicContact CD2-CD1 3.62Å; L92-L96 HydrophobicContact CG-CD1 4.16Å; L92-L96 WeakPolarHBondContact O-CB 3.32Å; L92-L96 PolarHBondContact O-N 2.91Å; L92-W431 HydrophobicContact CD1-CB 4.01Å; L92-W431 HydrophobicContact CD1-CD2 3.58Å; L92-W431 HydrophobicContact CD1-CE3 4.13Å; L92-W431 HydrophobicContact CD1-CG 3.49Å; L92-W431 VanDerWaalsContact CD1-CG 3.49Å
93	Q	47.5	Very low	48.6	Very low	81 Å²	81	86.4 Å²	86.4	38%	0.379	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-36.8	176	-164.5	-178.2	8.7	0	0	112	F89 K90 L96 Q97	F89-Q93 WeakPolarHBondContact O-CB 3.35Å; F89-Q93 PolarHBondContact O-N 3.46Å; K90-Q93 PolarHBondContact O-N 3.33Å; Q93-L96 PolarHBondContact O-N 2.99Å; Q93-Q97 WeakPolarHBondContact O-CB 3.45Å; Q93-Q97 WeakPolarHBondContact O-CG 3.44Å; Q93-Q97 PolarHBondContact O-N 3.35Å
94	H	46.3	Very low	48.2	Very low	93 Å²	93	88.4 Å²	88.4	43%	0.431	42%	0.418	S	S	.	.	H	α-helix	trans	-69.1	-38.6	175.4	-172	64.4	0	0	0	112.7	K90 R91 L92 Q97 K98	K90-H94 VanDerWaalsContact O-CB 3.32Å; K90-H94 WeakPolarHBondContact O-CB 3.49Å; K90-H94 PolarHBondContact O-N 2.87Å; R91-H94 PolarHBondContact O-N 3.1Å; L92-H94 VanDerWaalsContact C-N 3.29Å; L92-H94 PolarHBondContact O-N 3.14Å; H94-Q97 PolarHBondContact O-N 3.46Å; H94-K98 WeakPolarHBondContact NE2-CE 3.26Å; H94-K98 PolarHBondContact NE2-NZ 3.41Å; H94-K98 VanDerWaalsContact NE2-NZ 3.1Å; H94-K98 WeakPolarHBondContact O-CG 3.44Å; H94-K98 PolarHBondContact O-N 3.04Å
95	L	47.8	Very low	47.9	Very low	52 Å²	52	92 Å²	92	27%	0.272	43%	0.429	S	S	.	.	H	α-helix	trans	-67.6	-39.4	172	-98	162	0	0	0	112	R91 L92 K98 S99 V421 W431	R91-L95 PolarHBondContact O-N 3.46Å; L92-L95 PolarHBondContact O-N 3.3Å; L95-K98 CarbonylContact O-C 3.56Å; L95-K98 PolarHBondContact O-N 2.94Å; L95-S99 VanDerWaalsContact O-CB 3.27Å; L95-S99 WeakPolarHBondContact O-CB 3.37Å; L95-S99 PolarHBondContact O-N 3.48Å; L95-V421 HydrophobicContact CD2-CG1 4.25Å; L95-W431 HydrophobicContact CD1-CH2 3.89Å; L95-W431 HydrophobicContact CD1-CZ2 3.92Å
96	L	49.5	Very low	48	Very low	39 Å²	39	89.2 Å²	89.2	20%	0.204	42%	0.417	C	S	.	.	H	α-helix	trans	-64.1	-41	173.1	-85.2	161.4	0	0	0	111.8	L92 Q93 S99 N100 M455	L92-L96 HydrophobicContact CD2-CD1 3.62Å; L92-L96 HydrophobicContact CG-CD1 4.16Å; L92-L96 WeakPolarHBondContact O-CB 3.32Å; L92-L96 PolarHBondContact O-N 2.91Å; Q93-L96 PolarHBondContact O-N 2.99Å; L96-S99 PolarHBondContact O-N 3.29Å; L96-N100 WeakPolarHBondContact O-CB 3.39Å; L96-N100 VanDerWaalsContact O-CG 3.25Å; L96-N100 PolarHBondContact O-N 2.93Å; L96-N100 PolarHBondContact O-ND2 3.44Å; L96-M455 HydrophobicContact CD1-SD 4.49Å
97	Q	46.6	Very low	48	Very low	111 Å²	111	86.6 Å²	86.6	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-62	-44.5	171.8	-81.1	179.9	-15.1	0	0	110.8	Q93 H94 N100 I101	Q93-Q97 WeakPolarHBondContact O-CB 3.45Å; Q93-Q97 WeakPolarHBondContact O-CG 3.44Å; Q93-Q97 PolarHBondContact O-N 3.35Å; H94-Q97 PolarHBondContact O-N 3.46Å; Q97-N100 PolarHBondContact O-N 3.01Å; Q97-I101 WeakPolarHBondContact O-CB 3.2Å; Q97-I101 VanDerWaalsContact O-CD1 3.24Å; Q97-I101 WeakPolarHBondContact O-CD1 3.43Å; Q97-I101 WeakPolarHBondContact O-CG1 3.27Å; Q97-I101 PolarHBondContact O-N 3.05Å
98	K	47.8	Very low	47.7	Very low	121 Å²	121	85.2 Å²	85.2	53%	0.526	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-40	175	-76.7	177.1	171	171.6	0	113.1	H94 L95 I101 Y102	H94-K98 WeakPolarHBondContact NE2-CE 3.26Å; H94-K98 PolarHBondContact NE2-NZ 3.41Å; H94-K98 VanDerWaalsContact NE2-NZ 3.1Å; H94-K98 WeakPolarHBondContact O-CG 3.44Å; H94-K98 PolarHBondContact O-N 3.04Å; L95-K98 CarbonylContact O-C 3.56Å; L95-K98 PolarHBondContact O-N 2.94Å; K98-I101 PolarHBondContact O-N 2.99Å; K98-Y102 WeakPolarHBondContact O-CB 3.33Å; K98-Y102 PolarHBondContact O-N 3.23Å
99	S	43.5	Very low	47.8	Very low	30 Å²	30	84 Å²	84	21%	0.21	39%	0.392	C	S	.	.	H	α-helix	trans	-72.1	-36.5	178.1	-173	0	0	0	0	112.2	L95 L96 Y102 S103	L95-S99 VanDerWaalsContact O-CB 3.27Å; L95-S99 WeakPolarHBondContact O-CB 3.37Å; L95-S99 PolarHBondContact O-N 3.48Å; L96-S99 PolarHBondContact O-N 3.29Å; S99-Y102 PolarHBondContact O-N 3.37Å; S99-S103 WeakPolarHBondContact O-CB 3.48Å; S99-S103 PolarHBondContact O-N 3.18Å; S99-S103 PolarHBondContact O-OG 3.48Å
100	N	47	Very low	47.9	Very low	55 Å²	55	79.4 Å²	79.4	29%	0.294	37%	0.373	S	S	.	.	H	α-helix	trans	-71.4	-34.1	172.4	-78.4	-23.1	0	0	0	111.3	L96 Q97 Y102 K104	L96-N100 WeakPolarHBondContact O-CB 3.39Å; L96-N100 VanDerWaalsContact O-CG 3.25Å; L96-N100 PolarHBondContact O-N 2.93Å; L96-N100 PolarHBondContact O-ND2 3.44Å; Q97-N100 PolarHBondContact O-N 3.01Å; N100-Y102 VanDerWaalsContact C-N 3.34Å; N100-K104 WeakPolarHBondContact O-CB 3.44Å; N100-K104 VanDerWaalsContact O-CG 3.25Å; N100-K104 WeakPolarHBondContact O-CG 3.38Å; N100-K104 PolarHBondContact O-N 3.32Å
101	I	48.3	Very low	47.9	Very low	112 Å²	112	78 Å²	78	57%	0.574	37%	0.369	S	S	*	.	H	α-helix	trans	-63.6	-43.2	169.2	-70.5	159.7	0	0	0	109.5	Q97 K98 F105	Q97-I101 WeakPolarHBondContact O-CB 3.2Å; Q97-I101 VanDerWaalsContact O-CD1 3.24Å; Q97-I101 WeakPolarHBondContact O-CD1 3.43Å; Q97-I101 WeakPolarHBondContact O-CG1 3.27Å; Q97-I101 PolarHBondContact O-N 3.05Å; K98-I101 PolarHBondContact O-N 2.99Å; I101-F105 WeakPolarHBondContact O-CA 3.41Å; I101-F105 WeakPolarHBondContact O-CB 3.44Å; I101-F105 PolarHBondContact O-N 3.15Å
102	Y	47	Very low	48.1	Very low	93 Å²	93	76 Å²	76	37%	0.365	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-42.4	177.4	-163.9	-102.2	0	0	0	112.4	K98 S99 N100 F105 L106 I259 F463	K98-Y102 WeakPolarHBondContact O-CB 3.33Å; K98-Y102 PolarHBondContact O-N 3.23Å; S99-Y102 PolarHBondContact O-N 3.37Å; N100-Y102 VanDerWaalsContact C-N 3.34Å; Y102-F105 PolarHBondContact O-N 2.63Å; Y102-L106 HydrophobicContact CD1-CD1 3.64Å; Y102-L106 HydrophobicContact CE1-CD1 3.5Å; Y102-L106 WeakPolarHBondContact O-CB 3.38Å; Y102-L106 PolarHBondContact O-N 2.77Å; Y102-I259 HydrophobicContact CE1-CD1 3.95Å; Y102-I259 WeakPolarHBondContact OH-CD1 3.26Å; Y102-I259 WeakPolarHBondContact OH-CG1 3.26Å; Y102-F463 HydrophobicContact CD1-CZ 4.44Å; Y102-F463 HydrophobicContact CE1-CE1 4.38Å; Y102-F463 HydrophobicContact CE1-CZ 4.16Å
103	S	47.3	Very low	48.3	Very low	32 Å²	32	77 Å²	77	22%	0.224	37%	0.37	C	S	.	.	H	α-helix	trans	-68	-44.5	177.3	-56	0	0	0	0	111.7	S99 L106 L107	S99-S103 WeakPolarHBondContact O-CB 3.48Å; S99-S103 PolarHBondContact O-N 3.18Å; S99-S103 PolarHBondContact O-OG 3.48Å; S103-L106 WeakPolarHBondContact O-CB 3.26Å; S103-L106 PolarHBondContact O-N 3.33Å; S103-L107 WeakPolarHBondContact O-CB 3.2Å; S103-L107 WeakPolarHBondContact O-CD1 3.46Å; S103-L107 WeakPolarHBondContact O-CG 3.47Å; S103-L107 PolarHBondContact O-N 2.69Å
104	K	47	Very low	48.4	Very low	142 Å²	142	75.3 Å²	75.3	62%	0.617	36%	0.362	S	S	*	.	H	α-helix	trans	-65.6	-38.2	173.7	-74.8	-178.6	178	-173	0	112.1	N100 L107 T108	N100-K104 WeakPolarHBondContact O-CB 3.44Å; N100-K104 VanDerWaalsContact O-CG 3.25Å; N100-K104 WeakPolarHBondContact O-CG 3.38Å; N100-K104 PolarHBondContact O-N 3.32Å; K104-L107 PolarHBondContact O-N 3.39Å; K104-T108 WeakPolarHBondContact O-CB 3.46Å; K104-T108 PolarHBondContact O-N 2.9Å; K104-T108 PolarHBondContact O-OG1 3.16Å
105	F	45.8	Very low	48.8	Very low	115 Å²	115	75.2 Å²	75.2	50%	0.504	37%	0.365	S	S	.	.	H	α-helix	trans	-64.9	-43.6	175.7	179.9	-99.4	0	0	0	111.4	I101 Y102 T108 K109	I101-F105 WeakPolarHBondContact O-CA 3.41Å; I101-F105 WeakPolarHBondContact O-CB 3.44Å; I101-F105 PolarHBondContact O-N 3.15Å; Y102-F105 PolarHBondContact O-N 2.63Å; F105-T108 PolarHBondContact O-N 2.97Å; F105-K109 HydrophobicContact CE1-CD 3.89Å; F105-K109 HydrophobicContact CE1-CG 4.41Å; F105-K109 HydrophobicContact CZ-CD 3.97Å; F105-K109 HydrophobicContact CZ-CG 4.34Å; F105-K109 WeakPolarHBondContact O-CB 3.48Å; F105-K109 PolarHBondContact O-N 3.33Å
106	L	47.6	Very low	49.5	Very low	18 Å²	18	78.2 Å²	78.2	9%	0.094	38%	0.377	C	S	.	.	H	α-helix	trans	-58.6	-49.4	171.7	-94.1	157.2	0	0	0	111.9	Y102 S103 T108 K109 M110 N257 I259	Y102-L106 HydrophobicContact CD1-CD1 3.64Å; Y102-L106 HydrophobicContact CE1-CD1 3.5Å; Y102-L106 WeakPolarHBondContact O-CB 3.38Å; Y102-L106 PolarHBondContact O-N 2.77Å; S103-L106 WeakPolarHBondContact O-CB 3.26Å; S103-L106 PolarHBondContact O-N 3.33Å; L106-T108 PolarHBondContact O-N 3.47Å; L106-K109 PolarHBondContact O-N 3.21Å; L106-M110 VanDerWaalsContact O-CB 3.32Å; L106-M110 WeakPolarHBondContact O-CB 3.4Å; L106-M110 WeakPolarHBondContact O-CG 3.49Å; L106-M110 PolarHBondContact O-N 2.83Å; L106-N257 HydrophobicContact CD2-CB 4.11Å; L106-I259 HydrophobicContact CD1-CD1 3.48Å; L106-I259 VanDerWaalsContact CD1-CD1 3.48Å; L106-I259 HydrophobicContact CD2-CD1 3.41Å; L106-I259 VanDerWaalsContact CD2-CD1 3.41Å; L106-I259 HydrophobicContact CG-CD1 3.87Å
107	L	50.5	Low	49.8	Very low	39 Å²	39	79.9 Å²	79.9	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-43.9	178.9	-71.8	160.8	0	0	0	112	S103 K104 K109 M110 E111 I200 L204	S103-L107 WeakPolarHBondContact O-CB 3.2Å; S103-L107 WeakPolarHBondContact O-CD1 3.46Å; S103-L107 WeakPolarHBondContact O-CG 3.47Å; S103-L107 PolarHBondContact O-N 2.69Å; K104-L107 PolarHBondContact O-N 3.39Å; L107-K109 PolarHBondContact O-N 3.24Å; L107-M110 WeakPolarHBondContact O-CB 3.48Å; L107-M110 PolarHBondContact O-N 3.12Å; L107-E111 WeakPolarHBondContact O-CG 3.39Å; L107-E111 PolarHBondContact O-N 3.49Å; L107-I200 HydrophobicContact CD1-CD1 3.84Å; L107-I200 HydrophobicContact CD1-CG1 4.17Å; L107-I200 HydrophobicContact CD1-CG2 3.59Å; L107-I200 HydrophobicContact CD2-CG2 3.57Å; L107-I200 HydrophobicContact CG-CG2 4.21Å; L107-L204 HydrophobicContact CD2-CD1 3.53Å
108	T	50.5	Low	50.5	Low	72 Å²	72	80.6 Å²	80.6	44%	0.442	39%	0.385	S	S	.	.	H	α-helix	trans	-66	-40.4	178.7	-50.6	0	0	0	0	111	K104 F105 L106 Q112	K104-T108 WeakPolarHBondContact O-CB 3.46Å; K104-T108 PolarHBondContact O-N 2.9Å; K104-T108 PolarHBondContact O-OG1 3.16Å; F105-T108 PolarHBondContact O-N 2.97Å; L106-T108 PolarHBondContact O-N 3.47Å; T108-Q112 WeakPolarHBondContact O-CG 3.37Å; T108-Q112 PolarHBondContact O-N 3.48Å
109	K	50.2	Low	51.4	Low	92 Å²	92	79 Å²	79	40%	0.4	38%	0.382	S	S	.	.	H	α-helix	trans	-67.9	-36.5	173.5	-96.3	-160.1	168.7	-170.7	0	112.6	F105 L106 L107 Q112 Q113	F105-K109 HydrophobicContact CE1-CD 3.89Å; F105-K109 HydrophobicContact CE1-CG 4.41Å; F105-K109 HydrophobicContact CZ-CD 3.97Å; F105-K109 HydrophobicContact CZ-CG 4.34Å; F105-K109 WeakPolarHBondContact O-CB 3.48Å; F105-K109 PolarHBondContact O-N 3.33Å; L106-K109 PolarHBondContact O-N 3.21Å; L107-K109 PolarHBondContact O-N 3.24Å; K109-Q112 PolarHBondContact O-N 3.23Å; K109-Q113 WeakPolarHBondContact O-CG 3.23Å; K109-Q113 PolarHBondContact O-N 3.38Å
110	M	49.3	Very low	52.4	Low	33 Å²	33	83.5 Å²	83.5	16%	0.163	40%	0.398	C	S	.	.	H	α-helix	trans	-63.1	-44.7	175.2	-78.6	176.8	137.3	0	0	110.9	L106 L107 Q112 Q113 Q114 L204 M253	L106-M110 VanDerWaalsContact O-CB 3.32Å; L106-M110 WeakPolarHBondContact O-CB 3.4Å; L106-M110 WeakPolarHBondContact O-CG 3.49Å; L106-M110 PolarHBondContact O-N 2.83Å; L107-M110 WeakPolarHBondContact O-CB 3.48Å; L107-M110 PolarHBondContact O-N 3.12Å; M110-Q112 VanDerWaalsContact C-N 3.34Å; M110-Q112 PolarHBondContact O-N 3.36Å; M110-Q113 PolarHBondContact O-N 3.03Å; M110-Q114 WeakPolarHBondContact O-CG 3.43Å; M110-Q114 PolarHBondContact O-N 2.68Å; M110-L204 HydrophobicContact CE-CD2 4.43Å; M110-L204 HydrophobicContact SD-CD1 4.26Å; M110-M253 HydrophobicContact CE-CB 4.28Å; M110-M253 HydrophobicContact CE-SD 3.87Å
111	E	50.1	Low	53	Low	112 Å²	112	86.6 Å²	86.6	52%	0.523	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-39.9	174	-75.3	179.2	172.4	0	0	112	L107 Q114 N115	L107-E111 WeakPolarHBondContact O-CG 3.39Å; L107-E111 PolarHBondContact O-N 3.49Å; E111-Q114 PolarHBondContact O-N 2.78Å; E111-N115 WeakPolarHBondContact O-CB 3.3Å; E111-N115 VanDerWaalsContact O-CG 3.28Å; E111-N115 PolarHBondContact O-N 3.01Å; E111-N115 PolarHBondContact O-ND2 2.75Å
112	Q	54	Low	53.8	Low	114 Å²	114	85.5 Å²	85.5	53%	0.533	40%	0.401	S	S	.	.	H	α-helix	trans	-63.5	-44.6	174.8	-77.4	177.2	-11.7	0	0	112.4	T108 K109 M110 N115 E116	T108-Q112 WeakPolarHBondContact O-CG 3.37Å; T108-Q112 PolarHBondContact O-N 3.48Å; K109-Q112 PolarHBondContact O-N 3.23Å; M110-Q112 VanDerWaalsContact C-N 3.34Å; M110-Q112 PolarHBondContact O-N 3.36Å; Q112-N115 PolarHBondContact O-N 3.24Å; Q112-E116 WeakPolarHBondContact O-CG 3.27Å; Q112-E116 PolarHBondContact O-N 2.85Å
113	Q	51.2	Low	54.7	Low	62 Å²	62	89.1 Å²	89.1	29%	0.29	41%	0.414	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176.6	-78.7	-179	-24	0	0	112.2	K109 M110 N115 E116 E117	K109-Q113 WeakPolarHBondContact O-CG 3.23Å; K109-Q113 PolarHBondContact O-N 3.38Å; M110-Q113 PolarHBondContact O-N 3.03Å; Q113-N115 VanDerWaalsContact C-N 3.35Å; Q113-E116 PolarHBondContact O-N 2.83Å; Q113-E117 PolarHBondContact O-N 3.29Å
114	Q	49.4	Very low	55.4	Low	45 Å²	45	93.1 Å²	93.1	21%	0.21	43%	0.432	C	S	.	.	H	α-helix	trans	-63.5	-41.7	175	-75.1	-177.6	10.1	0	0	111.8	M110 E111 E116 E117 K118	M110-Q114 WeakPolarHBondContact O-CG 3.43Å; M110-Q114 PolarHBondContact O-N 2.68Å; E111-Q114 PolarHBondContact O-N 2.78Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E117 PolarHBondContact O-N 2.94Å; Q114-K118 VanDerWaalsContact O-CB 3.32Å; Q114-K118 WeakPolarHBondContact O-CB 3.33Å; Q114-K118 VanDerWaalsContact O-CG 3.28Å; Q114-K118 WeakPolarHBondContact O-CG 3.47Å; Q114-K118 PolarHBondContact O-N 3.29Å
115	N	55.7	Low	56.1	Low	91 Å²	91	92.1 Å²	92.1	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-39.3	176	-74.5	-19.9	0	0	0	111.3	E111 Q112 Q113 L119	E111-N115 WeakPolarHBondContact O-CB 3.3Å; E111-N115 VanDerWaalsContact O-CG 3.28Å; E111-N115 PolarHBondContact O-N 3.01Å; E111-N115 PolarHBondContact O-ND2 2.75Å; Q112-N115 PolarHBondContact O-N 3.24Å; Q113-N115 VanDerWaalsContact C-N 3.35Å; N115-L119 VanDerWaalsContact O-CB 3.24Å; N115-L119 WeakPolarHBondContact O-CB 3.46Å; N115-L119 WeakPolarHBondContact O-CD1 3.47Å; N115-L119 PolarHBondContact O-N 2.93Å
116	E	60.9	Low	57.1	Low	114 Å²	114	92.1 Å²	92.1	53%	0.533	43%	0.43	S	S	.	.	H	α-helix	trans	-66	-41.6	174.4	-77.6	-171.3	179.1	0	0	113.3	Q112 Q113 Q114 L119 K120	Q112-E116 WeakPolarHBondContact O-CG 3.27Å; Q112-E116 PolarHBondContact O-N 2.85Å; Q113-E116 PolarHBondContact O-N 2.83Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; E116-L119 PolarHBondContact O-N 3.48Å; E116-K120 WeakPolarHBondContact O-CB 3.44Å; E116-K120 WeakPolarHBondContact O-CG 3.31Å; E116-K120 PolarHBondContact O-N 3.34Å
117	E	56.4	Low	57.8	Low	74 Å²	74	98.3 Å²	98.3	35%	0.346	46%	0.456	S	S	.	.	H	α-helix	trans	-68.9	-40.3	176.2	-78	-164.2	158.7	0	0	111.8	Q113 Q114 K120 K121 R252	Q113-E117 PolarHBondContact O-N 3.29Å; Q114-E117 PolarHBondContact O-N 2.94Å; E117-K120 PolarHBondContact O-N 2.74Å; E117-K121 WeakPolarHBondContact O-CB 3.49Å; E117-K121 WeakPolarHBondContact O-CG 3.14Å; E117-K121 PolarHBondContact O-N 3.03Å; E117-R252 IonicContact OE1-NH2 2.66Å; E117-R252 PolarHBondContact OE1-NH2 2.6Å
118	K	61.5	Low	58	Low	126 Å²	126	99.6 Å²	99.6	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-60.6	-45.1	171	-76.1	178.3	-179	177.5	0	111.1	Q114 K120 K121 E122	Q114-K118 VanDerWaalsContact O-CB 3.32Å; Q114-K118 WeakPolarHBondContact O-CB 3.33Å; Q114-K118 VanDerWaalsContact O-CG 3.28Å; Q114-K118 WeakPolarHBondContact O-CG 3.47Å; Q114-K118 PolarHBondContact O-N 3.29Å; K118-K120 VanDerWaalsContact C-N 3.34Å; K118-K120 PolarHBondContact O-N 2.85Å; K118-K121 PolarHBondContact O-N 2.58Å; K118-E122 WeakPolarHBondContact O-CB 3.31Å; K118-E122 PolarHBondContact O-N 2.98Å
119	L	65.4	Low	58.1	Low	88 Å²	88	103.1 Å²	103.1	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-38.2	174.3	-96.1	150.4	0	0	0	112.6	N115 E116 R123	N115-L119 VanDerWaalsContact O-CB 3.24Å; N115-L119 WeakPolarHBondContact O-CB 3.46Å; N115-L119 WeakPolarHBondContact O-CD1 3.47Å; N115-L119 PolarHBondContact O-N 2.93Å; E116-L119 PolarHBondContact O-N 3.48Å; L119-R123 VanDerWaalsContact O-CB 3.25Å; L119-R123 WeakPolarHBondContact O-CB 3.11Å; L119-R123 WeakPolarHBondContact O-CG 3.43Å; L119-R123 PolarHBondContact O-N 2.89Å
120	K	64.8	Low	58.3	Low	125 Å²	125	106.6 Å²	106.6	54%	0.543	50%	0.501	S	S	.	.	H	α-helix	trans	-68.2	-42.4	175	-80.4	173.4	-178.4	165.5	0	111.7	E116 E117 K118 R123 L124	E116-K120 WeakPolarHBondContact O-CB 3.44Å; E116-K120 WeakPolarHBondContact O-CG 3.31Å; E116-K120 PolarHBondContact O-N 3.34Å; E117-K120 PolarHBondContact O-N 2.74Å; K118-K120 VanDerWaalsContact C-N 3.34Å; K118-K120 PolarHBondContact O-N 2.85Å; K120-R123 PolarHBondContact O-N 3.37Å; K120-L124 WeakPolarHBondContact O-CB 3.49Å; K120-L124 WeakPolarHBondContact O-CG 3.29Å; K120-L124 PolarHBondContact O-N 3.23Å
121	K	59.7	Low	58.3	Low	119 Å²	119	109.1 Å²	109.1	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-49.4	174.6	-78.6	-177.8	178.5	178.8	0	111.2	E117 K118 R123 L124 E125	E117-K121 WeakPolarHBondContact O-CB 3.49Å; E117-K121 WeakPolarHBondContact O-CG 3.14Å; E117-K121 PolarHBondContact O-N 3.03Å; K118-K121 PolarHBondContact O-N 2.58Å; K121-R123 VanDerWaalsContact C-N 3.26Å; K121-R123 PolarHBondContact O-N 3.26Å; K121-L124 CarbonylContact O-C 3.59Å; K121-L124 PolarHBondContact O-N 3.37Å; K121-E125 WeakPolarHBondContact O-CB 3.43Å; K121-E125 WeakPolarHBondContact O-CG 3.41Å; K121-E125 PolarHBondContact O-N 3.37Å
122	E	66.3	Low	58	Low	90 Å²	90	107.2 Å²	107.2	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-59	-38.3	173.9	-80.1	-168	-163.5	0	0	112.1	K118 K126	K118-E122 WeakPolarHBondContact O-CB 3.31Å; K118-E122 PolarHBondContact O-N 2.98Å; E122-K126 WeakPolarHBondContact O-CB 3.48Å; E122-K126 WeakPolarHBondContact O-CD 3.25Å; E122-K126 WeakPolarHBondContact O-CG 3.39Å; E122-K126 PolarHBondContact O-N 3.31Å; E122-K126 IonicContact OE2-NZ 3.27Å; E122-K126 PolarHBondContact OE2-NZ 3.07Å
123	R	66.4	Low	57.3	Low	168 Å²	168	106 Å²	106	63%	0.634	54%	0.541	S	S	*	.	H	α-helix	trans	-67.4	-35.5	175.7	-79.9	173	178.4	-169.5	1.7	112.1	L119 K120 K121 K127	L119-R123 VanDerWaalsContact O-CB 3.25Å; L119-R123 WeakPolarHBondContact O-CB 3.11Å; L119-R123 WeakPolarHBondContact O-CG 3.43Å; L119-R123 PolarHBondContact O-N 2.89Å; K120-R123 PolarHBondContact O-N 3.37Å; K121-R123 VanDerWaalsContact C-N 3.26Å; K121-R123 PolarHBondContact O-N 3.26Å; R123-K127 VanDerWaalsContact O-CB 3.29Å; R123-K127 WeakPolarHBondContact O-CB 3.3Å; R123-K127 WeakPolarHBondContact O-CG 3.22Å; R123-K127 PolarHBondContact O-N 2.93Å
124	L	61.3	Low	56.5	Low	116 Å²	116	106.6 Å²	106.6	61%	0.607	56%	0.564	S	S	*	*	H	α-helix	trans	-72.7	-41.9	175.9	-77.3	162	0	0	0	111.3	K120 K121 K127 A128	K120-L124 WeakPolarHBondContact O-CB 3.49Å; K120-L124 WeakPolarHBondContact O-CG 3.29Å; K120-L124 PolarHBondContact O-N 3.23Å; K121-L124 CarbonylContact O-C 3.59Å; K121-L124 PolarHBondContact O-N 3.37Å; L124-K127 CarbonylContact O-C 3.5Å; L124-K127 WeakPolarHBondContact O-CB 3.32Å; L124-K127 PolarHBondContact O-N 3.36Å; L124-A128 WeakPolarHBondContact O-CB 3.45Å; L124-A128 PolarHBondContact O-N 2.96Å
125	E	61.3	Low	55.6	Low	121 Å²	121	109 Å²	109	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-65.3	-44.4	173.4	-74.3	175.9	175.4	0	0	111.6	K121 K127 A128 M129	K121-E125 WeakPolarHBondContact O-CB 3.43Å; K121-E125 WeakPolarHBondContact O-CG 3.41Å; K121-E125 PolarHBondContact O-N 3.37Å; E125-K127 PolarHBondContact O-N 3.15Å; E125-A128 PolarHBondContact O-N 2.88Å; E125-A128 VanDerWaalsContact O-N 3.14Å; E125-M129 WeakPolarHBondContact O-CB 3.4Å; E125-M129 WeakPolarHBondContact O-CG 3.44Å; E125-M129 PolarHBondContact O-N 3.29Å
126	K	66.7	Low	54.4	Low	115 Å²	115	113.2 Å²	113.2	50%	0.5	61%	0.608	S	S	.	*	H	α-helix	trans	-63.2	-31	172.7	-74.6	165.4	179.2	159.1	0	111.7	E122 K130	E122-K126 WeakPolarHBondContact O-CB 3.48Å; E122-K126 WeakPolarHBondContact O-CD 3.25Å; E122-K126 WeakPolarHBondContact O-CG 3.39Å; E122-K126 PolarHBondContact O-N 3.31Å; E122-K126 IonicContact OE2-NZ 3.27Å; E122-K126 PolarHBondContact OE2-NZ 3.07Å; K126-K130 VanDerWaalsContact O-CB 3.27Å; K126-K130 WeakPolarHBondContact O-CB 3.38Å; K126-K130 VanDerWaalsContact O-CG 3.26Å; K126-K130 WeakPolarHBondContact O-CG 3.47Å; K126-K130 PolarHBondContact O-N 2.84Å
127	K	62	Low	52.9	Low	148 Å²	148	114.4 Å²	114.4	64%	0.643	62%	0.623	S	S	*	*	H	α-helix	trans	-73.5	-38.6	172	-83.1	176.7	177.2	-174.6	0	112	R123 L124 E125 K130 A131	R123-K127 VanDerWaalsContact O-CB 3.29Å; R123-K127 WeakPolarHBondContact O-CB 3.3Å; R123-K127 WeakPolarHBondContact O-CG 3.22Å; R123-K127 PolarHBondContact O-N 2.93Å; L124-K127 CarbonylContact O-C 3.5Å; L124-K127 WeakPolarHBondContact O-CB 3.32Å; L124-K127 PolarHBondContact O-N 3.36Å; E125-K127 PolarHBondContact O-N 3.15Å; K127-K130 PolarHBondContact O-N 3.41Å; K127-A131 WeakPolarHBondContact O-CB 3.38Å; K127-A131 PolarHBondContact O-N 2.82Å
128	A	55.3	Low	51.9	Low	66 Å²	66	122.2 Å²	122.2	55%	0.545	65%	0.649	S	S	.	*	H	α-helix	trans	-66.8	-41.4	174.5	0	0	0	0	0	111.6	L124 E125 A131 G132	L124-A128 WeakPolarHBondContact O-CB 3.45Å; L124-A128 PolarHBondContact O-N 2.96Å; E125-A128 PolarHBondContact O-N 2.88Å; E125-A128 VanDerWaalsContact O-N 3.14Å; A128-A131 PolarHBondContact O-N 3.17Å; A128-G132 PolarHBondContact O-N 3Å
129	M	52.3	Low	50.2	Low	147 Å²	147	122.6 Å²	122.6	72%	0.724	66%	0.663	S	S	*	*	H	α-helix	trans	-66.4	-36.1	173.5	-73.9	-177.2	161	0	0	112.7	E125 G132 S133	E125-M129 WeakPolarHBondContact O-CB 3.4Å; E125-M129 WeakPolarHBondContact O-CG 3.44Å; E125-M129 PolarHBondContact O-N 3.29Å; M129-G132 PolarHBondContact O-N 2.97Å; M129-S133 PolarHBondContact O-N 3.09Å; M129-S133 PolarHBondContact O-OG 3.28Å
130	K	55.6	Low	48.4	Very low	165 Å²	165	125.9 Å²	125.9	72%	0.717	68%	0.681	S	S	*	*	H	α-helix	trans	-73.3	-26.6	172.1	-80.3	-179.2	176.3	-175	0	113.4	K126 K127	K126-K130 VanDerWaalsContact O-CB 3.27Å; K126-K130 WeakPolarHBondContact O-CB 3.38Å; K126-K130 VanDerWaalsContact O-CG 3.26Å; K126-K130 WeakPolarHBondContact O-CG 3.47Å; K126-K130 PolarHBondContact O-N 2.84Å; K127-K130 PolarHBondContact O-N 3.41Å
131	A	47.6	Very low	46.6	Very low	86 Å²	86	124.9 Å²	124.9	71%	0.711	70%	0.695	S	S	*	*	H	α-helix	trans	-77.4	-26.3	173.2	0	0	0	0	0	112.2	K127 A128	K127-A131 WeakPolarHBondContact O-CB 3.38Å; K127-A131 PolarHBondContact O-N 2.82Å; A128-A131 PolarHBondContact O-N 3.17Å
132	G	45.3	Very low	45	Very low	72 Å²	72	128.2 Å²	128.2	74%	0.742	71%	0.71	S	S	*	*	S	Bend	trans	-82.2	-8.8	172.7	0	0	0	0	0	115.1	A128 M129	A128-G132 PolarHBondContact O-N 3Å; M129-G132 PolarHBondContact O-N 2.97Å
133	S	38.9	Very low	43.1	Very low	88 Å²	88	133.1 Å²	133.1	62%	0.615	73%	0.73	S	S	*	*			trans	-118.7	80	179	47.6	0	0	0	0	110.6	M129	M129-S133 PolarHBondContact O-N 3.09Å; M129-S133 PolarHBondContact O-OG 3.28Å
134	G	34.8	Very low	41.1	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	74%	0.743	S	S	*	*			trans	-150.6	70.8	-179.5	0	0	0	0	0	114.2
135	A	30.3	Very low	39.7	Very low	95 Å²	95	139.3 Å²	139.3	79%	0.785	76%	0.756	S	S	*	*			trans	-160.1	90.1	153.1	0	0	0	0	0	110.3
136	E	30.2	Very low	37.9	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	77%	0.773	S	S	*	*	S	Bend		165.8	134	115.5	-89.3	-174.6	168.2	0	0	114
137	T	30	Very low	36.3	Very low	139 Å²	139	150.7 Å²	150.7	85%	0.853	79%	0.791	S	S	*	*			trans	67.7	114.4	157	43.8	0	0	0	0	122.1
138	R	34.4	Very low	34.6	Very low	237 Å²	237	153.1 Å²	153.1	89%	0.894	80%	0.796	S	S	*	*			trans	-77.5	148.7	164.8	-66.6	170.3	167.6	168.7	-3.6	110.9
139	T	25.6	Very low	33.7	Very low	135 Å²	135	157.4 Å²	157.4	83%	0.828	81%	0.81	S	S	*	*				-156.4	122.4	127.8	42.8	0	0	0	0	112.5
140	D	28	Very low	32.5	Very low	157 Å²	157	156.5 Å²	156.5	84%	0.84	80%	0.804	S	S	*	*			trans	11	128.3	154.2	-68.2	-62.8	0	0	0	124.6
141	A	26.1	Very low	31.2	Very low	103 Å²	103	155.9 Å²	155.9	85%	0.851	81%	0.808	S	S	*	*				-158.9	100.9	127.7	0	0	0	0	0	113.7
142	K	27.1	Very low	30.4	Very low	190 Å²	190	161.9 Å²	161.9	83%	0.826	82%	0.819	S	S	*	*			trans	23.9	120.5	147.1	-80.3	170.8	177.5	167.1	0	122.7
143	K	26.6	Very low	29.5	Very low	192 Å²	192	167 Å²	167	84%	0.835	82%	0.821	S	S	*	*				58	111.5	126.1	-73.5	-179	175	178	0	120.2
144	K	24.7	Very low	29.1	Very low	210 Å²	210	170.9 Å²	170.9	91%	0.913	83%	0.833	S	S	*	*				-166.1	114.2	101.3	-111.4	173.6	-178.6	172.3	0	111.9
145	K	30.5	Very low	29	Very low	204 Å²	204	170.5 Å²	170.5	89%	0.887	82%	0.823	S	S	*	*			trans	-78.8	122.7	165.3	-174.2	-179.8	-172.8	176.8	0	107.8
146	R	25.1	Very low	29.2	Very low	244 Å²	244	174 Å²	174	92%	0.921	83%	0.829	S	S	*	*			trans	-155.4	119.6	147.2	-115.4	177	168.1	176.2	-4.1	110.1
147	R	33	Very low	29.5	Very low	231 Å²	231	170.3 Å²	170.3	87%	0.872	82%	0.818	S	S	*	*			trans	-44.1	131.3	162.5	-78.7	171.1	157.2	167.9	-8.8	110
148	R	25.1	Very low	29.6	Very low	199 Å²	199	169.5 Å²	169.5	75%	0.751	81%	0.806	S	S	*	*			trans	-138.3	106.9	140.4	-78.2	-159.7	-167.6	166.3	2.7	107.5	E150	R148-E150 VanDerWaalsContact C-N 3.34Å; R148-E150 HydrophobicContact CB-CG 4.25Å; R148-E150 WeakPolarHBondContact CD-OE1 3.17Å; R148-E150 IonicContact CZ-OE1 3.63Å; R148-E150 IonicContact NE-OE1 3.69Å; R148-E150 IonicContact NH1-OE1 2.83Å; R148-E150 PolarHBondContact NH1-OE1 3.37Å; R148-E150 PolarHBondContact O-N 3.46Å
149	D	35.8	Very low	30	Very low	157 Å²	157	162.2 Å²	162.2	84%	0.84	79%	0.788	S	S	*	*			trans	-56.4	108.2	139.9	-62.6	-52.4	0	0	0	105.6
150	E	27.2	Very low	30.7	Very low	127 Å²	127	164 Å²	164	59%	0.593	78%	0.784	S	S	*	*			trans	-125.9	107.4	160.1	-87.4	178.9	-164.5	0	0	105.3	R148 F152	R148-E150 VanDerWaalsContact C-N 3.34Å; R148-E150 HydrophobicContact CB-CG 4.25Å; R148-E150 WeakPolarHBondContact CD-OE1 3.17Å; R148-E150 IonicContact CZ-OE1 3.63Å; R148-E150 IonicContact NE-OE1 3.69Å; R148-E150 IonicContact NH1-OE1 2.83Å; R148-E150 PolarHBondContact NH1-OE1 3.37Å; R148-E150 PolarHBondContact O-N 3.46Å; E150-F152 PolarHBondContact O-N 2.87Å
151	D	29.5	Very low	31.3	Very low	152 Å²	152	163.7 Å²	163.7	81%	0.813	78%	0.777	S	S	*	*			trans	-43	117.5	167.3	-62.6	-54.1	0	0	0	109.7	K153	D151-K153 VanDerWaalsContact C-N 3.26Å; D151-K153 PolarHBondContact O-N 3.47Å
152	F	30.5	Very low	32	Very low	212 Å²	212	164 Å²	164	93%	0.93	76%	0.761	S	S	*	*			trans	-69	95.9	162.1	-84.8	-85.7	0	0	0	107.4	E150 I154	E150-F152 PolarHBondContact O-N 2.87Å; F152-I154 PolarHBondContact O-N 3.15Å
153	K	26.2	Very low	33	Very low	180 Å²	180	159.8 Å²	159.8	78%	0.783	75%	0.747	S	S	*	*			trans	-52.1	129.7	172.7	-84.1	174.9	174.6	173.6	0	110.4	D151 A155	D151-K153 VanDerWaalsContact C-N 3.26Å; D151-K153 PolarHBondContact O-N 3.47Å; K153-A155 HydrophobicContact CB-CB 4.25Å; K153-A155 PolarHBondContact O-N 3.19Å
154	I	30.4	Very low	33.5	Very low	169 Å²	169	156.3 Å²	156.3	87%	0.867	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	71.2	161.4	-64.2	157.8	0	0	0	108.3	F152	F152-I154 PolarHBondContact O-N 3.15Å
155	A	32.1	Very low	34.3	Very low	67 Å²	67	148.7 Å²	148.7	55%	0.554	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.6	-11	180	0	0	0	0	0	115.1	K153 V157	K153-A155 HydrophobicContact CB-CB 4.25Å; K153-A155 PolarHBondContact O-N 3.19Å; A155-V157 PolarHBondContact O-N 2.96Å
156	D	35.2	Very low	34.7	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	70%	0.695	S	S	*	*			trans	-87.1	23.2	170.1	-76.1	-11.2	0	0	0	112.8	M158	D156-M158 PolarHBondContact O-N 3.24Å
157	V	36.7	Very low	35.5	Very low	102 Å²	102	136.4 Å²	136.4	62%	0.618	68%	0.675	S	S	*	*	S	Bend	trans	-74.9	108	162.5	177.1	0	0	0	0	106.5	A155 T159	A155-V157 PolarHBondContact O-N 2.96Å; V157-T159 PolarHBondContact O-N 3.49Å
158	M	31.7	Very low	35.8	Very low	123 Å²	123	133 Å²	133	61%	0.606	67%	0.666	S	S	*	*			trans	-41.5	113.1	165.4	-65.8	178.9	68.9	0	0	109.1	D156 I163	D156-M158 PolarHBondContact O-N 3.24Å; M158-I163 HydrophobicContact CE-CG1 4.41Å
159	T	42.7	Very low	36.3	Very low	83 Å²	83	133 Å²	133	51%	0.509	67%	0.666	S	S	.	*			trans	-74.3	148.6	-178.8	52.1	0	0	0	0	109.7	V157 E161 E162	V157-T159 PolarHBondContact O-N 3.49Å; T159-E161 PolarHBondContact O-N 3.49Å; T159-E162 PolarHBondContact O-N 2.75Å
160	K	40.5	Very low	36.3	Very low	174 Å²	174	130.1 Å²	130.1	76%	0.757	66%	0.658	S	S	*	*	H	α-helix	trans	-49.2	-17.9	179	-170.6	178.1	177.4	-176.3	0	114.3
161	E	41.7	Very low	36.9	Very low	149 Å²	149	132.4 Å²	132.4	70%	0.696	67%	0.666	S	S	*	*	H	α-helix	trans	-84.1	-29.7	-179.3	-66.9	-175.8	154.5	0	0	113.6	T159 M164 S165	T159-E161 PolarHBondContact O-N 3.49Å; E161-M164 PolarHBondContact O-N 2.87Å; E161-S165 WeakPolarHBondContact O-CB 3.24Å; E161-S165 PolarHBondContact O-N 2.85Å; E161-S165 PolarHBondContact O-OG 2.77Å
162	E	40.7	Very low	37.3	Very low	111 Å²	111	130.9 Å²	130.9	52%	0.519	66%	0.662	S	S	.	*	H	α-helix	trans	-78	-29.6	-178.3	-119.1	164.9	-177.8	0	0	112.9	T159 S165 Q166	T159-E162 PolarHBondContact O-N 2.75Å; E162-S165 WeakPolarHBondContact CA-OG 3.48Å; E162-S165 PolarHBondContact O-N 3.36Å; E162-S165 PolarHBondContact O-OG 3.41Å; E162-Q166 PolarHBondContact O-N 3.37Å; E162-Q166 VanDerWaalsContact O-N 3.12Å
163	I	47.1	Very low	37.5	Very low	101 Å²	101	129.8 Å²	129.8	52%	0.518	66%	0.66	S	S	.	*	H	α-helix	trans	-70.8	-37.3	172.2	-58.4	173	0	0	0	110.3	M158 A167	M158-I163 HydrophobicContact CE-CG1 4.41Å; I163-A167 PolarHBondContact O-N 3.06Å
164	M	37.4	Very low	37.8	Very low	118 Å²	118	130.9 Å²	130.9	58%	0.581	66%	0.664	S	S	*	*	H	α-helix	trans	-72.8	-28.8	175.7	-74.3	-154.7	-67.7	0	0	112.9	E161 K168	E161-M164 PolarHBondContact O-N 2.87Å; M164-K168 PolarHBondContact O-N 3.13Å
165	S	41.3	Very low	37.8	Very low	51 Å²	51	126.1 Å²	126.1	36%	0.357	66%	0.657	S	S	.	*	H	α-helix	trans	-78	-35.3	178.2	71.1	0	0	0	0	112.4	E161 E162 K168 R169	E161-S165 WeakPolarHBondContact O-CB 3.24Å; E161-S165 PolarHBondContact O-N 2.85Å; E161-S165 PolarHBondContact O-OG 2.77Å; E162-S165 WeakPolarHBondContact CA-OG 3.48Å; E162-S165 PolarHBondContact O-N 3.36Å; E162-S165 PolarHBondContact O-OG 3.41Å; S165-K168 PolarHBondContact O-N 3.09Å; S165-R169 PolarHBondContact O-N 2.93Å
166	Q	39.8	Very low	37.9	Very low	131 Å²	131	132.3 Å²	132.3	61%	0.612	67%	0.672	S	S	*	*	H	α-helix	trans	-66.9	-38.3	171.9	-76.1	-172.5	-5.9	0	0	112.6	E162 K168 R169 S170	E162-Q166 PolarHBondContact O-N 3.37Å; E162-Q166 VanDerWaalsContact O-N 3.12Å; Q166-K168 VanDerWaalsContact C-N 3.26Å; Q166-K168 PolarHBondContact O-N 2.85Å; Q166-R169 PolarHBondContact O-N 3.03Å; Q166-S170 PolarHBondContact O-N 2.81Å
167	A	40.7	Very low	37.7	Very low	59 Å²	59	131.3 Å²	131.3	49%	0.488	67%	0.667	S	S	.	*	H	α-helix	trans	-68.9	-20.7	174	0	0	0	0	0	113.9	I163 S170	I163-A167 PolarHBondContact O-N 3.06Å; A167-S170 PolarHBondContact O-OG 3.26Å
168	K	39.7	Very low	37.4	Very low	158 Å²	158	134.1 Å²	134.1	69%	0.687	68%	0.678	S	S	*	*	H	α-helix	trans	-84.4	-34.9	171.3	-84	-178.1	175.9	179.4	0	112.4	M164 S165 Q166 K171	M164-K168 PolarHBondContact O-N 3.13Å; S165-K168 PolarHBondContact O-N 3.09Å; Q166-K168 VanDerWaalsContact C-N 3.26Å; Q166-K168 PolarHBondContact O-N 2.85Å; K168-K171 PolarHBondContact O-N 3.49Å
169	R	34.9	Very low	37.3	Very low	201 Å²	201	132.9 Å²	132.9	76%	0.758	69%	0.687	S	S	*	*	H	α-helix	trans	-66.8	-36.2	177	-85.6	-179.2	169.7	171.3	-2.3	112.7	S165 Q166 K171 V172	S165-R169 PolarHBondContact O-N 2.93Å; Q166-R169 PolarHBondContact O-N 3.03Å; R169-K171 PolarHBondContact O-N 3.18Å; R169-K171 VanDerWaalsContact O-N 3.15Å; R169-V172 PolarHBondContact O-N 3.46Å
170	S	35.5	Very low	36.9	Very low	96 Å²	96	135 Å²	135	67%	0.671	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-11.2	175.2	63.8	0	0	0	0	114.5	Q166 A167	Q166-S170 PolarHBondContact O-N 2.81Å; A167-S170 PolarHBondContact O-OG 3.26Å
171	K	40.1	Very low	36.5	Very low	175 Å²	175	131 Å²	131	76%	0.761	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-11.3	176.6	-87.7	-177.4	173.6	-179.7	0	114.5	K168 R169	K168-K171 PolarHBondContact O-N 3.49Å; R169-K171 PolarHBondContact O-N 3.18Å; R169-K171 VanDerWaalsContact O-N 3.15Å
172	V	38.3	Very low	36.1	Very low	120 Å²	120	133.2 Å²	133.2	73%	0.727	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-16	-170.7	178.9	0	0	0	0	113.3	R169	R169-V172 PolarHBondContact O-N 3.46Å
173	E	34.8	Very low	35.7	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	73%	0.729	S	S	*	*	S	Bend	trans	-94.4	4.3	-176.6	-79	-168.8	153.9	0	0	116.4
174	K	31.7	Very low	35.1	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	74%	0.743	S	S	*	*	S	Bend	trans	-110.8	89.7	167.2	-84.8	-176	175.5	179.3	0	110.4
175	G	30.2	Very low	35	Very low	70 Å²	70	142.1 Å²	142.1	72%	0.722	75%	0.748	S	S	*	*			trans	-77.3	132.8	179.1	0	0	0	0	0	114.2
176	K	34.7	Very low	34.7	Very low	196 Å²	196	145.1 Å²	145.1	85%	0.852	76%	0.76	S	S	*	*			trans	75.9	121.6	139.4	-71.4	-178.5	175.8	177.8	0	121.2
177	N	32.2	Very low	34.7	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	76%	0.761	S	S	*	*			trans	98.5	126.5	159	-60.5	-6.1	0	0	0	115.9
178	D	29.3	Very low	34.4	Very low	161 Å²	161	146 Å²	146	86%	0.861	77%	0.767	S	S	*	*			trans	84.8	121.4	-177.4	-57.5	-25.8	0	0	0	118.5
179	A	30.6	Very low	34.4	Very low	97 Å²	97	142.2 Å²	142.2	80%	0.802	75%	0.754	S	S	*	*			trans	-63.2	135	175.4	0	0	0	0	0	110.6	A181	A179-A181 PolarHBondContact O-N 3.02Å
180	P	32.7	Very low	34.9	Very low	126 Å²	126	138 Å²	138	82%	0.818	75%	0.746	S	S	*	*			trans	-87.3	113.6	-176.6	32.1	-29.1	0	0	0	110.7
181	A	32.3	Very low	35	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	74%	0.743	S	S	*	*			trans	-54.4	141.5	154.1	0	0	0	0	0	109.9	A179 K183	A179-A181 PolarHBondContact O-N 3.02Å; A181-K183 PolarHBondContact O-N 3.33Å; A181-K183 VanDerWaalsContact O-N 3.09Å
182	Q	33.5	Very low	34.9	Very low	194 Å²	194	137.6 Å²	137.6	91%	0.907	73%	0.734	S	S	*	*			trans	-53.7	113.1	175.3	-74.5	167.3	-32.2	0	0	110.4	K184	Q182-K184 PolarHBondContact O-N 2.93Å
183	K	32.6	Very low	34.9	Very low	201 Å²	201	137.3 Å²	137.3	87%	0.874	73%	0.726	S	S	*	*			trans	-68.2	115.8	163.8	-83.2	-173.7	172.9	-173.1	0	108.4	A181	A181-K183 PolarHBondContact O-N 3.33Å; A181-K183 VanDerWaalsContact O-N 3.09Å
184	K	35.7	Very low	35	Very low	184 Å²	184	130.5 Å²	130.5	80%	0.8	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56.2	133.2	157.8	-78.3	177	175	177.5	0	107.4	Q182 D186	Q182-K184 PolarHBondContact O-N 2.93Å; K184-D186 PolarHBondContact O-N 2.79Å
185	L	35.3	Very low	35.2	Very low	132 Å²	132	126 Å²	126	69%	0.691	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-75.8	116.1	167.7	-71.3	161.3	0	0	0	106.3
186	D	33.3	Very low	36	Very low	114 Å²	114	125.4 Å²	125.4	61%	0.61	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-77.4	157.1	-179.6	-65.8	-41.4	0	0	0	110.8	K184 E188 D189	K184-D186 PolarHBondContact O-N 2.79Å; D186-E188 PolarHBondContact O-N 2.93Å; D186-D189 PolarHBondContact O-N 3.22Å; D186-D189 VanDerWaalsContact O-N 3.08Å
187	A	40.9	Very low	36.4	Very low	76 Å²	76	118.6 Å²	118.6	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-54.9	-24	-174.5	0	0	0	0	0	114.4	D189 I190 E191	A187-D189 VanDerWaalsContact C-N 3.33Å; A187-D189 PolarHBondContact O-N 3.49Å; A187-I190 PolarHBondContact O-N 3.5Å; A187-E191 PolarHBondContact O-N 3.42Å
188	E	34.8	Very low	37.1	Very low	133 Å²	133	117 Å²	117	62%	0.621	63%	0.63	S	S	*	*	H	α-helix	trans	-65.3	-29.2	177.4	-72.9	-172.1	157.3	0	0	114	D186 I190 K192	D186-E188 PolarHBondContact O-N 2.93Å; E188-I190 VanDerWaalsContact C-N 3.3Å; E188-K192 PolarHBondContact O-N 3.47Å
189	D	39.7	Very low	37.8	Very low	79 Å²	79	114 Å²	114	42%	0.422	61%	0.611	S	S	.	*	H	α-helix	trans	-76.4	-21.8	178.2	-74.9	-26.1	0	0	0	111.8	D186 A187 M193	D186-D189 PolarHBondContact O-N 3.22Å; D186-D189 VanDerWaalsContact O-N 3.08Å; A187-D189 VanDerWaalsContact C-N 3.33Å; A187-D189 PolarHBondContact O-N 3.49Å; D189-M193 WeakPolarHBondContact O-CG 3.3Å
190	I	44.2	Very low	38.5	Very low	112 Å²	112	112 Å²	112	57%	0.574	59%	0.586	S	S	*	*	H	α-helix	trans	-81.4	-38.1	176.1	-60.8	174.9	0	0	0	110.5	A187 E188 M193 S194	A187-I190 PolarHBondContact O-N 3.5Å; E188-I190 VanDerWaalsContact C-N 3.3Å; I190-M193 PolarHBondContact O-N 3.46Å; I190-S194 PolarHBondContact O-N 2.83Å
191	E	38.8	Very low	39.1	Very low	132 Å²	132	109.7 Å²	109.7	62%	0.617	56%	0.564	S	S	*	*	H	α-helix	trans	-63	-42	174.1	-80.1	-172.4	150.3	0	0	112.2	A187 M193 S194 D195	A187-E191 PolarHBondContact O-N 3.42Å; E191-M193 VanDerWaalsContact C-N 3.26Å; E191-M193 PolarHBondContact O-N 3.12Å; E191-S194 WeakPolarHBondContact CA-OG 3.26Å; E191-S194 PolarHBondContact O-N 3.04Å; E191-S194 PolarHBondContact O-OG 2.99Å; E191-D195 PolarHBondContact O-N 2.99Å
192	K	37.7	Very low	39.9	Very low	131 Å²	131	107.5 Å²	107.5	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-64.5	-29.7	175.8	-71.9	172.3	-175.4	161.3	0	113.2	E188 S196	E188-K192 PolarHBondContact O-N 3.47Å; K192-S196 PolarHBondContact O-OG 2.86Å; K192-S196 VanDerWaalsContact O-OG 3.06Å
193	M	37.8	Very low	40.7	Very low	114 Å²	114	104.4 Å²	104.4	56%	0.562	52%	0.522	S	S	*	.	H	α-helix	trans	-79.2	-28.1	175.3	-72.8	-176.2	67	0	0	113	D189 I190 E191	D189-M193 WeakPolarHBondContact O-CG 3.3Å; I190-M193 PolarHBondContact O-N 3.46Å; E191-M193 VanDerWaalsContact C-N 3.26Å; E191-M193 PolarHBondContact O-N 3.12Å
194	S	36.5	Very low	41.2	Very low	45 Å²	45	96.9 Å²	96.9	32%	0.315	49%	0.492	S	S	.	.	H	α-helix	trans	-70.2	-38	173.8	51.9	0	0	0	0	112.8	I190 E191 S196 N197 E198	I190-S194 PolarHBondContact O-N 2.83Å; E191-S194 WeakPolarHBondContact CA-OG 3.26Å; E191-S194 PolarHBondContact O-N 3.04Å; E191-S194 PolarHBondContact O-OG 2.99Å; S194-S196 VanDerWaalsContact C-N 3.33Å; S194-S196 PolarHBondContact O-N 2.77Å; S194-N197 PolarHBondContact O-N 2.81Å; S194-E198 PolarHBondContact O-N 2.72Å; S194-E198 VanDerWaalsContact O-N 3.13Å
195	D	36.7	Very low	41.9	Very low	107 Å²	107	90.3 Å²	90.3	57%	0.572	47%	0.468	S	S	*	.	H	α-helix	trans	-65	-38.2	178.5	-70.6	-15.8	0	0	0	111.8	E191 N197 E198 E199	E191-D195 PolarHBondContact O-N 2.99Å; D195-N197 PolarHBondContact O-N 2.83Å; D195-E198 PolarHBondContact O-N 3.36Å; D195-E199 PolarHBondContact O-N 2.71Å
196	S	47.3	Very low	42.7	Very low	59 Å²	59	89 Å²	89	41%	0.413	46%	0.459	S	S	.	.	H	α-helix	trans	-60.6	-32.2	175.8	-57.8	0	0	0	0	112.5	K192 S194 I200	K192-S196 PolarHBondContact O-OG 2.86Å; K192-S196 VanDerWaalsContact O-OG 3.06Å; S194-S196 VanDerWaalsContact C-N 3.33Å; S194-S196 PolarHBondContact O-N 2.77Å; S196-I200 VanDerWaalsContact O-CD1 3.27Å; S196-I200 WeakPolarHBondContact O-CD1 3.07Å; S196-I200 WeakPolarHBondContact O-CG1 3.47Å; S196-I200 PolarHBondContact O-N 3.17Å; S196-I200 VanDerWaalsContact O-N 3.13Å
197	N	42.3	Very low	43.3	Very low	53 Å²	53	85.1 Å²	85.1	28%	0.283	44%	0.439	S	S	.	.	H	α-helix	trans	-87.5	-31.2	-177.3	-77.6	-18.6	0	0	0	113.4	S194 D195 I200 K201	S194-N197 PolarHBondContact O-N 2.81Å; D195-N197 PolarHBondContact O-N 2.83Å; N197-I200 PolarHBondContact O-N 2.9Å; N197-K201 PolarHBondContact O-N 3.18Å
198	E	46.3	Very low	43.7	Very low	115 Å²	115	82 Å²	82	54%	0.537	41%	0.412	S	S	.	.	H	α-helix	trans	-64.8	-41.3	167.6	-81.8	-102.6	133.3	0	0	110.4	S194 D195 I200 K201 S202 K770	S194-E198 PolarHBondContact O-N 2.72Å; S194-E198 VanDerWaalsContact O-N 3.13Å; D195-E198 PolarHBondContact O-N 3.36Å; E198-I200 PolarHBondContact O-N 2.99Å; E198-K201 PolarHBondContact O-N 3.42Å; E198-S202 WeakPolarHBondContact O-CB 3.28Å; E198-S202 PolarHBondContact O-N 3.42Å; E198-K770 IonicContact OE1-NZ 3.69Å; E198-K770 PolarHBondContact OE1-NZ 3.01Å
199	E	43.9	Very low	44.3	Very low	99 Å²	99	82.5 Å²	82.5	46%	0.463	41%	0.408	S	S	.	.	H	α-helix	trans	-57.5	-47.8	169.7	-98.8	-164.2	118.8	0	0	111.5	D195 K201 S202 R203	D195-E199 PolarHBondContact O-N 2.71Å; E199-K201 PolarHBondContact O-N 2.79Å; E199-S202 PolarHBondContact O-N 3.49Å; E199-S202 PolarHBondContact O-OG 2.93Å; E199-R203 VanDerWaalsContact O-CB 3.28Å; E199-R203 WeakPolarHBondContact O-CB 3.42Å; E199-R203 WeakPolarHBondContact O-CG 3.5Å; E199-R203 PolarHBondContact O-N 3.26Å; E199-R203 IonicContact OE1-CZ 3.63Å; E199-R203 IonicContact OE1-NE 3.68Å; E199-R203 IonicContact OE1-NH2 2.71Å; E199-R203 PolarHBondContact OE1-NH2 3.49Å
200	I	46.7	Very low	44.6	Very low	53 Å²	53	84.1 Å²	84.1	27%	0.272	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-42.8	177.5	-74.4	161.3	0	0	0	112	L107 S196 N197 E198 R203 L204	L107-I200 HydrophobicContact CD1-CD1 3.84Å; L107-I200 HydrophobicContact CD1-CG1 4.17Å; L107-I200 HydrophobicContact CD1-CG2 3.59Å; L107-I200 HydrophobicContact CD2-CG2 3.57Å; L107-I200 HydrophobicContact CG-CG2 4.21Å; S196-I200 VanDerWaalsContact O-CD1 3.27Å; S196-I200 WeakPolarHBondContact O-CD1 3.07Å; S196-I200 WeakPolarHBondContact O-CG1 3.47Å; S196-I200 PolarHBondContact O-N 3.17Å; S196-I200 VanDerWaalsContact O-N 3.13Å; N197-I200 PolarHBondContact O-N 2.9Å; E198-I200 PolarHBondContact O-N 2.99Å; I200-R203 PolarHBondContact O-N 2.72Å; I200-L204 HydrophobicContact CG2-CD1 4.41Å; I200-L204 WeakPolarHBondContact O-CB 3.49Å; I200-L204 PolarHBondContact O-N 2.9Å
201	K	45.8	Very low	44.7	Very low	79 Å²	79	81.2 Å²	81.2	34%	0.343	40%	0.399	S	S	.	.	H	α-helix	trans	-68.5	-41.8	178.5	-174.5	174.4	-173.8	150.3	0	111.7	N197 E198 E199 L204 S205 T461	N197-K201 PolarHBondContact O-N 3.18Å; E198-K201 PolarHBondContact O-N 3.42Å; E199-K201 PolarHBondContact O-N 2.79Å; K201-L204 PolarHBondContact O-N 3.36Å; K201-S205 WeakPolarHBondContact O-CB 3.45Å; K201-S205 PolarHBondContact O-N 3.13Å; K201-S205 PolarHBondContact O-OG 2.73Å; K201-S205 VanDerWaalsContact O-OG 3.09Å; K201-T461 HydrophobicContact CD-CG2 3.8Å; K201-T461 HydrophobicContact CG-CG2 4.01Å; K201-T461 PolarHBondContact NZ-OG1 3.44Å; K201-T461 VanDerWaalsContact NZ-OG1 3.07Å
202	S	49.2	Very low	44.9	Very low	45 Å²	45	76.2 Å²	76.2	32%	0.315	38%	0.38	S	S	.	.	H	α-helix	trans	-61.2	-47.1	173.9	80.7	0	0	0	0	109.7	E198 E199 L204 S205 E206	E198-S202 WeakPolarHBondContact O-CB 3.28Å; E198-S202 PolarHBondContact O-N 3.42Å; E199-S202 PolarHBondContact O-N 3.49Å; E199-S202 PolarHBondContact O-OG 2.93Å; S202-L204 PolarHBondContact O-N 2.86Å; S202-S205 WeakPolarHBondContact CA-OG 3.48Å; S202-S205 CarbonylContact O-C 3.56Å; S202-S205 PolarHBondContact O-N 3.42Å; S202-S205 PolarHBondContact O-OG 3.43Å; S202-E206 WeakPolarHBondContact O-CA 3.48Å; S202-E206 WeakPolarHBondContact O-CB 3.33Å; S202-E206 VanDerWaalsContact O-CG 3.25Å; S202-E206 WeakPolarHBondContact O-CG 3.43Å; S202-E206 PolarHBondContact O-N 3.17Å
203	R	48.5	Very low	45.1	Very low	130 Å²	130	76.2 Å²	76.2	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-64.2	-35	175.8	-71.7	179.8	-170.3	-172.2	8.7	113	E199 I200 T207	E199-R203 VanDerWaalsContact O-CB 3.28Å; E199-R203 WeakPolarHBondContact O-CB 3.42Å; E199-R203 WeakPolarHBondContact O-CG 3.5Å; E199-R203 PolarHBondContact O-N 3.26Å; E199-R203 IonicContact OE1-CZ 3.63Å; E199-R203 IonicContact OE1-NE 3.68Å; E199-R203 IonicContact OE1-NH2 2.71Å; E199-R203 PolarHBondContact OE1-NH2 3.49Å; I200-R203 PolarHBondContact O-N 2.72Å; R203-T207 WeakPolarHBondContact O-CB 2.97Å; R203-T207 WeakPolarHBondContact O-CG2 3.44Å; R203-T207 PolarHBondContact O-N 3.07Å; R203-T207 PolarHBondContact O-OG1 3.1Å
204	L	44.6	Very low	45.7	Very low	43 Å²	43	77.6 Å²	77.6	23%	0.225	39%	0.385	C	S	.	.	H	α-helix	trans	-69.6	-44.3	174.5	-129.1	120.1	0	0	0	110.9	L107 M110 I200 K201 S202 T207 V208	L107-L204 HydrophobicContact CD2-CD1 3.53Å; M110-L204 HydrophobicContact CE-CD2 4.43Å; M110-L204 HydrophobicContact SD-CD1 4.26Å; I200-L204 HydrophobicContact CG2-CD1 4.41Å; I200-L204 WeakPolarHBondContact O-CB 3.49Å; I200-L204 PolarHBondContact O-N 2.9Å; K201-L204 PolarHBondContact O-N 3.36Å; S202-L204 PolarHBondContact O-N 2.86Å; L204-T207 WeakPolarHBondContact CA-OG1 3.27Å; L204-T207 PolarHBondContact O-OG1 3.11Å; L204-V208 WeakPolarHBondContact O-CB 2.86Å; L204-V208 WeakPolarHBondContact O-CG2 3.21Å; L204-V208 PolarHBondContact O-N 3.16Å
205	S	50.2	Low	46.1	Very low	45 Å²	45	80.3 Å²	80.3	32%	0.315	40%	0.396	S	S	.	.	H	α-helix	trans	-68.5	-34.8	175.5	66.4	0	0	0	0	112.3	K201 S202 R209	K201-S205 WeakPolarHBondContact O-CB 3.45Å; K201-S205 PolarHBondContact O-N 3.13Å; K201-S205 PolarHBondContact O-OG 2.73Å; K201-S205 VanDerWaalsContact O-OG 3.09Å; S202-S205 WeakPolarHBondContact CA-OG 3.48Å; S202-S205 CarbonylContact O-C 3.56Å; S202-S205 PolarHBondContact O-N 3.42Å; S202-S205 PolarHBondContact O-OG 3.43Å; S205-R209 WeakPolarHBondContact O-CB 3.4Å; S205-R209 WeakPolarHBondContact O-CD 3.18Å; S205-R209 WeakPolarHBondContact O-CG 3.46Å; S205-R209 PolarHBondContact O-N 2.91Å
206	E	51.3	Low	46.7	Very low	106 Å²	106	79.3 Å²	79.3	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-73.8	-42.4	176	-78.2	177.3	171.1	0	0	111.2	S202 R209 E210	S202-E206 WeakPolarHBondContact O-CA 3.48Å; S202-E206 WeakPolarHBondContact O-CB 3.33Å; S202-E206 VanDerWaalsContact O-CG 3.25Å; S202-E206 WeakPolarHBondContact O-CG 3.43Å; S202-E206 PolarHBondContact O-N 3.17Å; E206-R209 CarbonylContact O-C 3.5Å; E206-R209 PolarHBondContact O-N 3.47Å; E206-E210 VanDerWaalsContact O-CB 3.26Å; E206-E210 WeakPolarHBondContact O-CB 3.36Å; E206-E210 VanDerWaalsContact O-CG 3.23Å; E206-E210 WeakPolarHBondContact O-CG 3.43Å; E206-E210 PolarHBondContact O-N 3.41Å
207	T	47.2	Very low	46.7	Very low	31 Å²	31	79 Å²	79	19%	0.19	38%	0.383	C	S	.	.	H	α-helix	trans	-68.4	-38	174.8	48.6	0	0	0	0	112.1	R203 L204 E210 N211	R203-T207 WeakPolarHBondContact O-CB 2.97Å; R203-T207 WeakPolarHBondContact O-CG2 3.44Å; R203-T207 PolarHBondContact O-N 3.07Å; R203-T207 PolarHBondContact O-OG1 3.1Å; L204-T207 WeakPolarHBondContact CA-OG1 3.27Å; L204-T207 PolarHBondContact O-OG1 3.11Å; T207-E210 PolarHBondContact O-N 2.94Å; T207-N211 VanDerWaalsContact O-CB 3.26Å; T207-N211 WeakPolarHBondContact O-CB 3.31Å; T207-N211 PolarHBondContact O-N 3.18Å; T207-N211 PolarHBondContact O-ND2 3.2Å
208	V	48.1	Very low	46.9	Very low	10 Å²	10	81.7 Å²	81.7	6%	0.061	40%	0.404	C	S	.	.	H	α-helix	trans	-66	-39.8	171.7	167.6	0	0	0	0	110.5	L204 A212 E246 M253	L204-V208 WeakPolarHBondContact O-CB 2.86Å; L204-V208 WeakPolarHBondContact O-CG2 3.21Å; L204-V208 PolarHBondContact O-N 3.16Å; V208-A212 WeakPolarHBondContact O-CB 3.05Å; V208-A212 PolarHBondContact O-N 3.48Å; V208-E246 HydrophobicContact CG1-CG 3.28Å; V208-M253 HydrophobicContact CG2-CE 4.34Å; V208-M253 HydrophobicContact CG2-SD 4.2Å
209	R	47.6	Very low	46.9	Very low	144 Å²	144	83.6 Å²	83.6	54%	0.543	42%	0.418	S	S	.	.	H	α-helix	trans	-67.8	-35	172.2	-78.2	169.8	178.3	-171.7	-2.5	113.3	S205 E206 A212 K213	S205-R209 WeakPolarHBondContact O-CB 3.4Å; S205-R209 WeakPolarHBondContact O-CD 3.18Å; S205-R209 WeakPolarHBondContact O-CG 3.46Å; S205-R209 PolarHBondContact O-N 2.91Å; E206-R209 CarbonylContact O-C 3.5Å; E206-R209 PolarHBondContact O-N 3.47Å; R209-A212 CarbonylContact O-C 3.57Å; R209-A212 PolarHBondContact O-N 3.14Å; R209-K213 WeakPolarHBondContact O-CG 3.41Å; R209-K213 PolarHBondContact O-N 2.89Å
210	E	46.4	Very low	47.1	Very low	114 Å²	114	81.6 Å²	81.6	53%	0.533	41%	0.406	S	S	.	.	H	α-helix	trans	-74	-37.3	177	-78.4	-169.5	155	0	0	111.8	E206 T207 A212 K213	E206-E210 VanDerWaalsContact O-CB 3.26Å; E206-E210 WeakPolarHBondContact O-CB 3.36Å; E206-E210 VanDerWaalsContact O-CG 3.23Å; E206-E210 WeakPolarHBondContact O-CG 3.43Å; E206-E210 PolarHBondContact O-N 3.41Å; T207-E210 PolarHBondContact O-N 2.94Å; E210-A212 VanDerWaalsContact C-N 3.27Å; E210-A212 PolarHBondContact O-N 3.19Å; E210-K213 HydrophobicContact CG-CD 4.41Å; E210-K213 WeakPolarHBondContact O-CB 3.29Å; E210-K213 PolarHBondContact O-N 3.1Å; E210-K213 IonicContact OE1-NZ 3.81Å
211	N	46.6	Very low	47.5	Very low	51 Å²	51	86.4 Å²	86.4	27%	0.273	43%	0.425	S	S	.	.	H	α-helix	trans	-68.1	-28.4	169.2	-72.6	-21.1	0	0	0	112	T207 Q230	T207-N211 VanDerWaalsContact O-CB 3.26Å; T207-N211 WeakPolarHBondContact O-CB 3.31Å; T207-N211 PolarHBondContact O-N 3.18Å; T207-N211 PolarHBondContact O-ND2 3.2Å; N211-Q230 PolarHBondContact O-NE2 3.18Å
212	A	42.9	Very low	47.7	Very low	26 Å²	26	83.5 Å²	83.5	22%	0.215	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	0.9	174	0	0	0	0	0	114.1	V208 R209 E210 H214	V208-A212 WeakPolarHBondContact O-CB 3.05Å; V208-A212 PolarHBondContact O-N 3.48Å; R209-A212 CarbonylContact O-C 3.57Å; R209-A212 PolarHBondContact O-N 3.14Å; E210-A212 VanDerWaalsContact C-N 3.27Å; E210-A212 PolarHBondContact O-N 3.19Å; A212-H214 PolarHBondContact O-N 3.15Å
213	K	41	Very low	47.7	Very low	132 Å²	132	88.5 Å²	88.5	57%	0.574	44%	0.437	S	S	*	.	S	Bend	trans	-65.7	103.3	172.3	-83.7	175.3	-177.3	167.5	0	108.8	R209 E210 L215	R209-K213 WeakPolarHBondContact O-CG 3.41Å; R209-K213 PolarHBondContact O-N 2.89Å; E210-K213 HydrophobicContact CG-CD 4.41Å; E210-K213 WeakPolarHBondContact O-CB 3.29Å; E210-K213 PolarHBondContact O-N 3.1Å; E210-K213 IonicContact OE1-NZ 3.81Å; K213-L215 PolarHBondContact O-N 3.06Å
214	H	50.2	Low	47.7	Very low	143 Å²	143	85.4 Å²	85.4	66%	0.662	45%	0.446	S	S	*	.			trans	3.7	81.5	158.5	-78.6	-88.8	0	0	0	116.1	A212	A212-H214 PolarHBondContact O-N 3.15Å
215	L	46.6	Very low	48	Very low	102 Å²	102	89.2 Å²	89.2	53%	0.534	46%	0.462	S	S	.	.			trans	-96.1	107.1	147	-86.3	125.4	0	0	0	106.1	K213 V229	K213-L215 PolarHBondContact O-N 3.06Å; L215-V229 HydrophobicContact CB-CB 4.24Å; L215-V229 HydrophobicContact CB-CG2 3.95Å; L215-V229 WeakPolarHBondContact O-CG2 3.25Å; L215-V229 PolarHBondContact O-N 2.95Å
216	L	49.2	Very low	48.3	Very low	86 Å²	86	90 Å²	90	45%	0.45	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.6	169.6	-65.6	168.3	0	0	0	107.4	P218 P226	L216-P218 WeakPolarHBondContact O-CD 3.44Å; L216-P226 HydrophobicContact CB-CB 4.29Å; L216-P226 HydrophobicContact CD1-CB 4.46Å; L216-P226 HydrophobicContact CD1-CG 4.12Å; L216-P226 HydrophobicContact CD2-CB 4Å; L216-P226 HydrophobicContact CD2-CG 3.9Å; L216-P226 HydrophobicContact CG-CB 4.48Å; L216-P226 HydrophobicContact CG-CG 4.49Å
217	D	45.8	Very low	48.6	Very low	52 Å²	52	85 Å²	85	28%	0.278	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	121.9	177.5	-156.3	-23.7	0	0	0	108.6	D219 R220 V227 V229	D217-D219 VanDerWaalsContact C-N 3.27Å; D217-D219 PolarHBondContact O-N 2.58Å; D217-R220 HydrophobicContact CB-CB 4.31Å; D217-V227 WeakPolarHBondContact CB-O 3.42Å; D217-V227 PolarHBondContact N-O 2.92Å; D217-V229 HydrophobicContact CB-CG2 3.82Å
218	P	47.6	Very low	49.2	Very low	109 Å²	109	84 Å²	84	71%	0.708	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	-27.7	-174.3	18.5	-29.6	0	0	0	114.3	L216	L216-P218 WeakPolarHBondContact O-CD 3.44Å
219	D	45.4	Very low	49.8	Very low	156 Å²	156	87.1 Å²	87.1	83%	0.834	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	-19.4	-171.1	-70.5	-29.3	0	0	0	114.5	D217	D217-D219 VanDerWaalsContact C-N 3.27Å; D217-D219 PolarHBondContact O-N 2.58Å
220	R	49.2	Very low	50.6	Low	56 Å²	56	82.8 Å²	82.8	21%	0.211	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	113.1	-170	-161.2	176.9	-175.2	-154.1	0.4	112.8	D217 V227 P232 Q233 F235	D217-R220 HydrophobicContact CB-CB 4.31Å; R220-V227 HydrophobicContact CB-CB 4.44Å; R220-V227 HydrophobicContact CG-CB 4.46Å; R220-V227 HydrophobicContact CG-CG2 4.25Å; R220-V227 WeakPolarHBondContact O-CG2 3.25Å; R220-V227 PolarHBondContact O-N 3.15Å; R220-V227 VanDerWaalsContact O-N 3.12Å; R220-P232 PolarHBondContact NH1-O 3.29Å; R220-Q233 VanDerWaalsContact NH1-CA 3.28Å; R220-Q233 PolarHBondContact NH2-O 2.82Å; R220-F235 PolarHBondContact NH2-O 2.76Å
221	K	53.3	Low	52.1	Low	155 Å²	155	77.8 Å²	77.8	67%	0.674	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	130	174.3	-63.6	-179.6	-175.9	177.1	0	110.7	Q225	K221-Q225 WeakPolarHBondContact CA-O 3.32Å
222	V	51.8	Low	53.6	Low	18 Å²	18	75.6 Å²	75.6	11%	0.109	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.8	169.1	174.4	0	0	0	0	107	G224 Q225 V227 T236 V239	V222-G224 PolarHBondContact O-N 2.93Å; V222-Q225 PolarHBondContact N-O 3.03Å; V222-Q225 PolarHBondContact O-N 2.91Å; V222-V227 HydrophobicContact CB-CG2 4.02Å; V222-V227 HydrophobicContact CG2-CG2 3.71Å; V222-T236 WeakPolarHBondContact CG1-O 3.34Å; V222-V239 HydrophobicContact CB-CG2 4.28Å
223	N	47.5	Very low	55.2	Low	150 Å²	150	81.4 Å²	81.4	80%	0.802	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	34.3	-177	-58.7	-21.8	0	0	0	114.5	Q225	N223-Q225 VanDerWaalsContact C-N 3.34Å; N223-Q225 PolarHBondContact O-N 3.32Å
224	G	48.8	Very low	57	Low	65 Å²	65	76 Å²	76	67%	0.67	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-3.7	177.9	0	0	0	0	0	116	V222	V222-G224 PolarHBondContact O-N 2.93Å
225	Q	51.8	Low	58.5	Low	123 Å²	123	69.2 Å²	69.2	58%	0.575	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.9	175.5	-69.7	-176.3	-10.2	0	0	111.5	K221 V222 N223 V239	K221-Q225 WeakPolarHBondContact CA-O 3.32Å; V222-Q225 PolarHBondContact N-O 3.03Å; V222-Q225 PolarHBondContact O-N 2.91Å; N223-Q225 VanDerWaalsContact C-N 3.34Å; N223-Q225 PolarHBondContact O-N 3.32Å; Q225-V239 HydrophobicContact CB-CG2 3.96Å
226	P	55.2	Low	59.8	Low	61 Å²	61	67 Å²	67	40%	0.396	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	133	176.6	29.2	-33.4	0	0	0	110.4	L216	L216-P226 HydrophobicContact CB-CB 4.29Å; L216-P226 HydrophobicContact CD1-CB 4.46Å; L216-P226 HydrophobicContact CD1-CG 4.12Å; L216-P226 HydrophobicContact CD2-CB 4Å; L216-P226 HydrophobicContact CD2-CG 3.9Å; L216-P226 HydrophobicContact CG-CB 4.48Å; L216-P226 HydrophobicContact CG-CG 4.49Å
227	V	59.3	Low	60.9	Low	1 Å²	1	63.9 Å²	63.9	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	138.6	-177	-179.3	0	0	0	0	109.7	D217 R220 V222 Q231 V239	D217-V227 WeakPolarHBondContact CB-O 3.42Å; D217-V227 PolarHBondContact N-O 2.92Å; R220-V227 HydrophobicContact CB-CB 4.44Å; R220-V227 HydrophobicContact CG-CB 4.46Å; R220-V227 HydrophobicContact CG-CG2 4.25Å; R220-V227 WeakPolarHBondContact O-CG2 3.25Å; R220-V227 PolarHBondContact O-N 3.15Å; R220-V227 VanDerWaalsContact O-N 3.12Å; V222-V227 HydrophobicContact CB-CG2 4.02Å; V222-V227 HydrophobicContact CG2-CG2 3.71Å; V227-Q231 HydrophobicContact CG1-CB 3.74Å; V227-Q231 HydrophobicContact CG1-CG 4.06Å; V227-V239 HydrophobicContact CG2-CG2 4.41Å
228	P	59.5	Low	62.4	Low	11 Å²	11	62 Å²	62	7%	0.071	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	137.3	170.5	-18.1	28.2	0	0	0	111.7	Q230 Q231 I245	P228-Q230 PolarHBondContact O-N 3.47Å; P228-Q230 VanDerWaalsContact O-N 3.14Å; P228-Q231 VanDerWaalsContact O-CB 3.26Å; P228-Q231 WeakPolarHBondContact O-CB 3.45Å; P228-Q231 PolarHBondContact O-N 2.73Å; P228-I245 HydrophobicContact CB-CD1 3.57Å; P228-I245 HydrophobicContact CB-CG1 4.45Å; P228-I245 HydrophobicContact CG-CD1 3.34Å; P228-I245 HydrophobicContact CG-CG1 4.32Å
229	V	59.8	Low	64	Low	75 Å²	75	59 Å²	59	46%	0.455	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.8	179	173.2	0	0	0	0	112.3	L215 D217 Q231	L215-V229 HydrophobicContact CB-CB 4.24Å; L215-V229 HydrophobicContact CB-CG2 3.95Å; L215-V229 WeakPolarHBondContact O-CG2 3.25Å; L215-V229 PolarHBondContact O-N 2.95Å; D217-V229 HydrophobicContact CB-CG2 3.82Å; V229-Q231 PolarHBondContact O-N 3.39Å
230	Q	64	Low	65.7	Low	52 Å²	52	51.9 Å²	51.9	24%	0.243	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.2	177.6	-61	88.2	-9.9	0	0	113.5	N211 P228 I245	N211-Q230 PolarHBondContact O-NE2 3.18Å; P228-Q230 PolarHBondContact O-N 3.47Å; P228-Q230 VanDerWaalsContact O-N 3.14Å; Q230-I245 HydrophobicContact CB-CG2 3.63Å; Q230-I245 HydrophobicContact CG-CG2 4.26Å
231	Q	78.4	Confident	67.3	Low	9 Å²	9	54.3 Å²	54.3	4%	0.042	30%	0.298	C	S	.	.	S	Bend	trans	-77.2	130	177.8	-175.4	175.3	-45	0	0	110.4	V227 P228 V229 F235 G238 M240	V227-Q231 HydrophobicContact CG1-CB 3.74Å; V227-Q231 HydrophobicContact CG1-CG 4.06Å; P228-Q231 VanDerWaalsContact O-CB 3.26Å; P228-Q231 WeakPolarHBondContact O-CB 3.45Å; P228-Q231 PolarHBondContact O-N 2.73Å; V229-Q231 PolarHBondContact O-N 3.39Å; Q231-F235 HydrophobicContact CG-CB 4.27Å; Q231-F235 HydrophobicContact CG-CD1 4.24Å; Q231-F235 HydrophobicContact CG-CG 4.44Å; Q231-F235 PolarHBondContact NE2-O 3.06Å; Q231-G238 PolarHBondContact NE2-O 2.98Å; Q231-M240 HydrophobicContact CG-CG 4.2Å; Q231-M240 HydrophobicContact CG-SD 4.19Å
232	P	78.7	Confident	68.6	Low	6 Å²	6	52.2 Å²	52.2	4%	0.039	29%	0.286	C	S	.	.			trans	-55.6	145.1	-179.3	-24.4	32.5	0	0	0	113.7	R220 L234 F235 A277 A280 M281 E284	R220-P232 PolarHBondContact NH1-O 3.29Å; P232-L234 VanDerWaalsContact C-N 3.31Å; P232-L234 PolarHBondContact O-N 2.82Å; P232-F235 HydrophobicContact CB-CB 4.28Å; P232-F235 WeakPolarHBondContact O-CB 3.49Å; P232-F235 PolarHBondContact O-N 2.79Å; P232-F235 VanDerWaalsContact O-N 3.17Å; P232-A277 HydrophobicContact CG-CB 4.27Å; P232-A277 VanDerWaalsContact CG-O 3.31Å; P232-A277 WeakPolarHBondContact CG-O 3.45Å; P232-A280 HydrophobicContact CB-CB 3.94Å; P232-A280 HydrophobicContact CG-CB 4.35Å; P232-M281 HydrophobicContact CG-CB 4.03Å; P232-E284 VanDerWaalsContact C-OE1 3.32Å; P232-E284 VanDerWaalsContact CB-OE1 3.26Å; P232-E284 WeakPolarHBondContact CB-OE1 3.32Å
233	Q	75.8	Confident	70.1	Confident	147 Å²	147	51.4 Å²	51.4	69%	0.687	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.7	173.7	-65.5	-170.7	2.5	0	0	112.8	R220 F235 E284	R220-Q233 VanDerWaalsContact NH1-CA 3.28Å; R220-Q233 PolarHBondContact NH2-O 2.82Å; Q233-F235 PolarHBondContact O-N 3.3Å; Q233-E284 VanDerWaalsContact CA-OE1 3.3Å; Q233-E284 WeakPolarHBondContact CA-OE1 3.2Å; Q233-E284 WeakPolarHBondContact CB-OE1 3.4Å; Q233-E284 PolarHBondContact N-OE1 2.86Å; Q233-E284 PolarHBondContact N-OE2 3.46Å
234	L	78.3	Confident	72	Confident	18 Å²	18	44.9 Å²	44.9	9%	0.094	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.1	179.1	-61.8	174.8	0	0	0	113.4	P232 T236 A280 V283 E284 E313 L340	P232-L234 VanDerWaalsContact C-N 3.31Å; P232-L234 PolarHBondContact O-N 2.82Å; L234-T236 PolarHBondContact O-N 3.09Å; L234-A280 HydrophobicContact CB-CB 4.05Å; L234-V283 HydrophobicContact CD1-CB 3.94Å; L234-V283 HydrophobicContact CD1-CG1 3.63Å; L234-E284 HydrophobicContact CD1-CG 3.94Å; L234-E284 HydrophobicContact CG-CG 3.98Å; L234-E284 PolarHBondContact N-OE1 2.89Å; L234-E313 HydrophobicContact CD2-CB 4.4Å; L234-E313 WeakPolarHBondContact CD2-OE2 3.47Å; L234-L340 HydrophobicContact CD1-CD1 4.22Å; L234-L340 HydrophobicContact CD2-CD1 4.19Å
235	F	81.9	Confident	73.7	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.009	22%	0.217	C	C	.	.			trans	-88.8	104.1	175.8	-166.8	-76	0	0	0	110.5	R220 Q231 P232 Q233 G238 M240 I273 A277 F310	R220-F235 PolarHBondContact NH2-O 2.76Å; Q231-F235 HydrophobicContact CG-CB 4.27Å; Q231-F235 HydrophobicContact CG-CD1 4.24Å; Q231-F235 HydrophobicContact CG-CG 4.44Å; Q231-F235 PolarHBondContact NE2-O 3.06Å; P232-F235 HydrophobicContact CB-CB 4.28Å; P232-F235 WeakPolarHBondContact O-CB 3.49Å; P232-F235 PolarHBondContact O-N 2.79Å; P232-F235 VanDerWaalsContact O-N 3.17Å; Q233-F235 PolarHBondContact O-N 3.3Å; F235-G238 VanDerWaalsContact CE1-O 3.31Å; F235-G238 WeakPolarHBondContact CE1-O 3.44Å; F235-M240 HydrophobicContact CE1-CG 4.06Å; F235-M240 HydrophobicContact CE2-SD 4.5Å; F235-M240 HydrophobicContact CZ-CG 4.1Å; F235-I273 HydrophobicContact CE2-CG2 3.63Å; F235-I273 HydrophobicContact CZ-CG2 3.51Å; F235-A277 HydrophobicContact CD2-CB 4Å; F235-A277 HydrophobicContact CE2-CB 4.3Å; F235-F310 CarbonylContact C-O 3.6Å; F235-F310 WeakPolarHBondContact CA-O 3.37Å; F235-F310 HydrophobicContact CD2-CB 4.13Å; F235-F310 HydrophobicContact CE1-CB 4.48Å; F235-F310 AromaticContact CE1-CD1 3.6Å; F235-F310 HydrophobicContact CE1-CD1 3.6Å; F235-F310 HydrophobicContact CE1-CE1 4.21Å; F235-F310 HydrophobicContact CE1-CG 4.34Å; F235-F310 HydrophobicContact CE2-CB 3.63Å; F235-F310 AromaticContact CE2-CD1 3.97Å; F235-F310 HydrophobicContact CE2-CD1 3.97Å; F235-F310 AromaticContact CE2-CG 3.89Å; F235-F310 HydrophobicContact CE2-CG 3.89Å; F235-F310 HydrophobicContact CZ-CB 3.85Å; F235-F310 AromaticContact CZ-CD1 3.25Å; F235-F310 HydrophobicContact CZ-CD1 3.25Å; F235-F310 AromaticContact CZ-CE1 3.87Å; F235-F310 HydrophobicContact CZ-CE1 3.87Å; F235-F310 AromaticContact CZ-CG 3.64Å; F235-F310 HydrophobicContact CZ-CG 3.64Å
236	T	75.3	Confident	75.2	Confident	55 Å²	55	37.5 Å²	37.5	34%	0.337	19%	0.194	S	C	.	.			trans	-115.9	-16.6	-170.6	50.5	0	0	0	0	114.3	V222 L234 G238 F310 P312	V222-T236 WeakPolarHBondContact CG1-O 3.34Å; L234-T236 PolarHBondContact O-N 3.09Å; T236-G238 PolarHBondContact O-N 2.91Å; T236-F310 PolarHBondContact N-O 3.08Å; T236-P312 WeakPolarHBondContact OG1-CD 3.48Å
237	G	71.5	Confident	76.7	Confident	20 Å²	20	34.6 Å²	34.6	21%	0.206	18%	0.175	C	C	.	.	S	Bend	trans	-81.7	2.2	-171.3	0	0	0	0	0	117.3	R309 F310	G237-R309 VanDerWaalsContact CA-O 3.27Å; G237-R309 WeakPolarHBondContact CA-O 3.28Å; G237-F310 PolarHBondContact N-O 2.84Å; G237-F310 WeakPolarHBondContact O-CE1 3.31Å
238	G	78.1	Confident	78.1	Confident	12 Å²	12	34.8 Å²	34.8	12%	0.124	18%	0.176	C	C	.	.			trans	170.8	179.6	178.4	0	0	0	0	0	114.1	Q231 F235 T236	Q231-G238 PolarHBondContact NE2-O 2.98Å; F235-G238 VanDerWaalsContact CE1-O 3.31Å; F235-G238 WeakPolarHBondContact CE1-O 3.44Å; T236-G238 PolarHBondContact O-N 2.91Å
239	V	80.4	Confident	79.2	Confident	46 Å²	46	35.5 Å²	35.5	28%	0.279	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-100	128	174.3	-178.3	0	0	0	0	109.2	V222 Q225 V227	V222-V239 HydrophobicContact CB-CG2 4.28Å; Q225-V239 HydrophobicContact CB-CG2 3.96Å; V227-V239 HydrophobicContact CG2-CG2 4.41Å
240	M	81.6	Confident	80.5	Confident	7 Å²	7	32.8 Å²	32.8	3%	0.034	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-73.8	141	176.6	-63.4	-170.2	75.3	0	0	110.9	Q231 F235 Q244 I245 V248 I273 A277	Q231-M240 HydrophobicContact CG-CG 4.2Å; Q231-M240 HydrophobicContact CG-SD 4.19Å; F235-M240 HydrophobicContact CE1-CG 4.06Å; F235-M240 HydrophobicContact CE2-SD 4.5Å; F235-M240 HydrophobicContact CZ-CG 4.1Å; M240-Q244 HydrophobicContact CB-CB 4.28Å; M240-Q244 HydrophobicContact CE-CB 3.68Å; M240-I245 HydrophobicContact CB-CG1 3.94Å; M240-V248 HydrophobicContact CE-CG2 3.55Å; M240-V248 HydrophobicContact SD-CG2 4.34Å; M240-I273 HydrophobicContact CE-CG2 4.27Å; M240-A277 HydrophobicContact CE-CB 3.77Å; M240-A277 HydrophobicContact SD-CB 3.64Å
241	R	82.9	Confident	81.7	Confident	108 Å²	108	30.3 Å²	30.3	41%	0.408	15%	0.149	S	C	.	.	P	Polyproline II helix	trans	-74.4	157.8	174.2	-62.3	-175.5	-179.6	-137.1	2.2	110.6	Y243 Q244 I245	R241-Y243 VanDerWaalsContact C-N 3.31Å; R241-Y243 HydrophobicContact CB-CD1 3.73Å; R241-Y243 HydrophobicContact CB-CE1 3.39Å; R241-Y243 VanDerWaalsContact CD-CE1 3.49Å; R241-Y243 HydrophobicContact CG-CE1 4.06Å; R241-Y243 PolarHBondContact O-N 2.96Å; R241-Q244 HydrophobicContact CB-CG 4.19Å; R241-Q244 WeakPolarHBondContact O-CA 3.49Å; R241-Q244 WeakPolarHBondContact O-CB 3.32Å; R241-Q244 PolarHBondContact O-N 3.32Å; R241-I245 WeakPolarHBondContact O-CG1 3.47Å; R241-I245 PolarHBondContact O-N 3.26Å; R241-I245 VanDerWaalsContact O-N 3.07Å
242	W	79.7	Confident	82	Confident	111 Å²	111	32.2 Å²	32.2	42%	0.42	16%	0.155	S	C	.	.	H	α-helix	trans	-50.4	-46.5	-176.1	68.1	-95.6	0	0	0	113.7	Q244 I245 E246 V472	W242-Q244 VanDerWaalsContact C-N 3.31Å; W242-Q244 PolarHBondContact O-N 2.97Å; W242-I245 WeakPolarHBondContact O-CB 3.34Å; W242-I245 PolarHBondContact O-N 3.21Å; W242-E246 PolarHBondContact O-N 2.85Å; W242-V472 HydrophobicContact CZ2-CG1 4.29Å
243	Y	83.7	Confident	82.1	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.7	-29.6	178.5	70.8	-86.4	0	0	0	111.7	R241 I245 E246 G247 L269 R467 V472 L474	R241-Y243 VanDerWaalsContact C-N 3.31Å; R241-Y243 HydrophobicContact CB-CD1 3.73Å; R241-Y243 HydrophobicContact CB-CE1 3.39Å; R241-Y243 VanDerWaalsContact CD-CE1 3.49Å; R241-Y243 HydrophobicContact CG-CE1 4.06Å; R241-Y243 PolarHBondContact O-N 2.96Å; Y243-I245 VanDerWaalsContact C-N 3.33Å; Y243-E246 WeakPolarHBondContact O-CB 3.45Å; Y243-E246 PolarHBondContact O-N 3.3Å; Y243-G247 PolarHBondContact O-N 3.37Å; Y243-L269 HydrophobicContact CE2-CB 3.87Å; Y243-L269 HydrophobicContact CE2-CD2 4.1Å; Y243-L269 HydrophobicContact CE2-CG 4.45Å; Y243-L269 WeakPolarHBondContact CE2-O 3.21Å; Y243-L269 PolarHBondContact OH-O 3.16Å; Y243-R467 VanDerWaalsContact O-CZ 3.27Å; Y243-R467 PolarHBondContact O-NH1 2.95Å; Y243-R467 PolarHBondContact O-NH2 3.47Å; Y243-V472 HydrophobicContact CD1-CB 4.42Å; Y243-V472 HydrophobicContact CD1-CG1 3.07Å; Y243-V472 HydrophobicContact CD1-CG2 4.45Å; Y243-V472 HydrophobicContact CD2-CG1 4.29Å; Y243-V472 HydrophobicContact CE1-CG1 3.26Å; Y243-V472 HydrophobicContact CE2-CG1 4.45Å; Y243-V472 HydrophobicContact CG-CG1 3.63Å; Y243-V472 HydrophobicContact CG-CG2 4.2Å; Y243-L474 HydrophobicContact CE1-CD2 4.04Å
244	Q	86.8	Confident	82.6	Confident	13 Å²	13	26.6 Å²	26.6	6%	0.061	13%	0.129	C	C	.	.	H	α-helix	trans	-69.1	-38.1	176.9	-60.3	176.8	-35.6	0	0	110.5	M240 R241 W242 G247 V248 L269 Q274	M240-Q244 HydrophobicContact CB-CB 4.28Å; M240-Q244 HydrophobicContact CE-CB 3.68Å; R241-Q244 HydrophobicContact CB-CG 4.19Å; R241-Q244 WeakPolarHBondContact O-CA 3.49Å; R241-Q244 WeakPolarHBondContact O-CB 3.32Å; R241-Q244 PolarHBondContact O-N 3.32Å; W242-Q244 VanDerWaalsContact C-N 3.31Å; W242-Q244 PolarHBondContact O-N 2.97Å; Q244-G247 PolarHBondContact O-N 3.48Å; Q244-V248 WeakPolarHBondContact O-CG2 3.43Å; Q244-V248 PolarHBondContact O-N 3.07Å; Q244-L269 PolarHBondContact NE2-O 3.09Å; Q244-L269 VanDerWaalsContact NE2-O 3.08Å; Q244-Q274 HydrophobicContact CB-CG 4.07Å; Q244-Q274 HydrophobicContact CG-CG 4.36Å
245	I	84.6	Confident	83	Confident	14 Å²	14	28.2 Å²	28.2	7%	0.072	13%	0.134	C	C	.	.	H	α-helix	trans	-63	-47.8	174	-57.6	161.5	0	0	0	110.1	P228 Q230 M240 R241 W242 Y243 G247 V248 E249	P228-I245 HydrophobicContact CB-CD1 3.57Å; P228-I245 HydrophobicContact CB-CG1 4.45Å; P228-I245 HydrophobicContact CG-CD1 3.34Å; P228-I245 HydrophobicContact CG-CG1 4.32Å; Q230-I245 HydrophobicContact CB-CG2 3.63Å; Q230-I245 HydrophobicContact CG-CG2 4.26Å; M240-I245 HydrophobicContact CB-CG1 3.94Å; R241-I245 WeakPolarHBondContact O-CG1 3.47Å; R241-I245 PolarHBondContact O-N 3.26Å; R241-I245 VanDerWaalsContact O-N 3.07Å; W242-I245 WeakPolarHBondContact O-CB 3.34Å; W242-I245 PolarHBondContact O-N 3.21Å; Y243-I245 VanDerWaalsContact C-N 3.33Å; I245-G247 PolarHBondContact O-N 2.87Å; I245-V248 PolarHBondContact O-N 2.88Å; I245-V248 VanDerWaalsContact O-N 3.08Å; I245-E249 PolarHBondContact O-N 2.93Å
246	E	83.8	Confident	83	Confident	19 Å²	19	31.3 Å²	31.3	9%	0.089	15%	0.149	C	C	.	.	H	α-helix	trans	-53.7	-41.7	174.4	-166.6	-163.8	-168.1	0	0	111.6	V208 W242 Y243 W250 R467	V208-E246 HydrophobicContact CG1-CG 3.28Å; W242-E246 PolarHBondContact O-N 2.85Å; Y243-E246 WeakPolarHBondContact O-CB 3.45Å; Y243-E246 PolarHBondContact O-N 3.3Å; E246-W250 WeakPolarHBondContact O-CB 3.28Å; E246-W250 PolarHBondContact O-N 3.31Å; E246-R467 IonicContact OE2-NH1 3.11Å; E246-R467 PolarHBondContact OE2-NH1 3.25Å
247	G	87.1	Confident	83.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.2	-40.4	176.6	0	0	0	0	0	113.4	Y243 Q244 I245 W250 L251	Y243-G247 PolarHBondContact O-N 3.37Å; Q244-G247 PolarHBondContact O-N 3.48Å; I245-G247 PolarHBondContact O-N 2.87Å; G247-W250 PolarHBondContact O-N 3.33Å; G247-L251 VanDerWaalsContact O-CG 3.29Å; G247-L251 WeakPolarHBondContact O-CG 3.2Å; G247-L251 PolarHBondContact O-N 2.99Å
248	V	87.4	Confident	83.7	Confident	6 Å²	6	31.7 Å²	31.7	4%	0.036	16%	0.155	C	C	.	.	H	α-helix	trans	-67.2	-41.1	176.8	172.8	0	0	0	0	111.3	M240 Q244 I245 L251 R252 Q274 A277	M240-V248 HydrophobicContact CE-CG2 3.55Å; M240-V248 HydrophobicContact SD-CG2 4.34Å; Q244-V248 WeakPolarHBondContact O-CG2 3.43Å; Q244-V248 PolarHBondContact O-N 3.07Å; I245-V248 PolarHBondContact O-N 2.88Å; I245-V248 VanDerWaalsContact O-N 3.08Å; V248-L251 PolarHBondContact O-N 3.06Å; V248-R252 WeakPolarHBondContact O-CB 2.95Å; V248-R252 PolarHBondContact O-N 3.13Å; V248-Q274 HydrophobicContact CG2-CB 4.26Å; V248-A277 HydrophobicContact CG1-CB 4.49Å; V248-A277 HydrophobicContact CG2-CB 3.72Å
249	E	84	Confident	84	Confident	25 Å²	25	31.4 Å²	31.4	12%	0.117	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-40.7	176.9	-171.6	58.7	-150.1	0	0	110.9	I245 L251 R252 M253	I245-E249 PolarHBondContact O-N 2.93Å; E249-L251 PolarHBondContact O-N 3.09Å; E249-R252 WeakPolarHBondContact O-CB 3.26Å; E249-R252 PolarHBondContact O-N 3.02Å; E249-R252 IonicContact OE1-NH1 3.3Å; E249-R252 IonicContact OE2-NH1 2.74Å; E249-M253 HydrophobicContact CG-CE 4.09Å; E249-M253 WeakPolarHBondContact O-CG 3.41Å; E249-M253 PolarHBondContact O-N 3.4Å
250	W	86.9	Confident	84.4	Confident	18 Å²	18	30.2 Å²	30.2	7%	0.068	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-44.7	171.6	178.3	79.8	0	0	0	112.2	E246 G247 R252 M253 L254 I262 L263 F463 L465	E246-W250 WeakPolarHBondContact O-CB 3.28Å; E246-W250 PolarHBondContact O-N 3.31Å; G247-W250 PolarHBondContact O-N 3.33Å; W250-R252 VanDerWaalsContact C-N 3.31Å; W250-R252 PolarHBondContact O-N 2.97Å; W250-M253 PolarHBondContact O-N 2.77Å; W250-L254 HydrophobicContact CD2-CD1 4.04Å; W250-L254 HydrophobicContact CD2-CG 4.46Å; W250-L254 HydrophobicContact CE3-CD1 3.94Å; W250-L254 HydrophobicContact CH2-CD1 3.39Å; W250-L254 HydrophobicContact CZ2-CD1 3.48Å; W250-L254 VanDerWaalsContact CZ2-CD1 3.48Å; W250-L254 HydrophobicContact CZ2-CG 4.28Å; W250-L254 HydrophobicContact CZ3-CD1 3.62Å; W250-L254 WeakPolarHBondContact O-CG 3.41Å; W250-L254 PolarHBondContact O-N 3.09Å; W250-L254 VanDerWaalsContact O-N 3.08Å; W250-I262 WeakPolarHBondContact CH2-O 3.31Å; W250-L263 HydrophobicContact CZ3-CD1 4.48Å; W250-F463 WeakPolarHBondContact CH2-O 3.27Å; W250-L465 HydrophobicContact CB-CD2 4.15Å; W250-L465 HydrophobicContact CD2-CB 3.82Å; W250-L465 HydrophobicContact CD2-CD2 3.95Å; W250-L465 HydrophobicContact CD2-CG 4.42Å; W250-L465 HydrophobicContact CE3-CB 3.77Å; W250-L465 HydrophobicContact CE3-CD2 3.83Å; W250-L465 HydrophobicContact CE3-CG 4.45Å; W250-L465 HydrophobicContact CG-CD2 4.1Å; W250-L465 HydrophobicContact CH2-CB 3.82Å; W250-L465 HydrophobicContact CZ2-CB 3.86Å; W250-L465 HydrophobicContact CZ3-CB 3.78Å
251	L	88.7	Confident	84.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-37.6	175	-71.8	172.5	0	0	0	112.3	G247 V248 E249 L254 W255 H278 L396	G247-L251 VanDerWaalsContact O-CG 3.29Å; G247-L251 WeakPolarHBondContact O-CG 3.2Å; G247-L251 PolarHBondContact O-N 2.99Å; V248-L251 PolarHBondContact O-N 3.06Å; E249-L251 PolarHBondContact O-N 3.09Å; L251-L254 PolarHBondContact O-N 3.1Å; L251-W255 WeakPolarHBondContact O-CB 3.25Å; L251-W255 PolarHBondContact O-N 2.96Å; L251-H278 VanDerWaalsContact C-CE1 3.46Å; L251-H278 HydrophobicContact CB-CB 4.4Å; L251-H278 HydrophobicContact CD1-CB 4.05Å; L251-H278 PolarHBondContact O-CE1 3.44Å; L251-L396 HydrophobicContact CD1-CD2 4.43Å; L251-L396 HydrophobicContact CD2-CD1 3.53Å; L251-L396 HydrophobicContact CD2-CD2 3.84Å; L251-L396 HydrophobicContact CD2-CG 4.35Å
252	R	84.9	Confident	85	Confident	49 Å²	49	25 Å²	25	19%	0.185	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-47.7	174.3	178.9	-174.9	169.8	-164.3	-11.7	111.2	E117 V248 E249 W250 L254 W255 E256 M281	E117-R252 IonicContact OE1-NH2 2.66Å; E117-R252 PolarHBondContact OE1-NH2 2.6Å; V248-R252 WeakPolarHBondContact O-CB 2.95Å; V248-R252 PolarHBondContact O-N 3.13Å; E249-R252 WeakPolarHBondContact O-CB 3.26Å; E249-R252 PolarHBondContact O-N 3.02Å; E249-R252 IonicContact OE1-NH1 3.3Å; E249-R252 IonicContact OE2-NH1 2.74Å; W250-R252 VanDerWaalsContact C-N 3.31Å; W250-R252 PolarHBondContact O-N 2.97Å; R252-L254 VanDerWaalsContact C-N 3.3Å; R252-L254 PolarHBondContact O-N 3.36Å; R252-W255 PolarHBondContact O-N 3.42Å; R252-E256 HydrophobicContact CG-CG 4.44Å; R252-E256 WeakPolarHBondContact CG-OE1 3.24Å; R252-E256 IonicContact CZ-OE1 3.98Å; R252-E256 IonicContact NE-OE1 3.7Å; R252-E256 PolarHBondContact NE-OE1 3.08Å; R252-E256 IonicContact NH2-OE1 2.74Å; R252-E256 PolarHBondContact NH2-OE1 3.36Å; R252-E256 WeakPolarHBondContact O-CG 3.29Å; R252-E256 PolarHBondContact O-N 3.31Å; R252-M281 HydrophobicContact CB-CE 3.73Å; R252-M281 HydrophobicContact CB-SD 3.64Å; R252-M281 VanDerWaalsContact CD-SD 3.55Å; R252-M281 HydrophobicContact CG-CE 3.72Å; R252-M281 HydrophobicContact CG-SD 3.54Å; R252-M281 VanDerWaalsContact CG-SD 3.54Å
253	M	81	Confident	85.4	Confident	22 Å²	22	19.7 Å²	19.7	11%	0.108	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-40.7	177.8	-70.6	177	176.8	0	0	111.9	M110 V208 E249 W250 N257	M110-M253 HydrophobicContact CE-CB 4.28Å; M110-M253 HydrophobicContact CE-SD 3.87Å; V208-M253 HydrophobicContact CG2-CE 4.34Å; V208-M253 HydrophobicContact CG2-SD 4.2Å; E249-M253 HydrophobicContact CG-CE 4.09Å; E249-M253 WeakPolarHBondContact O-CG 3.41Å; E249-M253 PolarHBondContact O-N 3.4Å; W250-M253 PolarHBondContact O-N 2.77Å; M253-N257 PolarHBondContact O-N 2.85Å; M253-N257 PolarHBondContact O-ND2 3.49Å
254	L	85.3	Confident	85.6	Confident	13 Å²	13	19.8 Å²	19.8	7%	0.068	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-47.1	175.8	-71.1	-179.8	0	0	0	112	W250 L251 R252 N257 G258 I259	W250-L254 HydrophobicContact CD2-CD1 4.04Å; W250-L254 HydrophobicContact CD2-CG 4.46Å; W250-L254 HydrophobicContact CE3-CD1 3.94Å; W250-L254 HydrophobicContact CH2-CD1 3.39Å; W250-L254 HydrophobicContact CZ2-CD1 3.48Å; W250-L254 VanDerWaalsContact CZ2-CD1 3.48Å; W250-L254 HydrophobicContact CZ2-CG 4.28Å; W250-L254 HydrophobicContact CZ3-CD1 3.62Å; W250-L254 WeakPolarHBondContact O-CG 3.41Å; W250-L254 PolarHBondContact O-N 3.09Å; W250-L254 VanDerWaalsContact O-N 3.08Å; L251-L254 PolarHBondContact O-N 3.1Å; R252-L254 VanDerWaalsContact C-N 3.3Å; R252-L254 PolarHBondContact O-N 3.36Å; L254-N257 PolarHBondContact O-N 3.35Å; L254-G258 PolarHBondContact O-N 3.24Å; L254-G258 VanDerWaalsContact O-N 3.13Å; L254-I259 HydrophobicContact CD2-CB 4.12Å; L254-I259 HydrophobicContact CD2-CG2 3.85Å; L254-I259 PolarHBondContact O-N 3.38Å
255	W	86.8	Confident	85.5	Confident	52 Å²	52	19.2 Å²	19.2	20%	0.197	10%	0.101	C	C	.	.	H	α-helix	trans	-64.4	-43	-178.9	171.5	68.9	0	0	0	112.8	L251 R252 N257 G258 M281 M282 K285 V287	L251-W255 WeakPolarHBondContact O-CB 3.25Å; L251-W255 PolarHBondContact O-N 2.96Å; R252-W255 PolarHBondContact O-N 3.42Å; W255-N257 PolarHBondContact O-N 3.35Å; W255-G258 PolarHBondContact O-N 3.05Å; W255-M281 HydrophobicContact CE3-CE 4.21Å; W255-M282 HydrophobicContact CD2-CG 4.13Å; W255-M282 HydrophobicContact CD2-SD 4.24Å; W255-M282 HydrophobicContact CE3-CG 4.48Å; W255-M282 HydrophobicContact CG-SD 4.17Å; W255-M282 HydrophobicContact CZ2-CG 4.32Å; W255-K285 HydrophobicContact CH2-CB 4.29Å; W255-K285 HydrophobicContact CH2-CD 3.85Å; W255-K285 HydrophobicContact CZ3-CD 3.53Å; W255-V287 HydrophobicContact CH2-CG2 4.26Å; W255-V287 HydrophobicContact CZ2-CG2 3.77Å
256	E	83.4	Confident	85.2	Confident	67 Å²	67	20.4 Å²	20.4	31%	0.313	11%	0.107	S	C	.	.	H	α-helix	trans	-64	-27.9	178	-72.1	-179.4	-174.1	0	0	112.8	R252 K285	R252-E256 HydrophobicContact CG-CG 4.44Å; R252-E256 WeakPolarHBondContact CG-OE1 3.24Å; R252-E256 IonicContact CZ-OE1 3.98Å; R252-E256 IonicContact NE-OE1 3.7Å; R252-E256 PolarHBondContact NE-OE1 3.08Å; R252-E256 IonicContact NH2-OE1 2.74Å; R252-E256 PolarHBondContact NH2-OE1 3.36Å; R252-E256 WeakPolarHBondContact O-CG 3.29Å; R252-E256 PolarHBondContact O-N 3.31Å; E256-K285 IonicContact OE1-NZ 3.12Å; E256-K285 PolarHBondContact OE1-NZ 2.86Å
257	N	79.8	Confident	84.9	Confident	35 Å²	35	20 Å²	20	19%	0.187	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-4.5	175.6	-71.4	-56.2	0	0	0	113.7	L106 M253 L254 W255 I259	L106-N257 HydrophobicContact CD2-CB 4.11Å; M253-N257 PolarHBondContact O-N 2.85Å; M253-N257 PolarHBondContact O-ND2 3.49Å; L254-N257 PolarHBondContact O-N 3.35Å; W255-N257 PolarHBondContact O-N 3.35Å; N257-I259 VanDerWaalsContact C-N 3.34Å; N257-I259 HydrophobicContact CB-CD1 3.87Å; N257-I259 HydrophobicContact CB-CG1 3.91Å
258	G	81	Confident	84.3	Confident	48 Å²	48	20.4 Å²	20.4	50%	0.495	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	33.1	-176.7	0	0	0	0	0	113.2	L254 W255	L254-G258 PolarHBondContact O-N 3.24Å; L254-G258 VanDerWaalsContact O-N 3.13Å; W255-G258 PolarHBondContact O-N 3.05Å
259	I	83.8	Confident	84	Confident	7 Å²	7	20.1 Å²	20.1	4%	0.036	11%	0.108	C	C	.	.			trans	-108.1	139.7	-175.2	-61.2	-177	0	0	0	110.5	Y102 L106 L254 N257 F463	Y102-I259 HydrophobicContact CE1-CD1 3.95Å; Y102-I259 WeakPolarHBondContact OH-CD1 3.26Å; Y102-I259 WeakPolarHBondContact OH-CG1 3.26Å; L106-I259 HydrophobicContact CD1-CD1 3.48Å; L106-I259 VanDerWaalsContact CD1-CD1 3.48Å; L106-I259 HydrophobicContact CD2-CD1 3.41Å; L106-I259 VanDerWaalsContact CD2-CD1 3.41Å; L106-I259 HydrophobicContact CG-CD1 3.87Å; L254-I259 HydrophobicContact CD2-CB 4.12Å; L254-I259 HydrophobicContact CD2-CG2 3.85Å; L254-I259 PolarHBondContact O-N 3.38Å; N257-I259 VanDerWaalsContact C-N 3.34Å; N257-I259 HydrophobicContact CB-CD1 3.87Å; N257-I259 HydrophobicContact CB-CG1 3.91Å; I259-F463 HydrophobicContact CG2-CD1 3.49Å; I259-F463 VanDerWaalsContact CG2-CD1 3.49Å; I259-F463 HydrophobicContact CG2-CE1 3.38Å
260	N	88.9	Confident	84	Confident	20 Å²	20	19.3 Å²	19.3	11%	0.107	11%	0.106	C	C	.	.			trans	-82.2	144.1	175.1	-60.6	-33.2	0	0	0	111.3	N394 K395 L417	N260-N394 WeakPolarHBondContact OD1-CA 3.5Å; N260-K395 VanDerWaalsContact CA-O 3.29Å; N260-K395 WeakPolarHBondContact CA-O 3.4Å; N260-K395 HydrophobicContact CB-CB 4.39Å; N260-K395 VanDerWaalsContact CB-O 3.32Å; N260-K395 WeakPolarHBondContact CB-O 3.45Å; N260-K395 PolarHBondContact OD1-N 3.1Å; N260-L417 HydrophobicContact CB-CB 4.12Å; N260-L417 HydrophobicContact CB-CD2 3.74Å; N260-L417 PolarHBondContact ND2-O 2.98Å
261	G	87.6	Confident	84.1	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.01	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.8	-172.6	0	0	0	0	0	115	K395 L397	G261-K395 PolarHBondContact N-O 3.33Å; G261-L397 PolarHBondContact O-N 3.27Å
262	I	88.8	Confident	84.2	Confident	5 Å²	5	20.1 Å²	20.1	3%	0.026	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.9	170	-51.6	176.9	0	0	0	109.2	W250 A264 L397 T399 L417 F463 L464 L465	W250-I262 WeakPolarHBondContact CH2-O 3.31Å; I262-A264 HydrophobicContact CG2-CB 4.21Å; I262-A264 PolarHBondContact O-N 3Å; I262-L397 CarbonylContact C-O 3.59Å; I262-L397 WeakPolarHBondContact CA-O 3.36Å; I262-L397 HydrophobicContact CG1-CB 4.4Å; I262-L397 HydrophobicContact CG2-CB 4.45Å; I262-T399 HydrophobicContact CG2-CG2 3.97Å; I262-L417 HydrophobicContact CD1-CD1 3.53Å; I262-L417 HydrophobicContact CG1-CD1 3.38Å; I262-F463 PolarHBondContact N-O 3.18Å; I262-L464 HydrophobicContact CB-CD1 4.37Å; I262-L464 HydrophobicContact CB-CG 4.46Å; I262-L464 HydrophobicContact CD1-CD1 4.42Å; I262-L464 HydrophobicContact CG2-CD1 4.2Å; I262-L464 WeakPolarHBondContact O-CA 3.4Å; I262-L465 PolarHBondContact O-N 3.31Å; I262-L465 VanDerWaalsContact O-N 3.09Å
263	L	89.6	Confident	84.4	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	100.7	169.1	-171.9	63.9	0	0	0	109.2	W250 K271 Q274 L396 L397 L398 T399 L465	W250-L263 HydrophobicContact CZ3-CD1 4.48Å; L263-K271 HydrophobicContact CD2-CB 3.95Å; L263-K271 HydrophobicContact CD2-CD 4.37Å; L263-K271 HydrophobicContact CD2-CG 3.84Å; L263-K271 HydrophobicContact CG-CD 4.26Å; L263-K271 HydrophobicContact CG-CG 4.14Å; L263-Q274 HydrophobicContact CD2-CB 4.33Å; L263-L396 HydrophobicContact CB-CD1 4.47Å; L263-L397 PolarHBondContact N-O 3.35Å; L263-L398 HydrophobicContact CB-CD2 3.77Å; L263-L398 HydrophobicContact CD2-CD2 4.06Å; L263-L398 HydrophobicContact CG-CD2 4.48Å; L263-L398 WeakPolarHBondContact O-CA 3.26Å; L263-T399 PolarHBondContact O-N 2.69Å; L263-L465 HydrophobicContact CD1-CB 4.18Å; L263-L465 HydrophobicContact CD1-CD2 3.94Å; L263-L465 HydrophobicContact CD1-CG 4.32Å
264	A	86.5	Confident	84.9	Confident	2 Å²	2	18.1 Å²	18.1	2%	0.017	11%	0.105	C	C	.	.			trans	-107	19.6	-173.7	0	0	0	0	0	113.8	I262 T399 L464 L465 R466	I262-A264 HydrophobicContact CG2-CB 4.21Å; I262-A264 PolarHBondContact O-N 3Å; A264-T399 CarbonylContact C-O 3.53Å; A264-T399 VanDerWaalsContact CA-O 3.31Å; A264-T399 WeakPolarHBondContact CA-O 3.31Å; A264-T399 HydrophobicContact CB-CG2 3.56Å; A264-L464 HydrophobicContact CB-CD1 4.05Å; A264-L464 HydrophobicContact CB-CD2 4.2Å; A264-L464 HydrophobicContact CB-CG 3.98Å; A264-L465 CarbonylContact C-O 3.56Å; A264-L465 WeakPolarHBondContact CA-O 3.45Å; A264-L465 PolarHBondContact N-O 3.44Å; A264-R466 HydrophobicContact CB-CB 4.1Å; A264-R466 WeakPolarHBondContact O-CG 3.28Å; A264-R466 PolarHBondContact O-NH1 2.84Å
265	D	85.9	Confident	85.2	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-50.3	143.6	172	-84.6	-8.9	0	0	0	112.1	L269 K271 Q274 L465 R467	D265-L269 HydrophobicContact CB-CB 4.26Å; D265-L269 HydrophobicContact CB-CD1 3.96Å; D265-K271 HydrophobicContact CB-CD 4.25Å; D265-K271 HydrophobicContact CB-CG 4.02Å; D265-K271 PolarHBondContact O-NZ 3.49Å; D265-Q274 PolarHBondContact OD2-NE2 3.08Å; D265-Q274 VanDerWaalsContact OD2-NE2 3.08Å; D265-L465 PolarHBondContact N-O 3.33Å; D265-R467 WeakPolarHBondContact OD1-CB 3.29Å; D265-R467 IonicContact OD1-CZ 3.44Å; D265-R467 PolarHBondContact OD1-N 3.17Å; D265-R467 VanDerWaalsContact OD1-N 3.1Å; D265-R467 IonicContact OD1-NE 2.76Å; D265-R467 PolarHBondContact OD1-NE 3.3Å; D265-R467 IonicContact OD1-NH2 3.55Å; D265-R467 IonicContact OD2-CZ 2.86Å; D265-R467 IonicContact OD2-NE 3.92Å; D265-R467 PolarHBondContact OD2-NE 2.95Å; D265-R467 IonicContact OD2-NH2 3.57Å; D265-R467 PolarHBondContact OD2-NH2 3.25Å
266	E	78.6	Confident	85.4	Confident	39 Å²	39	15 Å²	15	18%	0.182	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-54.1	152	175.9	-163.4	-177.6	146.8	0	0	111.9	G268 L269 K271 R467 L468 K469	E266-G268 PolarHBondContact O-N 2.95Å; E266-L269 HydrophobicContact CB-CD1 4.18Å; E266-L269 HydrophobicContact CB-CG 4.42Å; E266-L269 PolarHBondContact O-N 2.98Å; E266-K271 PolarHBondContact O-NZ 2.91Å; E266-R467 WeakPolarHBondContact CB-O 3.37Å; E266-R467 PolarHBondContact N-O 3.42Å; E266-L468 WeakPolarHBondContact OE2-CA 3.43Å; E266-K469 HydrophobicContact CG-CG 4.35Å; E266-K469 WeakPolarHBondContact OE1-CD 3.39Å; E266-K469 VanDerWaalsContact OE1-CE 3.23Å; E266-K469 WeakPolarHBondContact OE1-CE 3.33Å; E266-K469 WeakPolarHBondContact OE1-CG 3.47Å; E266-K469 IonicContact OE1-NZ 2.72Å; E266-K469 PolarHBondContact OE2-N 3.48Å
267	M	78	Confident	85.8	Confident	10 Å²	10	11.9 Å²	11.9	5%	0.049	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	136.3	174.9	-66.4	-166.9	127.5	0	0	111.2	K469 Q723 D726 R727	M267-K469 WeakPolarHBondContact O-CE 3.5Å; M267-Q723 HydrophobicContact CE-CB 4.21Å; M267-Q723 HydrophobicContact CE-CG 3.65Å; M267-Q723 HydrophobicContact SD-CB 4Å; M267-Q723 HydrophobicContact SD-CG 3.57Å; M267-Q723 VanDerWaalsContact SD-CG 3.57Å; M267-D726 HydrophobicContact CB-CB 4.28Å; M267-D726 HydrophobicContact SD-CB 4.42Å; M267-R727 PolarHBondContact SD-NH2 3.13Å
268	G	73.8	Confident	86.3	Confident	10 Å²	10	10.2 Å²	10.2	10%	0.103	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	-12.1	178.5	0	0	0	0	0	116	E266 G270 I731	E266-G268 PolarHBondContact O-N 2.95Å; G268-G270 PolarHBondContact O-N 2.89Å; G268-I731 VanDerWaalsContact O-CD1 3.23Å; G268-I731 WeakPolarHBondContact O-CD1 3.45Å
269	L	80.9	Confident	86.7	Confident	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.045	C	C	.	.	S	Bend	trans	-71.1	-9.3	176	-68.2	-173.9	0	0	0	114.3	Y243 Q244 D265 E266 R467 K469 V472 L474	Y243-L269 HydrophobicContact CE2-CB 3.87Å; Y243-L269 HydrophobicContact CE2-CD2 4.1Å; Y243-L269 HydrophobicContact CE2-CG 4.45Å; Y243-L269 WeakPolarHBondContact CE2-O 3.21Å; Y243-L269 PolarHBondContact OH-O 3.16Å; Q244-L269 PolarHBondContact NE2-O 3.09Å; Q244-L269 VanDerWaalsContact NE2-O 3.08Å; D265-L269 HydrophobicContact CB-CB 4.26Å; D265-L269 HydrophobicContact CB-CD1 3.96Å; E266-L269 HydrophobicContact CB-CD1 4.18Å; E266-L269 HydrophobicContact CB-CG 4.42Å; E266-L269 PolarHBondContact O-N 2.98Å; L269-R467 HydrophobicContact CD1-CB 4.02Å; L269-R467 WeakPolarHBondContact CD1-O 3.38Å; L269-K469 HydrophobicContact CD2-CG 4.26Å; L269-V472 HydrophobicContact CD1-CG2 4.43Å; L269-V472 HydrophobicContact CD2-CB 4.41Å; L269-V472 HydrophobicContact CD2-CG1 4.45Å; L269-V472 HydrophobicContact CD2-CG2 4.24Å; L269-L474 HydrophobicContact CD2-CD1 3.5Å
270	G	84.2	Confident	87	Confident	8 Å²	8	7.6 Å²	7.6	8%	0.082	4%	0.043	C	C	.	.			trans	89.6	42.7	175.2	0	0	0	0	0	114.2	G268 T272 I273 Q274	G268-G270 PolarHBondContact O-N 2.89Å; G270-T272 VanDerWaalsContact C-N 3.28Å; G270-T272 PolarHBondContact O-N 3.25Å; G270-I273 WeakPolarHBondContact O-CB 3.38Å; G270-I273 PolarHBondContact O-N 3.24Å; G270-Q274 PolarHBondContact O-N 2.71Å; G270-Q274 VanDerWaalsContact O-N 3.14Å
271	K	89.1	Confident	86.9	Confident	18 Å²	18	7.5 Å²	7.5	8%	0.078	4%	0.042	C	C	.	.	H	α-helix	trans	-51.4	-44.2	174.9	-67.6	-172.3	-77.2	-80.8	0	113	L263 D265 E266 I273 Q274 C275 L398	L263-K271 HydrophobicContact CD2-CB 3.95Å; L263-K271 HydrophobicContact CD2-CD 4.37Å; L263-K271 HydrophobicContact CD2-CG 3.84Å; L263-K271 HydrophobicContact CG-CD 4.26Å; L263-K271 HydrophobicContact CG-CG 4.14Å; D265-K271 HydrophobicContact CB-CD 4.25Å; D265-K271 HydrophobicContact CB-CG 4.02Å; D265-K271 PolarHBondContact O-NZ 3.49Å; E266-K271 PolarHBondContact O-NZ 2.91Å; K271-I273 VanDerWaalsContact C-N 3.29Å; K271-I273 PolarHBondContact O-N 3.42Å; K271-Q274 WeakPolarHBondContact O-CB 3.23Å; K271-Q274 PolarHBondContact O-N 2.9Å; K271-C275 PolarHBondContact O-N 2.96Å; K271-C275 PolarHBondContact O-SG 3.02Å; K271-L398 HydrophobicContact CD-CB 4.44Å
272	T	90.3	Very high	86.9	Confident	17 Å²	17	7.5 Å²	7.5	10%	0.104	4%	0.042	C	C	.	.	H	α-helix	trans	-55	-44.4	175.8	-52.5	0	0	0	0	112.2	G270 C275 I276 W303 E306	G270-T272 VanDerWaalsContact C-N 3.28Å; G270-T272 PolarHBondContact O-N 3.25Å; T272-C275 PolarHBondContact O-N 3.01Å; T272-I276 HydrophobicContact CG2-CD1 3.94Å; T272-I276 VanDerWaalsContact O-CG1 3.28Å; T272-I276 WeakPolarHBondContact O-CG1 3.45Å; T272-I276 PolarHBondContact O-N 3.19Å; T272-W303 HydrophobicContact CG2-CD2 3.72Å; T272-W303 HydrophobicContact CG2-CE3 3.6Å; T272-W303 HydrophobicContact CG2-CG 4.39Å; T272-W303 HydrophobicContact CG2-CH2 4.03Å; T272-W303 HydrophobicContact CG2-CZ2 4.12Å; T272-W303 HydrophobicContact CG2-CZ3 3.77Å; T272-E306 HydrophobicContact CG2-CB 4.19Å; T272-E306 HydrophobicContact CG2-CG 4.22Å
273	I	89.1	Confident	86.7	Confident	29 Å²	29	7.8 Å²	7.8	15%	0.149	4%	0.044	C	C	.	.	H	α-helix	trans	-66.6	-42.7	-179.6	-57.9	176.8	0	0	0	110.3	F235 M240 G270 K271 C275 I276 A277 F310	F235-I273 HydrophobicContact CE2-CG2 3.63Å; F235-I273 HydrophobicContact CZ-CG2 3.51Å; M240-I273 HydrophobicContact CE-CG2 4.27Å; G270-I273 WeakPolarHBondContact O-CB 3.38Å; G270-I273 PolarHBondContact O-N 3.24Å; K271-I273 VanDerWaalsContact C-N 3.29Å; K271-I273 PolarHBondContact O-N 3.42Å; I273-C275 VanDerWaalsContact C-N 3.32Å; I273-C275 PolarHBondContact O-N 2.81Å; I273-I276 PolarHBondContact O-N 2.89Å; I273-A277 WeakPolarHBondContact O-CB 3.45Å; I273-A277 PolarHBondContact O-N 2.98Å; I273-F310 HydrophobicContact CD1-CE2 3.73Å; I273-F310 HydrophobicContact CD1-CZ 3.86Å; I273-F310 HydrophobicContact CG1-CD2 4.26Å; I273-F310 HydrophobicContact CG1-CE2 3.78Å; I273-F310 HydrophobicContact CG1-CZ 4.36Å
274	Q	90.9	Very high	86.4	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.1	-41.8	175.5	-63.5	177	35.6	0	0	111.4	Q244 V248 L263 D265 G270 K271 A277 H278	Q244-Q274 HydrophobicContact CB-CG 4.07Å; Q244-Q274 HydrophobicContact CG-CG 4.36Å; V248-Q274 HydrophobicContact CG2-CB 4.26Å; L263-Q274 HydrophobicContact CD2-CB 4.33Å; D265-Q274 PolarHBondContact OD2-NE2 3.08Å; D265-Q274 VanDerWaalsContact OD2-NE2 3.08Å; G270-Q274 PolarHBondContact O-N 2.71Å; G270-Q274 VanDerWaalsContact O-N 3.14Å; K271-Q274 WeakPolarHBondContact O-CB 3.23Å; K271-Q274 PolarHBondContact O-N 2.9Å; Q274-A277 PolarHBondContact O-N 3.31Å; Q274-H278 WeakPolarHBondContact O-CB 3.23Å; Q274-H278 PolarHBondContact O-N 3.42Å
275	C	92.2	Very high	86.3	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.1	-42.5	176.3	-66.1	0	0	0	0	113.4	K271 T272 I273 A277 H278 I279 W303 I369 L398	K271-C275 PolarHBondContact O-N 2.96Å; K271-C275 PolarHBondContact O-SG 3.02Å; T272-C275 PolarHBondContact O-N 3.01Å; I273-C275 VanDerWaalsContact C-N 3.32Å; I273-C275 PolarHBondContact O-N 2.81Å; C275-A277 VanDerWaalsContact C-N 3.34Å; C275-H278 PolarHBondContact O-N 3.44Å; C275-I279 WeakPolarHBondContact O-CG1 3.5Å; C275-I279 PolarHBondContact O-N 2.96Å; C275-W303 HydrophobicContact CB-CH2 3.73Å; C275-W303 HydrophobicContact CB-CZ3 3.99Å; C275-I369 HydrophobicContact CB-CD1 4.07Å; C275-L398 WeakPolarHBondContact SG-CD2 3.37Å
276	I	91.8	Very high	86.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-44.7	177.2	-67.9	166.8	0	0	0	110	T272 I273 H278 I279 A280 W303 E306 F307 F310 A311	T272-I276 HydrophobicContact CG2-CD1 3.94Å; T272-I276 VanDerWaalsContact O-CG1 3.28Å; T272-I276 WeakPolarHBondContact O-CG1 3.45Å; T272-I276 PolarHBondContact O-N 3.19Å; I273-I276 PolarHBondContact O-N 2.89Å; I276-H278 VanDerWaalsContact C-N 3.32Å; I276-H278 PolarHBondContact O-N 3.27Å; I276-I279 PolarHBondContact O-N 3.1Å; I276-A280 WeakPolarHBondContact O-CB 3.36Å; I276-A280 PolarHBondContact O-N 3.34Å; I276-W303 HydrophobicContact CG1-CZ3 4.32Å; I276-E306 HydrophobicContact CD1-CB 3.61Å; I276-F307 HydrophobicContact CB-CE1 4.31Å; I276-F307 HydrophobicContact CD1-CD1 4.41Å; I276-F307 HydrophobicContact CD1-CD2 4.25Å; I276-F307 HydrophobicContact CD1-CE2 4.49Å; I276-F307 HydrophobicContact CD1-CG 4.2Å; I276-F307 HydrophobicContact CG1-CD1 3.99Å; I276-F307 HydrophobicContact CG1-CD2 4.21Å; I276-F307 HydrophobicContact CG1-CE1 3.79Å; I276-F307 HydrophobicContact CG1-CE2 4.02Å; I276-F307 HydrophobicContact CG1-CG 4.2Å; I276-F307 HydrophobicContact CG1-CZ 3.79Å; I276-F307 HydrophobicContact CG2-CD1 3.99Å; I276-F307 HydrophobicContact CG2-CE1 4.06Å; I276-F310 HydrophobicContact CG2-CB 4.43Å; I276-A311 HydrophobicContact CG2-CB 3.89Å
277	A	90.5	Very high	86.3	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-40.9	174.9	0	0	0	0	0	111.8	P232 F235 M240 V248 I273 Q274 C275 I279 A280 M281	P232-A277 HydrophobicContact CG-CB 4.27Å; P232-A277 VanDerWaalsContact CG-O 3.31Å; P232-A277 WeakPolarHBondContact CG-O 3.45Å; F235-A277 HydrophobicContact CD2-CB 4Å; F235-A277 HydrophobicContact CE2-CB 4.3Å; M240-A277 HydrophobicContact CE-CB 3.77Å; M240-A277 HydrophobicContact SD-CB 3.64Å; V248-A277 HydrophobicContact CG1-CB 4.49Å; V248-A277 HydrophobicContact CG2-CB 3.72Å; I273-A277 WeakPolarHBondContact O-CB 3.45Å; I273-A277 PolarHBondContact O-N 2.98Å; Q274-A277 PolarHBondContact O-N 3.31Å; C275-A277 VanDerWaalsContact C-N 3.34Å; A277-I279 PolarHBondContact O-N 3.42Å; A277-A280 WeakPolarHBondContact O-CB 3.5Å; A277-A280 PolarHBondContact O-N 3.33Å; A277-M281 WeakPolarHBondContact O-CB 2.84Å; A277-M281 PolarHBondContact O-N 2.79Å
278	H	90.6	Very high	86.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-41.2	175.6	-174.3	60.2	0	0	0	112.7	L251 Q274 C275 I276 M281 M282 Y367	L251-H278 VanDerWaalsContact C-CE1 3.46Å; L251-H278 HydrophobicContact CB-CB 4.4Å; L251-H278 HydrophobicContact CD1-CB 4.05Å; L251-H278 PolarHBondContact O-CE1 3.44Å; Q274-H278 WeakPolarHBondContact O-CB 3.23Å; Q274-H278 PolarHBondContact O-N 3.42Å; C275-H278 PolarHBondContact O-N 3.44Å; I276-H278 VanDerWaalsContact C-N 3.32Å; I276-H278 PolarHBondContact O-N 3.27Å; H278-M281 WeakPolarHBondContact ND1-CE 3.48Å; H278-M281 PolarHBondContact O-N 2.83Å; H278-M282 WeakPolarHBondContact O-CG 3.21Å; H278-M282 PolarHBondContact O-N 3.43Å; H278-M282 VanDerWaalsContact O-N 3.08Å; H278-Y367 AromaticContact CD2-CZ 3.73Å; H278-Y367 AromaticContact NE2-CE2 3.73Å; H278-Y367 AromaticContact NE2-CZ 3.57Å; H278-Y367 PolarHBondContact NE2-OH 3.01Å
279	I	90.3	Very high	86.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-45.2	174.1	-67.7	167.1	0	0	0	111.1	C275 I276 A277 M281 M282 V283 F291 F307 I314 V345 I369	C275-I279 WeakPolarHBondContact O-CG1 3.5Å; C275-I279 PolarHBondContact O-N 2.96Å; I276-I279 PolarHBondContact O-N 3.1Å; A277-I279 PolarHBondContact O-N 3.42Å; I279-M281 VanDerWaalsContact C-N 3.29Å; I279-M281 PolarHBondContact O-N 3.36Å; I279-M282 HydrophobicContact CB-CE 4.42Å; I279-M282 HydrophobicContact CG1-CE 3.96Å; I279-M282 WeakPolarHBondContact O-CB 3.34Å; I279-M282 PolarHBondContact O-N 3.39Å; I279-M282 VanDerWaalsContact O-N 3.1Å; I279-V283 HydrophobicContact CG2-CG2 4.45Å; I279-V283 WeakPolarHBondContact O-CG2 3.35Å; I279-V283 PolarHBondContact O-N 3.47Å; I279-F291 HydrophobicContact CG2-CD2 4.04Å; I279-F291 HydrophobicContact CG2-CE2 4.1Å; I279-F291 HydrophobicContact CG2-CG 4.47Å; I279-F307 HydrophobicContact CD1-CE1 4.29Å; I279-F307 HydrophobicContact CD1-CZ 3.83Å; I279-I314 HydrophobicContact CG2-CD1 4.41Å; I279-V345 HydrophobicContact CG2-CG2 4.19Å; I279-I369 HydrophobicContact CD1-CD1 3.78Å; I279-I369 HydrophobicContact CG1-CD1 4.3Å
280	A	88.7	Confident	86.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-55	-46	176.4	0	0	0	0	0	111.8	P232 L234 I276 A277 M282 V283 E284 I314	P232-A280 HydrophobicContact CB-CB 3.94Å; P232-A280 HydrophobicContact CG-CB 4.35Å; L234-A280 HydrophobicContact CB-CB 4.05Å; I276-A280 WeakPolarHBondContact O-CB 3.36Å; I276-A280 PolarHBondContact O-N 3.34Å; A277-A280 WeakPolarHBondContact O-CB 3.5Å; A277-A280 PolarHBondContact O-N 3.33Å; A280-M282 PolarHBondContact O-N 3.14Å; A280-V283 PolarHBondContact O-N 3.25Å; A280-E284 PolarHBondContact O-N 3.29Å; A280-I314 HydrophobicContact CB-CD1 4.01Å
281	M	87.3	Confident	87.1	Confident	18 Å²	18	26.4 Å²	26.4	9%	0.089	13%	0.129	C	C	.	.	H	α-helix	trans	-61.1	-40.6	175.3	-176.7	-158.7	70.2	0	0	112.8	P232 R252 W255 A277 H278 I279 V283 E284 K285	P232-M281 HydrophobicContact CG-CB 4.03Å; R252-M281 HydrophobicContact CB-CE 3.73Å; R252-M281 HydrophobicContact CB-SD 3.64Å; R252-M281 VanDerWaalsContact CD-SD 3.55Å; R252-M281 HydrophobicContact CG-CE 3.72Å; R252-M281 HydrophobicContact CG-SD 3.54Å; R252-M281 VanDerWaalsContact CG-SD 3.54Å; W255-M281 HydrophobicContact CE3-CE 4.21Å; A277-M281 WeakPolarHBondContact O-CB 2.84Å; A277-M281 PolarHBondContact O-N 2.79Å; H278-M281 WeakPolarHBondContact ND1-CE 3.48Å; H278-M281 PolarHBondContact O-N 2.83Å; I279-M281 VanDerWaalsContact C-N 3.29Å; I279-M281 PolarHBondContact O-N 3.36Å; M281-V283 VanDerWaalsContact C-N 3.33Å; M281-E284 PolarHBondContact O-N 3.38Å; M281-K285 PolarHBondContact O-N 2.91Å; M281-K285 VanDerWaalsContact O-N 3.1Å
282	M	87.5	Confident	87.2	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-39.3	176.6	-75	-172.4	-77.2	0	0	111.9	W255 H278 I279 A280 K285 K286 V287 F291 Y367	W255-M282 HydrophobicContact CD2-CG 4.13Å; W255-M282 HydrophobicContact CD2-SD 4.24Å; W255-M282 HydrophobicContact CE3-CG 4.48Å; W255-M282 HydrophobicContact CG-SD 4.17Å; W255-M282 HydrophobicContact CZ2-CG 4.32Å; H278-M282 WeakPolarHBondContact O-CG 3.21Å; H278-M282 PolarHBondContact O-N 3.43Å; H278-M282 VanDerWaalsContact O-N 3.08Å; I279-M282 HydrophobicContact CB-CE 4.42Å; I279-M282 HydrophobicContact CG1-CE 3.96Å; I279-M282 WeakPolarHBondContact O-CB 3.34Å; I279-M282 PolarHBondContact O-N 3.39Å; I279-M282 VanDerWaalsContact O-N 3.1Å; A280-M282 PolarHBondContact O-N 3.14Å; M282-K285 CarbonylContact O-C 3.55Å; M282-K285 PolarHBondContact O-N 2.79Å; M282-K286 PolarHBondContact O-N 2.66Å; M282-V287 HydrophobicContact CB-CB 4.3Å; M282-V287 WeakPolarHBondContact O-CB 3.36Å; M282-V287 PolarHBondContact O-N 2.66Å; M282-F291 HydrophobicContact CB-CZ 4.17Å; M282-F291 HydrophobicContact CE-CD1 4.42Å; M282-F291 HydrophobicContact CE-CE1 3.88Å; M282-F291 HydrophobicContact CE-CZ 4.49Å; M282-F291 HydrophobicContact SD-CE1 4.03Å; M282-Y367 HydrophobicContact CE-CD1 4.19Å; M282-Y367 HydrophobicContact CE-CD2 4.12Å; M282-Y367 HydrophobicContact CE-CE2 4.5Å; M282-Y367 HydrophobicContact CE-CG 3.98Å; M282-Y367 HydrophobicContact SD-CD2 4.08Å; M282-Y367 HydrophobicContact SD-CG 4.42Å
283	V	85.4	Confident	87.4	Confident	11 Å²	11	24.8 Å²	24.8	7%	0.067	12%	0.121	C	C	.	.	H	α-helix	trans	-64.4	-41.1	176.1	174.2	0	0	0	0	110.9	L234 I279 A280 M281 K285 K286 F291 L340 M342	L234-V283 HydrophobicContact CD1-CB 3.94Å; L234-V283 HydrophobicContact CD1-CG1 3.63Å; I279-V283 HydrophobicContact CG2-CG2 4.45Å; I279-V283 WeakPolarHBondContact O-CG2 3.35Å; I279-V283 PolarHBondContact O-N 3.47Å; A280-V283 PolarHBondContact O-N 3.25Å; M281-V283 VanDerWaalsContact C-N 3.33Å; V283-K285 VanDerWaalsContact C-N 3.26Å; V283-K285 PolarHBondContact O-N 3.2Å; V283-K286 WeakPolarHBondContact O-CA 3.19Å; V283-K286 PolarHBondContact O-N 3.46Å; V283-F291 HydrophobicContact CG2-CE2 4.04Å; V283-L340 HydrophobicContact CG1-CD1 4.24Å; V283-M342 HydrophobicContact CB-CE 4.48Å; V283-M342 HydrophobicContact CG1-CE 3.54Å; V283-M342 HydrophobicContact CG2-CE 4.07Å; V283-M342 HydrophobicContact CG2-SD 4.13Å
284	E	83.5	Confident	87.5	Confident	71 Å²	71	23.4 Å²	23.4	33%	0.332	11%	0.114	S	C	.	.	H	α-helix	trans	-60.5	-36	173.9	-74.6	167.3	-155.3	0	0	112.5	P232 Q233 L234 A280 M281 K286	P232-E284 VanDerWaalsContact C-OE1 3.32Å; P232-E284 VanDerWaalsContact CB-OE1 3.26Å; P232-E284 WeakPolarHBondContact CB-OE1 3.32Å; Q233-E284 VanDerWaalsContact CA-OE1 3.3Å; Q233-E284 WeakPolarHBondContact CA-OE1 3.2Å; Q233-E284 WeakPolarHBondContact CB-OE1 3.4Å; Q233-E284 PolarHBondContact N-OE1 2.86Å; Q233-E284 PolarHBondContact N-OE2 3.46Å; L234-E284 HydrophobicContact CD1-CG 3.94Å; L234-E284 HydrophobicContact CG-CG 3.98Å; L234-E284 PolarHBondContact N-OE1 2.89Å; A280-E284 PolarHBondContact O-N 3.29Å; M281-E284 PolarHBondContact O-N 3.38Å; E284-K286 PolarHBondContact O-N 2.6Å; E284-K286 VanDerWaalsContact O-N 3.14Å
285	K	83.6	Confident	87.4	Confident	85 Å²	85	23.4 Å²	23.4	37%	0.37	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	12.8	172.1	-68.4	-172.7	175.6	-155.1	0	113.8	W255 E256 M281 M282 V283	W255-K285 HydrophobicContact CH2-CB 4.29Å; W255-K285 HydrophobicContact CH2-CD 3.85Å; W255-K285 HydrophobicContact CZ3-CD 3.53Å; E256-K285 IonicContact OE1-NZ 3.12Å; E256-K285 PolarHBondContact OE1-NZ 2.86Å; M281-K285 PolarHBondContact O-N 2.91Å; M281-K285 VanDerWaalsContact O-N 3.1Å; M282-K285 CarbonylContact O-C 3.55Å; M282-K285 PolarHBondContact O-N 2.79Å; V283-K285 VanDerWaalsContact C-N 3.26Å; V283-K285 PolarHBondContact O-N 3.2Å
286	K	81.8	Confident	87.1	Confident	178 Å²	178	23.5 Å²	23.5	77%	0.774	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.9	25.5	178.1	-53.5	-178.6	177.7	-179.5	0	114.8	M282 V283 E284 M288	M282-K286 PolarHBondContact O-N 2.66Å; V283-K286 WeakPolarHBondContact O-CA 3.19Å; V283-K286 PolarHBondContact O-N 3.46Å; E284-K286 PolarHBondContact O-N 2.6Å; E284-K286 VanDerWaalsContact O-N 3.14Å; K286-M288 PolarHBondContact O-N 2.75Å
287	V	82.3	Confident	86.5	Confident	34 Å²	34	27.6 Å²	27.6	21%	0.206	14%	0.136	C	C	.	.			trans	-87.5	103.6	169.8	-174.9	0	0	0	0	108.9	W255 M282 G289 F291 K366	W255-V287 HydrophobicContact CH2-CG2 4.26Å; W255-V287 HydrophobicContact CZ2-CG2 3.77Å; M282-V287 HydrophobicContact CB-CB 4.3Å; M282-V287 WeakPolarHBondContact O-CB 3.36Å; M282-V287 PolarHBondContact O-N 2.66Å; V287-G289 VanDerWaalsContact C-N 3.28Å; V287-G289 PolarHBondContact O-N 2.83Å; V287-F291 HydrophobicContact CB-CZ 4.45Å; V287-F291 HydrophobicContact CG1-CE1 4.28Å; V287-F291 HydrophobicContact CG1-CZ 3.97Å; V287-K366 HydrophobicContact CG1-CB 4.45Å; V287-K366 HydrophobicContact CG1-CG 4.41Å
288	M	78.1	Confident	85.8	Confident	62 Å²	62	28.4 Å²	28.4	31%	0.305	14%	0.142	S	C	.	.			trans	-88.2	17.3	-169.7	-53.3	-54.2	-78.2	0	0	114.3	K286 L340 N341 M342 F343	K286-M288 PolarHBondContact O-N 2.75Å; M288-L340 WeakPolarHBondContact CE-O 3.35Å; M288-N341 WeakPolarHBondContact CE-O 3.14Å; M288-M342 HydrophobicContact CB-CB 4.25Å; M288-M342 HydrophobicContact CE-CB 3.65Å; M288-F343 WeakPolarHBondContact O-CB 3.37Å; M288-F343 WeakPolarHBondContact O-CD2 3.43Å; M288-F343 PolarHBondContact O-N 2.99Å
289	G	76.9	Confident	85.4	Confident	11 Å²	11	28.7 Å²	28.7	11%	0.113	14%	0.143	C	C	.	.			trans	83.3	-165.8	-179.3	0	0	0	0	0	114.5	V287	V287-G289 VanDerWaalsContact C-N 3.28Å; V287-G289 PolarHBondContact O-N 2.83Å
290	P	87.4	Confident	85.1	Confident	17 Å²	17	28.9 Å²	28.9	11%	0.11	14%	0.144	C	C	.	.			cis	-80.3	145.9	4.8	32.5	-35.1	0	0	0	113.3	F343 Q364 W365 K366	P290-F343 HydrophobicContact CB-CB 3.98Å; P290-Q364 WeakPolarHBondContact CD-O 3.5Å; P290-Q364 VanDerWaalsContact CG-O 3.31Å; P290-Q364 WeakPolarHBondContact CG-O 3.22Å; P290-W365 HydrophobicContact CB-CE3 3.8Å; P290-W365 HydrophobicContact CB-CZ3 3.8Å; P290-W365 HydrophobicContact CG-CE3 3.98Å; P290-W365 HydrophobicContact CG-CZ3 4.37Å; P290-K366 PolarHBondContact O-N 3.39Å
291	F	91.3	Very high	84.8	Confident	2 Å²	2	30 Å²	30	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.5	177.8	-57.8	-69.3	0	0	0	110.3	I279 M282 V283 V287 V345 V346 K366	I279-F291 HydrophobicContact CG2-CD2 4.04Å; I279-F291 HydrophobicContact CG2-CE2 4.1Å; I279-F291 HydrophobicContact CG2-CG 4.47Å; M282-F291 HydrophobicContact CB-CZ 4.17Å; M282-F291 HydrophobicContact CE-CD1 4.42Å; M282-F291 HydrophobicContact CE-CE1 3.88Å; M282-F291 HydrophobicContact CE-CZ 4.49Å; M282-F291 HydrophobicContact SD-CE1 4.03Å; V283-F291 HydrophobicContact CG2-CE2 4.04Å; V287-F291 HydrophobicContact CB-CZ 4.45Å; V287-F291 HydrophobicContact CG1-CE1 4.28Å; V287-F291 HydrophobicContact CG1-CZ 3.97Å; F291-V345 HydrophobicContact CB-CG1 4.25Å; F291-V345 HydrophobicContact CB-CG2 4.27Å; F291-V345 HydrophobicContact CD2-CG2 4.04Å; F291-V346 PolarHBondContact O-N 3.29Å; F291-K366 HydrophobicContact CE1-CB 4.31Å
292	L	92	Very high	84.7	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.2	179.6	-175.9	56.5	0	0	0	110.8	V294 V346 T348 W365 Y367 L368 I369 L390	L292-V294 HydrophobicContact CD1-CG2 4.46Å; L292-V294 HydrophobicContact CD2-CG2 4.25Å; L292-V294 HydrophobicContact CG-CG2 4.01Å; L292-V346 HydrophobicContact CD1-CB 4.21Å; L292-V346 HydrophobicContact CD1-CG1 4.11Å; L292-T348 HydrophobicContact CD1-CG2 3.82Å; L292-W365 HydrophobicContact CB-CD2 3.8Å; L292-W365 HydrophobicContact CB-CE3 3.51Å; L292-W365 HydrophobicContact CB-CG 4.37Å; L292-W365 HydrophobicContact CB-CH2 4.31Å; L292-W365 HydrophobicContact CB-CZ3 3.77Å; L292-W365 HydrophobicContact CD1-CH2 4.08Å; L292-W365 HydrophobicContact CD1-CZ2 4.38Å; L292-W365 HydrophobicContact CD1-CZ3 4.28Å; L292-W365 HydrophobicContact CD2-CD2 4.14Å; L292-W365 HydrophobicContact CD2-CZ2 4.19Å; L292-W365 HydrophobicContact CG-CE3 4.49Å; L292-W365 HydrophobicContact CG-CZ3 4.48Å; L292-Y367 PolarHBondContact N-O 3.15Å; L292-L368 HydrophobicContact CB-CD1 4.05Å; L292-L368 HydrophobicContact CD2-CD1 3.83Å; L292-L368 HydrophobicContact CG-CD1 3.84Å; L292-L368 WeakPolarHBondContact O-CA 3.46Å; L292-I369 PolarHBondContact O-N 3.04Å; L292-L390 HydrophobicContact CD2-CD1 4Å
293	V	93.5	Very high	84.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.6	171.3	-175.8	0	0	0	0	108.5	W303 V345 V346 I347 T348 I369	V293-W303 HydrophobicContact CG1-CD2 4.06Å; V293-W303 HydrophobicContact CG1-CE3 4.11Å; V293-W303 HydrophobicContact CG1-CH2 4.37Å; V293-W303 HydrophobicContact CG1-CZ2 4.33Å; V293-W303 HydrophobicContact CG1-CZ3 4.26Å; V293-V345 HydrophobicContact CG2-CG1 4.1Å; V293-V346 PolarHBondContact N-O 3.23Å; V293-I347 HydrophobicContact CB-CG1 4.23Å; V293-I347 WeakPolarHBondContact O-CA 3.16Å; V293-T348 PolarHBondContact O-N 3.24Å; V293-I369 WeakPolarHBondContact CA-O 3.45Å; V293-I369 HydrophobicContact CG1-CB 4.48Å; V293-I369 HydrophobicContact CG2-CB 4.33Å; V293-I369 HydrophobicContact CG2-CD1 4.36Å
294	V	91.7	Very high	84.8	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.3	174.9	-174	0	0	0	0	108.2	L292 T348 F350 L368 I369 V370 D371 L387	L292-V294 HydrophobicContact CD1-CG2 4.46Å; L292-V294 HydrophobicContact CD2-CG2 4.25Å; L292-V294 HydrophobicContact CG-CG2 4.01Å; V294-T348 WeakPolarHBondContact CA-O 3.25Å; V294-T348 HydrophobicContact CB-CG2 4.44Å; V294-T348 HydrophobicContact CG1-CG2 4.49Å; V294-T348 HydrophobicContact CG2-CG2 3.88Å; V294-F350 HydrophobicContact CG1-CD1 3.45Å; V294-F350 VanDerWaalsContact CG1-CD1 3.45Å; V294-F350 HydrophobicContact CG1-CE1 3.78Å; V294-F350 HydrophobicContact CG1-CG 4.11Å; V294-L368 HydrophobicContact CG2-CD1 3.86Å; V294-I369 PolarHBondContact N-O 3.15Å; V294-V370 HydrophobicContact CB-CG1 4.49Å; V294-V370 WeakPolarHBondContact O-CA 3.27Å; V294-D371 PolarHBondContact O-N 2.82Å; V294-L387 HydrophobicContact CG2-CD2 4.19Å
295	A	89.6	Confident	84.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	161.6	-176.7	0	0	0	0	0	112	V300 T348 S349 D371	A295-V300 HydrophobicContact CB-CG2 4.11Å; A295-T348 PolarHBondContact N-O 3.37Å; A295-S349 VanDerWaalsContact O-CA 3.3Å; A295-S349 WeakPolarHBondContact O-CA 3.44Å; A295-D371 HydrophobicContact CB-CB 3.9Å
296	P	84.6	Confident	85.2	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.013	16%	0.155	C	C	.	.			trans	-54.8	144.4	168.1	-19.2	24.3	0	0	0	112	S298 T299 V300 F350 E372 L699	P296-S298 WeakPolarHBondContact CB-OG 3.17Å; P296-S298 PolarHBondContact O-N 3.37Å; P296-T299 HydrophobicContact CB-CG2 4.34Å; P296-T299 WeakPolarHBondContact CD-OG1 3.26Å; P296-T299 HydrophobicContact CG-CG2 4.29Å; P296-T299 PolarHBondContact O-N 3.49Å; P296-T299 PolarHBondContact O-OG1 2.9Å; P296-V300 WeakPolarHBondContact O-CG2 3.49Å; P296-V300 PolarHBondContact O-N 3.29Å; P296-V300 VanDerWaalsContact O-N 3.16Å; P296-F350 HydrophobicContact CB-CE2 4.19Å; P296-F350 VanDerWaalsContact CD-CE2 3.46Å; P296-F350 HydrophobicContact CG-CE2 3.75Å; P296-F350 VanDerWaalsContact N-CE2 3.28Å; P296-E372 HydrophobicContact CG-CB 3.91Å; P296-E372 HydrophobicContact CG-CG 3.78Å; P296-L699 HydrophobicContact CB-CD2 4.01Å; P296-L699 HydrophobicContact CG-CD2 4.45Å
297	L	80.8	Confident	85.5	Confident	86 Å²	86	20.4 Å²	20.4	45%	0.45	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.5	-179.7	-177.3	62.6	0	0	0	112.9	P301 H320	L297-P301 WeakPolarHBondContact O-CD 3.12Å; L297-H320 WeakPolarHBondContact CD1-CE1 3.42Å
298	S	75.6	Confident	85.8	Confident	17 Å²	17	26 Å²	26	12%	0.119	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-30.1	176.1	52.9	0	0	0	0	115	P296 L699	P296-S298 WeakPolarHBondContact CB-OG 3.17Å; P296-S298 PolarHBondContact O-N 3.37Å; S298-L699 VanDerWaalsContact OG-CB 3.28Å; S298-L699 WeakPolarHBondContact OG-CB 3.43Å
299	T	81.1	Confident	86.2	Confident	6 Å²	6	30.7 Å²	30.7	4%	0.037	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-17.2	-174.7	67.8	0	0	0	0	112.6	P296 P301 N302 W303	P296-T299 HydrophobicContact CB-CG2 4.34Å; P296-T299 WeakPolarHBondContact CD-OG1 3.26Å; P296-T299 HydrophobicContact CG-CG2 4.29Å; P296-T299 PolarHBondContact O-N 3.49Å; P296-T299 PolarHBondContact O-OG1 2.9Å; T299-P301 VanDerWaalsContact C-CD 3.47Å; T299-P301 VanDerWaalsContact C-N 3.32Å; T299-N302 WeakPolarHBondContact O-CA 3.27Å; T299-N302 VanDerWaalsContact O-CB 3.29Å; T299-N302 WeakPolarHBondContact O-CB 3.36Å; T299-N302 PolarHBondContact O-N 2.79Å; T299-W303 VanDerWaalsContact O-CD1 3.27Å; T299-W303 PolarHBondContact O-N 2.62Å
300	V	85.3	Confident	86.6	Confident	4 Å²	4	31 Å²	31	2%	0.024	15%	0.152	C	C	.	.	H	α-helix	trans	-48.4	-45.7	174.7	165.9	0	0	0	0	113.1	A295 P296 N302 W303 I304 L318 I347	A295-V300 HydrophobicContact CB-CG2 4.11Å; P296-V300 WeakPolarHBondContact O-CG2 3.49Å; P296-V300 PolarHBondContact O-N 3.29Å; P296-V300 VanDerWaalsContact O-N 3.16Å; V300-N302 PolarHBondContact O-N 2.95Å; V300-W303 WeakPolarHBondContact O-CB 3.29Å; V300-W303 PolarHBondContact O-N 3.48Å; V300-I304 HydrophobicContact CG1-CD1 4.18Å; V300-I304 WeakPolarHBondContact O-CG1 3.46Å; V300-I304 PolarHBondContact O-N 2.97Å; V300-I304 VanDerWaalsContact O-N 3.11Å; V300-L318 HydrophobicContact CG1-CD1 3.29Å; V300-I347 HydrophobicContact CB-CG2 4.38Å; V300-I347 HydrophobicContact CG1-CG2 3.93Å; V300-I347 HydrophobicContact CG2-CG2 4.15Å
301	P	81.9	Confident	86.5	Confident	24 Å²	24	30.2 Å²	30.2	16%	0.156	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-40.7	175.3	-23.8	34.3	0	0	0	113.9	L297 T299 W303 I304 S305 Y671	L297-P301 WeakPolarHBondContact O-CD 3.12Å; T299-P301 VanDerWaalsContact C-CD 3.47Å; T299-P301 VanDerWaalsContact C-N 3.32Å; P301-W303 VanDerWaalsContact C-N 3.33Å; P301-W303 PolarHBondContact O-N 2.91Å; P301-I304 PolarHBondContact O-N 3Å; P301-S305 PolarHBondContact O-N 3.28Å; P301-S305 PolarHBondContact O-OG 3.02Å; P301-Y671 HydrophobicContact CB-CE2 3.63Å; P301-Y671 VanDerWaalsContact CB-OH 3.27Å; P301-Y671 WeakPolarHBondContact CB-OH 3.31Å; P301-Y671 HydrophobicContact CG-CD2 3.82Å; P301-Y671 HydrophobicContact CG-CE1 4.36Å; P301-Y671 HydrophobicContact CG-CE2 3.13Å; P301-Y671 VanDerWaalsContact CG-CZ 3.45Å
302	N	84.6	Confident	86.2	Confident	42 Å²	42	33.8 Å²	33.8	23%	0.225	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-48.9	176.3	-172.8	82	0	0	0	109.4	T299 V300 I304 S305 E306	T299-N302 WeakPolarHBondContact O-CA 3.27Å; T299-N302 VanDerWaalsContact O-CB 3.29Å; T299-N302 WeakPolarHBondContact O-CB 3.36Å; T299-N302 PolarHBondContact O-N 2.79Å; V300-N302 PolarHBondContact O-N 2.95Å; N302-I304 VanDerWaalsContact C-N 3.32Å; N302-I304 PolarHBondContact O-N 3.04Å; N302-S305 WeakPolarHBondContact CA-OG 3.42Å; N302-S305 PolarHBondContact O-N 3.33Å; N302-S305 VanDerWaalsContact O-N 3.16Å; N302-S305 PolarHBondContact O-OG 2.95Å; N302-E306 WeakPolarHBondContact O-CB 3.37Å; N302-E306 WeakPolarHBondContact O-CG 3.36Å; N302-E306 PolarHBondContact O-N 3.13Å
303	W	88.9	Confident	85.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-52.4	-47.6	174.7	-80.5	95.8	0	0	0	112.4	T272 C275 I276 V293 T299 V300 P301 S305 E306 F307 I347 I369 D371 L398	T272-W303 HydrophobicContact CG2-CD2 3.72Å; T272-W303 HydrophobicContact CG2-CE3 3.6Å; T272-W303 HydrophobicContact CG2-CG 4.39Å; T272-W303 HydrophobicContact CG2-CH2 4.03Å; T272-W303 HydrophobicContact CG2-CZ2 4.12Å; T272-W303 HydrophobicContact CG2-CZ3 3.77Å; C275-W303 HydrophobicContact CB-CH2 3.73Å; C275-W303 HydrophobicContact CB-CZ3 3.99Å; I276-W303 HydrophobicContact CG1-CZ3 4.32Å; V293-W303 HydrophobicContact CG1-CD2 4.06Å; V293-W303 HydrophobicContact CG1-CE3 4.11Å; V293-W303 HydrophobicContact CG1-CH2 4.37Å; V293-W303 HydrophobicContact CG1-CZ2 4.33Å; V293-W303 HydrophobicContact CG1-CZ3 4.26Å; T299-W303 VanDerWaalsContact O-CD1 3.27Å; T299-W303 PolarHBondContact O-N 2.62Å; V300-W303 WeakPolarHBondContact O-CB 3.29Å; V300-W303 PolarHBondContact O-N 3.48Å; P301-W303 VanDerWaalsContact C-N 3.33Å; P301-W303 PolarHBondContact O-N 2.91Å; W303-S305 PolarHBondContact O-N 3.26Å; W303-E306 PolarHBondContact O-N 2.98Å; W303-F307 HydrophobicContact CE3-CD2 4.4Å; W303-F307 AromaticContact CE3-CE2 3.76Å; W303-F307 HydrophobicContact CE3-CE2 3.76Å; W303-F307 HydrophobicContact CZ3-CE2 4.29Å; W303-F307 WeakPolarHBondContact O-CD2 3.46Å; W303-F307 PolarHBondContact O-N 3.09Å; W303-I347 HydrophobicContact CB-CD1 4.06Å; W303-I347 HydrophobicContact CB-CG2 4.35Å; W303-I369 HydrophobicContact CH2-CG2 4.36Å; W303-D371 HydrophobicContact CZ2-CB 4.26Å; W303-D371 PolarHBondContact NE1-OD2 2.88Å; W303-L398 HydrophobicContact CH2-CD1 3.87Å; W303-L398 HydrophobicContact CZ2-CD1 3.68Å
304	I	87.3	Confident	85.3	Confident	30 Å²	30	38.4 Å²	38.4	15%	0.154	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-45.6	178.7	-63.3	161.8	0	0	0	111.6	V300 P301 N302 E306 F307 K308 L318 I347	V300-I304 HydrophobicContact CG1-CD1 4.18Å; V300-I304 WeakPolarHBondContact O-CG1 3.46Å; V300-I304 PolarHBondContact O-N 2.97Å; V300-I304 VanDerWaalsContact O-N 3.11Å; P301-I304 PolarHBondContact O-N 3Å; N302-I304 VanDerWaalsContact C-N 3.32Å; N302-I304 PolarHBondContact O-N 3.04Å; I304-E306 VanDerWaalsContact C-N 3.3Å; I304-E306 PolarHBondContact O-N 3.36Å; I304-F307 PolarHBondContact O-N 3.15Å; I304-K308 HydrophobicContact CG2-CD 4.25Å; I304-K308 WeakPolarHBondContact O-CG 2.98Å; I304-K308 PolarHBondContact O-N 3.43Å; I304-L318 HydrophobicContact CD1-CB 3.82Å; I304-L318 HydrophobicContact CD1-CD1 4.06Å; I304-L318 HydrophobicContact CD1-CD2 3.8Å; I304-L318 HydrophobicContact CD1-CG 4.09Å; I304-I347 HydrophobicContact CG1-CD1 3.85Å
305	S	85.5	Confident	84.8	Confident	58 Å²	58	39.6 Å²	39.6	41%	0.406	20%	0.201	S	C	.	.	H	α-helix	trans	-62.8	-38.8	179.3	68.3	0	0	0	0	111.9	P301 N302 W303 K308 R309	P301-S305 PolarHBondContact O-N 3.28Å; P301-S305 PolarHBondContact O-OG 3.02Å; N302-S305 WeakPolarHBondContact CA-OG 3.42Å; N302-S305 PolarHBondContact O-N 3.33Å; N302-S305 VanDerWaalsContact O-N 3.16Å; N302-S305 PolarHBondContact O-OG 2.95Å; W303-S305 PolarHBondContact O-N 3.26Å; S305-K308 PolarHBondContact O-N 3.08Å; S305-R309 VanDerWaalsContact O-CB 3.28Å; S305-R309 WeakPolarHBondContact O-CB 3.36Å; S305-R309 PolarHBondContact O-N 3.18Å
306	E	88.4	Confident	84.7	Confident	30 Å²	30	41.7 Å²	41.7	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-72.2	-37.9	179.3	-62.7	-68.5	-159.1	0	0	111.6	T272 I276 N302 W303 I304 R309 F310	T272-E306 HydrophobicContact CG2-CB 4.19Å; T272-E306 HydrophobicContact CG2-CG 4.22Å; I276-E306 HydrophobicContact CD1-CB 3.61Å; N302-E306 WeakPolarHBondContact O-CB 3.37Å; N302-E306 WeakPolarHBondContact O-CG 3.36Å; N302-E306 PolarHBondContact O-N 3.13Å; W303-E306 PolarHBondContact O-N 2.98Å; I304-E306 VanDerWaalsContact C-N 3.3Å; I304-E306 PolarHBondContact O-N 3.36Å; E306-R309 PolarHBondContact O-N 3.11Å; E306-F310 HydrophobicContact CB-CD2 4.25Å; E306-F310 WeakPolarHBondContact O-CB 3.47Å; E306-F310 WeakPolarHBondContact O-CD2 3.41Å; E306-F310 PolarHBondContact O-N 3.16Å; E306-F310 WeakPolarHBondContact OE2-CD2 3.48Å; E306-F310 WeakPolarHBondContact OE2-CE2 3.2Å
307	F	89.6	Confident	84.8	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-47	171.2	-89	-73.4	0	0	0	111.7	I276 I279 W303 I304 R309 A311 V316 V345 I347	I276-F307 HydrophobicContact CB-CE1 4.31Å; I276-F307 HydrophobicContact CD1-CD1 4.41Å; I276-F307 HydrophobicContact CD1-CD2 4.25Å; I276-F307 HydrophobicContact CD1-CE2 4.49Å; I276-F307 HydrophobicContact CD1-CG 4.2Å; I276-F307 HydrophobicContact CG1-CD1 3.99Å; I276-F307 HydrophobicContact CG1-CD2 4.21Å; I276-F307 HydrophobicContact CG1-CE1 3.79Å; I276-F307 HydrophobicContact CG1-CE2 4.02Å; I276-F307 HydrophobicContact CG1-CG 4.2Å; I276-F307 HydrophobicContact CG1-CZ 3.79Å; I276-F307 HydrophobicContact CG2-CD1 3.99Å; I276-F307 HydrophobicContact CG2-CE1 4.06Å; I279-F307 HydrophobicContact CD1-CE1 4.29Å; I279-F307 HydrophobicContact CD1-CZ 3.83Å; W303-F307 HydrophobicContact CE3-CD2 4.4Å; W303-F307 AromaticContact CE3-CE2 3.76Å; W303-F307 HydrophobicContact CE3-CE2 3.76Å; W303-F307 HydrophobicContact CZ3-CE2 4.29Å; W303-F307 WeakPolarHBondContact O-CD2 3.46Å; W303-F307 PolarHBondContact O-N 3.09Å; I304-F307 PolarHBondContact O-N 3.15Å; F307-R309 VanDerWaalsContact C-N 3.26Å; F307-R309 PolarHBondContact O-N 3.21Å; F307-A311 CarbonylContact O-C 3.54Å; F307-A311 WeakPolarHBondContact O-CA 3.39Å; F307-A311 PolarHBondContact O-N 3.18Å; F307-A311 VanDerWaalsContact O-O 3.12Å; F307-V316 HydrophobicContact CB-CB 4.48Å; F307-V316 HydrophobicContact CB-CG1 4.47Å; F307-V316 HydrophobicContact CB-CG2 3.68Å; F307-V316 HydrophobicContact CD1-CG2 3.74Å; F307-V316 HydrophobicContact CD2-CG1 4.36Å; F307-V316 HydrophobicContact CD2-CG2 4.25Å; F307-V316 HydrophobicContact CE1-CG2 4.4Å; F307-V316 HydrophobicContact CG-CG1 4.47Å; F307-V316 HydrophobicContact CG-CG2 3.66Å; F307-V345 HydrophobicContact CE1-CG1 4.48Å; F307-V345 HydrophobicContact CE2-CG1 4.34Å; F307-V345 HydrophobicContact CZ-CG1 3.93Å; F307-I347 HydrophobicContact CD2-CD1 3.74Å; F307-I347 HydrophobicContact CE2-CD1 3.89Å; F307-I347 HydrophobicContact CE2-CG1 4.46Å
308	K	88.1	Confident	85.2	Confident	152 Å²	152	41.5 Å²	41.5	66%	0.661	21%	0.212	S	C	*	.	H	α-helix	trans	-61	-35.9	176.9	-74.1	179.6	178.6	-177.3	0	112.6	I304 S305	I304-K308 HydrophobicContact CG2-CD 4.25Å; I304-K308 WeakPolarHBondContact O-CG 2.98Å; I304-K308 PolarHBondContact O-N 3.43Å; S305-K308 PolarHBondContact O-N 3.08Å
309	R	85.8	Confident	85.7	Confident	161 Å²	161	40.9 Å²	40.9	61%	0.608	21%	0.207	S	C	*	.	H	α-helix	trans	-76.6	-49.9	-179.3	-177.5	-178.3	-178.8	175.8	3.7	112.5	G237 S305 E306 F307	G237-R309 VanDerWaalsContact CA-O 3.27Å; G237-R309 WeakPolarHBondContact CA-O 3.28Å; S305-R309 VanDerWaalsContact O-CB 3.28Å; S305-R309 WeakPolarHBondContact O-CB 3.36Å; S305-R309 PolarHBondContact O-N 3.18Å; E306-R309 PolarHBondContact O-N 3.11Å; F307-R309 VanDerWaalsContact C-N 3.26Å; F307-R309 PolarHBondContact O-N 3.21Å
310	F	85.6	Confident	85.8	Confident	17 Å²	17	44.2 Å²	44.2	8%	0.075	22%	0.222	C	C	.	.	H	α-helix	trans	-94.4	-27.9	-168.7	-71.1	-63.2	0	0	0	114.2	F235 T236 G237 I273 I276 E306	F235-F310 CarbonylContact C-O 3.6Å; F235-F310 WeakPolarHBondContact CA-O 3.37Å; F235-F310 HydrophobicContact CD2-CB 4.13Å; F235-F310 HydrophobicContact CE1-CB 4.48Å; F235-F310 AromaticContact CE1-CD1 3.6Å; F235-F310 HydrophobicContact CE1-CD1 3.6Å; F235-F310 HydrophobicContact CE1-CE1 4.21Å; F235-F310 HydrophobicContact CE1-CG 4.34Å; F235-F310 HydrophobicContact CE2-CB 3.63Å; F235-F310 AromaticContact CE2-CD1 3.97Å; F235-F310 HydrophobicContact CE2-CD1 3.97Å; F235-F310 AromaticContact CE2-CG 3.89Å; F235-F310 HydrophobicContact CE2-CG 3.89Å; F235-F310 HydrophobicContact CZ-CB 3.85Å; F235-F310 AromaticContact CZ-CD1 3.25Å; F235-F310 HydrophobicContact CZ-CD1 3.25Å; F235-F310 AromaticContact CZ-CE1 3.87Å; F235-F310 HydrophobicContact CZ-CE1 3.87Å; F235-F310 AromaticContact CZ-CG 3.64Å; F235-F310 HydrophobicContact CZ-CG 3.64Å; T236-F310 PolarHBondContact N-O 3.08Å; G237-F310 PolarHBondContact N-O 2.84Å; G237-F310 WeakPolarHBondContact O-CE1 3.31Å; I273-F310 HydrophobicContact CD1-CE2 3.73Å; I273-F310 HydrophobicContact CD1-CZ 3.86Å; I273-F310 HydrophobicContact CG1-CD2 4.26Å; I273-F310 HydrophobicContact CG1-CE2 3.78Å; I273-F310 HydrophobicContact CG1-CZ 4.36Å; I276-F310 HydrophobicContact CG2-CB 4.43Å; E306-F310 HydrophobicContact CB-CD2 4.25Å; E306-F310 WeakPolarHBondContact O-CB 3.47Å; E306-F310 WeakPolarHBondContact O-CD2 3.41Å; E306-F310 PolarHBondContact O-N 3.16Å; E306-F310 WeakPolarHBondContact OE2-CD2 3.48Å; E306-F310 WeakPolarHBondContact OE2-CE2 3.2Å
311	A	86.4	Confident	85.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	23%	0.232	C	C	.	.			trans	-141.5	68.1	-178.8	0	0	0	0	0	111.5	I276 F307 E313 I314	I276-A311 HydrophobicContact CG2-CB 3.89Å; F307-A311 CarbonylContact O-C 3.54Å; F307-A311 WeakPolarHBondContact O-CA 3.39Å; F307-A311 PolarHBondContact O-N 3.18Å; F307-A311 VanDerWaalsContact O-O 3.12Å; A311-E313 PolarHBondContact O-N 3.02Å; A311-I314 HydrophobicContact CB-CB 4.42Å; A311-I314 HydrophobicContact CB-CD1 3.62Å; A311-I314 HydrophobicContact CB-CG1 3.97Å; A311-I314 PolarHBondContact O-N 2.75Å
312	P	84.1	Confident	85.8	Confident	77 Å²	77	47.3 Å²	47.3	50%	0.5	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.2	-174	26.8	-35.3	0	0	0	114.1	T236 I314	T236-P312 WeakPolarHBondContact OG1-CD 3.48Å; P312-I314 VanDerWaalsContact C-N 3.3Å
313	E	82.6	Confident	85.9	Confident	91 Å²	91	49.1 Å²	49.1	43%	0.425	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.7	179.2	-62.9	-175.1	-169.2	0	0	113.1	L234 A311 L340	L234-E313 HydrophobicContact CD2-CB 4.4Å; L234-E313 WeakPolarHBondContact CD2-OE2 3.47Å; A311-E313 PolarHBondContact O-N 3.02Å; E313-L340 HydrophobicContact CB-CD1 4.1Å
314	I	83.2	Confident	85.7	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.041	29%	0.285	C	S	.	.	S	Bend	trans	-79.5	123.4	178.7	-58.8	-178	0	0	0	108.8	I279 A280 A311 P312 V316 M342 V345	I279-I314 HydrophobicContact CG2-CD1 4.41Å; A280-I314 HydrophobicContact CB-CD1 4.01Å; A311-I314 HydrophobicContact CB-CB 4.42Å; A311-I314 HydrophobicContact CB-CD1 3.62Å; A311-I314 HydrophobicContact CB-CG1 3.97Å; A311-I314 PolarHBondContact O-N 2.75Å; P312-I314 VanDerWaalsContact C-N 3.3Å; I314-V316 HydrophobicContact CG2-CG2 4.29Å; I314-V316 PolarHBondContact O-N 3.11Å; I314-M342 HydrophobicContact CG1-CE 4.47Å; I314-M342 HydrophobicContact CG2-CE 4.42Å; I314-M342 HydrophobicContact CG2-SD 4.04Å; I314-V345 HydrophobicContact CG2-CG2 3.66Å
315	S	82.6	Confident	85.6	Confident	25 Å²	25	56.5 Å²	56.5	18%	0.175	30%	0.301	C	S	.	.			trans	-70.2	118.7	175.7	-172.4	0	0	0	0	110.2	P344 V345	S315-P344 CarbonylContact O-C 3.59Å; S315-P344 VanDerWaalsContact O-CA 3.31Å; S315-P344 WeakPolarHBondContact O-CA 3.31Å; S315-V345 PolarHBondContact O-N 3.34Å
316	V	86.8	Confident	85.6	Confident	44 Å²	44	55.1 Å²	55.1	27%	0.267	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.4	-179.1	179.6	0	0	0	0	110.7	F307 I314 V345 I347	F307-V316 HydrophobicContact CB-CB 4.48Å; F307-V316 HydrophobicContact CB-CG1 4.47Å; F307-V316 HydrophobicContact CB-CG2 3.68Å; F307-V316 HydrophobicContact CD1-CG2 3.74Å; F307-V316 HydrophobicContact CD2-CG1 4.36Å; F307-V316 HydrophobicContact CD2-CG2 4.25Å; F307-V316 HydrophobicContact CE1-CG2 4.4Å; F307-V316 HydrophobicContact CG-CG1 4.47Å; F307-V316 HydrophobicContact CG-CG2 3.66Å; I314-V316 HydrophobicContact CG2-CG2 4.29Å; I314-V316 PolarHBondContact O-N 3.11Å; V316-V345 HydrophobicContact CG2-CB 4.27Å; V316-I347 HydrophobicContact CG1-CD1 3.39Å; V316-I347 HydrophobicContact CG1-CG1 4.08Å
317	M	86.9	Confident	85.4	Confident	15 Å²	15	57 Å²	57	7%	0.074	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.1	179.8	-172.5	179.2	-69.6	0	0	111.2	L329 Q332 V333 P344 V345 I347	M317-L329 HydrophobicContact CG-CD2 4.28Å; M317-L329 HydrophobicContact SD-CB 4.35Å; M317-L329 HydrophobicContact SD-CD2 4.08Å; M317-Q332 HydrophobicContact CE-CB 3.53Å; M317-Q332 HydrophobicContact SD-CB 4.37Å; M317-V333 HydrophobicContact SD-CG2 3.46Å; M317-V333 WeakPolarHBondContact SD-CG2 3.42Å; M317-P344 HydrophobicContact CB-CB 4.05Å; M317-P344 HydrophobicContact CB-CG 4.49Å; M317-P344 HydrophobicContact CE-CB 4.49Å; M317-P344 HydrophobicContact CE-CG 4.04Å; M317-V345 PolarHBondContact N-O 2.86Å; M317-I347 PolarHBondContact O-N 3.47Å
318	L	88.6	Confident	85.1	Confident	69 Å²	69	64 Å²	64	36%	0.361	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.1	169.1	174	55.1	0	0	0	109.5	V300 I304 H320	V300-L318 HydrophobicContact CG1-CD1 3.29Å; I304-L318 HydrophobicContact CD1-CB 3.82Å; I304-L318 HydrophobicContact CD1-CD1 4.06Å; I304-L318 HydrophobicContact CD1-CD2 3.8Å; I304-L318 HydrophobicContact CD1-CG 4.09Å; L318-H320 HydrophobicContact CD1-CB 3.77Å; L318-H320 HydrophobicContact CD2-CB 4.2Å; L318-H320 HydrophobicContact CG-CB 3.83Å; L318-H320 PolarHBondContact O-N 2.87Å
319	Y	86.4	Confident	84.9	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	82.7	171	-167.2	-100.9	0	0	0	109.9	R326 L329 V346 I347 T348 I352 D356	Y319-R326 HydrophobicContact CE2-CB 4.19Å; Y319-L329 HydrophobicContact CD2-CB 4.06Å; Y319-L329 HydrophobicContact CD2-CD1 4.44Å; Y319-L329 HydrophobicContact CE2-CB 4.23Å; Y319-V346 HydrophobicContact CG-CG1 4.44Å; Y319-I347 PolarHBondContact N-O 3.09Å; Y319-T348 PolarHBondContact O-OG1 3.42Å; Y319-I352 HydrophobicContact CD1-CG2 3.44Å; Y319-I352 VanDerWaalsContact CD1-CG2 3.44Å; Y319-I352 HydrophobicContact CE1-CG2 3.43Å; Y319-I352 VanDerWaalsContact CE1-CG2 3.43Å; Y319-D356 HydrophobicContact CE1-CB 4.07Å; Y319-D356 VanDerWaalsContact CE1-OD2 3.23Å; Y319-D356 WeakPolarHBondContact CE1-OD2 3.4Å; Y319-D356 VanDerWaalsContact CZ-OD2 3.26Å; Y319-D356 PolarHBondContact OH-OD2 3.25Å
320	H	83.7	Confident	84.7	Confident	76 Å²	76	51.7 Å²	51.7	35%	0.352	29%	0.287	S	S	.	.			trans	-144.7	159.9	177.3	-165	83.4	0	0	0	110.6	L297 L318 I352	L297-H320 WeakPolarHBondContact CD1-CE1 3.42Å; L318-H320 HydrophobicContact CD1-CB 3.77Å; L318-H320 HydrophobicContact CD2-CB 4.2Å; L318-H320 HydrophobicContact CG-CB 3.83Å; L318-H320 PolarHBondContact O-N 2.87Å; H320-I352 HydrophobicContact CB-CD1 4.05Å; H320-I352 WeakPolarHBondContact ND1-CD1 3.34Å
321	G	82.2	Confident	84.5	Confident	22 Å²	22	58.1 Å²	58.1	23%	0.227	31%	0.314	C	S	.	.	S	Bend	trans	120	-165.4	172.4	0	0	0	0	0	114.3	R326	G321-R326 WeakPolarHBondContact O-CD 3.44Å; G321-R326 PolarHBondContact O-NH1 3.24Å
322	T	85.4	Confident	84.1	Confident	70 Å²	70	62.1 Å²	62.1	43%	0.429	33%	0.333	S	S	.	.			trans	-72	154.1	-176.3	62.4	0	0	0	0	111.2	P324 E325 R326	T322-P324 VanDerWaalsContact C-CD 3.4Å; T322-P324 VanDerWaalsContact C-N 3.35Å; T322-E325 PolarHBondContact N-OE2 3.06Å; T322-E325 WeakPolarHBondContact O-CB 3.14Å; T322-E325 PolarHBondContact O-N 3.43Å; T322-E325 WeakPolarHBondContact OG1-CG 3.45Å; T322-E325 PolarHBondContact OG1-OE2 3.5Å; T322-R326 WeakPolarHBondContact O-CG 3.48Å; T322-R326 PolarHBondContact O-N 3.39Å
323	P	85.4	Confident	83.8	Confident	81 Å²	81	58.7 Å²	58.7	53%	0.526	31%	0.311	S	S	.	.	H	α-helix	trans	-48.6	-41	178.2	-27.1	34.9	0	0	0	116.3	S327	P323-S327 PolarHBondContact O-N 2.83Å; P323-S327 PolarHBondContact O-OG 3.37Å
324	P	84.8	Confident	83.3	Confident	84 Å²	84	61.1 Å²	61.1	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-68.4	-35.4	176.5	27.1	-36.1	0	0	0	113.6	T322 S327 K328	T322-P324 VanDerWaalsContact C-CD 3.4Å; T322-P324 VanDerWaalsContact C-N 3.35Å; P324-S327 PolarHBondContact O-N 3.25Å; P324-K328 PolarHBondContact O-N 3.1Å
325	E	86.5	Confident	82.9	Confident	101 Å²	101	69 Å²	69	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-67.1	-45	175.1	-68.5	167.3	154.3	0	0	110.3	T322 S327 K328 L329	T322-E325 PolarHBondContact N-OE2 3.06Å; T322-E325 WeakPolarHBondContact O-CB 3.14Å; T322-E325 PolarHBondContact O-N 3.43Å; T322-E325 WeakPolarHBondContact OG1-CG 3.45Å; T322-E325 PolarHBondContact OG1-OE2 3.5Å; E325-S327 VanDerWaalsContact C-N 3.27Å; E325-S327 PolarHBondContact O-N 2.89Å; E325-K328 WeakPolarHBondContact O-CB 3.43Å; E325-K328 PolarHBondContact O-N 3.38Å; E325-L329 WeakPolarHBondContact O-CG 3.5Å; E325-L329 PolarHBondContact O-N 3.23Å
326	R	85.3	Confident	82.3	Confident	29 Å²	29	70.1 Å²	70.1	11%	0.109	35%	0.353	C	S	.	.	H	α-helix	trans	-59.9	-37.6	176.9	-64.4	-164	-46	-116.2	14.7	112.4	Y319 G321 T322 K328 L329 L330 D356	Y319-R326 HydrophobicContact CE2-CB 4.19Å; G321-R326 WeakPolarHBondContact O-CD 3.44Å; G321-R326 PolarHBondContact O-NH1 3.24Å; T322-R326 WeakPolarHBondContact O-CG 3.48Å; T322-R326 PolarHBondContact O-N 3.39Å; R326-K328 VanDerWaalsContact C-N 3.33Å; R326-K328 PolarHBondContact O-N 3.22Å; R326-L329 PolarHBondContact O-N 3.39Å; R326-L330 WeakPolarHBondContact O-CB 3.4Å; R326-L330 PolarHBondContact O-N 3.32Å; R326-D356 VanDerWaalsContact CD-OD2 3.28Å; R326-D356 WeakPolarHBondContact CD-OD2 3.34Å; R326-D356 IonicContact CZ-OD1 2.98Å; R326-D356 IonicContact CZ-OD2 3.65Å; R326-D356 IonicContact NE-OD1 2.88Å; R326-D356 IonicContact NE-OD2 2.62Å; R326-D356 PolarHBondContact NE-OD2 3.32Å; R326-D356 IonicContact NH2-OD1 3.88Å; R326-D356 PolarHBondContact NH2-OD1 3.43Å; R326-D356 IonicContact NH2-OD2 3.47Å
327	S	83.1	Confident	81.2	Confident	70 Å²	70	70.8 Å²	70.8	49%	0.49	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-34.4	175.4	-62.1	0	0	0	0	113.1	P323 P324 E325	P323-S327 PolarHBondContact O-N 2.83Å; P323-S327 PolarHBondContact O-OG 3.37Å; P324-S327 PolarHBondContact O-N 3.25Å; E325-S327 VanDerWaalsContact C-N 3.27Å; E325-S327 PolarHBondContact O-N 2.89Å
328	K	84.6	Confident	79.9	Confident	146 Å²	146	72.3 Å²	72.3	64%	0.635	37%	0.373	S	S	*	.	H	α-helix	trans	-70.6	-44.6	172.8	-67.4	175.4	-177.9	176.5	0	111	P324 E325 R326 L330 K331 Q332	P324-K328 PolarHBondContact O-N 3.1Å; E325-K328 WeakPolarHBondContact O-CB 3.43Å; E325-K328 PolarHBondContact O-N 3.38Å; R326-K328 VanDerWaalsContact C-N 3.33Å; R326-K328 PolarHBondContact O-N 3.22Å; K328-L330 VanDerWaalsContact C-N 3.33Å; K328-L330 PolarHBondContact O-N 3.33Å; K328-K331 PolarHBondContact O-N 3.28Å; K328-Q332 PolarHBondContact O-N 3.1Å
329	L	83.8	Confident	78.5	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	39%	0.391	C	S	.	.	H	α-helix	trans	-60.6	-40.9	177.4	-66.8	172	0	0	0	111.6	M317 Y319 E325 R326 K331 Q332 V333	M317-L329 HydrophobicContact CG-CD2 4.28Å; M317-L329 HydrophobicContact SD-CB 4.35Å; M317-L329 HydrophobicContact SD-CD2 4.08Å; Y319-L329 HydrophobicContact CD2-CB 4.06Å; Y319-L329 HydrophobicContact CD2-CD1 4.44Å; Y319-L329 HydrophobicContact CE2-CB 4.23Å; E325-L329 WeakPolarHBondContact O-CG 3.5Å; E325-L329 PolarHBondContact O-N 3.23Å; R326-L329 PolarHBondContact O-N 3.39Å; L329-K331 VanDerWaalsContact C-N 3.27Å; L329-K331 PolarHBondContact O-N 2.98Å; L329-Q332 CarbonylContact O-C 3.54Å; L329-Q332 WeakPolarHBondContact O-CA 3.45Å; L329-Q332 VanDerWaalsContact O-CB 3.32Å; L329-Q332 WeakPolarHBondContact O-CB 3.5Å; L329-Q332 PolarHBondContact O-N 2.85Å; L329-V333 WeakPolarHBondContact O-CG2 3.47Å; L329-V333 PolarHBondContact O-N 3.11Å
330	L	81.8	Confident	77.2	Confident	22 Å²	22	77 Å²	77	12%	0.115	40%	0.404	C	S	.	.	H	α-helix	trans	-59	-38.1	178.3	-164.5	80.8	0	0	0	112.7	R326 K328 Q332 V333 R334 F359	R326-L330 WeakPolarHBondContact O-CB 3.4Å; R326-L330 PolarHBondContact O-N 3.32Å; K328-L330 VanDerWaalsContact C-N 3.33Å; K328-L330 PolarHBondContact O-N 3.33Å; L330-Q332 VanDerWaalsContact C-N 3.26Å; L330-Q332 PolarHBondContact O-N 3.25Å; L330-V333 PolarHBondContact O-N 3.21Å; L330-R334 PolarHBondContact O-N 2.89Å; L330-F359 HydrophobicContact CD1-CB 3.82Å; L330-F359 HydrophobicContact CD2-CB 3.96Å; L330-F359 HydrophobicContact CD2-CD1 3.7Å; L330-F359 HydrophobicContact CD2-CE1 4.48Å; L330-F359 HydrophobicContact CD2-CG 4Å
331	K	79.8	Confident	76.3	Confident	151 Å²	151	78.8 Å²	78.8	66%	0.657	42%	0.416	S	S	*	.	H	α-helix	trans	-66.6	-31.3	174.8	-66.1	178.9	-176.7	-178.9	0	111.8	K328 L329	K328-K331 PolarHBondContact O-N 3.28Å; L329-K331 VanDerWaalsContact C-N 3.27Å; L329-K331 PolarHBondContact O-N 2.98Å
332	Q	78.4	Confident	75.9	Confident	85 Å²	85	77.8 Å²	77.8	40%	0.397	41%	0.406	S	S	.	.	H	α-helix	trans	-77.7	-36.5	178.3	-69.1	179.4	-8.7	0	0	112.3	M317 K328 L329 L330 R334 R335 Q337	M317-Q332 HydrophobicContact CE-CB 3.53Å; M317-Q332 HydrophobicContact SD-CB 4.37Å; K328-Q332 PolarHBondContact O-N 3.1Å; L329-Q332 CarbonylContact O-C 3.54Å; L329-Q332 WeakPolarHBondContact O-CA 3.45Å; L329-Q332 VanDerWaalsContact O-CB 3.32Å; L329-Q332 WeakPolarHBondContact O-CB 3.5Å; L329-Q332 PolarHBondContact O-N 2.85Å; L330-Q332 VanDerWaalsContact C-N 3.26Å; L330-Q332 PolarHBondContact O-N 3.25Å; Q332-R334 VanDerWaalsContact C-N 3.25Å; Q332-R334 PolarHBondContact O-N 3.06Å; Q332-R335 PolarHBondContact O-N 3.42Å; Q332-R335 VanDerWaalsContact O-N 3.08Å; Q332-Q337 PolarHBondContact O-NE2 3.31Å; Q332-Q337 VanDerWaalsContact O-NE2 3.1Å
333	V	77.6	Confident	75.5	Confident	5 Å²	5	77.9 Å²	77.9	3%	0.03	40%	0.4	C	S	.	.	H	α-helix	trans	-60.1	-34.7	176.2	173.4	0	0	0	0	112	M317 L329 L330 R335 V346 L363	M317-V333 HydrophobicContact SD-CG2 3.46Å; M317-V333 WeakPolarHBondContact SD-CG2 3.42Å; L329-V333 WeakPolarHBondContact O-CG2 3.47Å; L329-V333 PolarHBondContact O-N 3.11Å; L330-V333 PolarHBondContact O-N 3.21Å; V333-R335 PolarHBondContact O-N 3.07Å; V333-V346 HydrophobicContact CG1-CG2 3.83Å; V333-V346 HydrophobicContact CG2-CG2 3.89Å; V333-L363 HydrophobicContact CG1-CD1 3.84Å
334	R	73.1	Confident	75.4	Confident	142 Å²	142	74 Å²	74	54%	0.536	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.7	178.4	-69.2	-177.6	-179.1	-175.6	-0.5	114.1	L330 Q332 L363	L330-R334 PolarHBondContact O-N 2.89Å; Q332-R334 VanDerWaalsContact C-N 3.25Å; Q332-R334 PolarHBondContact O-N 3.06Å; R334-L363 HydrophobicContact CG-CD2 4.13Å
335	R	74.6	Confident	75.6	Confident	175 Å²	175	70 Å²	70	66%	0.66	35%	0.349	S	S	*	.	S	Bend	trans	-103.7	141.4	-179.5	-67	179.4	179.6	178.1	-2	109.1	Q332 V333	Q332-R335 PolarHBondContact O-N 3.42Å; Q332-R335 VanDerWaalsContact O-N 3.08Å; V333-R335 PolarHBondContact O-N 3.07Å
336	S	69.7	Low	75.8	Confident	47 Å²	47	65.3 Å²	65.3	33%	0.329	33%	0.327	S	S	.	.			trans	-66.9	133.9	168	-173.9	0	0	0	0	109.8	N341 M342	S336-N341 VanDerWaalsContact CB-OD1 3.23Å; S336-N341 WeakPolarHBondContact CB-OD1 3.49Å; S336-N341 WeakPolarHBondContact OG-CA 3.05Å; S336-N341 PolarHBondContact OG-O 3.2Å; S336-N341 PolarHBondContact OG-OD1 3.1Å; S336-M342 WeakPolarHBondContact CA-O 2.92Å; S336-M342 PolarHBondContact OG-N 2.94Å; S336-M342 PolarHBondContact OG-O 3.37Å
337	Q	62.9	Low	76.1	Confident	59 Å²	59	63.9 Å²	63.9	28%	0.276	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-138.2	153.7	-174.2	-64	-168.2	7.7	0	0	112.1	Q332 M342	Q332-Q337 PolarHBondContact O-NE2 3.31Å; Q332-Q337 VanDerWaalsContact O-NE2 3.1Å; Q337-M342 PolarHBondContact N-O 3.45Å; Q337-M342 PolarHBondContact O-N 3.4Å; Q337-M342 VanDerWaalsContact O-O 3.06Å
338	G	60.2	Low	76.5	Confident	47 Å²	47	60.6 Å²	60.6	49%	0.485	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	176.5	173.7	0	0	0	0	0	114.6	L340 N341	G338-L340 PolarHBondContact O-N 3.28Å; G338-N341 PolarHBondContact O-N 3.43Å
339	P	58.6	Low	76.8	Confident	114 Å²	114	53.8 Å²	53.8	74%	0.74	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.9	-175.4	25.4	-33.1	0	0	0	112.9
340	L	60.3	Low	77	Confident	56 Å²	56	52.2 Å²	52.2	29%	0.293	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.8	-178.7	-64.7	169.7	0	0	0	113.3	L234 V283 M288 E313 G338 M342	L234-L340 HydrophobicContact CD1-CD1 4.22Å; L234-L340 HydrophobicContact CD2-CD1 4.19Å; V283-L340 HydrophobicContact CG1-CD1 4.24Å; M288-L340 WeakPolarHBondContact CE-O 3.35Å; E313-L340 HydrophobicContact CB-CD1 4.1Å; G338-L340 PolarHBondContact O-N 3.28Å; L340-M342 HydrophobicContact CB-CE 3.69Å; L340-M342 HydrophobicContact CD1-CE 3.44Å; L340-M342 VanDerWaalsContact CD1-CE 3.44Å; L340-M342 HydrophobicContact CG-CE 4.2Å; L340-M342 PolarHBondContact O-N 2.79Å
341	N	64.3	Low	77.2	Confident	114 Å²	114	56.8 Å²	56.8	61%	0.61	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	53.3	-176.8	-162	24.6	0	0	0	112	M288 S336 G338	M288-N341 WeakPolarHBondContact CE-O 3.14Å; S336-N341 VanDerWaalsContact CB-OD1 3.23Å; S336-N341 WeakPolarHBondContact CB-OD1 3.49Å; S336-N341 WeakPolarHBondContact OG-CA 3.05Å; S336-N341 PolarHBondContact OG-O 3.2Å; S336-N341 PolarHBondContact OG-OD1 3.1Å; G338-N341 PolarHBondContact O-N 3.43Å
342	M	73.1	Confident	77.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-113.3	162	178.4	81	172.4	77.2	0	0	112.5	V283 M288 I314 S336 Q337 L340	V283-M342 HydrophobicContact CB-CE 4.48Å; V283-M342 HydrophobicContact CG1-CE 3.54Å; V283-M342 HydrophobicContact CG2-CE 4.07Å; V283-M342 HydrophobicContact CG2-SD 4.13Å; M288-M342 HydrophobicContact CB-CB 4.25Å; M288-M342 HydrophobicContact CE-CB 3.65Å; I314-M342 HydrophobicContact CG1-CE 4.47Å; I314-M342 HydrophobicContact CG2-CE 4.42Å; I314-M342 HydrophobicContact CG2-SD 4.04Å; S336-M342 WeakPolarHBondContact CA-O 2.92Å; S336-M342 PolarHBondContact OG-N 2.94Å; S336-M342 PolarHBondContact OG-O 3.37Å; Q337-M342 PolarHBondContact N-O 3.45Å; Q337-M342 PolarHBondContact O-N 3.4Å; Q337-M342 VanDerWaalsContact O-O 3.06Å; L340-M342 HydrophobicContact CB-CE 3.69Å; L340-M342 HydrophobicContact CD1-CE 3.44Å; L340-M342 VanDerWaalsContact CD1-CE 3.44Å; L340-M342 HydrophobicContact CG-CE 4.2Å; L340-M342 PolarHBondContact O-N 2.79Å
343	F	78.7	Confident	78	Confident	73 Å²	73	46.1 Å²	46.1	32%	0.32	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-70.2	134.3	164.9	-66.8	-77.9	0	0	0	110	M288 P290	M288-F343 WeakPolarHBondContact O-CB 3.37Å; M288-F343 WeakPolarHBondContact O-CD2 3.43Å; M288-F343 PolarHBondContact O-N 2.99Å; P290-F343 HydrophobicContact CB-CB 3.98Å
344	P	82.6	Confident	78.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-63.2	145.2	-176.7	26.4	-34.1	0	0	0	111.4	S315 M317 V346	S315-P344 CarbonylContact O-C 3.59Å; S315-P344 VanDerWaalsContact O-CA 3.31Å; S315-P344 WeakPolarHBondContact O-CA 3.31Å; M317-P344 HydrophobicContact CB-CB 4.05Å; M317-P344 HydrophobicContact CB-CG 4.49Å; M317-P344 HydrophobicContact CE-CB 4.49Å; M317-P344 HydrophobicContact CE-CG 4.04Å; P344-V346 PolarHBondContact O-N 3.45Å
345	V	88.4	Confident	79	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	118.6	167.6	-179.1	0	0	0	0	107.8	I279 F291 V293 F307 I314 S315 V316 M317	I279-V345 HydrophobicContact CG2-CG2 4.19Å; F291-V345 HydrophobicContact CB-CG1 4.25Å; F291-V345 HydrophobicContact CB-CG2 4.27Å; F291-V345 HydrophobicContact CD2-CG2 4.04Å; V293-V345 HydrophobicContact CG2-CG1 4.1Å; F307-V345 HydrophobicContact CE1-CG1 4.48Å; F307-V345 HydrophobicContact CE2-CG1 4.34Å; F307-V345 HydrophobicContact CZ-CG1 3.93Å; I314-V345 HydrophobicContact CG2-CG2 3.66Å; S315-V345 PolarHBondContact O-N 3.34Å; V316-V345 HydrophobicContact CG2-CB 4.27Å; M317-V345 PolarHBondContact N-O 2.86Å
346	V	91.1	Very high	79.6	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.4	-178.2	-178.2	0	0	0	0	109.3	F291 L292 V293 Y319 V333 P344 W365	F291-V346 PolarHBondContact O-N 3.29Å; L292-V346 HydrophobicContact CD1-CB 4.21Å; L292-V346 HydrophobicContact CD1-CG1 4.11Å; V293-V346 PolarHBondContact N-O 3.23Å; Y319-V346 HydrophobicContact CG-CG1 4.44Å; V333-V346 HydrophobicContact CG1-CG2 3.83Å; V333-V346 HydrophobicContact CG2-CG2 3.89Å; P344-V346 PolarHBondContact O-N 3.45Å; V346-W365 HydrophobicContact CB-CH2 3.97Å; V346-W365 HydrophobicContact CB-CZ3 4.06Å; V346-W365 HydrophobicContact CG1-CH2 4.37Å; V346-W365 HydrophobicContact CG2-CH2 3.9Å; V346-W365 HydrophobicContact CG2-CZ3 4Å
347	I	92.2	Very high	80.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.6	174.6	-54.5	170.4	0	0	0	108.2	V293 V300 W303 I304 F307 V316 M317 Y319	V293-I347 HydrophobicContact CB-CG1 4.23Å; V293-I347 WeakPolarHBondContact O-CA 3.16Å; V300-I347 HydrophobicContact CB-CG2 4.38Å; V300-I347 HydrophobicContact CG1-CG2 3.93Å; V300-I347 HydrophobicContact CG2-CG2 4.15Å; W303-I347 HydrophobicContact CB-CD1 4.06Å; W303-I347 HydrophobicContact CB-CG2 4.35Å; I304-I347 HydrophobicContact CG1-CD1 3.85Å; F307-I347 HydrophobicContact CD2-CD1 3.74Å; F307-I347 HydrophobicContact CE2-CD1 3.89Å; F307-I347 HydrophobicContact CE2-CG1 4.46Å; V316-I347 HydrophobicContact CG1-CD1 3.39Å; V316-I347 HydrophobicContact CG1-CG1 4.08Å; M317-I347 PolarHBondContact O-N 3.47Å; Y319-I347 PolarHBondContact N-O 3.09Å
348	T	91.3	Very high	81.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	161.8	-177.8	-169	0	0	0	0	112	L292 V293 V294 A295 Y319	L292-T348 HydrophobicContact CD1-CG2 3.82Å; V293-T348 PolarHBondContact O-N 3.24Å; V294-T348 WeakPolarHBondContact CA-O 3.25Å; V294-T348 HydrophobicContact CB-CG2 4.44Å; V294-T348 HydrophobicContact CG1-CG2 4.49Å; V294-T348 HydrophobicContact CG2-CG2 3.88Å; A295-T348 PolarHBondContact N-O 3.37Å; Y319-T348 PolarHBondContact O-OG1 3.42Å
349	S	90.1	Very high	82.5	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	157.3	171.5	73.9	0	0	0	0	111.9	A295 E351 I352 S353	A295-S349 VanDerWaalsContact O-CA 3.3Å; A295-S349 WeakPolarHBondContact O-CA 3.44Å; S349-E351 VanDerWaalsContact C-N 3.28Å; S349-E351 PolarHBondContact O-N 2.96Å; S349-I352 PolarHBondContact O-N 2.83Å; S349-I352 WeakPolarHBondContact OG-CG1 3.26Å; S349-S353 PolarHBondContact O-N 3.28Å
350	F	87.9	Confident	83.7	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-53.8	-42.6	176	-65	-71.7	0	0	0	113.5	V294 P296 S353 M354 V370 D371 R375 L383	V294-F350 HydrophobicContact CG1-CD1 3.45Å; V294-F350 VanDerWaalsContact CG1-CD1 3.45Å; V294-F350 HydrophobicContact CG1-CE1 3.78Å; V294-F350 HydrophobicContact CG1-CG 4.11Å; P296-F350 HydrophobicContact CB-CE2 4.19Å; P296-F350 VanDerWaalsContact CD-CE2 3.46Å; P296-F350 HydrophobicContact CG-CE2 3.75Å; P296-F350 VanDerWaalsContact N-CE2 3.28Å; F350-S353 PolarHBondContact O-N 3.47Å; F350-S353 PolarHBondContact O-OG 3.45Å; F350-M354 WeakPolarHBondContact O-CG 3.2Å; F350-M354 PolarHBondContact O-N 3.31Å; F350-V370 HydrophobicContact CE1-CG1 3.69Å; F350-V370 HydrophobicContact CZ-CG1 4.25Å; F350-D371 VanDerWaalsContact CZ-O 3.26Å; F350-D371 WeakPolarHBondContact CZ-O 3.24Å; F350-R375 VanDerWaalsContact CE2-CD 3.5Å; F350-L383 HydrophobicContact CB-CD1 4.18Å; F350-L383 HydrophobicContact CD1-CD1 3.69Å; F350-L383 HydrophobicContact CD1-CD2 3.47Å; F350-L383 VanDerWaalsContact CD1-CD2 3.47Å; F350-L383 HydrophobicContact CD1-CG 4.21Å; F350-L383 HydrophobicContact CE1-CD2 3.79Å; F350-L383 HydrophobicContact CG-CD1 4.4Å; F350-L383 HydrophobicContact CG-CD2 4.22Å
351	E	86.8	Confident	84.9	Confident	117 Å²	117	41.4 Å²	41.4	55%	0.547	19%	0.193	S	C	.	.	H	α-helix	trans	-65	-43.8	-177.8	-67.5	168.6	-171.7	0	0	111.3	S349 S353 M354 I355	S349-E351 VanDerWaalsContact C-N 3.28Å; S349-E351 PolarHBondContact O-N 2.96Å; E351-S353 VanDerWaalsContact C-N 3.34Å; E351-S353 PolarHBondContact O-N 3.02Å; E351-M354 WeakPolarHBondContact O-CB 3.42Å; E351-M354 PolarHBondContact O-N 2.87Å; E351-M354 VanDerWaalsContact O-N 3.16Å; E351-I355 VanDerWaalsContact O-CG1 3.31Å; E351-I355 WeakPolarHBondContact O-CG1 3.49Å; E351-I355 PolarHBondContact O-N 3.07Å
352	I	87.4	Confident	85.9	Confident	9 Å²	9	42.9 Å²	42.9	5%	0.046	20%	0.196	C	C	.	.	H	α-helix	trans	-68.3	-37.5	179.3	-65.2	-175.5	0	0	0	110.9	Y319 H320 S349 M354 I355 D356	Y319-I352 HydrophobicContact CD1-CG2 3.44Å; Y319-I352 VanDerWaalsContact CD1-CG2 3.44Å; Y319-I352 HydrophobicContact CE1-CG2 3.43Å; Y319-I352 VanDerWaalsContact CE1-CG2 3.43Å; H320-I352 HydrophobicContact CB-CD1 4.05Å; H320-I352 WeakPolarHBondContact ND1-CD1 3.34Å; S349-I352 PolarHBondContact O-N 2.83Å; S349-I352 WeakPolarHBondContact OG-CG1 3.26Å; I352-M354 PolarHBondContact O-N 3.46Å; I352-I355 PolarHBondContact O-N 3.08Å; I352-D356 PolarHBondContact O-N 3.17Å
353	S	86.6	Confident	86.5	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-31.9	174.3	76.8	0	0	0	0	112.8	S349 F350 E351	S349-S353 PolarHBondContact O-N 3.28Å; F350-S353 PolarHBondContact O-N 3.47Å; F350-S353 PolarHBondContact O-OG 3.45Å; E351-S353 VanDerWaalsContact C-N 3.34Å; E351-S353 PolarHBondContact O-N 3.02Å
354	M	85.8	Confident	86.9	Confident	36 Å²	36	47 Å²	47	18%	0.177	22%	0.217	C	C	.	.	H	α-helix	trans	-77.5	-41.6	175.4	-63.9	176.9	-169.7	0	0	113	F350 E351 I352 L383 E386	F350-M354 WeakPolarHBondContact O-CG 3.2Å; F350-M354 PolarHBondContact O-N 3.31Å; E351-M354 WeakPolarHBondContact O-CB 3.42Å; E351-M354 PolarHBondContact O-N 2.87Å; E351-M354 VanDerWaalsContact O-N 3.16Å; I352-M354 PolarHBondContact O-N 3.46Å; M354-L383 HydrophobicContact CE-CB 3.37Å; M354-L383 HydrophobicContact CE-CD1 3.72Å; M354-L383 HydrophobicContact CE-CG 4.04Å; M354-L383 HydrophobicContact CG-CD1 4.44Å; M354-E386 HydrophobicContact CB-CG 4.41Å; M354-E386 HydrophobicContact CG-CG 4.21Å
355	I	86.7	Confident	87.2	Confident	110 Å²	110	47.1 Å²	47.1	56%	0.564	22%	0.217	S	C	*	.	H	α-helix	trans	-69.2	-48.5	-176.3	-63.7	163.9	0	0	0	110.1	E351 I352 R357	E351-I355 VanDerWaalsContact O-CG1 3.31Å; E351-I355 WeakPolarHBondContact O-CG1 3.49Å; E351-I355 PolarHBondContact O-N 3.07Å; I352-I355 PolarHBondContact O-N 3.08Å; I355-R357 VanDerWaalsContact C-N 3.31Å; I355-R357 PolarHBondContact O-N 3.43Å
356	D	86.6	Confident	87.3	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.059	23%	0.234	C	C	.	.	S	Bend	trans	-95.5	19.3	-172.6	-70.5	0.6	0	0	0	112.9	Y319 R326 I352 K358 F359 L360	Y319-D356 HydrophobicContact CE1-CB 4.07Å; Y319-D356 VanDerWaalsContact CE1-OD2 3.23Å; Y319-D356 WeakPolarHBondContact CE1-OD2 3.4Å; Y319-D356 VanDerWaalsContact CZ-OD2 3.26Å; Y319-D356 PolarHBondContact OH-OD2 3.25Å; R326-D356 VanDerWaalsContact CD-OD2 3.28Å; R326-D356 WeakPolarHBondContact CD-OD2 3.34Å; R326-D356 IonicContact CZ-OD1 2.98Å; R326-D356 IonicContact CZ-OD2 3.65Å; R326-D356 IonicContact NE-OD1 2.88Å; R326-D356 IonicContact NE-OD2 2.62Å; R326-D356 PolarHBondContact NE-OD2 3.32Å; R326-D356 IonicContact NH2-OD1 3.88Å; R326-D356 PolarHBondContact NH2-OD1 3.43Å; R326-D356 IonicContact NH2-OD2 3.47Å; I352-D356 PolarHBondContact O-N 3.17Å; D356-K358 PolarHBondContact O-N 3.36Å; D356-F359 HydrophobicContact CB-CD2 4.24Å; D356-F359 PolarHBondContact O-N 2.86Å; D356-L360 PolarHBondContact O-N 3.11Å
357	R	83.6	Confident	87.3	Confident	84 Å²	84	51 Å²	51	32%	0.317	23%	0.234	S	C	.	.	H	α-helix	trans	-45.9	-42.4	-178.6	68	177.8	-176.6	-173.3	3.1	113.6	I355 F359 L360 Q361 E386	I355-R357 VanDerWaalsContact C-N 3.31Å; I355-R357 PolarHBondContact O-N 3.43Å; R357-F359 PolarHBondContact O-N 2.84Å; R357-L360 PolarHBondContact O-N 2.76Å; R357-Q361 WeakPolarHBondContact O-CB 3.19Å; R357-Q361 VanDerWaalsContact O-CG 3.23Å; R357-Q361 WeakPolarHBondContact O-CG 3.45Å; R357-Q361 PolarHBondContact O-N 3.42Å; R357-E386 WeakPolarHBondContact CD-OE2 3.39Å; R357-E386 IonicContact CZ-OE1 2.7Å; R357-E386 IonicContact CZ-OE2 3.53Å; R357-E386 IonicContact NE-OE2 2.89Å; R357-E386 IonicContact NH1-OE1 2.7Å; R357-E386 PolarHBondContact NH1-OE1 3Å; R357-E386 IonicContact NH1-OE2 2.98Å; R357-E386 PolarHBondContact NH1-OE2 2.92Å
358	K	85	Confident	87.3	Confident	138 Å²	138	51 Å²	51	60%	0.6	23%	0.234	S	C	*	.	H	α-helix	trans	-61.5	-38.7	-175.6	-67.8	-175.5	-179.8	-178.9	0	110.1	D356 H362	D356-K358 PolarHBondContact O-N 3.36Å; K358-H362 PolarHBondContact O-CE1 3.02Å; K358-H362 VanDerWaalsContact O-CE1 3.25Å; K358-H362 PolarHBondContact O-ND1 2.88Å
359	F	84.8	Confident	87.4	Confident	103 Å²	103	51.1 Å²	51.1	45%	0.452	24%	0.235	S	C	.	.	H	α-helix	trans	-76.8	-39.7	-179.9	-59.6	-69.6	0	0	0	112	L330 D356 R357 Q361 H362	L330-F359 HydrophobicContact CD1-CB 3.82Å; L330-F359 HydrophobicContact CD2-CB 3.96Å; L330-F359 HydrophobicContact CD2-CD1 3.7Å; L330-F359 HydrophobicContact CD2-CE1 4.48Å; L330-F359 HydrophobicContact CD2-CG 4Å; D356-F359 HydrophobicContact CB-CD2 4.24Å; D356-F359 PolarHBondContact O-N 2.86Å; R357-F359 PolarHBondContact O-N 2.84Å; F359-Q361 VanDerWaalsContact C-N 3.32Å; F359-Q361 PolarHBondContact O-N 2.79Å; F359-H362 PolarHBondContact O-N 3.3Å
360	L	84.3	Confident	87.5	Confident	3 Å²	3	51 Å²	51	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-69.3	-28.4	-179.8	-62.3	174.8	0	0	0	113	D356 R357 H362 L363 W365 L390	D356-L360 PolarHBondContact O-N 3.11Å; R357-L360 PolarHBondContact O-N 2.76Å; L360-H362 VanDerWaalsContact C-N 3.29Å; L360-H362 PolarHBondContact O-N 2.92Å; L360-L363 PolarHBondContact O-N 3.3Å; L360-W365 HydrophobicContact CD2-CH2 4.49Å; L360-W365 HydrophobicContact CD2-CZ2 3.81Å; L360-W365 PolarHBondContact O-NE1 3.42Å; L360-L390 HydrophobicContact CB-CD2 3.7Å
361	Q	86.2	Confident	87.6	Confident	62 Å²	62	51.5 Å²	51.5	29%	0.29	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-26.9	175.2	-78.5	170.7	-8	0	0	113.7	R357 F359 L363 M389 L390 P391	R357-Q361 WeakPolarHBondContact O-CB 3.19Å; R357-Q361 VanDerWaalsContact O-CG 3.23Å; R357-Q361 WeakPolarHBondContact O-CG 3.45Å; R357-Q361 PolarHBondContact O-N 3.42Å; F359-Q361 VanDerWaalsContact C-N 3.32Å; F359-Q361 PolarHBondContact O-N 2.79Å; Q361-L363 PolarHBondContact O-N 3.35Å; Q361-M389 VanDerWaalsContact NE2-CB 3.34Å; Q361-L390 HydrophobicContact CG-CD2 4.07Å; Q361-P391 WeakPolarHBondContact O-CG 3.46Å
362	H	85.4	Confident	87.4	Confident	144 Å²	144	46.6 Å²	46.6	67%	0.667	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.5	178.6	-69.5	79.6	0	0	0	112.9	K358 F359 L360	K358-H362 PolarHBondContact O-CE1 3.02Å; K358-H362 VanDerWaalsContact O-CE1 3.25Å; K358-H362 PolarHBondContact O-ND1 2.88Å; F359-H362 PolarHBondContact O-N 3.3Å; L360-H362 VanDerWaalsContact C-N 3.29Å; L360-H362 PolarHBondContact O-N 2.92Å
363	L	84.4	Confident	86.9	Confident	23 Å²	23	46.3 Å²	46.3	12%	0.12	21%	0.213	C	C	.	.	S	Bend	trans	-101.3	129.3	178.3	-63.5	171.3	0	0	0	108.8	V333 R334 L360 Q361 W365 P391	V333-L363 HydrophobicContact CG1-CD1 3.84Å; R334-L363 HydrophobicContact CG-CD2 4.13Å; L360-L363 PolarHBondContact O-N 3.3Å; Q361-L363 PolarHBondContact O-N 3.35Å; L363-W365 HydrophobicContact CB-CZ2 3.95Å; L363-W365 HydrophobicContact CD1-CH2 3.98Å; L363-W365 HydrophobicContact CD1-CZ2 3.58Å; L363-W365 HydrophobicContact CG-CZ2 4.41Å; L363-W365 PolarHBondContact O-NE1 3.21Å; L363-P391 WeakPolarHBondContact O-CG 3.47Å
364	Q	87.1	Confident	86.4	Confident	139 Å²	139	48.5 Å²	48.5	65%	0.65	22%	0.223	S	C	*	.			trans	-84.9	111.6	171.4	-71.3	-162.9	-19.9	0	0	109.8	P290	P290-Q364 WeakPolarHBondContact CD-O 3.5Å; P290-Q364 VanDerWaalsContact CG-O 3.31Å; P290-Q364 WeakPolarHBondContact CG-O 3.22Å
365	W	90.3	Very high	85.9	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132.6	-175.9	-59.9	95.5	0	0	0	110.8	P290 L292 V346 L360 L363 P391 T392 D393	P290-W365 HydrophobicContact CB-CE3 3.8Å; P290-W365 HydrophobicContact CB-CZ3 3.8Å; P290-W365 HydrophobicContact CG-CE3 3.98Å; P290-W365 HydrophobicContact CG-CZ3 4.37Å; L292-W365 HydrophobicContact CB-CD2 3.8Å; L292-W365 HydrophobicContact CB-CE3 3.51Å; L292-W365 HydrophobicContact CB-CG 4.37Å; L292-W365 HydrophobicContact CB-CH2 4.31Å; L292-W365 HydrophobicContact CB-CZ3 3.77Å; L292-W365 HydrophobicContact CD1-CH2 4.08Å; L292-W365 HydrophobicContact CD1-CZ2 4.38Å; L292-W365 HydrophobicContact CD1-CZ3 4.28Å; L292-W365 HydrophobicContact CD2-CD2 4.14Å; L292-W365 HydrophobicContact CD2-CZ2 4.19Å; L292-W365 HydrophobicContact CG-CE3 4.49Å; L292-W365 HydrophobicContact CG-CZ3 4.48Å; V346-W365 HydrophobicContact CB-CH2 3.97Å; V346-W365 HydrophobicContact CB-CZ3 4.06Å; V346-W365 HydrophobicContact CG1-CH2 4.37Å; V346-W365 HydrophobicContact CG2-CH2 3.9Å; V346-W365 HydrophobicContact CG2-CZ3 4Å; L360-W365 HydrophobicContact CD2-CH2 4.49Å; L360-W365 HydrophobicContact CD2-CZ2 3.81Å; L360-W365 PolarHBondContact O-NE1 3.42Å; L363-W365 HydrophobicContact CB-CZ2 3.95Å; L363-W365 HydrophobicContact CD1-CH2 3.98Å; L363-W365 HydrophobicContact CD1-CZ2 3.58Å; L363-W365 HydrophobicContact CG-CZ2 4.41Å; L363-W365 PolarHBondContact O-NE1 3.21Å; W365-P391 PolarHBondContact N-O 3.13Å; W365-T392 HydrophobicContact CB-CG2 4.01Å; W365-T392 VanDerWaalsContact O-CA 3.28Å; W365-T392 WeakPolarHBondContact O-CA 3.44Å; W365-D393 PolarHBondContact O-N 3.29Å
366	K	89.8	Confident	85.4	Confident	79 Å²	79	46.5 Å²	46.5	34%	0.343	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-35.6	178	-66.5	-55.1	-175.7	-178.9	0	112.9	V287 P290 F291 D393 N394	V287-K366 HydrophobicContact CG1-CB 4.45Å; V287-K366 HydrophobicContact CG1-CG 4.41Å; P290-K366 PolarHBondContact O-N 3.39Å; F291-K366 HydrophobicContact CE1-CB 4.31Å; K366-D393 WeakPolarHBondContact CD-OD2 3.46Å; K366-D393 IonicContact NZ-OD2 2.75Å; K366-D393 PolarHBondContact NZ-OD2 3.43Å; K366-N394 PolarHBondContact O-N 3Å
367	Y	91.3	Very high	84.8	Confident	5 Å²	5	48.1 Å²	48.1	2%	0.02	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	129.8	-179.6	-150.3	-100.1	0	0	0	109.5	H278 M282 L292 I369 N394 L396	H278-Y367 AromaticContact CD2-CZ 3.73Å; H278-Y367 AromaticContact NE2-CE2 3.73Å; H278-Y367 AromaticContact NE2-CZ 3.57Å; H278-Y367 PolarHBondContact NE2-OH 3.01Å; M282-Y367 HydrophobicContact CE-CD1 4.19Å; M282-Y367 HydrophobicContact CE-CD2 4.12Å; M282-Y367 HydrophobicContact CE-CE2 4.5Å; M282-Y367 HydrophobicContact CE-CG 3.98Å; M282-Y367 HydrophobicContact SD-CD2 4.08Å; M282-Y367 HydrophobicContact SD-CG 4.42Å; L292-Y367 PolarHBondContact N-O 3.15Å; Y367-I369 HydrophobicContact CD1-CD1 3.99Å; Y367-I369 HydrophobicContact CD1-CG1 3.55Å; Y367-I369 HydrophobicContact CE1-CD1 4.03Å; Y367-I369 HydrophobicContact CE1-CG1 3.62Å; Y367-N394 HydrophobicContact CD2-CB 3.52Å; Y367-N394 HydrophobicContact CE2-CB 3.64Å; Y367-L396 HydrophobicContact CE1-CB 3.69Å; Y367-L396 HydrophobicContact CE1-CD2 4.05Å
368	L	92.4	Very high	84.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.7	173.8	171.3	63.6	0	0	0	109.3	L292 V294 V370 T392 N394 K395 L396 F416	L292-L368 HydrophobicContact CB-CD1 4.05Å; L292-L368 HydrophobicContact CD2-CD1 3.83Å; L292-L368 HydrophobicContact CG-CD1 3.84Å; L292-L368 WeakPolarHBondContact O-CA 3.46Å; V294-L368 HydrophobicContact CG2-CD1 3.86Å; L368-V370 HydrophobicContact CD1-CG2 4.16Å; L368-V370 HydrophobicContact CD2-CG2 4.19Å; L368-V370 HydrophobicContact CG-CG2 3.97Å; L368-T392 HydrophobicContact CB-CG2 3.69Å; L368-T392 HydrophobicContact CD2-CG2 3.95Å; L368-T392 HydrophobicContact CG-CG2 4.4Å; L368-N394 PolarHBondContact N-O 2.7Å; L368-K395 HydrophobicContact CB-CG 4.47Å; L368-K395 HydrophobicContact CD2-CG 4.4Å; L368-K395 CarbonylContact O-C 3.57Å; L368-K395 WeakPolarHBondContact O-CA 3.29Å; L368-L396 PolarHBondContact O-N 2.97Å; L368-F416 HydrophobicContact CD2-CZ 4.24Å
369	I	93.5	Very high	83.5	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.3	172.3	-57.4	176.2	0	0	0	107.9	C275 I279 L292 V293 V294 W303 Y367 L396 L398	C275-I369 HydrophobicContact CB-CD1 4.07Å; I279-I369 HydrophobicContact CD1-CD1 3.78Å; I279-I369 HydrophobicContact CG1-CD1 4.3Å; L292-I369 PolarHBondContact O-N 3.04Å; V293-I369 WeakPolarHBondContact CA-O 3.45Å; V293-I369 HydrophobicContact CG1-CB 4.48Å; V293-I369 HydrophobicContact CG2-CB 4.33Å; V293-I369 HydrophobicContact CG2-CD1 4.36Å; V294-I369 PolarHBondContact N-O 3.15Å; W303-I369 HydrophobicContact CH2-CG2 4.36Å; Y367-I369 HydrophobicContact CD1-CD1 3.99Å; Y367-I369 HydrophobicContact CD1-CG1 3.55Å; Y367-I369 HydrophobicContact CE1-CD1 4.03Å; Y367-I369 HydrophobicContact CE1-CG1 3.62Å; I369-L396 WeakPolarHBondContact CA-O 3.23Å; I369-L396 HydrophobicContact CG1-CB 4.35Å; I369-L396 HydrophobicContact CG1-CD2 4.35Å; I369-L398 HydrophobicContact CG2-CD1 3.78Å; I369-L398 HydrophobicContact CG2-CG 4.02Å
370	V	91.7	Very high	83	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114.7	172.1	-168.4	0	0	0	0	109.3	V294 F350 L368 I376 L387 L396 L397 L398 F416	V294-V370 HydrophobicContact CB-CG1 4.49Å; V294-V370 WeakPolarHBondContact O-CA 3.27Å; F350-V370 HydrophobicContact CE1-CG1 3.69Å; F350-V370 HydrophobicContact CZ-CG1 4.25Å; L368-V370 HydrophobicContact CD1-CG2 4.16Å; L368-V370 HydrophobicContact CD2-CG2 4.19Å; L368-V370 HydrophobicContact CG-CG2 3.97Å; V370-I376 HydrophobicContact CB-CD1 4.48Å; V370-I376 HydrophobicContact CG1-CD1 3.93Å; V370-L387 HydrophobicContact CG1-CD1 4.46Å; V370-L387 HydrophobicContact CG2-CD1 4.21Å; V370-L396 PolarHBondContact N-O 3.28Å; V370-L397 HydrophobicContact CB-CD2 3.75Å; V370-L397 HydrophobicContact CG1-CD2 4.5Å; V370-L397 HydrophobicContact CG2-CD2 4.15Å; V370-L398 PolarHBondContact O-N 3.09Å; V370-F416 HydrophobicContact CG2-CE1 4.36Å; V370-F416 HydrophobicContact CG2-CZ 4.28Å
371	D	90.2	Very high	82.8	Confident	11 Å²	11	45.7 Å²	45.7	6%	0.059	22%	0.22	C	C	.	.	S	Bend	trans	-81.3	153.2	176	-164.4	13.4	0	0	0	111	V294 A295 W303 F350 G373 L398	V294-D371 PolarHBondContact O-N 2.82Å; A295-D371 HydrophobicContact CB-CB 3.9Å; W303-D371 HydrophobicContact CZ2-CB 4.26Å; W303-D371 PolarHBondContact NE1-OD2 2.88Å; F350-D371 VanDerWaalsContact CZ-O 3.26Å; F350-D371 WeakPolarHBondContact CZ-O 3.24Å; D371-G373 PolarHBondContact O-N 3.15Å; D371-L398 HydrophobicContact CB-CD1 4.31Å
372	E	83	Confident	82.6	Confident	14 Å²	14	49.6 Å²	49.6	7%	0.065	23%	0.232	C	C	.	.			trans	49.5	56.2	-177.5	-66.1	-61.2	171.7	0	0	114.2	P296 H374 R375 L398	P296-E372 HydrophobicContact CG-CB 3.91Å; P296-E372 HydrophobicContact CG-CG 3.78Å; E372-H374 PolarHBondContact O-N 3.2Å; E372-H374 IonicContact OE2-CE1 3.62Å; E372-H374 PolarHBondContact OE2-CE1 3.21Å; E372-H374 IonicContact OE2-ND1 2.86Å; E372-H374 PolarHBondContact OE2-ND1 3.12Å; E372-R375 PolarHBondContact O-N 2.77Å; E372-L398 PolarHBondContact N-O 2.89Å; E372-L398 VanDerWaalsContact N-O 3.15Å
373	G	76.8	Confident	82.6	Confident	3 Å²	3	42.8 Å²	42.8	3%	0.031	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.4	-14.1	179.6	0	0	0	0	0	114.9	D371 R375 I376 L398	D371-G373 PolarHBondContact O-N 3.15Å; G373-R375 PolarHBondContact O-N 3.33Å; G373-I376 WeakPolarHBondContact O-CB 3.33Å; G373-I376 PolarHBondContact O-N 3Å; G373-L398 PolarHBondContact N-O 2.8Å
374	H	74.8	Confident	82.5	Confident	50 Å²	50	41.8 Å²	41.8	23%	0.231	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-61	-7.4	168.7	79.4	-97.9	0	0	0	113.4	E372 K377	E372-H374 PolarHBondContact O-N 3.2Å; E372-H374 IonicContact OE2-CE1 3.62Å; E372-H374 PolarHBondContact OE2-CE1 3.21Å; E372-H374 IonicContact OE2-ND1 2.86Å; E372-H374 PolarHBondContact OE2-ND1 3.12Å; H374-K377 WeakPolarHBondContact O-CD 3.28Å; H374-K377 VanDerWaalsContact O-CE 3.27Å; H374-K377 WeakPolarHBondContact O-CE 3.48Å; H374-K377 WeakPolarHBondContact O-CG 3.27Å
375	R	76.3	Confident	82.4	Confident	103 Å²	103	41.6 Å²	41.6	39%	0.389	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-82.1	-12.4	168.8	-66.5	-168.6	65.9	173.8	-0.2	114.1	F350 E372 G373 L383	F350-R375 VanDerWaalsContact CE2-CD 3.5Å; E372-R375 PolarHBondContact O-N 2.77Å; G373-R375 PolarHBondContact O-N 3.33Å; R375-L383 HydrophobicContact CB-CD2 4.48Å
376	I	75.6	Confident	82.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.191	C	C	.	.			trans	-94.2	4.9	-176.6	-66.5	174.6	0	0	0	112.2	V370 G373 N378 L383 V384 L387 L397 S412 L413 F416	V370-I376 HydrophobicContact CB-CD1 4.48Å; V370-I376 HydrophobicContact CG1-CD1 3.93Å; G373-I376 WeakPolarHBondContact O-CB 3.33Å; G373-I376 PolarHBondContact O-N 3Å; I376-N378 PolarHBondContact O-N 2.95Å; I376-L383 HydrophobicContact CG1-CD2 4.38Å; I376-V384 HydrophobicContact CB-CG2 4.15Å; I376-V384 HydrophobicContact CG1-CG2 4.25Å; I376-V384 HydrophobicContact CG2-CG1 4.41Å; I376-V384 HydrophobicContact CG2-CG2 3.71Å; I376-L387 HydrophobicContact CD1-CD1 4.45Å; I376-L397 HydrophobicContact CD1-CD2 3.84Å; I376-S412 WeakPolarHBondContact O-CB 3.23Å; I376-L413 HydrophobicContact CB-CD2 4.03Å; I376-L413 HydrophobicContact CG2-CD2 3.87Å; I376-F416 HydrophobicContact CD1-CE1 4.39Å; I376-F416 HydrophobicContact CG2-CB 4.3Å; I376-F416 HydrophobicContact CG2-CG 4.38Å
377	K	73.8	Confident	82	Confident	45 Å²	45	38.4 Å²	38.4	20%	0.196	18%	0.175	C	C	.	.			trans	-57.3	-20.8	-174.3	-60.2	177	171.9	-113.8	0	116	H374 E409 S412	H374-K377 WeakPolarHBondContact O-CD 3.28Å; H374-K377 VanDerWaalsContact O-CE 3.27Å; H374-K377 WeakPolarHBondContact O-CE 3.48Å; H374-K377 WeakPolarHBondContact O-CG 3.27Å; K377-E409 HydrophobicContact CB-CB 4.19Å; K377-E409 HydrophobicContact CB-CG 3.86Å; K377-E409 HydrophobicContact CD-CG 4.38Å; K377-E409 VanDerWaalsContact CD-OE2 3.26Å; K377-E409 WeakPolarHBondContact CD-OE2 3.16Å; K377-E409 WeakPolarHBondContact CE-OE1 3.39Å; K377-E409 WeakPolarHBondContact CE-OE2 3.26Å; K377-E409 HydrophobicContact CG-CB 4.49Å; K377-E409 HydrophobicContact CG-CG 3.68Å; K377-E409 WeakPolarHBondContact CG-OE1 3.13Å; K377-E409 IonicContact NZ-OE1 2.89Å; K377-E409 PolarHBondContact NZ-OE1 2.99Å; K377-E409 IonicContact NZ-OE2 3.45Å; K377-E409 PolarHBondContact NZ-OE2 3.29Å; K377-E409 WeakPolarHBondContact O-CA 3.2Å; K377-S412 PolarHBondContact O-OG 3.33Å; K377-S412 VanDerWaalsContact O-OG 3.06Å
378	N	73.3	Confident	81.7	Confident	90 Å²	90	41.4 Å²	41.4	48%	0.481	19%	0.188	S	C	.	.			trans	-118.4	119.3	-177.4	-173.3	-12	0	0	0	109.7	I376 N380 C381	I376-N378 PolarHBondContact O-N 2.95Å; N378-N380 PolarHBondContact O-N 3.12Å; N378-N380 WeakPolarHBondContact OD1-CB 3.44Å; N378-N380 PolarHBondContact OD1-N 2.9Å; N378-C381 HydrophobicContact CB-CB 4.38Å; N378-C381 WeakPolarHBondContact O-CB 3.29Å; N378-C381 PolarHBondContact O-N 3.16Å
379	L	68.7	Low	81.4	Confident	29 Å²	29	46.9 Å²	46.9	15%	0.152	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.8	176.5	-67.2	115.4	0	0	0	114.2	C381 W411 S412 N415 L425	L379-C381 PolarHBondContact O-N 3.45Å; L379-W411 HydrophobicContact CD1-CE3 3.28Å; L379-W411 HydrophobicContact CD1-CZ3 3.29Å; L379-W411 HydrophobicContact CD2-CE3 3.66Å; L379-W411 HydrophobicContact CD2-CH2 3.89Å; L379-W411 HydrophobicContact CD2-CZ3 3.09Å; L379-W411 HydrophobicContact CG-CE3 3.98Å; L379-W411 HydrophobicContact CG-CZ3 3.68Å; L379-S412 WeakPolarHBondContact CD1-OG 3.42Å; L379-S412 VanDerWaalsContact CG-OG 3.24Å; L379-S412 WeakPolarHBondContact CG-OG 3.38Å; L379-N415 HydrophobicContact CD2-CB 4.39Å; L379-N415 VanDerWaalsContact CD2-ND2 3.26Å; L379-N415 WeakPolarHBondContact CD2-ND2 3.5Å; L379-L425 HydrophobicContact CD1-CD1 3.74Å
380	N	74.7	Confident	81	Confident	118 Å²	118	47.1 Å²	47.1	63%	0.631	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-7.4	176	-64.6	-35.3	0	0	0	111.4	N378 R382 R385	N378-N380 PolarHBondContact O-N 3.12Å; N378-N380 WeakPolarHBondContact OD1-CB 3.44Å; N378-N380 PolarHBondContact OD1-N 2.9Å; N380-R382 PolarHBondContact O-N 2.83Å; N380-R385 PolarHBondContact OD1-NH2 2.71Å
381	C	78.8	Confident	80.8	Confident	40 Å²	40	49.4 Å²	49.4	27%	0.27	23%	0.231	S	C	.	.	S	Bend	trans	-63	127.1	171.9	-173.2	0	0	0	0	110	N378 L379 L383 V384	N378-C381 HydrophobicContact CB-CB 4.38Å; N378-C381 WeakPolarHBondContact O-CB 3.29Å; N378-C381 PolarHBondContact O-N 3.16Å; L379-C381 PolarHBondContact O-N 3.45Å; C381-L383 PolarHBondContact O-N 2.84Å; C381-L383 VanDerWaalsContact O-N 3.15Å; C381-L383 VanDerWaalsContact SG-CB 3.56Å; C381-V384 HydrophobicContact CB-CG2 4.19Å; C381-V384 PolarHBondContact O-N 3.37Å; C381-V384 VanDerWaalsContact O-N 3.16Å
382	R	82.7	Confident	80.8	Confident	145 Å²	145	50.1 Å²	50.1	55%	0.547	24%	0.236	S	C	.	.	H	α-helix	trans	-50.8	-39	174.3	-174.6	176	176	-175	-4.2	111.7	N380 V384 R385 E386	N380-R382 PolarHBondContact O-N 2.83Å; R382-V384 VanDerWaalsContact C-N 3.33Å; R382-V384 PolarHBondContact O-N 3.22Å; R382-R385 PolarHBondContact O-N 3.03Å; R382-E386 HydrophobicContact CG-CG 4.2Å; R382-E386 IonicContact NE-OE1 3.63Å; R382-E386 PolarHBondContact NE-OE1 3.07Å; R382-E386 WeakPolarHBondContact O-CG 3.27Å; R382-E386 PolarHBondContact O-N 2.86Å
383	L	84.7	Confident	81	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-51.5	-50.2	179.6	-178.3	58.3	0	0	0	112.7	F350 M354 R375 I376 C381 R385 E386 L387	F350-L383 HydrophobicContact CB-CD1 4.18Å; F350-L383 HydrophobicContact CD1-CD1 3.69Å; F350-L383 HydrophobicContact CD1-CD2 3.47Å; F350-L383 VanDerWaalsContact CD1-CD2 3.47Å; F350-L383 HydrophobicContact CD1-CG 4.21Å; F350-L383 HydrophobicContact CE1-CD2 3.79Å; F350-L383 HydrophobicContact CG-CD1 4.4Å; F350-L383 HydrophobicContact CG-CD2 4.22Å; M354-L383 HydrophobicContact CE-CB 3.37Å; M354-L383 HydrophobicContact CE-CD1 3.72Å; M354-L383 HydrophobicContact CE-CG 4.04Å; M354-L383 HydrophobicContact CG-CD1 4.44Å; R375-L383 HydrophobicContact CB-CD2 4.48Å; I376-L383 HydrophobicContact CG1-CD2 4.38Å; C381-L383 PolarHBondContact O-N 2.84Å; C381-L383 VanDerWaalsContact O-N 3.15Å; C381-L383 VanDerWaalsContact SG-CB 3.56Å; L383-R385 VanDerWaalsContact C-N 3.3Å; L383-R385 PolarHBondContact O-N 3.19Å; L383-E386 PolarHBondContact O-N 3.08Å; L383-L387 HydrophobicContact CD1-CD1 3.78Å; L383-L387 HydrophobicContact CD1-CG 3.93Å; L383-L387 HydrophobicContact CG-CD1 3.9Å; L383-L387 HydrophobicContact CG-CG 4.36Å; L383-L387 WeakPolarHBondContact O-CB 3.38Å; L383-L387 WeakPolarHBondContact O-CG 3.36Å; L383-L387 PolarHBondContact O-N 3.42Å
384	V	83.9	Confident	81.5	Confident	2 Å²	2	54 Å²	54	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-39.8	-174.2	-176.1	0	0	0	0	110	I376 C381 R382 K388 F416	I376-V384 HydrophobicContact CB-CG2 4.15Å; I376-V384 HydrophobicContact CG1-CG2 4.25Å; I376-V384 HydrophobicContact CG2-CG1 4.41Å; I376-V384 HydrophobicContact CG2-CG2 3.71Å; C381-V384 HydrophobicContact CB-CG2 4.19Å; C381-V384 PolarHBondContact O-N 3.37Å; C381-V384 VanDerWaalsContact O-N 3.16Å; R382-V384 VanDerWaalsContact C-N 3.33Å; R382-V384 PolarHBondContact O-N 3.22Å; V384-K388 HydrophobicContact CG1-CD 4.28Å; V384-K388 WeakPolarHBondContact O-CB 3.48Å; V384-K388 VanDerWaalsContact O-CG 3.26Å; V384-K388 WeakPolarHBondContact O-CG 3.48Å; V384-K388 PolarHBondContact O-N 3.37Å; V384-F416 HydrophobicContact CG1-CD2 3.99Å
385	R	84.4	Confident	82.3	Confident	135 Å²	135	52.5 Å²	52.5	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-63	-46	176.7	-62.1	-177.9	-178.6	-179.7	-1.4	111.4	N380 R382 L383 K388 M389	N380-R385 PolarHBondContact OD1-NH2 2.71Å; R382-R385 PolarHBondContact O-N 3.03Å; L383-R385 VanDerWaalsContact C-N 3.3Å; L383-R385 PolarHBondContact O-N 3.19Å; R385-K388 PolarHBondContact O-N 3.04Å; R385-M389 WeakPolarHBondContact O-CG 3.34Å; R385-M389 PolarHBondContact O-N 3.42Å
386	E	86.3	Confident	83.1	Confident	11 Å²	11	47.6 Å²	47.6	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-44.2	179.2	-54.2	-52.2	169.2	0	0	112	M354 R357 R382 L383 K388 M389	M354-E386 HydrophobicContact CB-CG 4.41Å; M354-E386 HydrophobicContact CG-CG 4.21Å; R357-E386 WeakPolarHBondContact CD-OE2 3.39Å; R357-E386 IonicContact CZ-OE1 2.7Å; R357-E386 IonicContact CZ-OE2 3.53Å; R357-E386 IonicContact NE-OE2 2.89Å; R357-E386 IonicContact NH1-OE1 2.7Å; R357-E386 PolarHBondContact NH1-OE1 3Å; R357-E386 IonicContact NH1-OE2 2.98Å; R357-E386 PolarHBondContact NH1-OE2 2.92Å; R382-E386 HydrophobicContact CG-CG 4.2Å; R382-E386 IonicContact NE-OE1 3.63Å; R382-E386 PolarHBondContact NE-OE1 3.07Å; R382-E386 WeakPolarHBondContact O-CG 3.27Å; R382-E386 PolarHBondContact O-N 2.86Å; L383-E386 PolarHBondContact O-N 3.08Å; E386-K388 VanDerWaalsContact C-N 3.29Å; E386-K388 PolarHBondContact O-N 3.4Å; E386-M389 PolarHBondContact O-N 3.3Å; E386-M389 VanDerWaalsContact O-N 3.16Å
387	L	86	Confident	83.8	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-29.8	179.8	-70.3	-179.6	0	0	0	112.7	V294 V370 I376 L383 M389 L390 F416	V294-L387 HydrophobicContact CG2-CD2 4.19Å; V370-L387 HydrophobicContact CG1-CD1 4.46Å; V370-L387 HydrophobicContact CG2-CD1 4.21Å; I376-L387 HydrophobicContact CD1-CD1 4.45Å; L383-L387 HydrophobicContact CD1-CD1 3.78Å; L383-L387 HydrophobicContact CD1-CG 3.93Å; L383-L387 HydrophobicContact CG-CD1 3.9Å; L383-L387 HydrophobicContact CG-CG 4.36Å; L383-L387 WeakPolarHBondContact O-CB 3.38Å; L383-L387 WeakPolarHBondContact O-CG 3.36Å; L383-L387 PolarHBondContact O-N 3.42Å; L387-M389 VanDerWaalsContact C-N 3.31Å; L387-L390 HydrophobicContact CD2-CD1 3.86Å; L387-L390 PolarHBondContact O-N 2.89Å; L387-F416 HydrophobicContact CB-CE2 3.61Å; L387-F416 HydrophobicContact CB-CZ 4Å; L387-F416 HydrophobicContact CD1-CE2 4.33Å; L387-F416 HydrophobicContact CD1-CZ 4.24Å
388	K	85.1	Confident	84.6	Confident	69 Å²	69	45.5 Å²	45.5	30%	0.3	22%	0.222	S	C	.	.	H	α-helix	trans	-67.9	-30.3	173.3	-82.2	-177.6	167.8	-160.3	0	112.9	V384 R385 E386 L390 N415 F416	V384-K388 HydrophobicContact CG1-CD 4.28Å; V384-K388 WeakPolarHBondContact O-CB 3.48Å; V384-K388 VanDerWaalsContact O-CG 3.26Å; V384-K388 WeakPolarHBondContact O-CG 3.48Å; V384-K388 PolarHBondContact O-N 3.37Å; R385-K388 PolarHBondContact O-N 3.04Å; E386-K388 VanDerWaalsContact C-N 3.29Å; E386-K388 PolarHBondContact O-N 3.4Å; K388-L390 VanDerWaalsContact C-N 3.26Å; K388-L390 PolarHBondContact O-N 3.31Å; K388-N415 WeakPolarHBondContact CE-O 3.49Å; K388-N415 PolarHBondContact NZ-ND2 2.62Å; K388-N415 PolarHBondContact NZ-O 3.19Å; K388-N415 PolarHBondContact NZ-OD1 2.94Å; K388-F416 HydrophobicContact CG-CD2 4Å; K388-F416 HydrophobicContact CG-CE2 4.32Å
389	M	84.8	Confident	85.1	Confident	114 Å²	114	41.7 Å²	41.7	56%	0.562	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.7	178.2	-66.4	-178.9	180	0	0	113.5	Q361 R385 E386 L387	Q361-M389 VanDerWaalsContact NE2-CB 3.34Å; R385-M389 WeakPolarHBondContact O-CG 3.34Å; R385-M389 PolarHBondContact O-N 3.42Å; E386-M389 PolarHBondContact O-N 3.3Å; E386-M389 VanDerWaalsContact O-N 3.16Å; L387-M389 VanDerWaalsContact C-N 3.31Å
390	L	86.5	Confident	85.3	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.042	20%	0.199	C	C	.	.	S	Bend	trans	-75.4	127.5	177.5	-64.5	174.6	0	0	0	110.2	L292 L360 Q361 L387 K388 T392	L292-L390 HydrophobicContact CD2-CD1 4Å; L360-L390 HydrophobicContact CB-CD2 3.7Å; Q361-L390 HydrophobicContact CG-CD2 4.07Å; L387-L390 HydrophobicContact CD2-CD1 3.86Å; L387-L390 PolarHBondContact O-N 2.89Å; K388-L390 VanDerWaalsContact C-N 3.26Å; K388-L390 PolarHBondContact O-N 3.31Å; L390-T392 HydrophobicContact CB-CG2 4.22Å; L390-T392 PolarHBondContact O-N 2.93Å
391	P	86.8	Confident	85	Confident	49 Å²	49	35.5 Å²	35.5	32%	0.318	17%	0.171	S	C	.	.			trans	-72.4	111.8	175	29.2	-31.7	0	0	0	109.3	Q361 L363 W365	Q361-P391 WeakPolarHBondContact O-CG 3.46Å; L363-P391 WeakPolarHBondContact O-CG 3.47Å; W365-P391 PolarHBondContact N-O 3.13Å
392	T	89.1	Confident	84.2	Confident	26 Å²	26	34.6 Å²	34.6	16%	0.16	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.9	-176.9	61.4	0	0	0	0	110.6	W365 L368 L390 K395	W365-T392 HydrophobicContact CB-CG2 4.01Å; W365-T392 VanDerWaalsContact O-CA 3.28Å; W365-T392 WeakPolarHBondContact O-CA 3.44Å; L368-T392 HydrophobicContact CB-CG2 3.69Å; L368-T392 HydrophobicContact CD2-CG2 3.95Å; L368-T392 HydrophobicContact CG-CG2 4.4Å; L390-T392 HydrophobicContact CB-CG2 4.22Å; L390-T392 PolarHBondContact O-N 2.93Å; T392-K395 WeakPolarHBondContact OG1-CE 3.5Å; T392-K395 PolarHBondContact OG1-NZ 2.78Å
393	D	87.3	Confident	83.2	Confident	85 Å²	85	29.5 Å²	29.5	46%	0.455	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-43.8	176.9	-64	-14.1	0	0	0	111.7	W365 K366	W365-D393 PolarHBondContact O-N 3.29Å; K366-D393 WeakPolarHBondContact CD-OD2 3.46Å; K366-D393 IonicContact NZ-OD2 2.75Å; K366-D393 PolarHBondContact NZ-OD2 3.43Å
394	N	89.1	Confident	81.9	Confident	13 Å²	13	31.9 Å²	31.9	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	150.9	176.7	-69.9	-76.4	0	0	0	111.8	N260 K366 Y367 L368	N260-N394 WeakPolarHBondContact OD1-CA 3.5Å; K366-N394 PolarHBondContact O-N 3Å; Y367-N394 HydrophobicContact CD2-CB 3.52Å; Y367-N394 HydrophobicContact CE2-CB 3.64Å; L368-N394 PolarHBondContact N-O 2.7Å
395	K	91.3	Very high	80.5	Confident	18 Å²	18	36.1 Å²	36.1	8%	0.078	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.3	179.1	-54.8	-177.8	-160.3	-78.9	0	110.8	N260 G261 L368 T392 F416	N260-K395 VanDerWaalsContact CA-O 3.29Å; N260-K395 WeakPolarHBondContact CA-O 3.4Å; N260-K395 HydrophobicContact CB-CB 4.39Å; N260-K395 VanDerWaalsContact CB-O 3.32Å; N260-K395 WeakPolarHBondContact CB-O 3.45Å; N260-K395 PolarHBondContact OD1-N 3.1Å; G261-K395 PolarHBondContact N-O 3.33Å; L368-K395 HydrophobicContact CB-CG 4.47Å; L368-K395 HydrophobicContact CD2-CG 4.4Å; L368-K395 CarbonylContact O-C 3.57Å; L368-K395 WeakPolarHBondContact O-CA 3.29Å; T392-K395 WeakPolarHBondContact OG1-CE 3.5Å; T392-K395 PolarHBondContact OG1-NZ 2.78Å; K395-F416 HydrophobicContact CD-CD1 4.48Å; K395-F416 HydrophobicContact CD-CE1 3.98Å; K395-F416 HydrophobicContact CD-CZ 4.14Å
396	L	92.1	Very high	79.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.2	173.5	178.7	64	0	0	0	109.7	L251 L263 Y367 L368 I369 V370 L398	L251-L396 HydrophobicContact CD1-CD2 4.43Å; L251-L396 HydrophobicContact CD2-CD1 3.53Å; L251-L396 HydrophobicContact CD2-CD2 3.84Å; L251-L396 HydrophobicContact CD2-CG 4.35Å; L263-L396 HydrophobicContact CB-CD1 4.47Å; Y367-L396 HydrophobicContact CE1-CB 3.69Å; Y367-L396 HydrophobicContact CE1-CD2 4.05Å; L368-L396 PolarHBondContact O-N 2.97Å; I369-L396 WeakPolarHBondContact CA-O 3.23Å; I369-L396 HydrophobicContact CG1-CB 4.35Å; I369-L396 HydrophobicContact CG1-CD2 4.35Å; V370-L396 PolarHBondContact N-O 3.28Å; L396-L398 HydrophobicContact CD1-CD2 4.46Å; L396-L398 HydrophobicContact CD2-CD2 3.85Å; L396-L398 HydrophobicContact CG-CD2 3.87Å
397	L	91	Very high	78.7	Confident	2 Å²	2	36 Å²	36	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.6	172.1	-67.3	-178	0	0	0	110.4	G261 I262 L263 V370 I376 L413 F416 L417	G261-L397 PolarHBondContact O-N 3.27Å; I262-L397 CarbonylContact C-O 3.59Å; I262-L397 WeakPolarHBondContact CA-O 3.36Å; I262-L397 HydrophobicContact CG1-CB 4.4Å; I262-L397 HydrophobicContact CG2-CB 4.45Å; L263-L397 PolarHBondContact N-O 3.35Å; V370-L397 HydrophobicContact CB-CD2 3.75Å; V370-L397 HydrophobicContact CG1-CD2 4.5Å; V370-L397 HydrophobicContact CG2-CD2 4.15Å; I376-L397 HydrophobicContact CD1-CD2 3.84Å; L397-L413 HydrophobicContact CD1-CD2 3.78Å; L397-F416 HydrophobicContact CD1-CD1 3.95Å; L397-F416 HydrophobicContact CD2-CD1 3.78Å; L397-F416 HydrophobicContact CD2-CE1 3.58Å; L397-F416 HydrophobicContact CG-CD1 4.12Å; L397-F416 HydrophobicContact CG-CE1 4.27Å; L397-L417 HydrophobicContact CD1-CD1 4.18Å; L397-L417 HydrophobicContact CD1-CD2 4.01Å; L397-L417 HydrophobicContact CD1-CG 4.01Å; L397-L417 HydrophobicContact CG-CD2 3.93Å; L397-L417 HydrophobicContact CG-CG 4.48Å
398	L	89.9	Confident	78	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.8	172.3	-44.5	178.3	0	0	0	109.1	L263 K271 C275 W303 I369 V370 D371 E372 G373 L396	L263-L398 HydrophobicContact CB-CD2 3.77Å; L263-L398 HydrophobicContact CD2-CD2 4.06Å; L263-L398 HydrophobicContact CG-CD2 4.48Å; L263-L398 WeakPolarHBondContact O-CA 3.26Å; K271-L398 HydrophobicContact CD-CB 4.44Å; C275-L398 WeakPolarHBondContact SG-CD2 3.37Å; W303-L398 HydrophobicContact CH2-CD1 3.87Å; W303-L398 HydrophobicContact CZ2-CD1 3.68Å; I369-L398 HydrophobicContact CG2-CD1 3.78Å; I369-L398 HydrophobicContact CG2-CG 4.02Å; V370-L398 PolarHBondContact O-N 3.09Å; D371-L398 HydrophobicContact CB-CD1 4.31Å; E372-L398 PolarHBondContact N-O 2.89Å; E372-L398 VanDerWaalsContact N-O 3.15Å; G373-L398 PolarHBondContact N-O 2.8Å; L396-L398 HydrophobicContact CD1-CD2 4.46Å; L396-L398 HydrophobicContact CD2-CD2 3.85Å; L396-L398 HydrophobicContact CG-CD2 3.87Å
399	T	84.9	Confident	77.6	Confident	10 Å²	10	33.9 Å²	33.9	6%	0.061	19%	0.186	C	C	.	.			trans	-135.1	137.7	173.7	-177	0	0	0	0	110.6	I262 L263 A264 T401	I262-T399 HydrophobicContact CG2-CG2 3.97Å; L263-T399 PolarHBondContact O-N 2.69Å; A264-T399 CarbonylContact C-O 3.53Å; A264-T399 VanDerWaalsContact CA-O 3.31Å; A264-T399 WeakPolarHBondContact CA-O 3.31Å; A264-T399 HydrophobicContact CB-CG2 3.56Å; T399-T401 PolarHBondContact OG1-N 3.03Å; T399-T401 PolarHBondContact OG1-O 3.43Å; T399-T401 VanDerWaalsContact OG1-O 3.08Å; T399-T401 PolarHBondContact OG1-OG1 3.09Å
400	G	72.3	Confident	77.1	Confident	8 Å²	8	29.2 Å²	29.2	8%	0.082	16%	0.163	C	C	.	.	S	Bend	trans	-92.4	-17.4	170.4	0	0	0	0	0	113.4
401	T	67.2	Low	76.7	Confident	8 Å²	8	29.5 Å²	29.5	5%	0.049	16%	0.164	C	C	.	.	S	Bend	trans	-102.4	142.2	-174.2	53	0	0	0	0	110.5	T399 Q719	T399-T401 PolarHBondContact OG1-N 3.03Å; T399-T401 PolarHBondContact OG1-O 3.43Å; T399-T401 VanDerWaalsContact OG1-O 3.08Å; T399-T401 PolarHBondContact OG1-OG1 3.09Å; T401-Q719 HydrophobicContact CG2-CB 4.17Å; T401-Q719 HydrophobicContact CG2-CG 4.36Å
402	P	62.8	Low	76.4	Confident	22 Å²	22	27.2 Å²	27.2	14%	0.143	15%	0.149	C	C	.	.			trans	-54.8	145.2	169.9	23.3	-29.4	0	0	0	110.4	Q404 R466 I767	P402-Q404 PolarHBondContact O-N 3Å; P402-Q404 VanDerWaalsContact O-N 3.09Å; P402-R466 VanDerWaalsContact CA-NH1 3.26Å; P402-I767 HydrophobicContact CB-CD1 4.05Å; P402-I767 HydrophobicContact CB-CG1 4.44Å; P402-I767 HydrophobicContact CG-CD1 4.17Å
403	L	62.6	Low	76	Confident	37 Å²	37	26.4 Å²	26.4	19%	0.194	14%	0.144	C	C	.	.			trans	-56.5	114.4	168.2	-68	163.1	0	0	0	106.8	L410 L413 L464	L403-L410 HydrophobicContact CD1-CD1 3.72Å; L403-L410 HydrophobicContact CD2-CD1 4.15Å; L403-L410 HydrophobicContact CG-CD1 4.35Å; L403-L413 HydrophobicContact CD2-CD1 3.2Å; L403-L464 HydrophobicContact CD1-CD1 3.41Å; L403-L464 VanDerWaalsContact CD1-CD1 3.41Å; L403-L464 HydrophobicContact CG-CD1 4.36Å
404	Q	55.9	Low	75.6	Confident	51 Å²	51	22.6 Å²	22.6	24%	0.238	12%	0.123	C	C	.	.			trans	-67.3	153.5	-179.8	-65.4	-176.2	-37.7	0	0	109.1	P402 N406 E409	P402-Q404 PolarHBondContact O-N 3Å; P402-Q404 VanDerWaalsContact O-N 3.09Å; Q404-N406 PolarHBondContact O-N 3.42Å; Q404-E409 PolarHBondContact OE1-OE2 2.55Å
405	N	55.6	Low	75.4	Confident	92 Å²	92	22.6 Å²	22.6	49%	0.492	12%	0.123	S	C	.	.	S	Bend	trans	-63.4	14.5	179.9	-68.1	-8.9	0	0	0	115.1	L407 V766	N405-L407 PolarHBondContact O-N 3.01Å; N405-V766 VanDerWaalsContact CG-CG2 3.44Å; N405-V766 WeakPolarHBondContact ND2-CG2 3.25Å; N405-V766 WeakPolarHBondContact OD1-CG2 3.16Å
406	N	65.2	Low	75.1	Confident	92 Å²	92	21.7 Å²	21.7	49%	0.492	12%	0.119	S	C	.	.			trans	-86	107.5	171.9	-170.3	-9.8	0	0	0	109	Q404 A408 E409 L410	Q404-N406 PolarHBondContact O-N 3.42Å; N406-A408 PolarHBondContact O-N 3.15Å; N406-A408 WeakPolarHBondContact OD1-CB 3.38Å; N406-A408 PolarHBondContact OD1-N 3.41Å; N406-A408 VanDerWaalsContact OD1-N 3.11Å; N406-E409 HydrophobicContact CB-CB 4.11Å; N406-E409 WeakPolarHBondContact O-CA 3.49Å; N406-E409 WeakPolarHBondContact O-CB 3.26Å; N406-E409 PolarHBondContact O-N 2.89Å; N406-L410 PolarHBondContact O-N 2.82Å; N406-L410 VanDerWaalsContact O-N 3.13Å
407	L	66.9	Low	74.6	Confident	50 Å²	50	22 Å²	22	26%	0.262	12%	0.121	S	C	.	.	H	α-helix	trans	-57.5	-32.4	178.5	-66.6	163.4	0	0	0	112.4	N405 E409 L410 W411 F428 F432 L456	N405-L407 PolarHBondContact O-N 3.01Å; L407-E409 VanDerWaalsContact C-N 3.31Å; L407-E409 PolarHBondContact O-N 3.01Å; L407-L410 PolarHBondContact O-N 3.34Å; L407-W411 WeakPolarHBondContact O-CB 3.38Å; L407-W411 PolarHBondContact O-N 3.11Å; L407-F428 HydrophobicContact CB-CE1 4.31Å; L407-F428 HydrophobicContact CD2-CE1 4.47Å; L407-F432 HydrophobicContact CD1-CB 3.24Å; L407-F432 HydrophobicContact CD1-CD1 3.6Å; L407-F432 HydrophobicContact CD1-CD2 3.83Å; L407-F432 HydrophobicContact CD1-CE1 4.42Å; L407-F432 HydrophobicContact CD1-CG 3.28Å; L407-F432 HydrophobicContact CD2-CD1 3.52Å; L407-F432 HydrophobicContact CD2-CD2 3.98Å; L407-F432 HydrophobicContact CD2-CE1 3.48Å; L407-F432 VanDerWaalsContact CD2-CE1 3.48Å; L407-F432 HydrophobicContact CD2-CE2 4.01Å; L407-F432 HydrophobicContact CD2-CG 3.81Å; L407-F432 HydrophobicContact CD2-CZ 3.8Å; L407-F432 HydrophobicContact CG-CD1 4.2Å; L407-F432 HydrophobicContact CG-CD2 4.37Å; L407-F432 HydrophobicContact CG-CG 4.12Å; L407-L456 HydrophobicContact CD2-CD1 4.02Å
408	A	72.4	Confident	74	Confident	21 Å²	21	23.8 Å²	23.8	17%	0.174	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-33.7	174.6	0	0	0	0	0	112.2	N406 S412 L425	N406-A408 PolarHBondContact O-N 3.15Å; N406-A408 WeakPolarHBondContact OD1-CB 3.38Å; N406-A408 PolarHBondContact OD1-N 3.41Å; N406-A408 VanDerWaalsContact OD1-N 3.11Å; A408-S412 WeakPolarHBondContact O-CB 3.26Å; A408-S412 PolarHBondContact O-N 2.93Å; A408-S412 PolarHBondContact O-OG 2.9Å; A408-L425 HydrophobicContact CB-CD1 4.38Å
409	E	75.4	Confident	73.2	Confident	6 Å²	6	27 Å²	27	3%	0.028	15%	0.151	C	C	.	.	H	α-helix	trans	-69.6	-45	173.7	165.5	175.6	172.7	0	0	111	K377 Q404 N406 L407 W411 S412 L413	K377-E409 HydrophobicContact CB-CB 4.19Å; K377-E409 HydrophobicContact CB-CG 3.86Å; K377-E409 HydrophobicContact CD-CG 4.38Å; K377-E409 VanDerWaalsContact CD-OE2 3.26Å; K377-E409 WeakPolarHBondContact CD-OE2 3.16Å; K377-E409 WeakPolarHBondContact CE-OE1 3.39Å; K377-E409 WeakPolarHBondContact CE-OE2 3.26Å; K377-E409 HydrophobicContact CG-CB 4.49Å; K377-E409 HydrophobicContact CG-CG 3.68Å; K377-E409 WeakPolarHBondContact CG-OE1 3.13Å; K377-E409 IonicContact NZ-OE1 2.89Å; K377-E409 PolarHBondContact NZ-OE1 2.99Å; K377-E409 IonicContact NZ-OE2 3.45Å; K377-E409 PolarHBondContact NZ-OE2 3.29Å; K377-E409 WeakPolarHBondContact O-CA 3.2Å; Q404-E409 PolarHBondContact OE1-OE2 2.55Å; N406-E409 HydrophobicContact CB-CB 4.11Å; N406-E409 WeakPolarHBondContact O-CA 3.49Å; N406-E409 WeakPolarHBondContact O-CB 3.26Å; N406-E409 PolarHBondContact O-N 2.89Å; L407-E409 VanDerWaalsContact C-N 3.31Å; L407-E409 PolarHBondContact O-N 3.01Å; E409-W411 VanDerWaalsContact C-N 3.33Å; E409-W411 PolarHBondContact O-N 2.87Å; E409-S412 WeakPolarHBondContact O-CB 3.2Å; E409-S412 PolarHBondContact O-N 3.1Å; E409-L413 HydrophobicContact CG-CD1 4.09Å; E409-L413 WeakPolarHBondContact O-CG 3.28Å; E409-L413 PolarHBondContact O-N 3.41Å
410	L	74.8	Confident	72.5	Confident	15 Å²	15	35.5 Å²	35.5	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-46.7	177.6	-176.8	68.1	0	0	0	111	L403 N406 L407 S412 L413 L414 F428 L456 L460	L403-L410 HydrophobicContact CD1-CD1 3.72Å; L403-L410 HydrophobicContact CD2-CD1 4.15Å; L403-L410 HydrophobicContact CG-CD1 4.35Å; N406-L410 PolarHBondContact O-N 2.82Å; N406-L410 VanDerWaalsContact O-N 3.13Å; L407-L410 PolarHBondContact O-N 3.34Å; L410-S412 VanDerWaalsContact C-N 3.34Å; L410-S412 PolarHBondContact O-N 3.45Å; L410-L413 PolarHBondContact O-N 2.75Å; L410-L414 HydrophobicContact CG-CD1 4.15Å; L410-L414 WeakPolarHBondContact O-CB 3.36Å; L410-L414 WeakPolarHBondContact O-CG 3.47Å; L410-L414 PolarHBondContact O-N 3.49Å; L410-F428 HydrophobicContact CD2-CZ 4.45Å; L410-L456 HydrophobicContact CD2-CD1 3.71Å; L410-L456 HydrophobicContact CD2-CD2 4.06Å; L410-L456 HydrophobicContact CD2-CG 4.43Å; L410-L460 HydrophobicContact CD1-CD1 3.76Å; L410-L460 HydrophobicContact CD1-CD2 4.11Å; L410-L460 HydrophobicContact CD2-CD1 4.07Å; L410-L460 HydrophobicContact CG-CD1 4.47Å
411	W	79.1	Confident	72.4	Confident	14 Å²	14	38.3 Å²	38.3	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-39.6	176	-173.5	82.7	0	0	0	111.8	L379 L407 E409 L413 L414 N415 F422 D423 D424 L425 F428	L379-W411 HydrophobicContact CD1-CE3 3.28Å; L379-W411 HydrophobicContact CD1-CZ3 3.29Å; L379-W411 HydrophobicContact CD2-CE3 3.66Å; L379-W411 HydrophobicContact CD2-CH2 3.89Å; L379-W411 HydrophobicContact CD2-CZ3 3.09Å; L379-W411 HydrophobicContact CG-CE3 3.98Å; L379-W411 HydrophobicContact CG-CZ3 3.68Å; L407-W411 WeakPolarHBondContact O-CB 3.38Å; L407-W411 PolarHBondContact O-N 3.11Å; E409-W411 VanDerWaalsContact C-N 3.33Å; E409-W411 PolarHBondContact O-N 2.87Å; W411-L413 VanDerWaalsContact C-N 3.27Å; W411-L413 PolarHBondContact O-N 3.44Å; W411-L414 PolarHBondContact O-N 3.3Å; W411-N415 HydrophobicContact CD2-CB 4.26Å; W411-N415 HydrophobicContact CE3-CB 4.41Å; W411-N415 HydrophobicContact CH2-CB 4.31Å; W411-N415 WeakPolarHBondContact CH2-ND2 3.21Å; W411-N415 HydrophobicContact CZ2-CB 4.11Å; W411-N415 WeakPolarHBondContact CZ2-ND2 3.4Å; W411-N415 HydrophobicContact CZ3-CB 4.46Å; W411-N415 WeakPolarHBondContact CZ3-ND2 3.23Å; W411-N415 WeakPolarHBondContact O-CB 3.11Å; W411-N415 PolarHBondContact O-N 3.34Å; W411-F422 WeakPolarHBondContact CZ2-O 3.41Å; W411-D423 WeakPolarHBondContact CZ2-O 3.15Å; W411-D424 VanDerWaalsContact CZ2-C 3.45Å; W411-L425 HydrophobicContact CD2-CB 4.06Å; W411-L425 HydrophobicContact CD2-CD1 4.4Å; W411-L425 HydrophobicContact CD2-CG 4.48Å; W411-L425 HydrophobicContact CE3-CB 3.72Å; W411-L425 HydrophobicContact CE3-CD1 3.59Å; W411-L425 HydrophobicContact CE3-CG 4.05Å; W411-L425 HydrophobicContact CH2-CB 3.74Å; W411-L425 HydrophobicContact CZ2-CB 4.09Å; W411-L425 HydrophobicContact CZ3-CB 3.52Å; W411-L425 HydrophobicContact CZ3-CD1 3.81Å; W411-L425 HydrophobicContact CZ3-CG 4.22Å; W411-F428 HydrophobicContact CB-CD1 3.71Å; W411-F428 HydrophobicContact CB-CE1 3.83Å; W411-F428 HydrophobicContact CB-CG 4.2Å; W411-F428 HydrophobicContact CB-CZ 4.43Å; W411-F428 VanDerWaalsContact CD1-CB 3.44Å; W411-F428 AromaticContact CD1-CD1 3.73Å; W411-F428 AromaticContact CD1-CD2 3.52Å; W411-F428 AromaticContact CD1-CG 3.28Å; W411-F428 HydrophobicContact CG-CB 4.15Å; W411-F428 AromaticContact CG-CD1 3.96Å; W411-F428 HydrophobicContact CG-CD1 3.96Å; W411-F428 HydrophobicContact CG-CD2 4.46Å; W411-F428 HydrophobicContact CG-CE1 4.46Å; W411-F428 AromaticContact CG-CG 3.95Å; W411-F428 HydrophobicContact CG-CG 3.95Å
412	S	80.4	Confident	72.6	Confident	1 Å²	1	39 Å²	39	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-54.8	-44.6	174.6	-61.4	0	0	0	0	112	I376 K377 L379 A408 E409 L410 F416	I376-S412 WeakPolarHBondContact O-CB 3.23Å; K377-S412 PolarHBondContact O-OG 3.33Å; K377-S412 VanDerWaalsContact O-OG 3.06Å; L379-S412 WeakPolarHBondContact CD1-OG 3.42Å; L379-S412 VanDerWaalsContact CG-OG 3.24Å; L379-S412 WeakPolarHBondContact CG-OG 3.38Å; A408-S412 WeakPolarHBondContact O-CB 3.26Å; A408-S412 PolarHBondContact O-N 2.93Å; A408-S412 PolarHBondContact O-OG 2.9Å; E409-S412 WeakPolarHBondContact O-CB 3.2Å; E409-S412 PolarHBondContact O-N 3.1Å; L410-S412 VanDerWaalsContact C-N 3.34Å; L410-S412 PolarHBondContact O-N 3.45Å; S412-F416 WeakPolarHBondContact O-CB 3.5Å; S412-F416 PolarHBondContact O-N 3.33Å; S412-F416 VanDerWaalsContact O-N 3.08Å
413	L	80.3	Confident	72.9	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-72.5	-43.5	-179.1	-67.4	165.3	0	0	0	111.4	I376 L397 L403 E409 L410 W411 F416 L417	I376-L413 HydrophobicContact CB-CD2 4.03Å; I376-L413 HydrophobicContact CG2-CD2 3.87Å; L397-L413 HydrophobicContact CD1-CD2 3.78Å; L403-L413 HydrophobicContact CD2-CD1 3.2Å; E409-L413 HydrophobicContact CG-CD1 4.09Å; E409-L413 WeakPolarHBondContact O-CG 3.28Å; E409-L413 PolarHBondContact O-N 3.41Å; L410-L413 PolarHBondContact O-N 2.75Å; W411-L413 VanDerWaalsContact C-N 3.27Å; W411-L413 PolarHBondContact O-N 3.44Å; L413-F416 WeakPolarHBondContact O-CB 3.19Å; L413-F416 PolarHBondContact O-N 3.16Å; L413-L417 WeakPolarHBondContact O-CG 3.39Å; L413-L417 PolarHBondContact O-N 2.91Å; L413-L417 VanDerWaalsContact O-N 3.12Å
414	L	78.8	Confident	73.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-46.4	176.8	-76.6	176.6	0	0	0	112.3	L410 W411 F416 L417 L418 F422 L460	L410-L414 HydrophobicContact CG-CD1 4.15Å; L410-L414 WeakPolarHBondContact O-CB 3.36Å; L410-L414 WeakPolarHBondContact O-CG 3.47Å; L410-L414 PolarHBondContact O-N 3.49Å; W411-L414 PolarHBondContact O-N 3.3Å; L414-F416 PolarHBondContact O-N 3.48Å; L414-L417 PolarHBondContact O-N 3.47Å; L414-L417 VanDerWaalsContact O-N 3.11Å; L414-L418 PolarHBondContact O-N 3.02Å; L414-F422 HydrophobicContact CB-CD2 4.05Å; L414-F422 HydrophobicContact CB-CE2 4.27Å; L414-F422 HydrophobicContact CB-CG 4.3Å; L414-F422 HydrophobicContact CD1-CE1 4.36Å; L414-F422 HydrophobicContact CD1-CZ 4.23Å; L414-F422 HydrophobicContact CD2-CE2 4.44Å; L414-L460 HydrophobicContact CD1-CD2 4.2Å; L414-L460 HydrophobicContact CD2-CD2 3.64Å; L414-L460 HydrophobicContact CG-CD2 4.18Å
415	N	84.1	Confident	74.3	Confident	13 Å²	13	44.5 Å²	44.5	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-27	175.6	-177.9	9.6	0	0	0	112	L379 K388 W411 P419 F422	L379-N415 HydrophobicContact CD2-CB 4.39Å; L379-N415 VanDerWaalsContact CD2-ND2 3.26Å; L379-N415 WeakPolarHBondContact CD2-ND2 3.5Å; K388-N415 WeakPolarHBondContact CE-O 3.49Å; K388-N415 PolarHBondContact NZ-ND2 2.62Å; K388-N415 PolarHBondContact NZ-O 3.19Å; K388-N415 PolarHBondContact NZ-OD1 2.94Å; W411-N415 HydrophobicContact CD2-CB 4.26Å; W411-N415 HydrophobicContact CE3-CB 4.41Å; W411-N415 HydrophobicContact CH2-CB 4.31Å; W411-N415 WeakPolarHBondContact CH2-ND2 3.21Å; W411-N415 HydrophobicContact CZ2-CB 4.11Å; W411-N415 WeakPolarHBondContact CZ2-ND2 3.4Å; W411-N415 HydrophobicContact CZ3-CB 4.46Å; W411-N415 WeakPolarHBondContact CZ3-ND2 3.23Å; W411-N415 WeakPolarHBondContact O-CB 3.11Å; W411-N415 PolarHBondContact O-N 3.34Å; N415-P419 WeakPolarHBondContact O-CA 3.17Å; N415-F422 HydrophobicContact CB-CB 4.22Å; N415-F422 WeakPolarHBondContact CB-O 3.46Å; N415-F422 PolarHBondContact OD1-O 2.65Å
416	F	84.6	Confident	75.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-37.8	171.9	-178.8	-98.9	0	0	0	112.4	L368 V370 I376 V384 L387 K388 K395 L397 S412 L413 L414	L368-F416 HydrophobicContact CD2-CZ 4.24Å; V370-F416 HydrophobicContact CG2-CE1 4.36Å; V370-F416 HydrophobicContact CG2-CZ 4.28Å; I376-F416 HydrophobicContact CD1-CE1 4.39Å; I376-F416 HydrophobicContact CG2-CB 4.3Å; I376-F416 HydrophobicContact CG2-CG 4.38Å; V384-F416 HydrophobicContact CG1-CD2 3.99Å; L387-F416 HydrophobicContact CB-CE2 3.61Å; L387-F416 HydrophobicContact CB-CZ 4Å; L387-F416 HydrophobicContact CD1-CE2 4.33Å; L387-F416 HydrophobicContact CD1-CZ 4.24Å; K388-F416 HydrophobicContact CG-CD2 4Å; K388-F416 HydrophobicContact CG-CE2 4.32Å; K395-F416 HydrophobicContact CD-CD1 4.48Å; K395-F416 HydrophobicContact CD-CE1 3.98Å; K395-F416 HydrophobicContact CD-CZ 4.14Å; L397-F416 HydrophobicContact CD1-CD1 3.95Å; L397-F416 HydrophobicContact CD2-CD1 3.78Å; L397-F416 HydrophobicContact CD2-CE1 3.58Å; L397-F416 HydrophobicContact CG-CD1 4.12Å; L397-F416 HydrophobicContact CG-CE1 4.27Å; S412-F416 WeakPolarHBondContact O-CB 3.5Å; S412-F416 PolarHBondContact O-N 3.33Å; S412-F416 VanDerWaalsContact O-N 3.08Å; L413-F416 WeakPolarHBondContact O-CB 3.19Å; L413-F416 PolarHBondContact O-N 3.16Å; L414-F416 PolarHBondContact O-N 3.48Å
417	L	81.8	Confident	75.4	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-78.9	-44.8	179.5	-66.2	164.1	0	0	0	112.1	N260 I262 L397 L413 L414	N260-L417 HydrophobicContact CB-CB 4.12Å; N260-L417 HydrophobicContact CB-CD2 3.74Å; N260-L417 PolarHBondContact ND2-O 2.98Å; I262-L417 HydrophobicContact CD1-CD1 3.53Å; I262-L417 HydrophobicContact CG1-CD1 3.38Å; L397-L417 HydrophobicContact CD1-CD1 4.18Å; L397-L417 HydrophobicContact CD1-CD2 4.01Å; L397-L417 HydrophobicContact CD1-CG 4.01Å; L397-L417 HydrophobicContact CG-CD2 3.93Å; L397-L417 HydrophobicContact CG-CG 4.48Å; L413-L417 WeakPolarHBondContact O-CG 3.39Å; L413-L417 PolarHBondContact O-N 2.91Å; L413-L417 VanDerWaalsContact O-N 3.12Å; L414-L417 PolarHBondContact O-N 3.47Å; L414-L417 VanDerWaalsContact O-N 3.11Å
418	L	78.5	Confident	75.5	Confident	41 Å²	41	42.5 Å²	42.5	22%	0.215	22%	0.222	C	C	.	.			trans	-133.2	74.8	-173.4	-65.6	174	0	0	0	109.8	L414 E420 V421 F422 F463	L414-L418 PolarHBondContact O-N 3.02Å; L418-E420 PolarHBondContact O-N 3Å; L418-V421 HydrophobicContact CB-CB 4.44Å; L418-V421 HydrophobicContact CB-CG2 4.47Å; L418-V421 PolarHBondContact O-N 2.96Å; L418-F422 HydrophobicContact CB-CD2 4.22Å; L418-F422 PolarHBondContact O-N 2.98Å; L418-F463 HydrophobicContact CD1-CE1 4.3Å; L418-F463 HydrophobicContact CD1-CZ 4.27Å
419	P	73.9	Confident	75.4	Confident	66 Å²	66	44.3 Å²	44.3	43%	0.429	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.7	-177.3	25.3	-34	0	0	0	113.4	N415	N415-P419 WeakPolarHBondContact O-CA 3.17Å
420	E	70.3	Confident	75	Confident	189 Å²	189	45.7 Å²	45.7	88%	0.883	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-27.5	-179.2	-61.9	-172.1	167.4	0	0	113.6	L418	L418-E420 PolarHBondContact O-N 3Å
421	V	70.4	Confident	74.4	Confident	68 Å²	68	47.7 Å²	47.7	41%	0.412	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-30.7	-178.6	-178.5	0	0	0	0	111.1	L95 L418	L95-V421 HydrophobicContact CD2-CG1 4.25Å; L418-V421 HydrophobicContact CB-CB 4.44Å; L418-V421 HydrophobicContact CB-CG2 4.47Å; L418-V421 PolarHBondContact O-N 2.96Å
422	F	70.3	Confident	73.6	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.096	25%	0.248	C	C	.	.			trans	-124.2	74.8	-171.4	-61.1	-77.2	0	0	0	110.9	W411 L414 N415 L418 F428	W411-F422 WeakPolarHBondContact CZ2-O 3.41Å; L414-F422 HydrophobicContact CB-CD2 4.05Å; L414-F422 HydrophobicContact CB-CE2 4.27Å; L414-F422 HydrophobicContact CB-CG 4.3Å; L414-F422 HydrophobicContact CD1-CE1 4.36Å; L414-F422 HydrophobicContact CD1-CZ 4.23Å; L414-F422 HydrophobicContact CD2-CE2 4.44Å; N415-F422 HydrophobicContact CB-CB 4.22Å; N415-F422 WeakPolarHBondContact CB-O 3.46Å; N415-F422 PolarHBondContact OD1-O 2.65Å; L418-F422 HydrophobicContact CB-CD2 4.22Å; L418-F422 PolarHBondContact O-N 2.98Å; F422-F428 HydrophobicContact CD1-CD2 4.45Å; F422-F428 HydrophobicContact CE1-CE2 4.45Å
423	D	70.3	Confident	72.5	Confident	119 Å²	119	53.7 Å²	53.7	64%	0.636	28%	0.276	S	S	*	.			trans	-89.8	-38.6	-174.7	59.2	-16.1	0	0	0	113.7	W411	W411-D423 WeakPolarHBondContact CZ2-O 3.15Å
424	D	73.7	Confident	71.2	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	29%	0.286	S	S	.	.			trans	-114	118.3	-176	-176.1	26.9	0	0	0	114.3	W411 K426 S427 F428	W411-D424 VanDerWaalsContact CZ2-C 3.45Å; D424-K426 PolarHBondContact OD1-N 3.47Å; D424-S427 VanDerWaalsContact OD2-CB 3.25Å; D424-S427 WeakPolarHBondContact OD2-CB 3.28Å; D424-S427 PolarHBondContact OD2-N 3.48Å; D424-S427 PolarHBondContact OD2-OG 3.29Å; D424-F428 PolarHBondContact O-N 2.94Å
425	L	73.2	Confident	69.9	Low	45 Å²	45	61.2 Å²	61.2	24%	0.236	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-38.4	174.4	177.7	137.3	0	0	0	111.4	L379 A408 W411 F428 E429	L379-L425 HydrophobicContact CD1-CD1 3.74Å; A408-L425 HydrophobicContact CB-CD1 4.38Å; W411-L425 HydrophobicContact CD2-CB 4.06Å; W411-L425 HydrophobicContact CD2-CD1 4.4Å; W411-L425 HydrophobicContact CD2-CG 4.48Å; W411-L425 HydrophobicContact CE3-CB 3.72Å; W411-L425 HydrophobicContact CE3-CD1 3.59Å; W411-L425 HydrophobicContact CE3-CG 4.05Å; W411-L425 HydrophobicContact CH2-CB 3.74Å; W411-L425 HydrophobicContact CZ2-CB 4.09Å; W411-L425 HydrophobicContact CZ3-CB 3.52Å; W411-L425 HydrophobicContact CZ3-CD1 3.81Å; W411-L425 HydrophobicContact CZ3-CG 4.22Å; L425-F428 CarbonylContact O-C 3.44Å; L425-F428 WeakPolarHBondContact O-CB 3.29Å; L425-F428 PolarHBondContact O-N 3.39Å; L425-E429 HydrophobicContact CD2-CG 4.14Å; L425-E429 WeakPolarHBondContact CD2-OE1 3.42Å; L425-E429 WeakPolarHBondContact CD2-OE2 3.36Å; L425-E429 HydrophobicContact CG-CG 4.25Å; L425-E429 WeakPolarHBondContact O-CB 3.47Å; L425-E429 WeakPolarHBondContact O-CG 3.4Å; L425-E429 PolarHBondContact O-N 3.24Å
426	K	72.4	Confident	68	Low	157 Å²	157	65.7 Å²	65.7	68%	0.683	35%	0.347	S	S	*	.	H	α-helix	trans	-69.7	-40.8	-177	-67.8	-178.1	179.1	179.8	0	111	D424 F428 S430	D424-K426 PolarHBondContact OD1-N 3.47Å; K426-F428 VanDerWaalsContact C-N 3.29Å; K426-F428 PolarHBondContact O-N 2.96Å; K426-S430 WeakPolarHBondContact O-CB 3.39Å; K426-S430 PolarHBondContact O-N 2.89Å; K426-S430 PolarHBondContact O-OG 2.97Å
427	S	71.4	Confident	66.2	Low	32 Å²	32	70.6 Å²	70.6	22%	0.224	37%	0.373	C	S	.	.	H	α-helix	trans	-57.5	-45.4	170.5	-68.5	0	0	0	0	110.9	D424 S430 W431	D424-S427 VanDerWaalsContact OD2-CB 3.25Å; D424-S427 WeakPolarHBondContact OD2-CB 3.28Å; D424-S427 PolarHBondContact OD2-N 3.48Å; D424-S427 PolarHBondContact OD2-OG 3.29Å; S427-S430 PolarHBondContact O-N 3.42Å; S427-S430 PolarHBondContact O-OG 3.14Å; S427-W431 PolarHBondContact O-N 3.19Å; S427-W431 PolarHBondContact O-NE1 2.94Å
428	F	69.3	Low	64.3	Low	3 Å²	3	73.5 Å²	73.5	1%	0.013	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-51.6	178.1	-170.1	-95	0	0	0	112.6	L407 L410 W411 F422 D424 L425 K426 S430 W431 F432 L456	L407-F428 HydrophobicContact CB-CE1 4.31Å; L407-F428 HydrophobicContact CD2-CE1 4.47Å; L410-F428 HydrophobicContact CD2-CZ 4.45Å; W411-F428 HydrophobicContact CB-CD1 3.71Å; W411-F428 HydrophobicContact CB-CE1 3.83Å; W411-F428 HydrophobicContact CB-CG 4.2Å; W411-F428 HydrophobicContact CB-CZ 4.43Å; W411-F428 VanDerWaalsContact CD1-CB 3.44Å; W411-F428 AromaticContact CD1-CD1 3.73Å; W411-F428 AromaticContact CD1-CD2 3.52Å; W411-F428 AromaticContact CD1-CG 3.28Å; W411-F428 HydrophobicContact CG-CB 4.15Å; W411-F428 AromaticContact CG-CD1 3.96Å; W411-F428 HydrophobicContact CG-CD1 3.96Å; W411-F428 HydrophobicContact CG-CD2 4.46Å; W411-F428 HydrophobicContact CG-CE1 4.46Å; W411-F428 AromaticContact CG-CG 3.95Å; W411-F428 HydrophobicContact CG-CG 3.95Å; F422-F428 HydrophobicContact CD1-CD2 4.45Å; F422-F428 HydrophobicContact CE1-CE2 4.45Å; D424-F428 PolarHBondContact O-N 2.94Å; L425-F428 CarbonylContact O-C 3.44Å; L425-F428 WeakPolarHBondContact O-CB 3.29Å; L425-F428 PolarHBondContact O-N 3.39Å; K426-F428 VanDerWaalsContact C-N 3.29Å; K426-F428 PolarHBondContact O-N 2.96Å; F428-S430 VanDerWaalsContact C-N 3.28Å; F428-S430 PolarHBondContact O-N 3.29Å; F428-W431 HydrophobicContact CB-CE3 4.4Å; F428-W431 AromaticContact CD2-CE3 3.46Å; F428-W431 HydrophobicContact CD2-CE3 3.46Å; F428-W431 VanDerWaalsContact CD2-CE3 3.46Å; F428-W431 HydrophobicContact CD2-CH2 4.31Å; F428-W431 AromaticContact CD2-CZ3 3.33Å; F428-W431 HydrophobicContact CD2-CZ3 3.33Å; F428-W431 HydrophobicContact CE2-CE3 4Å; F428-W431 AromaticContact CE2-CZ3 3.89Å; F428-W431 HydrophobicContact CE2-CZ3 3.89Å; F428-W431 HydrophobicContact CG-CE3 4.13Å; F428-W431 HydrophobicContact CG-CZ3 4.29Å; F428-W431 VanDerWaalsContact O-CB 3.22Å; F428-W431 WeakPolarHBondContact O-CB 3.45Å; F428-W431 PolarHBondContact O-N 3.32Å; F428-F432 HydrophobicContact CD1-CD2 4.21Å; F428-F432 AromaticContact CD1-CE2 3.84Å; F428-F432 HydrophobicContact CD1-CE2 3.84Å; F428-F432 HydrophobicContact CD2-CE2 4.38Å; F428-F432 HydrophobicContact CE1-CD2 4.13Å; F428-F432 AromaticContact CE1-CE2 3.48Å; F428-F432 HydrophobicContact CE1-CE2 3.48Å; F428-F432 VanDerWaalsContact CE1-CE2 3.48Å; F428-F432 HydrophobicContact CE1-CZ 4.2Å; F428-F432 HydrophobicContact CE2-CE2 4.05Å; F428-F432 HydrophobicContact CG-CE2 4.29Å; F428-F432 AromaticContact CZ-CE2 3.59Å; F428-F432 HydrophobicContact CZ-CE2 3.59Å; F428-F432 AromaticContact CZ-CZ 4Å; F428-F432 HydrophobicContact CZ-CZ 4Å; F428-F432 WeakPolarHBondContact O-CD2 3.39Å; F428-L456 HydrophobicContact CE2-CD2 4.31Å; F428-L456 HydrophobicContact CZ-CD2 3.99Å
429	E	70.4	Confident	62.5	Low	60 Å²	60	81.9 Å²	81.9	28%	0.28	44%	0.442	S	S	.	.	H	α-helix	trans	-59.5	-38.1	177	-75.8	179.8	167.5	0	0	111.6	L425 W431 F432 D433	L425-E429 HydrophobicContact CD2-CG 4.14Å; L425-E429 WeakPolarHBondContact CD2-OE1 3.42Å; L425-E429 WeakPolarHBondContact CD2-OE2 3.36Å; L425-E429 HydrophobicContact CG-CG 4.25Å; L425-E429 WeakPolarHBondContact O-CB 3.47Å; L425-E429 WeakPolarHBondContact O-CG 3.4Å; L425-E429 PolarHBondContact O-N 3.24Å; E429-W431 PolarHBondContact O-N 3.43Å; E429-W431 VanDerWaalsContact O-N 3.13Å; E429-F432 CarbonylContact O-C 3.55Å; E429-F432 WeakPolarHBondContact O-CA 3.41Å; E429-F432 PolarHBondContact O-N 3.05Å; E429-D433 PolarHBondContact O-N 2.96Å
430	S	68	Low	61.2	Low	35 Å²	35	81.2 Å²	81.2	25%	0.245	45%	0.447	C	S	.	.	H	α-helix	trans	-64.7	-16.5	175.5	79.1	0	0	0	0	114.3	K426 S427 F428 F432	K426-S430 WeakPolarHBondContact O-CB 3.39Å; K426-S430 PolarHBondContact O-N 2.89Å; K426-S430 PolarHBondContact O-OG 2.97Å; S427-S430 PolarHBondContact O-N 3.42Å; S427-S430 PolarHBondContact O-OG 3.14Å; F428-S430 VanDerWaalsContact C-N 3.28Å; F428-S430 PolarHBondContact O-N 3.29Å; S430-F432 VanDerWaalsContact C-N 3.26Å
431	W	62.3	Low	60.3	Low	56 Å²	56	77.3 Å²	77.3	21%	0.212	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.3	169.4	-56.4	-23.1	0	0	0	112.2	L92 L95 S427 F428 E429	L92-W431 HydrophobicContact CD1-CB 4.01Å; L92-W431 HydrophobicContact CD1-CD2 3.58Å; L92-W431 HydrophobicContact CD1-CE3 4.13Å; L92-W431 HydrophobicContact CD1-CG 3.49Å; L92-W431 VanDerWaalsContact CD1-CG 3.49Å; L95-W431 HydrophobicContact CD1-CH2 3.89Å; L95-W431 HydrophobicContact CD1-CZ2 3.92Å; S427-W431 PolarHBondContact O-N 3.19Å; S427-W431 PolarHBondContact O-NE1 2.94Å; F428-W431 HydrophobicContact CB-CE3 4.4Å; F428-W431 AromaticContact CD2-CE3 3.46Å; F428-W431 HydrophobicContact CD2-CE3 3.46Å; F428-W431 VanDerWaalsContact CD2-CE3 3.46Å; F428-W431 HydrophobicContact CD2-CH2 4.31Å; F428-W431 AromaticContact CD2-CZ3 3.33Å; F428-W431 HydrophobicContact CD2-CZ3 3.33Å; F428-W431 HydrophobicContact CE2-CE3 4Å; F428-W431 AromaticContact CE2-CZ3 3.89Å; F428-W431 HydrophobicContact CE2-CZ3 3.89Å; F428-W431 HydrophobicContact CG-CE3 4.13Å; F428-W431 HydrophobicContact CG-CZ3 4.29Å; F428-W431 VanDerWaalsContact O-CB 3.22Å; F428-W431 WeakPolarHBondContact O-CB 3.45Å; F428-W431 PolarHBondContact O-N 3.32Å; E429-W431 PolarHBondContact O-N 3.43Å; E429-W431 VanDerWaalsContact O-N 3.13Å
432	F	60.3	Low	59.5	Low	32 Å²	32	80.5 Å²	80.5	14%	0.14	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-24.2	-176.5	-61.1	-89.5	0	0	0	114.2	L407 F428 E429 S430 I434 I452 L456	L407-F432 HydrophobicContact CD1-CB 3.24Å; L407-F432 HydrophobicContact CD1-CD1 3.6Å; L407-F432 HydrophobicContact CD1-CD2 3.83Å; L407-F432 HydrophobicContact CD1-CE1 4.42Å; L407-F432 HydrophobicContact CD1-CG 3.28Å; L407-F432 HydrophobicContact CD2-CD1 3.52Å; L407-F432 HydrophobicContact CD2-CD2 3.98Å; L407-F432 HydrophobicContact CD2-CE1 3.48Å; L407-F432 VanDerWaalsContact CD2-CE1 3.48Å; L407-F432 HydrophobicContact CD2-CE2 4.01Å; L407-F432 HydrophobicContact CD2-CG 3.81Å; L407-F432 HydrophobicContact CD2-CZ 3.8Å; L407-F432 HydrophobicContact CG-CD1 4.2Å; L407-F432 HydrophobicContact CG-CD2 4.37Å; L407-F432 HydrophobicContact CG-CG 4.12Å; F428-F432 HydrophobicContact CD1-CD2 4.21Å; F428-F432 AromaticContact CD1-CE2 3.84Å; F428-F432 HydrophobicContact CD1-CE2 3.84Å; F428-F432 HydrophobicContact CD2-CE2 4.38Å; F428-F432 HydrophobicContact CE1-CD2 4.13Å; F428-F432 AromaticContact CE1-CE2 3.48Å; F428-F432 HydrophobicContact CE1-CE2 3.48Å; F428-F432 VanDerWaalsContact CE1-CE2 3.48Å; F428-F432 HydrophobicContact CE1-CZ 4.2Å; F428-F432 HydrophobicContact CE2-CE2 4.05Å; F428-F432 HydrophobicContact CG-CE2 4.29Å; F428-F432 AromaticContact CZ-CE2 3.59Å; F428-F432 HydrophobicContact CZ-CE2 3.59Å; F428-F432 AromaticContact CZ-CZ 4Å; F428-F432 HydrophobicContact CZ-CZ 4Å; F428-F432 WeakPolarHBondContact O-CD2 3.39Å; E429-F432 CarbonylContact O-C 3.55Å; E429-F432 WeakPolarHBondContact O-CA 3.41Å; E429-F432 PolarHBondContact O-N 3.05Å; S430-F432 VanDerWaalsContact C-N 3.26Å; F432-I434 PolarHBondContact O-N 3.34Å; F432-I452 HydrophobicContact CD1-CG2 3.63Å; F432-I452 HydrophobicContact CE1-CG2 3.22Å; F432-I452 HydrophobicContact CZ-CG2 3.84Å; F432-L456 HydrophobicContact CE1-CD1 3.36Å; F432-L456 HydrophobicContact CE1-CG 3.91Å; F432-L456 HydrophobicContact CZ-CD1 3.35Å; F432-L456 HydrophobicContact CZ-CD2 3.82Å; F432-L456 HydrophobicContact CZ-CG 3.62Å
433	D	58.1	Low	58.8	Low	110 Å²	110	84.9 Å²	84.9	59%	0.588	48%	0.476	S	S	*	.			trans	-73.7	65.4	175.2	-76.6	-20.8	0	0	0	110.5	E429	E429-D433 PolarHBondContact O-N 2.96Å
434	I	54	Low	58	Low	53 Å²	53	82.5 Å²	82.5	27%	0.272	46%	0.462	S	S	.	.			trans	-95.4	-1.5	169.1	-58.9	176.9	0	0	0	110.1	F432 S436 L437 I452	F432-I434 PolarHBondContact O-N 3.34Å; I434-S436 PolarHBondContact O-N 3.3Å; I434-L437 PolarHBondContact O-N 3.31Å; I434-I452 HydrophobicContact CD1-CD1 3.79Å
435	N	49.6	Very low	57.1	Low	118 Å²	118	81 Å²	81	63%	0.631	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	7.6	178.2	-73.5	-20.3	0	0	0	114.8
436	S	45.8	Very low	56.3	Low	107 Å²	107	79.4 Å²	79.4	75%	0.748	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	3.7	178.1	-177.1	0	0	0	0	114.2	I434	I434-S436 PolarHBondContact O-N 3.3Å
437	L	45.7	Very low	55.6	Low	104 Å²	104	77.4 Å²	77.4	55%	0.545	44%	0.441	S	S	.	.	S	Bend	trans	-110.9	94.8	176.1	-90	91.8	0	0	0	112.1	Q85 I434	Q85-L437 VanDerWaalsContact NE2-CD1 3.3Å; I434-L437 PolarHBondContact O-N 3.31Å
438	G	41.4	Very low	54.8	Low	65 Å²	65	82.5 Å²	82.5	67%	0.67	46%	0.456	S	S	*	.			trans	79.8	127.1	150.7	0	0	0	0	0	116.3	G440	G438-G440 PolarHBondContact O-N 3.3Å
439	E	42.5	Very low	54.2	Low	218 Å²	218	86.6 Å²	86.6	100%	1.019	48%	0.475	S	S	*	.	S	Bend	trans	-68.8	37.9	172.2	-65.4	-178.6	142.6	0	0	113.6
440	G	46.5	Very low	53.5	Low	52 Å²	52	88.3 Å²	88.3	54%	0.536	48%	0.483	S	S	.	.	S	Bend	trans	-132.7	118	178.4	0	0	0	0	0	110.8	G438	G438-G440 PolarHBondContact O-N 3.3Å
441	D	50.2	Low	53.1	Low	106 Å²	106	90.5 Å²	90.5	57%	0.567	49%	0.492	S	S	*	.			trans	79.4	67.7	173	-55.7	-25.9	0	0	0	117.9	V443 I444 V445	D441-V443 PolarHBondContact O-N 2.75Å; D441-I444 HydrophobicContact CB-CB 4.01Å; D441-I444 HydrophobicContact CB-CD1 3.74Å; D441-I444 HydrophobicContact CB-CG1 3.86Å; D441-I444 PolarHBondContact O-N 2.99Å; D441-I444 WeakPolarHBondContact OD2-CD1 3.41Å; D441-V445 PolarHBondContact O-N 2.98Å; D441-V445 VanDerWaalsContact O-N 3.11Å
442	D	54	Low	53	Low	136 Å²	136	89.7 Å²	89.7	73%	0.727	49%	0.491	S	S	*	.	H	α-helix	trans	-49.6	-26.1	165.8	-79.7	-24.6	0	0	0	113.8	A446	D442-A446 WeakPolarHBondContact O-CB 3.41Å; D442-A446 PolarHBondContact O-N 2.93Å; D442-A446 VanDerWaalsContact O-N 3.09Å
443	V	54.6	Low	53	Low	114 Å²	114	90.5 Å²	90.5	69%	0.691	50%	0.497	S	S	*	.	H	α-helix	trans	-73.2	-43.3	177.8	-178.3	0	0	0	0	111.4	D441 A446 E447	D441-V443 PolarHBondContact O-N 2.75Å; V443-A446 PolarHBondContact O-N 3.4Å; V443-E447 WeakPolarHBondContact O-CB 3.21Å; V443-E447 PolarHBondContact O-N 2.96Å
444	I	55.2	Low	53.1	Low	69 Å²	69	87.6 Å²	87.6	35%	0.354	49%	0.485	S	S	.	.	H	α-helix	trans	-72.3	-38.1	179.6	-62	177	0	0	0	110.3	D441 E447 R448	D441-I444 HydrophobicContact CB-CB 4.01Å; D441-I444 HydrophobicContact CB-CD1 3.74Å; D441-I444 HydrophobicContact CB-CG1 3.86Å; D441-I444 PolarHBondContact O-N 2.99Å; D441-I444 WeakPolarHBondContact OD2-CD1 3.41Å; I444-E447 PolarHBondContact O-N 3.26Å; I444-R448 WeakPolarHBondContact O-CB 3.43Å; I444-R448 VanDerWaalsContact O-CG 3.28Å; I444-R448 WeakPolarHBondContact O-CG 3.2Å; I444-R448 PolarHBondContact O-N 3.08Å
445	V	54.7	Low	53.4	Low	30 Å²	30	88.4 Å²	88.4	18%	0.182	49%	0.489	C	S	.	.	H	α-helix	trans	-62.2	-45.3	174.3	178	0	0	0	0	110.2	D441 E447 R448 E449	D441-V445 PolarHBondContact O-N 2.98Å; D441-V445 VanDerWaalsContact O-N 3.11Å; V445-E447 PolarHBondContact O-N 3.14Å; V445-R448 PolarHBondContact O-N 2.9Å; V445-E449 WeakPolarHBondContact O-CG 3.49Å; V445-E449 PolarHBondContact O-N 3.36Å
446	A	55.7	Low	54.1	Low	11 Å²	11	83.7 Å²	83.7	9%	0.091	46%	0.463	C	S	.	.	H	α-helix	trans	-64.8	-37.5	177.6	0	0	0	0	0	113.8	D442 V443 Q450	D442-A446 WeakPolarHBondContact O-CB 3.41Å; D442-A446 PolarHBondContact O-N 2.93Å; D442-A446 VanDerWaalsContact O-N 3.09Å; V443-A446 PolarHBondContact O-N 3.4Å; A446-Q450 WeakPolarHBondContact O-CB 3.28Å; A446-Q450 VanDerWaalsContact O-CG 3.26Å; A446-Q450 WeakPolarHBondContact O-CG 3.3Å; A446-Q450 PolarHBondContact O-N 3.3Å
447	E	56.8	Low	54.9	Low	114 Å²	114	82.4 Å²	82.4	53%	0.533	45%	0.445	S	S	.	.	H	α-helix	trans	-69.6	-39	176.9	-168	171.6	-164.2	0	0	111.3	V443 I444 V445 Q450 N451	V443-E447 WeakPolarHBondContact O-CB 3.21Å; V443-E447 PolarHBondContact O-N 2.96Å; I444-E447 PolarHBondContact O-N 3.26Å; V445-E447 PolarHBondContact O-N 3.14Å; E447-Q450 PolarHBondContact O-N 2.87Å; E447-N451 WeakPolarHBondContact O-CB 3.5Å; E447-N451 VanDerWaalsContact O-CG 3.29Å; E447-N451 PolarHBondContact O-N 2.98Å; E447-N451 PolarHBondContact O-ND2 3.27Å
448	R	56.4	Low	55.7	Low	139 Å²	139	81.1 Å²	81.1	53%	0.525	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-44	172.5	-73.3	175.9	-176.4	-179.9	4.2	112.2	I444 V445 Q450 N451 I452	I444-R448 WeakPolarHBondContact O-CB 3.43Å; I444-R448 VanDerWaalsContact O-CG 3.28Å; I444-R448 WeakPolarHBondContact O-CG 3.2Å; I444-R448 PolarHBondContact O-N 3.08Å; V445-R448 PolarHBondContact O-N 2.9Å; R448-Q450 VanDerWaalsContact C-N 3.28Å; R448-Q450 PolarHBondContact O-N 3.08Å; R448-N451 PolarHBondContact O-N 2.89Å; R448-I452 VanDerWaalsContact O-CG1 3.23Å; R448-I452 WeakPolarHBondContact O-CG1 3.45Å; R448-I452 PolarHBondContact O-N 2.92Å
449	E	55.9	Low	56.8	Low	89 Å²	89	79.9 Å²	79.9	42%	0.416	41%	0.414	S	S	.	.	H	α-helix	trans	-59.5	-40.1	173.9	-75.9	-175.6	158.9	0	0	111.8	V445 L453	V445-E449 WeakPolarHBondContact O-CG 3.49Å; V445-E449 PolarHBondContact O-N 3.36Å; E449-L453 WeakPolarHBondContact O-CB 3.31Å; E449-L453 PolarHBondContact O-N 2.76Å
450	Q	56.7	Low	58	Low	96 Å²	96	69.9 Å²	69.9	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-39.9	176.3	-75	-179.8	22.2	0	0	112.4	A446 E447 R448 L453 S454	A446-Q450 WeakPolarHBondContact O-CB 3.28Å; A446-Q450 VanDerWaalsContact O-CG 3.26Å; A446-Q450 WeakPolarHBondContact O-CG 3.3Å; A446-Q450 PolarHBondContact O-N 3.3Å; E447-Q450 PolarHBondContact O-N 2.87Å; R448-Q450 VanDerWaalsContact C-N 3.28Å; R448-Q450 PolarHBondContact O-N 3.08Å; Q450-L453 PolarHBondContact O-N 3.47Å; Q450-S454 WeakPolarHBondContact O-CB 3.47Å; Q450-S454 PolarHBondContact O-N 2.82Å; Q450-S454 PolarHBondContact O-OG 2.81Å
451	N	59.7	Low	59.1	Low	82 Å²	82	69.6 Å²	69.6	44%	0.439	36%	0.355	S	S	.	.	H	α-helix	trans	-67.6	-39.7	176.2	-73.9	-23.2	0	0	0	112.2	E447 R448 S454 M455	E447-N451 WeakPolarHBondContact O-CB 3.5Å; E447-N451 VanDerWaalsContact O-CG 3.29Å; E447-N451 PolarHBondContact O-N 2.98Å; E447-N451 PolarHBondContact O-ND2 3.27Å; R448-N451 PolarHBondContact O-N 2.89Å; N451-S454 PolarHBondContact O-N 3.36Å; N451-S454 PolarHBondContact O-OG 2.75Å; N451-M455 VanDerWaalsContact O-CG 3.24Å; N451-M455 WeakPolarHBondContact O-CG 3.47Å; N451-M455 PolarHBondContact O-N 3.37Å
452	I	60.2	Low	60.1	Low	39 Å²	39	66.4 Å²	66.4	20%	0.2	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-40	175.7	-63.9	163.7	0	0	0	110.4	F432 I434 R448 M455 L456	F432-I452 HydrophobicContact CD1-CG2 3.63Å; F432-I452 HydrophobicContact CE1-CG2 3.22Å; F432-I452 HydrophobicContact CZ-CG2 3.84Å; I434-I452 HydrophobicContact CD1-CD1 3.79Å; R448-I452 VanDerWaalsContact O-CG1 3.23Å; R448-I452 WeakPolarHBondContact O-CG1 3.45Å; R448-I452 PolarHBondContact O-N 2.92Å; I452-M455 WeakPolarHBondContact O-CB 3.3Å; I452-M455 PolarHBondContact O-N 3.47Å; I452-L456 PolarHBondContact O-N 2.68Å
453	L	58.4	Low	61.1	Low	48 Å²	48	60.8 Å²	60.8	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-67.5	-37.1	177.7	-171	140.5	0	0	0	111.8	E449 Q450 L456 H457 K769	E449-L453 WeakPolarHBondContact O-CB 3.31Å; E449-L453 PolarHBondContact O-N 2.76Å; Q450-L453 PolarHBondContact O-N 3.47Å; L453-L456 WeakPolarHBondContact O-CB 3.26Å; L453-L456 PolarHBondContact O-N 3.09Å; L453-H457 VanDerWaalsContact CD2-CD2 3.47Å; L453-H457 WeakPolarHBondContact CD2-CD2 3.26Å; L453-H457 PolarHBondContact O-CD2 2.75Å; L453-H457 PolarHBondContact O-N 3.08Å; L453-K769 HydrophobicContact CD2-CD 4.49Å
454	S	61	Low	62.4	Low	49 Å²	49	57 Å²	57	34%	0.343	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-40	172.5	74	0	0	0	0	111.5	Q450 N451 L456 H457 Q458	Q450-S454 WeakPolarHBondContact O-CB 3.47Å; Q450-S454 PolarHBondContact O-N 2.82Å; Q450-S454 PolarHBondContact O-OG 2.81Å; N451-S454 PolarHBondContact O-N 3.36Å; N451-S454 PolarHBondContact O-OG 2.75Å; S454-L456 PolarHBondContact O-N 2.72Å; S454-H457 PolarHBondContact O-N 3.5Å; S454-Q458 WeakPolarHBondContact O-CG 3.44Å; S454-Q458 PolarHBondContact O-N 2.93Å
455	M	60.8	Low	63.8	Low	70 Å²	70	55 Å²	55	35%	0.345	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-42.3	172.1	-72.9	177.9	-162.1	0	0	112.3	L96 N451 I452 H457 Q458 I459	L96-M455 HydrophobicContact CD1-SD 4.49Å; N451-M455 VanDerWaalsContact O-CG 3.24Å; N451-M455 WeakPolarHBondContact O-CG 3.47Å; N451-M455 PolarHBondContact O-N 3.37Å; I452-M455 WeakPolarHBondContact O-CB 3.3Å; I452-M455 PolarHBondContact O-N 3.47Å; M455-H457 PolarHBondContact O-N 2.89Å; M455-Q458 WeakPolarHBondContact O-CB 3.43Å; M455-Q458 PolarHBondContact O-N 2.69Å; M455-I459 WeakPolarHBondContact O-CG1 3.47Å; M455-I459 PolarHBondContact O-N 3.14Å
456	L	64.3	Low	65.1	Low	19 Å²	19	57 Å²	57	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-46.6	173.7	-85.9	-176.7	0	0	0	111.8	L407 L410 F428 F432 I452 L453 S454 Q458 I459 L460	L407-L456 HydrophobicContact CD2-CD1 4.02Å; L410-L456 HydrophobicContact CD2-CD1 3.71Å; L410-L456 HydrophobicContact CD2-CD2 4.06Å; L410-L456 HydrophobicContact CD2-CG 4.43Å; F428-L456 HydrophobicContact CE2-CD2 4.31Å; F428-L456 HydrophobicContact CZ-CD2 3.99Å; F432-L456 HydrophobicContact CE1-CD1 3.36Å; F432-L456 HydrophobicContact CE1-CG 3.91Å; F432-L456 HydrophobicContact CZ-CD1 3.35Å; F432-L456 HydrophobicContact CZ-CD2 3.82Å; F432-L456 HydrophobicContact CZ-CG 3.62Å; I452-L456 PolarHBondContact O-N 2.68Å; L453-L456 WeakPolarHBondContact O-CB 3.26Å; L453-L456 PolarHBondContact O-N 3.09Å; S454-L456 PolarHBondContact O-N 2.72Å; L456-Q458 PolarHBondContact O-N 3.26Å; L456-I459 PolarHBondContact O-N 2.87Å; L456-L460 WeakPolarHBondContact O-CB 3.46Å; L456-L460 WeakPolarHBondContact O-CD1 3.38Å; L456-L460 VanDerWaalsContact O-CG 3.25Å; L456-L460 WeakPolarHBondContact O-CG 3.49Å; L456-L460 PolarHBondContact O-N 2.91Å
457	H	62.1	Low	66.4	Low	80 Å²	80	57.3 Å²	57.3	37%	0.37	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-31.3	177.5	-78	-62.4	0	0	0	112.4	L453 S454 M455 L460 T461	L453-H457 VanDerWaalsContact CD2-CD2 3.47Å; L453-H457 WeakPolarHBondContact CD2-CD2 3.26Å; L453-H457 PolarHBondContact O-CD2 2.75Å; L453-H457 PolarHBondContact O-N 3.08Å; S454-H457 PolarHBondContact O-N 3.5Å; M455-H457 PolarHBondContact O-N 2.89Å; H457-L460 PolarHBondContact O-N 3.23Å; H457-T461 WeakPolarHBondContact O-CB 3.37Å; H457-T461 PolarHBondContact O-N 2.62Å; H457-T461 PolarHBondContact O-OG1 3.41Å
458	Q	62.5	Low	67.3	Low	77 Å²	77	53.4 Å²	53.4	36%	0.36	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-45.8	172.7	-72	173.3	2.6	0	0	111.6	S454 M455 L456 L460 P462	S454-Q458 WeakPolarHBondContact O-CG 3.44Å; S454-Q458 PolarHBondContact O-N 2.93Å; M455-Q458 WeakPolarHBondContact O-CB 3.43Å; M455-Q458 PolarHBondContact O-N 2.69Å; L456-Q458 PolarHBondContact O-N 3.26Å; Q458-L460 VanDerWaalsContact C-N 3.3Å; Q458-L460 PolarHBondContact O-N 3.07Å; Q458-P462 WeakPolarHBondContact O-CD 3.11Å
459	I	64.7	Low	68.2	Low	39 Å²	39	47.7 Å²	47.7	20%	0.2	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-38.8	176.4	-64.9	168.7	0	0	0	110.9	M455 L456 P462 F463	M455-I459 WeakPolarHBondContact O-CG1 3.47Å; M455-I459 PolarHBondContact O-N 3.14Å; L456-I459 PolarHBondContact O-N 2.87Å; I459-P462 WeakPolarHBondContact O-CD 3.27Å; I459-F463 WeakPolarHBondContact O-CD2 3.17Å; I459-F463 VanDerWaalsContact O-CE2 3.26Å; I459-F463 WeakPolarHBondContact O-CE2 3.35Å
460	L	68	Low	68.9	Low	8 Å²	8	48.6 Å²	48.6	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-80.8	-28.8	-175.5	-71	166.3	0	0	0	114.4	L410 L414 L456 H457 Q458 P462 F463 L464	L410-L460 HydrophobicContact CD1-CD1 3.76Å; L410-L460 HydrophobicContact CD1-CD2 4.11Å; L410-L460 HydrophobicContact CD2-CD1 4.07Å; L410-L460 HydrophobicContact CG-CD1 4.47Å; L414-L460 HydrophobicContact CD1-CD2 4.2Å; L414-L460 HydrophobicContact CD2-CD2 3.64Å; L414-L460 HydrophobicContact CG-CD2 4.18Å; L456-L460 WeakPolarHBondContact O-CB 3.46Å; L456-L460 WeakPolarHBondContact O-CD1 3.38Å; L456-L460 VanDerWaalsContact O-CG 3.25Å; L456-L460 WeakPolarHBondContact O-CG 3.49Å; L456-L460 PolarHBondContact O-N 2.91Å; H457-L460 PolarHBondContact O-N 3.23Å; Q458-L460 VanDerWaalsContact C-N 3.3Å; Q458-L460 PolarHBondContact O-N 3.07Å; L460-P462 VanDerWaalsContact C-CD 3.47Å; L460-F463 PolarHBondContact O-N 3.36Å; L460-L464 WeakPolarHBondContact O-CB 3.35Å; L460-L464 PolarHBondContact O-N 2.79Å
461	T	68.4	Low	69.5	Low	46 Å²	46	48.6 Å²	48.6	28%	0.282	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-43.4	-174.4	-69	0	0	0	0	114	K201 H457 F463	K201-T461 HydrophobicContact CD-CG2 3.8Å; K201-T461 HydrophobicContact CG-CG2 4.01Å; K201-T461 PolarHBondContact NZ-OG1 3.44Å; K201-T461 VanDerWaalsContact NZ-OG1 3.07Å; H457-T461 WeakPolarHBondContact O-CB 3.37Å; H457-T461 PolarHBondContact O-N 2.62Å; H457-T461 PolarHBondContact O-OG1 3.41Å; T461-F463 VanDerWaalsContact C-N 3.33Å; T461-F463 PolarHBondContact O-N 2.79Å
462	P	71.8	Confident	69.8	Low	39 Å²	39	44.8 Å²	44.8	25%	0.253	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-27.2	178.8	26.4	-34.2	0	0	0	113.6	Q458 I459 L460	Q458-P462 WeakPolarHBondContact O-CD 3.11Å; I459-P462 WeakPolarHBondContact O-CD 3.27Å; L460-P462 VanDerWaalsContact C-CD 3.47Å
463	F	76.3	Confident	69.8	Low	18 Å²	18	48.6 Å²	48.6	8%	0.079	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-11.6	-176.9	-52.5	-72.3	0	0	0	113.5	Y102 W250 I259 I262 L418 I459 L460 T461	Y102-F463 HydrophobicContact CD1-CZ 4.44Å; Y102-F463 HydrophobicContact CE1-CE1 4.38Å; Y102-F463 HydrophobicContact CE1-CZ 4.16Å; W250-F463 WeakPolarHBondContact CH2-O 3.27Å; I259-F463 HydrophobicContact CG2-CD1 3.49Å; I259-F463 VanDerWaalsContact CG2-CD1 3.49Å; I259-F463 HydrophobicContact CG2-CE1 3.38Å; I262-F463 PolarHBondContact N-O 3.18Å; L418-F463 HydrophobicContact CD1-CE1 4.3Å; L418-F463 HydrophobicContact CD1-CZ 4.27Å; I459-F463 WeakPolarHBondContact O-CD2 3.17Å; I459-F463 VanDerWaalsContact O-CE2 3.26Å; I459-F463 WeakPolarHBondContact O-CE2 3.35Å; L460-F463 PolarHBondContact O-N 3.36Å; T461-F463 VanDerWaalsContact C-N 3.33Å; T461-F463 PolarHBondContact O-N 2.79Å
464	L	81.8	Confident	69.9	Low	36 Å²	36	47.3 Å²	47.3	19%	0.188	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.4	-173.3	-174.5	142.3	0	0	0	111.8	I262 A264 L403 L460 R466	I262-L464 HydrophobicContact CB-CD1 4.37Å; I262-L464 HydrophobicContact CB-CG 4.46Å; I262-L464 HydrophobicContact CD1-CD1 4.42Å; I262-L464 HydrophobicContact CG2-CD1 4.2Å; I262-L464 WeakPolarHBondContact O-CA 3.4Å; A264-L464 HydrophobicContact CB-CD1 4.05Å; A264-L464 HydrophobicContact CB-CD2 4.2Å; A264-L464 HydrophobicContact CB-CG 3.98Å; L403-L464 HydrophobicContact CD1-CD1 3.41Å; L403-L464 VanDerWaalsContact CD1-CD1 3.41Å; L403-L464 HydrophobicContact CG-CD1 4.36Å; L460-L464 WeakPolarHBondContact O-CB 3.35Å; L460-L464 PolarHBondContact O-N 2.79Å; L464-R466 HydrophobicContact CD2-CB 3.73Å
465	L	83.9	Confident	70	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.141	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123.3	169.1	-175.2	64.7	0	0	0	109.7	W250 I262 L263 A264 D265	W250-L465 HydrophobicContact CB-CD2 4.15Å; W250-L465 HydrophobicContact CD2-CB 3.82Å; W250-L465 HydrophobicContact CD2-CD2 3.95Å; W250-L465 HydrophobicContact CD2-CG 4.42Å; W250-L465 HydrophobicContact CE3-CB 3.77Å; W250-L465 HydrophobicContact CE3-CD2 3.83Å; W250-L465 HydrophobicContact CE3-CG 4.45Å; W250-L465 HydrophobicContact CG-CD2 4.1Å; W250-L465 HydrophobicContact CH2-CB 3.82Å; W250-L465 HydrophobicContact CZ2-CB 3.86Å; W250-L465 HydrophobicContact CZ3-CB 3.78Å; I262-L465 PolarHBondContact O-N 3.31Å; I262-L465 VanDerWaalsContact O-N 3.09Å; L263-L465 HydrophobicContact CD1-CB 4.18Å; L263-L465 HydrophobicContact CD1-CD2 3.94Å; L263-L465 HydrophobicContact CD1-CG 4.32Å; A264-L465 CarbonylContact C-O 3.56Å; A264-L465 WeakPolarHBondContact CA-O 3.45Å; A264-L465 PolarHBondContact N-O 3.44Å; D265-L465 PolarHBondContact N-O 3.33Å
466	R	81.9	Confident	70.3	Confident	71 Å²	71	52.3 Å²	52.3	27%	0.268	27%	0.272	S	S	.	.			trans	-140	125.6	178.6	175.8	173.7	-177.1	96.6	-2	110.9	A264 P402 L464	A264-R466 HydrophobicContact CB-CB 4.1Å; A264-R466 WeakPolarHBondContact O-CG 3.28Å; A264-R466 PolarHBondContact O-NH1 2.84Å; P402-R466 VanDerWaalsContact CA-NH1 3.26Å; L464-R466 HydrophobicContact CD2-CB 3.73Å
467	R	82.8	Confident	70.8	Confident	17 Å²	17	52.5 Å²	52.5	6%	0.064	27%	0.274	C	S	.	.			trans	-128.5	148.2	173.3	-65.7	164.8	-72	-159	7.4	111.2	Y243 E246 D265 E266 L269 V472	Y243-R467 VanDerWaalsContact O-CZ 3.27Å; Y243-R467 PolarHBondContact O-NH1 2.95Å; Y243-R467 PolarHBondContact O-NH2 3.47Å; E246-R467 IonicContact OE2-NH1 3.11Å; E246-R467 PolarHBondContact OE2-NH1 3.25Å; D265-R467 WeakPolarHBondContact OD1-CB 3.29Å; D265-R467 IonicContact OD1-CZ 3.44Å; D265-R467 PolarHBondContact OD1-N 3.17Å; D265-R467 VanDerWaalsContact OD1-N 3.1Å; D265-R467 IonicContact OD1-NE 2.76Å; D265-R467 PolarHBondContact OD1-NE 3.3Å; D265-R467 IonicContact OD1-NH2 3.55Å; D265-R467 IonicContact OD2-CZ 2.86Å; D265-R467 IonicContact OD2-NE 3.92Å; D265-R467 PolarHBondContact OD2-NE 2.95Å; D265-R467 IonicContact OD2-NH2 3.57Å; D265-R467 PolarHBondContact OD2-NH2 3.25Å; E266-R467 WeakPolarHBondContact CB-O 3.37Å; E266-R467 PolarHBondContact N-O 3.42Å; L269-R467 HydrophobicContact CD1-CB 4.02Å; L269-R467 WeakPolarHBondContact CD1-O 3.38Å; R467-V472 HydrophobicContact CB-CG2 4.3Å
468	L	76.8	Confident	71.6	Confident	32 Å²	32	52 Å²	52	17%	0.168	28%	0.278	C	S	.	.			trans	-97.5	156.6	175	-55.6	175.4	0	0	0	111.2	E266 T470 D471 V472	E266-L468 WeakPolarHBondContact OE2-CA 3.43Å; L468-T470 WeakPolarHBondContact CB-OG1 3.41Å; L468-T470 PolarHBondContact O-N 3.02Å; L468-D471 WeakPolarHBondContact CB-OD2 3.38Å; L468-D471 PolarHBondContact N-OD2 3.49Å; L468-D471 VanDerWaalsContact N-OD2 3.1Å; L468-D471 PolarHBondContact O-N 3.13Å; L468-V472 WeakPolarHBondContact O-CG2 3.46Å; L468-V472 PolarHBondContact O-N 3.38Å
469	K	75.3	Confident	72.6	Confident	20 Å²	20	50.4 Å²	50.4	9%	0.087	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-34	174.6	-71.9	175.9	-166.8	167.7	0	112.1	E266 M267 L269 V472 D726 H729	E266-K469 HydrophobicContact CG-CG 4.35Å; E266-K469 WeakPolarHBondContact OE1-CD 3.39Å; E266-K469 VanDerWaalsContact OE1-CE 3.23Å; E266-K469 WeakPolarHBondContact OE1-CE 3.33Å; E266-K469 WeakPolarHBondContact OE1-CG 3.47Å; E266-K469 IonicContact OE1-NZ 2.72Å; E266-K469 PolarHBondContact OE2-N 3.48Å; M267-K469 WeakPolarHBondContact O-CE 3.5Å; L269-K469 HydrophobicContact CD2-CG 4.26Å; K469-V472 PolarHBondContact O-N 2.86Å; K469-D726 IonicContact NZ-OD1 3.51Å; K469-D726 PolarHBondContact NZ-OD1 3.4Å; K469-D726 IonicContact NZ-OD2 3.36Å; K469-H729 PolarHBondContact NZ-O 3.36Å
470	T	70.3	Confident	73.6	Confident	107 Å²	107	48.9 Å²	48.9	66%	0.656	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-41.7	176.6	48.5	0	0	0	0	112.1	L468 V472 T473	L468-T470 WeakPolarHBondContact CB-OG1 3.41Å; L468-T470 PolarHBondContact O-N 3.02Å; T470-V472 PolarHBondContact O-N 2.92Å; T470-T473 PolarHBondContact O-N 3.43Å
471	D	68.5	Low	74.4	Confident	96 Å²	96	49.3 Å²	49.3	51%	0.513	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.4	-177.8	-53	-21.1	0	0	0	111.9	L468	L468-D471 WeakPolarHBondContact CB-OD2 3.38Å; L468-D471 PolarHBondContact N-OD2 3.49Å; L468-D471 VanDerWaalsContact N-OD2 3.1Å; L468-D471 PolarHBondContact O-N 3.13Å
472	V	66.6	Low	75.3	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-2	-173.6	-177.3	0	0	0	0	112	W242 Y243 L269 R467 L468 K469 T470 L474	W242-V472 HydrophobicContact CZ2-CG1 4.29Å; Y243-V472 HydrophobicContact CD1-CB 4.42Å; Y243-V472 HydrophobicContact CD1-CG1 3.07Å; Y243-V472 HydrophobicContact CD1-CG2 4.45Å; Y243-V472 HydrophobicContact CD2-CG1 4.29Å; Y243-V472 HydrophobicContact CE1-CG1 3.26Å; Y243-V472 HydrophobicContact CE2-CG1 4.45Å; Y243-V472 HydrophobicContact CG-CG1 3.63Å; Y243-V472 HydrophobicContact CG-CG2 4.2Å; L269-V472 HydrophobicContact CD1-CG2 4.43Å; L269-V472 HydrophobicContact CD2-CB 4.41Å; L269-V472 HydrophobicContact CD2-CG1 4.45Å; L269-V472 HydrophobicContact CD2-CG2 4.24Å; R467-V472 HydrophobicContact CB-CG2 4.3Å; L468-V472 WeakPolarHBondContact O-CG2 3.46Å; L468-V472 PolarHBondContact O-N 3.38Å; K469-V472 PolarHBondContact O-N 2.86Å; T470-V472 PolarHBondContact O-N 2.92Å; V472-L474 HydrophobicContact CB-CD1 4.39Å; V472-L474 HydrophobicContact CB-CG 4.06Å; V472-L474 HydrophobicContact CG1-CD1 4.17Å; V472-L474 HydrophobicContact CG1-CD2 3.7Å; V472-L474 HydrophobicContact CG1-CG 3.7Å; V472-L474 PolarHBondContact O-N 2.82Å; V472-L474 VanDerWaalsContact O-N 3.1Å
473	T	60.6	Low	76	Confident	118 Å²	118	45.7 Å²	45.7	72%	0.724	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	43	47.2	180	57.1	0	0	0	0	112.2	T470	T470-T473 PolarHBondContact O-N 3.43Å
474	L	59.2	Low	76.4	Confident	21 Å²	21	44.9 Å²	44.9	11%	0.11	24%	0.237	C	C	.	.			trans	-71.9	136.4	176.1	-61.3	168.4	0	0	0	108	Y243 L269 V472 V476 I731	Y243-L474 HydrophobicContact CE1-CD2 4.04Å; L269-L474 HydrophobicContact CD2-CD1 3.5Å; V472-L474 HydrophobicContact CB-CD1 4.39Å; V472-L474 HydrophobicContact CB-CG 4.06Å; V472-L474 HydrophobicContact CG1-CD1 4.17Å; V472-L474 HydrophobicContact CG1-CD2 3.7Å; V472-L474 HydrophobicContact CG1-CG 3.7Å; V472-L474 PolarHBondContact O-N 2.82Å; V472-L474 VanDerWaalsContact O-N 3.1Å; L474-V476 HydrophobicContact CB-CG2 3.82Å; L474-V476 PolarHBondContact O-N 2.86Å; L474-I731 HydrophobicContact CD1-CD1 4.02Å; L474-I731 HydrophobicContact CD1-CG1 4.18Å; L474-I731 HydrophobicContact CD2-CD1 4.26Å
475	E	63.1	Low	76.6	Confident	194 Å²	194	46.2 Å²	46.2	91%	0.907	24%	0.24	S	C	*	.			trans	-65.6	48.3	167.5	-62.2	176.4	166.5	0	0	111.5
476	V	67.4	Low	76.6	Confident	30 Å²	30	45 Å²	45	18%	0.182	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-87.9	124.7	170.3	-174.9	0	0	0	0	106.6	L474 H729	L474-V476 HydrophobicContact CB-CG2 3.82Å; L474-V476 PolarHBondContact O-N 2.86Å; V476-H729 VanDerWaalsContact CG1-NE2 3.32Å; V476-H729 WeakPolarHBondContact CG1-NE2 3.37Å
477	P	75.7	Confident	76.7	Confident	23 Å²	23	44.2 Å²	44.2	15%	0.149	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-52.3	147.1	175.7	-27.9	35.1	0	0	0	111.9	H729 P736	P477-H729 PolarHBondContact O-CD2 3.49Å; P477-H729 PolarHBondContact O-NE2 3.13Å; P477-P736 HydrophobicContact CB-CB 4.41Å
478	P	78.4	Confident	76.7	Confident	69 Å²	69	44.9 Å²	44.9	45%	0.448	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-61.5	150.6	177.3	27	-34.4	0	0	0	110.7	V737 L826	P478-V737 PolarHBondContact O-N 3.45Å; P478-L826 HydrophobicContact CB-CD2 4.16Å; P478-L826 HydrophobicContact CG-CB 4.33Å; P478-L826 HydrophobicContact CG-CD2 4.04Å
479	K	84	Confident	77.2	Confident	44 Å²	44	44.2 Å²	44.2	19%	0.191	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	143.4	171.9	67.6	176.4	-179.7	179.4	0	111	D726 H729 V737	K479-D726 IonicContact NZ-OD1 3.98Å; K479-H729 HydrophobicContact CD-CB 4.35Å; K479-V737 VanDerWaalsContact CA-O 3.22Å; K479-V737 WeakPolarHBondContact CA-O 3.39Å; K479-V737 HydrophobicContact CB-CB 4.32Å
480	K	84	Confident	77.7	Confident	7 Å²	7	48.7 Å²	48.7	3%	0.03	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127	175.1	-168.6	173.2	-177.2	175.2	0	109.2	I482 V737 V739 D825 L826 V842	K480-I482 HydrophobicContact CD-CD1 4.17Å; K480-I482 HydrophobicContact CD-CG1 4.41Å; K480-I482 HydrophobicContact CG-CD1 4.31Å; K480-I482 HydrophobicContact CG-CG1 4.05Å; K480-V737 PolarHBondContact N-O 3.34Å; K480-V739 PolarHBondContact O-N 2.89Å; K480-D825 IonicContact NZ-OD2 2.75Å; K480-D825 PolarHBondContact NZ-OD2 3.25Å; K480-L826 HydrophobicContact CB-CD1 3.94Å; K480-L826 HydrophobicContact CB-CD2 4.17Å; K480-L826 HydrophobicContact CD-CD1 4.39Å; K480-V842 HydrophobicContact CG-CG1 4.27Å
481	E	85.3	Confident	78.4	Confident	18 Å²	18	48.6 Å²	48.6	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.6	175	-173.5	170.8	-166.7	0	0	108.9	V739 R741 R760 I843	E481-V739 WeakPolarHBondContact CA-O 3.42Å; E481-R741 IonicContact OE1-CZ 3.75Å; E481-R741 IonicContact OE1-NE 2.82Å; E481-R741 PolarHBondContact OE1-NE 3.04Å; E481-R741 VanDerWaalsContact OE1-NE 3.11Å; E481-R741 IonicContact OE1-NH2 3.2Å; E481-R741 PolarHBondContact OE1-NH2 3.13Å; E481-R760 IonicContact OE2-NH1 2.83Å; E481-R760 PolarHBondContact OE2-NH1 3.41Å; E481-I843 CarbonylContact O-C 3.49Å; E481-I843 PolarHBondContact O-N 3.38Å; E481-I843 VanDerWaalsContact O-O 3.05Å
482	I	86.8	Confident	79.3	Confident	4 Å²	4	44 Å²	44	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.8	-177.5	-54	173.8	0	0	0	108.4	K480 V484 V738 V739 Y740 R741 L820 F840	K480-I482 HydrophobicContact CD-CD1 4.17Å; K480-I482 HydrophobicContact CD-CG1 4.41Å; K480-I482 HydrophobicContact CG-CD1 4.31Å; K480-I482 HydrophobicContact CG-CG1 4.05Å; I482-V484 HydrophobicContact CG2-CG2 4.16Å; I482-V738 HydrophobicContact CD1-CG1 3.96Å; I482-V739 PolarHBondContact N-O 2.74Å; I482-Y740 HydrophobicContact CB-CD1 4.18Å; I482-Y740 HydrophobicContact CB-CE1 4.47Å; I482-Y740 HydrophobicContact CD1-CD1 4.4Å; I482-Y740 HydrophobicContact CD1-CE1 3.85Å; I482-Y740 CarbonylContact O-C 3.48Å; I482-Y740 WeakPolarHBondContact O-CA 3.42Å; I482-R741 PolarHBondContact O-N 3.36Å; I482-L820 HydrophobicContact CG2-CD2 3.67Å; I482-F840 HydrophobicContact CG2-CB 4.27Å; I482-F840 HydrophobicContact CG2-CD2 4.3Å
483	I	86.6	Confident	80.2	Confident	4 Å²	4	47 Å²	47	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.2	170.6	-59.1	166.4	0	0	0	108.1	Y485 V743 L753 F840 R841 I843	I483-Y485 HydrophobicContact CG2-CD2 4.39Å; I483-Y485 HydrophobicContact CG2-CE1 4.2Å; I483-Y485 HydrophobicContact CG2-CE2 3.95Å; I483-V743 HydrophobicContact CG2-CB 4.26Å; I483-V743 HydrophobicContact CG2-CG2 3.85Å; I483-L753 HydrophobicContact CD1-CD2 3.66Å; I483-L753 HydrophobicContact CG1-CD2 4.28Å; I483-L753 HydrophobicContact CG2-CD2 4.22Å; I483-F840 CarbonylContact O-C 3.6Å; I483-F840 WeakPolarHBondContact O-CA 3.48Å; I483-F840 VanDerWaalsContact O-CB 3.3Å; I483-F840 WeakPolarHBondContact O-CB 3.27Å; I483-R841 HydrophobicContact CB-CB 4.31Å; I483-R841 PolarHBondContact N-O 2.98Å; I483-R841 PolarHBondContact O-N 3.26Å; I483-I843 HydrophobicContact CD1-CD1 3.35Å; I483-I843 HydrophobicContact CD1-CG1 4.02Å; I483-I843 HydrophobicContact CG1-CD1 4.07Å
484	V	86.3	Confident	81.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.1	177.6	-175.2	0	0	0	0	108.5	I482 I623 Y740 R741 L742 V743 I812 L820	I482-V484 HydrophobicContact CG2-CG2 4.16Å; V484-I623 HydrophobicContact CG1-CD1 4.01Å; V484-I623 HydrophobicContact CG1-CG2 3.94Å; V484-Y740 HydrophobicContact CG2-CD1 4.05Å; V484-R741 PolarHBondContact N-O 3.1Å; V484-L742 HydrophobicContact CB-CD2 4.03Å; V484-L742 HydrophobicContact CG1-CD2 4.39Å; V484-V743 PolarHBondContact O-N 3.17Å; V484-I812 HydrophobicContact CG1-CD1 4.29Å; V484-L820 HydrophobicContact CG2-CD2 4.38Å
485	Y	85.3	Confident	82.6	Confident	64 Å²	64	45.1 Å²	45.1	25%	0.251	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.9	-179.1	-69.2	-79.1	0	0	0	111.1	I483 V743 A745 V839 R841	I483-Y485 HydrophobicContact CG2-CD2 4.39Å; I483-Y485 HydrophobicContact CG2-CE1 4.2Å; I483-Y485 HydrophobicContact CG2-CE2 3.95Å; Y485-V743 CarbonylContact C-O 3.53Å; Y485-V743 VanDerWaalsContact CA-O 3.26Å; Y485-V743 WeakPolarHBondContact CA-O 3.32Å; Y485-V743 HydrophobicContact CD1-CB 4.3Å; Y485-V743 HydrophobicContact CD1-CG1 4.32Å; Y485-V743 HydrophobicContact CE1-CB 4.43Å; Y485-V743 HydrophobicContact CE1-CG1 4.21Å; Y485-A745 HydrophobicContact CD1-CB 4.25Å; Y485-V839 PolarHBondContact N-O 2.81Å; Y485-R841 HydrophobicContact CE2-CB 4.19Å
486	A	84.2	Confident	83.7	Confident	1 Å²	1	36 Å²	36	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.6	175.3	0	0	0	0	0	111.2	K620 I623 V743 T744 A745	A486-K620 HydrophobicContact CB-CG 4Å; A486-I623 HydrophobicContact CB-CD1 3.69Å; A486-V743 PolarHBondContact N-O 2.74Å; A486-T744 HydrophobicContact CB-CG2 4.08Å; A486-T744 WeakPolarHBondContact O-CA 3.5Å; A486-A745 PolarHBondContact O-N 3.45Å
487	P	83.3	Confident	84.5	Confident	55 Å²	55	35.9 Å²	35.9	36%	0.357	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-72.4	151.8	169	31.9	-34.4	0	0	0	110.4	G619 V811	P487-G619 VanDerWaalsContact O-CA 3.32Å; P487-G619 WeakPolarHBondContact O-CA 3.43Å; P487-V811 VanDerWaalsContact CD-CG1 3.45Å; P487-V811 HydrophobicContact CG-CG1 3.57Å; P487-V811 HydrophobicContact CG-CG2 4.35Å
488	L	82.8	Confident	84.9	Confident	31 Å²	31	35.2 Å²	35.2	16%	0.162	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-76.3	140.7	168	-76.3	162.6	0	0	0	110.1	Q492 T747	L488-Q492 HydrophobicContact CB-CB 4.49Å; L488-Q492 HydrophobicContact CD2-CB 3.71Å; L488-T747 HydrophobicContact CD1-CG2 3.55Å; L488-T747 HydrophobicContact CD2-CG2 4.24Å; L488-T747 HydrophobicContact CG-CG2 4.09Å
489	T	86.9	Confident	85.2	Confident	18 Å²	18	32.1 Å²	32.1	11%	0.11	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-79.7	164.3	169.6	66.1	0	0	0	0	110.9	K491 Q492 E493 Q616 S617 L622	T489-K491 VanDerWaalsContact C-N 3.32Å; T489-K491 PolarHBondContact O-N 3.41Å; T489-Q492 PolarHBondContact O-N 2.87Å; T489-Q492 VanDerWaalsContact O-N 3.12Å; T489-Q492 WeakPolarHBondContact OG1-CB 3.46Å; T489-Q492 VanDerWaalsContact OG1-CG 3.27Å; T489-Q492 WeakPolarHBondContact OG1-CG 3.48Å; T489-Q492 PolarHBondContact OG1-N 2.91Å; T489-Q492 PolarHBondContact OG1-OE1 3.31Å; T489-E493 WeakPolarHBondContact O-CB 3.47Å; T489-E493 PolarHBondContact O-N 3.24Å; T489-Q616 WeakPolarHBondContact CG2-O 3.27Å; T489-S617 WeakPolarHBondContact CB-O 3.29Å; T489-S617 WeakPolarHBondContact CG2-O 3.36Å; T489-S617 PolarHBondContact OG1-O 3.41Å; T489-L622 HydrophobicContact CG2-CD1 4.26Å
490	T	86.4	Confident	85.2	Confident	115 Å²	115	30.9 Å²	30.9	71%	0.706	17%	0.168	S	C	*	.	H	α-helix	trans	-56.7	-44.6	177.7	51.1	0	0	0	0	112.1	E493 T494	T490-E493 PolarHBondContact O-N 2.88Å; T490-T494 PolarHBondContact O-N 3.21Å; T490-T494 PolarHBondContact O-OG1 3.4Å
491	K	84.4	Confident	85.2	Confident	104 Å²	104	34.5 Å²	34.5	45%	0.452	19%	0.188	S	C	.	.	H	α-helix	trans	-61.2	-45.1	175.1	-70.5	-170	176.4	-173.5	0	111.7	T489 T494 L495	T489-K491 VanDerWaalsContact C-N 3.32Å; T489-K491 PolarHBondContact O-N 3.41Å; K491-T494 PolarHBondContact O-N 3.17Å; K491-L495 WeakPolarHBondContact O-CG 3.37Å; K491-L495 PolarHBondContact O-N 2.75Å; K491-L495 VanDerWaalsContact O-N 3.12Å
492	Q	87	Confident	84.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177.5	-73	-180	-60.6	0	0	112.1	L488 T489 T494 L495 Y496 C590 C591 P594	L488-Q492 HydrophobicContact CB-CB 4.49Å; L488-Q492 HydrophobicContact CD2-CB 3.71Å; T489-Q492 PolarHBondContact O-N 2.87Å; T489-Q492 VanDerWaalsContact O-N 3.12Å; T489-Q492 WeakPolarHBondContact OG1-CB 3.46Å; T489-Q492 VanDerWaalsContact OG1-CG 3.27Å; T489-Q492 WeakPolarHBondContact OG1-CG 3.48Å; T489-Q492 PolarHBondContact OG1-N 2.91Å; T489-Q492 PolarHBondContact OG1-OE1 3.31Å; Q492-T494 VanDerWaalsContact C-N 3.35Å; Q492-T494 PolarHBondContact O-N 3.03Å; Q492-L495 PolarHBondContact O-N 3.36Å; Q492-Y496 WeakPolarHBondContact O-CB 3.48Å; Q492-Y496 PolarHBondContact O-N 3.26Å; Q492-C590 PolarHBondContact NE2-O 2.83Å; Q492-C591 PolarHBondContact NE2-O 3.25Å; Q492-P594 HydrophobicContact CG-CG 3.49Å; Q492-P594 VanDerWaalsContact CG-CG 3.49Å
493	E	85.9	Confident	84.4	Confident	65 Å²	65	43.6 Å²	43.6	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-40.3	-180	-177.8	165.6	-175.5	0	0	111.9	T489 T490 Y496 S497 R798	T489-E493 WeakPolarHBondContact O-CB 3.47Å; T489-E493 PolarHBondContact O-N 3.24Å; T490-E493 PolarHBondContact O-N 2.88Å; E493-Y496 PolarHBondContact O-N 3.24Å; E493-S497 VanDerWaalsContact O-CB 3.25Å; E493-S497 WeakPolarHBondContact O-CB 3.49Å; E493-S497 PolarHBondContact O-N 2.86Å; E493-S497 PolarHBondContact O-OG 2.9Å; E493-R798 IonicContact OE1-NH1 2.6Å; E493-R798 PolarHBondContact OE1-NH1 3.46Å; E493-R798 IonicContact OE2-CZ 3.74Å; E493-R798 IonicContact OE2-NH1 2.69Å; E493-R798 PolarHBondContact OE2-NH1 3.33Å
494	T	87.1	Confident	83.6	Confident	87 Å²	87	43.5 Å²	43.5	53%	0.534	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-49	177.1	-44	0	0	0	0	110.7	T490 K491 Q492 A498	T490-T494 PolarHBondContact O-N 3.21Å; T490-T494 PolarHBondContact O-OG1 3.4Å; K491-T494 PolarHBondContact O-N 3.17Å; Q492-T494 VanDerWaalsContact C-N 3.35Å; Q492-T494 PolarHBondContact O-N 3.03Å; T494-A498 VanDerWaalsContact O-CB 3.31Å; T494-A498 WeakPolarHBondContact O-CB 3.35Å; T494-A498 PolarHBondContact O-N 3.3Å
495	L	83.9	Confident	82.7	Confident	13 Å²	13	48.8 Å²	48.8	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-45.6	177.1	-71.4	172.8	0	0	0	111.6	K491 Q492 S497 A498 V499 L508 P594	K491-L495 WeakPolarHBondContact O-CG 3.37Å; K491-L495 PolarHBondContact O-N 2.75Å; K491-L495 VanDerWaalsContact O-N 3.12Å; Q492-L495 PolarHBondContact O-N 3.36Å; L495-S497 PolarHBondContact O-N 2.96Å; L495-A498 WeakPolarHBondContact O-CB 3.38Å; L495-A498 PolarHBondContact O-N 2.82Å; L495-V499 VanDerWaalsContact O-CG2 3.31Å; L495-V499 WeakPolarHBondContact O-CG2 3.48Å; L495-V499 PolarHBondContact O-N 3.3Å; L495-L508 HydrophobicContact CD2-CD1 4.45Å; L495-P594 HydrophobicContact CD1-CB 3.95Å
496	Y	85.3	Confident	81.9	Confident	2 Å²	2	53 Å²	53	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-46.7	-178.9	-168.3	-86.9	0	0	0	111.3	Q492 E493 A498 V499 V500 L587 C590 C591 T747 I748 L795	Q492-Y496 WeakPolarHBondContact O-CB 3.48Å; Q492-Y496 PolarHBondContact O-N 3.26Å; E493-Y496 PolarHBondContact O-N 3.24Å; Y496-A498 VanDerWaalsContact C-N 3.31Å; Y496-A498 PolarHBondContact O-N 3.41Å; Y496-V499 PolarHBondContact O-N 3.02Å; Y496-V500 HydrophobicContact CD1-CG2 4.02Å; Y496-V500 HydrophobicContact CE1-CG2 3.81Å; Y496-V500 WeakPolarHBondContact O-CG2 3.37Å; Y496-V500 PolarHBondContact O-N 3.29Å; Y496-L587 HydrophobicContact CD1-CD2 4.4Å; Y496-L587 HydrophobicContact CD2-CD2 3.73Å; Y496-L587 HydrophobicContact CE1-CD2 4.26Å; Y496-L587 HydrophobicContact CE2-CB 4Å; Y496-L587 HydrophobicContact CE2-CD2 3.56Å; Y496-L587 HydrophobicContact CE2-CG 4.28Å; Y496-L587 HydrophobicContact CG-CD2 4.16Å; Y496-C590 HydrophobicContact CD2-CB 4.37Å; Y496-C591 WeakPolarHBondContact CE2-SG 3.41Å; Y496-T747 HydrophobicContact CE2-CG2 4.21Å; Y496-I748 HydrophobicContact CE2-CG2 4.46Å; Y496-I748 PolarHBondContact OH-N 2.86Å; Y496-I748 VanDerWaalsContact OH-N 3.07Å; Y496-L795 HydrophobicContact CD1-CD1 3.73Å; Y496-L795 HydrophobicContact CE1-CD1 3.9Å
497	S	85.9	Confident	81.2	Confident	29 Å²	29	56.7 Å²	56.7	20%	0.203	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-39.1	175.6	-57.5	0	0	0	0	111.7	E493 L495 V499 V500 N501	E493-S497 VanDerWaalsContact O-CB 3.25Å; E493-S497 WeakPolarHBondContact O-CB 3.49Å; E493-S497 PolarHBondContact O-N 2.86Å; E493-S497 PolarHBondContact O-OG 2.9Å; L495-S497 PolarHBondContact O-N 2.96Å; S497-V499 PolarHBondContact O-N 3.44Å; S497-V500 PolarHBondContact O-N 3.37Å; S497-N501 VanDerWaalsContact O-CB 3.3Å; S497-N501 WeakPolarHBondContact O-CB 3.28Å; S497-N501 VanDerWaalsContact O-CG 3.26Å; S497-N501 PolarHBondContact O-N 2.94Å; S497-N501 PolarHBondContact O-ND2 2.9Å
498	A	84	Confident	80.4	Confident	8 Å²	8	54.9 Å²	54.9	7%	0.066	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-35.7	175.9	0	0	0	0	0	112.8	T494 L495 Y496 K502 T503 I504 V507	T494-A498 VanDerWaalsContact O-CB 3.31Å; T494-A498 WeakPolarHBondContact O-CB 3.35Å; T494-A498 PolarHBondContact O-N 3.3Å; L495-A498 WeakPolarHBondContact O-CB 3.38Å; L495-A498 PolarHBondContact O-N 2.82Å; Y496-A498 VanDerWaalsContact C-N 3.31Å; Y496-A498 PolarHBondContact O-N 3.41Å; A498-K502 CarbonylContact O-C 3.57Å; A498-K502 PolarHBondContact O-N 3.22Å; A498-T503 PolarHBondContact O-N 3.41Å; A498-I504 HydrophobicContact CB-CB 4.32Å; A498-I504 PolarHBondContact O-N 2.94Å; A498-V507 HydrophobicContact CB-CB 4.42Å; A498-V507 HydrophobicContact CB-CG2 3.82Å
499	V	83.4	Confident	79.4	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.03	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-47.8	174.3	178.6	0	0	0	0	110.9	L495 Y496 S497 N501 K502 I504 V583 V586 L587	L495-V499 VanDerWaalsContact O-CG2 3.31Å; L495-V499 WeakPolarHBondContact O-CG2 3.48Å; L495-V499 PolarHBondContact O-N 3.3Å; Y496-V499 PolarHBondContact O-N 3.02Å; S497-V499 PolarHBondContact O-N 3.44Å; V499-N501 VanDerWaalsContact C-N 3.3Å; V499-N501 PolarHBondContact O-N 2.86Å; V499-K502 PolarHBondContact O-N 3.24Å; V499-I504 HydrophobicContact CG2-CB 4.43Å; V499-I504 HydrophobicContact CG2-CD1 3.34Å; V499-I504 HydrophobicContact CG2-CG1 4.39Å; V499-V583 HydrophobicContact CG1-CG1 3.8Å; V499-V586 HydrophobicContact CG1-CB 4.31Å; V499-V586 HydrophobicContact CG1-CG1 4.2Å; V499-V586 HydrophobicContact CG2-CG1 3.64Å; V499-L587 HydrophobicContact CB-CD2 3.66Å; V499-L587 HydrophobicContact CB-CG 4.48Å; V499-L587 HydrophobicContact CG1-CD2 3.43Å; V499-L587 VanDerWaalsContact CG1-CD2 3.43Å; V499-L587 HydrophobicContact CG1-CG 3.72Å; V499-L587 HydrophobicContact CG2-CD2 4.5Å
500	V	84.3	Confident	78	Confident	18 Å²	18	60.1 Å²	60.1	11%	0.109	32%	0.323	C	S	.	.	H	α-helix	trans	-59.9	-43.5	179.4	174	0	0	0	0	110.4	Y496 S497 K502 L587 R792	Y496-V500 HydrophobicContact CD1-CG2 4.02Å; Y496-V500 HydrophobicContact CE1-CG2 3.81Å; Y496-V500 WeakPolarHBondContact O-CG2 3.37Å; Y496-V500 PolarHBondContact O-N 3.29Å; S497-V500 PolarHBondContact O-N 3.37Å; V500-K502 PolarHBondContact O-N 3.2Å; V500-L587 HydrophobicContact CG2-CD2 3.87Å; V500-R792 HydrophobicContact CG1-CB 4.28Å
501	N	83.5	Confident	76	Confident	83 Å²	83	61.1 Å²	61.1	44%	0.444	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	6.2	177.1	-64.6	-25.1	0	0	0	113.8	S497 V499 T503	S497-N501 VanDerWaalsContact O-CB 3.3Å; S497-N501 WeakPolarHBondContact O-CB 3.28Å; S497-N501 VanDerWaalsContact O-CG 3.26Å; S497-N501 PolarHBondContact O-N 2.94Å; S497-N501 PolarHBondContact O-ND2 2.9Å; V499-N501 VanDerWaalsContact C-N 3.3Å; V499-N501 PolarHBondContact O-N 2.86Å; N501-T503 PolarHBondContact O-N 2.9Å; N501-T503 PolarHBondContact O-OG1 3.4Å
502	K	77.2	Confident	74.1	Confident	156 Å²	156	65.2 Å²	65.2	68%	0.678	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	24.8	-175.5	-58.6	179.6	-178.4	172.8	0	114.4	A498 V499 V500	A498-K502 CarbonylContact O-C 3.57Å; A498-K502 PolarHBondContact O-N 3.22Å; V499-K502 PolarHBondContact O-N 3.24Å; V500-K502 PolarHBondContact O-N 3.2Å
503	T	77.8	Confident	72	Confident	56 Å²	56	73.4 Å²	73.4	34%	0.344	37%	0.373	S	S	.	.			trans	-101.1	4.4	-175.3	-53.9	0	0	0	0	111.9	A498 N501 E505 K506 V507	A498-T503 PolarHBondContact O-N 3.41Å; N501-T503 PolarHBondContact O-N 2.9Å; N501-T503 PolarHBondContact O-OG1 3.4Å; T503-E505 VanDerWaalsContact C-N 3.27Å; T503-E505 PolarHBondContact O-N 2.99Å; T503-E505 VanDerWaalsContact O-N 3.17Å; T503-K506 HydrophobicContact CG2-CB 3.98Å; T503-K506 HydrophobicContact CG2-CD 3.92Å; T503-K506 HydrophobicContact CG2-CG 4.12Å; T503-K506 WeakPolarHBondContact O-CB 3.39Å; T503-K506 PolarHBondContact O-N 3.32Å; T503-V507 PolarHBondContact O-N 3.39Å
504	I	71.2	Confident	69.9	Low	3 Å²	3	78.5 Å²	78.5	2%	0.015	40%	0.397	C	S	.	.	H	α-helix	trans	-57.6	-32.9	-174.3	-170.1	160.5	0	0	0	114	A498 V499 K506 V507 L508 L578 L580 V586 V597	A498-I504 HydrophobicContact CB-CB 4.32Å; A498-I504 PolarHBondContact O-N 2.94Å; V499-I504 HydrophobicContact CG2-CB 4.43Å; V499-I504 HydrophobicContact CG2-CD1 3.34Å; V499-I504 HydrophobicContact CG2-CG1 4.39Å; I504-K506 VanDerWaalsContact C-N 3.29Å; I504-K506 PolarHBondContact O-N 3.11Å; I504-V507 PolarHBondContact O-N 3.31Å; I504-L508 HydrophobicContact CB-CD1 4.42Å; I504-L508 HydrophobicContact CD1-CD1 3.77Å; I504-L508 HydrophobicContact CG1-CD1 3.14Å; I504-L508 WeakPolarHBondContact O-CD1 3.42Å; I504-L508 PolarHBondContact O-N 3.27Å; I504-L578 HydrophobicContact CD1-CD1 4.32Å; I504-L578 HydrophobicContact CD1-CD2 4.18Å; I504-L578 HydrophobicContact CG1-CD1 4.31Å; I504-L580 HydrophobicContact CG2-CD1 4.17Å; I504-L580 HydrophobicContact CG2-CD2 3.5Å; I504-L580 HydrophobicContact CG2-CG 4.49Å; I504-V586 HydrophobicContact CD1-CG1 4.28Å; I504-V597 HydrophobicContact CD1-CG1 4.46Å
505	E	67.4	Low	68	Low	111 Å²	111	78.2 Å²	78.2	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-64	-34.1	176.2	-64.5	-172.4	152.9	0	0	112.8	T503 G509 K510 L580	T503-E505 VanDerWaalsContact C-N 3.27Å; T503-E505 PolarHBondContact O-N 2.99Å; T503-E505 VanDerWaalsContact O-N 3.17Å; E505-G509 PolarHBondContact O-N 3.26Å; E505-K510 PolarHBondContact O-N 3.16Å; E505-K510 VanDerWaalsContact O-N 3.09Å; E505-L580 HydrophobicContact CG-CD1 3.53Å; E505-L580 WeakPolarHBondContact OE1-CD1 3.48Å
506	K	68.3	Low	66.4	Low	153 Å²	153	83.3 Å²	83.3	67%	0.665	44%	0.437	S	S	*	.	H	α-helix	trans	-70.4	-39.5	175.6	-58.6	-167.1	-173.9	176.5	0	111.4	T503 I504 G509	T503-K506 HydrophobicContact CG2-CB 3.98Å; T503-K506 HydrophobicContact CG2-CD 3.92Å; T503-K506 HydrophobicContact CG2-CG 4.12Å; T503-K506 WeakPolarHBondContact O-CB 3.39Å; T503-K506 PolarHBondContact O-N 3.32Å; I504-K506 VanDerWaalsContact C-N 3.29Å; I504-K506 PolarHBondContact O-N 3.11Å; K506-G509 PolarHBondContact O-N 3.29Å
507	V	69.6	Low	64.9	Low	79 Å²	79	87.4 Å²	87.4	48%	0.479	46%	0.462	S	S	.	.	H	α-helix	trans	-69.3	-35	-179.5	177.9	0	0	0	0	111.7	A498 T503 I504 G509	A498-V507 HydrophobicContact CB-CB 4.42Å; A498-V507 HydrophobicContact CB-CG2 3.82Å; T503-V507 PolarHBondContact O-N 3.39Å; I504-V507 PolarHBondContact O-N 3.31Å; V507-G509 VanDerWaalsContact C-N 3.34Å
508	L	66.2	Low	63.4	Low	16 Å²	16	90.4 Å²	90.4	8%	0.084	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	11.9	178.2	-75.4	118.2	0	0	0	114.4	L495 I504 K510 I576 L578 V597 E598	L495-L508 HydrophobicContact CD2-CD1 4.45Å; I504-L508 HydrophobicContact CB-CD1 4.42Å; I504-L508 HydrophobicContact CD1-CD1 3.77Å; I504-L508 HydrophobicContact CG1-CD1 3.14Å; I504-L508 WeakPolarHBondContact O-CD1 3.42Å; I504-L508 PolarHBondContact O-N 3.27Å; L508-K510 PolarHBondContact O-N 3.28Å; L508-I576 HydrophobicContact CB-CD1 4.33Å; L508-I576 HydrophobicContact CD2-CB 4.42Å; L508-I576 HydrophobicContact CD2-CD1 3.93Å; L508-I576 HydrophobicContact CD2-CG1 3.94Å; L508-I576 HydrophobicContact CD2-CG2 3.58Å; L508-L578 HydrophobicContact CB-CD1 4.43Å; L508-L578 HydrophobicContact CD1-CD1 3.44Å; L508-L578 VanDerWaalsContact CD1-CD1 3.44Å; L508-L578 HydrophobicContact CD2-CD1 3.95Å; L508-L578 HydrophobicContact CG-CD1 4.14Å; L508-V597 HydrophobicContact CD1-CG1 4.34Å; L508-V597 HydrophobicContact CD2-CG1 4.11Å; L508-E598 HydrophobicContact CD2-CB 4.17Å
509	G	62.1	Low	61.9	Low	64 Å²	64	94.2 Å²	94.2	66%	0.66	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	16.5	174.2	0	0	0	0	0	115	E505 K506 V507 E511	E505-G509 PolarHBondContact O-N 3.26Å; K506-G509 PolarHBondContact O-N 3.29Å; V507-G509 VanDerWaalsContact C-N 3.34Å; G509-E511 PolarHBondContact O-N 3.17Å
510	K	56.8	Low	60.6	Low	95 Å²	95	96.3 Å²	96.3	41%	0.413	52%	0.516	S	S	.	.			trans	-82.4	45.6	176.1	-71.3	-168.5	178.5	-178.9	0	111.4	E505 L508 K512 I576	E505-K510 PolarHBondContact O-N 3.16Å; E505-K510 VanDerWaalsContact O-N 3.09Å; L508-K510 PolarHBondContact O-N 3.28Å; K510-K512 PolarHBondContact O-N 2.78Å; K510-K512 VanDerWaalsContact O-N 3.15Å; K510-I576 PolarHBondContact NZ-O 3.36Å; K510-I576 VanDerWaalsContact NZ-O 3.08Å
511	E	44.3	Very low	59.5	Low	136 Å²	136	101.9 Å²	101.9	64%	0.636	55%	0.553	S	S	*	*			trans	-69.7	111.9	162.7	-79.4	-165.2	164.9	0	0	108	G509 K513	G509-E511 PolarHBondContact O-N 3.17Å; E511-K513 PolarHBondContact O-N 2.9Å
512	K	44.9	Very low	58.3	Low	191 Å²	191	105.1 Å²	105.1	83%	0.83	57%	0.57	S	S	*	*			trans	-61.7	98.6	143.7	-79.8	-178.5	178.4	177.1	0	104.8	K510 E514	K510-K512 PolarHBondContact O-N 2.78Å; K510-K512 VanDerWaalsContact O-N 3.15Å; K512-E514 PolarHBondContact O-N 3.43Å
513	K	42.9	Very low	57.4	Low	171 Å²	171	100.4 Å²	100.4	74%	0.743	57%	0.566	S	S	*	*			trans	-58.4	93.5	158.3	-73.9	-178.8	-179.8	172.7	0	105.4	E511 A515	E511-K513 PolarHBondContact O-N 2.9Å; K513-A515 VanDerWaalsContact C-N 3.28Å; K513-A515 PolarHBondContact O-N 3Å
514	E	41.2	Very low	56.1	Low	173 Å²	173	107 Å²	107	81%	0.808	58%	0.584	S	S	*	*			trans	-60.9	102.9	165.5	-76.4	-169.5	162.3	0	0	105	K512	K512-E514 PolarHBondContact O-N 3.43Å
515	A	47.7	Very low	55.2	Low	80 Å²	80	111.3 Å²	111.3	66%	0.661	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-51.1	130.9	171.2	0	0	0	0	0	107	K513 V517	K513-A515 VanDerWaalsContact C-N 3.28Å; K513-A515 PolarHBondContact O-N 3Å; A515-V517 PolarHBondContact O-N 3.22Å; A515-V517 VanDerWaalsContact O-N 3.12Å
516	P	50.4	Low	54.4	Low	120 Å²	120	112.6 Å²	112.6	78%	0.779	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-53.2	125.4	-174.1	18.4	-29.5	0	0	0	109	P518	P516-P518 VanDerWaalsContact O-CD 3.24Å; P516-P518 WeakPolarHBondContact O-CD 3.41Å; P516-P518 VanDerWaalsContact O-N 3.08Å
517	V	53.1	Low	53.5	Low	89 Å²	89	116.3 Å²	116.3	54%	0.539	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-59.3	116.4	177.9	179.2	0	0	0	0	106.7	A515 V519 P525	A515-V517 PolarHBondContact O-N 3.22Å; A515-V517 VanDerWaalsContact O-N 3.12Å; V517-V519 VanDerWaalsContact O-CG2 3.27Å; V517-V519 WeakPolarHBondContact O-CG2 3.39Å; V517-V519 PolarHBondContact O-N 3.45Å; V517-P525 HydrophobicContact CG1-CB 4.13Å
518	P	55.9	Low	52.6	Low	91 Å²	91	124.4 Å²	124.4	59%	0.591	65%	0.648	S	S	*	*			trans	-63.4	115.2	-179.4	23.1	-30.4	0	0	0	108.1	P516 K526	P516-P518 VanDerWaalsContact O-CD 3.24Å; P516-P518 WeakPolarHBondContact O-CD 3.41Å; P516-P518 VanDerWaalsContact O-N 3.08Å; P518-K526 WeakPolarHBondContact O-CB 3.25Å; P518-K526 PolarHBondContact O-N 3.25Å
519	V	51.2	Low	51.5	Low	88 Å²	88	129.5 Å²	129.5	53%	0.533	68%	0.68	S	S	.	*	B	Isolated β-bridge	trans	-89.4	141	178.4	-162.4	0	0	0	0	107.8	V517 G523 R524	V517-V519 VanDerWaalsContact O-CG2 3.27Å; V517-V519 WeakPolarHBondContact O-CG2 3.39Å; V517-V519 PolarHBondContact O-N 3.45Å; V519-G523 VanDerWaalsContact CG1-CA 3.4Å; V519-G523 WeakPolarHBondContact CG1-O 3.35Å; V519-R524 WeakPolarHBondContact CG1-O 3.49Å
520	T	57.2	Low	50.7	Low	49 Å²	49	138.4 Å²	138.4	30%	0.301	69%	0.694	S	S	.	*			trans	-69.7	162.7	167.4	47.7	0	0	0	0	110.2	D522 G523 R524 K526	T520-D522 PolarHBondContact O-N 2.68Å; T520-G523 PolarHBondContact O-N 2.95Å; T520-R524 PolarHBondContact N-O 3.49Å; T520-R524 PolarHBondContact OG1-O 2.9Å; T520-K526 HydrophobicContact CG2-CG 4.5Å
521	P	61.5	Low	50.2	Low	136 Å²	136	144.3 Å²	144.3	88%	0.883	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-26.3	177	-26.8	34.9	0	0	0	114.2	G523	P521-G523 VanDerWaalsContact C-N 3.33Å; P521-G523 PolarHBondContact O-N 3.32Å
522	D	57.7	Low	50.3	Low	150 Å²	150	143.5 Å²	143.5	80%	0.802	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	16.7	177.6	-53.1	-49.8	0	0	0	115.1	T520 R524	T520-D522 PolarHBondContact O-N 2.68Å; D522-R524 VanDerWaalsContact C-N 3.31Å; D522-R524 PolarHBondContact O-N 3.48Å
523	G	58.1	Low	50.5	Low	58 Å²	58	138.9 Å²	138.9	60%	0.598	71%	0.71	S	S	*	*	S	Bend	trans	76.6	5.6	171.2	0	0	0	0	0	116.3	V519 T520 P521	V519-G523 VanDerWaalsContact CG1-CA 3.4Å; V519-G523 WeakPolarHBondContact CG1-O 3.35Å; T520-G523 PolarHBondContact O-N 2.95Å; P521-G523 VanDerWaalsContact C-N 3.33Å; P521-G523 PolarHBondContact O-N 3.32Å
524	R	49.9	Very low	50.8	Low	193 Å²	193	137.3 Å²	137.3	73%	0.728	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-94.8	136.3	-178.2	-156.9	172	-173.1	179.5	3.3	112.5	V519 T520 D522 K526	V519-R524 WeakPolarHBondContact CG1-O 3.49Å; T520-R524 PolarHBondContact N-O 3.49Å; T520-R524 PolarHBondContact OG1-O 2.9Å; D522-R524 VanDerWaalsContact C-N 3.31Å; D522-R524 PolarHBondContact O-N 3.48Å; R524-K526 PolarHBondContact O-N 2.97Å
525	P	53.4	Low	51.2	Low	94 Å²	94	138.6 Å²	138.6	61%	0.61	71%	0.709	S	S	*	*	B	Isolated β-bridge	trans	-61	125	174.7	-22.1	32.1	0	0	0	111.7	V517 R527	V517-P525 HydrophobicContact CG1-CB 4.13Å; P525-R527 PolarHBondContact O-N 3.44Å
526	K	50.3	Low	51.4	Low	138 Å²	138	138.8 Å²	138.8	60%	0.6	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-70.5	116	-178.2	-158.9	173.4	-171.8	176.2	0	110.5	P518 T520 R524 R528	P518-K526 WeakPolarHBondContact O-CB 3.25Å; P518-K526 PolarHBondContact O-N 3.25Å; T520-K526 HydrophobicContact CG2-CG 4.5Å; R524-K526 PolarHBondContact O-N 2.97Å; K526-R528 PolarHBondContact O-N 3.26Å
527	R	49.1	Very low	51.4	Low	232 Å²	232	141.8 Å²	141.8	88%	0.875	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-69.1	118.2	178.4	-147	178.1	-170.9	-170.5	2.5	109.1	P525 T529	P525-R527 PolarHBondContact O-N 3.44Å; R527-T529 PolarHBondContact O-N 2.9Å; R527-T529 VanDerWaalsContact O-N 3.13Å
528	R	49.8	Very low	51.3	Low	249 Å²	249	143.6 Å²	143.6	94%	0.94	72%	0.721	S	S	*	*			trans	-70.6	105	174.1	-69.9	177.7	88.1	174.5	6.3	108.8	K526	K526-R528 PolarHBondContact O-N 3.26Å
529	T	43.2	Very low	51	Low	122 Å²	122	149 Å²	149	75%	0.748	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.9	139.3	163.7	48.5	0	0	0	0	109	R527 R531	R527-T529 PolarHBondContact O-N 2.9Å; R527-T529 VanDerWaalsContact O-N 3.13Å; T529-R531 PolarHBondContact O-N 3.15Å
530	R	45.9	Very low	51.1	Low	251 Å²	251	148 Å²	148	95%	0.947	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-59	121.8	160.6	-86.4	178.9	169.3	169.8	-4.3	106.1	S532	R530-S532 PolarHBondContact O-N 3.47Å
531	R	46.5	Very low	50.9	Low	220 Å²	220	154.1 Å²	154.1	83%	0.83	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-53.9	131.8	170.3	-82.8	-178.1	174.5	176.1	-3.1	107.9	T529 V533	T529-R531 PolarHBondContact O-N 3.15Å; R531-V533 PolarHBondContact O-N 2.93Å
532	S	46.7	Very low	51.3	Low	118 Å²	118	151.5 Å²	151.5	83%	0.825	75%	0.747	S	S	*	*			trans	-65.8	113.5	165.8	50.1	0	0	0	0	107.3	R530 D534	R530-S532 PolarHBondContact O-N 3.47Å; S532-D534 PolarHBondContact O-N 2.79Å
533	V	49.3	Very low	51.5	Low	95 Å²	95	152.3 Å²	152.3	58%	0.576	75%	0.746	S	S	*	*			trans	-77.1	114	169	-179	0	0	0	0	106	R531 Y535	R531-V533 PolarHBondContact O-N 2.93Å; V533-Y535 HydrophobicContact CB-CD2 4.3Å; V533-Y535 HydrophobicContact CB-CE2 3.76Å; V533-Y535 HydrophobicContact CG1-CD1 4.34Å; V533-Y535 HydrophobicContact CG1-CD2 3.98Å; V533-Y535 HydrophobicContact CG1-CE1 3.97Å; V533-Y535 HydrophobicContact CG1-CE2 3.58Å; V533-Y535 HydrophobicContact CG1-CG 4.35Å; V533-Y535 WeakPolarHBondContact O-CD2 3.42Å
534	D	49.5	Very low	51.9	Low	137 Å²	137	153.1 Å²	153.1	73%	0.733	75%	0.747	S	S	*	*			trans	-83.4	117.8	172.9	-160.5	-16	0	0	0	107.9	S532 S536	S532-D534 PolarHBondContact O-N 2.79Å; D534-S536 PolarHBondContact OD1-OG 2.87Å; D534-S536 VanDerWaalsContact OD1-OG 3.09Å
535	Y	48.1	Very low	52.5	Low	201 Å²	201	145.9 Å²	145.9	79%	0.788	73%	0.728	S	S	*	*			trans	-99.6	31.3	-176.4	-72.3	-85.9	0	0	0	111.9	V533 E537	V533-Y535 HydrophobicContact CB-CD2 4.3Å; V533-Y535 HydrophobicContact CB-CE2 3.76Å; V533-Y535 HydrophobicContact CG1-CD1 4.34Å; V533-Y535 HydrophobicContact CG1-CD2 3.98Å; V533-Y535 HydrophobicContact CG1-CE1 3.97Å; V533-Y535 HydrophobicContact CG1-CE2 3.58Å; V533-Y535 HydrophobicContact CG1-CG 4.35Å; V533-Y535 WeakPolarHBondContact O-CD2 3.42Å; Y535-E537 PolarHBondContact O-N 2.83Å; Y535-E537 VanDerWaalsContact O-N 3.14Å
536	S	53.3	Low	53	Low	84 Å²	84	146.4 Å²	146.4	59%	0.587	73%	0.726	S	S	*	*			trans	-80.4	93.2	172.7	42.8	0	0	0	0	110.1	D534 T538	D534-S536 PolarHBondContact OD1-OG 2.87Å; D534-S536 VanDerWaalsContact OD1-OG 3.09Å; S536-T538 PolarHBondContact O-N 2.94Å
537	E	49.3	Very low	53.7	Low	182 Å²	182	145.7 Å²	145.7	85%	0.85	73%	0.726	S	S	*	*			trans	-64	121.9	166.5	-69.8	-178.2	170.9	0	0	108.8	Y535	Y535-E537 PolarHBondContact O-N 2.83Å; Y535-E537 VanDerWaalsContact O-N 3.14Å
538	T	50.5	Low	54.7	Low	128 Å²	128	141.5 Å²	141.5	79%	0.785	71%	0.714	S	S	*	*			trans	-90.3	111.9	169.4	33.1	0	0	0	0	107.3	S536 S540	S536-T538 PolarHBondContact O-N 2.94Å; T538-S540 PolarHBondContact O-N 2.89Å
539	E	50	Low	55.5	Low	204 Å²	204	136.6 Å²	136.6	95%	0.953	70%	0.697	S	S	*	*	S	Bend	trans	-66	43.5	-171.9	-63.3	-178	146.2	0	0	115.5
540	S	53.2	Low	56.7	Low	66 Å²	66	135.4 Å²	135.4	46%	0.462	69%	0.685	S	S	.	*			trans	-129.8	93.7	174.2	65	0	0	0	0	111.9	T538 T542	T538-S540 PolarHBondContact O-N 2.89Å; S540-T542 PolarHBondContact O-N 3.01Å
541	D	53.8	Low	57.8	Low	179 Å²	179	129.6 Å²	129.6	96%	0.957	67%	0.669	S	S	*	*			trans	-68.9	61.5	171	-79	-20.8	0	0	0	111.5
542	T	69.3	Low	58.9	Low	80 Å²	80	126.3 Å²	126.3	49%	0.491	66%	0.656	S	S	.	*			trans	-98.6	136.1	170	51.1	0	0	0	0	109.9	S540 A544 A545 L546	S540-T542 PolarHBondContact O-N 3.01Å; T542-A544 PolarHBondContact O-N 3Å; T542-A545 WeakPolarHBondContact O-CB 3.46Å; T542-A545 PolarHBondContact O-N 3.47Å; T542-L546 PolarHBondContact O-N 2.98Å
543	Q	61.4	Low	59.6	Low	167 Å²	167	123.6 Å²	123.6	78%	0.78	64%	0.635	S	S	*	*	H	α-helix	trans	-57.2	-26.5	-178	-166	163.9	-5.8	0	0	113.1	M547	Q543-M547 WeakPolarHBondContact O-CB 3.27Å; Q543-M547 WeakPolarHBondContact O-CG 3.16Å; Q543-M547 PolarHBondContact O-N 3.2Å
544	A	66.1	Low	60	Low	75 Å²	75	128 Å²	128	62%	0.62	64%	0.641	S	S	*	*	H	α-helix	trans	-70.8	-35.8	173.4	0	0	0	0	0	113.3	T542 K548	T542-A544 PolarHBondContact O-N 3Å; A544-K548 VanDerWaalsContact O-CB 3.31Å; A544-K548 WeakPolarHBondContact O-CB 3.46Å; A544-K548 PolarHBondContact O-N 3.47Å
545	A	62.6	Low	60.6	Low	41 Å²	41	128 Å²	128	34%	0.339	63%	0.634	S	S	.	*	H	α-helix	trans	-69.4	-38.8	175.1	0	0	0	0	0	111.1	T542 K548 Y549	T542-A545 WeakPolarHBondContact O-CB 3.46Å; T542-A545 PolarHBondContact O-N 3.47Å; A545-K548 PolarHBondContact O-N 2.84Å; A545-Y549 WeakPolarHBondContact O-CB 3.36Å; A545-Y549 PolarHBondContact O-N 2.95Å
546	L	64.2	Low	60.8	Low	105 Å²	105	123.9 Å²	123.9	55%	0.55	62%	0.623	S	S	.	*	H	α-helix	trans	-64.9	-43.8	174.3	-172	70.8	0	0	0	112.1	T542 Y549 L550	T542-L546 PolarHBondContact O-N 2.98Å; L546-Y549 PolarHBondContact O-N 3.46Å; L546-L550 HydrophobicContact CG-CD1 4.2Å; L546-L550 WeakPolarHBondContact O-CB 3.13Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 2.93Å
547	M	65.3	Low	60.8	Low	124 Å²	124	122.9 Å²	122.9	61%	0.611	62%	0.619	S	S	*	*	H	α-helix	trans	-61.3	-44.6	174	-79.6	-102.9	-80.7	0	0	111.5	Q543 Y549 L550 E551	Q543-M547 WeakPolarHBondContact O-CB 3.27Å; Q543-M547 WeakPolarHBondContact O-CG 3.16Å; Q543-M547 PolarHBondContact O-N 3.2Å; M547-Y549 VanDerWaalsContact C-N 3.31Å; M547-Y549 PolarHBondContact O-N 3.09Å; M547-L550 PolarHBondContact O-N 3.32Å; M547-E551 VanDerWaalsContact O-CB 3.29Å; M547-E551 WeakPolarHBondContact O-CB 3.43Å; M547-E551 PolarHBondContact O-N 2.78Å
548	K	70.5	Confident	60.8	Low	144 Å²	144	121.5 Å²	121.5	63%	0.626	61%	0.613	S	S	*	*	H	α-helix	trans	-66.4	-32.6	178	-165.4	175.3	-173.7	177.2	0	112.6	A544 A545 R552	A544-K548 VanDerWaalsContact O-CB 3.31Å; A544-K548 WeakPolarHBondContact O-CB 3.46Å; A544-K548 PolarHBondContact O-N 3.47Å; A545-K548 PolarHBondContact O-N 2.84Å; K548-R552 WeakPolarHBondContact O-CB 3.24Å; K548-R552 PolarHBondContact O-N 3.26Å
549	Y	67.3	Low	60.7	Low	146 Å²	146	122 Å²	122	57%	0.573	61%	0.611	S	S	*	*	H	α-helix	trans	-68.7	-49.9	171.8	179.6	-97.7	0	0	0	111.2	A545 L546 M547 E551 R552 V553	A545-Y549 WeakPolarHBondContact O-CB 3.36Å; A545-Y549 PolarHBondContact O-N 2.95Å; L546-Y549 PolarHBondContact O-N 3.46Å; M547-Y549 VanDerWaalsContact C-N 3.31Å; M547-Y549 PolarHBondContact O-N 3.09Å; Y549-E551 VanDerWaalsContact C-N 3.25Å; Y549-E551 PolarHBondContact O-N 3.14Å; Y549-R552 CarbonylContact O-C 3.49Å; Y549-R552 WeakPolarHBondContact O-CB 3.34Å; Y549-R552 PolarHBondContact O-N 2.77Å; Y549-R552 VanDerWaalsContact O-N 3.11Å; Y549-V553 HydrophobicContact CD1-CG2 4.1Å; Y549-V553 HydrophobicContact CE1-CG2 3.74Å; Y549-V553 HydrophobicContact CE2-CG2 4.35Å; Y549-V553 WeakPolarHBondContact O-CG2 3.47Å; Y549-V553 PolarHBondContact O-N 3.06Å
550	L	67.2	Low	60.2	Low	96 Å²	96	114.5 Å²	114.5	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-58.3	-37.2	176.2	-80.4	163.1	0	0	0	112.6	L546 M547 V553 R554	L546-L550 HydrophobicContact CG-CD1 4.2Å; L546-L550 WeakPolarHBondContact O-CB 3.13Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 2.93Å; M547-L550 PolarHBondContact O-N 3.32Å; L550-V553 PolarHBondContact O-N 2.8Å; L550-R554 WeakPolarHBondContact O-CB 3.44Å; L550-R554 PolarHBondContact O-N 3.23Å
551	E	70.3	Confident	59.8	Low	130 Å²	130	117.1 Å²	117.1	61%	0.607	60%	0.596	S	S	*	*	H	α-helix	trans	-74.3	-33.1	177.6	-163.5	149.8	-155.5	0	0	112.4	M547 Y549 K555	M547-E551 VanDerWaalsContact O-CB 3.29Å; M547-E551 WeakPolarHBondContact O-CB 3.43Å; M547-E551 PolarHBondContact O-N 2.78Å; Y549-E551 VanDerWaalsContact C-N 3.25Å; Y549-E551 PolarHBondContact O-N 3.14Å; E551-K555 WeakPolarHBondContact O-CB 3.43Å; E551-K555 PolarHBondContact O-N 3.21Å
552	R	68.6	Low	58.9	Low	150 Å²	150	112.6 Å²	112.6	57%	0.566	58%	0.579	S	S	*	*	H	α-helix	trans	-65.8	-43.5	168.7	-169	-175.2	-64.3	163.5	-1.1	111.2	K548 Y549 K555 E556	K548-R552 WeakPolarHBondContact O-CB 3.24Å; K548-R552 PolarHBondContact O-N 3.26Å; Y549-R552 CarbonylContact O-C 3.49Å; Y549-R552 WeakPolarHBondContact O-CB 3.34Å; Y549-R552 PolarHBondContact O-N 2.77Å; Y549-R552 VanDerWaalsContact O-N 3.11Å; R552-K555 PolarHBondContact O-N 3.47Å; R552-E556 WeakPolarHBondContact O-CB 3.36Å; R552-E556 WeakPolarHBondContact O-CG 3.39Å; R552-E556 PolarHBondContact O-N 3.34Å
553	V	62.5	Low	57.4	Low	62 Å²	62	113.5 Å²	113.5	38%	0.376	59%	0.586	S	S	.	*	H	α-helix	trans	-63.7	-40.5	175.6	174.5	0	0	0	0	111.1	Y549 L550 E556 A557	Y549-V553 HydrophobicContact CD1-CG2 4.1Å; Y549-V553 HydrophobicContact CE1-CG2 3.74Å; Y549-V553 HydrophobicContact CE2-CG2 4.35Å; Y549-V553 WeakPolarHBondContact O-CG2 3.47Å; Y549-V553 PolarHBondContact O-N 3.06Å; L550-V553 PolarHBondContact O-N 2.8Å; V553-E556 PolarHBondContact O-N 3.33Å; V553-A557 WeakPolarHBondContact O-CB 3.35Å; V553-A557 PolarHBondContact O-N 3.08Å
554	R	57.9	Low	56.2	Low	186 Å²	186	111 Å²	111	70%	0.702	58%	0.584	S	S	*	*	H	α-helix	trans	-63.8	-46.9	173.8	-90	-174.1	173.2	-175.1	-1.9	112.5	L550 E556 A557 E558	L550-R554 WeakPolarHBondContact O-CB 3.44Å; L550-R554 PolarHBondContact O-N 3.23Å; R554-E556 VanDerWaalsContact C-N 3.3Å; R554-E556 PolarHBondContact O-N 2.95Å; R554-A557 WeakPolarHBondContact O-CB 3.06Å; R554-A557 PolarHBondContact O-N 3.32Å; R554-A557 VanDerWaalsContact O-N 3.15Å; R554-E558 WeakPolarHBondContact O-CG 3.14Å; R554-E558 PolarHBondContact O-N 3.13Å
555	K	60.6	Low	54.8	Low	137 Å²	137	113.2 Å²	113.2	60%	0.596	59%	0.59	S	S	*	*	H	α-helix	trans	-64.1	-33.6	175.9	-101.3	179	173.6	172.1	0	113	E551 R552 N559	E551-K555 WeakPolarHBondContact O-CB 3.43Å; E551-K555 PolarHBondContact O-N 3.21Å; R552-K555 PolarHBondContact O-N 3.47Å; K555-N559 VanDerWaalsContact O-CB 3.29Å; K555-N559 WeakPolarHBondContact O-CB 3.31Å; K555-N559 PolarHBondContact O-N 3.45Å; K555-N559 PolarHBondContact O-ND2 2.87Å
556	E	53.1	Low	53.5	Low	116 Å²	116	118.6 Å²	118.6	54%	0.542	61%	0.612	S	S	.	*	H	α-helix	trans	-71.2	-33.3	173.1	-79.2	-177.1	173.9	0	0	112.3	R552 V553 R554 S560	R552-E556 WeakPolarHBondContact O-CB 3.36Å; R552-E556 WeakPolarHBondContact O-CG 3.39Å; R552-E556 PolarHBondContact O-N 3.34Å; V553-E556 PolarHBondContact O-N 3.33Å; R554-E556 VanDerWaalsContact C-N 3.3Å; R554-E556 PolarHBondContact O-N 2.95Å; E556-S560 WeakPolarHBondContact O-CB 3.37Å; E556-S560 PolarHBondContact O-N 2.93Å; E556-S560 VanDerWaalsContact O-N 3.1Å
557	A	53.4	Low	51.9	Low	63 Å²	63	120.1 Å²	120.1	52%	0.521	62%	0.621	S	S	.	*	H	α-helix	trans	-69.2	-40.9	172.6	0	0	0	0	0	112	V553 R554 S560	V553-A557 WeakPolarHBondContact O-CB 3.35Å; V553-A557 PolarHBondContact O-N 3.08Å; R554-A557 WeakPolarHBondContact O-CB 3.06Å; R554-A557 PolarHBondContact O-N 3.32Å; R554-A557 VanDerWaalsContact O-N 3.15Å; A557-S560 PolarHBondContact O-OG 3.11Å
558	E	48.4	Very low	50.4	Low	152 Å²	152	121.6 Å²	121.6	71%	0.71	63%	0.63	S	S	*	*	H	α-helix	trans	-72.6	-34.4	178.6	-74.2	174.8	176.4	0	0	113.4	R554	R554-E558 WeakPolarHBondContact O-CG 3.14Å; R554-E558 PolarHBondContact O-N 3.13Å
559	N	49.3	Very low	48.9	Very low	139 Å²	139	119 Å²	119	74%	0.743	63%	0.63	S	S	*	*	H	α-helix	trans	-88.9	-8.1	178.2	-74.1	-37.9	0	0	0	114.1	K555	K555-N559 VanDerWaalsContact O-CB 3.29Å; K555-N559 WeakPolarHBondContact O-CB 3.31Å; K555-N559 PolarHBondContact O-N 3.45Å; K555-N559 PolarHBondContact O-ND2 2.87Å
560	S	40.1	Very low	47.4	Very low	47 Å²	47	117.3 Å²	117.3	33%	0.329	63%	0.634	S	S	.	*	S	Bend	trans	-72.5	131.4	164.3	72.7	0	0	0	0	107.7	E556 A557 S562	E556-S560 WeakPolarHBondContact O-CB 3.37Å; E556-S560 PolarHBondContact O-N 2.93Å; E556-S560 VanDerWaalsContact O-N 3.1Å; A557-S560 PolarHBondContact O-OG 3.11Å; S560-S562 PolarHBondContact O-N 3.22Å
561	P	43.4	Very low	46.2	Very low	120 Å²	120	116.1 Å²	116.1	78%	0.779	63%	0.633	S	S	*	*			trans	-56.2	118	161.8	25.9	-29	0	0	0	103.6	P563	P561-P563 VanDerWaalsContact O-N 3.12Å
562	S	34.7	Very low	45.6	Very low	84 Å²	84	113.9 Å²	113.9	59%	0.587	63%	0.629	S	S	*	*			trans	-35.7	127.1	179	50.2	0	0	0	0	107.4	S560 P564	S560-S562 PolarHBondContact O-N 3.22Å; S562-P564 VanDerWaalsContact O-N 3.1Å
563	P	38.2	Very low	45	Very low	99 Å²	99	112 Å²	112	64%	0.643	63%	0.631	S	S	*	*			trans	-47.2	133.4	160.8	24.5	-30.2	0	0	0	104	P561 V565	P561-P563 VanDerWaalsContact O-N 3.12Å; P563-V565 PolarHBondContact O-N 2.61Å
564	P	37.1	Very low	44.8	Very low	114 Å²	114	109.4 Å²	109.4	74%	0.74	62%	0.615	S	S	*	*			trans	-45.4	118.8	-179.6	21.7	-31.2	0	0	0	103.8	S562 L566	S562-P564 VanDerWaalsContact O-N 3.1Å; P564-L566 VanDerWaalsContact C-N 3.32Å; P564-L566 PolarHBondContact O-N 3.47Å
565	V	36	Very low	45.1	Very low	122 Å²	122	104.4 Å²	104.4	74%	0.739	60%	0.603	S	S	*	*			trans	-38.7	115.5	170.9	168.5	0	0	0	0	101.8	P563 D567	P563-V565 PolarHBondContact O-N 2.61Å; V565-D567 PolarHBondContact O-N 3.01Å
566	L	36.1	Very low	45.4	Very low	155 Å²	155	99.6 Å²	99.6	81%	0.812	58%	0.583	S	S	*	*			trans	-42.6	107.9	175.4	-84.6	151.8	0	0	0	102.2	P564 I568	P564-L566 VanDerWaalsContact C-N 3.32Å; P564-L566 PolarHBondContact O-N 3.47Å; L566-I568 PolarHBondContact O-N 2.92Å
567	D	30.1	Very low	45.9	Very low	136 Å²	136	97.8 Å²	97.8	73%	0.727	58%	0.58	S	S	*	*			trans	-47.5	112.9	163.4	-100.9	-26.7	0	0	0	99.4	V565 S569	V565-D567 PolarHBondContact O-N 3.01Å; D567-S569 PolarHBondContact O-N 3.43Å
568	I	33.9	Very low	46.4	Very low	156 Å²	156	96.3 Å²	96.3	80%	0.8	56%	0.563	S	S	*	*			trans	-56.7	95.3	169.4	-67.7	168.4	0	0	0	99.4	L566 T570	L566-I568 PolarHBondContact O-N 2.92Å; I568-T570 PolarHBondContact O-N 3.47Å
569	S	37.8	Very low	47.2	Very low	90 Å²	90	96.7 Å²	96.7	63%	0.629	56%	0.562	S	S	*	*			trans	-59.1	107.1	-179.3	51.6	0	0	0	0	100	D567	D567-S569 PolarHBondContact O-N 3.43Å
570	T	37.6	Very low	47.9	Very low	109 Å²	109	93.1 Å²	93.1	67%	0.669	54%	0.543	S	S	*	.			trans	-34.9	117.8	160.9	34.4	0	0	0	0	104.2	I568	I568-T570 PolarHBondContact O-N 3.47Å
571	P	42.2	Very low	49.1	Very low	72 Å²	72	100.2 Å²	100.2	47%	0.468	57%	0.571	S	S	.	*			trans	-48.8	122.8	179.6	20.3	-30.1	0	0	0	104.4	D573	P571-D573 PolarHBondContact O-N 2.91Å
572	P	56.2	Low	50.6	Low	83 Å²	83	98.3 Å²	98.3	54%	0.539	55%	0.554	S	S	.	*			trans	-56.5	122.4	-167.2	23.9	-33.7	0	0	0	106	A574	P572-A574 WeakPolarHBondContact CB-O 3.43Å; P572-A574 PolarHBondContact O-N 3.21Å
573	D	55.9	Low	52.9	Low	111 Å²	111	96.2 Å²	96.2	59%	0.594	54%	0.538	S	S	*	.	S	Bend	trans	-57.9	-5.5	-178.2	-67.2	-36.7	0	0	0	111.5	P571 L601	P571-D573 PolarHBondContact O-N 2.91Å; D573-L601 PolarHBondContact O-N 2.65Å
574	A	59.1	Low	55	Low	6 Å²	6	93.9 Å²	93.9	5%	0.05	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.2	170.2	0	0	0	0	0	113.5	P572 E598 Y599	P572-A574 WeakPolarHBondContact CB-O 3.43Å; P572-A574 PolarHBondContact O-N 3.21Å; A574-E598 HydrophobicContact CB-CB 4.49Å; A574-E598 HydrophobicContact CB-CG 3.28Å; A574-Y599 CarbonylContact C-O 3.58Å; A574-Y599 WeakPolarHBondContact CA-O 3.5Å; A574-Y599 VanDerWaalsContact CB-O 3.28Å; A574-Y599 WeakPolarHBondContact CB-O 3.29Å
575	D	64.1	Low	57.2	Low	82 Å²	82	91.6 Å²	91.6	44%	0.439	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.8	168.4	-170.7	6.3	0	0	0	110.3	Y599 L601	D575-Y599 PolarHBondContact N-O 3.24Å; D575-Y599 PolarHBondContact O-N 3.28Å; D575-L601 HydrophobicContact CB-CD1 4.36Å
576	I	66.9	Low	59.5	Low	36 Å²	36	86 Å²	86	19%	0.185	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	96.3	-173.2	-57.4	167.5	0	0	0	111.2	L508 K510 L578 V597	L508-I576 HydrophobicContact CB-CD1 4.33Å; L508-I576 HydrophobicContact CD2-CB 4.42Å; L508-I576 HydrophobicContact CD2-CD1 3.93Å; L508-I576 HydrophobicContact CD2-CG1 3.94Å; L508-I576 HydrophobicContact CD2-CG2 3.58Å; K510-I576 PolarHBondContact NZ-O 3.36Å; K510-I576 VanDerWaalsContact NZ-O 3.08Å; I576-L578 HydrophobicContact CG2-CB 4.29Å; I576-L578 HydrophobicContact CG2-CD1 3.62Å; I576-L578 HydrophobicContact CG2-CG 3.86Å; I576-L578 PolarHBondContact O-N 3.04Å; I576-V597 WeakPolarHBondContact CA-O 3.45Å
577	T	62.7	Low	61.9	Low	78 Å²	78	78.6 Å²	78.6	48%	0.479	43%	0.427	S	S	.	.			trans	-94.5	68.6	-179	-29.3	0	0	0	0	112.9	R589 V597	T577-R589 PolarHBondContact O-NH1 3.32Å; T577-R589 VanDerWaalsContact O-NH1 3.09Å; T577-V597 PolarHBondContact N-O 3.21Å
578	L	64.3	Low	64.7	Low	31 Å²	31	72.2 Å²	72.2	16%	0.162	39%	0.393	C	S	.	.			trans	-103.1	124.2	-179.2	-76.2	170.6	0	0	0	113.7	I504 L508 I576 V586 V597	I504-L578 HydrophobicContact CD1-CD1 4.32Å; I504-L578 HydrophobicContact CD1-CD2 4.18Å; I504-L578 HydrophobicContact CG1-CD1 4.31Å; L508-L578 HydrophobicContact CB-CD1 4.43Å; L508-L578 HydrophobicContact CD1-CD1 3.44Å; L508-L578 VanDerWaalsContact CD1-CD1 3.44Å; L508-L578 HydrophobicContact CD2-CD1 3.95Å; L508-L578 HydrophobicContact CG-CD1 4.14Å; I576-L578 HydrophobicContact CG2-CB 4.29Å; I576-L578 HydrophobicContact CG2-CD1 3.62Å; I576-L578 HydrophobicContact CG2-CG 3.86Å; I576-L578 PolarHBondContact O-N 3.04Å; L578-V586 HydrophobicContact CD2-CG1 4.1Å; L578-V597 HydrophobicContact CD1-CG1 4.05Å; L578-V597 HydrophobicContact CD2-CB 4.5Å; L578-V597 HydrophobicContact CD2-CG1 3.67Å; L578-V597 HydrophobicContact CD2-CG2 4.36Å; L578-V597 HydrophobicContact CG-CG1 3.97Å
579	K	65.3	Low	67.2	Low	161 Å²	161	68 Å²	68	70%	0.7	37%	0.367	S	S	*	.			trans	-125.1	103.4	166.3	-67.3	-175.7	-179.7	-179.1	0	108.6	Q581	K579-Q581 VanDerWaalsContact C-N 3.29Å; K579-Q581 PolarHBondContact O-N 3.49Å
580	L	63.5	Low	69.6	Low	63 Å²	63	63.8 Å²	63.8	33%	0.33	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.5	-171.9	-66	171.9	0	0	0	115.3	I504 E505 N582	I504-L580 HydrophobicContact CG2-CD1 4.17Å; I504-L580 HydrophobicContact CG2-CD2 3.5Å; I504-L580 HydrophobicContact CG2-CG 4.49Å; E505-L580 HydrophobicContact CG-CD1 3.53Å; E505-L580 WeakPolarHBondContact OE1-CD1 3.48Å; L580-N582 PolarHBondContact O-N 2.89Å
581	Q	66.1	Low	72	Confident	197 Å²	197	58.6 Å²	58.6	92%	0.921	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.6	179	-70.7	179	-13.9	0	0	113.2	K579	K579-Q581 VanDerWaalsContact C-N 3.29Å; K579-Q581 PolarHBondContact O-N 3.49Å
582	N	75.8	Confident	74.2	Confident	80 Å²	80	55.2 Å²	55.2	43%	0.428	28%	0.283	S	S	.	.			trans	-132.3	91.4	179.6	-168.5	-21.9	0	0	0	111.2	L580 L584 M585 V586	L580-N582 PolarHBondContact O-N 2.89Å; N582-L584 VanDerWaalsContact C-N 3.29Å; N582-L584 PolarHBondContact O-N 3.3Å; N582-L584 PolarHBondContact OD1-N 2.8Å; N582-M585 HydrophobicContact CB-CB 4.07Å; N582-M585 HydrophobicContact CB-CG 4.12Å; N582-M585 VanDerWaalsContact CG-CG 3.48Å; N582-M585 VanDerWaalsContact ND2-CG 3.31Å; N582-M585 WeakPolarHBondContact ND2-CG 3.43Å; N582-M585 WeakPolarHBondContact O-CB 3.45Å; N582-M585 PolarHBondContact O-N 2.77Å; N582-M585 VanDerWaalsContact O-N 3.1Å; N582-M585 PolarHBondContact OD1-N 3.26Å; N582-V586 PolarHBondContact O-N 3.45Å
583	V	81.7	Confident	75.8	Confident	40 Å²	40	51.2 Å²	51.2	24%	0.242	26%	0.258	C	S	.	.	H	α-helix	trans	-54.6	-43.2	-179.8	-179.4	0	0	0	0	111.6	V499 M585 V586 L587 L788	V499-V583 HydrophobicContact CG1-CG1 3.8Å; V583-M585 VanDerWaalsContact C-N 3.29Å; V583-M585 PolarHBondContact O-N 2.99Å; V583-V586 PolarHBondContact O-N 3.01Å; V583-V586 VanDerWaalsContact O-N 3.1Å; V583-L587 HydrophobicContact CG1-CD1 4.19Å; V583-L587 HydrophobicContact CG1-CG 4.35Å; V583-L587 WeakPolarHBondContact O-CG 3.49Å; V583-L587 PolarHBondContact O-N 3.08Å; V583-L788 HydrophobicContact CG1-CD2 4.02Å
584	L	82.8	Confident	77.3	Confident	50 Å²	50	46.2 Å²	46.2	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-37.4	179.5	-65.5	177.8	0	0	0	112.3	N582 L587 K588 I748 I786	N582-L584 VanDerWaalsContact C-N 3.29Å; N582-L584 PolarHBondContact O-N 3.3Å; N582-L584 PolarHBondContact OD1-N 2.8Å; L584-L587 HydrophobicContact CD2-CD1 4.44Å; L584-L587 PolarHBondContact O-N 3.45Å; L584-K588 PolarHBondContact O-N 2.98Å; L584-I748 HydrophobicContact CD2-CD1 3.75Å; L584-I748 HydrophobicContact CD2-CG1 4.31Å; L584-I786 HydrophobicContact CD2-CG2 4.38Å
585	M	83.1	Confident	78.5	Confident	66 Å²	66	46.5 Å²	46.5	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-69.3	-34.9	176.3	-75.4	-62.8	-59.9	0	0	112.4	N582 V583 K588 R589 M644	N582-M585 HydrophobicContact CB-CB 4.07Å; N582-M585 HydrophobicContact CB-CG 4.12Å; N582-M585 VanDerWaalsContact CG-CG 3.48Å; N582-M585 VanDerWaalsContact ND2-CG 3.31Å; N582-M585 WeakPolarHBondContact ND2-CG 3.43Å; N582-M585 WeakPolarHBondContact O-CB 3.45Å; N582-M585 PolarHBondContact O-N 2.77Å; N582-M585 VanDerWaalsContact O-N 3.1Å; N582-M585 PolarHBondContact OD1-N 3.26Å; V583-M585 VanDerWaalsContact C-N 3.29Å; V583-M585 PolarHBondContact O-N 2.99Å; M585-K588 HydrophobicContact SD-CD 4.48Å; M585-R589 WeakPolarHBondContact O-CG 3.44Å; M585-R589 PolarHBondContact O-N 3.02Å; M585-R589 VanDerWaalsContact O-N 3.08Å; M585-M644 HydrophobicContact CE-CE 3.97Å
586	V	83.8	Confident	79.4	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-69.3	-43.3	174.7	-176.3	0	0	0	0	110.4	V499 I504 L578 N582 V583 K588 R589 C590	V499-V586 HydrophobicContact CG1-CB 4.31Å; V499-V586 HydrophobicContact CG1-CG1 4.2Å; V499-V586 HydrophobicContact CG2-CG1 3.64Å; I504-V586 HydrophobicContact CD1-CG1 4.28Å; L578-V586 HydrophobicContact CD2-CG1 4.1Å; N582-V586 PolarHBondContact O-N 3.45Å; V583-V586 PolarHBondContact O-N 3.01Å; V583-V586 VanDerWaalsContact O-N 3.1Å; V586-K588 VanDerWaalsContact C-N 3.3Å; V586-K588 PolarHBondContact O-N 3.06Å; V586-R589 WeakPolarHBondContact O-CB 3.47Å; V586-R589 PolarHBondContact O-N 2.87Å; V586-C590 PolarHBondContact O-N 3.31Å; V586-C590 PolarHBondContact O-SG 3.25Å; V586-C590 VanDerWaalsContact O-SG 3.35Å
587	L	87	Confident	79.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-42.5	174.4	-68.2	173.7	0	0	0	111.8	Y496 V499 V500 V583 L584 C590 C591 I748 L791	Y496-L587 HydrophobicContact CD1-CD2 4.4Å; Y496-L587 HydrophobicContact CD2-CD2 3.73Å; Y496-L587 HydrophobicContact CE1-CD2 4.26Å; Y496-L587 HydrophobicContact CE2-CB 4Å; Y496-L587 HydrophobicContact CE2-CD2 3.56Å; Y496-L587 HydrophobicContact CE2-CG 4.28Å; Y496-L587 HydrophobicContact CG-CD2 4.16Å; V499-L587 HydrophobicContact CB-CD2 3.66Å; V499-L587 HydrophobicContact CB-CG 4.48Å; V499-L587 HydrophobicContact CG1-CD2 3.43Å; V499-L587 VanDerWaalsContact CG1-CD2 3.43Å; V499-L587 HydrophobicContact CG1-CG 3.72Å; V499-L587 HydrophobicContact CG2-CD2 4.5Å; V500-L587 HydrophobicContact CG2-CD2 3.87Å; V583-L587 HydrophobicContact CG1-CD1 4.19Å; V583-L587 HydrophobicContact CG1-CG 4.35Å; V583-L587 WeakPolarHBondContact O-CG 3.49Å; V583-L587 PolarHBondContact O-N 3.08Å; L584-L587 HydrophobicContact CD2-CD1 4.44Å; L584-L587 PolarHBondContact O-N 3.45Å; L587-C590 PolarHBondContact O-N 3.11Å; L587-C591 PolarHBondContact O-N 3.42Å; L587-C591 PolarHBondContact O-SG 3.41Å; L587-I748 HydrophobicContact CB-CG2 3.98Å; L587-L791 HydrophobicContact CD1-CD1 4.06Å
588	K	88.3	Confident	80.5	Confident	3 Å²	3	41.9 Å²	41.9	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-43.8	172.7	-81.2	-165	168.6	-150.4	0	112.7	L584 M585 V586 C590 C591 N592 M644 S714 I748 I752	L584-K588 PolarHBondContact O-N 2.98Å; M585-K588 HydrophobicContact SD-CD 4.48Å; V586-K588 VanDerWaalsContact C-N 3.3Å; V586-K588 PolarHBondContact O-N 3.06Å; K588-C590 PolarHBondContact O-N 3.38Å; K588-C591 PolarHBondContact O-N 2.88Å; K588-N592 PolarHBondContact O-N 3.13Å; K588-M644 HydrophobicContact CB-CE 3.68Å; K588-M644 HydrophobicContact CD-CE 4.36Å; K588-S714 PolarHBondContact NZ-O 2.97Å; K588-I748 HydrophobicContact CG-CG2 4.38Å; K588-I752 HydrophobicContact CD-CD1 4.37Å; K588-I752 HydrophobicContact CG-CD1 4.4Å
589	R	87.9	Confident	81.1	Confident	68 Å²	68	41.7 Å²	41.7	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-60.2	-45.6	177.1	-73.1	175.7	-177.8	-164.2	-0.6	111.1	T577 M585 V586 C591 N592 H593 L596 V597 M644	T577-R589 PolarHBondContact O-NH1 3.32Å; T577-R589 VanDerWaalsContact O-NH1 3.09Å; M585-R589 WeakPolarHBondContact O-CG 3.44Å; M585-R589 PolarHBondContact O-N 3.02Å; M585-R589 VanDerWaalsContact O-N 3.08Å; V586-R589 WeakPolarHBondContact O-CB 3.47Å; V586-R589 PolarHBondContact O-N 2.87Å; R589-C591 PolarHBondContact O-N 3.03Å; R589-N592 PolarHBondContact O-N 3.3Å; R589-H593 CarbonylContact O-C 3.52Å; R589-H593 PolarHBondContact O-N 2.93Å; R589-L596 HydrophobicContact CB-CB 4.02Å; R589-L596 HydrophobicContact CB-CD1 4.31Å; R589-L596 HydrophobicContact CG-CB 4.27Å; R589-L596 HydrophobicContact CG-CD1 4.37Å; R589-V597 HydrophobicContact CB-CG2 4.25Å; R589-M644 HydrophobicContact CG-CE 4.02Å; R589-M644 HydrophobicContact CG-SD 3.88Å
590	C	87.1	Confident	81.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-42.5	177	-63.7	0	0	0	0	112.6	Q492 Y496 V586 L587 K588 N592	Q492-C590 PolarHBondContact NE2-O 2.83Å; Y496-C590 HydrophobicContact CD2-CB 4.37Å; V586-C590 PolarHBondContact O-N 3.31Å; V586-C590 PolarHBondContact O-SG 3.25Å; V586-C590 VanDerWaalsContact O-SG 3.35Å; L587-C590 PolarHBondContact O-N 3.11Å; K588-C590 PolarHBondContact O-N 3.38Å; C590-N592 VanDerWaalsContact C-N 3.33Å; C590-N592 PolarHBondContact O-N 3.3Å
591	C	87.3	Confident	81.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-35	178	-64.2	0	0	0	0	112.6	Q492 Y496 L587 K588 R589 K620	Q492-C591 PolarHBondContact NE2-O 3.25Å; Y496-C591 WeakPolarHBondContact CE2-SG 3.41Å; L587-C591 PolarHBondContact O-N 3.42Å; L587-C591 PolarHBondContact O-SG 3.41Å; K588-C591 PolarHBondContact O-N 2.88Å; R589-C591 PolarHBondContact O-N 3.03Å; C591-K620 WeakPolarHBondContact O-CE 3.46Å
592	N	89.5	Confident	81.6	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-72.5	-63.7	176.7	-77	-14.4	0	0	0	111.6	K588 R589 C590 L596 S618 K620 I647 F712 D713	K588-N592 PolarHBondContact O-N 3.13Å; R589-N592 PolarHBondContact O-N 3.3Å; C590-N592 VanDerWaalsContact C-N 3.33Å; C590-N592 PolarHBondContact O-N 3.3Å; N592-L596 HydrophobicContact CB-CD1 3.96Å; N592-S618 PolarHBondContact O-OG 3.18Å; N592-K620 PolarHBondContact OD1-NZ 2.87Å; N592-I647 HydrophobicContact CB-CD1 4.49Å; N592-F712 HydrophobicContact CB-CE1 3.97Å; N592-D713 PolarHBondContact ND2-OD2 2.83Å
593	H	89.3	Confident	80.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.			trans	-159.1	133.2	-179.2	-160	-83.9	0	0	0	112.3	R589 Y595 L596 L614 S617 S618 F621 I647 I650	R589-H593 CarbonylContact O-C 3.52Å; R589-H593 PolarHBondContact O-N 2.93Å; H593-Y595 AromaticContact CE1-CD1 3.63Å; H593-Y595 AromaticContact CE1-CD2 3.37Å; H593-Y595 WeakPolarHBondContact CE1-CD2 3.32Å; H593-Y595 AromaticContact CE1-CE2 3.88Å; H593-Y595 AromaticContact CE1-CG 3.22Å; H593-Y595 WeakPolarHBondContact ND1-CB 2.95Å; H593-Y595 AromaticContact ND1-CD1 3.94Å; H593-Y595 AromaticContact ND1-CD2 3.89Å; H593-Y595 AromaticContact ND1-CG 3.4Å; H593-Y595 PolarHBondContact ND1-N 2.86Å; H593-Y595 PolarHBondContact O-N 3.46Å; H593-L596 HydrophobicContact CB-CD1 4.37Å; H593-L596 HydrophobicContact CB-CG 4.24Å; H593-L596 WeakPolarHBondContact O-CB 3.48Å; H593-L596 PolarHBondContact O-N 2.85Å; H593-L596 VanDerWaalsContact O-N 3.13Å; H593-L614 VanDerWaalsContact CE1-CD1 3.49Å; H593-L614 WeakPolarHBondContact CE1-CD1 3.35Å; H593-L614 WeakPolarHBondContact NE2-CD1 3.26Å; H593-L614 PolarHBondContact NE2-O 2.6Å; H593-S617 PolarHBondContact CE1-OG 3.24Å; H593-S617 PolarHBondContact NE2-OG 3.43Å; H593-S617 VanDerWaalsContact NE2-OG 3.16Å; H593-S618 WeakPolarHBondContact CD2-CB 3.2Å; H593-F621 HydrophobicContact CB-CE2 4.46Å; H593-F621 AromaticContact CD2-CD2 3.5Å; H593-F621 AromaticContact CD2-CE2 3.46Å; H593-F621 VanDerWaalsContact CD2-CE2 3.46Å; H593-F621 WeakPolarHBondContact CD2-CE2 3.49Å; H593-I647 HydrophobicContact CB-CD1 3.7Å; H593-I650 HydrophobicContact CB-CD1 4.16Å
594	P	86.9	Confident	79.7	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.032	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-54.5	-36.7	174.5	-28.6	36.6	0	0	0	114.3	Q492 L495 L596 V597 E598 S617	Q492-P594 HydrophobicContact CG-CG 3.49Å; Q492-P594 VanDerWaalsContact CG-CG 3.49Å; L495-P594 HydrophobicContact CD1-CB 3.95Å; P594-L596 PolarHBondContact O-N 2.88Å; P594-V597 WeakPolarHBondContact O-CB 3.48Å; P594-V597 PolarHBondContact O-N 3Å; P594-E598 PolarHBondContact O-N 2.85Å; P594-E598 VanDerWaalsContact O-N 3.09Å; P594-S617 WeakPolarHBondContact CG-O 3.46Å
595	Y	85.8	Confident	78.6	Confident	12 Å²	12	33 Å²	33	5%	0.047	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-65.6	-9.8	-179.2	-57.7	-5.6	0	0	0	114.6	H593 V597 E598 Y599 P600 Q613 L614	H593-Y595 AromaticContact CE1-CD1 3.63Å; H593-Y595 AromaticContact CE1-CD2 3.37Å; H593-Y595 WeakPolarHBondContact CE1-CD2 3.32Å; H593-Y595 AromaticContact CE1-CE2 3.88Å; H593-Y595 AromaticContact CE1-CG 3.22Å; H593-Y595 WeakPolarHBondContact ND1-CB 2.95Å; H593-Y595 AromaticContact ND1-CD1 3.94Å; H593-Y595 AromaticContact ND1-CD2 3.89Å; H593-Y595 AromaticContact ND1-CG 3.4Å; H593-Y595 PolarHBondContact ND1-N 2.86Å; H593-Y595 PolarHBondContact O-N 3.46Å; Y595-V597 PolarHBondContact O-N 3.27Å; Y595-E598 WeakPolarHBondContact CA-O 3.35Å; Y595-Y599 HydrophobicContact CD2-CE1 4.29Å; Y595-P600 VanDerWaalsContact CD1-CD 3.43Å; Y595-P600 HydrophobicContact CD1-CG 3.89Å; Y595-P600 HydrophobicContact CE1-CG 3.47Å; Y595-P600 VanDerWaalsContact CE1-CG 3.47Å; Y595-P600 HydrophobicContact CE2-CG 4.31Å; Y595-P600 HydrophobicContact CG-CG 4.5Å; Y595-Q613 PolarHBondContact OH-O 2.97Å; Y595-L614 HydrophobicContact CD2-CD1 3.41Å; Y595-L614 VanDerWaalsContact CD2-CD1 3.41Å; Y595-L614 HydrophobicContact CE2-CB 3.97Å; Y595-L614 HydrophobicContact CE2-CD1 3.42Å; Y595-L614 VanDerWaalsContact CE2-CD1 3.42Å; Y595-L614 HydrophobicContact CE2-CG 4.31Å; Y595-L614 HydrophobicContact CG-CD1 4.49Å; Y595-L614 PolarHBondContact OH-N 3.36Å
596	L	82.4	Confident	77.4	Confident	15 Å²	15	36.3 Å²	36.3	8%	0.079	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-74.9	-14.9	169.2	-65.8	176.4	0	0	0	113.2	R589 N592 H593 P594 M644 S646 I647 I650	R589-L596 HydrophobicContact CB-CB 4.02Å; R589-L596 HydrophobicContact CB-CD1 4.31Å; R589-L596 HydrophobicContact CG-CB 4.27Å; R589-L596 HydrophobicContact CG-CD1 4.37Å; N592-L596 HydrophobicContact CB-CD1 3.96Å; H593-L596 HydrophobicContact CB-CD1 4.37Å; H593-L596 HydrophobicContact CB-CG 4.24Å; H593-L596 WeakPolarHBondContact O-CB 3.48Å; H593-L596 PolarHBondContact O-N 2.85Å; H593-L596 VanDerWaalsContact O-N 3.13Å; P594-L596 PolarHBondContact O-N 2.88Å; L596-M644 HydrophobicContact CD1-SD 4.22Å; L596-S646 WeakPolarHBondContact CD2-OG 3.44Å; L596-I647 HydrophobicContact CD1-CD1 4.33Å; L596-I650 HydrophobicContact CD2-CD1 3.61Å; L596-I650 HydrophobicContact CG-CD1 3.9Å
597	V	78.1	Confident	76.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-46.5	178.2	172.2	0	0	0	0	110.2	I504 L508 I576 T577 L578 R589 P594 Y595	I504-V597 HydrophobicContact CD1-CG1 4.46Å; L508-V597 HydrophobicContact CD1-CG1 4.34Å; L508-V597 HydrophobicContact CD2-CG1 4.11Å; I576-V597 WeakPolarHBondContact CA-O 3.45Å; T577-V597 PolarHBondContact N-O 3.21Å; L578-V597 HydrophobicContact CD1-CG1 4.05Å; L578-V597 HydrophobicContact CD2-CB 4.5Å; L578-V597 HydrophobicContact CD2-CG1 3.67Å; L578-V597 HydrophobicContact CD2-CG2 4.36Å; L578-V597 HydrophobicContact CG-CG1 3.97Å; R589-V597 HydrophobicContact CB-CG2 4.25Å; P594-V597 WeakPolarHBondContact O-CB 3.48Å; P594-V597 PolarHBondContact O-N 3Å; Y595-V597 PolarHBondContact O-N 3.27Å
598	E	74.9	Confident	75.4	Confident	85 Å²	85	48.1 Å²	48.1	40%	0.397	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	97.6	-176.8	-178.4	-175.1	178	0	0	108.6	L508 A574 P594 Y595 P600	L508-E598 HydrophobicContact CD2-CB 4.17Å; A574-E598 HydrophobicContact CB-CB 4.49Å; A574-E598 HydrophobicContact CB-CG 3.28Å; P594-E598 PolarHBondContact O-N 2.85Å; P594-E598 VanDerWaalsContact O-N 3.09Å; Y595-E598 WeakPolarHBondContact CA-O 3.35Å; E598-P600 WeakPolarHBondContact O-CD 3.32Å
599	Y	75.8	Confident	74.5	Confident	26 Å²	26	51.2 Å²	51.2	10%	0.102	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	113.4	-179.9	-155.5	-56.5	0	0	0	109.5	A574 D575 Y595 L601 F608 I650 D653	A574-Y599 CarbonylContact C-O 3.58Å; A574-Y599 WeakPolarHBondContact CA-O 3.5Å; A574-Y599 VanDerWaalsContact CB-O 3.28Å; A574-Y599 WeakPolarHBondContact CB-O 3.29Å; D575-Y599 PolarHBondContact N-O 3.24Å; D575-Y599 PolarHBondContact O-N 3.28Å; Y595-Y599 HydrophobicContact CD2-CE1 4.29Å; Y599-L601 PolarHBondContact O-N 3.37Å; Y599-F608 HydrophobicContact CD1-CB 4.25Å; Y599-F608 AromaticContact CD1-CD1 3.27Å; Y599-F608 HydrophobicContact CD1-CD1 3.27Å; Y599-F608 AromaticContact CD1-CE1 3.93Å; Y599-F608 HydrophobicContact CD1-CE1 3.93Å; Y599-F608 HydrophobicContact CD1-CG 4.09Å; Y599-F608 HydrophobicContact CD2-CD1 4.3Å; Y599-F608 HydrophobicContact CD2-CE1 4.39Å; Y599-F608 HydrophobicContact CE1-CB 3.49Å; Y599-F608 VanDerWaalsContact CE1-CB 3.49Å; Y599-F608 AromaticContact CE1-CD1 3.37Å; Y599-F608 HydrophobicContact CE1-CD1 3.37Å; Y599-F608 HydrophobicContact CE1-CE1 4.33Å; Y599-F608 AromaticContact CE1-CG 3.7Å; Y599-F608 HydrophobicContact CE1-CG 3.7Å; Y599-F608 HydrophobicContact CE2-CD1 4.33Å; Y599-F608 AromaticContact CG-CD1 3.79Å; Y599-F608 HydrophobicContact CG-CD1 3.79Å; Y599-F608 AromaticContact CG-CE1 3.98Å; Y599-F608 HydrophobicContact CG-CE1 3.98Å; Y599-F608 AromaticContact CZ-CD1 3.9Å; Y599-F608 AromaticContact CZ-CG 3.96Å; Y599-I650 HydrophobicContact CE2-CG1 4.18Å; Y599-D653 PolarHBondContact OH-OD2 2.83Å
600	P	71.9	Confident	73.7	Confident	27 Å²	27	50.7 Å²	50.7	18%	0.175	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	129.8	-178.5	-14.8	28.6	0	0	0	111.5	Y595 E598 K609	Y595-P600 VanDerWaalsContact CD1-CD 3.43Å; Y595-P600 HydrophobicContact CD1-CG 3.89Å; Y595-P600 HydrophobicContact CE1-CG 3.47Å; Y595-P600 VanDerWaalsContact CE1-CG 3.47Å; Y595-P600 HydrophobicContact CE2-CG 4.31Å; Y595-P600 HydrophobicContact CG-CG 4.5Å; E598-P600 WeakPolarHBondContact O-CD 3.32Å; P600-K609 PolarHBondContact O-N 3Å
601	L	71.3	Confident	73.2	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.209	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-100.6	142.1	173.2	-67.1	165.3	0	0	0	108.5	D573 D575 Y599 P603 F608	D573-L601 PolarHBondContact O-N 2.65Å; D575-L601 HydrophobicContact CB-CD1 4.36Å; Y599-L601 PolarHBondContact O-N 3.37Å; L601-P603 WeakPolarHBondContact O-CD 3.44Å; L601-F608 HydrophobicContact CD2-CD1 3.79Å; L601-F608 HydrophobicContact CD2-CE1 3.97Å
602	D	63	Low	73	Confident	46 Å²	46	58.6 Å²	58.6	25%	0.246	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-71.8	123.4	172.9	-177.8	34.1	0	0	0	109.6	V604 T605 Q606 Q607 K609	D602-V604 PolarHBondContact O-N 3.35Å; D602-T605 WeakPolarHBondContact CB-OG1 3.24Å; D602-T605 PolarHBondContact O-N 3.24Å; D602-T605 PolarHBondContact OD2-OG1 3.1Å; D602-Q606 WeakPolarHBondContact O-CA 3.39Å; D602-Q606 PolarHBondContact O-N 3.08Å; D602-Q607 PolarHBondContact N-O 3.03Å; D602-K609 HydrophobicContact CB-CB 4.43Å; D602-K609 HydrophobicContact CB-CG 4.42Å
603	P	59	Low	72.6	Confident	93 Å²	93	62.6 Å²	62.6	60%	0.604	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.9	-171.7	-27.4	34.8	0	0	0	115.1	L601	L601-P603 WeakPolarHBondContact O-CD 3.44Å
604	V	57.5	Low	72.4	Confident	130 Å²	130	62.7 Å²	62.7	79%	0.788	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-42.2	-176.8	-176.2	0	0	0	0	111.9	D602	D602-V604 PolarHBondContact O-N 3.35Å
605	T	60.8	Low	72.3	Confident	74 Å²	74	62.7 Å²	62.7	45%	0.454	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-14.3	-173.3	58.4	0	0	0	0	113.7	D602 Q607	D602-T605 WeakPolarHBondContact CB-OG1 3.24Å; D602-T605 PolarHBondContact O-N 3.24Å; D602-T605 PolarHBondContact OD2-OG1 3.1Å; T605-Q607 PolarHBondContact O-N 3.44Å
606	Q	58.5	Low	72.3	Confident	135 Å²	135	67.6 Å²	67.6	63%	0.631	34%	0.343	S	S	*	.			trans	51.7	20.1	-170	-62.5	-170.2	-26.7	0	0	113.6	D602	D602-Q606 WeakPolarHBondContact O-CA 3.39Å; D602-Q606 PolarHBondContact O-N 3.08Å
607	Q	63.5	Low	72.4	Confident	137 Å²	137	67.1 Å²	67.1	64%	0.64	34%	0.341	S	S	*	.	S	Bend	trans	-95.3	158.7	173.3	-67.7	-178.2	1.2	0	0	109.6	D602 T605 K609	D602-Q607 PolarHBondContact N-O 3.03Å; T605-Q607 PolarHBondContact O-N 3.44Å; Q607-K609 PolarHBondContact O-N 3.37Å
608	F	65.4	Low	72.9	Confident	114 Å²	114	67.1 Å²	67.1	50%	0.5	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-60.6	125.4	176.8	-66.8	-53.9	0	0	0	110.7	Y599 L601 I610	Y599-F608 HydrophobicContact CD1-CB 4.25Å; Y599-F608 AromaticContact CD1-CD1 3.27Å; Y599-F608 HydrophobicContact CD1-CD1 3.27Å; Y599-F608 AromaticContact CD1-CE1 3.93Å; Y599-F608 HydrophobicContact CD1-CE1 3.93Å; Y599-F608 HydrophobicContact CD1-CG 4.09Å; Y599-F608 HydrophobicContact CD2-CD1 4.3Å; Y599-F608 HydrophobicContact CD2-CE1 4.39Å; Y599-F608 HydrophobicContact CE1-CB 3.49Å; Y599-F608 VanDerWaalsContact CE1-CB 3.49Å; Y599-F608 AromaticContact CE1-CD1 3.37Å; Y599-F608 HydrophobicContact CE1-CD1 3.37Å; Y599-F608 HydrophobicContact CE1-CE1 4.33Å; Y599-F608 AromaticContact CE1-CG 3.7Å; Y599-F608 HydrophobicContact CE1-CG 3.7Å; Y599-F608 HydrophobicContact CE2-CD1 4.33Å; Y599-F608 AromaticContact CG-CD1 3.79Å; Y599-F608 HydrophobicContact CG-CD1 3.79Å; Y599-F608 AromaticContact CG-CE1 3.98Å; Y599-F608 HydrophobicContact CG-CE1 3.98Å; Y599-F608 AromaticContact CZ-CD1 3.9Å; Y599-F608 AromaticContact CZ-CG 3.96Å; L601-F608 HydrophobicContact CD2-CD1 3.79Å; L601-F608 HydrophobicContact CD2-CE1 3.97Å; F608-I610 PolarHBondContact O-N 3.44Å
609	K	68.1	Low	73.4	Confident	68 Å²	68	63.1 Å²	63.1	30%	0.296	32%	0.322	S	S	.	.			trans	-79.9	105.1	-175.8	-160.2	-176	-160.2	-142.7	0	111.1	P600 D602 Q607 D611	P600-K609 PolarHBondContact O-N 3Å; D602-K609 HydrophobicContact CB-CB 4.43Å; D602-K609 HydrophobicContact CB-CG 4.42Å; Q607-K609 PolarHBondContact O-N 3.37Å; K609-D611 VanDerWaalsContact CD-OD2 3.28Å; K609-D611 WeakPolarHBondContact CD-OD2 2.91Å; K609-D611 WeakPolarHBondContact CE-OD2 3.39Å; K609-D611 IonicContact NZ-OD2 3Å; K609-D611 PolarHBondContact NZ-OD2 2.85Å; K609-D611 PolarHBondContact O-N 2.88Å
610	I	71.4	Confident	74	Confident	56 Å²	56	61.9 Å²	61.9	29%	0.287	32%	0.317	S	S	.	.			trans	-94.2	80	178.5	-49.9	175.7	0	0	0	109.6	F608 D653 L657	F608-I610 PolarHBondContact O-N 3.44Å; I610-D653 HydrophobicContact CD1-CB 4.09Å; I610-D653 HydrophobicContact CG1-CB 4.27Å; I610-D653 HydrophobicContact CG2-CB 4.32Å; I610-L657 HydrophobicContact CG2-CB 4.18Å; I610-L657 HydrophobicContact CG2-CD1 4.39Å
611	D	76.8	Confident	74.9	Confident	57 Å²	57	60.6 Å²	60.6	31%	0.305	31%	0.309	S	S	.	.	S	Bend	trans	-111.1	169.7	177.8	-72.6	-9.9	0	0	0	111.9	K609 Q613 L614	K609-D611 VanDerWaalsContact CD-OD2 3.28Å; K609-D611 WeakPolarHBondContact CD-OD2 2.91Å; K609-D611 WeakPolarHBondContact CE-OD2 3.39Å; K609-D611 IonicContact NZ-OD2 3Å; K609-D611 PolarHBondContact NZ-OD2 2.85Å; K609-D611 PolarHBondContact O-N 2.88Å; D611-Q613 HydrophobicContact CB-CB 4.3Å; D611-Q613 HydrophobicContact CB-CG 4.41Å; D611-Q613 PolarHBondContact O-N 2.83Å; D611-L614 VanDerWaalsContact O-CB 3.22Å; D611-L614 WeakPolarHBondContact O-CB 3.48Å; D611-L614 PolarHBondContact O-N 3.39Å
612	E	82.2	Confident	75.7	Confident	109 Å²	109	61 Å²	61	51%	0.509	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-20.4	168.6	-68.2	-158	149	0	0	113.6	L614 V615 Q616 R658	E612-L614 PolarHBondContact O-N 3.22Å; E612-V615 PolarHBondContact O-N 2.81Å; E612-V615 VanDerWaalsContact O-N 3.12Å; E612-Q616 WeakPolarHBondContact O-CG 3.43Å; E612-Q616 PolarHBondContact O-N 3.27Å; E612-Q616 VanDerWaalsContact O-N 3.09Å; E612-R658 IonicContact OE1-NH1 3.96Å
613	Q	81.8	Confident	76.8	Confident	86 Å²	86	58.9 Å²	58.9	40%	0.402	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-28.6	172.6	-65.6	-162.6	-4.1	0	0	112.9	Y595 D611 V615 Q616 S617	Y595-Q613 PolarHBondContact OH-O 2.97Å; D611-Q613 HydrophobicContact CB-CB 4.3Å; D611-Q613 HydrophobicContact CB-CG 4.41Å; D611-Q613 PolarHBondContact O-N 2.83Å; Q613-V615 VanDerWaalsContact C-N 3.32Å; Q613-V615 PolarHBondContact O-N 2.83Å; Q613-Q616 PolarHBondContact O-N 2.95Å; Q613-S617 WeakPolarHBondContact O-CB 3.33Å; Q613-S617 PolarHBondContact O-N 3Å; Q613-S617 PolarHBondContact O-OG 3.26Å
614	L	84.7	Confident	78.3	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-55.3	-51.8	174.2	176.2	64.1	0	0	0	110	H593 Y595 D611 E612 S617 I650 D653	H593-L614 VanDerWaalsContact CE1-CD1 3.49Å; H593-L614 WeakPolarHBondContact CE1-CD1 3.35Å; H593-L614 WeakPolarHBondContact NE2-CD1 3.26Å; H593-L614 PolarHBondContact NE2-O 2.6Å; Y595-L614 HydrophobicContact CD2-CD1 3.41Å; Y595-L614 VanDerWaalsContact CD2-CD1 3.41Å; Y595-L614 HydrophobicContact CE2-CB 3.97Å; Y595-L614 HydrophobicContact CE2-CD1 3.42Å; Y595-L614 VanDerWaalsContact CE2-CD1 3.42Å; Y595-L614 HydrophobicContact CE2-CG 4.31Å; Y595-L614 HydrophobicContact CG-CD1 4.49Å; Y595-L614 PolarHBondContact OH-N 3.36Å; D611-L614 VanDerWaalsContact O-CB 3.22Å; D611-L614 WeakPolarHBondContact O-CB 3.48Å; D611-L614 PolarHBondContact O-N 3.39Å; E612-L614 PolarHBondContact O-N 3.22Å; L614-S617 PolarHBondContact O-OG 3.43Å; L614-I650 HydrophobicContact CD1-CG2 3.49Å; L614-I650 VanDerWaalsContact CD1-CG2 3.49Å; L614-I650 HydrophobicContact CD2-CG2 4.37Å; L614-I650 HydrophobicContact CG-CG2 4.39Å; L614-D653 HydrophobicContact CD2-CB 4.21Å
615	V	84.8	Confident	79.8	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-44.5	-179.4	-174.9	0	0	0	0	111.4	E612 Q613 S617 S618 F621 L622 D625 Y654 L657	E612-V615 PolarHBondContact O-N 2.81Å; E612-V615 VanDerWaalsContact O-N 3.12Å; Q613-V615 VanDerWaalsContact C-N 3.32Å; Q613-V615 PolarHBondContact O-N 2.83Å; V615-S617 VanDerWaalsContact C-N 3.25Å; V615-S617 PolarHBondContact O-N 3.2Å; V615-S618 PolarHBondContact O-N 3.03Å; V615-F621 HydrophobicContact CG1-CB 4.41Å; V615-L622 HydrophobicContact CG1-CD2 4.25Å; V615-D625 HydrophobicContact CG1-CB 3.79Å; V615-Y654 HydrophobicContact CG2-CD2 3.65Å; V615-Y654 HydrophobicContact CG2-CE2 3.63Å; V615-L657 HydrophobicContact CG2-CD2 4.28Å
616	Q	86	Confident	81	Confident	116 Å²	116	50.9 Å²	50.9	54%	0.542	24%	0.237	S	C	.	.	H	α-helix	trans	-68.6	-23.9	-176.4	-65.3	177.9	11.9	0	0	113.4	T489 E612 Q613	T489-Q616 WeakPolarHBondContact CG2-O 3.27Å; E612-Q616 WeakPolarHBondContact O-CG 3.43Å; E612-Q616 PolarHBondContact O-N 3.27Å; E612-Q616 VanDerWaalsContact O-N 3.09Å; Q613-Q616 PolarHBondContact O-N 2.95Å
617	S	85.5	Confident	82.4	Confident	5 Å²	5	44.7 Å²	44.7	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-77.1	-19.3	-177.2	75.3	0	0	0	0	114.1	T489 H593 P594 Q613 L614 V615	T489-S617 WeakPolarHBondContact CB-O 3.29Å; T489-S617 WeakPolarHBondContact CG2-O 3.36Å; T489-S617 PolarHBondContact OG1-O 3.41Å; H593-S617 PolarHBondContact CE1-OG 3.24Å; H593-S617 PolarHBondContact NE2-OG 3.43Å; H593-S617 VanDerWaalsContact NE2-OG 3.16Å; P594-S617 WeakPolarHBondContact CG-O 3.46Å; Q613-S617 WeakPolarHBondContact O-CB 3.33Å; Q613-S617 PolarHBondContact O-N 3Å; Q613-S617 PolarHBondContact O-OG 3.26Å; L614-S617 PolarHBondContact O-OG 3.43Å; V615-S617 VanDerWaalsContact C-N 3.25Å; V615-S617 PolarHBondContact O-N 3.2Å
618	S	88.1	Confident	83.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.			trans	-126.2	129.4	-179.5	176	0	0	0	0	113	N592 H593 V615 K620 F621 L622	N592-S618 PolarHBondContact O-OG 3.18Å; H593-S618 WeakPolarHBondContact CD2-CB 3.2Å; V615-S618 PolarHBondContact O-N 3.03Å; S618-K620 VanDerWaalsContact C-N 3.28Å; S618-K620 PolarHBondContact O-N 3.38Å; S618-K620 PolarHBondContact OG-N 3.12Å; S618-F621 PolarHBondContact O-N 3.32Å; S618-L622 PolarHBondContact O-N 2.64Å
619	G	85.5	Confident	84.8	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-32.6	178.4	0	0	0	0	0	113.8	P487 L622 I623	P487-G619 VanDerWaalsContact O-CA 3.32Å; P487-G619 WeakPolarHBondContact O-CA 3.43Å; G619-L622 PolarHBondContact O-N 3.08Å; G619-I623 PolarHBondContact O-N 2.95Å
620	K	88.8	Confident	85.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.8	-39.6	175.9	-64.6	-173.4	-175.8	-174.4	0	111.2	A486 C591 N592 S618 I623 L624 F712 L742 T744 D749	A486-K620 HydrophobicContact CB-CG 4Å; C591-K620 WeakPolarHBondContact O-CE 3.46Å; N592-K620 PolarHBondContact OD1-NZ 2.87Å; S618-K620 VanDerWaalsContact C-N 3.28Å; S618-K620 PolarHBondContact O-N 3.38Å; S618-K620 PolarHBondContact OG-N 3.12Å; K620-I623 PolarHBondContact O-N 2.94Å; K620-L624 VanDerWaalsContact O-CB 3.32Å; K620-L624 WeakPolarHBondContact O-CB 3.13Å; K620-L624 PolarHBondContact O-N 2.87Å; K620-F712 HydrophobicContact CB-CE2 3.85Å; K620-F712 HydrophobicContact CB-CZ 3.73Å; K620-F712 HydrophobicContact CD-CD1 4.37Å; K620-F712 HydrophobicContact CD-CE1 3.84Å; K620-F712 HydrophobicContact CD-CE2 4.36Å; K620-F712 HydrophobicContact CD-CZ 3.84Å; K620-F712 HydrophobicContact CG-CZ 4.44Å; K620-F712 PolarHBondContact NZ-O 3.2Å; K620-F712 VanDerWaalsContact NZ-O 3.09Å; K620-L742 HydrophobicContact CB-CD1 4.4Å; K620-L742 HydrophobicContact CD-CB 4.48Å; K620-T744 HydrophobicContact CG-CG2 4.19Å; K620-D749 WeakPolarHBondContact CE-OD2 3.44Å; K620-D749 IonicContact NZ-OD2 3.15Å; K620-D749 PolarHBondContact NZ-OD2 3.23Å
621	F	90.3	Very high	86.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-69	-36.3	176.1	-83.6	-98.8	0	0	0	112.1	H593 V615 S618 I623 L624 D625 I647 I650 L651 Y654 F712	H593-F621 HydrophobicContact CB-CE2 4.46Å; H593-F621 AromaticContact CD2-CD2 3.5Å; H593-F621 AromaticContact CD2-CE2 3.46Å; H593-F621 VanDerWaalsContact CD2-CE2 3.46Å; H593-F621 WeakPolarHBondContact CD2-CE2 3.49Å; V615-F621 HydrophobicContact CG1-CB 4.41Å; S618-F621 PolarHBondContact O-N 3.32Å; F621-I623 VanDerWaalsContact C-N 3.29Å; F621-I623 PolarHBondContact O-N 3.26Å; F621-L624 PolarHBondContact O-N 3.07Å; F621-D625 VanDerWaalsContact O-CB 3.3Å; F621-D625 WeakPolarHBondContact O-CB 3.38Å; F621-D625 PolarHBondContact O-N 3.42Å; F621-I647 HydrophobicContact CE2-CD1 3.83Å; F621-I647 HydrophobicContact CZ-CD1 4.11Å; F621-I650 HydrophobicContact CE1-CG2 4.21Å; F621-I650 HydrophobicContact CE2-CG2 4.35Å; F621-I650 HydrophobicContact CZ-CB 4.48Å; F621-I650 HydrophobicContact CZ-CG2 3.67Å; F621-L651 HydrophobicContact CE1-CD2 3.66Å; F621-L651 HydrophobicContact CE1-CG 4.31Å; F621-L651 HydrophobicContact CZ-CD2 3.75Å; F621-L651 HydrophobicContact CZ-CG 4.01Å; F621-Y654 HydrophobicContact CD1-CD2 4.04Å; F621-Y654 HydrophobicContact CD1-CG 4.09Å; F621-Y654 HydrophobicContact CE1-CD2 4.42Å; F621-Y654 HydrophobicContact CE1-CG 4.04Å; F621-F712 HydrophobicContact CD2-CE2 4.2Å; F621-F712 AromaticContact CD2-CZ 3.94Å; F621-F712 HydrophobicContact CD2-CZ 3.94Å; F621-F712 AromaticContact CE2-CE2 3.96Å; F621-F712 HydrophobicContact CE2-CE2 3.96Å; F621-F712 AromaticContact CE2-CZ 3.56Å; F621-F712 HydrophobicContact CE2-CZ 3.56Å; F621-F712 HydrophobicContact CZ-CZ 4.41Å
622	L	87.4	Confident	87.1	Confident	49 Å²	49	32.3 Å²	32.3	26%	0.257	16%	0.156	S	C	.	.	H	α-helix	trans	-58.2	-40.5	172.7	-73.1	170.3	0	0	0	112.6	T489 V615 S618 G619 R626 V811	T489-L622 HydrophobicContact CG2-CD1 4.26Å; V615-L622 HydrophobicContact CG1-CD2 4.25Å; S618-L622 PolarHBondContact O-N 2.64Å; G619-L622 PolarHBondContact O-N 3.08Å; L622-R626 WeakPolarHBondContact O-CG 3.12Å; L622-R626 PolarHBondContact O-N 3.21Å; L622-V811 HydrophobicContact CB-CG2 4.11Å; L622-V811 HydrophobicContact CD1-CG2 4.04Å
623	I	87.3	Confident	87.4	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-70.6	-44.2	175.8	-70	-178.9	0	0	0	111	V484 A486 G619 K620 F621 D625 R626 L627 L742 V811 I812	V484-I623 HydrophobicContact CG1-CD1 4.01Å; V484-I623 HydrophobicContact CG1-CG2 3.94Å; A486-I623 HydrophobicContact CB-CD1 3.69Å; G619-I623 PolarHBondContact O-N 2.95Å; K620-I623 PolarHBondContact O-N 2.94Å; F621-I623 VanDerWaalsContact C-N 3.29Å; F621-I623 PolarHBondContact O-N 3.26Å; I623-D625 VanDerWaalsContact C-N 3.29Å; I623-D625 PolarHBondContact O-N 3.01Å; I623-R626 PolarHBondContact O-N 2.99Å; I623-R626 VanDerWaalsContact O-N 3.14Å; I623-L627 WeakPolarHBondContact O-CB 3.46Å; I623-L627 PolarHBondContact O-N 2.78Å; I623-L742 HydrophobicContact CG2-CD2 4.04Å; I623-V811 HydrophobicContact CD1-CG1 4.1Å; I623-V811 HydrophobicContact CG1-CG1 3.75Å; I623-I812 HydrophobicContact CB-CD1 4.45Å; I623-I812 HydrophobicContact CD1-CD1 4.22Å; I623-I812 HydrophobicContact CG1-CD1 3.98Å; I623-I812 HydrophobicContact CG1-CG1 4.44Å; I623-I812 HydrophobicContact CG2-CD1 3.93Å
624	L	89.4	Confident	87.5	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-37.7	179.5	-175.5	142.6	0	0	0	111.7	K620 F621 R626 L627 L628 I640 L651 Y654 F712	K620-L624 VanDerWaalsContact O-CB 3.32Å; K620-L624 WeakPolarHBondContact O-CB 3.13Å; K620-L624 PolarHBondContact O-N 2.87Å; F621-L624 PolarHBondContact O-N 3.07Å; L624-R626 VanDerWaalsContact C-N 3.25Å; L624-R626 PolarHBondContact O-N 2.79Å; L624-L627 PolarHBondContact O-N 3.04Å; L624-L628 HydrophobicContact CD1-CD1 4.45Å; L624-L628 HydrophobicContact CD2-CD1 3.3Å; L624-L628 HydrophobicContact CD2-CG 4.1Å; L624-L628 HydrophobicContact CG-CD1 3.69Å; L624-L628 HydrophobicContact CG-CG 4.01Å; L624-L628 WeakPolarHBondContact O-CB 3.32Å; L624-L628 WeakPolarHBondContact O-CG 3.45Å; L624-L628 PolarHBondContact O-N 2.88Å; L624-I640 HydrophobicContact CD1-CD1 4.34Å; L624-L651 HydrophobicContact CD1-CD2 4.01Å; L624-L651 HydrophobicContact CD2-CD2 4.44Å; L624-Y654 HydrophobicContact CD2-CD1 3.78Å; L624-Y654 HydrophobicContact CD2-CE1 3.3Å; L624-Y654 HydrophobicContact CD2-CE2 4.49Å; L624-F712 HydrophobicContact CD1-CD2 4.27Å; L624-F712 HydrophobicContact CD1-CE2 4.35Å
625	D	89.3	Confident	87.6	Confident	29 Å²	29	37.9 Å²	37.9	16%	0.155	20%	0.195	C	C	.	.	H	α-helix	trans	-67.2	-23.8	176.5	-163.7	57.6	0	0	0	113.6	V615 F621 I623 P629 Y654 R658	V615-D625 HydrophobicContact CG1-CB 3.79Å; F621-D625 VanDerWaalsContact O-CB 3.3Å; F621-D625 WeakPolarHBondContact O-CB 3.38Å; F621-D625 PolarHBondContact O-N 3.42Å; I623-D625 VanDerWaalsContact C-N 3.29Å; I623-D625 PolarHBondContact O-N 3.01Å; D625-P629 WeakPolarHBondContact O-CD 3.45Å; D625-P629 WeakPolarHBondContact O-CG 3.18Å; D625-Y654 VanDerWaalsContact CA-OH 3.26Å; D625-Y654 WeakPolarHBondContact CA-OH 3.33Å; D625-Y654 HydrophobicContact CB-CE2 4.32Å; D625-Y654 WeakPolarHBondContact OD1-CE2 3.12Å; D625-Y654 PolarHBondContact OD1-OH 2.8Å; D625-R658 IonicContact OD1-CZ 3.46Å; D625-R658 IonicContact OD1-NE 2.82Å; D625-R658 PolarHBondContact OD1-NE 3.05Å; D625-R658 IonicContact OD1-NH2 3.26Å; D625-R658 PolarHBondContact OD1-NH2 3.23Å; D625-R658 IonicContact OD2-CZ 3.73Å; D625-R658 IonicContact OD2-NE 3.87Å; D625-R658 IonicContact OD2-NH2 2.81Å; D625-R658 PolarHBondContact OD2-NH2 2.88Å
626	R	85.9	Confident	87.8	Confident	96 Å²	96	39 Å²	39	36%	0.362	20%	0.2	S	C	.	.	H	α-helix	trans	-84.8	-37.3	171.5	-66.9	-67.6	-175.9	151.3	-7.7	112.4	L622 I623 L624 D814	L622-R626 WeakPolarHBondContact O-CG 3.12Å; L622-R626 PolarHBondContact O-N 3.21Å; I623-R626 PolarHBondContact O-N 2.99Å; I623-R626 VanDerWaalsContact O-N 3.14Å; L624-R626 VanDerWaalsContact C-N 3.25Å; L624-R626 PolarHBondContact O-N 2.79Å; R626-D814 IonicContact NH1-OD1 3.98Å
627	L	87.6	Confident	88.1	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-80.2	-41.5	-171.2	-170.7	143.7	0	0	0	112.3	I623 L624 L631 I710 Y740	I623-L627 WeakPolarHBondContact O-CB 3.46Å; I623-L627 PolarHBondContact O-N 2.78Å; L624-L627 PolarHBondContact O-N 3.04Å; L627-L631 HydrophobicContact CD2-CD1 3.38Å; L627-L631 HydrophobicContact CD2-CG 4.21Å; L627-L631 HydrophobicContact CG-CD1 4.29Å; L627-L631 WeakPolarHBondContact O-CG 3.14Å; L627-L631 PolarHBondContact O-N 3.28Å; L627-L631 VanDerWaalsContact O-N 3.07Å; L627-I710 HydrophobicContact CD2-CD1 3.59Å; L627-I710 HydrophobicContact CD2-CG1 4.45Å; L627-Y740 HydrophobicContact CD1-CD1 4.16Å; L627-Y740 HydrophobicContact CD1-CD2 4.38Å; L627-Y740 HydrophobicContact CD1-CE1 4.29Å; L627-Y740 HydrophobicContact CD1-CE2 4.48Å; L627-Y740 HydrophobicContact CD1-CG 4.21Å; L627-Y740 HydrophobicContact CD2-CD2 4.42Å
628	L	90.5	Very high	88.4	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-46.2	-176.6	-71	-179.8	0	0	0	114.5	L624 A630 L631 K632 V638 I640 Y654 F660 F688 I689 I710	L624-L628 HydrophobicContact CD1-CD1 4.45Å; L624-L628 HydrophobicContact CD2-CD1 3.3Å; L624-L628 HydrophobicContact CD2-CG 4.1Å; L624-L628 HydrophobicContact CG-CD1 3.69Å; L624-L628 HydrophobicContact CG-CG 4.01Å; L624-L628 WeakPolarHBondContact O-CB 3.32Å; L624-L628 WeakPolarHBondContact O-CG 3.45Å; L624-L628 PolarHBondContact O-N 2.88Å; L628-A630 VanDerWaalsContact C-N 3.3Å; L628-A630 PolarHBondContact O-N 3.27Å; L628-L631 PolarHBondContact O-N 3.25Å; L628-K632 PolarHBondContact O-N 2.8Å; L628-V638 HydrophobicContact CD2-CB 4.49Å; L628-V638 HydrophobicContact CD2-CG1 4.16Å; L628-V638 HydrophobicContact CD2-CG2 4.34Å; L628-I640 HydrophobicContact CD1-CD1 4.49Å; L628-Y654 HydrophobicContact CD1-CE1 3.86Å; L628-F660 HydrophobicContact CB-CE2 4.26Å; L628-F660 HydrophobicContact CB-CZ 4.45Å; L628-F660 HydrophobicContact CD1-CE2 4.44Å; L628-F688 HydrophobicContact CB-CE1 4.2Å; L628-F688 HydrophobicContact CD2-CE1 4.03Å; L628-F688 HydrophobicContact CD2-CZ 4.18Å; L628-F688 WeakPolarHBondContact O-CZ 3.24Å; L628-I689 HydrophobicContact CD1-CD1 3.88Å; L628-I689 HydrophobicContact CD2-CD1 4.45Å; L628-I710 HydrophobicContact CD2-CD1 4.03Å
629	P	89.6	Confident	88.6	Confident	47 Å²	47	35 Å²	35	31%	0.305	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-41.1	177.1	-23.4	34.1	0	0	0	112.2	D625 L631 K632 I633 F660	D625-P629 WeakPolarHBondContact O-CD 3.45Å; D625-P629 WeakPolarHBondContact O-CG 3.18Å; P629-L631 VanDerWaalsContact C-N 3.34Å; P629-L631 PolarHBondContact O-N 3.29Å; P629-K632 PolarHBondContact O-N 2.84Å; P629-I633 WeakPolarHBondContact O-CG1 3.32Å; P629-I633 PolarHBondContact O-N 3.48Å; P629-F660 HydrophobicContact CG-CZ 4.25Å
630	A	87.4	Confident	89	Confident	21 Å²	21	35 Å²	35	17%	0.174	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-37.3	178.7	0	0	0	0	0	112.2	L628 R634 L817 L821	L628-A630 VanDerWaalsContact C-N 3.3Å; L628-A630 PolarHBondContact O-N 3.27Å; A630-R634 WeakPolarHBondContact O-CG 3.5Å; A630-R634 PolarHBondContact O-N 2.8Å; A630-L817 HydrophobicContact CB-CD2 4.43Å; A630-L821 HydrophobicContact CB-CD1 3.44Å; A630-L821 VanDerWaalsContact CB-CD1 3.44Å
631	L	88.6	Confident	89.2	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-69.1	-36.5	173.1	-74.1	177	0	0	0	113	L627 L628 P629 R634 G635 H636 V638 F688 T708 L821	L627-L631 HydrophobicContact CD2-CD1 3.38Å; L627-L631 HydrophobicContact CD2-CG 4.21Å; L627-L631 HydrophobicContact CG-CD1 4.29Å; L627-L631 WeakPolarHBondContact O-CG 3.14Å; L627-L631 PolarHBondContact O-N 3.28Å; L627-L631 VanDerWaalsContact O-N 3.07Å; L628-L631 PolarHBondContact O-N 3.25Å; P629-L631 VanDerWaalsContact C-N 3.34Å; P629-L631 PolarHBondContact O-N 3.29Å; L631-R634 PolarHBondContact O-N 2.92Å; L631-G635 PolarHBondContact O-N 3.43Å; L631-H636 HydrophobicContact CB-CB 4.45Å; L631-H636 HydrophobicContact CD2-CB 4.23Å; L631-H636 PolarHBondContact O-N 3.31Å; L631-H636 VanDerWaalsContact O-N 3.13Å; L631-V638 HydrophobicContact CB-CG2 4.34Å; L631-V638 HydrophobicContact CD1-CG2 3.71Å; L631-F688 HydrophobicContact CB-CE2 4.26Å; L631-F688 HydrophobicContact CB-CZ 3.97Å; L631-T708 HydrophobicContact CD1-CG2 3.84Å; L631-L821 HydrophobicContact CD2-CD2 3.6Å; L631-L821 HydrophobicContact CG-CD2 3.91Å
632	K	88.5	Confident	89.3	Confident	101 Å²	101	35 Å²	35	44%	0.439	18%	0.18	S	C	.	.	H	α-helix	trans	-65.7	-42.8	177.2	-168.8	179.2	179.8	-173.7	0	111.3	L628 P629 R634 G635 F660 F688	L628-K632 PolarHBondContact O-N 2.8Å; P629-K632 PolarHBondContact O-N 2.84Å; K632-R634 PolarHBondContact O-N 3.31Å; K632-G635 PolarHBondContact O-N 2.94Å; K632-F660 HydrophobicContact CD-CD1 3.82Å; K632-F660 HydrophobicContact CD-CE1 3.58Å; K632-F688 HydrophobicContact CB-CD1 4.41Å; K632-F688 HydrophobicContact CB-CD2 4.36Å; K632-F688 HydrophobicContact CB-CE1 4.1Å; K632-F688 HydrophobicContact CB-CE2 3.99Å; K632-F688 HydrophobicContact CB-CZ 3.89Å; K632-F688 HydrophobicContact CD-CD1 4.42Å; K632-F688 HydrophobicContact CG-CD1 4.44Å; K632-F688 HydrophobicContact CG-CD2 4.38Å; K632-F688 HydrophobicContact CG-CG 4.37Å
633	I	88.4	Confident	89.4	Confident	149 Å²	149	34.3 Å²	34.3	76%	0.764	18%	0.175	S	C	*	.	H	α-helix	trans	-59.1	-36.8	175.8	-68.3	165.2	0	0	0	111.1	P629 G635	P629-I633 WeakPolarHBondContact O-CG1 3.32Å; P629-I633 PolarHBondContact O-N 3.48Å; I633-G635 VanDerWaalsContact C-N 3.29Å; I633-G635 PolarHBondContact O-N 2.9Å
634	R	85	Confident	89.5	Confident	112 Å²	112	35 Å²	35	42%	0.423	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.8	177.7	-65	-179.3	-175.7	-157.8	2	114.1	A630 L631 K632 H636 L821	A630-R634 WeakPolarHBondContact O-CG 3.5Å; A630-R634 PolarHBondContact O-N 2.8Å; L631-R634 PolarHBondContact O-N 2.92Å; K632-R634 PolarHBondContact O-N 3.31Å; R634-H636 VanDerWaalsContact CB-CD2 3.43Å; R634-H636 WeakPolarHBondContact CB-CD2 3.36Å; R634-L821 VanDerWaalsContact NH1-C 3.31Å; R634-L821 VanDerWaalsContact NH1-CB 3.26Å; R634-L821 PolarHBondContact NH1-O 2.81Å
635	G	86.1	Confident	89.4	Confident	52 Å²	52	38.2 Å²	38.2	54%	0.536	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	28.6	176.8	0	0	0	0	0	114.7	L631 K632 I633	L631-G635 PolarHBondContact O-N 3.43Å; K632-G635 PolarHBondContact O-N 2.94Å; I633-G635 VanDerWaalsContact C-N 3.29Å; I633-G635 PolarHBondContact O-N 2.9Å
636	H	88.8	Confident	89.4	Confident	30 Å²	30	38.9 Å²	38.9	14%	0.139	21%	0.206	C	C	.	.			trans	-84.4	155.4	176.1	-64.1	-49.6	0	0	0	111.4	L631 R634 F688 D707 R823	L631-H636 HydrophobicContact CB-CB 4.45Å; L631-H636 HydrophobicContact CD2-CB 4.23Å; L631-H636 PolarHBondContact O-N 3.31Å; L631-H636 VanDerWaalsContact O-N 3.13Å; R634-H636 VanDerWaalsContact CB-CD2 3.43Å; R634-H636 WeakPolarHBondContact CB-CD2 3.36Å; H636-F688 WeakPolarHBondContact O-CD2 3.45Å; H636-F688 WeakPolarHBondContact O-CE2 3.39Å; H636-D707 WeakPolarHBondContact CB-OD1 3.26Å; H636-D707 IonicContact CE1-OD2 3.63Å; H636-D707 IonicContact CG-OD1 3.67Å; H636-D707 IonicContact CG-OD2 3.02Å; H636-D707 IonicContact ND1-OD1 3.89Å; H636-D707 IonicContact ND1-OD2 3.71Å; H636-D707 PolarHBondContact ND1-OD2 2.82Å; H636-R823 PolarHBondContact CD2-NH2 2.85Å; H636-R823 PolarHBondContact CE1-NH1 2.86Å; H636-R823 PolarHBondContact CE1-NH2 2.87Å; H636-R823 PolarHBondContact ND1-NH1 3.28Å; H636-R823 PolarHBondContact ND1-NH2 3.43Å
637	K	91.2	Very high	89.6	Confident	35 Å²	35	34.3 Å²	34.3	15%	0.152	19%	0.188	C	C	.	.			trans	-112.4	131.5	174.8	-83.8	-170.9	170.4	-169.9	0	108.8	F681 D684 V687 A706 D707 T708	K637-F681 HydrophobicContact CB-CZ 4.14Å; K637-F681 HydrophobicContact CD-CE2 4.24Å; K637-F681 HydrophobicContact CD-CZ 4.08Å; K637-F681 PolarHBondContact NZ-O 2.92Å; K637-D684 PolarHBondContact NZ-O 3.04Å; K637-V687 WeakPolarHBondContact CE-O 3.13Å; K637-A706 HydrophobicContact CB-CB 4.46Å; K637-D707 PolarHBondContact N-OD1 3.43Å; K637-D707 PolarHBondContact O-N 2.86Å; K637-T708 PolarHBondContact O-N 3.29Å; K637-T708 VanDerWaalsContact O-N 3.15Å
638	V	92.6	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.8	-166.2	-173.3	0	0	0	0	111.7	L628 L631 I640 F688 I689 F690 T708 I710	L628-V638 HydrophobicContact CD2-CB 4.49Å; L628-V638 HydrophobicContact CD2-CG1 4.16Å; L628-V638 HydrophobicContact CD2-CG2 4.34Å; L631-V638 HydrophobicContact CB-CG2 4.34Å; L631-V638 HydrophobicContact CD1-CG2 3.71Å; V638-I640 HydrophobicContact CG1-CG1 4.06Å; V638-F688 HydrophobicContact CB-CZ 4.5Å; V638-F688 HydrophobicContact CG2-CD2 4.48Å; V638-F688 HydrophobicContact CG2-CE1 4.48Å; V638-F688 HydrophobicContact CG2-CE2 3.62Å; V638-F688 HydrophobicContact CG2-CZ 3.6Å; V638-F688 PolarHBondContact N-O 3.22Å; V638-I689 WeakPolarHBondContact O-CA 3.43Å; V638-F690 PolarHBondContact O-N 3.03Å; V638-T708 WeakPolarHBondContact CA-O 3.49Å; V638-T708 HydrophobicContact CG1-CG2 4.46Å; V638-T708 HydrophobicContact CG2-CG2 4.48Å; V638-I710 HydrophobicContact CG1-CD1 3.59Å; V638-I710 HydrophobicContact CG1-CG1 3.83Å
639	L	93.3	Very high	89.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.6	167.5	-54.7	-177.5	0	0	0	109.2	F641 F681 F690 L692 L703 A706 T708 V709 I710 C728	L639-F641 HydrophobicContact CB-CE2 3.91Å; L639-F641 HydrophobicContact CB-CZ 4.42Å; L639-F641 HydrophobicContact CD1-CE2 4.26Å; L639-F641 HydrophobicContact CD1-CZ 4.29Å; L639-F681 HydrophobicContact CD2-CE1 4.11Å; L639-F681 HydrophobicContact CD2-CZ 3.9Å; L639-F690 HydrophobicContact CD2-CB 3.65Å; L639-F690 HydrophobicContact CD2-CD1 3.89Å; L639-F690 HydrophobicContact CD2-CG 4.28Å; L639-L692 HydrophobicContact CB-CD1 4.26Å; L639-L692 HydrophobicContact CD2-CD1 4.06Å; L639-L703 HydrophobicContact CD1-CB 3.99Å; L639-L703 HydrophobicContact CD1-CD1 4.03Å; L639-L703 HydrophobicContact CD2-CD1 4.3Å; L639-A706 HydrophobicContact CD1-CB 3.8Å; L639-A706 HydrophobicContact CD2-CB 3.64Å; L639-A706 HydrophobicContact CG-CB 3.42Å; L639-A706 VanDerWaalsContact CG-CB 3.42Å; L639-T708 PolarHBondContact N-O 3.32Å; L639-V709 HydrophobicContact CB-CG2 4.44Å; L639-V709 HydrophobicContact CD1-CG2 4.32Å; L639-V709 CarbonylContact O-C 3.37Å; L639-V709 WeakPolarHBondContact O-CA 3.48Å; L639-I710 PolarHBondContact O-N 3.41Å; L639-C728 HydrophobicContact CD1-CB 4Å
640	I	93.8	Very high	89.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.5	174.8	-53.7	179.3	0	0	0	108.3	L624 L628 V638 L651 I689 F690 L691 L692 I710 F712	L624-I640 HydrophobicContact CD1-CD1 4.34Å; L628-I640 HydrophobicContact CD1-CD1 4.49Å; V638-I640 HydrophobicContact CG1-CG1 4.06Å; I640-L651 HydrophobicContact CG2-CD1 3.93Å; I640-I689 HydrophobicContact CD1-CG2 3.76Å; I640-I689 HydrophobicContact CG1-CG2 4.14Å; I640-F690 PolarHBondContact N-O 2.91Å; I640-L691 HydrophobicContact CB-CD2 3.98Å; I640-L691 HydrophobicContact CD1-CD2 4.04Å; I640-L691 HydrophobicContact CG1-CD2 4.4Å; I640-L692 PolarHBondContact O-N 3.27Å; I640-I710 WeakPolarHBondContact CA-O 3.49Å; I640-I710 HydrophobicContact CG1-CB 4.33Å; I640-I710 HydrophobicContact CG1-CD1 4.43Å; I640-F712 HydrophobicContact CG2-CB 4.43Å
641	F	93	Very high	89.9	Confident	1 Å²	1	33.9 Å²	33.9	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.7	175.8	-68	-79.6	0	0	0	110.9	L639 L692 V709 I710 F712 A724	L639-F641 HydrophobicContact CB-CE2 3.91Å; L639-F641 HydrophobicContact CB-CZ 4.42Å; L639-F641 HydrophobicContact CD1-CE2 4.26Å; L639-F641 HydrophobicContact CD1-CZ 4.29Å; F641-L692 VanDerWaalsContact CA-O 3.29Å; F641-L692 WeakPolarHBondContact CA-O 3.47Å; F641-L692 HydrophobicContact CD1-CB 3.53Å; F641-L692 HydrophobicContact CD1-CD1 4.32Å; F641-L692 HydrophobicContact CE1-CB 3.55Å; F641-L692 HydrophobicContact CE1-CD1 3.61Å; F641-L692 HydrophobicContact CE1-CG 4.11Å; F641-L692 HydrophobicContact CG-CB 4.42Å; F641-L692 HydrophobicContact CZ-CB 4.45Å; F641-L692 HydrophobicContact CZ-CD1 3.72Å; F641-V709 HydrophobicContact CD2-CG1 3.58Å; F641-V709 HydrophobicContact CE2-CG1 3.58Å; F641-I710 PolarHBondContact N-O 2.74Å; F641-F712 WeakPolarHBondContact O-CB 3.18Å; F641-F712 PolarHBondContact O-N 3.24Å; F641-A724 HydrophobicContact CD1-CB 3.89Å; F641-A724 HydrophobicContact CD2-CB 4.13Å; F641-A724 HydrophobicContact CE1-CB 3.8Å; F641-A724 HydrophobicContact CE2-CB 4.05Å; F641-A724 HydrophobicContact CG-CB 4.04Å; F641-A724 HydrophobicContact CZ-CB 3.88Å
642	S	92.3	Very high	90	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.7	166.1	-171.4	0	0	0	0	115	I647 L692 S693 T694 D713	S642-I647 VanDerWaalsContact CB-CG2 3.42Å; S642-I647 WeakPolarHBondContact OG-CG2 3.19Å; S642-L692 PolarHBondContact N-O 2.78Å; S642-S693 CarbonylContact O-C 3.08Å; S642-S693 WeakPolarHBondContact O-CA 3.04Å; S642-T694 PolarHBondContact O-N 3.01Å; S642-T694 PolarHBondContact O-OG1 2.89Å; S642-D713 WeakPolarHBondContact CA-OD1 3.47Å; S642-D713 VanDerWaalsContact CB-OD1 3.31Å; S642-D713 WeakPolarHBondContact CB-OD1 3.42Å; S642-D713 VanDerWaalsContact OG-CG 3.24Å; S642-D713 PolarHBondContact OG-OD1 2.74Å; S642-D713 PolarHBondContact OG-OD2 3.47Å
643	Q	89.8	Confident	90	Very high	33 Å²	33	32.6 Å²	32.6	15%	0.154	18%	0.177	C	C	.	.	S	Bend	trans	-70.3	-41.7	175.5	-166.8	178.2	46.2	0	0	111.8	T694 D713 D715	Q643-T694 PolarHBondContact N-OG1 3.32Å; Q643-D713 VanDerWaalsContact CB-OD2 3.29Å; Q643-D713 WeakPolarHBondContact CB-OD2 3.33Å; Q643-D713 PolarHBondContact N-OD1 3.28Å; Q643-D713 PolarHBondContact N-OD2 2.75Å; Q643-D715 VanDerWaalsContact NE2-CG 3.3Å; Q643-D715 PolarHBondContact NE2-OD2 2.84Å
644	M	87.7	Confident	90.1	Very high	18 Å²	18	25.5 Å²	25.5	9%	0.089	14%	0.141	C	C	.	.			trans	-91.1	124.7	-175.7	-56.1	-171	-173.8	0	0	111.2	M585 K588 R589 L596 S646 I647	M585-M644 HydrophobicContact CE-CE 3.97Å; K588-M644 HydrophobicContact CB-CE 3.68Å; K588-M644 HydrophobicContact CD-CE 4.36Å; R589-M644 HydrophobicContact CG-CE 4.02Å; R589-M644 HydrophobicContact CG-SD 3.88Å; L596-M644 HydrophobicContact CD1-SD 4.22Å; M644-S646 VanDerWaalsContact C-N 3.26Å; M644-S646 PolarHBondContact O-N 3.44Å; M644-I647 HydrophobicContact CB-CG2 4.19Å; M644-I647 WeakPolarHBondContact O-CG2 3.45Å; M644-I647 PolarHBondContact O-N 3.34Å
645	T	89	Confident	90.3	Very high	70 Å²	70	20.2 Å²	20.2	43%	0.429	12%	0.121	S	C	.	.	H	α-helix	trans	-66.8	-30.1	177.1	53.5	0	0	0	0	112.6	I647 L648 D649	T645-I647 PolarHBondContact O-N 2.96Å; T645-L648 WeakPolarHBondContact O-CA 3.4Å; T645-L648 VanDerWaalsContact O-CB 3.26Å; T645-L648 WeakPolarHBondContact O-CB 3.22Å; T645-L648 PolarHBondContact O-N 2.94Å; T645-D649 PolarHBondContact O-N 3.48Å; T645-D649 VanDerWaalsContact O-N 3.16Å
646	S	88.3	Confident	90.4	Very high	43 Å²	43	26 Å²	26	30%	0.301	13%	0.128	S	C	.	.	H	α-helix	trans	-61.8	-28.9	177.1	54.3	0	0	0	0	113.7	L596 M644 D649 I650	L596-S646 WeakPolarHBondContact CD2-OG 3.44Å; M644-S646 VanDerWaalsContact C-N 3.26Å; M644-S646 PolarHBondContact O-N 3.44Å; S646-D649 WeakPolarHBondContact CA-OD2 3.25Å; S646-D649 WeakPolarHBondContact O-CB 3.49Å; S646-D649 PolarHBondContact O-N 3.24Å; S646-I650 WeakPolarHBondContact O-CG1 3.33Å; S646-I650 PolarHBondContact O-N 2.78Å
647	I	90.7	Very high	90.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-78.7	-25.6	174.3	-163.6	63.3	0	0	0	111.6	N592 H593 L596 F621 S642 M644 T645 I650 L651 F712	N592-I647 HydrophobicContact CB-CD1 4.49Å; H593-I647 HydrophobicContact CB-CD1 3.7Å; L596-I647 HydrophobicContact CD1-CD1 4.33Å; F621-I647 HydrophobicContact CE2-CD1 3.83Å; F621-I647 HydrophobicContact CZ-CD1 4.11Å; S642-I647 VanDerWaalsContact CB-CG2 3.42Å; S642-I647 WeakPolarHBondContact OG-CG2 3.19Å; M644-I647 HydrophobicContact CB-CG2 4.19Å; M644-I647 WeakPolarHBondContact O-CG2 3.45Å; M644-I647 PolarHBondContact O-N 3.34Å; T645-I647 PolarHBondContact O-N 2.96Å; I647-I650 HydrophobicContact CD1-CB 4.26Å; I647-I650 HydrophobicContact CD1-CD1 4.02Å; I647-I650 PolarHBondContact O-N 2.77Å; I647-L651 WeakPolarHBondContact O-CB 3.14Å; I647-L651 VanDerWaalsContact O-CG 3.3Å; I647-L651 WeakPolarHBondContact O-CG 3.41Å; I647-L651 PolarHBondContact O-N 3.39Å; I647-F712 HydrophobicContact CD1-CE1 3.98Å; I647-F712 HydrophobicContact CD1-CZ 4.21Å; I647-F712 HydrophobicContact CG1-CD1 3.98Å; I647-F712 HydrophobicContact CG1-CE1 3.59Å; I647-F712 HydrophobicContact CG1-CZ 4.1Å
648	L	91	Very high	90.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66	-37.5	172.1	-56.8	179.4	0	0	0	109	T645 L651 M652 L691	T645-L648 WeakPolarHBondContact O-CA 3.4Å; T645-L648 VanDerWaalsContact O-CB 3.26Å; T645-L648 WeakPolarHBondContact O-CB 3.22Å; T645-L648 PolarHBondContact O-N 2.94Å; L648-L651 HydrophobicContact CD2-CD1 4.34Å; L648-L651 PolarHBondContact O-N 2.9Å; L648-M652 VanDerWaalsContact O-CG 3.3Å; L648-M652 WeakPolarHBondContact O-CG 3.41Å; L648-M652 PolarHBondContact O-N 3.45Å; L648-L691 HydrophobicContact CD2-CB 4.33Å
649	D	89.6	Confident	89.8	Confident	61 Å²	61	35.8 Å²	35.8	33%	0.326	18%	0.177	S	C	.	.	H	α-helix	trans	-59	-50.5	173.2	-54.9	-39.3	0	0	0	111.2	T645 S646 L651 M652 D653 R664	T645-D649 PolarHBondContact O-N 3.48Å; T645-D649 VanDerWaalsContact O-N 3.16Å; S646-D649 WeakPolarHBondContact CA-OD2 3.25Å; S646-D649 WeakPolarHBondContact O-CB 3.49Å; S646-D649 PolarHBondContact O-N 3.24Å; D649-L651 VanDerWaalsContact C-N 3.29Å; D649-L651 PolarHBondContact O-N 3.47Å; D649-M652 HydrophobicContact CB-CE 4.46Å; D649-M652 WeakPolarHBondContact O-CA 3.31Å; D649-M652 VanDerWaalsContact O-CB 3.26Å; D649-M652 WeakPolarHBondContact O-CB 3.43Å; D649-M652 PolarHBondContact O-N 2.85Å; D649-D653 PolarHBondContact O-N 2.92Å; D649-R664 IonicContact OD1-CZ 3.95Å; D649-R664 VanDerWaalsContact OD1-CZ 3.27Å; D649-R664 IonicContact OD1-NH1 3.16Å; D649-R664 PolarHBondContact OD1-NH1 3.2Å; D649-R664 IonicContact OD1-NH2 2.75Å; D649-R664 PolarHBondContact OD1-NH2 3.27Å
650	I	89.6	Confident	89.7	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-36.4	176.3	-62.5	170.1	0	0	0	112.1	H593 L596 Y599 L614 F621 S646 I647 M652 D653 Y654	H593-I650 HydrophobicContact CB-CD1 4.16Å; L596-I650 HydrophobicContact CD2-CD1 3.61Å; L596-I650 HydrophobicContact CG-CD1 3.9Å; Y599-I650 HydrophobicContact CE2-CG1 4.18Å; L614-I650 HydrophobicContact CD1-CG2 3.49Å; L614-I650 VanDerWaalsContact CD1-CG2 3.49Å; L614-I650 HydrophobicContact CD2-CG2 4.37Å; L614-I650 HydrophobicContact CG-CG2 4.39Å; F621-I650 HydrophobicContact CE1-CG2 4.21Å; F621-I650 HydrophobicContact CE2-CG2 4.35Å; F621-I650 HydrophobicContact CZ-CB 4.48Å; F621-I650 HydrophobicContact CZ-CG2 3.67Å; S646-I650 WeakPolarHBondContact O-CG1 3.33Å; S646-I650 PolarHBondContact O-N 2.78Å; I647-I650 HydrophobicContact CD1-CB 4.26Å; I647-I650 HydrophobicContact CD1-CD1 4.02Å; I647-I650 PolarHBondContact O-N 2.77Å; I650-M652 VanDerWaalsContact C-N 3.28Å; I650-M652 PolarHBondContact O-N 2.82Å; I650-D653 PolarHBondContact O-N 3.4Å; I650-Y654 PolarHBondContact O-N 3.41Å
651	L	90.8	Very high	89.5	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-67.2	-28.8	174.9	-77.6	166.1	0	0	0	112.2	F621 L624 I640 I647 L648 D649 C655 L691	F621-L651 HydrophobicContact CE1-CD2 3.66Å; F621-L651 HydrophobicContact CE1-CG 4.31Å; F621-L651 HydrophobicContact CZ-CD2 3.75Å; F621-L651 HydrophobicContact CZ-CG 4.01Å; L624-L651 HydrophobicContact CD1-CD2 4.01Å; L624-L651 HydrophobicContact CD2-CD2 4.44Å; I640-L651 HydrophobicContact CG2-CD1 3.93Å; I647-L651 WeakPolarHBondContact O-CB 3.14Å; I647-L651 VanDerWaalsContact O-CG 3.3Å; I647-L651 WeakPolarHBondContact O-CG 3.41Å; I647-L651 PolarHBondContact O-N 3.39Å; L648-L651 HydrophobicContact CD2-CD1 4.34Å; L648-L651 PolarHBondContact O-N 2.9Å; D649-L651 VanDerWaalsContact C-N 3.29Å; D649-L651 PolarHBondContact O-N 3.47Å; L651-C655 WeakPolarHBondContact O-CB 3.48Å; L651-C655 PolarHBondContact O-N 3.13Å; L651-C655 PolarHBondContact O-SG 3.36Å; L651-L691 HydrophobicContact CB-CD1 4.11Å; L651-L691 HydrophobicContact CB-CD2 4.08Å; L651-L691 HydrophobicContact CD1-CD2 4.21Å
652	M	90.5	Very high	89.4	Confident	41 Å²	41	46.9 Å²	46.9	20%	0.202	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-46.9	170.9	-62.8	-167.5	-53.3	0	0	110.6	L648 D649 I650 Y654 C655 Y656 Y662 R664 L691	L648-M652 VanDerWaalsContact O-CG 3.3Å; L648-M652 WeakPolarHBondContact O-CG 3.41Å; L648-M652 PolarHBondContact O-N 3.45Å; D649-M652 HydrophobicContact CB-CE 4.46Å; D649-M652 WeakPolarHBondContact O-CA 3.31Å; D649-M652 VanDerWaalsContact O-CB 3.26Å; D649-M652 WeakPolarHBondContact O-CB 3.43Å; D649-M652 PolarHBondContact O-N 2.85Å; I650-M652 VanDerWaalsContact C-N 3.28Å; I650-M652 PolarHBondContact O-N 2.82Å; M652-Y654 VanDerWaalsContact C-N 3.27Å; M652-Y654 PolarHBondContact O-N 3.5Å; M652-C655 PolarHBondContact O-N 2.99Å; M652-C655 VanDerWaalsContact O-N 3.07Å; M652-Y656 PolarHBondContact O-N 3.35Å; M652-Y662 HydrophobicContact CB-CE1 4.41Å; M652-Y662 HydrophobicContact CB-CE2 4.15Å; M652-Y662 WeakPolarHBondContact CB-OH 3.48Å; M652-Y662 HydrophobicContact CG-CD2 4.37Å; M652-Y662 HydrophobicContact CG-CE2 3.51Å; M652-Y662 HydrophobicContact SD-CE2 3.7Å; M652-Y662 PolarHBondContact SD-OH 3.04Å; M652-R664 PolarHBondContact SD-NH1 3.3Å; M652-L691 HydrophobicContact CG-CD1 3.9Å
653	D	88.8	Confident	89.4	Confident	34 Å²	34	47.1 Å²	47.1	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-41.5	177.5	-58.6	-23.6	0	0	0	110.8	Y599 I610 L614 D649 I650 Y656 L657	Y599-D653 PolarHBondContact OH-OD2 2.83Å; I610-D653 HydrophobicContact CD1-CB 4.09Å; I610-D653 HydrophobicContact CG1-CB 4.27Å; I610-D653 HydrophobicContact CG2-CB 4.32Å; L614-D653 HydrophobicContact CD2-CB 4.21Å; D649-D653 PolarHBondContact O-N 2.92Å; I650-D653 PolarHBondContact O-N 3.4Å; D653-Y656 WeakPolarHBondContact O-CB 3.39Å; D653-Y656 PolarHBondContact O-N 3.47Å; D653-L657 PolarHBondContact O-N 2.82Å
654	Y	89.8	Confident	89.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-42	173.8	172.8	-95.9	0	0	0	113	V615 F621 L624 D625 L628 I650 M652 Y656 L657 R658 F660	V615-Y654 HydrophobicContact CG2-CD2 3.65Å; V615-Y654 HydrophobicContact CG2-CE2 3.63Å; F621-Y654 HydrophobicContact CD1-CD2 4.04Å; F621-Y654 HydrophobicContact CD1-CG 4.09Å; F621-Y654 HydrophobicContact CE1-CD2 4.42Å; F621-Y654 HydrophobicContact CE1-CG 4.04Å; L624-Y654 HydrophobicContact CD2-CD1 3.78Å; L624-Y654 HydrophobicContact CD2-CE1 3.3Å; L624-Y654 HydrophobicContact CD2-CE2 4.49Å; D625-Y654 VanDerWaalsContact CA-OH 3.26Å; D625-Y654 WeakPolarHBondContact CA-OH 3.33Å; D625-Y654 HydrophobicContact CB-CE2 4.32Å; D625-Y654 WeakPolarHBondContact OD1-CE2 3.12Å; D625-Y654 PolarHBondContact OD1-OH 2.8Å; L628-Y654 HydrophobicContact CD1-CE1 3.86Å; I650-Y654 PolarHBondContact O-N 3.41Å; M652-Y654 VanDerWaalsContact C-N 3.27Å; M652-Y654 PolarHBondContact O-N 3.5Å; Y654-Y656 VanDerWaalsContact C-N 3.28Å; Y654-Y656 PolarHBondContact O-N 2.83Å; Y654-L657 PolarHBondContact O-N 2.83Å; Y654-R658 HydrophobicContact CD2-CG 4.43Å; Y654-R658 HydrophobicContact CE1-CG 4.41Å; Y654-R658 HydrophobicContact CE2-CG 3.79Å; Y654-R658 PolarHBondContact O-N 3.26Å; Y654-R658 VanDerWaalsContact O-N 3.14Å; Y654-F660 HydrophobicContact CE1-CD2 4.25Å; Y654-F660 HydrophobicContact CE1-CE2 4.14Å
655	C	89.5	Confident	89.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-34.6	176.4	-69.4	0	0	0	0	111.7	L651 M652 D659 F660 Y662	L651-C655 WeakPolarHBondContact O-CB 3.48Å; L651-C655 PolarHBondContact O-N 3.13Å; L651-C655 PolarHBondContact O-SG 3.36Å; M652-C655 PolarHBondContact O-N 2.99Å; M652-C655 VanDerWaalsContact O-N 3.07Å; C655-D659 PolarHBondContact O-N 3.2Å; C655-D659 VanDerWaalsContact O-N 3.1Å; C655-F660 HydrophobicContact CB-CB 4.19Å; C655-F660 PolarHBondContact O-N 3.05Å; C655-Y662 HydrophobicContact CB-CD1 3.5Å; C655-Y662 VanDerWaalsContact CB-CD1 3.5Å; C655-Y662 HydrophobicContact CB-CE1 3.99Å; C655-Y662 HydrophobicContact CB-CG 4.25Å
656	Y	88.3	Confident	89.2	Confident	174 Å²	174	43.6 Å²	43.6	68%	0.682	20%	0.198	S	C	*	.	H	α-helix	trans	-65.6	-45.8	173.1	-175.3	-99	0	0	0	111.2	M652 D653 Y654 R658 D659	M652-Y656 PolarHBondContact O-N 3.35Å; D653-Y656 WeakPolarHBondContact O-CB 3.39Å; D653-Y656 PolarHBondContact O-N 3.47Å; Y654-Y656 VanDerWaalsContact C-N 3.28Å; Y654-Y656 PolarHBondContact O-N 2.83Å; Y656-R658 VanDerWaalsContact C-N 3.26Å; Y656-R658 PolarHBondContact O-N 2.86Å; Y656-D659 PolarHBondContact O-N 3.38Å
657	L	87.1	Confident	88.8	Confident	52 Å²	52	44.6 Å²	44.6	27%	0.272	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-32.3	178.3	-175.9	68.4	0	0	0	113.7	I610 V615 D653 Y654	I610-L657 HydrophobicContact CG2-CB 4.18Å; I610-L657 HydrophobicContact CG2-CD1 4.39Å; V615-L657 HydrophobicContact CG2-CD2 4.28Å; D653-L657 PolarHBondContact O-N 2.82Å; Y654-L657 PolarHBondContact O-N 2.83Å
658	R	86	Confident	88.3	Confident	82 Å²	82	49.3 Å²	49.3	31%	0.309	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	9.1	-177	-63.8	-60.3	-160.9	-153.6	1.6	114	E612 D625 Y654 Y656 F660	E612-R658 IonicContact OE1-NH1 3.96Å; D625-R658 IonicContact OD1-CZ 3.46Å; D625-R658 IonicContact OD1-NE 2.82Å; D625-R658 PolarHBondContact OD1-NE 3.05Å; D625-R658 IonicContact OD1-NH2 3.26Å; D625-R658 PolarHBondContact OD1-NH2 3.23Å; D625-R658 IonicContact OD2-CZ 3.73Å; D625-R658 IonicContact OD2-NE 3.87Å; D625-R658 IonicContact OD2-NH2 2.81Å; D625-R658 PolarHBondContact OD2-NH2 2.88Å; Y654-R658 HydrophobicContact CD2-CG 4.43Å; Y654-R658 HydrophobicContact CE1-CG 4.41Å; Y654-R658 HydrophobicContact CE2-CG 3.79Å; Y654-R658 PolarHBondContact O-N 3.26Å; Y654-R658 VanDerWaalsContact O-N 3.14Å; Y656-R658 VanDerWaalsContact C-N 3.26Å; Y656-R658 PolarHBondContact O-N 2.86Å; R658-F660 VanDerWaalsContact C-N 3.31Å; R658-F660 HydrophobicContact CB-CD2 3.69Å; R658-F660 HydrophobicContact CB-CE2 3.47Å; R658-F660 VanDerWaalsContact CB-CE2 3.47Å; R658-F660 HydrophobicContact CB-CG 4.42Å; R658-F660 HydrophobicContact CB-CZ 4.03Å; R658-F660 HydrophobicContact CG-CE2 4.18Å; R658-F660 PolarHBondContact O-N 2.96Å
659	D	87.5	Confident	87.8	Confident	136 Å²	136	50.9 Å²	50.9	73%	0.727	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	44.1	-177.4	-69.3	-41.4	0	0	0	114.1	C655 Y656	C655-D659 PolarHBondContact O-N 3.2Å; C655-D659 VanDerWaalsContact O-N 3.1Å; Y656-D659 PolarHBondContact O-N 3.38Å
660	F	89.8	Confident	87.3	Confident	19 Å²	19	51.1 Å²	51.1	8%	0.083	26%	0.261	C	S	.	.			trans	-93.2	122.2	171.7	-63.3	-44.9	0	0	0	111	L628 P629 K632 Y654 C655 R658 Y662 F688 I689	L628-F660 HydrophobicContact CB-CE2 4.26Å; L628-F660 HydrophobicContact CB-CZ 4.45Å; L628-F660 HydrophobicContact CD1-CE2 4.44Å; P629-F660 HydrophobicContact CG-CZ 4.25Å; K632-F660 HydrophobicContact CD-CD1 3.82Å; K632-F660 HydrophobicContact CD-CE1 3.58Å; Y654-F660 HydrophobicContact CE1-CD2 4.25Å; Y654-F660 HydrophobicContact CE1-CE2 4.14Å; C655-F660 HydrophobicContact CB-CB 4.19Å; C655-F660 PolarHBondContact O-N 3.05Å; R658-F660 VanDerWaalsContact C-N 3.31Å; R658-F660 HydrophobicContact CB-CD2 3.69Å; R658-F660 HydrophobicContact CB-CE2 3.47Å; R658-F660 VanDerWaalsContact CB-CE2 3.47Å; R658-F660 HydrophobicContact CB-CG 4.42Å; R658-F660 HydrophobicContact CB-CZ 4.03Å; R658-F660 HydrophobicContact CG-CE2 4.18Å; R658-F660 PolarHBondContact O-N 2.96Å; F660-Y662 PolarHBondContact O-N 2.89Å; F660-F688 HydrophobicContact CD1-CD1 4.2Å; F660-F688 HydrophobicContact CG-CD1 4.46Å; F660-I689 HydrophobicContact CB-CD1 3.88Å; F660-I689 HydrophobicContact CD2-CD1 4.05Å; F660-I689 HydrophobicContact CG-CD1 4.11Å
661	R	90.7	Very high	86.4	Confident	136 Å²	136	56.6 Å²	56.6	51%	0.513	28%	0.282	S	S	.	.			trans	-72.1	124.5	170.2	-62.7	-160.1	-169.5	170	19.6	110	E686 F688 I689	R661-E686 IonicContact CZ-OE1 2.99Å; R661-E686 IonicContact CZ-OE2 3.59Å; R661-E686 IonicContact NH1-OE1 2.82Å; R661-E686 IonicContact NH1-OE2 3.43Å; R661-E686 PolarHBondContact NH1-OE2 3.34Å; R661-E686 VanDerWaalsContact NH2-CD 3.33Å; R661-E686 IonicContact NH2-OE1 2.72Å; R661-E686 PolarHBondContact NH2-OE1 3.11Å; R661-E686 IonicContact NH2-OE2 3.99Å; R661-E686 PolarHBondContact NH2-OE2 2.81Å; R661-E686 VanDerWaalsContact NH2-OE2 3.15Å; R661-F688 PolarHBondContact O-N 3.31Å; R661-F688 VanDerWaalsContact O-N 3.15Å; R661-I689 PolarHBondContact O-N 2.96Å
662	Y	91.3	Very high	85.9	Confident	81 Å²	81	60.7 Å²	60.7	32%	0.318	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	158.5	-178.9	70.2	-86.5	0	0	0	111.7	M652 C655 F660 I689 L691	M652-Y662 HydrophobicContact CB-CE1 4.41Å; M652-Y662 HydrophobicContact CB-CE2 4.15Å; M652-Y662 WeakPolarHBondContact CB-OH 3.48Å; M652-Y662 HydrophobicContact CG-CD2 4.37Å; M652-Y662 HydrophobicContact CG-CE2 3.51Å; M652-Y662 HydrophobicContact SD-CE2 3.7Å; M652-Y662 PolarHBondContact SD-OH 3.04Å; C655-Y662 HydrophobicContact CB-CD1 3.5Å; C655-Y662 VanDerWaalsContact CB-CD1 3.5Å; C655-Y662 HydrophobicContact CB-CE1 3.99Å; C655-Y662 HydrophobicContact CB-CG 4.25Å; F660-Y662 PolarHBondContact O-N 2.89Å; Y662-I689 CarbonylContact C-O 3.47Å; Y662-I689 WeakPolarHBondContact CA-O 3.46Å; Y662-L691 HydrophobicContact CD2-CD1 3.86Å; Y662-L691 HydrophobicContact CD2-CG 4.42Å; Y662-L691 HydrophobicContact CE2-CD1 4.35Å; Y662-L691 HydrophobicContact CG-CD1 4.39Å
663	S	91.1	Very high	85.6	Confident	5 Å²	5	63.1 Å²	63.1	4%	0.035	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	152.3	163.2	-74.9	0	0	0	0	108.5	I689 F690 L691	S663-I689 PolarHBondContact N-O 2.75Å; S663-F690 WeakPolarHBondContact O-CA 3.33Å; S663-F690 VanDerWaalsContact O-CD2 3.27Å; S663-F690 WeakPolarHBondContact O-CD2 3.47Å; S663-L691 PolarHBondContact O-N 3.13Å
664	R	90.6	Very high	85.2	Confident	41 Å²	41	62.8 Å²	62.8	16%	0.155	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.5	179.5	176.8	-179.7	173.4	147.5	-1.2	110.7	D649 M652 D666 M669 N677 L691	D649-R664 IonicContact OD1-CZ 3.95Å; D649-R664 VanDerWaalsContact OD1-CZ 3.27Å; D649-R664 IonicContact OD1-NH1 3.16Å; D649-R664 PolarHBondContact OD1-NH1 3.2Å; D649-R664 IonicContact OD1-NH2 2.75Å; D649-R664 PolarHBondContact OD1-NH2 3.27Å; M652-R664 PolarHBondContact SD-NH1 3.3Å; R664-D666 IonicContact CZ-OD2 3.39Å; R664-D666 VanDerWaalsContact CZ-OD2 3.3Å; R664-D666 IonicContact NE-OD2 2.58Å; R664-D666 PolarHBondContact NE-OD2 3.32Å; R664-D666 IonicContact NH2-OD2 3.82Å; R664-D666 PolarHBondContact NH2-OD2 2.73Å; R664-M669 WeakPolarHBondContact O-CE 2.88Å; R664-N677 PolarHBondContact O-ND2 3.43Å; R664-L691 CarbonylContact C-O 3.54Å; R664-L691 WeakPolarHBondContact CA-O 3.28Å
665	L	87.5	Confident	84.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	111.4	169.2	-166.6	163.3	0	0	0	111.4	M669 R674 I678 F690 L691 L692 S693 A696 I701	L665-M669 HydrophobicContact CB-CE 4.29Å; L665-R674 HydrophobicContact CD1-CG 3.7Å; L665-R674 HydrophobicContact CG-CG 4.14Å; L665-I678 HydrophobicContact CD1-CD1 4.1Å; L665-I678 HydrophobicContact CD1-CG1 4.1Å; L665-F690 HydrophobicContact CB-CE1 4.46Å; L665-F690 HydrophobicContact CB-CE2 4.1Å; L665-F690 HydrophobicContact CB-CZ 3.73Å; L665-F690 HydrophobicContact CD1-CE1 4.36Å; L665-F690 HydrophobicContact CD1-CZ 3.88Å; L665-F690 HydrophobicContact CG-CZ 4.49Å; L665-L691 PolarHBondContact N-O 2.85Å; L665-L692 HydrophobicContact CB-CD2 3.65Å; L665-L692 HydrophobicContact CD1-CD2 4.08Å; L665-L692 HydrophobicContact CD2-CD2 4.09Å; L665-L692 HydrophobicContact CG-CD2 4.15Å; L665-S693 PolarHBondContact O-N 2.86Å; L665-S693 VanDerWaalsContact O-N 3.13Å; L665-A696 HydrophobicContact CD2-CB 3.6Å; L665-I701 HydrophobicContact CD1-CD1 3.58Å; L665-I701 HydrophobicContact CD2-CD1 4.03Å; L665-I701 HydrophobicContact CG-CD1 4.49Å
666	D	85.4	Confident	84.6	Confident	6 Å²	6	71.6 Å²	71.6	3%	0.032	36%	0.355	C	S	.	.			trans	-123.7	179.2	172.4	64.8	27.8	0	0	0	112.3	R664 S668 M669 R674	R664-D666 IonicContact CZ-OD2 3.39Å; R664-D666 VanDerWaalsContact CZ-OD2 3.3Å; R664-D666 IonicContact NE-OD2 2.58Å; R664-D666 PolarHBondContact NE-OD2 3.32Å; R664-D666 IonicContact NH2-OD2 3.82Å; R664-D666 PolarHBondContact NH2-OD2 2.73Å; D666-S668 VanDerWaalsContact C-N 3.33Å; D666-S668 PolarHBondContact OD1-N 3.45Å; D666-S668 VanDerWaalsContact OD1-N 3.15Å; D666-S668 PolarHBondContact OD1-OG 2.95Å; D666-S668 PolarHBondContact OD2-OG 3.22Å; D666-M669 WeakPolarHBondContact OD1-CG 3.23Å; D666-M669 PolarHBondContact OD1-N 3.25Å; D666-R674 PolarHBondContact O-NH2 3.42Å; D666-R674 VanDerWaalsContact O-NH2 3.15Å
667	G	78.6	Confident	84.5	Confident	63 Å²	63	65.1 Å²	65.1	65%	0.649	33%	0.332	S	S	*	.	S	Bend	trans	-79	-14.3	-178.9	0	0	0	0	0	114.3
668	S	80.4	Confident	84.3	Confident	99 Å²	99	63.8 Å²	63.8	69%	0.692	33%	0.325	S	S	*	.	S	Bend	trans	-87.3	-25.3	-178.4	33.2	0	0	0	0	113.3	D666	D666-S668 VanDerWaalsContact C-N 3.33Å; D666-S668 PolarHBondContact OD1-N 3.45Å; D666-S668 VanDerWaalsContact OD1-N 3.15Å; D666-S668 PolarHBondContact OD1-OG 2.95Å; D666-S668 PolarHBondContact OD2-OG 3.22Å
669	M	80.3	Confident	84.3	Confident	34 Å²	34	65.5 Å²	65.5	17%	0.167	34%	0.336	C	S	.	.	S	Bend	trans	-67.6	141.5	-177.4	-76.6	-165.4	-65.3	0	0	113.6	R664 L665 D666	R664-M669 WeakPolarHBondContact O-CE 2.88Å; L665-M669 HydrophobicContact CB-CE 4.29Å; D666-M669 WeakPolarHBondContact OD1-CG 3.23Å; D666-M669 PolarHBondContact OD1-N 3.25Å
670	P	78.8	Confident	84.3	Confident	66 Å²	66	63.8 Å²	63.8	43%	0.429	32%	0.323	S	S	.	.			trans	-64.8	155.3	173.9	29.3	-34.6	0	0	0	111.3	T672 E673 R674	P670-T672 VanDerWaalsContact C-N 3.32Å; P670-T672 PolarHBondContact O-N 3.07Å; P670-E673 WeakPolarHBondContact CD-OE2 3.46Å; P670-E673 HydrophobicContact CG-CB 4.1Å; P670-E673 HydrophobicContact CG-CG 3.86Å; P670-E673 PolarHBondContact O-N 3.16Å; P670-R674 PolarHBondContact O-N 2.91Å; P670-R674 VanDerWaalsContact O-N 3.13Å
671	Y	72.1	Confident	84.2	Confident	117 Å²	117	62.9 Å²	62.9	46%	0.459	32%	0.319	S	S	.	.	H	α-helix	trans	-57.8	-40.1	-175.3	169.4	-114.9	0	0	0	113.7	P301 E673 R674 D675	P301-Y671 HydrophobicContact CB-CE2 3.63Å; P301-Y671 VanDerWaalsContact CB-OH 3.27Å; P301-Y671 WeakPolarHBondContact CB-OH 3.31Å; P301-Y671 HydrophobicContact CG-CD2 3.82Å; P301-Y671 HydrophobicContact CG-CE1 4.36Å; P301-Y671 HydrophobicContact CG-CE2 3.13Å; P301-Y671 VanDerWaalsContact CG-CZ 3.45Å; Y671-E673 VanDerWaalsContact C-N 3.33Å; Y671-E673 PolarHBondContact O-N 3.48Å; Y671-R674 WeakPolarHBondContact O-CB 3.41Å; Y671-R674 PolarHBondContact O-N 3.45Å; Y671-D675 VanDerWaalsContact CE2-CG 3.49Å; Y671-D675 WeakPolarHBondContact CE2-OD1 3.36Å; Y671-D675 VanDerWaalsContact CE2-OD2 3.23Å; Y671-D675 WeakPolarHBondContact CE2-OD2 3.34Å; Y671-D675 PolarHBondContact O-N 3.14Å; Y671-D675 VanDerWaalsContact O-N 3.15Å; Y671-D675 PolarHBondContact OH-OD2 3.35Å
672	T	80.2	Confident	83.9	Confident	88 Å²	88	60 Å²	60	54%	0.54	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-35.6	-179.5	48.8	0	0	0	0	113	P670 K676	P670-T672 VanDerWaalsContact C-N 3.32Å; P670-T672 PolarHBondContact O-N 3.07Å; T672-K676 VanDerWaalsContact O-CG 3.27Å; T672-K676 WeakPolarHBondContact O-CG 3.38Å; T672-K676 PolarHBondContact O-N 3.1Å
673	E	83.4	Confident	83.8	Confident	91 Å²	91	62 Å²	62	43%	0.425	33%	0.326	S	S	.	.	H	α-helix	trans	-75.9	-37.3	176.8	-70.6	178.8	-178.7	0	0	111.8	P670 Y671 D675 K676 N677	P670-E673 WeakPolarHBondContact CD-OE2 3.46Å; P670-E673 HydrophobicContact CG-CB 4.1Å; P670-E673 HydrophobicContact CG-CG 3.86Å; P670-E673 PolarHBondContact O-N 3.16Å; Y671-E673 VanDerWaalsContact C-N 3.33Å; Y671-E673 PolarHBondContact O-N 3.48Å; E673-D675 VanDerWaalsContact C-N 3.34Å; E673-D675 PolarHBondContact O-N 3.3Å; E673-K676 PolarHBondContact O-N 3.22Å; E673-N677 WeakPolarHBondContact O-CB 3.49Å; E673-N677 PolarHBondContact O-N 2.98Å
674	R	81.1	Confident	83.5	Confident	27 Å²	27	64.6 Å²	64.6	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-55	-50.3	174.1	177	177.1	-70.2	169.1	0.9	111.3	L665 D666 P670 Y671 N677 I678	L665-R674 HydrophobicContact CD1-CG 3.7Å; L665-R674 HydrophobicContact CG-CG 4.14Å; D666-R674 PolarHBondContact O-NH2 3.42Å; D666-R674 VanDerWaalsContact O-NH2 3.15Å; P670-R674 PolarHBondContact O-N 2.91Å; P670-R674 VanDerWaalsContact O-N 3.13Å; Y671-R674 WeakPolarHBondContact O-CB 3.41Å; Y671-R674 PolarHBondContact O-N 3.45Å; R674-N677 PolarHBondContact O-N 2.96Å; R674-I678 HydrophobicContact CG-CD1 3.84Å; R674-I678 VanDerWaalsContact O-CG1 3.28Å; R674-I678 WeakPolarHBondContact O-CG1 3.37Å; R674-I678 PolarHBondContact O-N 3.15Å
675	D	79.9	Confident	83	Confident	49 Å²	49	68 Å²	68	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-39.6	-178.9	-81.4	7.3	0	0	0	112.1	Y671 E673 N677 I678 Q679	Y671-D675 VanDerWaalsContact CE2-CG 3.49Å; Y671-D675 WeakPolarHBondContact CE2-OD1 3.36Å; Y671-D675 VanDerWaalsContact CE2-OD2 3.23Å; Y671-D675 WeakPolarHBondContact CE2-OD2 3.34Å; Y671-D675 PolarHBondContact O-N 3.14Å; Y671-D675 VanDerWaalsContact O-N 3.15Å; Y671-D675 PolarHBondContact OH-OD2 3.35Å; E673-D675 VanDerWaalsContact C-N 3.34Å; E673-D675 PolarHBondContact O-N 3.3Å; D675-N677 PolarHBondContact O-N 3.28Å; D675-I678 PolarHBondContact O-N 2.9Å; D675-Q679 WeakPolarHBondContact O-CB 3.35Å; D675-Q679 WeakPolarHBondContact O-CG 3.41Å; D675-Q679 PolarHBondContact O-N 3.43Å
676	K	85.6	Confident	82.8	Confident	137 Å²	137	73.6 Å²	73.6	60%	0.596	39%	0.393	S	S	*	.	H	α-helix	trans	-59.3	-45.3	173.2	-74	173.2	-177.2	-178.7	0	111.7	T672 E673 I678 Q679 K680	T672-K676 VanDerWaalsContact O-CG 3.27Å; T672-K676 WeakPolarHBondContact O-CG 3.38Å; T672-K676 PolarHBondContact O-N 3.1Å; E673-K676 PolarHBondContact O-N 3.22Å; K676-I678 PolarHBondContact O-N 3.27Å; K676-Q679 PolarHBondContact O-N 2.99Å; K676-K680 VanDerWaalsContact O-CB 3.24Å; K676-K680 WeakPolarHBondContact O-CB 3.26Å; K676-K680 PolarHBondContact O-N 3.31Å
677	N	86.4	Confident	82.9	Confident	38 Å²	38	73.4 Å²	73.4	20%	0.203	39%	0.392	C	S	.	.	H	α-helix	trans	-66.6	-37.1	179.9	-73.2	-9.8	0	0	0	112.3	R664 E673 R674 D675 F681 F690	R664-N677 PolarHBondContact O-ND2 3.43Å; E673-N677 WeakPolarHBondContact O-CB 3.49Å; E673-N677 PolarHBondContact O-N 2.98Å; R674-N677 PolarHBondContact O-N 2.96Å; D675-N677 PolarHBondContact O-N 3.28Å; N677-F681 WeakPolarHBondContact O-CB 3.35Å; N677-F681 PolarHBondContact O-N 3.37Å; N677-F681 VanDerWaalsContact O-N 3.08Å; N677-F690 HydrophobicContact CB-CE2 4.42Å
678	I	83.9	Confident	83.5	Confident	25 Å²	25	71 Å²	71	13%	0.128	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-51.7	173.9	-67.4	164.1	0	0	0	109.7	L665 R674 D675 K676 K680 F681 F682 F690 I701	L665-I678 HydrophobicContact CD1-CD1 4.1Å; L665-I678 HydrophobicContact CD1-CG1 4.1Å; R674-I678 HydrophobicContact CG-CD1 3.84Å; R674-I678 VanDerWaalsContact O-CG1 3.28Å; R674-I678 WeakPolarHBondContact O-CG1 3.37Å; R674-I678 PolarHBondContact O-N 3.15Å; D675-I678 PolarHBondContact O-N 2.9Å; K676-I678 PolarHBondContact O-N 3.27Å; I678-K680 VanDerWaalsContact C-N 3.31Å; I678-K680 PolarHBondContact O-N 2.75Å; I678-F681 WeakPolarHBondContact O-CB 3.37Å; I678-F681 PolarHBondContact O-N 2.98Å; I678-F681 VanDerWaalsContact O-N 3.09Å; I678-F682 HydrophobicContact CG2-CD2 3.79Å; I678-F682 HydrophobicContact CG2-CE2 3.76Å; I678-F682 VanDerWaalsContact O-CD2 3.32Å; I678-F682 WeakPolarHBondContact O-CD2 3.38Å; I678-F682 PolarHBondContact O-N 3.16Å; I678-F690 HydrophobicContact CG1-CZ 4.29Å; I678-I701 HydrophobicContact CD1-CG2 3.74Å; I678-I701 HydrophobicContact CG1-CG2 4.28Å
679	Q	85	Confident	84.1	Confident	117 Å²	117	66.3 Å²	66.3	55%	0.547	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-41.3	179.1	-73.1	179.9	1.1	0	0	112.1	D675 K676 F681 F682 N683	D675-Q679 WeakPolarHBondContact O-CB 3.35Å; D675-Q679 WeakPolarHBondContact O-CG 3.41Å; D675-Q679 PolarHBondContact O-N 3.43Å; K676-Q679 PolarHBondContact O-N 2.99Å; Q679-F681 VanDerWaalsContact C-N 3.29Å; Q679-F681 PolarHBondContact O-N 3.05Å; Q679-F682 PolarHBondContact O-N 3.2Å; Q679-N683 WeakPolarHBondContact O-CB 3.33Å; Q679-N683 VanDerWaalsContact O-CG 3.32Å; Q679-N683 PolarHBondContact O-N 3.3Å
680	K	87.9	Confident	84.7	Confident	101 Å²	101	64.7 Å²	64.7	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-57.2	-43.8	174.5	-166.6	-177.2	-178.2	179	0	111.3	K676 I678 F682 D684 V687	K676-K680 VanDerWaalsContact O-CB 3.24Å; K676-K680 WeakPolarHBondContact O-CB 3.26Å; K676-K680 PolarHBondContact O-N 3.31Å; I678-K680 VanDerWaalsContact C-N 3.31Å; I678-K680 PolarHBondContact O-N 2.75Å; K680-F682 PolarHBondContact O-N 2.92Å; K680-D684 WeakPolarHBondContact CG-OD2 3.25Å; K680-D684 VanDerWaalsContact O-CB 3.26Å; K680-D684 WeakPolarHBondContact O-CB 3.26Å; K680-D684 PolarHBondContact O-N 3.42Å; K680-V687 HydrophobicContact CG-CG2 4.27Å
681	F	87.6	Confident	85.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-34.5	177.8	-177.9	-104.2	0	0	0	113.6	K637 L639 N677 I678 Q679 V687 F690 L703 A705 A706	K637-F681 HydrophobicContact CB-CZ 4.14Å; K637-F681 HydrophobicContact CD-CE2 4.24Å; K637-F681 HydrophobicContact CD-CZ 4.08Å; K637-F681 PolarHBondContact NZ-O 2.92Å; L639-F681 HydrophobicContact CD2-CE1 4.11Å; L639-F681 HydrophobicContact CD2-CZ 3.9Å; N677-F681 WeakPolarHBondContact O-CB 3.35Å; N677-F681 PolarHBondContact O-N 3.37Å; N677-F681 VanDerWaalsContact O-N 3.08Å; I678-F681 WeakPolarHBondContact O-CB 3.37Å; I678-F681 PolarHBondContact O-N 2.98Å; I678-F681 VanDerWaalsContact O-N 3.09Å; Q679-F681 VanDerWaalsContact C-N 3.29Å; Q679-F681 PolarHBondContact O-N 3.05Å; F681-V687 HydrophobicContact CD2-CG1 3.89Å; F681-F690 HydrophobicContact CD1-CD1 4.46Å; F681-F690 HydrophobicContact CD2-CB 3.85Å; F681-F690 HydrophobicContact CD2-CG 4.22Å; F681-F690 HydrophobicContact CE2-CB 3.76Å; F681-F690 HydrophobicContact CG-CB 4.36Å; F681-F690 HydrophobicContact CG-CD1 4.45Å; F681-F690 HydrophobicContact CG-CG 4.29Å; F681-F690 HydrophobicContact CZ-CB 4.2Å; F681-L703 HydrophobicContact CD1-CD2 4.49Å; F681-A705 HydrophobicContact CD1-CB 4.42Å; F681-A705 HydrophobicContact CE1-CB 4.06Å; F681-A706 HydrophobicContact CE1-CB 4.12Å; F681-A706 HydrophobicContact CZ-CB 3.93Å
682	F	85.7	Confident	86.2	Confident	75 Å²	75	56 Å²	56	33%	0.329	28%	0.281	S	S	.	.	H	α-helix	trans	-74.2	-46.3	176.6	-86.8	-83.2	0	0	0	112.6	I678 Q679 K680 N702 L703 A705	I678-F682 HydrophobicContact CG2-CD2 3.79Å; I678-F682 HydrophobicContact CG2-CE2 3.76Å; I678-F682 VanDerWaalsContact O-CD2 3.32Å; I678-F682 WeakPolarHBondContact O-CD2 3.38Å; I678-F682 PolarHBondContact O-N 3.16Å; Q679-F682 PolarHBondContact O-N 3.2Å; K680-F682 PolarHBondContact O-N 2.92Å; F682-N702 VanDerWaalsContact CE2-O 3.25Å; F682-N702 WeakPolarHBondContact CE2-O 3.37Å; F682-N702 VanDerWaalsContact CZ-O 3.27Å; F682-N702 WeakPolarHBondContact CZ-O 3.35Å; F682-L703 HydrophobicContact CE2-CD2 4.38Å; F682-A705 HydrophobicContact CD1-CB 3.62Å; F682-A705 HydrophobicContact CE1-CB 3.62Å; F682-A705 HydrophobicContact CG-CB 4.31Å; F682-A705 HydrophobicContact CZ-CB 4.31Å
683	N	87.3	Confident	86.7	Confident	122 Å²	122	52.1 Å²	52.1	65%	0.652	26%	0.257	S	S	*	.	H	α-helix	trans	-81	-39.2	-172	-65.2	-16	0	0	0	112.5	Q679 P685	Q679-N683 WeakPolarHBondContact O-CB 3.33Å; Q679-N683 VanDerWaalsContact O-CG 3.32Å; Q679-N683 PolarHBondContact O-N 3.3Å; N683-P685 WeakPolarHBondContact O-CD 3.36Å
684	D	86.3	Confident	86.8	Confident	60 Å²	60	47.9 Å²	47.9	32%	0.321	24%	0.238	S	C	.	.			trans	-89.3	120.3	-174.5	-62.5	-20	0	0	0	110.6	K637 K680 E686 V687	K637-D684 PolarHBondContact NZ-O 3.04Å; K680-D684 WeakPolarHBondContact CG-OD2 3.25Å; K680-D684 VanDerWaalsContact O-CB 3.26Å; K680-D684 WeakPolarHBondContact O-CB 3.26Å; K680-D684 PolarHBondContact O-N 3.42Å; D684-E686 VanDerWaalsContact C-N 3.27Å; D684-V687 HydrophobicContact CB-CG2 3.91Å
685	P	80.3	Confident	86.6	Confident	114 Å²	114	55.4 Å²	55.4	74%	0.74	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.6	172.9	29.6	-33.3	0	0	0	112.3	N683 V687	N683-P685 WeakPolarHBondContact O-CD 3.36Å; P685-V687 VanDerWaalsContact C-N 3.31Å; P685-V687 PolarHBondContact O-N 3.29Å
686	E	83.4	Confident	86.3	Confident	117 Å²	117	53.2 Å²	53.2	55%	0.547	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21.6	179.9	-64	-174.6	119.1	0	0	113.2	R661 D684 F688	R661-E686 IonicContact CZ-OE1 2.99Å; R661-E686 IonicContact CZ-OE2 3.59Å; R661-E686 IonicContact NH1-OE1 2.82Å; R661-E686 IonicContact NH1-OE2 3.43Å; R661-E686 PolarHBondContact NH1-OE2 3.34Å; R661-E686 VanDerWaalsContact NH2-CD 3.33Å; R661-E686 IonicContact NH2-OE1 2.72Å; R661-E686 PolarHBondContact NH2-OE1 3.11Å; R661-E686 IonicContact NH2-OE2 3.99Å; R661-E686 PolarHBondContact NH2-OE2 2.81Å; R661-E686 VanDerWaalsContact NH2-OE2 3.15Å; D684-E686 VanDerWaalsContact C-N 3.27Å; E686-F688 PolarHBondContact O-N 2.72Å
687	V	87.6	Confident	85.4	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	23%	0.227	C	C	.	.			trans	-78.7	106.1	175.5	-176.4	0	0	0	0	108.9	K637 K680 F681 D684 P685	K637-V687 WeakPolarHBondContact CE-O 3.13Å; K680-V687 HydrophobicContact CG-CG2 4.27Å; F681-V687 HydrophobicContact CD2-CG1 3.89Å; D684-V687 HydrophobicContact CB-CG2 3.91Å; P685-V687 VanDerWaalsContact C-N 3.31Å; P685-V687 PolarHBondContact O-N 3.29Å
688	F	90	Very high	84.3	Confident	12 Å²	12	45.1 Å²	45.1	5%	0.053	22%	0.22	C	C	.	.			trans	-88.7	-40.6	-175.3	170.4	-123	0	0	0	112.3	L628 L631 K632 H636 V638 F660 R661 E686	L628-F688 HydrophobicContact CB-CE1 4.2Å; L628-F688 HydrophobicContact CD2-CE1 4.03Å; L628-F688 HydrophobicContact CD2-CZ 4.18Å; L628-F688 WeakPolarHBondContact O-CZ 3.24Å; L631-F688 HydrophobicContact CB-CE2 4.26Å; L631-F688 HydrophobicContact CB-CZ 3.97Å; K632-F688 HydrophobicContact CB-CD1 4.41Å; K632-F688 HydrophobicContact CB-CD2 4.36Å; K632-F688 HydrophobicContact CB-CE1 4.1Å; K632-F688 HydrophobicContact CB-CE2 3.99Å; K632-F688 HydrophobicContact CB-CZ 3.89Å; K632-F688 HydrophobicContact CD-CD1 4.42Å; K632-F688 HydrophobicContact CG-CD1 4.44Å; K632-F688 HydrophobicContact CG-CD2 4.38Å; K632-F688 HydrophobicContact CG-CG 4.37Å; H636-F688 WeakPolarHBondContact O-CD2 3.45Å; H636-F688 WeakPolarHBondContact O-CE2 3.39Å; V638-F688 HydrophobicContact CB-CZ 4.5Å; V638-F688 HydrophobicContact CG2-CD2 4.48Å; V638-F688 HydrophobicContact CG2-CE1 4.48Å; V638-F688 HydrophobicContact CG2-CE2 3.62Å; V638-F688 HydrophobicContact CG2-CZ 3.6Å; V638-F688 PolarHBondContact N-O 3.22Å; F660-F688 HydrophobicContact CD1-CD1 4.2Å; F660-F688 HydrophobicContact CG-CD1 4.46Å; R661-F688 PolarHBondContact O-N 3.31Å; R661-F688 VanDerWaalsContact O-N 3.15Å; E686-F688 PolarHBondContact O-N 2.72Å
689	I	92.6	Very high	83.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.9	-172.1	-58.6	175.3	0	0	0	110.7	L628 V638 I640 F660 R661 Y662 S663 L691	L628-I689 HydrophobicContact CD1-CD1 3.88Å; L628-I689 HydrophobicContact CD2-CD1 4.45Å; V638-I689 WeakPolarHBondContact O-CA 3.43Å; I640-I689 HydrophobicContact CD1-CG2 3.76Å; I640-I689 HydrophobicContact CG1-CG2 4.14Å; F660-I689 HydrophobicContact CB-CD1 3.88Å; F660-I689 HydrophobicContact CD2-CD1 4.05Å; F660-I689 HydrophobicContact CG-CD1 4.11Å; R661-I689 PolarHBondContact O-N 2.96Å; Y662-I689 CarbonylContact C-O 3.47Å; Y662-I689 WeakPolarHBondContact CA-O 3.46Å; S663-I689 PolarHBondContact N-O 2.75Å; I689-L691 HydrophobicContact CG2-CD2 3.62Å; I689-L691 HydrophobicContact CG2-CG 4.07Å
690	F	92.8	Very high	82.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.8	166.2	-162.2	-145.6	0	0	0	110.8	V638 L639 I640 S663 L665 N677 I678 F681 L692 L703	V638-F690 PolarHBondContact O-N 3.03Å; L639-F690 HydrophobicContact CD2-CB 3.65Å; L639-F690 HydrophobicContact CD2-CD1 3.89Å; L639-F690 HydrophobicContact CD2-CG 4.28Å; I640-F690 PolarHBondContact N-O 2.91Å; S663-F690 WeakPolarHBondContact O-CA 3.33Å; S663-F690 VanDerWaalsContact O-CD2 3.27Å; S663-F690 WeakPolarHBondContact O-CD2 3.47Å; L665-F690 HydrophobicContact CB-CE1 4.46Å; L665-F690 HydrophobicContact CB-CE2 4.1Å; L665-F690 HydrophobicContact CB-CZ 3.73Å; L665-F690 HydrophobicContact CD1-CE1 4.36Å; L665-F690 HydrophobicContact CD1-CZ 3.88Å; L665-F690 HydrophobicContact CG-CZ 4.49Å; N677-F690 HydrophobicContact CB-CE2 4.42Å; I678-F690 HydrophobicContact CG1-CZ 4.29Å; F681-F690 HydrophobicContact CD1-CD1 4.46Å; F681-F690 HydrophobicContact CD2-CB 3.85Å; F681-F690 HydrophobicContact CD2-CG 4.22Å; F681-F690 HydrophobicContact CE2-CB 3.76Å; F681-F690 HydrophobicContact CG-CB 4.36Å; F681-F690 HydrophobicContact CG-CD1 4.45Å; F681-F690 HydrophobicContact CG-CG 4.29Å; F681-F690 HydrophobicContact CZ-CB 4.2Å; F690-L692 HydrophobicContact CD1-CD1 3.6Å; F690-L692 HydrophobicContact CD1-CD2 4.17Å; F690-L692 HydrophobicContact CD1-CG 3.94Å; F690-L692 HydrophobicContact CE1-CD1 4.05Å; F690-L692 HydrophobicContact CE1-CD2 3.79Å; F690-L692 HydrophobicContact CE1-CG 4.07Å; F690-L692 HydrophobicContact CG-CD1 4.28Å; F690-L692 HydrophobicContact CG-CG 4.41Å; F690-L692 HydrophobicContact CZ-CD2 4.3Å; F690-L703 HydrophobicContact CD1-CD1 3.99Å; F690-L703 HydrophobicContact CD1-CD2 3.92Å; F690-L703 HydrophobicContact CE1-CD1 3.94Å; F690-L703 HydrophobicContact CE1-CD2 3.58Å; F690-L703 HydrophobicContact CE1-CG 4.43Å
691	L	92.7	Very high	81.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	119.1	-179.2	-60.6	-178.7	0	0	0	109.6	I640 L648 L651 M652 Y662 S663 R664 L665 I689	I640-L691 HydrophobicContact CB-CD2 3.98Å; I640-L691 HydrophobicContact CD1-CD2 4.04Å; I640-L691 HydrophobicContact CG1-CD2 4.4Å; L648-L691 HydrophobicContact CD2-CB 4.33Å; L651-L691 HydrophobicContact CB-CD1 4.11Å; L651-L691 HydrophobicContact CB-CD2 4.08Å; L651-L691 HydrophobicContact CD1-CD2 4.21Å; M652-L691 HydrophobicContact CG-CD1 3.9Å; Y662-L691 HydrophobicContact CD2-CD1 3.86Å; Y662-L691 HydrophobicContact CD2-CG 4.42Å; Y662-L691 HydrophobicContact CE2-CD1 4.35Å; Y662-L691 HydrophobicContact CG-CD1 4.39Å; S663-L691 PolarHBondContact O-N 3.13Å; R664-L691 CarbonylContact C-O 3.54Å; R664-L691 WeakPolarHBondContact CA-O 3.28Å; L665-L691 PolarHBondContact N-O 2.85Å; I689-L691 HydrophobicContact CG2-CD2 3.62Å; I689-L691 HydrophobicContact CG2-CG 4.07Å
692	L	91.4	Very high	81.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.9	-173.8	-74.5	149.6	0	0	0	110.4	L639 I640 F641 S642 L665 F690 L703	L639-L692 HydrophobicContact CB-CD1 4.26Å; L639-L692 HydrophobicContact CD2-CD1 4.06Å; I640-L692 PolarHBondContact O-N 3.27Å; F641-L692 VanDerWaalsContact CA-O 3.29Å; F641-L692 WeakPolarHBondContact CA-O 3.47Å; F641-L692 HydrophobicContact CD1-CB 3.53Å; F641-L692 HydrophobicContact CD1-CD1 4.32Å; F641-L692 HydrophobicContact CE1-CB 3.55Å; F641-L692 HydrophobicContact CE1-CD1 3.61Å; F641-L692 HydrophobicContact CE1-CG 4.11Å; F641-L692 HydrophobicContact CG-CB 4.42Å; F641-L692 HydrophobicContact CZ-CB 4.45Å; F641-L692 HydrophobicContact CZ-CD1 3.72Å; S642-L692 PolarHBondContact N-O 2.78Å; L665-L692 HydrophobicContact CB-CD2 3.65Å; L665-L692 HydrophobicContact CD1-CD2 4.08Å; L665-L692 HydrophobicContact CD2-CD2 4.09Å; L665-L692 HydrophobicContact CG-CD2 4.15Å; F690-L692 HydrophobicContact CD1-CD1 3.6Å; F690-L692 HydrophobicContact CD1-CD2 4.17Å; F690-L692 HydrophobicContact CD1-CG 3.94Å; F690-L692 HydrophobicContact CE1-CD1 4.05Å; F690-L692 HydrophobicContact CE1-CD2 3.79Å; F690-L692 HydrophobicContact CE1-CG 4.07Å; F690-L692 HydrophobicContact CG-CD1 4.28Å; F690-L692 HydrophobicContact CG-CG 4.41Å; F690-L692 HydrophobicContact CZ-CD2 4.3Å; L692-L703 HydrophobicContact CD1-CD1 3.6Å; L692-L703 HydrophobicContact CD2-CD1 4.29Å
693	S	90.4	Very high	81.2	Confident	7 Å²	7	37.1 Å²	37.1	5%	0.049	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	136	163.4	175.9	0	0	0	0	109.7	S642 L665 R695 A696 G697	S642-S693 CarbonylContact O-C 3.08Å; S642-S693 WeakPolarHBondContact O-CA 3.04Å; L665-S693 PolarHBondContact O-N 2.86Å; L665-S693 VanDerWaalsContact O-N 3.13Å; S693-R695 PolarHBondContact O-N 3.26Å; S693-R695 VanDerWaalsContact O-N 3.11Å; S693-A696 PolarHBondContact O-N 3.32Å; S693-G697 PolarHBondContact O-N 3.33Å
694	T	84.1	Confident	81.1	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-53.6	-36.7	178.8	-48.1	0	0	0	0	111.8	S642 Q643 G698 A720	S642-T694 PolarHBondContact O-N 3.01Å; S642-T694 PolarHBondContact O-OG1 2.89Å; Q643-T694 PolarHBondContact N-OG1 3.32Å; T694-G698 PolarHBondContact O-N 3.18Å; T694-A720 HydrophobicContact CG2-CB 4.24Å
695	R	78	Confident	81.1	Confident	185 Å²	185	31.2 Å²	31.2	70%	0.698	17%	0.166	S	C	*	.	H	α-helix	trans	-72.7	-41.3	176.9	-67.2	-173.2	-179.8	-176.8	1.2	113.2	S693 L699	S693-R695 PolarHBondContact O-N 3.26Å; S693-R695 VanDerWaalsContact O-N 3.11Å; R695-L699 WeakPolarHBondContact O-CD1 3.2Å; R695-L699 WeakPolarHBondContact O-CG 3.48Å
696	A	73.9	Confident	81.5	Confident	4 Å²	4	25.8 Å²	25.8	3%	0.033	13%	0.13	C	C	.	.	H	α-helix	trans	-75.4	-31.9	179.8	0	0	0	0	0	111.9	L665 S693 I701	L665-A696 HydrophobicContact CD2-CB 3.6Å; S693-A696 PolarHBondContact O-N 3.32Å; A696-I701 WeakPolarHBondContact O-CD1 3.49Å
697	G	65.5	Low	81.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-80.5	-27.9	177.7	0	0	0	0	0	114.2	S693 L699 R727	S693-G697 PolarHBondContact O-N 3.33Å; G697-L699 PolarHBondContact O-N 3.2Å; G697-L699 VanDerWaalsContact O-N 3.16Å; G697-R727 VanDerWaalsContact O-CD 3.26Å; G697-R727 WeakPolarHBondContact O-CD 3.45Å; G697-R727 VanDerWaalsContact O-CG 3.26Å; G697-R727 WeakPolarHBondContact O-CG 3.42Å
698	G	64.1	Low	81.9	Confident	5 Å²	5	20.2 Å²	20.2	5%	0.052	10%	0.104	C	C	.	.	S	Bend	trans	-65.8	-12.8	173.5	0	0	0	0	0	113.9	T694 G700 Q723	T694-G698 PolarHBondContact O-N 3.18Å; G698-G700 PolarHBondContact O-N 2.92Å; G698-Q723 PolarHBondContact O-OE1 3.47Å
699	L	64	Low	82	Confident	59 Å²	59	19.7 Å²	19.7	31%	0.309	10%	0.102	S	C	.	.	S	Bend	trans	-92.7	67.5	-170.4	-81.5	178.5	0	0	0	113.2	P296 S298 R695 G697 I701	P296-L699 HydrophobicContact CB-CD2 4.01Å; P296-L699 HydrophobicContact CG-CD2 4.45Å; S298-L699 VanDerWaalsContact OG-CB 3.28Å; S298-L699 WeakPolarHBondContact OG-CB 3.43Å; R695-L699 WeakPolarHBondContact O-CD1 3.2Å; R695-L699 WeakPolarHBondContact O-CG 3.48Å; G697-L699 PolarHBondContact O-N 3.2Å; G697-L699 VanDerWaalsContact O-N 3.16Å; L699-I701 VanDerWaalsContact C-N 3.27Å; L699-I701 PolarHBondContact O-N 3.01Å
700	G	62.3	Low	82.1	Confident	12 Å²	12	19.8 Å²	19.8	12%	0.124	10%	0.102	C	C	.	.	S	Bend	trans	69.8	2.7	158.1	0	0	0	0	0	118.7	G698 R727	G698-G700 PolarHBondContact O-N 2.92Å; G700-R727 VanDerWaalsContact C-NH1 3.3Å
701	I	76.4	Confident	82.1	Confident	14 Å²	14	19.8 Å²	19.8	7%	0.072	10%	0.103	C	C	.	.			trans	-69.2	155.4	-180	-56.3	154.4	0	0	0	110.4	L665 I678 A696 L699 L703 R727	L665-I701 HydrophobicContact CD1-CD1 3.58Å; L665-I701 HydrophobicContact CD2-CD1 4.03Å; L665-I701 HydrophobicContact CG-CD1 4.49Å; I678-I701 HydrophobicContact CD1-CG2 3.74Å; I678-I701 HydrophobicContact CG1-CG2 4.28Å; A696-I701 WeakPolarHBondContact O-CD1 3.49Å; L699-I701 VanDerWaalsContact C-N 3.27Å; L699-I701 PolarHBondContact O-N 3.01Å; I701-L703 HydrophobicContact CG2-CD1 4.41Å; I701-L703 HydrophobicContact CG2-CD2 3.96Å; I701-L703 HydrophobicContact CG2-CG 3.91Å; I701-R727 VanDerWaalsContact O-CD 3.24Å; I701-R727 WeakPolarHBondContact O-CD 3.47Å; I701-R727 PolarHBondContact O-NH1 3.03Å
702	N	78.8	Confident	82.1	Confident	65 Å²	65	19.8 Å²	19.8	35%	0.348	10%	0.103	S	C	.	.			trans	-107.8	119.4	173.1	-170.1	20.6	0	0	0	110.1	F682 T704	F682-N702 VanDerWaalsContact CE2-O 3.25Å; F682-N702 WeakPolarHBondContact CE2-O 3.37Å; F682-N702 VanDerWaalsContact CZ-O 3.27Å; F682-N702 WeakPolarHBondContact CZ-O 3.35Å; N702-T704 WeakPolarHBondContact OD1-CG2 3.33Å
703	L	82.8	Confident	82.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.			trans	-132.6	44.3	-175.5	-62.5	173	0	0	0	111.8	L639 F681 F682 F690 L692 I701 A705 A706 R727	L639-L703 HydrophobicContact CD1-CB 3.99Å; L639-L703 HydrophobicContact CD1-CD1 4.03Å; L639-L703 HydrophobicContact CD2-CD1 4.3Å; F681-L703 HydrophobicContact CD1-CD2 4.49Å; F682-L703 HydrophobicContact CE2-CD2 4.38Å; F690-L703 HydrophobicContact CD1-CD1 3.99Å; F690-L703 HydrophobicContact CD1-CD2 3.92Å; F690-L703 HydrophobicContact CE1-CD1 3.94Å; F690-L703 HydrophobicContact CE1-CD2 3.58Å; F690-L703 HydrophobicContact CE1-CG 4.43Å; L692-L703 HydrophobicContact CD1-CD1 3.6Å; L692-L703 HydrophobicContact CD2-CD1 4.29Å; I701-L703 HydrophobicContact CG2-CD1 4.41Å; I701-L703 HydrophobicContact CG2-CD2 3.96Å; I701-L703 HydrophobicContact CG2-CG 3.91Å; L703-A705 PolarHBondContact O-N 2.89Å; L703-A706 PolarHBondContact O-N 2.87Å; L703-R727 HydrophobicContact CB-CB 4.5Å; L703-R727 HydrophobicContact CD1-CB 4.47Å; L703-R727 PolarHBondContact N-O 3.47Å; L703-R727 VanDerWaalsContact N-O 3.11Å
704	T	85.1	Confident	81.9	Confident	22 Å²	22	20 Å²	20	14%	0.135	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.9	180	51.5	0	0	0	0	114.3	N702 A706 R730 Q733	N702-T704 WeakPolarHBondContact OD1-CG2 3.33Å; T704-A706 VanDerWaalsContact C-N 3.27Å; T704-A706 PolarHBondContact O-N 3.43Å; T704-R730 HydrophobicContact CG2-CB 4.34Å; T704-Q733 PolarHBondContact O-NE2 3.3Å; T704-Q733 PolarHBondContact O-OE1 2.93Å
705	A	86.2	Confident	82	Confident	36 Å²	36	20.9 Å²	20.9	30%	0.298	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.5	176.1	0	0	0	0	0	113.5	F681 F682 L703	F681-A705 HydrophobicContact CD1-CB 4.42Å; F681-A705 HydrophobicContact CE1-CB 4.06Å; F682-A705 HydrophobicContact CD1-CB 3.62Å; F682-A705 HydrophobicContact CE1-CB 3.62Å; F682-A705 HydrophobicContact CG-CB 4.31Å; F682-A705 HydrophobicContact CZ-CB 4.31Å; L703-A705 PolarHBondContact O-N 2.89Å
706	A	88.6	Confident	82.2	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.089	C	C	.	.			trans	-85.2	157.6	174.6	0	0	0	0	0	111	K637 L639 F681 L703 T704 C728 Q733	K637-A706 HydrophobicContact CB-CB 4.46Å; L639-A706 HydrophobicContact CD1-CB 3.8Å; L639-A706 HydrophobicContact CD2-CB 3.64Å; L639-A706 HydrophobicContact CG-CB 3.42Å; L639-A706 VanDerWaalsContact CG-CB 3.42Å; F681-A706 HydrophobicContact CE1-CB 4.12Å; F681-A706 HydrophobicContact CZ-CB 3.93Å; L703-A706 PolarHBondContact O-N 2.87Å; T704-A706 VanDerWaalsContact C-N 3.27Å; T704-A706 PolarHBondContact O-N 3.43Å; A706-C728 PolarHBondContact O-SG 2.77Å; A706-Q733 PolarHBondContact O-NE2 2.99Å
707	D	89.4	Confident	82.5	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.011	10%	0.102	C	C	.	.			trans	-126.9	-19.1	175.3	63.8	-11.1	0	0	0	112.7	H636 K637 K735 V737 V738 R823	H636-D707 WeakPolarHBondContact CB-OD1 3.26Å; H636-D707 IonicContact CE1-OD2 3.63Å; H636-D707 IonicContact CG-OD1 3.67Å; H636-D707 IonicContact CG-OD2 3.02Å; H636-D707 IonicContact ND1-OD1 3.89Å; H636-D707 IonicContact ND1-OD2 3.71Å; H636-D707 PolarHBondContact ND1-OD2 2.82Å; K637-D707 PolarHBondContact N-OD1 3.43Å; K637-D707 PolarHBondContact O-N 2.86Å; D707-K735 HydrophobicContact CB-CB 3.91Å; D707-K735 HydrophobicContact CB-CD 4.11Å; D707-V737 VanDerWaalsContact O-CA 3.27Å; D707-V737 WeakPolarHBondContact O-CA 3.03Å; D707-V738 PolarHBondContact O-N 2.66Å; D707-V738 VanDerWaalsContact O-N 3.13Å; D707-R823 IonicContact OD1-NH2 3.57Å; D707-R823 IonicContact OD2-CZ 3.86Å; D707-R823 IonicContact OD2-NH1 3.04Å; D707-R823 PolarHBondContact OD2-NH1 2.99Å; D707-R823 IonicContact OD2-NH2 2.82Å; D707-R823 PolarHBondContact OD2-NH2 3.31Å
708	T	90.9	Very high	83.3	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.7	179	-47	0	0	0	0	110.5	L631 K637 V638 L639 V738 Y740 R823	L631-T708 HydrophobicContact CD1-CG2 3.84Å; K637-T708 PolarHBondContact O-N 3.29Å; K637-T708 VanDerWaalsContact O-N 3.15Å; V638-T708 WeakPolarHBondContact CA-O 3.49Å; V638-T708 HydrophobicContact CG1-CG2 4.46Å; V638-T708 HydrophobicContact CG2-CG2 4.48Å; L639-T708 PolarHBondContact N-O 3.32Å; T708-V738 WeakPolarHBondContact CA-O 3.49Å; T708-Y740 HydrophobicContact CG2-CD2 3.68Å; T708-Y740 HydrophobicContact CG2-CE2 3.55Å; T708-R823 PolarHBondContact OG1-NH2 3.36Å
709	V	92.5	Very high	83.9	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.9	175.4	178.6	0	0	0	0	109	L639 F641 I711 C728 V737 V738 V739 Y740	L639-V709 HydrophobicContact CB-CG2 4.44Å; L639-V709 HydrophobicContact CD1-CG2 4.32Å; L639-V709 CarbonylContact O-C 3.37Å; L639-V709 WeakPolarHBondContact O-CA 3.48Å; F641-V709 HydrophobicContact CD2-CG1 3.58Å; F641-V709 HydrophobicContact CE2-CG1 3.58Å; V709-I711 HydrophobicContact CG1-CG1 4.42Å; V709-C728 HydrophobicContact CG2-CB 4.01Å; V709-V737 HydrophobicContact CG2-CG1 4.36Å; V709-V738 PolarHBondContact N-O 2.9Å; V709-V739 HydrophobicContact CB-CG1 4.31Å; V709-V739 HydrophobicContact CB-CG2 4.23Å; V709-V739 HydrophobicContact CG1-CG1 4.26Å; V709-V739 CarbonylContact O-C 3.59Å; V709-V739 VanDerWaalsContact O-CA 3.29Å; V709-V739 WeakPolarHBondContact O-CA 3.27Å; V709-Y740 PolarHBondContact O-N 2.99Å
710	I	93.5	Very high	84.8	Confident	2 Å²	2	17.5 Å²	17.5	1%	0.01	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.1	173.2	-56.7	177.8	0	0	0	108	L627 L628 V638 L639 I640 F641 Y740 L742	L627-I710 HydrophobicContact CD2-CD1 3.59Å; L627-I710 HydrophobicContact CD2-CG1 4.45Å; L628-I710 HydrophobicContact CD2-CD1 4.03Å; V638-I710 HydrophobicContact CG1-CD1 3.59Å; V638-I710 HydrophobicContact CG1-CG1 3.83Å; L639-I710 PolarHBondContact O-N 3.41Å; I640-I710 WeakPolarHBondContact CA-O 3.49Å; I640-I710 HydrophobicContact CG1-CB 4.33Å; I640-I710 HydrophobicContact CG1-CD1 4.43Å; F641-I710 PolarHBondContact N-O 2.74Å; I710-Y740 CarbonylContact C-O 3.47Å; I710-Y740 WeakPolarHBondContact CA-O 3.27Å; I710-Y740 HydrophobicContact CG1-CD2 4.31Å; I710-L742 HydrophobicContact CG2-CD1 4.1Å; I710-L742 HydrophobicContact CG2-CG 4.17Å
711	I	92.9	Very high	85.8	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.1	170.4	-59.8	175	0	0	0	106.8	V709 D713 D721 Q725 V739 Y740 L742	V709-I711 HydrophobicContact CG1-CG1 4.42Å; I711-D713 WeakPolarHBondContact CG2-O 3.2Å; I711-D721 HydrophobicContact CD1-CB 4.14Å; I711-Q725 HydrophobicContact CD1-CG 4.28Å; I711-V739 HydrophobicContact CD1-CG1 4.03Å; I711-V739 HydrophobicContact CG1-CG1 4.36Å; I711-Y740 PolarHBondContact N-O 3.38Å; I711-L742 PolarHBondContact O-N 3.09Å
712	F	92.9	Very high	86.1	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	-75.3	-39.9	-176	-169.6	-88.2	0	0	0	112.3	N592 K620 F621 L624 I640 F641 I647 L742	N592-F712 HydrophobicContact CB-CE1 3.97Å; K620-F712 HydrophobicContact CB-CE2 3.85Å; K620-F712 HydrophobicContact CB-CZ 3.73Å; K620-F712 HydrophobicContact CD-CD1 4.37Å; K620-F712 HydrophobicContact CD-CE1 3.84Å; K620-F712 HydrophobicContact CD-CE2 4.36Å; K620-F712 HydrophobicContact CD-CZ 3.84Å; K620-F712 HydrophobicContact CG-CZ 4.44Å; K620-F712 PolarHBondContact NZ-O 3.2Å; K620-F712 VanDerWaalsContact NZ-O 3.09Å; F621-F712 HydrophobicContact CD2-CE2 4.2Å; F621-F712 AromaticContact CD2-CZ 3.94Å; F621-F712 HydrophobicContact CD2-CZ 3.94Å; F621-F712 AromaticContact CE2-CE2 3.96Å; F621-F712 HydrophobicContact CE2-CE2 3.96Å; F621-F712 AromaticContact CE2-CZ 3.56Å; F621-F712 HydrophobicContact CE2-CZ 3.56Å; F621-F712 HydrophobicContact CZ-CZ 4.41Å; L624-F712 HydrophobicContact CD1-CD2 4.27Å; L624-F712 HydrophobicContact CD1-CE2 4.35Å; I640-F712 HydrophobicContact CG2-CB 4.43Å; F641-F712 WeakPolarHBondContact O-CB 3.18Å; F641-F712 PolarHBondContact O-N 3.24Å; I647-F712 HydrophobicContact CD1-CE1 3.98Å; I647-F712 HydrophobicContact CD1-CZ 4.21Å; I647-F712 HydrophobicContact CG1-CD1 3.98Å; I647-F712 HydrophobicContact CG1-CE1 3.59Å; I647-F712 HydrophobicContact CG1-CZ 4.1Å; F712-L742 HydrophobicContact CD2-CD1 3.93Å; F712-L742 HydrophobicContact CE2-CD1 4.31Å
713	D	90.6	Very high	86.2	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.011	10%	0.097	C	C	.	.	S	Bend	trans	-137.2	138.9	173.6	58.3	-19.6	0	0	0	110.8	N592 S642 Q643 I711	N592-D713 PolarHBondContact ND2-OD2 2.83Å; S642-D713 WeakPolarHBondContact CA-OD1 3.47Å; S642-D713 VanDerWaalsContact CB-OD1 3.31Å; S642-D713 WeakPolarHBondContact CB-OD1 3.42Å; S642-D713 VanDerWaalsContact OG-CG 3.24Å; S642-D713 PolarHBondContact OG-OD1 2.74Å; S642-D713 PolarHBondContact OG-OD2 3.47Å; Q643-D713 VanDerWaalsContact CB-OD2 3.29Å; Q643-D713 WeakPolarHBondContact CB-OD2 3.33Å; Q643-D713 PolarHBondContact N-OD1 3.28Å; Q643-D713 PolarHBondContact N-OD2 2.75Å; I711-D713 WeakPolarHBondContact CG2-O 3.2Å
714	S	87.5	Confident	86.3	Confident	9 Å²	9	17.6 Å²	17.6	6%	0.063	10%	0.097	C	C	.	.			trans	-88.6	138.9	-176.4	-59.1	0	0	0	0	111.2	K588 R741	K588-S714 PolarHBondContact NZ-O 2.97Å; S714-R741 PolarHBondContact OG-NH1 3.38Å
715	D	85.8	Confident	86.3	Confident	20 Å²	20	16.8 Å²	16.8	11%	0.107	9%	0.092	C	C	.	.			trans	-78.3	155.7	173.5	-152.8	-55.1	0	0	0	110.9	Q643 N717 A720	Q643-D715 VanDerWaalsContact NE2-CG 3.3Å; Q643-D715 PolarHBondContact NE2-OD2 2.84Å; D715-N717 PolarHBondContact O-N 2.81Å; D715-N717 PolarHBondContact OD1-N 3.48Å; D715-A720 HydrophobicContact CB-CB 4.24Å
716	W	82.3	Confident	86.1	Confident	79 Å²	79	15.2 Å²	15.2	30%	0.299	8%	0.079	S	C	.	.	S	Bend	trans	-67.3	-23.4	172.1	-67.3	94.4	0	0	0	112.8	I752 K759 I786	W716-I752 HydrophobicContact CD2-CG1 4.24Å; W716-I752 HydrophobicContact CD2-CG2 4.46Å; W716-I752 HydrophobicContact CE3-CG1 4.09Å; W716-I752 HydrophobicContact CH2-CD1 4.1Å; W716-I752 HydrophobicContact CH2-CG1 3.62Å; W716-I752 HydrophobicContact CZ2-CD1 3.78Å; W716-I752 HydrophobicContact CZ2-CG1 3.8Å; W716-I752 HydrophobicContact CZ3-CG1 3.79Å; W716-K759 PolarHBondContact O-NZ 3.45Å; W716-I786 HydrophobicContact CH2-CD1 3.41Å; W716-I786 VanDerWaalsContact CH2-CD1 3.41Å; W716-I786 HydrophobicContact CZ3-CD1 3.78Å
717	N	81.1	Confident	85.8	Confident	57 Å²	57	15.6 Å²	15.6	31%	0.305	8%	0.08	S	C	.	.	S	Bend	trans	-100.2	108.3	173.7	-176.6	11	0	0	0	110.1	D715 Q719 A720	D715-N717 PolarHBondContact O-N 2.81Å; D715-N717 PolarHBondContact OD1-N 3.48Å; N717-Q719 PolarHBondContact O-N 3.23Å; N717-Q719 WeakPolarHBondContact OD1-CB 3.05Å; N717-Q719 WeakPolarHBondContact OD1-CG 3.24Å; N717-Q719 PolarHBondContact OD1-N 2.98Å; N717-A720 PolarHBondContact O-N 3.39Å; N717-A720 VanDerWaalsContact O-N 3.11Å
718	P	80.5	Confident	85.5	Confident	19 Å²	19	15.5 Å²	15.5	12%	0.123	8%	0.079	C	C	.	.	H	α-helix	trans	-56.5	-28	178.9	-19.2	27.4	0	0	0	113.5	A720 D721 L722 A756 K759	P718-A720 VanDerWaalsContact C-N 3.31Å; P718-A720 PolarHBondContact O-N 3.38Å; P718-D721 PolarHBondContact O-N 3.48Å; P718-L722 PolarHBondContact O-N 3.34Å; P718-A756 HydrophobicContact CG-CB 3.84Å; P718-A756 WeakPolarHBondContact CG-O 3.48Å; P718-K759 HydrophobicContact CG-CB 4.16Å
719	Q	78.1	Confident	85.2	Confident	8 Å²	8	16.4 Å²	16.4	4%	0.037	8%	0.084	C	C	.	.	H	α-helix	trans	-63.8	-37.1	-178.6	-60.8	-175.4	-9.9	0	0	111.6	T401 N717 D721 L722 Q723 E763	T401-Q719 HydrophobicContact CG2-CB 4.17Å; T401-Q719 HydrophobicContact CG2-CG 4.36Å; N717-Q719 PolarHBondContact O-N 3.23Å; N717-Q719 WeakPolarHBondContact OD1-CB 3.05Å; N717-Q719 WeakPolarHBondContact OD1-CG 3.24Å; N717-Q719 PolarHBondContact OD1-N 2.98Å; Q719-D721 VanDerWaalsContact C-N 3.3Å; Q719-D721 PolarHBondContact O-N 2.85Å; Q719-L722 PolarHBondContact O-N 3.24Å; Q719-Q723 WeakPolarHBondContact O-CB 3.45Å; Q719-Q723 WeakPolarHBondContact O-CG 3.4Å; Q719-Q723 PolarHBondContact O-N 3Å; Q719-E763 PolarHBondContact NE2-OE1 3.44Å
720	A	81.7	Confident	84.7	Confident	19 Å²	19	18.6 Å²	18.6	16%	0.157	9%	0.092	C	C	.	.	H	α-helix	trans	-61.3	-41.7	179.4	0	0	0	0	0	111.4	T694 D715 N717 P718 Q723 A724	T694-A720 HydrophobicContact CG2-CB 4.24Å; D715-A720 HydrophobicContact CB-CB 4.24Å; N717-A720 PolarHBondContact O-N 3.39Å; N717-A720 VanDerWaalsContact O-N 3.11Å; P718-A720 VanDerWaalsContact C-N 3.31Å; P718-A720 PolarHBondContact O-N 3.38Å; A720-Q723 PolarHBondContact O-N 2.92Å; A720-A724 PolarHBondContact O-N 3.24Å
721	D	85.1	Confident	83.8	Confident	5 Å²	5	21 Å²	21	3%	0.027	10%	0.104	C	C	.	.	H	α-helix	trans	-68.5	-40.9	177.3	-66.4	-3.8	0	0	0	111.4	I711 P718 Q719 Q723 A724 Q725 R741	I711-D721 HydrophobicContact CD1-CB 4.14Å; P718-D721 PolarHBondContact O-N 3.48Å; Q719-D721 VanDerWaalsContact C-N 3.3Å; Q719-D721 PolarHBondContact O-N 2.85Å; D721-Q723 VanDerWaalsContact C-N 3.34Å; D721-Q723 PolarHBondContact O-N 2.92Å; D721-A724 WeakPolarHBondContact O-CB 3.42Å; D721-A724 PolarHBondContact O-N 3.38Å; D721-Q725 WeakPolarHBondContact O-CG 3.46Å; D721-Q725 PolarHBondContact O-N 3.41Å; D721-R741 IonicContact OD2-CZ 2.77Å; D721-R741 IonicContact OD2-NH1 2.69Å; D721-R741 PolarHBondContact OD2-NH1 3.44Å; D721-R741 IonicContact OD2-NH2 3.54Å
722	L	80.7	Confident	83.1	Confident	67 Å²	67	23.5 Å²	23.5	35%	0.351	13%	0.13	S	C	.	.	H	α-helix	trans	-63	-42.3	175.7	-173.4	66.1	0	0	0	111.4	P718 Q719 A724 Q725 D726	P718-L722 PolarHBondContact O-N 3.34Å; Q719-L722 PolarHBondContact O-N 3.24Å; L722-A724 VanDerWaalsContact C-N 3.28Å; L722-A724 PolarHBondContact O-N 2.94Å; L722-Q725 PolarHBondContact O-N 2.85Å; L722-D726 WeakPolarHBondContact O-CB 3.36Å; L722-D726 VanDerWaalsContact O-CG 3.29Å; L722-D726 PolarHBondContact O-N 3.1Å
723	Q	82.4	Confident	82.6	Confident	22 Å²	22	24 Å²	24	10%	0.103	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-39.6	175.3	-70	-174	-2.5	0	0	111.7	M267 G698 Q719 A720 D721 R727	M267-Q723 HydrophobicContact CE-CB 4.21Å; M267-Q723 HydrophobicContact CE-CG 3.65Å; M267-Q723 HydrophobicContact SD-CB 4Å; M267-Q723 HydrophobicContact SD-CG 3.57Å; M267-Q723 VanDerWaalsContact SD-CG 3.57Å; G698-Q723 PolarHBondContact O-OE1 3.47Å; Q719-Q723 WeakPolarHBondContact O-CB 3.45Å; Q719-Q723 WeakPolarHBondContact O-CG 3.4Å; Q719-Q723 PolarHBondContact O-N 3Å; A720-Q723 PolarHBondContact O-N 2.92Å; D721-Q723 VanDerWaalsContact C-N 3.34Å; D721-Q723 PolarHBondContact O-N 2.92Å; Q723-R727 WeakPolarHBondContact O-CG 3.46Å; Q723-R727 PolarHBondContact O-N 2.93Å; Q723-R727 PolarHBondContact O-NE 3.02Å
724	A	84.3	Confident	82.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-44.4	176.2	0	0	0	0	0	111.8	F641 A720 D721 L722 R727	F641-A724 HydrophobicContact CD1-CB 3.89Å; F641-A724 HydrophobicContact CD2-CB 4.13Å; F641-A724 HydrophobicContact CE1-CB 3.8Å; F641-A724 HydrophobicContact CE2-CB 4.05Å; F641-A724 HydrophobicContact CG-CB 4.04Å; F641-A724 HydrophobicContact CZ-CB 3.88Å; A720-A724 PolarHBondContact O-N 3.24Å; D721-A724 WeakPolarHBondContact O-CB 3.42Å; D721-A724 PolarHBondContact O-N 3.38Å; L722-A724 VanDerWaalsContact C-N 3.28Å; L722-A724 PolarHBondContact O-N 2.94Å; A724-R727 VanDerWaalsContact O-CB 3.28Å; A724-R727 WeakPolarHBondContact O-CB 3.1Å; A724-R727 VanDerWaalsContact O-CG 3.31Å; A724-R727 WeakPolarHBondContact O-CG 3.34Å; A724-R727 PolarHBondContact O-N 3.08Å
725	Q	86.3	Confident	82.1	Confident	4 Å²	4	34 Å²	34	2%	0.019	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-43.5	175.3	-66.8	173.1	18.3	0	0	112.1	I711 D721 L722 R727 C728 H729 V739	I711-Q725 HydrophobicContact CD1-CG 4.28Å; D721-Q725 WeakPolarHBondContact O-CG 3.46Å; D721-Q725 PolarHBondContact O-N 3.41Å; L722-Q725 PolarHBondContact O-N 2.85Å; Q725-R727 PolarHBondContact O-N 3.28Å; Q725-R727 VanDerWaalsContact O-N 3.09Å; Q725-C728 PolarHBondContact O-N 3.07Å; Q725-C728 VanDerWaalsContact O-N 3.1Å; Q725-H729 PolarHBondContact O-N 3.02Å; Q725-V739 HydrophobicContact CG-CG1 3.95Å; Q725-V739 HydrophobicContact CG-CG2 4.02Å
726	D	81.8	Confident	82.1	Confident	4 Å²	4	34 Å²	34	2%	0.021	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.7	-179.9	-74.3	-19.2	0	0	0	113.5	M267 K469 K479 L722 C728	M267-D726 HydrophobicContact CB-CB 4.28Å; M267-D726 HydrophobicContact SD-CB 4.42Å; K469-D726 IonicContact NZ-OD1 3.51Å; K469-D726 PolarHBondContact NZ-OD1 3.4Å; K469-D726 IonicContact NZ-OD2 3.36Å; K479-D726 IonicContact NZ-OD1 3.98Å; L722-D726 WeakPolarHBondContact O-CB 3.36Å; L722-D726 VanDerWaalsContact O-CG 3.29Å; L722-D726 PolarHBondContact O-N 3.1Å; D726-C728 VanDerWaalsContact C-N 3.32Å
727	R	81.8	Confident	82.4	Confident	7 Å²	7	30.3 Å²	30.3	3%	0.026	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-34.1	169.8	-59.6	-54.3	101.2	-168.1	10.5	112.5	M267 G697 G700 I701 L703 Q723 A724 Q725	M267-R727 PolarHBondContact SD-NH2 3.13Å; G697-R727 VanDerWaalsContact O-CD 3.26Å; G697-R727 WeakPolarHBondContact O-CD 3.45Å; G697-R727 VanDerWaalsContact O-CG 3.26Å; G697-R727 WeakPolarHBondContact O-CG 3.42Å; G700-R727 VanDerWaalsContact C-NH1 3.3Å; I701-R727 VanDerWaalsContact O-CD 3.24Å; I701-R727 WeakPolarHBondContact O-CD 3.47Å; I701-R727 PolarHBondContact O-NH1 3.03Å; L703-R727 HydrophobicContact CB-CB 4.5Å; L703-R727 HydrophobicContact CD1-CB 4.47Å; L703-R727 PolarHBondContact N-O 3.47Å; L703-R727 VanDerWaalsContact N-O 3.11Å; Q723-R727 WeakPolarHBondContact O-CG 3.46Å; Q723-R727 PolarHBondContact O-N 2.93Å; Q723-R727 PolarHBondContact O-NE 3.02Å; A724-R727 VanDerWaalsContact O-CB 3.28Å; A724-R727 WeakPolarHBondContact O-CB 3.1Å; A724-R727 VanDerWaalsContact O-CG 3.31Å; A724-R727 WeakPolarHBondContact O-CG 3.34Å; A724-R727 PolarHBondContact O-N 3.08Å; Q725-R727 PolarHBondContact O-N 3.28Å; Q725-R727 VanDerWaalsContact O-N 3.09Å
728	C	83.8	Confident	82.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-42	179.1	172.4	0	0	0	0	110.8	L639 A706 V709 Q725 D726 R730 Q733	L639-C728 HydrophobicContact CD1-CB 4Å; A706-C728 PolarHBondContact O-SG 2.77Å; V709-C728 HydrophobicContact CG2-CB 4.01Å; Q725-C728 PolarHBondContact O-N 3.07Å; Q725-C728 VanDerWaalsContact O-N 3.1Å; D726-C728 VanDerWaalsContact C-N 3.32Å; C728-R730 PolarHBondContact O-N 3.42Å; C728-Q733 PolarHBondContact O-NE2 3.37Å; C728-Q733 PolarHBondContact SG-NE2 3.35Å; C728-Q733 VanDerWaalsContact SG-NE2 3.36Å
729	H	84	Confident	83.3	Confident	20 Å²	20	26.9 Å²	26.9	9%	0.093	15%	0.153	C	C	.	.	S	Bend	trans	-80.7	70	174.8	-168.8	-102.7	0	0	0	111.5	K469 V476 P477 K479 Q725	K469-H729 PolarHBondContact NZ-O 3.36Å; V476-H729 VanDerWaalsContact CG1-NE2 3.32Å; V476-H729 WeakPolarHBondContact CG1-NE2 3.37Å; P477-H729 PolarHBondContact O-CD2 3.49Å; P477-H729 PolarHBondContact O-NE2 3.13Å; K479-H729 HydrophobicContact CD-CB 4.35Å; Q725-H729 PolarHBondContact O-N 3.02Å
730	R	80.9	Confident	84	Confident	46 Å²	46	26.6 Å²	26.6	17%	0.174	15%	0.152	C	C	.	.	S	Bend	trans	-136.4	162.4	-177.8	-167	169.6	-178.9	178.7	2.3	111.2	T704 C728 G732 Q733	T704-R730 HydrophobicContact CG2-CB 4.34Å; C728-R730 PolarHBondContact O-N 3.42Å; R730-G732 PolarHBondContact O-N 2.88Å; R730-Q733 VanDerWaalsContact O-CB 3.25Å; R730-Q733 WeakPolarHBondContact O-CB 3.46Å; R730-Q733 PolarHBondContact O-N 2.95Å
731	I	76.3	Confident	84.4	Confident	52 Å²	52	26.3 Å²	26.3	27%	0.267	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	125.4	169.5	-56.9	178.8	0	0	0	109.4	G268 L474	G268-I731 VanDerWaalsContact O-CD1 3.23Å; G268-I731 WeakPolarHBondContact O-CD1 3.45Å; L474-I731 HydrophobicContact CD1-CD1 4.02Å; L474-I731 HydrophobicContact CD1-CG1 4.18Å; L474-I731 HydrophobicContact CD2-CD1 4.26Å
732	G	77.4	Confident	84.7	Confident	54 Å²	54	26.3 Å²	26.3	56%	0.557	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	108	-10.7	-172.5	0	0	0	0	0	113.7	R730	R730-G732 PolarHBondContact O-N 2.88Å
733	Q	83	Confident	85.1	Confident	11 Å²	11	23.1 Å²	23.1	5%	0.051	13%	0.13	C	C	.	.			trans	-73.9	131.3	169.1	-179.2	58.3	-87.5	0	0	110.7	T704 A706 C728 R730 K735 V737	T704-Q733 PolarHBondContact O-NE2 3.3Å; T704-Q733 PolarHBondContact O-OE1 2.93Å; A706-Q733 PolarHBondContact O-NE2 2.99Å; C728-Q733 PolarHBondContact O-NE2 3.37Å; C728-Q733 PolarHBondContact SG-NE2 3.35Å; C728-Q733 VanDerWaalsContact SG-NE2 3.36Å; R730-Q733 VanDerWaalsContact O-CB 3.25Å; R730-Q733 WeakPolarHBondContact O-CB 3.46Å; R730-Q733 PolarHBondContact O-N 2.95Å; Q733-K735 VanDerWaalsContact CD-O 3.31Å; Q733-K735 WeakPolarHBondContact CG-O 3.36Å; Q733-K735 PolarHBondContact OE1-O 3.29Å; Q733-V737 HydrophobicContact CG-CG2 3.82Å
734	T	82.8	Confident	85.2	Confident	122 Å²	122	22.1 Å²	22.1	75%	0.748	13%	0.125	S	C	*	.			trans	-107.6	-25.3	177.8	53.5	0	0	0	0	112.4
735	K	84.8	Confident	85	Confident	98 Å²	98	23.8 Å²	23.8	43%	0.426	14%	0.139	S	C	.	.	S	Bend	trans	-99.5	147	-177.5	-64.7	-178.1	179.8	-178.9	0	111.6	D707 Q733 V737	D707-K735 HydrophobicContact CB-CB 3.91Å; D707-K735 HydrophobicContact CB-CD 4.11Å; Q733-K735 VanDerWaalsContact CD-O 3.31Å; Q733-K735 WeakPolarHBondContact CG-O 3.36Å; Q733-K735 PolarHBondContact OE1-O 3.29Å; K735-V737 PolarHBondContact O-N 2.99Å
736	P	85.9	Confident	84.6	Confident	21 Å²	21	25.9 Å²	25.9	14%	0.136	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-63	134.3	172	26.8	-33.4	0	0	0	110.4	P477 L826	P477-P736 HydrophobicContact CB-CB 4.41Å; P736-L826 HydrophobicContact CB-CB 4.15Å; P736-L826 HydrophobicContact CB-CD1 4.04Å
737	V	88.1	Confident	84.8	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.2	-173.4	-179.8	0	0	0	0	110.6	P478 K479 K480 D707 V709 Q733 K735 V739	P478-V737 PolarHBondContact O-N 3.45Å; K479-V737 VanDerWaalsContact CA-O 3.22Å; K479-V737 WeakPolarHBondContact CA-O 3.39Å; K479-V737 HydrophobicContact CB-CB 4.32Å; K480-V737 PolarHBondContact N-O 3.34Å; D707-V737 VanDerWaalsContact O-CA 3.27Å; D707-V737 WeakPolarHBondContact O-CA 3.03Å; V709-V737 HydrophobicContact CG2-CG1 4.36Å; Q733-V737 HydrophobicContact CG-CG2 3.82Å; K735-V737 PolarHBondContact O-N 2.99Å; V737-V739 HydrophobicContact CG1-CG2 4.36Å
738	V	89.9	Confident	85	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.1	174.4	-174.7	0	0	0	0	109.6	I482 D707 T708 V709 Y740 R823 L826	I482-V738 HydrophobicContact CD1-CG1 3.96Å; D707-V738 PolarHBondContact O-N 2.66Å; D707-V738 VanDerWaalsContact O-N 3.13Å; T708-V738 WeakPolarHBondContact CA-O 3.49Å; V709-V738 PolarHBondContact N-O 2.9Å; V738-Y740 HydrophobicContact CB-CE2 4.31Å; V738-Y740 HydrophobicContact CG1-CD2 4.27Å; V738-Y740 HydrophobicContact CG1-CE1 4Å; V738-Y740 HydrophobicContact CG1-CE2 3.7Å; V738-R823 HydrophobicContact CG2-CG 4.19Å; V738-L826 HydrophobicContact CG2-CD1 4.23Å
739	V	90.9	Very high	85.1	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.2	178.7	-173.6	0	0	0	0	109	K480 E481 I482 V709 I711 Q725 V737	K480-V739 PolarHBondContact O-N 2.89Å; E481-V739 WeakPolarHBondContact CA-O 3.42Å; I482-V739 PolarHBondContact N-O 2.74Å; V709-V739 HydrophobicContact CB-CG1 4.31Å; V709-V739 HydrophobicContact CB-CG2 4.23Å; V709-V739 HydrophobicContact CG1-CG1 4.26Å; V709-V739 CarbonylContact O-C 3.59Å; V709-V739 VanDerWaalsContact O-CA 3.29Å; V709-V739 WeakPolarHBondContact O-CA 3.27Å; I711-V739 HydrophobicContact CD1-CG1 4.03Å; I711-V739 HydrophobicContact CG1-CG1 4.36Å; Q725-V739 HydrophobicContact CG-CG1 3.95Å; Q725-V739 HydrophobicContact CG-CG2 4.02Å; V737-V739 HydrophobicContact CG1-CG2 4.36Å
740	Y	91.5	Very high	85.1	Confident	1 Å²	1	26.9 Å²	26.9	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.5	172.3	-61.2	-76.4	0	0	0	110	I482 V484 L627 T708 V709 I710 I711 V738 L820	I482-Y740 HydrophobicContact CB-CD1 4.18Å; I482-Y740 HydrophobicContact CB-CE1 4.47Å; I482-Y740 HydrophobicContact CD1-CD1 4.4Å; I482-Y740 HydrophobicContact CD1-CE1 3.85Å; I482-Y740 CarbonylContact O-C 3.48Å; I482-Y740 WeakPolarHBondContact O-CA 3.42Å; V484-Y740 HydrophobicContact CG2-CD1 4.05Å; L627-Y740 HydrophobicContact CD1-CD1 4.16Å; L627-Y740 HydrophobicContact CD1-CD2 4.38Å; L627-Y740 HydrophobicContact CD1-CE1 4.29Å; L627-Y740 HydrophobicContact CD1-CE2 4.48Å; L627-Y740 HydrophobicContact CD1-CG 4.21Å; L627-Y740 HydrophobicContact CD2-CD2 4.42Å; T708-Y740 HydrophobicContact CG2-CD2 3.68Å; T708-Y740 HydrophobicContact CG2-CE2 3.55Å; V709-Y740 PolarHBondContact O-N 2.99Å; I710-Y740 CarbonylContact C-O 3.47Å; I710-Y740 WeakPolarHBondContact CA-O 3.27Å; I710-Y740 HydrophobicContact CG1-CD2 4.31Å; I711-Y740 PolarHBondContact N-O 3.38Å; V738-Y740 HydrophobicContact CB-CE2 4.31Å; V738-Y740 HydrophobicContact CG1-CD2 4.27Å; V738-Y740 HydrophobicContact CG1-CE1 4Å; V738-Y740 HydrophobicContact CG1-CE2 3.7Å; Y740-L820 PolarHBondContact OH-O 2.97Å
741	R	91.4	Very high	85.3	Confident	14 Å²	14	26.9 Å²	26.9	5%	0.053	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.8	174.9	-175.4	-178.3	-64.3	-83.5	0.2	109.4	E481 I482 V484 S714 D721 V743	E481-R741 IonicContact OE1-CZ 3.75Å; E481-R741 IonicContact OE1-NE 2.82Å; E481-R741 PolarHBondContact OE1-NE 3.04Å; E481-R741 VanDerWaalsContact OE1-NE 3.11Å; E481-R741 IonicContact OE1-NH2 3.2Å; E481-R741 PolarHBondContact OE1-NH2 3.13Å; I482-R741 PolarHBondContact O-N 3.36Å; V484-R741 PolarHBondContact N-O 3.1Å; S714-R741 PolarHBondContact OG-NH1 3.38Å; D721-R741 IonicContact OD2-CZ 2.77Å; D721-R741 IonicContact OD2-NH1 2.69Å; D721-R741 PolarHBondContact OD2-NH1 3.44Å; D721-R741 IonicContact OD2-NH2 3.54Å; R741-V743 HydrophobicContact CG-CG2 4.06Å
742	L	90.6	Very high	85.7	Confident	4 Å²	4	24.5 Å²	24.5	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.8	179.1	-57.2	-176.6	0	0	0	110.1	V484 K620 I623 I710 I711 F712	V484-L742 HydrophobicContact CB-CD2 4.03Å; V484-L742 HydrophobicContact CG1-CD2 4.39Å; K620-L742 HydrophobicContact CB-CD1 4.4Å; K620-L742 HydrophobicContact CD-CB 4.48Å; I623-L742 HydrophobicContact CG2-CD2 4.04Å; I710-L742 HydrophobicContact CG2-CD1 4.1Å; I710-L742 HydrophobicContact CG2-CG 4.17Å; I711-L742 PolarHBondContact O-N 3.09Å; F712-L742 HydrophobicContact CD2-CD1 3.93Å; F712-L742 HydrophobicContact CE2-CD1 4.31Å
743	V	89.1	Confident	86.1	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.5	-178.1	-179	0	0	0	0	109.5	I483 V484 Y485 A486 R741 D749 Q750 L753	I483-V743 HydrophobicContact CG2-CB 4.26Å; I483-V743 HydrophobicContact CG2-CG2 3.85Å; V484-V743 PolarHBondContact O-N 3.17Å; Y485-V743 CarbonylContact C-O 3.53Å; Y485-V743 VanDerWaalsContact CA-O 3.26Å; Y485-V743 WeakPolarHBondContact CA-O 3.32Å; Y485-V743 HydrophobicContact CD1-CB 4.3Å; Y485-V743 HydrophobicContact CD1-CG1 4.32Å; Y485-V743 HydrophobicContact CE1-CB 4.43Å; Y485-V743 HydrophobicContact CE1-CG1 4.21Å; A486-V743 PolarHBondContact N-O 2.74Å; R741-V743 HydrophobicContact CG-CG2 4.06Å; V743-D749 HydrophobicContact CG1-CB 4.24Å; V743-Q750 HydrophobicContact CG1-CB 4.19Å; V743-L753 HydrophobicContact CG2-CD2 3.95Å
744	T	85.6	Confident	86.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	123.1	172.5	39.4	0	0	0	0	110.6	A486 K620 T747 D749	A486-T744 HydrophobicContact CB-CG2 4.08Å; A486-T744 WeakPolarHBondContact O-CA 3.5Å; K620-T744 HydrophobicContact CG-CG2 4.19Å; T744-T747 WeakPolarHBondContact CB-OG1 3.27Å; T744-T747 PolarHBondContact O-OG1 3.14Å; T744-T747 PolarHBondContact OG1-OG1 3.36Å; T744-D749 PolarHBondContact OG1-OD2 3.43Å
745	A	79.3	Confident	85.9	Confident	35 Å²	35	24.7 Å²	24.7	29%	0.289	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	144.5	-178.1	0	0	0	0	0	111.8	Y485 A486 T747	Y485-A745 HydrophobicContact CD1-CB 4.25Å; A486-A745 PolarHBondContact O-N 3.45Å; A745-T747 VanDerWaalsContact C-N 3.26Å; A745-T747 PolarHBondContact O-N 2.81Å
746	N	78.7	Confident	85.6	Confident	49 Å²	49	20.4 Å²	20.4	26%	0.262	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	30.5	179	-55.6	-25.8	0	0	0	114.8
747	T	84.8	Confident	85.2	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	11%	0.11	C	C	.	.	S	Bend	trans	-125.9	178	178.7	64.8	0	0	0	0	112.6	L488 Y496 T744 A745 D749 Q750 R751	L488-T747 HydrophobicContact CD1-CG2 3.55Å; L488-T747 HydrophobicContact CD2-CG2 4.24Å; L488-T747 HydrophobicContact CG-CG2 4.09Å; Y496-T747 HydrophobicContact CE2-CG2 4.21Å; T744-T747 WeakPolarHBondContact CB-OG1 3.27Å; T744-T747 PolarHBondContact O-OG1 3.14Å; T744-T747 PolarHBondContact OG1-OG1 3.36Å; A745-T747 VanDerWaalsContact C-N 3.26Å; A745-T747 PolarHBondContact O-N 2.81Å; T747-D749 PolarHBondContact O-N 2.79Å; T747-D749 VanDerWaalsContact O-N 3.17Å; T747-D749 PolarHBondContact OG1-N 3.09Å; T747-Q750 PolarHBondContact O-N 3.33Å; T747-Q750 VanDerWaalsContact O-N 3.13Å; T747-R751 PolarHBondContact O-N 3.38Å
748	I	85.9	Confident	84.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-52.2	-32.9	172.2	-168.7	61.1	0	0	0	113.1	Y496 L584 L587 K588 Q750 R751 I752 I786 L791	Y496-I748 HydrophobicContact CE2-CG2 4.46Å; Y496-I748 PolarHBondContact OH-N 2.86Å; Y496-I748 VanDerWaalsContact OH-N 3.07Å; L584-I748 HydrophobicContact CD2-CD1 3.75Å; L584-I748 HydrophobicContact CD2-CG1 4.31Å; L587-I748 HydrophobicContact CB-CG2 3.98Å; K588-I748 HydrophobicContact CG-CG2 4.38Å; I748-Q750 VanDerWaalsContact C-N 3.34Å; I748-Q750 PolarHBondContact O-N 2.93Å; I748-R751 PolarHBondContact O-N 3.42Å; I748-I752 HydrophobicContact CG1-CD1 3.91Å; I748-I752 HydrophobicContact CG1-CG1 4.36Å; I748-I752 WeakPolarHBondContact O-CD1 3.36Å; I748-I752 VanDerWaalsContact O-CG1 3.25Å; I748-I752 WeakPolarHBondContact O-CG1 3.48Å; I748-I752 PolarHBondContact O-N 3.32Å; I748-I786 HydrophobicContact CD1-CD1 3.68Å; I748-I786 HydrophobicContact CD1-CG2 4.13Å; I748-L791 HydrophobicContact CD1-CD1 4.38Å; I748-L791 HydrophobicContact CD1-CD2 4.35Å
749	D	85.1	Confident	83.7	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-39.5	179.8	-81	1.7	0	0	0	112	K620 V743 T744 T747 I752 L753	K620-D749 WeakPolarHBondContact CE-OD2 3.44Å; K620-D749 IonicContact NZ-OD2 3.15Å; K620-D749 PolarHBondContact NZ-OD2 3.23Å; V743-D749 HydrophobicContact CG1-CB 4.24Å; T744-D749 PolarHBondContact OG1-OD2 3.43Å; T747-D749 PolarHBondContact O-N 2.79Å; T747-D749 VanDerWaalsContact O-N 3.17Å; T747-D749 PolarHBondContact OG1-N 3.09Å; D749-I752 PolarHBondContact O-N 3.24Å; D749-L753 PolarHBondContact O-N 3.43Å; D749-L753 VanDerWaalsContact O-N 3.08Å
750	Q	85.5	Confident	82.6	Confident	42 Å²	42	32.4 Å²	32.4	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-43.6	176.4	-178.2	-179.8	-17.6	0	0	111.4	V743 T747 I748 I752 L753 E754	V743-Q750 HydrophobicContact CG1-CB 4.19Å; T747-Q750 PolarHBondContact O-N 3.33Å; T747-Q750 VanDerWaalsContact O-N 3.13Å; I748-Q750 VanDerWaalsContact C-N 3.34Å; I748-Q750 PolarHBondContact O-N 2.93Å; Q750-I752 VanDerWaalsContact C-N 3.31Å; Q750-I752 PolarHBondContact O-N 3.5Å; Q750-L753 WeakPolarHBondContact O-CB 3.36Å; Q750-L753 PolarHBondContact O-N 3.06Å; Q750-L753 VanDerWaalsContact O-N 3.14Å; Q750-E754 WeakPolarHBondContact CG-OE1 3.41Å; Q750-E754 PolarHBondContact NE2-OE1 2.91Å; Q750-E754 WeakPolarHBondContact O-CG 3.36Å; Q750-E754 PolarHBondContact O-N 3.1Å
751	R	83.8	Confident	81.3	Confident	45 Å²	45	38.1 Å²	38.1	17%	0.17	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-38.4	177.1	-70.5	-63.4	-163.3	139.1	4	112.5	T747 I748 L753 E754 R755 E790 L791 L794	T747-R751 PolarHBondContact O-N 3.38Å; I748-R751 PolarHBondContact O-N 3.42Å; R751-L753 VanDerWaalsContact C-N 3.31Å; R751-E754 PolarHBondContact O-N 3.45Å; R751-R755 WeakPolarHBondContact O-CB 3.38Å; R751-R755 WeakPolarHBondContact O-CG 3.37Å; R751-R755 PolarHBondContact O-N 3.26Å; R751-E790 IonicContact CZ-OE1 2.82Å; R751-E790 IonicContact NH1-OE1 2.73Å; R751-E790 PolarHBondContact NH1-OE1 2.96Å; R751-E790 IonicContact NH1-OE2 3.7Å; R751-E790 IonicContact NH2-OE1 3.47Å; R751-E790 PolarHBondContact NH2-OE1 3.08Å; R751-E790 IonicContact NH2-OE2 2.69Å; R751-L791 HydrophobicContact CG-CD2 4.4Å; R751-L794 HydrophobicContact CG-CD1 4.27Å; R751-L794 VanDerWaalsContact NH2-CD1 3.26Å
752	I	86.5	Confident	79.9	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.015	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-43.7	174.9	-69.9	162.6	0	0	0	109.9	K588 W716 I748 D749 Q750 R755 A756	K588-I752 HydrophobicContact CD-CD1 4.37Å; K588-I752 HydrophobicContact CG-CD1 4.4Å; W716-I752 HydrophobicContact CD2-CG1 4.24Å; W716-I752 HydrophobicContact CD2-CG2 4.46Å; W716-I752 HydrophobicContact CE3-CG1 4.09Å; W716-I752 HydrophobicContact CH2-CD1 4.1Å; W716-I752 HydrophobicContact CH2-CG1 3.62Å; W716-I752 HydrophobicContact CZ2-CD1 3.78Å; W716-I752 HydrophobicContact CZ2-CG1 3.8Å; W716-I752 HydrophobicContact CZ3-CG1 3.79Å; I748-I752 HydrophobicContact CG1-CD1 3.91Å; I748-I752 HydrophobicContact CG1-CG1 4.36Å; I748-I752 WeakPolarHBondContact O-CD1 3.36Å; I748-I752 VanDerWaalsContact O-CG1 3.25Å; I748-I752 WeakPolarHBondContact O-CG1 3.48Å; I748-I752 PolarHBondContact O-N 3.32Å; D749-I752 PolarHBondContact O-N 3.24Å; Q750-I752 VanDerWaalsContact C-N 3.31Å; Q750-I752 PolarHBondContact O-N 3.5Å; I752-R755 PolarHBondContact O-N 3.49Å; I752-A756 WeakPolarHBondContact O-CB 3.38Å; I752-A756 PolarHBondContact O-N 3.33Å
753	L	84.6	Confident	78.5	Confident	15 Å²	15	42.3 Å²	42.3	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-46.7	177.2	-175.5	64.3	0	0	0	112.1	I483 V743 D749 Q750 R751 R755 A756 T757	I483-L753 HydrophobicContact CD1-CD2 3.66Å; I483-L753 HydrophobicContact CG1-CD2 4.28Å; I483-L753 HydrophobicContact CG2-CD2 4.22Å; V743-L753 HydrophobicContact CG2-CD2 3.95Å; D749-L753 PolarHBondContact O-N 3.43Å; D749-L753 VanDerWaalsContact O-N 3.08Å; Q750-L753 WeakPolarHBondContact O-CB 3.36Å; Q750-L753 PolarHBondContact O-N 3.06Å; Q750-L753 VanDerWaalsContact O-N 3.14Å; R751-L753 VanDerWaalsContact C-N 3.31Å; L753-R755 VanDerWaalsContact C-N 3.34Å; L753-R755 PolarHBondContact O-N 2.86Å; L753-A756 CarbonylContact O-C 3.53Å; L753-A756 WeakPolarHBondContact O-CB 3.39Å; L753-A756 PolarHBondContact O-N 3.48Å; L753-A756 VanDerWaalsContact O-N 3.14Å; L753-T757 HydrophobicContact CD1-CG2 4.29Å; L753-T757 HydrophobicContact CG-CG2 4.36Å; L753-T757 WeakPolarHBondContact O-CG2 3.23Å; L753-T757 PolarHBondContact O-N 3.35Å; L753-T757 PolarHBondContact O-OG1 2.87Å
754	E	83.3	Confident	77.1	Confident	85 Å²	85	44.9 Å²	44.9	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-58.1	-46.8	177.5	-73.3	166.3	-173.5	0	0	110.9	Q750 R751 A756 T757 A758	Q750-E754 WeakPolarHBondContact CG-OE1 3.41Å; Q750-E754 PolarHBondContact NE2-OE1 2.91Å; Q750-E754 WeakPolarHBondContact O-CG 3.36Å; Q750-E754 PolarHBondContact O-N 3.1Å; R751-E754 PolarHBondContact O-N 3.45Å; E754-A756 PolarHBondContact O-N 3.48Å; E754-T757 PolarHBondContact O-N 2.57Å; E754-T757 PolarHBondContact O-OG1 3.22Å; E754-A758 WeakPolarHBondContact O-CB 3.36Å; E754-A758 PolarHBondContact O-N 3.41Å
755	R	78.8	Confident	75.6	Confident	90 Å²	90	49.3 Å²	49.3	34%	0.34	24%	0.243	S	C	.	.	H	α-helix	trans	-64.1	-38.9	174.8	-71.5	-176	176.9	-156.3	-0.1	112.7	R751 I752 L753 A758 K759 S785	R751-R755 WeakPolarHBondContact O-CB 3.38Å; R751-R755 WeakPolarHBondContact O-CG 3.37Å; R751-R755 PolarHBondContact O-N 3.26Å; I752-R755 PolarHBondContact O-N 3.49Å; L753-R755 VanDerWaalsContact C-N 3.34Å; L753-R755 PolarHBondContact O-N 2.86Å; R755-A758 PolarHBondContact O-N 3.27Å; R755-K759 WeakPolarHBondContact O-CG 3.32Å; R755-K759 PolarHBondContact O-N 2.6Å; R755-S785 PolarHBondContact NH2-O 2.82Å
756	A	77.5	Confident	74.3	Confident	9 Å²	9	49 Å²	49	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-44.1	176.4	0	0	0	0	0	111.4	P718 I752 L753 E754 K759 R760	P718-A756 HydrophobicContact CG-CB 3.84Å; P718-A756 WeakPolarHBondContact CG-O 3.48Å; I752-A756 WeakPolarHBondContact O-CB 3.38Å; I752-A756 PolarHBondContact O-N 3.33Å; L753-A756 CarbonylContact O-C 3.53Å; L753-A756 WeakPolarHBondContact O-CB 3.39Å; L753-A756 PolarHBondContact O-N 3.48Å; L753-A756 VanDerWaalsContact O-N 3.14Å; E754-A756 PolarHBondContact O-N 3.48Å; A756-K759 PolarHBondContact O-N 3.22Å; A756-R760 PolarHBondContact O-N 2.96Å
757	T	78.3	Confident	73.1	Confident	52 Å²	52	49.5 Å²	49.5	32%	0.319	24%	0.239	S	C	.	.	H	α-helix	trans	-66.3	-39.2	176	61	0	0	0	0	112.1	L753 E754 R760 K761	L753-T757 HydrophobicContact CD1-CG2 4.29Å; L753-T757 HydrophobicContact CG-CG2 4.36Å; L753-T757 WeakPolarHBondContact O-CG2 3.23Å; L753-T757 PolarHBondContact O-N 3.35Å; L753-T757 PolarHBondContact O-OG1 2.87Å; E754-T757 PolarHBondContact O-N 2.57Å; E754-T757 PolarHBondContact O-OG1 3.22Å; T757-R760 WeakPolarHBondContact O-CB 3.49Å; T757-R760 PolarHBondContact O-N 2.95Å; T757-K761 WeakPolarHBondContact O-CG 3.45Å; T757-K761 PolarHBondContact O-N 3.04Å
758	A	73.7	Confident	71.2	Confident	49 Å²	49	54 Å²	54	41%	0.405	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-44.7	173.5	0	0	0	0	0	111.9	E754 R755 R760 K761 L762	E754-A758 WeakPolarHBondContact O-CB 3.36Å; E754-A758 PolarHBondContact O-N 3.41Å; R755-A758 PolarHBondContact O-N 3.27Å; A758-R760 VanDerWaalsContact C-N 3.33Å; A758-R760 PolarHBondContact O-N 3.3Å; A758-K761 PolarHBondContact O-N 3.44Å; A758-L762 WeakPolarHBondContact O-CG 3.49Å; A758-L762 PolarHBondContact O-N 2.89Å
759	K	72.3	Confident	69.1	Low	100 Å²	100	58.8 Å²	58.8	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-60.1	-42.1	173.1	-73.2	177.6	-177.6	-178.8	0	112	W716 P718 R755 A756 L762 E763	W716-K759 PolarHBondContact O-NZ 3.45Å; P718-K759 HydrophobicContact CG-CB 4.16Å; R755-K759 WeakPolarHBondContact O-CG 3.32Å; R755-K759 PolarHBondContact O-N 2.6Å; A756-K759 PolarHBondContact O-N 3.22Å; K759-L762 WeakPolarHBondContact O-CB 3.36Å; K759-L762 PolarHBondContact O-N 3.02Å; K759-E763 WeakPolarHBondContact O-CG 3.46Å; K759-E763 PolarHBondContact O-N 2.95Å
760	R	69.1	Low	67	Low	76 Å²	76	64.9 Å²	64.9	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-42.7	176.1	-178.5	177.9	172.3	177.4	-3.1	112	E481 A756 T757 A758 L762 E763 Q764	E481-R760 IonicContact OE2-NH1 2.83Å; E481-R760 PolarHBondContact OE2-NH1 3.41Å; A756-R760 PolarHBondContact O-N 2.96Å; T757-R760 WeakPolarHBondContact O-CB 3.49Å; T757-R760 PolarHBondContact O-N 2.95Å; A758-R760 VanDerWaalsContact C-N 3.33Å; A758-R760 PolarHBondContact O-N 3.3Å; R760-L762 VanDerWaalsContact C-N 3.32Å; R760-L762 PolarHBondContact O-N 3.3Å; R760-E763 PolarHBondContact O-N 3.43Å; R760-Q764 WeakPolarHBondContact O-CG 3.45Å; R760-Q764 PolarHBondContact O-N 3.41Å
761	K	64.4	Low	64.4	Low	122 Å²	122	72.2 Å²	72.2	53%	0.53	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-43.9	175.1	-74.7	-178.4	178.5	-173.9	0	111	T757 A758 Q764 M765	T757-K761 WeakPolarHBondContact O-CG 3.45Å; T757-K761 PolarHBondContact O-N 3.04Å; A758-K761 PolarHBondContact O-N 3.44Å; K761-Q764 PolarHBondContact O-N 3.16Å; K761-M765 WeakPolarHBondContact O-CB 2.85Å; K761-M765 VanDerWaalsContact O-CG 3.29Å; K761-M765 WeakPolarHBondContact O-CG 3.42Å; K761-M765 PolarHBondContact O-N 2.7Å
762	L	61.5	Low	61.8	Low	72 Å²	72	76.6 Å²	76.6	38%	0.377	36%	0.359	S	S	.	.	H	α-helix	trans	-61.5	-44.1	175.1	-71.3	170.2	0	0	0	112.2	A758 K759 R760 M765 V766 L779	A758-L762 WeakPolarHBondContact O-CG 3.49Å; A758-L762 PolarHBondContact O-N 2.89Å; K759-L762 WeakPolarHBondContact O-CB 3.36Å; K759-L762 PolarHBondContact O-N 3.02Å; R760-L762 VanDerWaalsContact C-N 3.32Å; R760-L762 PolarHBondContact O-N 3.3Å; L762-M765 PolarHBondContact O-N 2.75Å; L762-V766 WeakPolarHBondContact O-CG2 3.31Å; L762-V766 PolarHBondContact O-N 3.24Å; L762-V766 VanDerWaalsContact O-N 3.11Å; L762-L779 HydrophobicContact CD2-CD2 4.17Å
763	E	61.5	Low	59.3	Low	33 Å²	33	86.8 Å²	86.8	15%	0.154	40%	0.403	C	S	.	.	H	α-helix	trans	-60.7	-45	174.4	-72	-179.1	170.7	0	0	111.5	Q719 K759 R760 M765 V766 I767	Q719-E763 PolarHBondContact NE2-OE1 3.44Å; K759-E763 WeakPolarHBondContact O-CG 3.46Å; K759-E763 PolarHBondContact O-N 2.95Å; R760-E763 PolarHBondContact O-N 3.43Å; E763-M765 PolarHBondContact O-N 2.99Å; E763-V766 PolarHBondContact O-N 3.03Å; E763-I767 WeakPolarHBondContact O-CD1 3.42Å; E763-I767 VanDerWaalsContact O-CG1 3.22Å; E763-I767 WeakPolarHBondContact O-CG1 3.23Å; E763-I767 PolarHBondContact O-N 3.01Å; E763-I767 VanDerWaalsContact O-N 3.09Å
764	Q	60	Low	56.8	Low	56 Å²	56	89.4 Å²	89.4	26%	0.262	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-40.2	177.2	-76.4	179	-34.2	0	0	112.4	R760 K761 V766 I767 H768	R760-Q764 WeakPolarHBondContact O-CG 3.45Å; R760-Q764 PolarHBondContact O-N 3.41Å; K761-Q764 PolarHBondContact O-N 3.16Å; Q764-V766 VanDerWaalsContact C-N 3.29Å; Q764-V766 PolarHBondContact O-N 3.4Å; Q764-I767 PolarHBondContact O-N 2.98Å; Q764-I767 VanDerWaalsContact O-N 3.17Å; Q764-H768 WeakPolarHBondContact O-CB 3.32Å; Q764-H768 PolarHBondContact O-N 3.35Å; Q764-H768 PolarHBondContact O-ND1 3.44Å
765	M	53.2	Low	54.3	Low	93 Å²	93	89 Å²	89	46%	0.458	45%	0.453	S	S	.	.	H	α-helix	trans	-60.1	-40	175	-76.3	178.4	177.4	0	0	111.6	K761 L762 E763 I767 K769	K761-M765 WeakPolarHBondContact O-CB 2.85Å; K761-M765 VanDerWaalsContact O-CG 3.29Å; K761-M765 WeakPolarHBondContact O-CG 3.42Å; K761-M765 PolarHBondContact O-N 2.7Å; L762-M765 PolarHBondContact O-N 2.75Å; E763-M765 PolarHBondContact O-N 2.99Å; M765-I767 VanDerWaalsContact C-N 3.29Å; M765-I767 PolarHBondContact O-N 2.77Å; M765-K769 VanDerWaalsContact O-CB 3.26Å; M765-K769 WeakPolarHBondContact O-CB 3.02Å; M765-K769 WeakPolarHBondContact O-CG 3.28Å; M765-K769 PolarHBondContact O-N 3.19Å; M765-K769 VanDerWaalsContact O-N 3.08Å
766	V	52.4	Low	52.5	Low	27 Å²	27	91.4 Å²	91.4	16%	0.164	47%	0.465	C	S	.	.	H	α-helix	trans	-67.6	-35	177.9	177.5	0	0	0	0	110.9	N405 L762 E763 Q764	N405-V766 VanDerWaalsContact CG-CG2 3.44Å; N405-V766 WeakPolarHBondContact ND2-CG2 3.25Å; N405-V766 WeakPolarHBondContact OD1-CG2 3.16Å; L762-V766 WeakPolarHBondContact O-CG2 3.31Å; L762-V766 PolarHBondContact O-N 3.24Å; L762-V766 VanDerWaalsContact O-N 3.11Å; E763-V766 PolarHBondContact O-N 3.03Å; Q764-V766 VanDerWaalsContact C-N 3.29Å; Q764-V766 PolarHBondContact O-N 3.4Å
767	I	53.3	Low	50.3	Low	60 Å²	60	96 Å²	96	31%	0.308	50%	0.503	S	S	.	.	H	α-helix	trans	-75.2	-40.7	179.2	-63.8	162.1	0	0	0	111.8	P402 E763 Q764 M765	P402-I767 HydrophobicContact CB-CD1 4.05Å; P402-I767 HydrophobicContact CB-CG1 4.44Å; P402-I767 HydrophobicContact CG-CD1 4.17Å; E763-I767 WeakPolarHBondContact O-CD1 3.42Å; E763-I767 VanDerWaalsContact O-CG1 3.22Å; E763-I767 WeakPolarHBondContact O-CG1 3.23Å; E763-I767 PolarHBondContact O-N 3.01Å; E763-I767 VanDerWaalsContact O-N 3.09Å; Q764-I767 PolarHBondContact O-N 2.98Å; Q764-I767 VanDerWaalsContact O-N 3.17Å; M765-I767 VanDerWaalsContact C-N 3.29Å; M765-I767 PolarHBondContact O-N 2.77Å
768	H	43.7	Very low	48.2	Very low	97 Å²	97	102 Å²	102	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-99.5	4.1	-171.3	-68.3	82.1	0	0	0	114.8	Q764 K770 K771	Q764-H768 WeakPolarHBondContact O-CB 3.32Å; Q764-H768 PolarHBondContact O-N 3.35Å; Q764-H768 PolarHBondContact O-ND1 3.44Å; H768-K770 PolarHBondContact O-N 2.59Å; H768-K771 PolarHBondContact O-N 3.44Å
769	K	42.3	Very low	46.6	Very low	100 Å²	100	103.7 Å²	103.7	44%	0.435	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-2.5	-179.5	-108.3	175.8	-179	-171.4	0	115.7	L453 M765 K771	L453-K769 HydrophobicContact CD2-CD 4.49Å; M765-K769 VanDerWaalsContact O-CB 3.26Å; M765-K769 WeakPolarHBondContact O-CB 3.02Å; M765-K769 WeakPolarHBondContact O-CG 3.28Å; M765-K769 PolarHBondContact O-N 3.19Å; M765-K769 VanDerWaalsContact O-N 3.08Å; K769-K771 PolarHBondContact O-N 3.04Å
770	K	40.7	Very low	44.7	Very low	137 Å²	137	106.2 Å²	106.2	60%	0.596	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-5.6	166.3	-83.7	-176	166.7	-99.7	0	114.6	E198 H768	E198-K770 IonicContact OE1-NZ 3.69Å; E198-K770 PolarHBondContact OE1-NZ 3.01Å; H768-K770 PolarHBondContact O-N 2.59Å
771	K	31.4	Very low	43.3	Very low	196 Å²	196	111.9 Å²	111.9	85%	0.852	58%	0.577	S	S	*	*	S	Bend	trans	-136.4	4.2	-178.2	-70.6	-168.9	177.7	-176.6	0	117.3	H768 K769	H768-K771 PolarHBondContact O-N 3.44Å; K769-K771 PolarHBondContact O-N 3.04Å
772	F	29.5	Very low	42.2	Very low	137 Å²	137	111.2 Å²	111.2	60%	0.601	59%	0.588	S	S	*	*			trans	-119.1	107.7	-173.7	-110.2	-95.2	0	0	0	112.8
773	K	33.6	Very low	41.2	Very low	217 Å²	217	116.6 Å²	116.6	94%	0.943	61%	0.608	S	S	*	*			trans	-100.8	121.5	156.9	-86.4	-174.3	173.7	-178.3	0	107.8
774	G	33.2	Very low	40	Very low	70 Å²	70	119.8 Å²	119.8	72%	0.722	63%	0.634	S	S	*	*			trans	114.4	133.5	159.8	0	0	0	0	0	117.5
775	G	29.6	Very low	39.1	Very low	77 Å²	77	121.2 Å²	121.2	79%	0.794	65%	0.65	S	S	*	*			trans	114.3	83	160	0	0	0	0	0	116.8
776	K	40.5	Very low	38.9	Very low	140 Å²	140	118 Å²	118	61%	0.609	64%	0.635	S	S	*	*			trans	-113.1	44.6	177.1	-80.6	-169.5	173.2	-171.8	0	113.5
777	A	31.5	Very low	38.8	Very low	105 Å²	105	121.2 Å²	121.2	87%	0.868	65%	0.651	S	S	*	*	S	Bend	trans	-90.1	-13.8	178.9	0	0	0	0	0	114.7
778	E	34.8	Very low	38.8	Very low	179 Å²	179	120.7 Å²	120.7	84%	0.836	65%	0.649	S	S	*	*	S	Bend	trans	-109.6	-0.7	-169.8	-67.6	-172.3	159.9	0	0	115.8
779	L	39.7	Very low	39.4	Very low	84 Å²	84	121 Å²	121	44%	0.44	65%	0.653	S	S	.	*			trans	-94.4	-5.3	-164.4	-99.8	141	0	0	0	116.3	L762 Q781	L762-L779 HydrophobicContact CD2-CD2 4.17Å; L779-Q781 PolarHBondContact O-N 3.37Å
780	N	33.6	Very low	40.1	Very low	153 Å²	153	119.8 Å²	119.8	82%	0.818	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	10.6	-168.7	-79.4	-1.3	0	0	0	116.5
781	Q	40	Very low	40.9	Very low	194 Å²	194	113.5 Å²	113.5	91%	0.907	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	5.8	179.8	-76.3	-173.7	-0.4	0	0	115.9	L779 K783	L779-Q781 PolarHBondContact O-N 3.37Å; Q781-K783 PolarHBondContact O-N 2.97Å
782	S	41.1	Very low	42.1	Very low	108 Å²	108	109.6 Å²	109.6	76%	0.755	60%	0.602	S	S	*	*			trans	-91.9	80.7	179	62.3	0	0	0	0	112.7
783	K	39	Very low	43.4	Very low	186 Å²	186	107.9 Å²	107.9	81%	0.809	60%	0.599	S	S	*	*			trans	-101.8	130	158.6	-77.6	-171.2	179	179.5	0	111.2	Q781	Q781-K783 PolarHBondContact O-N 2.97Å
784	S	38	Very low	44.4	Very low	100 Å²	100	99.9 Å²	99.9	70%	0.699	57%	0.567	S	S	*	*	S	Bend	trans	18.8	129	154.8	53.5	0	0	0	0	121.4
785	S	40.6	Very low	45.4	Very low	85 Å²	85	98.8 Å²	98.8	59%	0.594	54%	0.544	S	S	*	.	S	Bend	trans	61.1	158.2	169.4	32.7	0	0	0	0	115.6	R755	R755-S785 PolarHBondContact NH2-O 2.82Å
786	I	47.7	Very low	46.4	Very low	25 Å²	25	100.7 Å²	100.7	13%	0.128	53%	0.532	C	S	.	.			trans	-92.8	110.1	166.6	-66	172.6	0	0	0	103.4	L584 W716 I748 L791	L584-I786 HydrophobicContact CD2-CG2 4.38Å; W716-I786 HydrophobicContact CH2-CD1 3.41Å; W716-I786 VanDerWaalsContact CH2-CD1 3.41Å; W716-I786 HydrophobicContact CZ3-CD1 3.78Å; I748-I786 HydrophobicContact CD1-CD1 3.68Å; I748-I786 HydrophobicContact CD1-CG2 4.13Å; I786-L791 HydrophobicContact CG2-CD1 3.72Å; I786-L791 HydrophobicContact CG2-CD2 4.34Å; I786-L791 HydrophobicContact CG2-CG 3.93Å
787	D	51.9	Low	46.8	Very low	96 Å²	96	97.8 Å²	97.8	51%	0.513	53%	0.534	S	S	.	.			trans	-79.7	139.9	-179.3	-139.3	-15.2	0	0	0	109.9	D789 E790 L791	D787-D789 PolarHBondContact O-N 3.03Å; D787-E790 HydrophobicContact CB-CB 4.33Å; D787-E790 PolarHBondContact O-N 2.99Å; D787-L791 PolarHBondContact O-N 3.46Å
788	L	52	Low	47.4	Very low	48 Å²	48	99.2 Å²	99.2	25%	0.251	52%	0.517	S	S	.	.	H	α-helix	trans	-67.5	-28.8	-177.3	-71.9	172.5	0	0	0	111.6	V583 L791 R792	V583-L788 HydrophobicContact CG1-CD2 4.02Å; L788-L791 HydrophobicContact CD2-CD1 4.45Å; L788-L791 PolarHBondContact O-N 2.91Å; L788-R792 PolarHBondContact O-N 2.93Å; L788-R792 VanDerWaalsContact O-N 3.15Å
789	D	56.8	Low	47.4	Very low	103 Å²	103	92.5 Å²	92.5	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-71.4	-35.4	176.8	-67.3	-27.5	0	0	0	111.6	D787 L791 R792 D793	D787-D789 PolarHBondContact O-N 3.03Å; D789-L791 VanDerWaalsContact C-N 3.29Å; D789-L791 PolarHBondContact O-N 2.9Å; D789-R792 WeakPolarHBondContact O-CB 3.41Å; D789-R792 PolarHBondContact O-N 3.42Å; D789-R792 VanDerWaalsContact O-N 3.1Å; D789-D793 PolarHBondContact O-N 3.38Å
790	E	58.1	Low	47.2	Very low	75 Å²	75	94.7 Å²	94.7	35%	0.35	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-32.6	175	-155.6	-165.9	172.2	0	0	112.4	R751 D787 L794	R751-E790 IonicContact CZ-OE1 2.82Å; R751-E790 IonicContact NH1-OE1 2.73Å; R751-E790 PolarHBondContact NH1-OE1 2.96Å; R751-E790 IonicContact NH1-OE2 3.7Å; R751-E790 IonicContact NH2-OE1 3.47Å; R751-E790 PolarHBondContact NH2-OE1 3.08Å; R751-E790 IonicContact NH2-OE2 2.69Å; D787-E790 HydrophobicContact CB-CB 4.33Å; D787-E790 PolarHBondContact O-N 2.99Å; E790-L794 PolarHBondContact O-N 3.49Å
791	L	56.1	Low	47.1	Very low	5 Å²	5	96.4 Å²	96.4	3%	0.026	52%	0.519	C	S	.	.	H	α-helix	trans	-73.3	-33.4	173.2	-73	171.2	0	0	0	112.2	L587 I748 R751 I786 D787 L788 D789 L795	L587-L791 HydrophobicContact CD1-CD1 4.06Å; I748-L791 HydrophobicContact CD1-CD1 4.38Å; I748-L791 HydrophobicContact CD1-CD2 4.35Å; R751-L791 HydrophobicContact CG-CD2 4.4Å; I786-L791 HydrophobicContact CG2-CD1 3.72Å; I786-L791 HydrophobicContact CG2-CD2 4.34Å; I786-L791 HydrophobicContact CG2-CG 3.93Å; D787-L791 PolarHBondContact O-N 3.46Å; L788-L791 HydrophobicContact CD2-CD1 4.45Å; L788-L791 PolarHBondContact O-N 2.91Å; D789-L791 VanDerWaalsContact C-N 3.29Å; D789-L791 PolarHBondContact O-N 2.9Å; L791-L795 PolarHBondContact O-N 2.96Å
792	R	56.5	Low	47	Very low	115 Å²	115	94.7 Å²	94.7	43%	0.434	51%	0.508	S	S	.	.	H	α-helix	trans	-68.3	-43.1	174.9	-173.3	179.9	-178.3	165.4	1.9	110.8	V500 L788 D789 L794 L795 Q796	V500-R792 HydrophobicContact CG1-CB 4.28Å; L788-R792 PolarHBondContact O-N 2.93Å; L788-R792 VanDerWaalsContact O-N 3.15Å; D789-R792 WeakPolarHBondContact O-CB 3.41Å; D789-R792 PolarHBondContact O-N 3.42Å; D789-R792 VanDerWaalsContact O-N 3.1Å; R792-L794 PolarHBondContact O-N 3.21Å; R792-L795 PolarHBondContact O-N 2.94Å; R792-Q796 WeakPolarHBondContact O-CB 3.33Å; R792-Q796 WeakPolarHBondContact O-CG 3.31Å; R792-Q796 PolarHBondContact O-N 3.26Å
793	D	58.3	Low	46.6	Very low	100 Å²	100	96.4 Å²	96.4	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-38.4	176.9	-74.6	-8.7	0	0	0	111.9	D789 L795 Q796 A797	D789-D793 PolarHBondContact O-N 3.38Å; D793-L795 VanDerWaalsContact C-N 3.34Å; D793-L795 PolarHBondContact O-N 3.32Å; D793-Q796 CarbonylContact O-C 3.6Å; D793-Q796 PolarHBondContact O-N 3.09Å; D793-A797 WeakPolarHBondContact O-CB 3.31Å; D793-A797 PolarHBondContact O-N 2.89Å
794	L	53.5	Low	46.5	Very low	50 Å²	50	92 Å²	92	26%	0.262	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-36.1	173	-81.3	-174.7	0	0	0	113.9	R751 E790 R792 Q796	R751-L794 HydrophobicContact CG-CD1 4.27Å; R751-L794 VanDerWaalsContact NH2-CD1 3.26Å; E790-L794 PolarHBondContact O-N 3.49Å; R792-L794 PolarHBondContact O-N 3.21Å; L794-Q796 VanDerWaalsContact C-N 3.32Å
795	L	53.3	Low	46.1	Very low	47 Å²	47	94.9 Å²	94.9	25%	0.246	49%	0.493	C	S	.	.	H	α-helix	trans	-70.8	-33.3	176.6	-168.8	135.9	0	0	0	110.8	Y496 L791 R792 D793 R798	Y496-L795 HydrophobicContact CD1-CD1 3.73Å; Y496-L795 HydrophobicContact CE1-CD1 3.9Å; L791-L795 PolarHBondContact O-N 2.96Å; R792-L795 PolarHBondContact O-N 2.94Å; D793-L795 VanDerWaalsContact C-N 3.34Å; D793-L795 PolarHBondContact O-N 3.32Å; L795-R798 VanDerWaalsContact O-CB 3.28Å; L795-R798 WeakPolarHBondContact O-CB 3.35Å
796	Q	51.7	Low	45.7	Very low	117 Å²	117	94.8 Å²	94.8	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-81.7	-29.5	177	-70.2	-177.5	-0.2	0	0	114	R792 D793 L794 R798	R792-Q796 WeakPolarHBondContact O-CB 3.33Å; R792-Q796 WeakPolarHBondContact O-CG 3.31Å; R792-Q796 PolarHBondContact O-N 3.26Å; D793-Q796 CarbonylContact O-C 3.6Å; D793-Q796 PolarHBondContact O-N 3.09Å; L794-Q796 VanDerWaalsContact C-N 3.32Å; Q796-R798 PolarHBondContact O-N 2.96Å
797	A	49.5	Very low	45	Very low	79 Å²	79	98.2 Å²	98.2	65%	0.653	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	2.7	172.8	0	0	0	0	0	113.3	D793 G799	D793-A797 WeakPolarHBondContact O-CB 3.31Å; D793-A797 PolarHBondContact O-N 2.89Å; A797-G799 PolarHBondContact O-N 3.25Å
798	R	44	Very low	44.1	Very low	134 Å²	134	103 Å²	103	51%	0.506	53%	0.534	S	S	.	.			trans	-68.2	53.7	163.4	-158.2	179.6	-172	-172.8	0.5	110.9	E493 L795 Q796	E493-R798 IonicContact OE1-NH1 2.6Å; E493-R798 PolarHBondContact OE1-NH1 3.46Å; E493-R798 IonicContact OE2-CZ 3.74Å; E493-R798 IonicContact OE2-NH1 2.69Å; E493-R798 PolarHBondContact OE2-NH1 3.33Å; L795-R798 VanDerWaalsContact O-CB 3.28Å; L795-R798 WeakPolarHBondContact O-CB 3.35Å; Q796-R798 PolarHBondContact O-N 2.96Å
799	G	33.2	Very low	43.6	Very low	39 Å²	39	104.1 Å²	104.1	40%	0.402	56%	0.557	S	S	.	*			trans	-72.1	168.6	160	0	0	0	0	0	111.1	A797 E801	A797-G799 PolarHBondContact O-N 3.25Å; G799-E801 PolarHBondContact O-N 2.98Å
800	P	35.6	Very low	43.1	Very low	129 Å²	129	102.8 Å²	102.8	84%	0.838	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	18.1	-162.1	28.9	-35.9	0	0	0	116.5
801	E	31.6	Very low	42.9	Very low	189 Å²	189	101 Å²	101	88%	0.883	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-0.8	-179.4	-68.3	-165.2	155.7	0	0	114.6	G799	G799-E801 PolarHBondContact O-N 2.98Å
802	K	38	Very low	43.3	Very low	158 Å²	158	101.3 Å²	101.3	69%	0.687	54%	0.542	S	S	*	.			trans	-135.8	42.9	175.2	-72.9	-176.7	-179.3	171.7	0	113.4	V804	K802-V804 VanDerWaalsContact C-N 3.34Å; K802-V804 PolarHBondContact O-N 3.45Å
803	E	32.7	Very low	43.9	Very low	144 Å²	144	98 Å²	98	67%	0.673	54%	0.537	S	S	*	.			trans	-65.4	103.1	151.7	-76.2	-172.5	164.5	0	0	107.5	K805	E803-K805 HydrophobicContact CB-CG 4.01Å; E803-K805 PolarHBondContact O-N 2.95Å
804	V	38	Very low	44.5	Very low	94 Å²	94	97 Å²	97	57%	0.57	53%	0.532	S	S	*	.			trans	-59.8	89.4	147.2	178.7	0	0	0	0	104.1	K802 S806	K802-V804 VanDerWaalsContact C-N 3.34Å; K802-V804 PolarHBondContact O-N 3.45Å; V804-S806 VanDerWaalsContact C-N 3.33Å; V804-S806 PolarHBondContact O-N 3.3Å
805	K	29.9	Very low	45.3	Very low	161 Å²	161	102.3 Å²	102.3	70%	0.7	55%	0.553	S	S	*	*			trans	-57.9	101.4	-178.7	-78.2	-174.2	177.3	-179.6	0	107.2	E803 S807	E803-K805 HydrophobicContact CB-CG 4.01Å; E803-K805 PolarHBondContact O-N 2.95Å; K805-S807 PolarHBondContact O-N 3.44Å
806	S	31.9	Very low	46.2	Very low	83 Å²	83	101.9 Å²	101.9	58%	0.58	55%	0.551	S	S	*	*			trans	-62.4	81.9	163.9	-172.5	0	0	0	0	106.9	V804 K808	V804-S806 VanDerWaalsContact C-N 3.33Å; V804-S806 PolarHBondContact O-N 3.3Å; S806-K808 PolarHBondContact O-N 2.95Å; S806-K808 VanDerWaalsContact O-N 3.16Å
807	S	31.5	Very low	47.2	Very low	96 Å²	96	97.4 Å²	97.4	67%	0.671	53%	0.53	S	S	*	.			trans	-77.2	101.3	169.9	41.9	0	0	0	0	106.5	K805	K805-S807 PolarHBondContact O-N 3.44Å
808	K	34.1	Very low	48.5	Very low	197 Å²	197	99.6 Å²	99.6	86%	0.857	53%	0.527	S	S	*	.	S	Bend	trans	65.1	67.8	172.1	-56.4	-176.8	177.9	-176.7	0	116	S806 K810	S806-K808 PolarHBondContact O-N 2.95Å; S806-K808 VanDerWaalsContact O-N 3.16Å; K808-K810 PolarHBondContact O-N 3.33Å
809	G	41.5	Very low	50	Low	71 Å²	71	96.2 Å²	96.2	73%	0.732	52%	0.518	S	S	*	.	S	Bend	trans	59.6	8.5	159.7	0	0	0	0	0	116.4
810	K	46	Very low	52	Low	76 Å²	76	94.5 Å²	94.5	33%	0.33	50%	0.5	S	S	.	.			trans	-112.5	116	175.9	-71.7	-169.8	179.6	-167.7	0	107.1	K808 I812 D814	K808-K810 PolarHBondContact O-N 3.33Å; K810-I812 PolarHBondContact O-N 3.1Å; K810-D814 IonicContact NZ-OD1 2.89Å; K810-D814 PolarHBondContact NZ-OD1 3.05Å; K810-D814 IonicContact NZ-OD2 2.62Å; K810-D814 PolarHBondContact NZ-OD2 3.48Å
811	V	54.9	Low	53.9	Low	38 Å²	38	88.5 Å²	88.5	23%	0.23	46%	0.461	C	S	.	.	S	Bend	trans	-64.9	-27.3	177.9	175.6	0	0	0	0	111.5	P487 L622 I623	P487-V811 VanDerWaalsContact CD-CG1 3.45Å; P487-V811 HydrophobicContact CG-CG1 3.57Å; P487-V811 HydrophobicContact CG-CG2 4.35Å; L622-V811 HydrophobicContact CB-CG2 4.11Å; L622-V811 HydrophobicContact CD1-CG2 4.04Å; I623-V811 HydrophobicContact CD1-CG1 4.1Å; I623-V811 HydrophobicContact CG1-CG1 3.75Å
812	I	63.4	Low	56.1	Low	11 Å²	11	82.4 Å²	82.4	6%	0.056	43%	0.434	C	S	.	.	S	Bend	trans	-134.7	135	175.2	-59.7	178.5	0	0	0	107.6	V484 I623 K810 D816 L817 L820	V484-I812 HydrophobicContact CG1-CD1 4.29Å; I623-I812 HydrophobicContact CB-CD1 4.45Å; I623-I812 HydrophobicContact CD1-CD1 4.22Å; I623-I812 HydrophobicContact CG1-CD1 3.98Å; I623-I812 HydrophobicContact CG1-CG1 4.44Å; I623-I812 HydrophobicContact CG2-CD1 3.93Å; K810-I812 PolarHBondContact O-N 3.1Å; I812-D816 HydrophobicContact CG2-CB 3.76Å; I812-L817 HydrophobicContact CG2-CB 4.2Å; I812-L820 HydrophobicContact CD1-CD1 4.29Å; I812-L820 HydrophobicContact CG2-CD1 4.33Å
813	S	68.6	Low	57.8	Low	46 Å²	46	76 Å²	76	32%	0.322	41%	0.406	S	S	.	.			trans	-70.2	147.2	174.6	81.6	0	0	0	0	110.5	K815 D816 L817	S813-K815 PolarHBondContact O-N 3.01Å; S813-K815 VanDerWaalsContact O-N 3.1Å; S813-D816 WeakPolarHBondContact CB-OD2 3.39Å; S813-D816 PolarHBondContact O-N 3.35Å; S813-D816 PolarHBondContact OG-N 3.2Å; S813-D816 PolarHBondContact OG-OD2 3.45Å; S813-L817 PolarHBondContact O-N 3.29Å
814	D	71.1	Confident	59.4	Low	78 Å²	78	71.9 Å²	71.9	42%	0.417	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-28.9	-177.9	-53.9	-34.9	0	0	0	111.6	R626 K810 L817 E818	R626-D814 IonicContact NH1-OD1 3.98Å; K810-D814 IonicContact NZ-OD1 2.89Å; K810-D814 PolarHBondContact NZ-OD1 3.05Å; K810-D814 IonicContact NZ-OD2 2.62Å; K810-D814 PolarHBondContact NZ-OD2 3.48Å; D814-L817 PolarHBondContact O-N 2.89Å; D814-E818 WeakPolarHBondContact O-CG 3.49Å; D814-E818 PolarHBondContact O-N 3.01Å
815	K	70.6	Confident	60.7	Low	162 Å²	162	70 Å²	70	70%	0.704	38%	0.379	S	S	*	.	H	α-helix	trans	-67.6	-43.3	173.4	-66.8	-176.3	178.7	-179	0	112.5	S813 L817 E818 I819	S813-K815 PolarHBondContact O-N 3.01Å; S813-K815 VanDerWaalsContact O-N 3.1Å; K815-L817 VanDerWaalsContact C-N 3.29Å; K815-L817 PolarHBondContact O-N 3.13Å; K815-E818 PolarHBondContact O-N 3.42Å; K815-I819 WeakPolarHBondContact O-CD1 3.41Å; K815-I819 VanDerWaalsContact O-CG1 3.26Å; K815-I819 WeakPolarHBondContact O-CG1 3.42Å; K815-I819 PolarHBondContact O-N 3.17Å; K815-I819 VanDerWaalsContact O-N 3.11Å
816	D	71.4	Confident	62.2	Low	38 Å²	38	63.9 Å²	63.9	20%	0.203	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-33.6	176.4	-61.8	-39.5	0	0	0	110.9	I812 S813 I819 L820 F840	I812-D816 HydrophobicContact CG2-CB 3.76Å; S813-D816 WeakPolarHBondContact CB-OD2 3.39Å; S813-D816 PolarHBondContact O-N 3.35Å; S813-D816 PolarHBondContact OG-N 3.2Å; S813-D816 PolarHBondContact OG-OD2 3.45Å; D816-I819 PolarHBondContact O-N 3.47Å; D816-L820 WeakPolarHBondContact O-CB 3.49Å; D816-L820 WeakPolarHBondContact O-CG 3.38Å; D816-L820 PolarHBondContact O-N 3.1Å; D816-F840 HydrophobicContact CB-CE1 4.35Å
817	L	74.1	Confident	63.5	Low	22 Å²	22	66.2 Å²	66.2	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-43.1	174.2	-176	65.1	0	0	0	111.8	A630 I812 S813 D814 K815 I819 L820 L821	A630-L817 HydrophobicContact CB-CD2 4.43Å; I812-L817 HydrophobicContact CG2-CB 4.2Å; S813-L817 PolarHBondContact O-N 3.29Å; D814-L817 PolarHBondContact O-N 2.89Å; K815-L817 VanDerWaalsContact C-N 3.29Å; K815-L817 PolarHBondContact O-N 3.13Å; L817-I819 VanDerWaalsContact C-N 3.32Å; L817-I819 PolarHBondContact O-N 2.67Å; L817-L820 PolarHBondContact O-N 3.26Å; L817-L821 HydrophobicContact CD1-CD1 3.98Å; L817-L821 HydrophobicContact CD1-CG 4.26Å; L817-L821 HydrophobicContact CG-CD1 3.84Å; L817-L821 HydrophobicContact CG-CG 4.48Å; L817-L821 WeakPolarHBondContact O-CB 3.43Å; L817-L821 WeakPolarHBondContact O-CD1 3.35Å; L817-L821 WeakPolarHBondContact O-CG 3.46Å; L817-L821 PolarHBondContact O-N 3.37Å
818	E	75.6	Confident	64.3	Low	125 Å²	125	64.7 Å²	64.7	58%	0.584	36%	0.359	S	S	*	.	H	α-helix	trans	-61.2	-41.8	175.4	-78.8	176.9	178.1	0	0	112	D814 K815 L821 D822	D814-E818 WeakPolarHBondContact O-CG 3.49Å; D814-E818 PolarHBondContact O-N 3.01Å; K815-E818 PolarHBondContact O-N 3.42Å; E818-L821 PolarHBondContact O-N 3.34Å; E818-D822 PolarHBondContact O-N 3.46Å
819	I	75.9	Confident	64.5	Low	64 Å²	64	62.3 Å²	62.3	33%	0.328	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-43.3	175.5	-66.5	165	0	0	0	111.3	K815 D816 L817 L821 D822 M833 F840	K815-I819 WeakPolarHBondContact O-CD1 3.41Å; K815-I819 VanDerWaalsContact O-CG1 3.26Å; K815-I819 WeakPolarHBondContact O-CG1 3.42Å; K815-I819 PolarHBondContact O-N 3.17Å; K815-I819 VanDerWaalsContact O-N 3.11Å; D816-I819 PolarHBondContact O-N 3.47Å; L817-I819 VanDerWaalsContact C-N 3.32Å; L817-I819 PolarHBondContact O-N 2.67Å; I819-L821 PolarHBondContact O-N 3.25Å; I819-D822 PolarHBondContact O-N 3.12Å; I819-M833 HydrophobicContact CG2-CE 3.58Å; I819-M833 HydrophobicContact CG2-SD 3.61Å; I819-F840 HydrophobicContact CG2-CE2 4.46Å; I819-F840 HydrophobicContact CG2-CZ 3.84Å
820	L	74.8	Confident	64.1	Low	2 Å²	2	61.6 Å²	61.6	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-32.2	178	-79.7	171.2	0	0	0	112.9	I482 V484 Y740 I812 D816 L817 F840	I482-L820 HydrophobicContact CG2-CD2 3.67Å; V484-L820 HydrophobicContact CG2-CD2 4.38Å; Y740-L820 PolarHBondContact OH-O 2.97Å; I812-L820 HydrophobicContact CD1-CD1 4.29Å; I812-L820 HydrophobicContact CG2-CD1 4.33Å; D816-L820 WeakPolarHBondContact O-CB 3.49Å; D816-L820 WeakPolarHBondContact O-CG 3.38Å; D816-L820 PolarHBondContact O-N 3.1Å; L817-L820 PolarHBondContact O-N 3.26Å; L820-F840 HydrophobicContact CD1-CD1 4.23Å; L820-F840 HydrophobicContact CD2-CB 3.84Å; L820-F840 HydrophobicContact CD2-CD1 3.75Å; L820-F840 HydrophobicContact CD2-CD2 3.71Å; L820-F840 HydrophobicContact CD2-CE1 4.21Å; L820-F840 HydrophobicContact CD2-CE2 4.16Å; L820-F840 HydrophobicContact CD2-CG 3.49Å; L820-F840 VanDerWaalsContact CD2-CG 3.49Å; L820-F840 HydrophobicContact CD2-CZ 4.39Å; L820-F840 HydrophobicContact CG-CD1 3.97Å; L820-F840 HydrophobicContact CG-CE1 4.13Å; L820-F840 HydrophobicContact CG-CG 4.23Å
821	L	77.2	Confident	63.6	Low	4 Å²	4	69 Å²	69	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	-91.3	-9.4	-179.4	-63.2	171.1	0	0	0	112.6	A630 L631 R634 L817 E818 I819 R823	A630-L821 HydrophobicContact CB-CD1 3.44Å; A630-L821 VanDerWaalsContact CB-CD1 3.44Å; L631-L821 HydrophobicContact CD2-CD2 3.6Å; L631-L821 HydrophobicContact CG-CD2 3.91Å; R634-L821 VanDerWaalsContact NH1-C 3.31Å; R634-L821 VanDerWaalsContact NH1-CB 3.26Å; R634-L821 PolarHBondContact NH1-O 2.81Å; L817-L821 HydrophobicContact CD1-CD1 3.98Å; L817-L821 HydrophobicContact CD1-CG 4.26Å; L817-L821 HydrophobicContact CG-CD1 3.84Å; L817-L821 HydrophobicContact CG-CG 4.48Å; L817-L821 WeakPolarHBondContact O-CB 3.43Å; L817-L821 WeakPolarHBondContact O-CD1 3.35Å; L817-L821 WeakPolarHBondContact O-CG 3.46Å; L817-L821 PolarHBondContact O-N 3.37Å; E818-L821 PolarHBondContact O-N 3.34Å; I819-L821 PolarHBondContact O-N 3.25Å; L821-R823 PolarHBondContact O-N 3.26Å
822	D	76.6	Confident	62.8	Low	60 Å²	60	72.6 Å²	72.6	32%	0.321	40%	0.401	S	S	.	.			trans	-69.6	129.9	-179.5	-165.5	5.1	0	0	0	111.2	E818 I819 S824	E818-D822 PolarHBondContact O-N 3.46Å; I819-D822 PolarHBondContact O-N 3.12Å; D822-S824 VanDerWaalsContact OD1-CB 3.25Å; D822-S824 WeakPolarHBondContact OD1-CB 3.47Å; D822-S824 PolarHBondContact OD1-N 3.27Å; D822-S824 PolarHBondContact OD1-OG 3.15Å
823	R	73.2	Confident	61.7	Low	25 Å²	25	75.8 Å²	75.8	9%	0.094	42%	0.417	C	S	.	.			trans	-114.9	1.6	179.6	-59.4	-172.5	-177.1	-178.7	5.5	112.3	H636 D707 T708 V738 L821 D825 L826	H636-R823 PolarHBondContact CD2-NH2 2.85Å; H636-R823 PolarHBondContact CE1-NH1 2.86Å; H636-R823 PolarHBondContact CE1-NH2 2.87Å; H636-R823 PolarHBondContact ND1-NH1 3.28Å; H636-R823 PolarHBondContact ND1-NH2 3.43Å; D707-R823 IonicContact OD1-NH2 3.57Å; D707-R823 IonicContact OD2-CZ 3.86Å; D707-R823 IonicContact OD2-NH1 3.04Å; D707-R823 PolarHBondContact OD2-NH1 2.99Å; D707-R823 IonicContact OD2-NH2 2.82Å; D707-R823 PolarHBondContact OD2-NH2 3.31Å; T708-R823 PolarHBondContact OG1-NH2 3.36Å; V738-R823 HydrophobicContact CG2-CG 4.19Å; L821-R823 PolarHBondContact O-N 3.26Å; R823-D825 PolarHBondContact O-N 3.42Å; R823-L826 PolarHBondContact O-N 3.28Å
824	S	66.3	Low	60.2	Low	57 Å²	57	83 Å²	83	40%	0.399	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-57.6	-36.6	-177.5	-53	0	0	0	0	112.1	D822 L826 L827	D822-S824 VanDerWaalsContact OD1-CB 3.25Å; D822-S824 WeakPolarHBondContact OD1-CB 3.47Å; D822-S824 PolarHBondContact OD1-N 3.27Å; D822-S824 PolarHBondContact OD1-OG 3.15Å; S824-L826 PolarHBondContact O-N 3.2Å; S824-L827 PolarHBondContact O-N 3.25Å
825	D	65.8	Low	58.5	Low	53 Å²	53	85.9 Å²	85.9	28%	0.283	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-57.4	-31.6	175.6	-55.6	-21.2	0	0	0	113.5	K480 R823 M833	K480-D825 IonicContact NZ-OD2 2.75Å; K480-D825 PolarHBondContact NZ-OD2 3.25Å; R823-D825 PolarHBondContact O-N 3.42Å; D825-M833 WeakPolarHBondContact OD2-CE 3.4Å
826	L	62.6	Low	57	Low	34 Å²	34	86.2 Å²	86.2	18%	0.178	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-86.4	-16.1	-176	-65.2	171.3	0	0	0	113	P478 K480 P736 V738 R823 S824	P478-L826 HydrophobicContact CB-CD2 4.16Å; P478-L826 HydrophobicContact CG-CB 4.33Å; P478-L826 HydrophobicContact CG-CD2 4.04Å; K480-L826 HydrophobicContact CB-CD1 3.94Å; K480-L826 HydrophobicContact CB-CD2 4.17Å; K480-L826 HydrophobicContact CD-CD1 4.39Å; P736-L826 HydrophobicContact CB-CB 4.15Å; P736-L826 HydrophobicContact CB-CD1 4.04Å; V738-L826 HydrophobicContact CG2-CD1 4.23Å; R823-L826 PolarHBondContact O-N 3.28Å; S824-L826 PolarHBondContact O-N 3.2Å
827	L	58.4	Low	55.4	Low	131 Å²	131	91.3 Å²	91.3	69%	0.686	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-94.5	5.4	-179.2	-69.5	167.1	0	0	0	112.9	S824	S824-L827 PolarHBondContact O-N 3.25Å
828	G	48.9	Very low	53.9	Low	65 Å²	65	92.7 Å²	92.7	67%	0.67	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	2.7	171.2	0	0	0	0	0	116.2
829	N	38.3	Very low	52.8	Low	147 Å²	147	88.3 Å²	88.3	79%	0.786	49%	0.488	S	S	*	.			trans	-121	84.7	177.1	-81.9	-7.8	0	0	0	110.8
830	G	32.5	Very low	51.7	Low	56 Å²	56	86.6 Å²	86.6	58%	0.577	48%	0.478	S	S	*	.	S	Bend	trans	161.8	143.6	171	0	0	0	0	0	115.9
831	R	36.2	Very low	50.7	Low	231 Å²	231	92.7 Å²	92.7	87%	0.872	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-57.5	140.7	-173.7	-73.5	168.1	168.1	159.5	-4.3	113.5	M833	R831-M833 PolarHBondContact O-N 3.19Å
832	S	37.5	Very low	49.7	Very low	113 Å²	113	94.2 Å²	94.2	79%	0.79	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-50.9	120.7	168	-171.8	0	0	0	0	111
833	M	40.8	Very low	48.7	Very low	79 Å²	79	93.1 Å²	93.1	39%	0.389	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-71.5	126.4	178.4	-87	-144.8	-100.5	0	0	110.4	I819 D825 R831	I819-M833 HydrophobicContact CG2-CE 3.58Å; I819-M833 HydrophobicContact CG2-SD 3.61Å; D825-M833 WeakPolarHBondContact OD2-CE 3.4Å; R831-M833 PolarHBondContact O-N 3.19Å
834	K	36.2	Very low	47.2	Very low	198 Å²	198	95.2 Å²	95.2	86%	0.861	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-71.4	129.7	168.5	-72.3	-174.8	175.5	-175.5	0	109.6	K836	K834-K836 PolarHBondContact O-N 3.18Å
835	E	36.6	Very low	45.8	Very low	137 Å²	137	94.7 Å²	94.7	64%	0.64	52%	0.517	S	S	*	.			trans	-44.8	124	173.1	-70.6	-178.4	122.3	0	0	111.6
836	K	37.5	Very low	44.3	Very low	169 Å²	169	99.3 Å²	99.3	74%	0.735	53%	0.534	S	S	*	.			trans	-111.2	107.5	159.8	-85.3	-172.9	175.8	179.6	0	108.4	K834 G838	K834-K836 PolarHBondContact O-N 3.18Å; K836-G838 PolarHBondContact O-N 3.43Å
837	V	38.5	Very low	42.9	Very low	146 Å²	146	103 Å²	103	89%	0.885	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	16.3	-175.3	-176.6	0	0	0	0	113.6
838	G	42.7	Very low	41.7	Very low	50 Å²	50	99.1 Å²	99.1	52%	0.515	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-43.6	-165.9	0	0	0	0	0	117.5	K836	K836-G838 PolarHBondContact O-N 3.43Å
839	V	51.5	Low	40.8	Very low	34 Å²	34	100.2 Å²	100.2	21%	0.206	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-32.1	-166.3	-177.5	0	0	0	0	113.1	Y485	Y485-V839 PolarHBondContact N-O 2.81Å
840	F	53.3	Low	40.2	Very low	27 Å²	27	99.3 Å²	99.3	12%	0.118	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	151	177.2	56.8	-88.9	0	0	0	109.7	I482 I483 D816 I819 L820 V842	I482-F840 HydrophobicContact CG2-CB 4.27Å; I482-F840 HydrophobicContact CG2-CD2 4.3Å; I483-F840 CarbonylContact O-C 3.6Å; I483-F840 WeakPolarHBondContact O-CA 3.48Å; I483-F840 VanDerWaalsContact O-CB 3.3Å; I483-F840 WeakPolarHBondContact O-CB 3.27Å; D816-F840 HydrophobicContact CB-CE1 4.35Å; I819-F840 HydrophobicContact CG2-CE2 4.46Å; I819-F840 HydrophobicContact CG2-CZ 3.84Å; L820-F840 HydrophobicContact CD1-CD1 4.23Å; L820-F840 HydrophobicContact CD2-CB 3.84Å; L820-F840 HydrophobicContact CD2-CD1 3.75Å; L820-F840 HydrophobicContact CD2-CD2 3.71Å; L820-F840 HydrophobicContact CD2-CE1 4.21Å; L820-F840 HydrophobicContact CD2-CE2 4.16Å; L820-F840 HydrophobicContact CD2-CG 3.49Å; L820-F840 VanDerWaalsContact CD2-CG 3.49Å; L820-F840 HydrophobicContact CD2-CZ 4.39Å; L820-F840 HydrophobicContact CG-CD1 3.97Å; L820-F840 HydrophobicContact CG-CE1 4.13Å; L820-F840 HydrophobicContact CG-CG 4.23Å; F840-V842 HydrophobicContact CD2-CG2 3.92Å; F840-V842 HydrophobicContact CE2-CG2 3.95Å
841	R	55	Low	40	Very low	130 Å²	130	103.1 Å²	103.1	49%	0.491	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.4	173.8	-173.9	178.9	-176.5	177.2	3.7	108.3	I483 Y485	I483-R841 HydrophobicContact CB-CB 4.31Å; I483-R841 PolarHBondContact N-O 2.98Å; I483-R841 PolarHBondContact O-N 3.26Å; Y485-R841 HydrophobicContact CE2-CB 4.19Å
842	V	55.7	Low	39.3	Very low	36 Å²	36	97.7 Å²	97.7	22%	0.218	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	124.3	171.2	-176	0	0	0	0	107.1	K480 F840 D844	K480-V842 HydrophobicContact CG-CG1 4.27Å; F840-V842 HydrophobicContact CD2-CG2 3.92Å; F840-V842 HydrophobicContact CE2-CG2 3.95Å; V842-D844 WeakPolarHBondContact CG1-OD1 3.43Å
843	I	54.4	Low	38.6	Very low	38 Å²	38	100.4 Å²	100.4	20%	0.195	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	100.4	166.8	-61.6	178.8	0	0	0	105.3	E481 I483	E481-I843 CarbonylContact O-C 3.49Å; E481-I843 PolarHBondContact O-N 3.38Å; E481-I843 VanDerWaalsContact O-O 3.05Å; I483-I843 HydrophobicContact CD1-CD1 3.35Å; I483-I843 HydrophobicContact CD1-CG1 4.02Å; I483-I843 HydrophobicContact CG1-CD1 4.07Å
844	D	41.9	Very low	37.9	Very low	68 Å²	68	106.6 Å²	106.6	36%	0.364	57%	0.568	S	S	.	*			trans	-71.9	139.9	175.7	-87.1	-17	0	0	0	110.2	V842 K846 E847	V842-D844 WeakPolarHBondContact CG1-OD1 3.43Å; D844-K846 PolarHBondContact O-N 3.01Å; D844-K846 VanDerWaalsContact O-N 3.1Å; D844-E847 PolarHBondContact O-N 2.86Å; D844-E847 VanDerWaalsContact O-N 3.16Å
845	A	37.5	Very low	37.9	Very low	47 Å²	47	102 Å²	102	39%	0.388	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	-21.7	172.3	0	0	0	0	0	111.9	S848	A845-S848 WeakPolarHBondContact O-CB 2.98Å; A845-S848 PolarHBondContact O-N 3.01Å; A845-S848 PolarHBondContact O-OG 2.89Å
846	K	34.8	Very low	38	Very low	150 Å²	150	100.2 Å²	100.2	65%	0.652	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-32.2	176.6	-75.7	-171.9	176.1	-174.5	0	114.4	D844 S848 S849 E850	D844-K846 PolarHBondContact O-N 3.01Å; D844-K846 VanDerWaalsContact O-N 3.1Å; K846-S848 PolarHBondContact O-N 3.28Å; K846-S848 VanDerWaalsContact O-N 3.15Å; K846-S849 WeakPolarHBondContact CA-OG 3.48Å; K846-S849 CarbonylContact O-C 3.57Å; K846-S849 PolarHBondContact O-N 2.83Å; K846-S849 PolarHBondContact O-OG 3.36Å; K846-S849 VanDerWaalsContact O-OG 3.06Å; K846-E850 PolarHBondContact O-N 3.48Å
847	E	33.1	Very low	38	Very low	112 Å²	112	96.3 Å²	96.3	52%	0.523	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.4	170.2	-74.1	-172.8	149.3	0	0	112	D844	D844-E847 PolarHBondContact O-N 2.86Å; D844-E847 VanDerWaalsContact O-N 3.16Å
848	S	32.9	Very low	38	Very low	49 Å²	49	93.4 Å²	93.4	34%	0.343	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.3	171.9	78.9	0	0	0	0	114.4	A845 K846	A845-S848 WeakPolarHBondContact O-CB 2.98Å; A845-S848 PolarHBondContact O-N 3.01Å; A845-S848 PolarHBondContact O-OG 2.89Å; K846-S848 PolarHBondContact O-N 3.28Å; K846-S848 VanDerWaalsContact O-N 3.15Å
849	S	29.2	Very low	37.7	Very low	87 Å²	87	96.1 Å²	96.1	61%	0.608	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-24.1	179.7	55.6	0	0	0	0	114.8	K846	K846-S849 WeakPolarHBondContact CA-OG 3.48Å; K846-S849 CarbonylContact O-C 3.57Å; K846-S849 PolarHBondContact O-N 2.83Å; K846-S849 PolarHBondContact O-OG 3.36Å; K846-S849 VanDerWaalsContact O-OG 3.06Å
850	E	27.2	Very low	36.8	Very low	129 Å²	129	100.3 Å²	100.3	60%	0.603	54%	0.539	S	S	*	.			trans	-126.2	90.8	-178.2	-72.8	178.9	164.7	0	0	110.3	K846	K846-E850 PolarHBondContact O-N 3.48Å
851	I	26.6	Very low	35.6	Very low	136 Å²	136	105.5 Å²	105.5	70%	0.697	57%	0.569	S	S	*	*			trans	-91.2	89.2	148.8	-58.8	172.7	0	0	0	104.6
852	T	21.9	Very low	34.1	Very low	116 Å²	116	103.6 Å²	103.6	71%	0.712	58%	0.575	S	S	*	*			trans	-67	128.8	168.4	27	0	0	0	0	109.5	T854	T852-T854 PolarHBondContact O-N 3.45Å
853	L	23.4	Very low	32.3	Very low	171 Å²	171	109.3 Å²	109.3	90%	0.895	61%	0.605	S	S	*	*			trans	-52.1	119.8	174.9	-75.6	145.3	0	0	0	111.7
854	T	24.9	Very low	30.3	Very low	208 Å²	208	115.7 Å²	115.7	100%	1.276	64%	0.642	S	S	*	*			trans	-128.5	0	138.5	49.9	0	0	0	0	108.1	T852	T852-T854 PolarHBondContact O-N 3.45Å

Retrieved 854 of 854 residues in 4841.8 ms (Link to these results)

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