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Kinetochore protein NDC80

Acts as a component of the essential kinetochore-associated NDC80 complex, which is required for chromosome segregation and spindle checkpoint activity. Required for kinetochore integrity and the organization of stable microtubule binding sites in the outer plate of the kinetochore. The NDC80 complex synergistically enhances the affinity of the SKA1 complex for microtubules and may allow the NDC80 complex to track depolymerizing microtubules. Plays a role in chromosome congression and is essential for the end-on attachment of the kinetochores to spindle microtubules.

AlphaFold DB , UniProt , Accession A0A096N7Z4, Species PAPAN (Papio anubis, Olive baboon), Gene NDC80, Length 642 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	35.2	Very low	248 Å²	248	134.2 Å²	134.2	100%	1.222	82%	0.823	S	S	*	*				0	179.1	0	-82.5	-176.4	170.2	0	0	109.5
2	K	34.9	Very low	34.9	Very low	186 Å²	186	129 Å²	129	81%	0.809	82%	0.816	S	S	*	*			trans	-48.6	155.2	170.2	-63.9	168.6	-176.3	171.4	0	111.5
3	R	36.6	Very low	34.8	Very low	217 Å²	217	136.5 Å²	136.5	82%	0.819	82%	0.819	S	S	*	*			cis	-162.9	166.3	6.8	-128.7	175.2	-175.1	179.3	-2.2	111.2
4	S	37.1	Very low	34.7	Very low	92 Å²	92	137.8 Å²	137.8	64%	0.643	82%	0.818	S	S	*	*			trans	-1.7	148.9	145.7	55.9	0	0	0	0	119.9
5	S	39.8	Very low	34.6	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	82%	0.82	S	S	*	*			cis	179.2	179.6	11.2	36.7	0	0	0	0	113.5
6	V	35.9	Very low	34.7	Very low	136 Å²	136	138.4 Å²	138.4	82%	0.824	82%	0.82	S	S	*	*			trans	89.2	140.5	159	-171.6	0	0	0	0	116.2
7	S	33.3	Very low	34.6	Very low	83 Å²	83	139.1 Å²	139.1	58%	0.58	81%	0.813	S	S	*	*			cis	-176.9	145.7	-33.6	-176.6	0	0	0	0	108.2
8	T	35.9	Very low	34.3	Very low	137 Å²	137	139.6 Å²	139.6	84%	0.84	81%	0.806	S	S	*	*			trans	43.8	135.7	153.1	46.7	0	0	0	0	120.9
9	G	33	Very low	34.2	Very low	79 Å²	79	138.8 Å²	138.8	81%	0.814	80%	0.798	S	S	*	*			cis	134.8	118.1	9.5	0	0	0	0	0	110.3
10	G	30.9	Very low	33.9	Very low	83 Å²	83	142.8 Å²	142.8	86%	0.856	80%	0.799	S	S	*	*			trans	-90.2	177.7	-169	0	0	0	0	0	116.6
11	A	34.5	Very low	33.9	Very low	112 Å²	112	140.5 Å²	140.5	93%	0.926	79%	0.793	S	S	*	*			trans	-71.5	162	-173.9	0	0	0	0	0	115.7
12	G	32	Very low	33.8	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	77%	0.772	S	S	*	*			trans	163.7	96.2	156.9	0	0	0	0	0	119.5
13	R	34	Very low	33.6	Very low	227 Å²	227	133.8 Å²	133.8	86%	0.857	77%	0.765	S	S	*	*			trans	44.2	122.2	142.3	-71.7	-178.8	170.6	-116.5	-1.4	122.6
14	L	33.4	Very low	33.4	Very low	154 Å²	154	128.8 Å²	128.8	81%	0.806	76%	0.759	S	S	*	*				44.9	127.2	121	-60.2	168.3	0	0	0	121.5
15	S	32.7	Very low	33.1	Very low	121 Å²	121	130.4 Å²	130.4	85%	0.846	76%	0.76	S	S	*	*			trans	-148.6	169.4	141.4	-166.2	0	0	0	0	110.3
16	M	35.6	Very low	33	Very low	164 Å²	164	134.5 Å²	134.5	81%	0.808	77%	0.765	S	S	*	*			trans	-128.4	168.7	-175.6	-71	-132.2	-55.8	0	0	113.6
17	Q	33.7	Very low	33	Very low	151 Å²	151	136.6 Å²	136.6	71%	0.706	77%	0.766	S	S	*	*			trans	102.2	95.4	139.5	-157.6	152.7	9.7	0	0	120.1
18	E	29.8	Very low	33	Very low	147 Å²	147	135.8 Å²	135.8	69%	0.687	77%	0.77	S	S	*	*				79.1	150.9	127.8	-83.5	-170.7	114.8	0	0	126.4
19	L	32.1	Very low	32.9	Very low	126 Å²	126	137.4 Å²	137.4	66%	0.66	77%	0.773	S	S	*	*			trans	76	88.6	147.2	-72.9	161.8	0	0	0	122.1
20	R	28.8	Very low	32.9	Very low	218 Å²	218	143.4 Å²	143.4	82%	0.823	77%	0.772	S	S	*	*				59.9	117.1	106.3	-167.5	-168.6	-159.5	171.1	6.1	119.2
21	S	32.9	Very low	33	Very low	95 Å²	95	145.1 Å²	145.1	66%	0.664	77%	0.766	S	S	*	*				169	137.8	114.8	-74.2	0	0	0	0	115.1
22	Q	32.2	Very low	34	Very low	169 Å²	169	145.4 Å²	145.4	79%	0.79	76%	0.759	S	S	*	*			trans	58.1	149.5	134.9	-67.5	-156.1	-78.7	0	0	122.6
23	D	31.1	Very low	34	Very low	124 Å²	124	150.1 Å²	150.1	66%	0.663	76%	0.761	S	S	*	*			cis	-169.4	172.3	-21.4	-133.4	-42.8	0	0	0	113.2
24	V	33.5	Very low	34	Very low	112 Å²	112	144.4 Å²	144.4	68%	0.679	75%	0.752	S	S	*	*			trans	77.5	141.4	146.5	163.5	0	0	0	0	124.7
25	N	31	Very low	34	Very low	126 Å²	126	145.8 Å²	145.8	67%	0.674	75%	0.752	S	S	*	*			trans	77.7	128.8	164.6	-80.8	-18.7	0	0	0	119.8
26	K	36.7	Very low	33.9	Very low	189 Å²	189	147.8 Å²	147.8	82%	0.822	75%	0.748	S	S	*	*			cis	73.3	145.7	28.4	-55	-176.8	174.9	176.6	0	114
27	Q	35.6	Very low	33.8	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	75%	0.75	S	S	*	*			cis	-137.1	-177.4	25.1	-57.1	171.3	14.6	0	0	110.3
28	G	33.1	Very low	34.3	Very low	65 Å²	65	149.3 Å²	149.3	67%	0.67	75%	0.753	S	S	*	*			cis	125.1	132.3	-0.6	0	0	0	0	0	113.5
29	L	34.2	Very low	34.4	Very low	171 Å²	171	149.2 Å²	149.2	90%	0.895	76%	0.763	S	S	*	*			trans	-172	159.9	171.4	-94	176	0	0	0	109.7
30	Y	32.2	Very low	34.4	Very low	206 Å²	206	153.6 Å²	153.6	81%	0.808	78%	0.777	S	S	*	*				-148.5	158.8	-66.1	-144.9	-92	0	0	0	111.7
31	T	33.2	Very low	34.6	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.724	78%	0.778	S	S	*	*			trans	-147.7	148.7	178.6	58.2	0	0	0	0	114.4
32	P	56.6	Low	34.5	Very low	119 Å²	119	152 Å²	152	77%	0.773	79%	0.787	S	S	*	*				-127.7	-170.4	129.9	36.7	-23.3	0	0	0	109
33	Q	31.5	Very low	34.4	Very low	170 Å²	170	151.7 Å²	151.7	79%	0.794	79%	0.79	S	S	*	*			cis	-138.9	173.5	11.4	-68.5	-171.7	58.1	0	0	107.6
34	T	34.2	Very low	34.2	Very low	108 Å²	108	150.8 Å²	150.8	66%	0.663	79%	0.793	S	S	*	*			cis	-158.8	144.6	-8.3	18.9	0	0	0	0	104.7
35	K	34.2	Very low	34.1	Very low	183 Å²	183	152.4 Å²	152.4	80%	0.796	80%	0.796	S	S	*	*				56.3	127.1	73.3	-70	-169.2	179.1	-175.8	0	114.1
36	E	29.7	Very low	34	Very low	163 Å²	163	154.3 Å²	154.3	76%	0.762	81%	0.807	S	S	*	*			cis	-130	161.1	8.8	-67.9	-155.9	146.5	0	0	110
37	R	33.2	Very low	33.8	Very low	228 Å²	228	153.9 Å²	153.9	86%	0.86	81%	0.805	S	S	*	*			cis	150.1	148.5	-0.3	-151.5	-179.7	-169.8	-165	0	104.3
38	P	44	Very low	34.2	Very low	118 Å²	118	151.5 Å²	151.5	77%	0.766	81%	0.805	S	S	*	*			trans	-128.5	-180	-153.6	43.6	-30	0	0	0	116.7
39	T	31.5	Very low	34.1	Very low	146 Å²	146	155.2 Å²	155.2	90%	0.896	82%	0.815	S	S	*	*			trans	-139.3	157.3	166.4	-30.6	0	0	0	0	112.4
40	F	33.2	Very low	34	Very low	218 Å²	218	151.5 Å²	151.5	96%	0.956	80%	0.803	S	S	*	*			trans	-82.6	160	-173.5	-82.1	-117.5	0	0	0	115
41	G	31.9	Very low	34.1	Very low	81 Å²	81	149.1 Å²	149.1	84%	0.835	80%	0.799	S	S	*	*			trans	172.5	129.1	157.8	0	0	0	0	0	114.4
42	K	32.1	Very low	33.9	Very low	198 Å²	198	155.4 Å²	155.4	86%	0.861	81%	0.81	S	S	*	*			trans	-104.4	140.5	178.6	-81.1	-177	177.7	178.1	0	112.7
43	L	29	Very low	32.8	Very low	163 Å²	163	158.2 Å²	158.2	85%	0.853	81%	0.81	S	S	*	*			trans	37.7	126.7	136.9	-56.9	170	0	0	0	120.7
44	S	26.9	Very low	32.7	Very low	104 Å²	104	156.5 Å²	156.5	73%	0.727	81%	0.811	S	S	*	*				134.8	138.7	110.6	-154.2	0	0	0	0	115.7
45	I	31.6	Very low	32.6	Very low	146 Å²	146	156 Å²	156	75%	0.749	81%	0.812	S	S	*	*			trans	35.2	133	159.8	-87.1	64.2	0	0	0	119.9
46	N	30	Very low	32.6	Very low	166 Å²	166	154.6 Å²	154.6	89%	0.888	81%	0.812	S	S	*	*			trans	-143.5	136.9	153.8	-100.3	-42	0	0	0	112.1
47	K	32.6	Very low	32.7	Very low	181 Å²	181	156.2 Å²	156.2	79%	0.787	82%	0.817	S	S	*	*			trans	-90.4	152.3	156.9	-76.8	-178.9	174.4	179.9	0	108.5
48	P	43.4	Very low	32.6	Very low	130 Å²	130	149.3 Å²	149.3	84%	0.844	82%	0.817	S	S	*	*			trans	-73.1	155.6	165	32	-33.9	0	0	0	111.7
49	T	31.5	Very low	32.1	Very low	143 Å²	143	152.8 Å²	152.8	88%	0.877	82%	0.82	S	S	*	*			trans	-113.3	174.8	-176.9	42.8	0	0	0	0	112.8
50	S	32.6	Very low	32.1	Very low	92 Å²	92	157.7 Å²	157.7	64%	0.643	82%	0.822	S	S	*	*			trans	-92	162.6	-170.5	-162.8	0	0	0	0	115
51	E	32.5	Very low	32	Very low	157 Å²	157	153.7 Å²	153.7	73%	0.734	82%	0.816	S	S	*	*			trans	63	123.4	151	-81.4	153.3	-95.7	0	0	122.5
52	R	30.7	Very low	32.1	Very low	249 Å²	249	155.6 Å²	155.6	94%	0.94	82%	0.816	S	S	*	*				-152.5	162	107.9	-110.9	173.4	-170.1	-170.8	3.3	114
53	K	32.3	Very low	32	Very low	178 Å²	178	149.2 Å²	149.2	77%	0.774	81%	0.807	S	S	*	*			trans	-73.9	170.7	-173.1	-57.9	168.6	-178.4	177	0	110.9
54	V	30.6	Very low	32.2	Very low	134 Å²	134	151.2 Å²	151.2	81%	0.812	81%	0.811	S	S	*	*			cis	-157.8	149.7	31.2	-141.1	0	0	0	0	113.5
55	S	32.2	Very low	32.3	Very low	98 Å²	98	149.9 Å²	149.9	69%	0.685	82%	0.815	S	S	*	*			trans	17.1	124.5	146.9	-163.4	0	0	0	0	122.1
56	L	33.3	Very low	32.2	Very low	153 Å²	153	148.7 Å²	148.7	80%	0.801	82%	0.819	S	S	*	*				-178.6	166	107.6	-95.8	167.9	0	0	0	111.9
57	F	31.7	Very low	32.3	Very low	197 Å²	197	152.3 Å²	152.3	86%	0.864	82%	0.82	S	S	*	*			trans	56.6	92.1	177.8	-81.1	-85.1	0	0	0	118.1
58	G	31.3	Very low	32.3	Very low	84 Å²	84	151 Å²	151	87%	0.866	82%	0.822	S	S	*	*			trans	-88.8	127.4	159.1	0	0	0	0	0	111.7
59	K	33.6	Very low	31.7	Very low	191 Å²	191	149.5 Å²	149.5	83%	0.83	81%	0.814	S	S	*	*			trans	-135.9	104.3	169.6	-164.3	174.3	-173.8	179.3	0	110
60	R	31.1	Very low	31.8	Very low	248 Å²	248	151.6 Å²	151.6	94%	0.936	81%	0.814	S	S	*	*			trans	-68.2	137.1	174	-78.5	178.9	156.7	-154.7	-5.5	110
61	T	32.3	Very low	31.7	Very low	134 Å²	134	154 Å²	154	82%	0.822	82%	0.819	S	S	*	*			trans	-132.9	107.7	165.2	47.3	0	0	0	0	109.3
62	S	32.9	Very low	31.7	Very low	121 Å²	121	150.2 Å²	150.2	85%	0.846	82%	0.822	S	S	*	*			trans	-116.3	135.8	170.1	50.3	0	0	0	0	108.3
63	G	30.6	Very low	31.8	Very low	65 Å²	65	143.7 Å²	143.7	67%	0.67	80%	0.804	S	S	*	*			trans	-179.8	148.9	174.5	0	0	0	0	0	109.8
64	H	32.6	Very low	31.7	Very low	204 Å²	204	143.8 Å²	143.8	94%	0.944	81%	0.805	S	S	*	*			cis	-137.4	147.6	12.4	-64.3	69	0	0	0	110.3
65	G	28.9	Very low	31.8	Very low	77 Å²	77	143.1 Å²	143.1	79%	0.794	81%	0.807	S	S	*	*			trans	-177	119.4	176.1	0	0	0	0	0	113.5
66	S	30.9	Very low	32	Very low	120 Å²	120	143 Å²	143	84%	0.839	81%	0.806	S	S	*	*			trans	27.2	107.8	167.6	-140.7	0	0	0	0	121.1	N68	S66-N68 PolarHBondContact O-N 2.57Å
67	R	32	Very low	32.3	Very low	243 Å²	243	141.1 Å²	141.1	92%	0.917	81%	0.806	S	S	*	*			trans	-14	110.7	151.8	-56.6	164	80.2	162	4.8	115.6	S69	R67-S69 PolarHBondContact O-N 3.05Å
68	N	31	Very low	33	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	80%	0.804	S	S	*	*			trans	-69	123	166	-169	12.2	0	0	0	110.3	S66 Q70	S66-N68 PolarHBondContact O-N 2.57Å; N68-Q70 PolarHBondContact O-N 3.15Å
69	S	31	Very low	34.3	Very low	97 Å²	97	145.9 Å²	145.9	68%	0.678	81%	0.805	S	S	*	*			trans	-86	74.1	-171.7	56.1	0	0	0	0	112.5	R67 L71	R67-S69 PolarHBondContact O-N 3.05Å; S69-L71 PolarHBondContact O-N 2.68Å
70	Q	33.3	Very low	36.4	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	80%	0.795	S	S	*	*			trans	-69.9	93.3	173.3	-165.4	167.9	7.5	0	0	109.8	N68 G72	N68-Q70 PolarHBondContact O-N 3.15Å; Q70-G72 PolarHBondContact O-N 2.88Å
71	L	31.3	Very low	38.8	Very low	143 Å²	143	139.6 Å²	139.6	75%	0.749	79%	0.789	S	S	*	*			trans	-76.6	46.1	-165.6	-151.3	87.8	0	0	0	114.7	S69 I73	S69-L71 PolarHBondContact O-N 2.68Å; L71-I73 VanDerWaalsContact C-N 3.27Å; L71-I73 HydrophobicContact CD1-CD1 4.07Å; L71-I73 HydrophobicContact CG-CD1 4.11Å; L71-I73 HydrophobicContact CG-CG1 4.32Å; L71-I73 PolarHBondContact O-N 3.38Å
72	G	33.3	Very low	41.3	Very low	77 Å²	77	134.8 Å²	134.8	79%	0.794	76%	0.758	S	S	*	*			trans	-78.3	68.4	173.7	0	0	0	0	0	112.4	Q70	Q70-G72 PolarHBondContact O-N 2.88Å
73	I	31.6	Very low	43.9	Very low	112 Å²	112	134.4 Å²	134.4	57%	0.574	75%	0.753	S	S	*	*			trans	-96.2	149	177.7	-49.8	-179.5	0	0	0	109.3	L71	L71-I73 VanDerWaalsContact C-N 3.27Å; L71-I73 HydrophobicContact CD1-CD1 4.07Å; L71-I73 HydrophobicContact CG-CD1 4.11Å; L71-I73 HydrophobicContact CG-CG1 4.32Å; L71-I73 PolarHBondContact O-N 3.38Å
74	F	31	Very low	46.8	Very low	180 Å²	180	133.6 Å²	133.6	79%	0.789	73%	0.729	S	S	*	*			trans	72.6	70.9	179.7	-51.4	-69.6	0	0	0	116.9
75	S	31.3	Very low	49.5	Very low	121 Å²	121	127.2 Å²	127.2	85%	0.846	71%	0.706	S	S	*	*			trans	-132.8	19.6	151.7	-156.6	0	0	0	0	113.1	S77	S75-S77 PolarHBondContact O-N 2.95Å
76	S	36.3	Very low	52.3	Low	95 Å²	95	124.3 Å²	124.3	66%	0.664	67%	0.672	S	S	*	*			trans	-82.7	95.1	163.8	50.9	0	0	0	0	108.4	E78	S76-E78 PolarHBondContact O-N 2.64Å
77	S	41.5	Very low	54.9	Low	114 Å²	114	126.4 Å²	126.4	80%	0.797	67%	0.674	S	S	*	*			trans	-78.3	45.8	-170.6	51.7	0	0	0	0	114.9	S75 K79	S75-S77 PolarHBondContact O-N 2.95Å; S77-K79 PolarHBondContact O-N 2.91Å
78	E	45.2	Very low	57.8	Low	179 Å²	179	118.3 Å²	118.3	84%	0.836	65%	0.649	S	S	*	*			trans	-57.6	119.7	147.1	-70	-164.2	145.7	0	0	107.1	S76 I80	S76-E78 PolarHBondContact O-N 2.64Å; E78-I80 PolarHBondContact O-N 3.04Å
79	K	58.9	Low	60.5	Low	201 Å²	201	119.4 Å²	119.4	87%	0.874	65%	0.646	S	S	*	*			trans	-68.3	98	179.1	-67.3	179.7	-178.8	177.8	0	107.7	S77 K81	S77-K79 PolarHBondContact O-N 2.91Å; K79-K81 PolarHBondContact O-N 3.39Å
80	I	78.5	Confident	63.5	Low	123 Å²	123	117.9 Å²	117.9	63%	0.631	64%	0.639	S	S	*	*			trans	-54.6	115.8	-178.4	-147.8	169.7	0	0	0	107.8	E78 F162	E78-I80 PolarHBondContact O-N 3.04Å; I80-F162 HydrophobicContact CG2-CE1 3.84Å; I80-F162 HydrophobicContact CG2-CZ 4.43Å
81	K	79.8	Confident	66.3	Low	185 Å²	185	111 Å²	111	80%	0.804	61%	0.607	S	S	*	*			trans	-76.3	133.3	-174.6	-173.5	-178.2	176.7	-173.1	0	107.8	K79 P83	K79-K81 PolarHBondContact O-N 3.39Å; K81-P83 VanDerWaalsContact O-CD 3.31Å; K81-P83 WeakPolarHBondContact O-CD 3.39Å; K81-P83 VanDerWaalsContact O-N 3.13Å
82	D	86.1	Confident	69.2	Low	32 Å²	32	105 Å²	105	17%	0.171	58%	0.575	C	S	.	*			trans	-57.2	119.3	177	-161.5	-28.3	0	0	0	109.9	R84 F162	D82-R84 PolarHBondContact O-N 2.65Å; D82-R84 WeakPolarHBondContact OD1-CB 3.49Å; D82-R84 WeakPolarHBondContact OD1-CG 3.1Å; D82-R84 IonicContact OD1-CZ 3.62Å; D82-R84 PolarHBondContact OD1-N 2.7Å; D82-R84 IonicContact OD1-NE 2.74Å; D82-R84 PolarHBondContact OD1-NE 2.95Å; D82-R84 IonicContact OD1-NH2 3.71Å; D82-R84 IonicContact OD2-CZ 2.67Å; D82-R84 IonicContact OD2-NE 3.24Å; D82-R84 PolarHBondContact OD2-NE 2.97Å; D82-R84 IonicContact OD2-NH2 3.35Å; D82-R84 PolarHBondContact OD2-NH2 2.75Å; D82-F162 VanDerWaalsContact CA-CE1 3.46Å; D82-F162 HydrophobicContact CB-CD1 4.09Å; D82-F162 HydrophobicContact CB-CE1 3.77Å; D82-F162 HydrophobicContact CB-CE2 4.46Å; D82-F162 HydrophobicContact CB-CZ 3.98Å
83	P	87.8	Confident	72	Confident	113 Å²	113	104.7 Å²	104.7	73%	0.734	55%	0.553	S	S	*	*			trans	-74.9	-14	178.7	31.5	-35.8	0	0	0	112	K81	K81-P83 VanDerWaalsContact O-CD 3.31Å; K81-P83 WeakPolarHBondContact O-CD 3.39Å; K81-P83 VanDerWaalsContact O-N 3.13Å
84	R	90.3	Very high	74.9	Confident	49 Å²	49	103.3 Å²	103.3	19%	0.185	54%	0.544	C	S	.	.	S	Bend	trans	-74.5	133.8	178.4	-61.1	171.2	-66.2	-179.4	6	109.5	D82 L86 F91 Y160 F162 A183	D82-R84 PolarHBondContact O-N 2.65Å; D82-R84 WeakPolarHBondContact OD1-CB 3.49Å; D82-R84 WeakPolarHBondContact OD1-CG 3.1Å; D82-R84 IonicContact OD1-CZ 3.62Å; D82-R84 PolarHBondContact OD1-N 2.7Å; D82-R84 IonicContact OD1-NE 2.74Å; D82-R84 PolarHBondContact OD1-NE 2.95Å; D82-R84 IonicContact OD1-NH2 3.71Å; D82-R84 IonicContact OD2-CZ 2.67Å; D82-R84 IonicContact OD2-NE 3.24Å; D82-R84 PolarHBondContact OD2-NE 2.97Å; D82-R84 IonicContact OD2-NH2 3.35Å; D82-R84 PolarHBondContact OD2-NH2 2.75Å; R84-L86 HydrophobicContact CB-CD2 3.85Å; R84-L86 HydrophobicContact CB-CG 4.42Å; R84-L86 PolarHBondContact O-N 3.09Å; R84-F91 HydrophobicContact CB-CE1 3.82Å; R84-F91 HydrophobicContact CB-CZ 3.77Å; R84-F91 HydrophobicContact CG-CZ 4.01Å; R84-Y160 PolarHBondContact NH2-OH 3.49Å; R84-F162 VanDerWaalsContact NH2-CD2 3.28Å; R84-A183 PolarHBondContact NH1-O 2.64Å
85	P	89.8	Confident	77.9	Confident	69 Å²	69	94.9 Å²	94.9	45%	0.448	51%	0.507	S	S	.	.			trans	-79.2	69.6	-177.3	32.8	-35.3	0	0	0	111	N87 D88 F91	P85-N87 PolarHBondContact O-N 2.96Å; P85-D88 HydrophobicContact CB-CB 4.13Å; P85-D88 WeakPolarHBondContact O-CB 3.15Å; P85-D88 PolarHBondContact O-N 3.03Å; P85-F91 HydrophobicContact CG-CB 3.8Å; P85-F91 HydrophobicContact CG-CD1 4.14Å; P85-F91 HydrophobicContact CG-CD2 3.96Å; P85-F91 HydrophobicContact CG-CG 3.69Å
86	L	87.8	Confident	80.8	Confident	16 Å²	16	89.1 Å²	89.1	8%	0.084	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.4	-174.8	-55.8	-172.8	0	0	0	114.7	R84 F91 I92 P179 H180 A183	R84-L86 HydrophobicContact CB-CD2 3.85Å; R84-L86 HydrophobicContact CB-CG 4.42Å; R84-L86 PolarHBondContact O-N 3.09Å; L86-F91 HydrophobicContact CD2-CE1 3.95Å; L86-I92 HydrophobicContact CD2-CD1 4.35Å; L86-P179 WeakPolarHBondContact O-CB 3.27Å; L86-H180 HydrophobicContact CD1-CB 4.49Å; L86-H180 WeakPolarHBondContact CD1-CD2 3.27Å; L86-A183 HydrophobicContact CD2-CB 3.57Å
87	N	86.1	Confident	83.5	Confident	164 Å²	164	90.1 Å²	90.1	88%	0.877	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-10.8	174.3	-68	-18.1	0	0	0	113.4	P85	P85-N87 PolarHBondContact O-N 2.96Å
88	D	91.8	Very high	86	Confident	73 Å²	73	87.4 Å²	87.4	39%	0.39	43%	0.431	S	S	.	.			trans	-84.8	125.3	176.6	173.2	31.8	0	0	0	111.2	P85 A90 F91 I92	P85-D88 HydrophobicContact CB-CB 4.13Å; P85-D88 WeakPolarHBondContact O-CB 3.15Å; P85-D88 PolarHBondContact O-N 3.03Å; D88-A90 VanDerWaalsContact C-N 3.31Å; D88-A90 PolarHBondContact O-N 3.25Å; D88-A90 PolarHBondContact OD1-N 3.17Å; D88-A90 WeakPolarHBondContact OD2-CB 3.31Å; D88-F91 HydrophobicContact CB-CB 4.22Å; D88-F91 PolarHBondContact OD2-N 3.13Å; D88-I92 WeakPolarHBondContact O-CG1 3.11Å; D88-I92 PolarHBondContact O-N 3.3Å; D88-I92 VanDerWaalsContact O-N 3.16Å
89	K	88.5	Confident	88.3	Confident	177 Å²	177	78.9 Å²	78.9	77%	0.77	39%	0.391	S	S	*	.	H	α-helix	trans	-65.3	-33.3	177.4	-64.3	-179.9	-178.9	177.7	0	111.9	Q93	K89-Q93 VanDerWaalsContact O-CG 3.3Å; K89-Q93 WeakPolarHBondContact O-CG 3.46Å; K89-Q93 PolarHBondContact O-N 3.37Å
90	A	92.4	Very high	89.9	Confident	65 Å²	65	70 Å²	70	54%	0.537	35%	0.354	S	S	.	.	H	α-helix	trans	-68.5	-47.3	-179.5	0	0	0	0	0	111.1	D88 I92 Q93 Q94	D88-A90 VanDerWaalsContact C-N 3.31Å; D88-A90 PolarHBondContact O-N 3.25Å; D88-A90 PolarHBondContact OD1-N 3.17Å; D88-A90 WeakPolarHBondContact OD2-CB 3.31Å; A90-I92 PolarHBondContact O-N 3.01Å; A90-Q93 PolarHBondContact O-N 3.41Å; A90-Q94 PolarHBondContact O-N 2.86Å
91	F	93.3	Very high	90.6	Very high	44 Å²	44	68 Å²	68	19%	0.193	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-46.4	172.6	-178.2	-101.9	0	0	0	112.9	R84 P85 L86 D88 Q93 Q94 C95	R84-F91 HydrophobicContact CB-CE1 3.82Å; R84-F91 HydrophobicContact CB-CZ 3.77Å; R84-F91 HydrophobicContact CG-CZ 4.01Å; P85-F91 HydrophobicContact CG-CB 3.8Å; P85-F91 HydrophobicContact CG-CD1 4.14Å; P85-F91 HydrophobicContact CG-CD2 3.96Å; P85-F91 HydrophobicContact CG-CG 3.69Å; L86-F91 HydrophobicContact CD2-CE1 3.95Å; D88-F91 HydrophobicContact CB-CB 4.22Å; D88-F91 PolarHBondContact OD2-N 3.13Å; F91-Q93 PolarHBondContact O-N 3.31Å; F91-Q94 WeakPolarHBondContact O-CA 3.08Å; F91-Q94 WeakPolarHBondContact O-CB 3.4Å; F91-Q94 PolarHBondContact O-N 3.07Å; F91-Q94 VanDerWaalsContact O-N 3.09Å; F91-C95 VanDerWaalsContact CE1-SG 3.57Å; F91-C95 VanDerWaalsContact CZ-SG 3.58Å; F91-C95 PolarHBondContact O-N 3.34Å
92	I	92	Very high	91.2	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.077	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-35.9	179.3	-63.6	-54.7	0	0	0	112.5	L86 D88 A90 Q94 C95 I96 P179 V182	L86-I92 HydrophobicContact CD2-CD1 4.35Å; D88-I92 WeakPolarHBondContact O-CG1 3.11Å; D88-I92 PolarHBondContact O-N 3.3Å; D88-I92 VanDerWaalsContact O-N 3.16Å; A90-I92 PolarHBondContact O-N 3.01Å; I92-Q94 VanDerWaalsContact C-N 3.32Å; I92-Q94 PolarHBondContact O-N 3.42Å; I92-C95 PolarHBondContact O-N 2.88Å; I92-I96 HydrophobicContact CG2-CD1 4.03Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.38Å; I92-I96 PolarHBondContact O-N 3.32Å; I92-P179 HydrophobicContact CD1-CB 3.7Å; I92-P179 HydrophobicContact CG1-CB 3.96Å; I92-P179 HydrophobicContact CG1-CG 4.45Å; I92-V182 HydrophobicContact CD1-CG1 4.24Å; I92-V182 HydrophobicContact CG2-CG1 4.21Å
93	Q	91.8	Very high	91.5	Very high	71 Å²	71	58.4 Å²	58.4	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-33.1	171.1	-67.6	-58.2	-32.7	0	0	112.5	K89 A90 F91 R97	K89-Q93 VanDerWaalsContact O-CG 3.3Å; K89-Q93 WeakPolarHBondContact O-CG 3.46Å; K89-Q93 PolarHBondContact O-N 3.37Å; A90-Q93 PolarHBondContact O-N 3.41Å; F91-Q93 PolarHBondContact O-N 3.31Å; Q93-R97 WeakPolarHBondContact O-CB 3.48Å; Q93-R97 PolarHBondContact O-N 3.43Å
94	Q	93.3	Very high	91.7	Very high	84 Å²	84	57.6 Å²	57.6	39%	0.393	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-43.4	172.5	176.6	173.2	-13.6	0	0	111.8	A90 F91 I92 R97 Q98	A90-Q94 PolarHBondContact O-N 2.86Å; F91-Q94 WeakPolarHBondContact O-CA 3.08Å; F91-Q94 WeakPolarHBondContact O-CB 3.4Å; F91-Q94 PolarHBondContact O-N 3.07Å; F91-Q94 VanDerWaalsContact O-N 3.09Å; I92-Q94 VanDerWaalsContact C-N 3.32Å; I92-Q94 PolarHBondContact O-N 3.42Å; Q94-R97 PolarHBondContact O-N 2.8Å; Q94-Q98 WeakPolarHBondContact O-CG 3.33Å; Q94-Q98 PolarHBondContact O-N 3.46Å
95	C	93.4	Very high	91.7	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.5	-67.1	0	0	0	0	112.3	F91 I92 R97 Q98 L99 V182 V186	F91-C95 VanDerWaalsContact CE1-SG 3.57Å; F91-C95 VanDerWaalsContact CZ-SG 3.58Å; F91-C95 PolarHBondContact O-N 3.34Å; I92-C95 PolarHBondContact O-N 2.88Å; C95-R97 VanDerWaalsContact C-N 3.27Å; C95-R97 PolarHBondContact O-N 3.34Å; C95-Q98 PolarHBondContact O-N 3.5Å; C95-L99 WeakPolarHBondContact O-CB 3.5Å; C95-L99 PolarHBondContact O-N 2.87Å; C95-V182 HydrophobicContact CB-CG1 4.02Å; C95-V182 HydrophobicContact CB-CG2 4.11Å; C95-V186 HydrophobicContact CB-CG2 3.83Å; C95-V186 VanDerWaalsContact O-CG2 3.32Å; C95-V186 WeakPolarHBondContact O-CG2 3.4Å
96	I	92.6	Very high	91.7	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-60.3	-39.6	173.9	-70.7	167.7	0	0	0	110.8	I92 C100 M114 L117 V182	I92-I96 HydrophobicContact CG2-CD1 4.03Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.38Å; I92-I96 PolarHBondContact O-N 3.32Å; I96-C100 WeakPolarHBondContact O-CB 3.42Å; I96-C100 PolarHBondContact O-N 2.8Å; I96-M114 HydrophobicContact CB-CE 4.46Å; I96-M114 HydrophobicContact CG2-CE 3.91Å; I96-M114 HydrophobicContact CG2-SD 3.98Å; I96-L117 HydrophobicContact CG2-CB 3.64Å; I96-L117 HydrophobicContact CG2-CD1 4.35Å; I96-V182 HydrophobicContact CG1-CG2 3.96Å
97	R	93.3	Very high	91.7	Very high	115 Å²	115	64.1 Å²	64.1	43%	0.434	34%	0.336	S	S	.	.	H	α-helix	trans	-65.8	-49.9	176.8	-175.9	174.1	66.1	-126.4	-3.8	112.4	Q93 Q94 C95 L99 C100 E101 M114	Q93-R97 WeakPolarHBondContact O-CB 3.48Å; Q93-R97 PolarHBondContact O-N 3.43Å; Q94-R97 PolarHBondContact O-N 2.8Å; C95-R97 VanDerWaalsContact C-N 3.27Å; C95-R97 PolarHBondContact O-N 3.34Å; R97-L99 VanDerWaalsContact C-N 3.26Å; R97-L99 PolarHBondContact O-N 2.85Å; R97-C100 WeakPolarHBondContact O-CA 3.48Å; R97-C100 WeakPolarHBondContact O-CB 3.46Å; R97-C100 PolarHBondContact O-N 3.38Å; R97-E101 VanDerWaalsContact CD-OE1 3.26Å; R97-E101 WeakPolarHBondContact CD-OE1 3.46Å; R97-E101 VanDerWaalsContact CG-CD 3.44Å; R97-E101 HydrophobicContact CG-CG 4.16Å; R97-E101 WeakPolarHBondContact CG-OE1 3.42Å; R97-E101 IonicContact NE-OE1 3.03Å; R97-E101 WeakPolarHBondContact O-CB 3.35Å; R97-E101 WeakPolarHBondContact O-CG 3.42Å; R97-E101 PolarHBondContact O-N 3.31Å; R97-M114 WeakPolarHBondContact CA-SD 3.5Å; R97-M114 HydrophobicContact CB-CE 3.91Å; R97-M114 HydrophobicContact CB-SD 3.75Å; R97-M114 HydrophobicContact CG-SD 4.16Å
98	Q	93.4	Very high	91.8	Very high	57 Å²	57	57.9 Å²	57.9	27%	0.266	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-37.2	177.7	-71.9	173	-42.5	0	0	112.4	Q94 C95 F102 V186	Q94-Q98 WeakPolarHBondContact O-CG 3.33Å; Q94-Q98 PolarHBondContact O-N 3.46Å; C95-Q98 PolarHBondContact O-N 3.5Å; Q98-F102 WeakPolarHBondContact O-CB 3.4Å; Q98-F102 PolarHBondContact O-N 3.06Å; Q98-V186 HydrophobicContact CB-CG2 4.33Å
99	L	93.8	Very high	91.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.9	-43.1	172.3	179.2	60.3	0	0	0	111.9	C95 R97 L103 L117 I128 L132 W178 V182 L185 I189	C95-L99 WeakPolarHBondContact O-CB 3.5Å; C95-L99 PolarHBondContact O-N 2.87Å; R97-L99 VanDerWaalsContact C-N 3.26Å; R97-L99 PolarHBondContact O-N 2.85Å; L99-L103 HydrophobicContact CD1-CD1 3.82Å; L99-L103 HydrophobicContact CD1-CG 4.05Å; L99-L103 HydrophobicContact CG-CD1 3.96Å; L99-L103 WeakPolarHBondContact O-CB 3.5Å; L99-L103 WeakPolarHBondContact O-CD1 3.44Å; L99-L103 WeakPolarHBondContact O-CG 3.42Å; L99-L103 PolarHBondContact O-N 3.37Å; L99-L103 VanDerWaalsContact O-N 3.1Å; L99-L117 HydrophobicContact CB-CD1 4.37Å; L99-L117 HydrophobicContact CD2-CD1 4.17Å; L99-L117 HydrophobicContact CD2-CD2 4.28Å; L99-L117 HydrophobicContact CG-CD1 4.05Å; L99-I128 HydrophobicContact CD1-CG2 3.94Å; L99-L132 HydrophobicContact CD1-CD1 3.97Å; L99-W178 HydrophobicContact CD2-CH2 4.19Å; L99-W178 HydrophobicContact CD2-CZ2 4.39Å; L99-V182 HydrophobicContact CD2-CG2 3.96Å; L99-L185 HydrophobicContact CD1-CB 4.35Å; L99-L185 HydrophobicContact CD2-CB 4.43Å; L99-L185 HydrophobicContact CD2-CD1 3.87Å; L99-I189 HydrophobicContact CB-CD1 4.42Å; L99-I189 HydrophobicContact CD1-CD1 3.7Å
100	C	92.4	Very high	91.1	Very high	14 Å²	14	54.5 Å²	54.5	10%	0.095	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-43.6	177.9	-160.4	0	0	0	0	112.4	I96 R97 T104 M114 L117	I96-C100 WeakPolarHBondContact O-CB 3.42Å; I96-C100 PolarHBondContact O-N 2.8Å; R97-C100 WeakPolarHBondContact O-CA 3.48Å; R97-C100 WeakPolarHBondContact O-CB 3.46Å; R97-C100 PolarHBondContact O-N 3.38Å; C100-T104 WeakPolarHBondContact O-CB 3.39Å; C100-T104 PolarHBondContact O-N 2.93Å; C100-T104 PolarHBondContact O-OG1 3.16Å; C100-M114 HydrophobicContact CB-SD 4.15Å; C100-L117 HydrophobicContact CB-CD1 3.8Å
101	E	93.3	Very high	90.4	Very high	81 Å²	81	59.1 Å²	59.1	38%	0.379	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-57.9	177	-72.7	161.9	167.2	0	0	109.5	R97 L103 T104 E105	R97-E101 VanDerWaalsContact CD-OE1 3.26Å; R97-E101 WeakPolarHBondContact CD-OE1 3.46Å; R97-E101 VanDerWaalsContact CG-CD 3.44Å; R97-E101 HydrophobicContact CG-CG 4.16Å; R97-E101 WeakPolarHBondContact CG-OE1 3.42Å; R97-E101 IonicContact NE-OE1 3.03Å; R97-E101 WeakPolarHBondContact O-CB 3.35Å; R97-E101 WeakPolarHBondContact O-CG 3.42Å; R97-E101 PolarHBondContact O-N 3.31Å; E101-L103 PolarHBondContact O-N 3.43Å; E101-T104 WeakPolarHBondContact O-CB 3.48Å; E101-T104 PolarHBondContact O-N 3.35Å; E101-E105 WeakPolarHBondContact O-CG 2.99Å; E101-E105 PolarHBondContact O-N 3.45Å
102	F	93.1	Very high	90	Very high	16 Å²	16	58.2 Å²	58.2	7%	0.07	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-42.9	-177.7	-172.3	-88.7	0	0	0	113.5	Q98 T104 N106 L132 I189 I192	Q98-F102 WeakPolarHBondContact O-CB 3.4Å; Q98-F102 PolarHBondContact O-N 3.06Å; F102-T104 VanDerWaalsContact C-N 3.29Å; F102-T104 PolarHBondContact O-N 2.81Å; F102-N106 WeakPolarHBondContact CD2-ND2 3.34Å; F102-N106 HydrophobicContact CE1-CB 4.48Å; F102-N106 WeakPolarHBondContact CE2-ND2 3.36Å; F102-N106 WeakPolarHBondContact O-CB 3.49Å; F102-N106 PolarHBondContact O-N 2.91Å; F102-N106 VanDerWaalsContact O-N 3.09Å; F102-N106 PolarHBondContact O-ND2 2.87Å; F102-L132 HydrophobicContact CD1-CD2 3.5Å; F102-L132 VanDerWaalsContact CD1-CD2 3.5Å; F102-L132 HydrophobicContact CE1-CD2 3.46Å; F102-L132 VanDerWaalsContact CE1-CD2 3.46Å; F102-I189 HydrophobicContact CB-CD1 3.87Å; F102-I189 HydrophobicContact CB-CG1 4.35Å; F102-I189 HydrophobicContact CB-CG2 4.26Å; F102-I189 HydrophobicContact CD1-CD1 4.05Å; F102-I189 HydrophobicContact CD1-CG1 3.8Å; F102-I189 HydrophobicContact CD1-CG2 4.46Å; F102-I189 HydrophobicContact CD2-CG1 4.47Å; F102-I189 HydrophobicContact CD2-CG2 3.63Å; F102-I189 HydrophobicContact CE1-CG1 4.22Å; F102-I189 HydrophobicContact CE2-CG2 4.05Å; F102-I189 HydrophobicContact CG-CD1 4.01Å; F102-I189 HydrophobicContact CG-CG1 3.94Å; F102-I189 HydrophobicContact CG-CG2 3.85Å; F102-I192 HydrophobicContact CE1-CD1 4.48Å; F102-I192 HydrophobicContact CZ-CB 4.47Å; F102-I192 HydrophobicContact CZ-CD1 4.48Å; F102-I192 HydrophobicContact CZ-CG2 3.88Å
103	L	92.3	Very high	89.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-35.6	176.3	-71	172	0	0	0	112.1	L99 E101 Y108 V112 I128 F131 L132	L99-L103 HydrophobicContact CD1-CD1 3.82Å; L99-L103 HydrophobicContact CD1-CG 4.05Å; L99-L103 HydrophobicContact CG-CD1 3.96Å; L99-L103 WeakPolarHBondContact O-CB 3.5Å; L99-L103 WeakPolarHBondContact O-CD1 3.44Å; L99-L103 WeakPolarHBondContact O-CG 3.42Å; L99-L103 PolarHBondContact O-N 3.37Å; L99-L103 VanDerWaalsContact O-N 3.1Å; E101-L103 PolarHBondContact O-N 3.43Å; L103-Y108 HydrophobicContact CB-CD1 4.36Å; L103-Y108 HydrophobicContact CB-CG 4.42Å; L103-Y108 HydrophobicContact CD1-CD1 4.48Å; L103-Y108 HydrophobicContact CD2-CD1 4.28Å; L103-Y108 HydrophobicContact CD2-CD2 4.25Å; L103-Y108 HydrophobicContact CD2-CG 4.01Å; L103-Y108 WeakPolarHBondContact O-CB 3.48Å; L103-Y108 PolarHBondContact O-N 2.91Å; L103-V112 HydrophobicContact CD1-CG1 4.2Å; L103-V112 HydrophobicContact CD1-CG2 4.39Å; L103-I128 HydrophobicContact CD1-CD1 4.17Å; L103-I128 HydrophobicContact CD1-CG1 3.98Å; L103-I128 HydrophobicContact CD1-CG2 4.13Å; L103-I128 HydrophobicContact CD2-CG2 4.37Å; L103-F131 HydrophobicContact CD2-CD1 3.41Å; L103-F131 VanDerWaalsContact CD2-CD1 3.41Å; L103-F131 HydrophobicContact CD2-CE1 3.66Å; L103-F131 HydrophobicContact CD2-CG 4.48Å; L103-L132 HydrophobicContact CD2-CD2 4.24Å
104	T	90.3	Very high	89.3	Confident	96 Å²	96	59.7 Å²	59.7	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-74.8	-46	179.6	-52.6	0	0	0	0	111.2	C100 E101 F102 N106 G107	C100-T104 WeakPolarHBondContact O-CB 3.39Å; C100-T104 PolarHBondContact O-N 2.93Å; C100-T104 PolarHBondContact O-OG1 3.16Å; E101-T104 WeakPolarHBondContact O-CB 3.48Å; E101-T104 PolarHBondContact O-N 3.35Å; F102-T104 VanDerWaalsContact C-N 3.29Å; F102-T104 PolarHBondContact O-N 2.81Å; T104-N106 VanDerWaalsContact C-N 3.32Å; T104-N106 PolarHBondContact O-N 3.01Å; T104-G107 PolarHBondContact O-N 3.5Å
105	E	91.1	Very high	88.9	Confident	149 Å²	149	64.4 Å²	64.4	70%	0.696	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-37.3	-179.7	-71.2	168.1	171.8	0	0	112.5	E101	E101-E105 WeakPolarHBondContact O-CG 2.99Å; E101-E105 PolarHBondContact O-N 3.45Å
106	N	89.4	Confident	88.5	Confident	64 Å²	64	67.1 Å²	67.1	34%	0.342	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	11	-176.8	-67	-90.8	0	0	0	113.7	F102 T104 F131 F135	F102-N106 WeakPolarHBondContact CD2-ND2 3.34Å; F102-N106 HydrophobicContact CE1-CB 4.48Å; F102-N106 WeakPolarHBondContact CE2-ND2 3.36Å; F102-N106 WeakPolarHBondContact O-CB 3.49Å; F102-N106 PolarHBondContact O-N 2.91Å; F102-N106 VanDerWaalsContact O-N 3.09Å; F102-N106 PolarHBondContact O-ND2 2.87Å; T104-N106 VanDerWaalsContact C-N 3.32Å; T104-N106 PolarHBondContact O-N 3.01Å; N106-F131 HydrophobicContact CB-CE1 4.35Å; N106-F131 HydrophobicContact CB-CZ 4.03Å; N106-F131 WeakPolarHBondContact O-CZ 3.26Å; N106-F135 HydrophobicContact CB-CE1 4.43Å; N106-F135 HydrophobicContact CB-CZ 3.81Å
107	G	87.1	Confident	88.3	Confident	58 Å²	58	67.2 Å²	67.2	60%	0.598	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	34.9	169.7	0	0	0	0	0	116	T104 A109	T104-G107 PolarHBondContact O-N 3.5Å; G107-A109 PolarHBondContact O-N 2.86Å
108	Y	89.7	Confident	88	Confident	33 Å²	33	65.4 Å²	65.4	13%	0.129	36%	0.362	C	S	.	.			trans	-57.8	127.8	177.8	-178.3	-124.4	0	0	0	112.4	L103 H110 V112 K127 I128 F131	L103-Y108 HydrophobicContact CB-CD1 4.36Å; L103-Y108 HydrophobicContact CB-CG 4.42Å; L103-Y108 HydrophobicContact CD1-CD1 4.48Å; L103-Y108 HydrophobicContact CD2-CD1 4.28Å; L103-Y108 HydrophobicContact CD2-CD2 4.25Å; L103-Y108 HydrophobicContact CD2-CG 4.01Å; L103-Y108 WeakPolarHBondContact O-CB 3.48Å; L103-Y108 PolarHBondContact O-N 2.91Å; Y108-H110 HydrophobicContact CD1-CB 4.2Å; Y108-H110 WeakPolarHBondContact CD1-O 3.4Å; Y108-H110 HydrophobicContact CE1-CB 3.74Å; Y108-H110 PolarHBondContact O-N 3.48Å; Y108-V112 HydrophobicContact CD1-CG2 3.56Å; Y108-V112 HydrophobicContact CE1-CG2 3.45Å; Y108-V112 VanDerWaalsContact CE1-CG2 3.45Å; Y108-K127 VanDerWaalsContact OH-CB 3.25Å; Y108-K127 WeakPolarHBondContact OH-CB 3.47Å; Y108-I128 HydrophobicContact CE1-CG1 4.14Å; Y108-I128 PolarHBondContact OH-N 3.45Å; Y108-F131 HydrophobicContact CD2-CB 3.76Å; Y108-F131 AromaticContact CD2-CD1 3.77Å; Y108-F131 HydrophobicContact CD2-CD1 3.77Å; Y108-F131 AromaticContact CD2-CD2 3.68Å; Y108-F131 HydrophobicContact CD2-CD2 3.68Å; Y108-F131 HydrophobicContact CD2-CE1 4.24Å; Y108-F131 HydrophobicContact CD2-CE2 4.15Å; Y108-F131 AromaticContact CD2-CG 3.45Å; Y108-F131 HydrophobicContact CD2-CG 3.45Å; Y108-F131 VanDerWaalsContact CD2-CG 3.45Å; Y108-F131 HydrophobicContact CD2-CZ 4.4Å; Y108-F131 HydrophobicContact CE2-CB 3.75Å; Y108-F131 HydrophobicContact CE2-CD1 4.48Å; Y108-F131 HydrophobicContact CE2-CD2 4.44Å; Y108-F131 AromaticContact CE2-CG 3.99Å; Y108-F131 HydrophobicContact CE2-CG 3.99Å; Y108-F131 HydrophobicContact CG-CD1 4.37Å; Y108-F131 HydrophobicContact CG-CE1 4.48Å; Y108-F131 HydrophobicContact CG-CG 4.42Å
109	A	82.8	Confident	87.6	Confident	92 Å²	92	65.8 Å²	65.8	76%	0.76	38%	0.375	S	S	*	.	S	Bend	trans	-71.1	7.2	-169.1	0	0	0	0	0	116	G107	G107-A109 PolarHBondContact O-N 2.86Å
110	H	82.2	Confident	87.4	Confident	87 Å²	87	66.2 Å²	66.2	40%	0.403	38%	0.378	S	S	.	.	S	Bend	trans	-129.8	140.8	178.2	-63.5	-21	0	0	0	110.6	Y108 V112 K127	Y108-H110 HydrophobicContact CD1-CB 4.2Å; Y108-H110 WeakPolarHBondContact CD1-O 3.4Å; Y108-H110 HydrophobicContact CE1-CB 3.74Å; Y108-H110 PolarHBondContact O-N 3.48Å; H110-V112 PolarHBondContact O-N 2.89Å; H110-K127 PolarHBondContact NE2-NZ 2.81Å
111	N	78.4	Confident	87.2	Confident	161 Å²	161	68.2 Å²	68.2	86%	0.861	39%	0.392	S	S	*	.			trans	-67.8	116.9	179.7	-171.4	-37.7	0	0	0	110.5
112	V	83.7	Confident	87.1	Confident	26 Å²	26	66.3 Å²	66.3	16%	0.158	39%	0.386	C	S	.	.			trans	-117.1	145.7	-178.1	173	0	0	0	0	109.6	L103 Y108 H110 L117	L103-V112 HydrophobicContact CD1-CG1 4.2Å; L103-V112 HydrophobicContact CD1-CG2 4.39Å; Y108-V112 HydrophobicContact CD1-CG2 3.56Å; Y108-V112 HydrophobicContact CE1-CG2 3.45Å; Y108-V112 VanDerWaalsContact CE1-CG2 3.45Å; H110-V112 PolarHBondContact O-N 2.89Å; V112-L117 HydrophobicContact CG1-CD1 3.54Å; V112-L117 HydrophobicContact CG1-CD2 3.89Å; V112-L117 HydrophobicContact CG1-CG 3.59Å
113	S	85.3	Confident	86.8	Confident	47 Å²	47	73.3 Å²	73.3	33%	0.329	42%	0.416	S	S	.	.			trans	-143.9	158.7	178.5	70.8	0	0	0	0	111	K115 S116 L117	S113-K115 PolarHBondContact O-N 3.4Å; S113-K115 PolarHBondContact OG-N 2.83Å; S113-S116 PolarHBondContact N-OG 2.95Å; S113-S116 PolarHBondContact O-N 2.63Å; S113-S116 VanDerWaalsContact O-N 3.1Å; S113-S116 PolarHBondContact O-OG 3.23Å; S113-S116 PolarHBondContact OG-N 2.81Å; S113-S116 VanDerWaalsContact OG-N 3.13Å; S113-S116 PolarHBondContact OG-OG 3.44Å; S113-L117 PolarHBondContact O-N 3.38Å; S113-L117 VanDerWaalsContact O-N 3.12Å
114	M	84.5	Confident	86.7	Confident	70 Å²	70	76.6 Å²	76.6	35%	0.345	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-24	168.9	-72.7	-61.8	-64.8	0	0	113.8	I96 R97 C100 Q118	I96-M114 HydrophobicContact CB-CE 4.46Å; I96-M114 HydrophobicContact CG2-CE 3.91Å; I96-M114 HydrophobicContact CG2-SD 3.98Å; R97-M114 WeakPolarHBondContact CA-SD 3.5Å; R97-M114 HydrophobicContact CB-CE 3.91Å; R97-M114 HydrophobicContact CB-SD 3.75Å; R97-M114 HydrophobicContact CG-SD 4.16Å; C100-M114 HydrophobicContact CB-SD 4.15Å; M114-Q118 WeakPolarHBondContact O-CG 3.45Å; M114-Q118 PolarHBondContact O-NE2 2.91Å
115	K	84.3	Confident	86.8	Confident	183 Å²	183	72 Å²	72	80%	0.796	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-38.8	179.5	-168.8	176.2	-179.4	-178.6	0	112.9	S113 Q118	S113-K115 PolarHBondContact O-N 3.4Å; S113-K115 PolarHBondContact OG-N 2.83Å; K115-Q118 PolarHBondContact O-N 3.14Å
116	S	85.4	Confident	86.7	Confident	59 Å²	59	66 Å²	66	41%	0.413	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-73.1	-27.8	177.7	43	0	0	0	0	112.7	S113 Q118	S113-S116 PolarHBondContact N-OG 2.95Å; S113-S116 PolarHBondContact O-N 2.63Å; S113-S116 VanDerWaalsContact O-N 3.1Å; S113-S116 PolarHBondContact O-OG 3.23Å; S113-S116 PolarHBondContact OG-N 2.81Å; S113-S116 VanDerWaalsContact OG-N 3.13Å; S113-S116 PolarHBondContact OG-OG 3.44Å; S116-Q118 VanDerWaalsContact C-N 3.3Å; S116-Q118 PolarHBondContact O-N 3.18Å
117	L	87.4	Confident	86.8	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.016	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-81	7	173.9	-64.5	-178.5	0	0	0	115.1	I96 L99 C100 V112 S113 I128 W178	I96-L117 HydrophobicContact CG2-CB 3.64Å; I96-L117 HydrophobicContact CG2-CD1 4.35Å; L99-L117 HydrophobicContact CB-CD1 4.37Å; L99-L117 HydrophobicContact CD2-CD1 4.17Å; L99-L117 HydrophobicContact CD2-CD2 4.28Å; L99-L117 HydrophobicContact CG-CD1 4.05Å; C100-L117 HydrophobicContact CB-CD1 3.8Å; V112-L117 HydrophobicContact CG1-CD1 3.54Å; V112-L117 HydrophobicContact CG1-CD2 3.89Å; V112-L117 HydrophobicContact CG1-CG 3.59Å; S113-L117 PolarHBondContact O-N 3.38Å; S113-L117 VanDerWaalsContact O-N 3.12Å; L117-I128 HydrophobicContact CD2-CD1 3.61Å; L117-W178 VanDerWaalsContact O-CE2 3.32Å; L117-W178 WeakPolarHBondContact O-CZ2 3.4Å; L117-W178 PolarHBondContact O-NE1 2.78Å
118	Q	87.1	Confident	87	Confident	76 Å²	76	64.9 Å²	64.9	36%	0.355	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-75.4	-30.6	175.3	-63.9	-63.6	-47.2	0	0	112.8	M114 K115 S116	M114-Q118 WeakPolarHBondContact O-CG 3.45Å; M114-Q118 PolarHBondContact O-NE2 2.91Å; K115-Q118 PolarHBondContact O-N 3.14Å; S116-Q118 VanDerWaalsContact C-N 3.3Å; S116-Q118 PolarHBondContact O-N 3.18Å
119	A	86.6	Confident	87.2	Confident	66 Å²	66	63.3 Å²	63.3	55%	0.545	35%	0.348	S	S	.	.	S	Bend	trans	-160	72.1	179.2	0	0	0	0	0	109.5	G173	A119-G173 WeakPolarHBondContact CB-O 3.37Å
120	P	88.6	Confident	87.6	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.058	32%	0.323	C	S	.	.			trans	-67.8	154.3	-177	28.3	-34.5	0	0	0	112	D124 G173 W178	P120-D124 HydrophobicContact CB-CB 4.21Å; P120-G173 WeakPolarHBondContact O-CA 3.5Å; P120-W178 HydrophobicContact CG-CD2 4.13Å; P120-W178 HydrophobicContact CG-CE3 3.85Å; P120-W178 HydrophobicContact CG-CH2 3.52Å; P120-W178 HydrophobicContact CG-CZ2 3.75Å; P120-W178 HydrophobicContact CG-CZ3 3.54Å
121	S	89.6	Confident	88	Confident	55 Å²	55	58.9 Å²	58.9	39%	0.385	31%	0.314	S	S	.	.			trans	-71.8	162.8	172	83.4	0	0	0	0	111.1	K123 D124 F125	S121-K123 PolarHBondContact O-N 3.39Å; S121-K123 PolarHBondContact OG-N 3.39Å; S121-D124 VanDerWaalsContact CB-OD2 3.23Å; S121-D124 WeakPolarHBondContact CB-OD2 3.23Å; S121-D124 PolarHBondContact N-OD2 2.89Å; S121-D124 PolarHBondContact O-N 3.2Å; S121-D124 VanDerWaalsContact O-N 3.12Å; S121-D124 VanDerWaalsContact OG-CG 3.24Å; S121-D124 PolarHBondContact OG-N 3.28Å; S121-D124 PolarHBondContact OG-OD2 2.83Å; S121-F125 PolarHBondContact O-N 2.89Å
122	V	89.4	Confident	88.7	Confident	41 Å²	41	51.2 Å²	51.2	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-55.9	-37.6	173.3	-179.4	0	0	0	0	111.1	L126 F147 V172	V122-L126 HydrophobicContact CG1-CD1 3.99Å; V122-L126 HydrophobicContact CG1-CG 4.39Å; V122-L126 WeakPolarHBondContact O-CB 3.48Å; V122-L126 VanDerWaalsContact O-CG 3.22Å; V122-L126 WeakPolarHBondContact O-CG 3.26Å; V122-L126 PolarHBondContact O-N 2.73Å; V122-F147 HydrophobicContact CG1-CE2 3.64Å; V122-F147 HydrophobicContact CG1-CZ 3.7Å; V122-V172 HydrophobicContact CG2-CG2 4.09Å
123	K	88.1	Confident	89.2	Confident	163 Å²	163	51.9 Å²	51.9	71%	0.709	27%	0.273	S	S	*	.	H	α-helix	trans	-67.8	-37.8	177.8	-67.8	-168.6	175.9	-170.4	0	112.7	S121 K127	S121-K123 PolarHBondContact O-N 3.39Å; S121-K123 PolarHBondContact OG-N 3.39Å; K123-K127 VanDerWaalsContact O-CG 3.28Å; K123-K127 WeakPolarHBondContact O-CG 3.37Å; K123-K127 PolarHBondContact O-N 3.17Å; K123-K127 VanDerWaalsContact O-N 3.14Å
124	D	89.5	Confident	89.4	Confident	70 Å²	70	50.9 Å²	50.9	37%	0.374	27%	0.27	S	S	.	.	H	α-helix	trans	-73.7	-39.6	179	-53.3	-53.4	0	0	0	111	P120 S121 K127 I128	P120-D124 HydrophobicContact CB-CB 4.21Å; S121-D124 VanDerWaalsContact CB-OD2 3.23Å; S121-D124 WeakPolarHBondContact CB-OD2 3.23Å; S121-D124 PolarHBondContact N-OD2 2.89Å; S121-D124 PolarHBondContact O-N 3.2Å; S121-D124 VanDerWaalsContact O-N 3.12Å; S121-D124 VanDerWaalsContact OG-CG 3.24Å; S121-D124 PolarHBondContact OG-N 3.28Å; S121-D124 PolarHBondContact OG-OD2 2.83Å; D124-K127 PolarHBondContact O-N 3.29Å; D124-I128 WeakPolarHBondContact O-CB 3.25Å; D124-I128 VanDerWaalsContact O-CG1 3.25Å; D124-I128 WeakPolarHBondContact O-CG1 3.41Å; D124-I128 PolarHBondContact O-N 2.96Å
125	F	91.8	Very high	89.6	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-57.3	-48.7	170.8	167.1	-102.5	0	0	0	112	S121 K127 I128 F129 V151 M169 V172 W178 I181 L185	S121-F125 PolarHBondContact O-N 2.89Å; F125-K127 PolarHBondContact O-N 3.35Å; F125-I128 PolarHBondContact O-N 3.49Å; F125-F129 HydrophobicContact CZ-CB 4.39Å; F125-F129 WeakPolarHBondContact O-CB 3.25Å; F125-F129 PolarHBondContact O-N 3.05Å; F125-V151 HydrophobicContact CE1-CG1 4.14Å; F125-V151 HydrophobicContact CZ-CG1 3.94Å; F125-M169 HydrophobicContact CE1-SD 4.28Å; F125-V172 HydrophobicContact CB-CB 4.37Å; F125-V172 HydrophobicContact CB-CG2 3.66Å; F125-V172 HydrophobicContact CD1-CB 4.39Å; F125-V172 HydrophobicContact CD1-CG1 3.75Å; F125-V172 HydrophobicContact CD1-CG2 4.25Å; F125-V172 HydrophobicContact CD2-CG1 4.43Å; F125-V172 HydrophobicContact CE1-CG1 3.98Å; F125-V172 HydrophobicContact CG-CB 4.15Å; F125-V172 HydrophobicContact CG-CG1 3.98Å; F125-V172 HydrophobicContact CG-CG2 3.94Å; F125-V172 HydrophobicContact CZ-CG1 4.43Å; F125-W178 HydrophobicContact CD2-CZ3 4.34Å; F125-I181 HydrophobicContact CD2-CG2 3.59Å; F125-I181 HydrophobicContact CE2-CG2 3.19Å; F125-I181 HydrophobicContact CZ-CG2 3.96Å; F125-L185 HydrophobicContact CD2-CD1 4.01Å; F125-L185 HydrophobicContact CE2-CD1 3.96Å; F125-L185 HydrophobicContact CE2-CD2 3.92Å; F125-L185 HydrophobicContact CE2-CG 4.13Å
126	L	90.8	Very high	89.8	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.11	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-44	-179.9	-71.1	169.7	0	0	0	111.3	V122 I128 F129 T130 L142 F147 V151	V122-L126 HydrophobicContact CG1-CD1 3.99Å; V122-L126 HydrophobicContact CG1-CG 4.39Å; V122-L126 WeakPolarHBondContact O-CB 3.48Å; V122-L126 VanDerWaalsContact O-CG 3.22Å; V122-L126 WeakPolarHBondContact O-CG 3.26Å; V122-L126 PolarHBondContact O-N 2.73Å; L126-I128 PolarHBondContact O-N 3.34Å; L126-F129 PolarHBondContact O-N 2.68Å; L126-T130 PolarHBondContact O-N 3.04Å; L126-T130 PolarHBondContact O-OG1 3.25Å; L126-L142 HydrophobicContact CB-CD1 4.48Å; L126-L142 HydrophobicContact CD2-CD1 3.89Å; L126-F147 HydrophobicContact CD1-CB 4.42Å; L126-F147 HydrophobicContact CD1-CD1 4.05Å; L126-F147 HydrophobicContact CD1-CD2 3.92Å; L126-F147 HydrophobicContact CD1-CE1 4.31Å; L126-F147 HydrophobicContact CD1-CE2 4.18Å; L126-F147 HydrophobicContact CD1-CG 3.86Å; L126-F147 HydrophobicContact CD1-CZ 4.37Å; L126-F147 HydrophobicContact CD2-CB 3.84Å; L126-F147 HydrophobicContact CD2-CD2 3.69Å; L126-F147 HydrophobicContact CD2-CG 3.89Å; L126-F147 HydrophobicContact CG-CD2 4.31Å; L126-V151 HydrophobicContact CD2-CG2 4.08Å
127	K	90.1	Very high	89.9	Confident	97 Å²	97	42.9 Å²	42.9	42%	0.422	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-42.1	175.4	-71.1	169.7	162.9	-161	0	113.2	Y108 H110 K123 D124 F125 F131	Y108-K127 VanDerWaalsContact OH-CB 3.25Å; Y108-K127 WeakPolarHBondContact OH-CB 3.47Å; H110-K127 PolarHBondContact NE2-NZ 2.81Å; K123-K127 VanDerWaalsContact O-CG 3.28Å; K123-K127 WeakPolarHBondContact O-CG 3.37Å; K123-K127 PolarHBondContact O-N 3.17Å; K123-K127 VanDerWaalsContact O-N 3.14Å; D124-K127 PolarHBondContact O-N 3.29Å; F125-K127 PolarHBondContact O-N 3.35Å; K127-F131 WeakPolarHBondContact O-CB 3.43Å; K127-F131 PolarHBondContact O-N 2.87Å
128	I	92.1	Very high	89.8	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-45.6	174.7	-72.7	167.2	0	0	0	110.2	L99 L103 Y108 L117 D124 F125 L126 F131 L132 L185	L99-I128 HydrophobicContact CD1-CG2 3.94Å; L103-I128 HydrophobicContact CD1-CD1 4.17Å; L103-I128 HydrophobicContact CD1-CG1 3.98Å; L103-I128 HydrophobicContact CD1-CG2 4.13Å; L103-I128 HydrophobicContact CD2-CG2 4.37Å; Y108-I128 HydrophobicContact CE1-CG1 4.14Å; Y108-I128 PolarHBondContact OH-N 3.45Å; L117-I128 HydrophobicContact CD2-CD1 3.61Å; D124-I128 WeakPolarHBondContact O-CB 3.25Å; D124-I128 VanDerWaalsContact O-CG1 3.25Å; D124-I128 WeakPolarHBondContact O-CG1 3.41Å; D124-I128 PolarHBondContact O-N 2.96Å; F125-I128 PolarHBondContact O-N 3.49Å; L126-I128 PolarHBondContact O-N 3.34Å; I128-F131 PolarHBondContact O-N 2.8Å; I128-L132 HydrophobicContact CG2-CD1 4.13Å; I128-L132 WeakPolarHBondContact O-CG 3.36Å; I128-L132 PolarHBondContact O-N 2.61Å; I128-L185 HydrophobicContact CG2-CD1 4.11Å; I128-L185 HydrophobicContact CG2-CD2 4.45Å
129	F	92.7	Very high	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-48.1	178.7	173.8	-97	0	0	0	112	F125 L126 F131 L132 Y133 Y140 L142 V151 I154 F155 L185 L188	F125-F129 HydrophobicContact CZ-CB 4.39Å; F125-F129 WeakPolarHBondContact O-CB 3.25Å; F125-F129 PolarHBondContact O-N 3.05Å; L126-F129 PolarHBondContact O-N 2.68Å; F129-F131 VanDerWaalsContact C-N 3.34Å; F129-F131 PolarHBondContact O-N 2.85Å; F129-L132 PolarHBondContact O-N 2.86Å; F129-Y133 HydrophobicContact CZ-CD1 4.49Å; F129-Y133 HydrophobicContact CZ-CG 4.31Å; F129-Y133 VanDerWaalsContact O-CB 3.32Å; F129-Y133 WeakPolarHBondContact O-CB 3.46Å; F129-Y133 PolarHBondContact O-N 3.49Å; F129-Y140 HydrophobicContact CE1-CE1 4.41Å; F129-L142 HydrophobicContact CD1-CD1 4.3Å; F129-V151 HydrophobicContact CD1-CG1 4.35Å; F129-V151 HydrophobicContact CD1-CG2 3.86Å; F129-V151 HydrophobicContact CD2-CG1 4.04Å; F129-V151 HydrophobicContact CE1-CB 4.45Å; F129-V151 HydrophobicContact CE1-CG1 4.25Å; F129-V151 HydrophobicContact CE1-CG2 3.78Å; F129-V151 HydrophobicContact CE2-CG1 3.92Å; F129-V151 HydrophobicContact CG-CG1 4.25Å; F129-V151 HydrophobicContact CG-CG2 4.46Å; F129-V151 HydrophobicContact CZ-CG1 4.03Å; F129-V151 HydrophobicContact CZ-CG2 4.31Å; F129-I154 HydrophobicContact CE1-CD1 3.89Å; F129-I154 HydrophobicContact CZ-CB 4.02Å; F129-I154 HydrophobicContact CZ-CD1 3.84Å; F129-I154 HydrophobicContact CZ-CG2 3.82Å; F129-F155 AromaticContact CD2-CE2 3.78Å; F129-F155 HydrophobicContact CD2-CE2 3.78Å; F129-F155 HydrophobicContact CD2-CZ 4.15Å; F129-F155 HydrophobicContact CE2-CD2 4.07Å; F129-F155 AromaticContact CE2-CE2 3.49Å; F129-F155 HydrophobicContact CE2-CE2 3.49Å; F129-F155 VanDerWaalsContact CE2-CE2 3.49Å; F129-F155 AromaticContact CE2-CZ 3.98Å; F129-F155 HydrophobicContact CE2-CZ 3.98Å; F129-L185 HydrophobicContact CB-CD2 4.39Å; F129-L185 HydrophobicContact CD2-CD2 4.33Å; F129-L188 HydrophobicContact CD2-CD2 4.07Å; F129-L188 HydrophobicContact CE2-CD2 4.06Å
130	T	91.3	Very high	89.6	Confident	38 Å²	38	48.7 Å²	48.7	23%	0.233	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-43.4	176.5	-56.7	0	0	0	0	111.4	L126 G134 Y140 L142	L126-T130 PolarHBondContact O-N 3.04Å; L126-T130 PolarHBondContact O-OG1 3.25Å; T130-G134 PolarHBondContact O-N 2.95Å; T130-Y140 HydrophobicContact CG2-CD1 4.24Å; T130-Y140 HydrophobicContact CG2-CE1 4.38Å; T130-L142 HydrophobicContact CG2-CB 4.45Å; T130-L142 WeakPolarHBondContact OG1-CD1 3.49Å
131	F	92.4	Very high	89.2	Confident	48 Å²	48	56.5 Å²	56.5	21%	0.211	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-47.4	176.8	174.4	-98.3	0	0	0	112.2	L103 N106 Y108 K127 I128 F129 G134 F135	L103-F131 HydrophobicContact CD2-CD1 3.41Å; L103-F131 VanDerWaalsContact CD2-CD1 3.41Å; L103-F131 HydrophobicContact CD2-CE1 3.66Å; L103-F131 HydrophobicContact CD2-CG 4.48Å; N106-F131 HydrophobicContact CB-CE1 4.35Å; N106-F131 HydrophobicContact CB-CZ 4.03Å; N106-F131 WeakPolarHBondContact O-CZ 3.26Å; Y108-F131 HydrophobicContact CD2-CB 3.76Å; Y108-F131 AromaticContact CD2-CD1 3.77Å; Y108-F131 HydrophobicContact CD2-CD1 3.77Å; Y108-F131 AromaticContact CD2-CD2 3.68Å; Y108-F131 HydrophobicContact CD2-CD2 3.68Å; Y108-F131 HydrophobicContact CD2-CE1 4.24Å; Y108-F131 HydrophobicContact CD2-CE2 4.15Å; Y108-F131 AromaticContact CD2-CG 3.45Å; Y108-F131 HydrophobicContact CD2-CG 3.45Å; Y108-F131 VanDerWaalsContact CD2-CG 3.45Å; Y108-F131 HydrophobicContact CD2-CZ 4.4Å; Y108-F131 HydrophobicContact CE2-CB 3.75Å; Y108-F131 HydrophobicContact CE2-CD1 4.48Å; Y108-F131 HydrophobicContact CE2-CD2 4.44Å; Y108-F131 AromaticContact CE2-CG 3.99Å; Y108-F131 HydrophobicContact CE2-CG 3.99Å; Y108-F131 HydrophobicContact CG-CD1 4.37Å; Y108-F131 HydrophobicContact CG-CE1 4.48Å; Y108-F131 HydrophobicContact CG-CG 4.42Å; K127-F131 WeakPolarHBondContact O-CB 3.43Å; K127-F131 PolarHBondContact O-N 2.87Å; I128-F131 PolarHBondContact O-N 2.8Å; F129-F131 VanDerWaalsContact C-N 3.34Å; F129-F131 PolarHBondContact O-N 2.85Å; F131-G134 PolarHBondContact O-N 3.13Å; F131-F135 HydrophobicContact CD1-CE2 4.15Å; F131-F135 HydrophobicContact CD2-CE2 4.45Å; F131-F135 AromaticContact CE1-CE2 3.73Å; F131-F135 HydrophobicContact CE1-CE2 3.73Å; F131-F135 HydrophobicContact CE1-CZ 4.33Å; F131-F135 HydrophobicContact CE2-CE2 4.06Å; F131-F135 HydrophobicContact CE2-CZ 4.37Å; F131-F135 AromaticContact CZ-CE2 3.69Å; F131-F135 HydrophobicContact CZ-CE2 3.69Å; F131-F135 AromaticContact CZ-CZ 3.94Å; F131-F135 HydrophobicContact CZ-CZ 3.94Å; F131-F135 WeakPolarHBondContact O-CD2 3.39Å; F131-F135 WeakPolarHBondContact O-CE2 3.46Å
132	L	92.9	Very high	88.7	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-49.3	177	-68.6	178.6	0	0	0	111.5	L99 F102 L103 I128 F129 G134 F135 L185 L188 I189 I192	L99-L132 HydrophobicContact CD1-CD1 3.97Å; F102-L132 HydrophobicContact CD1-CD2 3.5Å; F102-L132 VanDerWaalsContact CD1-CD2 3.5Å; F102-L132 HydrophobicContact CE1-CD2 3.46Å; F102-L132 VanDerWaalsContact CE1-CD2 3.46Å; L103-L132 HydrophobicContact CD2-CD2 4.24Å; I128-L132 HydrophobicContact CG2-CD1 4.13Å; I128-L132 WeakPolarHBondContact O-CG 3.36Å; I128-L132 PolarHBondContact O-N 2.61Å; F129-L132 PolarHBondContact O-N 2.86Å; L132-G134 PolarHBondContact O-N 3.07Å; L132-F135 WeakPolarHBondContact O-CB 3.41Å; L132-F135 PolarHBondContact O-N 3.15Å; L132-F135 VanDerWaalsContact O-N 3.11Å; L132-L185 HydrophobicContact CD1-CB 4.25Å; L132-L185 HydrophobicContact CD1-CD2 3.99Å; L132-L188 HydrophobicContact CB-CD2 3.75Å; L132-L188 HydrophobicContact CB-CG 4.29Å; L132-L188 HydrophobicContact CD1-CD2 4.35Å; L132-I189 HydrophobicContact CD1-CD1 4.22Å; L132-I189 HydrophobicContact CD1-CG1 4.02Å; L132-I189 HydrophobicContact CD2-CD1 4.13Å; L132-I189 HydrophobicContact CD2-CG1 3.65Å; L132-I189 HydrophobicContact CG-CG1 4.48Å; L132-I192 HydrophobicContact CB-CD1 3.97Å; L132-I192 HydrophobicContact CD2-CD1 4.2Å; L132-I192 WeakPolarHBondContact O-CD1 3.43Å
133	Y	92.4	Very high	88.3	Confident	40 Å²	40	56.8 Å²	56.8	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-66.9	-25.2	-177.6	-170.6	-125.2	0	0	0	112.8	F129 F135 L136 C137 Y140 I154 L158	F129-Y133 HydrophobicContact CZ-CD1 4.49Å; F129-Y133 HydrophobicContact CZ-CG 4.31Å; F129-Y133 VanDerWaalsContact O-CB 3.32Å; F129-Y133 WeakPolarHBondContact O-CB 3.46Å; F129-Y133 PolarHBondContact O-N 3.49Å; Y133-F135 PolarHBondContact O-N 2.76Å; Y133-L136 HydrophobicContact CD2-CB 4.21Å; Y133-L136 HydrophobicContact CD2-CD1 4.26Å; Y133-L136 HydrophobicContact CE2-CB 4.27Å; Y133-L136 HydrophobicContact CE2-CD1 4.46Å; Y133-L136 PolarHBondContact O-N 2.89Å; Y133-C137 HydrophobicContact CE1-CB 4.17Å; Y133-C137 PolarHBondContact O-N 2.91Å; Y133-Y140 AromaticContact CD1-CD1 3.55Å; Y133-Y140 HydrophobicContact CD1-CD1 3.55Å; Y133-Y140 AromaticContact CD1-CD2 3.97Å; Y133-Y140 HydrophobicContact CD1-CD2 3.97Å; Y133-Y140 AromaticContact CD1-CE1 3.9Å; Y133-Y140 HydrophobicContact CD1-CE1 3.9Å; Y133-Y140 HydrophobicContact CD1-CE2 4.3Å; Y133-Y140 AromaticContact CD1-CG 3.58Å; Y133-Y140 HydrophobicContact CD1-CG 3.58Å; Y133-Y140 HydrophobicContact CE1-CD1 4.16Å; Y133-Y140 AromaticContact CE1-CD2 3.7Å; Y133-Y140 HydrophobicContact CE1-CD2 3.7Å; Y133-Y140 HydrophobicContact CE1-CE2 4.1Å; Y133-Y140 AromaticContact CE1-CG 3.73Å; Y133-Y140 HydrophobicContact CE1-CG 3.73Å; Y133-I154 HydrophobicContact CD1-CD1 4.2Å; Y133-I154 HydrophobicContact CD1-CG2 4.19Å; Y133-I154 HydrophobicContact CD2-CG2 3.85Å; Y133-I154 HydrophobicContact CE1-CD1 3.91Å; Y133-I154 HydrophobicContact CE1-CG1 4.33Å; Y133-I154 HydrophobicContact CE1-CG2 3.83Å; Y133-I154 HydrophobicContact CE2-CG2 3.46Å; Y133-I154 VanDerWaalsContact CE2-CG2 3.46Å; Y133-I154 HydrophobicContact CG-CG2 4.21Å; Y133-I154 VanDerWaalsContact CZ-CG2 3.45Å; Y133-L158 HydrophobicContact CD2-CD1 4.14Å; Y133-L158 HydrophobicContact CE2-CD1 3.9Å; Y133-L158 HydrophobicContact CE2-CD2 4.28Å; Y133-L158 HydrophobicContact CE2-CG 4.33Å
134	G	90.1	Very high	87.6	Confident	26 Å²	26	57.2 Å²	57.2	27%	0.268	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-24.4	170.9	0	0	0	0	0	114.8	T130 F131 L132 L136 C137 P138	T130-G134 PolarHBondContact O-N 2.95Å; F131-G134 PolarHBondContact O-N 3.13Å; L132-G134 PolarHBondContact O-N 3.07Å; G134-L136 VanDerWaalsContact C-N 3.31Å; G134-C137 CarbonylContact O-C 3.59Å; G134-P138 WeakPolarHBondContact O-CA 3.47Å
135	F	89.6	Confident	87	Confident	68 Å²	68	58.5 Å²	58.5	30%	0.298	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.6	172.3	-71.8	-92.4	0	0	0	113.4	N106 F131 L132 Y133 I192	N106-F135 HydrophobicContact CB-CE1 4.43Å; N106-F135 HydrophobicContact CB-CZ 3.81Å; F131-F135 HydrophobicContact CD1-CE2 4.15Å; F131-F135 HydrophobicContact CD2-CE2 4.45Å; F131-F135 AromaticContact CE1-CE2 3.73Å; F131-F135 HydrophobicContact CE1-CE2 3.73Å; F131-F135 HydrophobicContact CE1-CZ 4.33Å; F131-F135 HydrophobicContact CE2-CE2 4.06Å; F131-F135 HydrophobicContact CE2-CZ 4.37Å; F131-F135 AromaticContact CZ-CE2 3.69Å; F131-F135 HydrophobicContact CZ-CE2 3.69Å; F131-F135 AromaticContact CZ-CZ 3.94Å; F131-F135 HydrophobicContact CZ-CZ 3.94Å; F131-F135 WeakPolarHBondContact O-CD2 3.39Å; F131-F135 WeakPolarHBondContact O-CE2 3.46Å; L132-F135 WeakPolarHBondContact O-CB 3.41Å; L132-F135 PolarHBondContact O-N 3.15Å; L132-F135 VanDerWaalsContact O-N 3.11Å; Y133-F135 PolarHBondContact O-N 2.76Å; F135-I192 HydrophobicContact CB-CB 4.44Å; F135-I192 HydrophobicContact CB-CD1 4.12Å; F135-I192 HydrophobicContact CB-CG1 3.98Å; F135-I192 HydrophobicContact CB-CG2 3.59Å; F135-I192 HydrophobicContact CD1-CG2 4.33Å; F135-I192 HydrophobicContact CG-CG2 4.01Å
136	L	88.7	Confident	86.7	Confident	38 Å²	38	64.1 Å²	64.1	20%	0.199	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-31.9	174.7	-59.5	-176.3	0	0	0	112.1	Y133 G134 L158 L188 I192 H195	Y133-L136 HydrophobicContact CD2-CB 4.21Å; Y133-L136 HydrophobicContact CD2-CD1 4.26Å; Y133-L136 HydrophobicContact CE2-CB 4.27Å; Y133-L136 HydrophobicContact CE2-CD1 4.46Å; Y133-L136 PolarHBondContact O-N 2.89Å; G134-L136 VanDerWaalsContact C-N 3.31Å; L136-L158 HydrophobicContact CD1-CD1 4.11Å; L136-L158 HydrophobicContact CD1-CD2 3.96Å; L136-L188 HydrophobicContact CD1-CD1 3.73Å; L136-I192 HydrophobicContact CD1-CG1 4.42Å; L136-I192 HydrophobicContact CD2-CG1 3.94Å; L136-I192 HydrophobicContact CG-CG1 3.91Å; L136-H195 HydrophobicContact CD2-CB 3.58Å
137	C	87.4	Confident	86.5	Confident	37 Å²	37	65.2 Å²	65.2	25%	0.25	35%	0.352	C	S	.	.			trans	-135.9	88.7	179.7	-169.1	0	0	0	0	110.6	Y133 G134 S139 Y140	Y133-C137 HydrophobicContact CE1-CB 4.17Å; Y133-C137 PolarHBondContact O-N 2.91Å; G134-C137 CarbonylContact O-C 3.59Å; C137-S139 PolarHBondContact O-N 3.34Å; C137-Y140 WeakPolarHBondContact O-CB 3.49Å; C137-Y140 PolarHBondContact O-N 2.87Å
138	P	85.4	Confident	86.4	Confident	124 Å²	124	62 Å²	62	81%	0.805	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.2	-176.7	-26.5	36.4	0	0	0	115.5	G134	G134-P138 WeakPolarHBondContact O-CA 3.47Å
139	S	83.1	Confident	86.2	Confident	106 Å²	106	65.4 Å²	65.4	74%	0.741	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	12.3	176.2	53.4	0	0	0	0	113.7	C137 E141	C137-S139 PolarHBondContact O-N 3.34Å; S139-E141 PolarHBondContact O-N 3.4Å
140	Y	85.8	Confident	86	Confident	38 Å²	38	67.3 Å²	67.3	15%	0.149	36%	0.363	C	S	.	.			trans	-80.5	111.8	177.8	-179.7	-103	0	0	0	112.5	F129 T130 Y133 C137 L142 E150 I154	F129-Y140 HydrophobicContact CE1-CE1 4.41Å; T130-Y140 HydrophobicContact CG2-CD1 4.24Å; T130-Y140 HydrophobicContact CG2-CE1 4.38Å; Y133-Y140 AromaticContact CD1-CD1 3.55Å; Y133-Y140 HydrophobicContact CD1-CD1 3.55Å; Y133-Y140 AromaticContact CD1-CD2 3.97Å; Y133-Y140 HydrophobicContact CD1-CD2 3.97Å; Y133-Y140 AromaticContact CD1-CE1 3.9Å; Y133-Y140 HydrophobicContact CD1-CE1 3.9Å; Y133-Y140 HydrophobicContact CD1-CE2 4.3Å; Y133-Y140 AromaticContact CD1-CG 3.58Å; Y133-Y140 HydrophobicContact CD1-CG 3.58Å; Y133-Y140 HydrophobicContact CE1-CD1 4.16Å; Y133-Y140 AromaticContact CE1-CD2 3.7Å; Y133-Y140 HydrophobicContact CE1-CD2 3.7Å; Y133-Y140 HydrophobicContact CE1-CE2 4.1Å; Y133-Y140 AromaticContact CE1-CG 3.73Å; Y133-Y140 HydrophobicContact CE1-CG 3.73Å; C137-Y140 WeakPolarHBondContact O-CB 3.49Å; C137-Y140 PolarHBondContact O-N 2.87Å; Y140-L142 HydrophobicContact CE1-CB 3.96Å; Y140-L142 HydrophobicContact CE1-CD1 4.38Å; Y140-E150 VanDerWaalsContact CE2-OE1 3.26Å; Y140-E150 WeakPolarHBondContact CE2-OE1 3.47Å; Y140-E150 PolarHBondContact OH-OE1 3.44Å; Y140-I154 HydrophobicContact CE2-CD1 3.85Å
141	E	80.2	Confident	86	Confident	173 Å²	173	65.5 Å²	65.5	81%	0.808	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-98.9	136.5	162.2	-62.3	-175.3	164.7	0	0	109.1	S139 P143	S139-E141 PolarHBondContact O-N 3.4Å; E141-P143 WeakPolarHBondContact O-CD 3.5Å
142	L	79.1	Confident	86	Confident	47 Å²	47	64.2 Å²	64.2	25%	0.246	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-81.1	119.5	-179.9	-174.1	136.6	0	0	0	110.4	L126 F129 T130 Y140 F147	L126-L142 HydrophobicContact CB-CD1 4.48Å; L126-L142 HydrophobicContact CD2-CD1 3.89Å; F129-L142 HydrophobicContact CD1-CD1 4.3Å; T130-L142 HydrophobicContact CG2-CB 4.45Å; T130-L142 WeakPolarHBondContact OG1-CD1 3.49Å; Y140-L142 HydrophobicContact CE1-CB 3.96Å; Y140-L142 HydrophobicContact CE1-CD1 4.38Å; L142-F147 HydrophobicContact CD2-CB 4.44Å
143	P	80.8	Confident	85.9	Confident	54 Å²	54	71.9 Å²	71.9	35%	0.351	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-59.9	141.4	-177.7	-28.6	38.6	0	0	0	114.7	E141 T145 E150	E141-P143 WeakPolarHBondContact O-CD 3.5Å; P143-T145 PolarHBondContact O-N 2.93Å; P143-E150 VanDerWaalsContact CD-OE1 3.25Å; P143-E150 WeakPolarHBondContact CD-OE1 3.42Å; P143-E150 WeakPolarHBondContact CD-OE2 3.16Å; P143-E150 WeakPolarHBondContact CG-OE2 3.43Å
144	D	74.3	Confident	85.9	Confident	173 Å²	173	70.7 Å²	70.7	93%	0.925	37%	0.373	S	S	*	.	S	Bend	trans	-61	-9.8	178.9	-71.3	-52.3	0	0	0	114.8
145	T	76.8	Confident	86	Confident	97 Å²	97	69.5 Å²	69.5	60%	0.595	36%	0.361	S	S	*	.	S	Bend	trans	-141.6	152.8	-179.8	66.1	0	0	0	0	111.4	P143 F147	P143-T145 PolarHBondContact O-N 2.93Å; T145-F147 PolarHBondContact O-N 2.85Å
146	K	84.4	Confident	86.1	Confident	119 Å²	119	73.8 Å²	73.8	52%	0.517	38%	0.379	S	S	.	.			trans	68.3	22.1	172.4	-65.4	160.9	155.2	-89.9	0	117	E148 E149 E150	K146-E148 WeakPolarHBondContact CA-OE2 3.47Å; K146-E148 PolarHBondContact O-N 3.48Å; K146-E149 HydrophobicContact CB-CG 4.33Å; K146-E149 IonicContact NZ-OE2 2.63Å; K146-E149 PolarHBondContact NZ-OE2 2.9Å; K146-E149 PolarHBondContact O-N 2.95Å; K146-E150 PolarHBondContact O-N 3.5Å; K146-E150 VanDerWaalsContact O-N 3.09Å
147	F	86.7	Confident	86.3	Confident	44 Å²	44	76.5 Å²	76.5	19%	0.193	39%	0.394	C	S	.	.	H	α-helix	trans	-51.3	-29.3	173.1	71	-97.3	0	0	0	113.2	V122 L126 L142 T145 E149 E150 V151 M169 Y170	V122-F147 HydrophobicContact CG1-CE2 3.64Å; V122-F147 HydrophobicContact CG1-CZ 3.7Å; L126-F147 HydrophobicContact CD1-CB 4.42Å; L126-F147 HydrophobicContact CD1-CD1 4.05Å; L126-F147 HydrophobicContact CD1-CD2 3.92Å; L126-F147 HydrophobicContact CD1-CE1 4.31Å; L126-F147 HydrophobicContact CD1-CE2 4.18Å; L126-F147 HydrophobicContact CD1-CG 3.86Å; L126-F147 HydrophobicContact CD1-CZ 4.37Å; L126-F147 HydrophobicContact CD2-CB 3.84Å; L126-F147 HydrophobicContact CD2-CD2 3.69Å; L126-F147 HydrophobicContact CD2-CG 3.89Å; L126-F147 HydrophobicContact CG-CD2 4.31Å; L142-F147 HydrophobicContact CD2-CB 4.44Å; T145-F147 PolarHBondContact O-N 2.85Å; F147-E149 VanDerWaalsContact C-N 3.29Å; F147-E149 PolarHBondContact O-N 3.28Å; F147-E150 PolarHBondContact O-N 3.07Å; F147-V151 WeakPolarHBondContact O-CB 3.3Å; F147-V151 WeakPolarHBondContact O-CG2 3.21Å; F147-V151 PolarHBondContact O-N 3.37Å; F147-M169 HydrophobicContact CE2-CB 4.32Å; F147-Y170 HydrophobicContact CZ-CD1 4.21Å; F147-Y170 HydrophobicContact CZ-CE1 4.39Å
148	E	87.3	Confident	86.5	Confident	30 Å²	30	77.6 Å²	77.6	14%	0.14	40%	0.397	C	S	.	.	H	α-helix	trans	-69.9	-21	177.9	70.2	-89.1	-145.2	0	0	114.5	K146 P152 M169 Y170	K146-E148 WeakPolarHBondContact CA-OE2 3.47Å; K146-E148 PolarHBondContact O-N 3.48Å; E148-P152 WeakPolarHBondContact O-CD 3.5Å; E148-P152 WeakPolarHBondContact O-CG 3.41Å; E148-M169 HydrophobicContact CB-CB 3.79Å; E148-M169 HydrophobicContact CB-CG 4.36Å; E148-Y170 HydrophobicContact CB-CD1 4.43Å; E148-Y170 HydrophobicContact CB-CE1 3.9Å; E148-Y170 VanDerWaalsContact CD-OH 3.24Å; E148-Y170 HydrophobicContact CG-CE1 3.86Å; E148-Y170 HydrophobicContact CG-CE2 4.37Å; E148-Y170 WeakPolarHBondContact CG-OH 3.4Å; E148-Y170 PolarHBondContact OE1-OH 3.45Å
149	E	88.4	Confident	86.8	Confident	73 Å²	73	74.1 Å²	74.1	34%	0.341	38%	0.384	S	S	.	.	H	α-helix	trans	-94.1	-35.1	172.8	-48.1	-162.8	116.6	0	0	110.6	K146 F147 R153 K166	K146-E149 HydrophobicContact CB-CG 4.33Å; K146-E149 IonicContact NZ-OE2 2.63Å; K146-E149 PolarHBondContact NZ-OE2 2.9Å; K146-E149 PolarHBondContact O-N 2.95Å; F147-E149 VanDerWaalsContact C-N 3.29Å; F147-E149 PolarHBondContact O-N 3.28Å; E149-R153 WeakPolarHBondContact O-CB 3.5Å; E149-R153 PolarHBondContact O-N 3.36Å; E149-K166 HydrophobicContact CG-CD 4.22Å; E149-K166 IonicContact OE1-NZ 2.71Å; E149-K166 PolarHBondContact OE1-NZ 3.23Å
150	E	89.7	Confident	87.3	Confident	40 Å²	40	69.9 Å²	69.9	19%	0.187	35%	0.352	C	S	.	.	H	α-helix	trans	-80.8	-46.7	-171.7	-174.1	-179.8	164.5	0	0	114.1	Y140 P143 K146 F147 R153 I154	Y140-E150 VanDerWaalsContact CE2-OE1 3.26Å; Y140-E150 WeakPolarHBondContact CE2-OE1 3.47Å; Y140-E150 PolarHBondContact OH-OE1 3.44Å; P143-E150 VanDerWaalsContact CD-OE1 3.25Å; P143-E150 WeakPolarHBondContact CD-OE1 3.42Å; P143-E150 WeakPolarHBondContact CD-OE2 3.16Å; P143-E150 WeakPolarHBondContact CG-OE2 3.43Å; K146-E150 PolarHBondContact O-N 3.5Å; K146-E150 VanDerWaalsContact O-N 3.09Å; F147-E150 PolarHBondContact O-N 3.07Å; E150-R153 CarbonylContact O-C 3.35Å; E150-R153 WeakPolarHBondContact O-CA 3.44Å; E150-R153 VanDerWaalsContact O-CB 3.32Å; E150-R153 WeakPolarHBondContact O-CB 3.34Å; E150-R153 PolarHBondContact O-N 3.13Å; E150-I154 HydrophobicContact CG-CD1 3.89Å; E150-I154 HydrophobicContact CG-CG1 4.3Å; E150-I154 PolarHBondContact O-N 2.96Å
151	V	91.4	Very high	87.5	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-45.9	-179.8	175.6	0	0	0	0	111.1	F125 L126 F129 F147 R153 I154 F155 M169	F125-V151 HydrophobicContact CE1-CG1 4.14Å; F125-V151 HydrophobicContact CZ-CG1 3.94Å; L126-V151 HydrophobicContact CD2-CG2 4.08Å; F129-V151 HydrophobicContact CD1-CG1 4.35Å; F129-V151 HydrophobicContact CD1-CG2 3.86Å; F129-V151 HydrophobicContact CD2-CG1 4.04Å; F129-V151 HydrophobicContact CE1-CB 4.45Å; F129-V151 HydrophobicContact CE1-CG1 4.25Å; F129-V151 HydrophobicContact CE1-CG2 3.78Å; F129-V151 HydrophobicContact CE2-CG1 3.92Å; F129-V151 HydrophobicContact CG-CG1 4.25Å; F129-V151 HydrophobicContact CG-CG2 4.46Å; F129-V151 HydrophobicContact CZ-CG1 4.03Å; F129-V151 HydrophobicContact CZ-CG2 4.31Å; F147-V151 WeakPolarHBondContact O-CB 3.3Å; F147-V151 WeakPolarHBondContact O-CG2 3.21Å; F147-V151 PolarHBondContact O-N 3.37Å; V151-R153 VanDerWaalsContact C-N 3.27Å; V151-R153 PolarHBondContact O-N 3.32Å; V151-I154 PolarHBondContact O-N 2.69Å; V151-F155 HydrophobicContact CG1-CD2 3.91Å; V151-F155 HydrophobicContact CG1-CE2 3.87Å; V151-F155 WeakPolarHBondContact O-CD2 3.25Å; V151-F155 PolarHBondContact O-N 3.11Å; V151-F155 VanDerWaalsContact O-N 3.09Å; V151-M169 HydrophobicContact CB-SD 3.91Å; V151-M169 HydrophobicContact CG1-SD 3.86Å
152	P	91.6	Very high	87.9	Confident	21 Å²	21	65.8 Å²	65.8	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-31.6	171.1	-25.5	37.5	0	0	0	114.2	E148 K156 L164 M169	E148-P152 WeakPolarHBondContact O-CD 3.5Å; E148-P152 WeakPolarHBondContact O-CG 3.41Å; P152-K156 WeakPolarHBondContact O-CB 3.39Å; P152-K156 PolarHBondContact O-N 3.5Å; P152-K156 VanDerWaalsContact O-N 3.08Å; P152-L164 HydrophobicContact CB-CB 4.1Å; P152-L164 HydrophobicContact CG-CB 4.21Å; P152-M169 HydrophobicContact CG-CE 4.5Å; P152-M169 HydrophobicContact CG-CG 3.65Å; P152-M169 HydrophobicContact CG-SD 3.86Å
153	R	90.7	Very high	88.3	Confident	162 Å²	162	68.6 Å²	68.6	61%	0.611	37%	0.37	S	S	*	.	H	α-helix	trans	-67.8	-48.5	174.1	175.2	-175.6	169.4	-165.6	-4.7	111.1	E149 E150 V151 F155 K156 D157	E149-R153 WeakPolarHBondContact O-CB 3.5Å; E149-R153 PolarHBondContact O-N 3.36Å; E150-R153 CarbonylContact O-C 3.35Å; E150-R153 WeakPolarHBondContact O-CA 3.44Å; E150-R153 VanDerWaalsContact O-CB 3.32Å; E150-R153 WeakPolarHBondContact O-CB 3.34Å; E150-R153 PolarHBondContact O-N 3.13Å; V151-R153 VanDerWaalsContact C-N 3.27Å; V151-R153 PolarHBondContact O-N 3.32Å; R153-F155 VanDerWaalsContact C-N 3.32Å; R153-F155 PolarHBondContact O-N 3.17Å; R153-K156 CarbonylContact O-C 3.5Å; R153-K156 WeakPolarHBondContact O-CA 3.47Å; R153-K156 WeakPolarHBondContact O-CB 3.39Å; R153-K156 PolarHBondContact O-N 3.37Å; R153-D157 VanDerWaalsContact CG-OD2 3.26Å; R153-D157 WeakPolarHBondContact CG-OD2 3.39Å; R153-D157 IonicContact CZ-OD2 3.56Å; R153-D157 IonicContact NE-OD2 2.6Å; R153-D157 PolarHBondContact NE-OD2 2.64Å; R153-D157 IonicContact NH2-OD2 2.87Å; R153-D157 WeakPolarHBondContact O-CB 3.24Å; R153-D157 VanDerWaalsContact O-CG 3.31Å; R153-D157 PolarHBondContact O-N 3.03Å
154	I	92.5	Very high	88.7	Confident	14 Å²	14	67.2 Å²	67.2	7%	0.072	36%	0.359	C	S	.	.	H	α-helix	trans	-58.7	-46.3	179	-67.7	165.5	0	0	0	110	F129 Y133 Y140 E150 V151 K156 D157 L158	F129-I154 HydrophobicContact CE1-CD1 3.89Å; F129-I154 HydrophobicContact CZ-CB 4.02Å; F129-I154 HydrophobicContact CZ-CD1 3.84Å; F129-I154 HydrophobicContact CZ-CG2 3.82Å; Y133-I154 HydrophobicContact CD1-CD1 4.2Å; Y133-I154 HydrophobicContact CD1-CG2 4.19Å; Y133-I154 HydrophobicContact CD2-CG2 3.85Å; Y133-I154 HydrophobicContact CE1-CD1 3.91Å; Y133-I154 HydrophobicContact CE1-CG1 4.33Å; Y133-I154 HydrophobicContact CE1-CG2 3.83Å; Y133-I154 HydrophobicContact CE2-CG2 3.46Å; Y133-I154 VanDerWaalsContact CE2-CG2 3.46Å; Y133-I154 HydrophobicContact CG-CG2 4.21Å; Y133-I154 VanDerWaalsContact CZ-CG2 3.45Å; Y140-I154 HydrophobicContact CE2-CD1 3.85Å; E150-I154 HydrophobicContact CG-CD1 3.89Å; E150-I154 HydrophobicContact CG-CG1 4.3Å; E150-I154 PolarHBondContact O-N 2.96Å; V151-I154 PolarHBondContact O-N 2.69Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 2.89Å; I154-D157 PolarHBondContact O-N 3.2Å; I154-L158 HydrophobicContact CG2-CD1 3.92Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 WeakPolarHBondContact O-CB 3.41Å; I154-L158 VanDerWaalsContact O-CG 3.28Å; I154-L158 WeakPolarHBondContact O-CG 3.14Å; I154-L158 PolarHBondContact O-N 2.49Å
155	F	92.9	Very high	89.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.009	33%	0.332	C	S	.	.	H	α-helix	trans	-57	-44.1	173.8	-86.3	-72.4	0	0	0	112.3	F129 V151 R153 G159 Y160 L164 A184 L185 W187 L188	F129-F155 AromaticContact CD2-CE2 3.78Å; F129-F155 HydrophobicContact CD2-CE2 3.78Å; F129-F155 HydrophobicContact CD2-CZ 4.15Å; F129-F155 HydrophobicContact CE2-CD2 4.07Å; F129-F155 AromaticContact CE2-CE2 3.49Å; F129-F155 HydrophobicContact CE2-CE2 3.49Å; F129-F155 VanDerWaalsContact CE2-CE2 3.49Å; F129-F155 AromaticContact CE2-CZ 3.98Å; F129-F155 HydrophobicContact CE2-CZ 3.98Å; V151-F155 HydrophobicContact CG1-CD2 3.91Å; V151-F155 HydrophobicContact CG1-CE2 3.87Å; V151-F155 WeakPolarHBondContact O-CD2 3.25Å; V151-F155 PolarHBondContact O-N 3.11Å; V151-F155 VanDerWaalsContact O-N 3.09Å; R153-F155 VanDerWaalsContact C-N 3.32Å; R153-F155 PolarHBondContact O-N 3.17Å; F155-G159 PolarHBondContact O-N 2.93Å; F155-Y160 HydrophobicContact CB-CD1 4.05Å; F155-Y160 HydrophobicContact CB-CG 4.35Å; F155-Y160 HydrophobicContact CD1-CD1 4.02Å; F155-Y160 AromaticContact CD1-CG 4Å; F155-Y160 HydrophobicContact CD1-CG 4Å; F155-Y160 HydrophobicContact CG-CD1 4.28Å; F155-Y160 WeakPolarHBondContact O-CB 3.33Å; F155-Y160 PolarHBondContact O-N 3.18Å; F155-L164 HydrophobicContact CB-CD1 4.31Å; F155-L164 HydrophobicContact CD2-CD1 3.51Å; F155-L164 HydrophobicContact CE2-CD1 3.96Å; F155-L164 HydrophobicContact CG-CD1 3.92Å; F155-A184 HydrophobicContact CD1-CB 4.33Å; F155-A184 HydrophobicContact CE1-CB 3.77Å; F155-A184 WeakPolarHBondContact CE1-O 3.5Å; F155-A184 HydrophobicContact CE2-CB 4.46Å; F155-A184 HydrophobicContact CZ-CB 3.85Å; F155-L185 HydrophobicContact CZ-CD2 4.47Å; F155-W187 AromaticContact CD1-CE3 3.97Å; F155-W187 HydrophobicContact CD1-CE3 3.97Å; F155-W187 AromaticContact CD1-CZ3 3.8Å; F155-W187 HydrophobicContact CD1-CZ3 3.8Å; F155-W187 AromaticContact CE1-CE3 3.99Å; F155-W187 HydrophobicContact CE1-CE3 3.99Å; F155-W187 HydrophobicContact CE1-CZ3 4.16Å; F155-L188 HydrophobicContact CE1-CB 4.07Å; F155-L188 HydrophobicContact CZ-CB 4.4Å; F155-L188 HydrophobicContact CZ-CD2 4.25Å
156	K	91.8	Very high	89.9	Confident	157 Å²	157	61.9 Å²	61.9	68%	0.683	33%	0.326	S	S	*	.	H	α-helix	trans	-66.2	-43.1	177.5	-172.8	-162.7	172.1	-158.1	0	112.8	P152 R153 I154 L158 G159	P152-K156 WeakPolarHBondContact O-CB 3.39Å; P152-K156 PolarHBondContact O-N 3.5Å; P152-K156 VanDerWaalsContact O-N 3.08Å; R153-K156 CarbonylContact O-C 3.5Å; R153-K156 WeakPolarHBondContact O-CA 3.47Å; R153-K156 WeakPolarHBondContact O-CB 3.39Å; R153-K156 PolarHBondContact O-N 3.37Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 2.89Å; K156-L158 VanDerWaalsContact C-N 3.29Å; K156-L158 PolarHBondContact O-N 3.16Å; K156-G159 WeakPolarHBondContact O-CA 3.14Å; K156-G159 PolarHBondContact O-N 3.39Å
157	D	91.3	Very high	90	Very high	96 Å²	96	60.1 Å²	60.1	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-71.2	-26.7	-177.9	-67.4	-3.3	0	0	0	110.6	R153 I154 G159	R153-D157 VanDerWaalsContact CG-OD2 3.26Å; R153-D157 WeakPolarHBondContact CG-OD2 3.39Å; R153-D157 IonicContact CZ-OD2 3.56Å; R153-D157 IonicContact NE-OD2 2.6Å; R153-D157 PolarHBondContact NE-OD2 2.64Å; R153-D157 IonicContact NH2-OD2 2.87Å; R153-D157 WeakPolarHBondContact O-CB 3.24Å; R153-D157 VanDerWaalsContact O-CG 3.31Å; R153-D157 PolarHBondContact O-N 3.03Å; I154-D157 PolarHBondContact O-N 3.2Å; D157-G159 VanDerWaalsContact C-N 3.26Å; D157-G159 PolarHBondContact O-N 3.45Å
158	L	91.8	Very high	90	Very high	60 Å²	60	59.2 Å²	59.2	31%	0.314	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-3.5	164.9	-70.6	173.8	0	0	0	114.3	Y133 L136 I154 K156 W187 L188	Y133-L158 HydrophobicContact CD2-CD1 4.14Å; Y133-L158 HydrophobicContact CE2-CD1 3.9Å; Y133-L158 HydrophobicContact CE2-CD2 4.28Å; Y133-L158 HydrophobicContact CE2-CG 4.33Å; L136-L158 HydrophobicContact CD1-CD1 4.11Å; L136-L158 HydrophobicContact CD1-CD2 3.96Å; I154-L158 HydrophobicContact CG2-CD1 3.92Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 WeakPolarHBondContact O-CB 3.41Å; I154-L158 VanDerWaalsContact O-CG 3.28Å; I154-L158 WeakPolarHBondContact O-CG 3.14Å; I154-L158 PolarHBondContact O-N 2.49Å; K156-L158 VanDerWaalsContact C-N 3.29Å; K156-L158 PolarHBondContact O-N 3.16Å; L158-W187 HydrophobicContact CB-CH2 3.88Å; L158-W187 HydrophobicContact CB-CZ3 4.24Å; L158-L188 HydrophobicContact CD1-CD1 3.77Å
159	G	91.6	Very high	90.2	Very high	51 Å²	51	57.8 Å²	57.8	53%	0.526	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	20	179.2	0	0	0	0	0	116	F155 K156 D157 P161	F155-G159 PolarHBondContact O-N 2.93Å; K156-G159 WeakPolarHBondContact O-CA 3.14Å; K156-G159 PolarHBondContact O-N 3.39Å; D157-G159 VanDerWaalsContact C-N 3.26Å; D157-G159 PolarHBondContact O-N 3.45Å; G159-P161 WeakPolarHBondContact O-CD 3.11Å
160	Y	93.4	Very high	90.1	Very high	17 Å²	17	60.6 Å²	60.6	7%	0.067	33%	0.33	C	S	.	.			trans	-60.8	121.6	176.9	-174.9	-130	0	0	0	111.4	R84 F155 F162 L164 A184 W187	R84-Y160 PolarHBondContact NH2-OH 3.49Å; F155-Y160 HydrophobicContact CB-CD1 4.05Å; F155-Y160 HydrophobicContact CB-CG 4.35Å; F155-Y160 HydrophobicContact CD1-CD1 4.02Å; F155-Y160 AromaticContact CD1-CG 4Å; F155-Y160 HydrophobicContact CD1-CG 4Å; F155-Y160 HydrophobicContact CG-CD1 4.28Å; F155-Y160 WeakPolarHBondContact O-CB 3.33Å; F155-Y160 PolarHBondContact O-N 3.18Å; Y160-F162 WeakPolarHBondContact CD1-O 3.39Å; Y160-F162 HydrophobicContact CE1-CB 3.99Å; Y160-F162 WeakPolarHBondContact CE1-O 3.43Å; Y160-F162 HydrophobicContact CE2-CD2 4.06Å; Y160-F162 PolarHBondContact O-N 3.4Å; Y160-F162 VanDerWaalsContact O-N 3.08Å; Y160-L164 HydrophobicContact CD1-CG 4.41Å; Y160-L164 HydrophobicContact CE1-CD1 4.45Å; Y160-L164 HydrophobicContact CE1-CD2 4.01Å; Y160-L164 HydrophobicContact CE1-CG 4.06Å; Y160-A184 HydrophobicContact CE1-CB 3.82Å; Y160-A184 HydrophobicContact CE2-CB 4.35Å; Y160-A184 WeakPolarHBondContact OH-CA 3.4Å; Y160-A184 WeakPolarHBondContact OH-CB 3.46Å; Y160-W187 HydrophobicContact CD2-CB 4.48Å; Y160-W187 AromaticContact CD2-CD2 3.44Å; Y160-W187 HydrophobicContact CD2-CD2 3.44Å; Y160-W187 VanDerWaalsContact CD2-CD2 3.44Å; Y160-W187 AromaticContact CD2-CE2 3.78Å; Y160-W187 AromaticContact CD2-CE3 3.57Å; Y160-W187 HydrophobicContact CD2-CE3 3.57Å; Y160-W187 AromaticContact CD2-CG 3.86Å; Y160-W187 HydrophobicContact CD2-CG 3.86Å; Y160-W187 HydrophobicContact CD2-CH2 4.3Å; Y160-W187 HydrophobicContact CD2-CZ2 4.19Å; Y160-W187 HydrophobicContact CD2-CZ3 4.02Å; Y160-W187 HydrophobicContact CE2-CB 4.13Å; Y160-W187 AromaticContact CE2-CD2 4Å; Y160-W187 HydrophobicContact CE2-CD2 4Å; Y160-W187 HydrophobicContact CE2-CE3 4.25Å; Y160-W187 AromaticContact CE2-CG 3.94Å; Y160-W187 HydrophobicContact CE2-CG 3.94Å; Y160-W187 HydrophobicContact CG-CD2 4.38Å; Y160-W187 HydrophobicContact CG-CE3 4.13Å; Y160-W187 HydrophobicContact CG-CH2 4.43Å; Y160-W187 HydrophobicContact CG-CZ3 4.17Å
161	P	89.9	Confident	90	Very high	80 Å²	80	61.6 Å²	61.6	52%	0.519	34%	0.339	S	S	.	.	S	Bend	trans	-69.5	-10.1	-170	-23.5	34.5	0	0	0	116.2	G159	G159-P161 WeakPolarHBondContact O-CD 3.11Å
162	F	90.4	Very high	89.9	Confident	44 Å²	44	61.6 Å²	61.6	19%	0.193	34%	0.339	C	S	.	.	S	Bend	trans	-122.6	115.2	-168.3	-52.7	-70.9	0	0	0	111.6	I80 D82 R84 Y160 L164	I80-F162 HydrophobicContact CG2-CE1 3.84Å; I80-F162 HydrophobicContact CG2-CZ 4.43Å; D82-F162 VanDerWaalsContact CA-CE1 3.46Å; D82-F162 HydrophobicContact CB-CD1 4.09Å; D82-F162 HydrophobicContact CB-CE1 3.77Å; D82-F162 HydrophobicContact CB-CE2 4.46Å; D82-F162 HydrophobicContact CB-CZ 3.98Å; R84-F162 VanDerWaalsContact NH2-CD2 3.28Å; Y160-F162 WeakPolarHBondContact CD1-O 3.39Å; Y160-F162 HydrophobicContact CE1-CB 3.99Å; Y160-F162 WeakPolarHBondContact CE1-O 3.43Å; Y160-F162 HydrophobicContact CE2-CD2 4.06Å; Y160-F162 PolarHBondContact O-N 3.4Å; Y160-F162 VanDerWaalsContact O-N 3.08Å; F162-L164 PolarHBondContact O-N 3.46Å
163	A	87.2	Confident	89.6	Confident	106 Å²	106	61.5 Å²	61.5	88%	0.876	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-65.7	116.4	-173.8	0	0	0	0	0	112.7
164	L	89.2	Confident	89.6	Confident	25 Å²	25	55 Å²	55	13%	0.131	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-78.2	135.7	168.3	-58.6	-178.1	0	0	0	109.7	P152 F155 Y160 F162 M169 I181 A184	P152-L164 HydrophobicContact CB-CB 4.1Å; P152-L164 HydrophobicContact CG-CB 4.21Å; F155-L164 HydrophobicContact CB-CD1 4.31Å; F155-L164 HydrophobicContact CD2-CD1 3.51Å; F155-L164 HydrophobicContact CE2-CD1 3.96Å; F155-L164 HydrophobicContact CG-CD1 3.92Å; Y160-L164 HydrophobicContact CD1-CG 4.41Å; Y160-L164 HydrophobicContact CE1-CD1 4.45Å; Y160-L164 HydrophobicContact CE1-CD2 4.01Å; Y160-L164 HydrophobicContact CE1-CG 4.06Å; F162-L164 PolarHBondContact O-N 3.46Å; L164-M169 HydrophobicContact CB-CE 4.13Å; L164-M169 HydrophobicContact CD1-CE 4.21Å; L164-I181 HydrophobicContact CD2-CD1 4.12Å; L164-A184 HydrophobicContact CD1-CB 4.23Å; L164-A184 HydrophobicContact CD2-CB 4.5Å
165	S	88.9	Confident	89.3	Confident	49 Å²	49	60.1 Å²	60.1	34%	0.343	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-94	151.3	-178.2	82.7	0	0	0	0	112.2	S167 S168 M169	S165-S167 VanDerWaalsContact C-N 3.27Å; S165-S167 PolarHBondContact O-N 3.13Å; S165-S167 PolarHBondContact OG-OG 3.31Å; S165-S167 VanDerWaalsContact OG-OG 3.08Å; S165-S168 WeakPolarHBondContact O-CA 3.47Å; S165-S168 WeakPolarHBondContact O-CB 3.38Å; S165-S168 PolarHBondContact O-N 2.92Å; S165-S168 PolarHBondContact OG-N 3.44Å; S165-S168 VanDerWaalsContact OG-N 3.14Å; S165-S168 PolarHBondContact OG-OG 3.39Å; S165-M169 PolarHBondContact O-N 3.07Å
166	K	87.4	Confident	89	Confident	110 Å²	110	66.6 Å²	66.6	48%	0.478	39%	0.386	S	S	.	.	H	α-helix	trans	-57.4	-39.8	176.5	-58.4	-169.9	-178.3	179.4	0	112.2	E149 S168 M169	E149-K166 HydrophobicContact CG-CD 4.22Å; E149-K166 IonicContact OE1-NZ 2.71Å; E149-K166 PolarHBondContact OE1-NZ 3.23Å; K166-S168 VanDerWaalsContact C-N 3.28Å; K166-S168 PolarHBondContact O-N 3.44Å; K166-M169 WeakPolarHBondContact O-CB 3.25Å; K166-M169 PolarHBondContact O-N 3.05Å
167	S	86.7	Confident	88.9	Confident	81 Å²	81	59.5 Å²	59.5	57%	0.566	36%	0.356	S	S	*	.	H	α-helix	trans	-65.7	-28	175.7	40.9	0	0	0	0	113.2	S165 M169 T171	S165-S167 VanDerWaalsContact C-N 3.27Å; S165-S167 PolarHBondContact O-N 3.13Å; S165-S167 PolarHBondContact OG-OG 3.31Å; S165-S167 VanDerWaalsContact OG-OG 3.08Å; S167-M169 VanDerWaalsContact C-N 3.3Å; S167-M169 PolarHBondContact O-N 3.35Å; S167-T171 PolarHBondContact O-N 2.91Å; S167-T171 PolarHBondContact O-OG1 3.03Å
168	S	87	Confident	89	Confident	26 Å²	26	55.3 Å²	55.3	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-34.3	170.1	-54.6	0	0	0	0	112	S165 K166 T171 V172	S165-S168 WeakPolarHBondContact O-CA 3.47Å; S165-S168 WeakPolarHBondContact O-CB 3.38Å; S165-S168 PolarHBondContact O-N 2.92Å; S165-S168 PolarHBondContact OG-N 3.44Å; S165-S168 VanDerWaalsContact OG-N 3.14Å; S165-S168 PolarHBondContact OG-OG 3.39Å; K166-S168 VanDerWaalsContact C-N 3.28Å; K166-S168 PolarHBondContact O-N 3.44Å; S168-T171 CarbonylContact O-C 3.43Å; S168-T171 PolarHBondContact O-N 3.08Å; S168-T171 VanDerWaalsContact O-N 3.13Å; S168-V172 WeakPolarHBondContact O-CA 3.11Å; S168-V172 VanDerWaalsContact O-CG1 3.27Å; S168-V172 WeakPolarHBondContact O-CG1 3.49Å; S168-V172 PolarHBondContact O-N 3.38Å
169	M	89.5	Confident	89	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71	-32.3	-177.9	-57.9	-64	97.3	0	0	112.9	F125 F147 E148 V151 P152 L164 S165 K166 S167 T171 V172 I181	F125-M169 HydrophobicContact CE1-SD 4.28Å; F147-M169 HydrophobicContact CE2-CB 4.32Å; E148-M169 HydrophobicContact CB-CB 3.79Å; E148-M169 HydrophobicContact CB-CG 4.36Å; V151-M169 HydrophobicContact CB-SD 3.91Å; V151-M169 HydrophobicContact CG1-SD 3.86Å; P152-M169 HydrophobicContact CG-CE 4.5Å; P152-M169 HydrophobicContact CG-CG 3.65Å; P152-M169 HydrophobicContact CG-SD 3.86Å; L164-M169 HydrophobicContact CB-CE 4.13Å; L164-M169 HydrophobicContact CD1-CE 4.21Å; S165-M169 PolarHBondContact O-N 3.07Å; K166-M169 WeakPolarHBondContact O-CB 3.25Å; K166-M169 PolarHBondContact O-N 3.05Å; S167-M169 VanDerWaalsContact C-N 3.3Å; S167-M169 PolarHBondContact O-N 3.35Å; M169-T171 VanDerWaalsContact C-N 3.27Å; M169-T171 PolarHBondContact O-N 3.19Å; M169-V172 HydrophobicContact CE-CG1 4.44Å; M169-I181 HydrophobicContact CE-CD1 3.48Å; M169-I181 VanDerWaalsContact CE-CD1 3.48Å
170	Y	86.8	Confident	89	Confident	131 Å²	131	55.3 Å²	55.3	51%	0.514	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-13.2	170.9	-57	-52.2	0	0	0	113.5	F147 E148	F147-Y170 HydrophobicContact CZ-CD1 4.21Å; F147-Y170 HydrophobicContact CZ-CE1 4.39Å; E148-Y170 HydrophobicContact CB-CD1 4.43Å; E148-Y170 HydrophobicContact CB-CE1 3.9Å; E148-Y170 VanDerWaalsContact CD-OH 3.24Å; E148-Y170 HydrophobicContact CG-CE1 3.86Å; E148-Y170 HydrophobicContact CG-CE2 4.37Å; E148-Y170 WeakPolarHBondContact CG-OH 3.4Å; E148-Y170 PolarHBondContact OE1-OH 3.45Å
171	T	88.1	Confident	89	Confident	62 Å²	62	54.5 Å²	54.5	38%	0.38	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	27	-170.6	61.3	0	0	0	0	113.6	S167 S168 M169 G173 A174 T177	S167-T171 PolarHBondContact O-N 2.91Å; S167-T171 PolarHBondContact O-OG1 3.03Å; S168-T171 CarbonylContact O-C 3.43Å; S168-T171 PolarHBondContact O-N 3.08Å; S168-T171 VanDerWaalsContact O-N 3.13Å; M169-T171 VanDerWaalsContact C-N 3.27Å; M169-T171 PolarHBondContact O-N 3.19Å; T171-G173 VanDerWaalsContact C-N 3.31Å; T171-G173 PolarHBondContact O-N 2.97Å; T171-G173 VanDerWaalsContact O-N 3.12Å; T171-A174 WeakPolarHBondContact O-CB 3.44Å; T171-A174 PolarHBondContact O-N 2.92Å; T171-T177 WeakPolarHBondContact O-CB 3.48Å; T171-T177 WeakPolarHBondContact O-CG2 3.48Å
172	V	88.5	Confident	89.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-41.4	-169.7	-66.4	0	0	0	0	115	V122 F125 S168 M169 A174 W178 I181	V122-V172 HydrophobicContact CG2-CG2 4.09Å; F125-V172 HydrophobicContact CB-CB 4.37Å; F125-V172 HydrophobicContact CB-CG2 3.66Å; F125-V172 HydrophobicContact CD1-CB 4.39Å; F125-V172 HydrophobicContact CD1-CG1 3.75Å; F125-V172 HydrophobicContact CD1-CG2 4.25Å; F125-V172 HydrophobicContact CD2-CG1 4.43Å; F125-V172 HydrophobicContact CE1-CG1 3.98Å; F125-V172 HydrophobicContact CG-CB 4.15Å; F125-V172 HydrophobicContact CG-CG1 3.98Å; F125-V172 HydrophobicContact CG-CG2 3.94Å; F125-V172 HydrophobicContact CZ-CG1 4.43Å; S168-V172 WeakPolarHBondContact O-CA 3.11Å; S168-V172 VanDerWaalsContact O-CG1 3.27Å; S168-V172 WeakPolarHBondContact O-CG1 3.49Å; S168-V172 PolarHBondContact O-N 3.38Å; M169-V172 HydrophobicContact CE-CG1 4.44Å; V172-A174 VanDerWaalsContact C-N 3.31Å; V172-A174 PolarHBondContact O-N 3.46Å; V172-W178 WeakPolarHBondContact O-CA 3.49Å; V172-W178 VanDerWaalsContact O-CB 3.27Å; V172-W178 WeakPolarHBondContact O-CB 3.32Å; V172-W178 PolarHBondContact O-N 2.98Å; V172-I181 HydrophobicContact CB-CG1 4.34Å; V172-I181 HydrophobicContact CB-CG2 4.46Å; V172-I181 HydrophobicContact CG1-CG1 4.3Å; V172-I181 HydrophobicContact CG1-CG2 4.48Å
173	G	86.9	Confident	89.2	Confident	18 Å²	18	48.7 Å²	48.7	19%	0.186	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	2.3	179.1	0	0	0	0	0	115.5	A119 P120 T171	A119-G173 WeakPolarHBondContact CB-O 3.37Å; P120-G173 WeakPolarHBondContact O-CA 3.5Å; T171-G173 VanDerWaalsContact C-N 3.31Å; T171-G173 PolarHBondContact O-N 2.97Å; T171-G173 VanDerWaalsContact O-N 3.12Å
174	A	89.2	Confident	89.6	Confident	25 Å²	25	43.7 Å²	43.7	21%	0.207	24%	0.241	C	C	.	.	S	Bend	trans	-70.7	143.6	-179.1	0	0	0	0	0	111.3	T171 V172 H176 T177 W178	T171-A174 WeakPolarHBondContact O-CB 3.44Å; T171-A174 PolarHBondContact O-N 2.92Å; V172-A174 VanDerWaalsContact C-N 3.31Å; V172-A174 PolarHBondContact O-N 3.46Å; A174-H176 PolarHBondContact O-N 3.02Å; A174-T177 PolarHBondContact O-N 3.06Å; A174-W178 PolarHBondContact O-N 2.88Å
175	P	86	Confident	89.8	Confident	122 Å²	122	42.5 Å²	42.5	79%	0.792	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.1	-170.4	-29.3	36	0	0	0	117	P179	P175-P179 WeakPolarHBondContact O-CD 3.38Å
176	H	87	Confident	90.1	Very high	139 Å²	139	40.6 Å²	40.6	64%	0.644	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	-20.3	175.2	56.1	-96.9	0	0	0	113.3	A174 H180	A174-H176 PolarHBondContact O-N 3.02Å; H176-H180 PolarHBondContact O-CE1 3.37Å; H176-H180 PolarHBondContact O-ND1 2.94Å
177	T	90.6	Very high	90.5	Very high	8 Å²	8	38.1 Å²	38.1	5%	0.049	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-48.9	-179.8	-57.6	0	0	0	0	110.7	T171 A174 P179 H180 I181	T171-T177 WeakPolarHBondContact O-CB 3.48Å; T171-T177 WeakPolarHBondContact O-CG2 3.48Å; A174-T177 PolarHBondContact O-N 3.06Å; T177-P179 VanDerWaalsContact C-CD 3.44Å; T177-H180 WeakPolarHBondContact O-CB 3.43Å; T177-H180 PolarHBondContact O-N 3.38Å; T177-I181 HydrophobicContact CG2-CD1 4.31Å; T177-I181 HydrophobicContact CG2-CG1 3.83Å; T177-I181 PolarHBondContact O-N 3.26Å
178	W	92.3	Very high	90.9	Very high	8 Å²	8	34.2 Å²	34.2	3%	0.03	18%	0.182	C	C	.	.	H	α-helix	trans	-53.1	-39.8	-174.2	-175	-129.1	0	0	0	114.7	L99 L117 P120 F125 V172 A174 H180 I181 V182 L185	L99-W178 HydrophobicContact CD2-CH2 4.19Å; L99-W178 HydrophobicContact CD2-CZ2 4.39Å; L117-W178 VanDerWaalsContact O-CE2 3.32Å; L117-W178 WeakPolarHBondContact O-CZ2 3.4Å; L117-W178 PolarHBondContact O-NE1 2.78Å; P120-W178 HydrophobicContact CG-CD2 4.13Å; P120-W178 HydrophobicContact CG-CE3 3.85Å; P120-W178 HydrophobicContact CG-CH2 3.52Å; P120-W178 HydrophobicContact CG-CZ2 3.75Å; P120-W178 HydrophobicContact CG-CZ3 3.54Å; F125-W178 HydrophobicContact CD2-CZ3 4.34Å; V172-W178 WeakPolarHBondContact O-CA 3.49Å; V172-W178 VanDerWaalsContact O-CB 3.27Å; V172-W178 WeakPolarHBondContact O-CB 3.32Å; V172-W178 PolarHBondContact O-N 2.98Å; A174-W178 PolarHBondContact O-N 2.88Å; W178-H180 VanDerWaalsContact C-N 3.26Å; W178-H180 PolarHBondContact O-N 2.94Å; W178-I181 HydrophobicContact CE3-CB 3.81Å; W178-I181 HydrophobicContact CE3-CG2 3.87Å; W178-I181 HydrophobicContact CZ3-CB 4.06Å; W178-I181 HydrophobicContact CZ3-CG2 3.62Å; W178-I181 PolarHBondContact O-N 3.22Å; W178-I181 VanDerWaalsContact O-N 3.08Å; W178-V182 HydrophobicContact CD2-CB 4.24Å; W178-V182 HydrophobicContact CH2-CB 4.04Å; W178-V182 HydrophobicContact CH2-CG2 4.18Å; W178-V182 HydrophobicContact CZ2-CB 3.74Å; W178-V182 HydrophobicContact CZ2-CG2 3.75Å; W178-V182 HydrophobicContact CZ3-CB 4.44Å; W178-V182 WeakPolarHBondContact O-CG1 3.48Å; W178-V182 PolarHBondContact O-N 3.07Å; W178-L185 HydrophobicContact CH2-CD1 3.88Å; W178-L185 HydrophobicContact CZ3-CD1 4.11Å
179	P	92.6	Very high	91.3	Very high	20 Å²	20	33 Å²	33	13%	0.13	17%	0.174	C	C	.	.	H	α-helix	trans	-53.7	-39.2	173.9	-30.5	38.4	0	0	0	114.6	L86 I92 P175 T177 A183	L86-P179 WeakPolarHBondContact O-CB 3.27Å; I92-P179 HydrophobicContact CD1-CB 3.7Å; I92-P179 HydrophobicContact CG1-CB 3.96Å; I92-P179 HydrophobicContact CG1-CG 4.45Å; P175-P179 WeakPolarHBondContact O-CD 3.38Å; T177-P179 VanDerWaalsContact C-CD 3.44Å; P179-A183 VanDerWaalsContact O-CB 3.3Å; P179-A183 WeakPolarHBondContact O-CB 3.19Å; P179-A183 PolarHBondContact O-N 2.68Å
180	H	91.2	Very high	91.5	Very high	90 Å²	90	36.1 Å²	36.1	42%	0.417	19%	0.19	S	C	.	.	H	α-helix	trans	-75.3	-33.8	178.6	-59.3	86.6	0	0	0	111.9	L86 H176 T177 W178 A184	L86-H180 HydrophobicContact CD1-CB 4.49Å; L86-H180 WeakPolarHBondContact CD1-CD2 3.27Å; H176-H180 PolarHBondContact O-CE1 3.37Å; H176-H180 PolarHBondContact O-ND1 2.94Å; T177-H180 WeakPolarHBondContact O-CB 3.43Å; T177-H180 PolarHBondContact O-N 3.38Å; W178-H180 VanDerWaalsContact C-N 3.26Å; W178-H180 PolarHBondContact O-N 2.94Å; H180-A184 PolarHBondContact O-N 3.2Å
181	I	92.9	Very high	91.8	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-75.8	-46.6	-179.3	-57	-56.1	0	0	0	111.4	F125 L164 M169 V172 T177 W178 A183 A184 L185	F125-I181 HydrophobicContact CD2-CG2 3.59Å; F125-I181 HydrophobicContact CE2-CG2 3.19Å; F125-I181 HydrophobicContact CZ-CG2 3.96Å; L164-I181 HydrophobicContact CD2-CD1 4.12Å; M169-I181 HydrophobicContact CE-CD1 3.48Å; M169-I181 VanDerWaalsContact CE-CD1 3.48Å; V172-I181 HydrophobicContact CB-CG1 4.34Å; V172-I181 HydrophobicContact CB-CG2 4.46Å; V172-I181 HydrophobicContact CG1-CG1 4.3Å; V172-I181 HydrophobicContact CG1-CG2 4.48Å; T177-I181 HydrophobicContact CG2-CD1 4.31Å; T177-I181 HydrophobicContact CG2-CG1 3.83Å; T177-I181 PolarHBondContact O-N 3.26Å; W178-I181 HydrophobicContact CE3-CB 3.81Å; W178-I181 HydrophobicContact CE3-CG2 3.87Å; W178-I181 HydrophobicContact CZ3-CB 4.06Å; W178-I181 HydrophobicContact CZ3-CG2 3.62Å; W178-I181 PolarHBondContact O-N 3.22Å; W178-I181 VanDerWaalsContact O-N 3.08Å; I181-A183 VanDerWaalsContact C-N 3.29Å; I181-A183 PolarHBondContact O-N 3.16Å; I181-A184 WeakPolarHBondContact O-CA 3.42Å; I181-A184 WeakPolarHBondContact O-CB 3.46Å; I181-A184 PolarHBondContact O-N 2.89Å; I181-L185 HydrophobicContact CG2-CD1 4.38Å; I181-L185 WeakPolarHBondContact O-CG 3.41Å; I181-L185 PolarHBondContact O-N 3.48Å
182	V	92.9	Very high	92	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-34.7	178.5	75.1	0	0	0	0	111.5	I92 C95 I96 L99 W178 A184 L185 V186	I92-V182 HydrophobicContact CD1-CG1 4.24Å; I92-V182 HydrophobicContact CG2-CG1 4.21Å; C95-V182 HydrophobicContact CB-CG1 4.02Å; C95-V182 HydrophobicContact CB-CG2 4.11Å; I96-V182 HydrophobicContact CG1-CG2 3.96Å; L99-V182 HydrophobicContact CD2-CG2 3.96Å; W178-V182 HydrophobicContact CD2-CB 4.24Å; W178-V182 HydrophobicContact CH2-CB 4.04Å; W178-V182 HydrophobicContact CH2-CG2 4.18Å; W178-V182 HydrophobicContact CZ2-CB 3.74Å; W178-V182 HydrophobicContact CZ2-CG2 3.75Å; W178-V182 HydrophobicContact CZ3-CB 4.44Å; W178-V182 WeakPolarHBondContact O-CG1 3.48Å; W178-V182 PolarHBondContact O-N 3.07Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.41Å; V182-L185 PolarHBondContact O-N 3.05Å; V182-V186 WeakPolarHBondContact O-CG2 3.43Å; V182-V186 PolarHBondContact O-N 3.38Å
183	A	93.3	Very high	92.1	Very high	2 Å²	2	33.2 Å²	33.2	2%	0.017	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-31.4	171.8	0	0	0	0	0	112.8	R84 L86 P179 I181 W187	R84-A183 PolarHBondContact NH1-O 2.64Å; L86-A183 HydrophobicContact CD2-CB 3.57Å; P179-A183 VanDerWaalsContact O-CB 3.3Å; P179-A183 WeakPolarHBondContact O-CB 3.19Å; P179-A183 PolarHBondContact O-N 2.68Å; I181-A183 VanDerWaalsContact C-N 3.29Å; I181-A183 PolarHBondContact O-N 3.16Å; A183-W187 WeakPolarHBondContact O-CB 3.23Å; A183-W187 PolarHBondContact O-N 2.95Å; A183-W187 VanDerWaalsContact O-N 3.11Å
184	A	94.1	Very high	92.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-70.2	-42.4	171.3	0	0	0	0	0	111.8	F155 Y160 L164 H180 I181 V182 W187 L188	F155-A184 HydrophobicContact CD1-CB 4.33Å; F155-A184 HydrophobicContact CE1-CB 3.77Å; F155-A184 WeakPolarHBondContact CE1-O 3.5Å; F155-A184 HydrophobicContact CE2-CB 4.46Å; F155-A184 HydrophobicContact CZ-CB 3.85Å; Y160-A184 HydrophobicContact CE1-CB 3.82Å; Y160-A184 HydrophobicContact CE2-CB 4.35Å; Y160-A184 WeakPolarHBondContact OH-CA 3.4Å; Y160-A184 WeakPolarHBondContact OH-CB 3.46Å; L164-A184 HydrophobicContact CD1-CB 4.23Å; L164-A184 HydrophobicContact CD2-CB 4.5Å; H180-A184 PolarHBondContact O-N 3.2Å; I181-A184 WeakPolarHBondContact O-CA 3.42Å; I181-A184 WeakPolarHBondContact O-CB 3.46Å; I181-A184 PolarHBondContact O-N 2.89Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.41Å; A184-W187 PolarHBondContact O-N 2.96Å; A184-L188 PolarHBondContact O-N 3.18Å
185	L	94.7	Very high	92.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-37.3	176.7	-66.3	172.2	0	0	0	112.7	L99 F125 I128 F129 L132 F155 W178 I181 V182 L188 I189	L99-L185 HydrophobicContact CD1-CB 4.35Å; L99-L185 HydrophobicContact CD2-CB 4.43Å; L99-L185 HydrophobicContact CD2-CD1 3.87Å; F125-L185 HydrophobicContact CD2-CD1 4.01Å; F125-L185 HydrophobicContact CE2-CD1 3.96Å; F125-L185 HydrophobicContact CE2-CD2 3.92Å; F125-L185 HydrophobicContact CE2-CG 4.13Å; I128-L185 HydrophobicContact CG2-CD1 4.11Å; I128-L185 HydrophobicContact CG2-CD2 4.45Å; F129-L185 HydrophobicContact CB-CD2 4.39Å; F129-L185 HydrophobicContact CD2-CD2 4.33Å; L132-L185 HydrophobicContact CD1-CB 4.25Å; L132-L185 HydrophobicContact CD1-CD2 3.99Å; F155-L185 HydrophobicContact CZ-CD2 4.47Å; W178-L185 HydrophobicContact CH2-CD1 3.88Å; W178-L185 HydrophobicContact CZ3-CD1 4.11Å; I181-L185 HydrophobicContact CG2-CD1 4.38Å; I181-L185 WeakPolarHBondContact O-CG 3.41Å; I181-L185 PolarHBondContact O-N 3.48Å; V182-L185 PolarHBondContact O-N 3.05Å; L185-L188 WeakPolarHBondContact O-CB 3.25Å; L185-L188 PolarHBondContact O-N 3Å; L185-I189 WeakPolarHBondContact O-CG1 3.36Å; L185-I189 PolarHBondContact O-N 3.15Å
186	V	94.9	Very high	92.2	Very high	10 Å²	10	36.7 Å²	36.7	6%	0.061	18%	0.181	C	C	.	.	H	α-helix	trans	-69.1	-39.2	173.6	170.9	0	0	0	0	111.5	C95 Q98 V182 L188 I189 D190	C95-V186 HydrophobicContact CB-CG2 3.83Å; C95-V186 VanDerWaalsContact O-CG2 3.32Å; C95-V186 WeakPolarHBondContact O-CG2 3.4Å; Q98-V186 HydrophobicContact CB-CG2 4.33Å; V182-V186 WeakPolarHBondContact O-CG2 3.43Å; V182-V186 PolarHBondContact O-N 3.38Å; V186-L188 VanDerWaalsContact C-N 3.3Å; V186-L188 PolarHBondContact O-N 3.07Å; V186-I189 WeakPolarHBondContact O-CB 3.46Å; V186-I189 PolarHBondContact O-N 3.28Å; V186-D190 PolarHBondContact O-N 2.89Å
187	W	95.4	Very high	92.2	Very high	57 Å²	57	32.3 Å²	32.3	22%	0.216	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-39.8	171	174.4	87.5	0	0	0	111.8	F155 L158 Y160 A183 A184 D190 C191	F155-W187 AromaticContact CD1-CE3 3.97Å; F155-W187 HydrophobicContact CD1-CE3 3.97Å; F155-W187 AromaticContact CD1-CZ3 3.8Å; F155-W187 HydrophobicContact CD1-CZ3 3.8Å; F155-W187 AromaticContact CE1-CE3 3.99Å; F155-W187 HydrophobicContact CE1-CE3 3.99Å; F155-W187 HydrophobicContact CE1-CZ3 4.16Å; L158-W187 HydrophobicContact CB-CH2 3.88Å; L158-W187 HydrophobicContact CB-CZ3 4.24Å; Y160-W187 HydrophobicContact CD2-CB 4.48Å; Y160-W187 AromaticContact CD2-CD2 3.44Å; Y160-W187 HydrophobicContact CD2-CD2 3.44Å; Y160-W187 VanDerWaalsContact CD2-CD2 3.44Å; Y160-W187 AromaticContact CD2-CE2 3.78Å; Y160-W187 AromaticContact CD2-CE3 3.57Å; Y160-W187 HydrophobicContact CD2-CE3 3.57Å; Y160-W187 AromaticContact CD2-CG 3.86Å; Y160-W187 HydrophobicContact CD2-CG 3.86Å; Y160-W187 HydrophobicContact CD2-CH2 4.3Å; Y160-W187 HydrophobicContact CD2-CZ2 4.19Å; Y160-W187 HydrophobicContact CD2-CZ3 4.02Å; Y160-W187 HydrophobicContact CE2-CB 4.13Å; Y160-W187 AromaticContact CE2-CD2 4Å; Y160-W187 HydrophobicContact CE2-CD2 4Å; Y160-W187 HydrophobicContact CE2-CE3 4.25Å; Y160-W187 AromaticContact CE2-CG 3.94Å; Y160-W187 HydrophobicContact CE2-CG 3.94Å; Y160-W187 HydrophobicContact CG-CD2 4.38Å; Y160-W187 HydrophobicContact CG-CE3 4.13Å; Y160-W187 HydrophobicContact CG-CH2 4.43Å; Y160-W187 HydrophobicContact CG-CZ3 4.17Å; A183-W187 WeakPolarHBondContact O-CB 3.23Å; A183-W187 PolarHBondContact O-N 2.95Å; A183-W187 VanDerWaalsContact O-N 3.11Å; A184-W187 PolarHBondContact O-N 2.96Å; W187-D190 PolarHBondContact O-N 3.37Å; W187-C191 VanDerWaalsContact CZ2-SG 3.56Å; W187-C191 PolarHBondContact O-N 3.46Å; W187-C191 PolarHBondContact O-SG 3.3Å; W187-C191 VanDerWaalsContact O-SG 3.38Å
188	L	94.7	Very high	91.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-39.9	173.7	-178.8	62.2	0	0	0	111.9	F129 L132 L136 F155 L158 A184 L185 V186 D190 C191 I192	F129-L188 HydrophobicContact CD2-CD2 4.07Å; F129-L188 HydrophobicContact CE2-CD2 4.06Å; L132-L188 HydrophobicContact CB-CD2 3.75Å; L132-L188 HydrophobicContact CB-CG 4.29Å; L132-L188 HydrophobicContact CD1-CD2 4.35Å; L136-L188 HydrophobicContact CD1-CD1 3.73Å; F155-L188 HydrophobicContact CE1-CB 4.07Å; F155-L188 HydrophobicContact CZ-CB 4.4Å; F155-L188 HydrophobicContact CZ-CD2 4.25Å; L158-L188 HydrophobicContact CD1-CD1 3.77Å; A184-L188 PolarHBondContact O-N 3.18Å; L185-L188 WeakPolarHBondContact O-CB 3.25Å; L185-L188 PolarHBondContact O-N 3Å; V186-L188 VanDerWaalsContact C-N 3.3Å; V186-L188 PolarHBondContact O-N 3.07Å; L188-D190 VanDerWaalsContact C-N 3.32Å; L188-D190 PolarHBondContact O-N 2.8Å; L188-C191 WeakPolarHBondContact O-CB 3.41Å; L188-C191 PolarHBondContact O-N 2.78Å; L188-I192 HydrophobicContact CG-CD1 4.27Å; L188-I192 WeakPolarHBondContact O-CD1 3.45Å; L188-I192 VanDerWaalsContact O-CG1 3.26Å; L188-I192 WeakPolarHBondContact O-CG1 3.39Å; L188-I192 PolarHBondContact O-N 3.47Å
189	I	94.9	Very high	91.1	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-41.5	171.8	-75.4	164.1	0	0	0	111.5	L99 F102 L132 L185 V186 I192 K193	L99-I189 HydrophobicContact CB-CD1 4.42Å; L99-I189 HydrophobicContact CD1-CD1 3.7Å; F102-I189 HydrophobicContact CB-CD1 3.87Å; F102-I189 HydrophobicContact CB-CG1 4.35Å; F102-I189 HydrophobicContact CB-CG2 4.26Å; F102-I189 HydrophobicContact CD1-CD1 4.05Å; F102-I189 HydrophobicContact CD1-CG1 3.8Å; F102-I189 HydrophobicContact CD1-CG2 4.46Å; F102-I189 HydrophobicContact CD2-CG1 4.47Å; F102-I189 HydrophobicContact CD2-CG2 3.63Å; F102-I189 HydrophobicContact CE1-CG1 4.22Å; F102-I189 HydrophobicContact CE2-CG2 4.05Å; F102-I189 HydrophobicContact CG-CD1 4.01Å; F102-I189 HydrophobicContact CG-CG1 3.94Å; F102-I189 HydrophobicContact CG-CG2 3.85Å; L132-I189 HydrophobicContact CD1-CD1 4.22Å; L132-I189 HydrophobicContact CD1-CG1 4.02Å; L132-I189 HydrophobicContact CD2-CD1 4.13Å; L132-I189 HydrophobicContact CD2-CG1 3.65Å; L132-I189 HydrophobicContact CG-CG1 4.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.36Å; L185-I189 PolarHBondContact O-N 3.15Å; V186-I189 WeakPolarHBondContact O-CB 3.46Å; V186-I189 PolarHBondContact O-N 3.28Å; I189-I192 WeakPolarHBondContact O-CB 3.36Å; I189-I192 PolarHBondContact O-N 3.15Å; I189-K193 HydrophobicContact CG2-CD 4.48Å; I189-K193 VanDerWaalsContact CG2-CE 3.48Å; I189-K193 WeakPolarHBondContact O-CG 3.38Å; I189-K193 PolarHBondContact O-N 3.28Å
190	D	93.5	Very high	90.3	Very high	65 Å²	65	52.2 Å²	52.2	35%	0.348	26%	0.259	S	S	.	.	H	α-helix	trans	-71.1	-34.1	177.6	-65.8	-28.5	0	0	0	112	V186 W187 L188 I192 K193 I194	V186-D190 PolarHBondContact O-N 2.89Å; W187-D190 PolarHBondContact O-N 3.37Å; L188-D190 VanDerWaalsContact C-N 3.32Å; L188-D190 PolarHBondContact O-N 2.8Å; D190-I192 VanDerWaalsContact C-N 3.35Å; D190-K193 PolarHBondContact O-N 3.16Å; D190-K193 IonicContact OD1-NZ 2.65Å; D190-K193 PolarHBondContact OD1-NZ 2.92Å; D190-I194 VanDerWaalsContact O-CG1 3.3Å; D190-I194 WeakPolarHBondContact O-CG1 3.47Å; D190-I194 PolarHBondContact O-N 2.98Å
191	C	92.8	Very high	88.7	Confident	30 Å²	30	52.2 Å²	52.2	20%	0.203	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-39.9	167.5	-69.1	0	0	0	0	112.6	W187 L188 I194 H195	W187-C191 VanDerWaalsContact CZ2-SG 3.56Å; W187-C191 PolarHBondContact O-N 3.46Å; W187-C191 PolarHBondContact O-SG 3.3Å; W187-C191 VanDerWaalsContact O-SG 3.38Å; L188-C191 WeakPolarHBondContact O-CB 3.41Å; L188-C191 PolarHBondContact O-N 2.78Å; C191-I194 PolarHBondContact O-N 2.87Å; C191-H195 WeakPolarHBondContact O-CB 3.42Å; C191-H195 PolarHBondContact O-N 2.79Å
192	I	92.8	Very high	86.7	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-46.2	175.6	-66.9	158.5	0	0	0	110.6	F102 L132 F135 L136 L188 I189 D190 I194 H195 T196	F102-I192 HydrophobicContact CE1-CD1 4.48Å; F102-I192 HydrophobicContact CZ-CB 4.47Å; F102-I192 HydrophobicContact CZ-CD1 4.48Å; F102-I192 HydrophobicContact CZ-CG2 3.88Å; L132-I192 HydrophobicContact CB-CD1 3.97Å; L132-I192 HydrophobicContact CD2-CD1 4.2Å; L132-I192 WeakPolarHBondContact O-CD1 3.43Å; F135-I192 HydrophobicContact CB-CB 4.44Å; F135-I192 HydrophobicContact CB-CD1 4.12Å; F135-I192 HydrophobicContact CB-CG1 3.98Å; F135-I192 HydrophobicContact CB-CG2 3.59Å; F135-I192 HydrophobicContact CD1-CG2 4.33Å; F135-I192 HydrophobicContact CG-CG2 4.01Å; L136-I192 HydrophobicContact CD1-CG1 4.42Å; L136-I192 HydrophobicContact CD2-CG1 3.94Å; L136-I192 HydrophobicContact CG-CG1 3.91Å; L188-I192 HydrophobicContact CG-CD1 4.27Å; L188-I192 WeakPolarHBondContact O-CD1 3.45Å; L188-I192 VanDerWaalsContact O-CG1 3.26Å; L188-I192 WeakPolarHBondContact O-CG1 3.39Å; L188-I192 PolarHBondContact O-N 3.47Å; I189-I192 WeakPolarHBondContact O-CB 3.36Å; I189-I192 PolarHBondContact O-N 3.15Å; D190-I192 VanDerWaalsContact C-N 3.35Å; I192-I194 VanDerWaalsContact C-N 3.31Å; I192-I194 PolarHBondContact O-N 3.3Å; I192-H195 PolarHBondContact O-N 3.49Å; I192-H195 VanDerWaalsContact O-N 3.16Å; I192-T196 PolarHBondContact O-N 3.48Å; I192-T196 PolarHBondContact O-OG1 3.2Å
193	K	91	Very high	84.6	Confident	98 Å²	98	60.8 Å²	60.8	43%	0.426	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-43.3	175.4	-67.8	168.7	-165.1	157.2	0	111.9	I189 D190 A197	I189-K193 HydrophobicContact CG2-CD 4.48Å; I189-K193 VanDerWaalsContact CG2-CE 3.48Å; I189-K193 WeakPolarHBondContact O-CG 3.38Å; I189-K193 PolarHBondContact O-N 3.28Å; D190-K193 PolarHBondContact O-N 3.16Å; D190-K193 IonicContact OD1-NZ 2.65Å; D190-K193 PolarHBondContact OD1-NZ 2.92Å; K193-A197 VanDerWaalsContact O-CB 3.23Å; K193-A197 WeakPolarHBondContact O-CB 3.41Å; K193-A197 PolarHBondContact O-N 2.82Å
194	I	89.2	Confident	82.4	Confident	103 Å²	103	67.2 Å²	67.2	53%	0.528	36%	0.36	S	S	.	.	H	α-helix	trans	-64.1	-44.4	176.4	-68	164.3	0	0	0	110.6	D190 C191 I192 A197 M198	D190-I194 VanDerWaalsContact O-CG1 3.3Å; D190-I194 WeakPolarHBondContact O-CG1 3.47Å; D190-I194 PolarHBondContact O-N 2.98Å; C191-I194 PolarHBondContact O-N 2.87Å; I192-I194 VanDerWaalsContact C-N 3.31Å; I192-I194 PolarHBondContact O-N 3.3Å; I194-A197 PolarHBondContact O-N 3.15Å; I194-M198 HydrophobicContact CG2-CG 4.35Å; I194-M198 HydrophobicContact CG2-SD 3.92Å; I194-M198 WeakPolarHBondContact O-CB 3.32Å; I194-M198 VanDerWaalsContact O-CG 3.29Å; I194-M198 WeakPolarHBondContact O-CG 3.32Å; I194-M198 PolarHBondContact O-N 3.19Å
195	H	88.1	Confident	80.1	Confident	82 Å²	82	75.8 Å²	75.8	38%	0.38	40%	0.397	S	S	.	.	H	α-helix	trans	-62.4	-47	178.3	-178.9	68.5	0	0	0	112.4	L136 C191 I192 M198 K199	L136-H195 HydrophobicContact CD2-CB 3.58Å; C191-H195 WeakPolarHBondContact O-CB 3.42Å; C191-H195 PolarHBondContact O-N 2.79Å; I192-H195 PolarHBondContact O-N 3.49Å; I192-H195 VanDerWaalsContact O-N 3.16Å; H195-M198 PolarHBondContact O-N 2.9Å; H195-K199 WeakPolarHBondContact O-CB 3.45Å; H195-K199 PolarHBondContact O-N 3.29Å
196	T	87.3	Confident	78	Confident	54 Å²	54	80.5 Å²	80.5	33%	0.331	42%	0.423	S	S	.	.	H	α-helix	trans	-61	-48	175.4	-58.6	0	0	0	0	111	I192 M198 K199 E200	I192-T196 PolarHBondContact O-N 3.48Å; I192-T196 PolarHBondContact O-OG1 3.2Å; T196-M198 VanDerWaalsContact C-N 3.35Å; T196-M198 PolarHBondContact O-N 2.85Å; T196-K199 WeakPolarHBondContact O-CB 3.45Å; T196-K199 PolarHBondContact O-N 3.36Å; T196-E200 WeakPolarHBondContact O-CG 3.4Å; T196-E200 PolarHBondContact O-N 3.48Å
197	A	85.8	Confident	75.6	Confident	47 Å²	47	87.8 Å²	87.8	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-59.9	-42.1	177.3	0	0	0	0	0	112.1	K193 I194 K199 E200 S201	K193-A197 VanDerWaalsContact O-CB 3.23Å; K193-A197 WeakPolarHBondContact O-CB 3.41Å; K193-A197 PolarHBondContact O-N 2.82Å; I194-A197 PolarHBondContact O-N 3.15Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.47Å; A197-E200 PolarHBondContact O-N 2.9Å; A197-S201 WeakPolarHBondContact O-CA 3.38Å; A197-S201 WeakPolarHBondContact O-CB 3.39Å; A197-S201 PolarHBondContact O-N 3.39Å; A197-S201 PolarHBondContact O-OG 3.49Å; A197-S201 VanDerWaalsContact O-OG 3.08Å
198	M	82.2	Confident	73.3	Confident	128 Å²	128	88.5 Å²	88.5	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-66.6	-28.1	175.2	-74.1	179.7	67.2	0	0	113.4	I194 H195 T196 S202	I194-M198 HydrophobicContact CG2-CG 4.35Å; I194-M198 HydrophobicContact CG2-SD 3.92Å; I194-M198 WeakPolarHBondContact O-CB 3.32Å; I194-M198 VanDerWaalsContact O-CG 3.29Å; I194-M198 WeakPolarHBondContact O-CG 3.32Å; I194-M198 PolarHBondContact O-N 3.19Å; H195-M198 PolarHBondContact O-N 2.9Å; T196-M198 VanDerWaalsContact C-N 3.35Å; T196-M198 PolarHBondContact O-N 2.85Å; M198-S202 WeakPolarHBondContact O-CB 3.27Å; M198-S202 PolarHBondContact O-N 3.09Å
199	K	79.4	Confident	71.1	Confident	166 Å²	166	94 Å²	94	72%	0.722	51%	0.512	S	S	*	.	H	α-helix	trans	-76.6	-36.1	176.3	-173	179.2	179.3	-178.9	0	112	H195 T196 A197	H195-K199 WeakPolarHBondContact O-CB 3.45Å; H195-K199 PolarHBondContact O-N 3.29Å; T196-K199 WeakPolarHBondContact O-CB 3.45Å; T196-K199 PolarHBondContact O-N 3.36Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.47Å
200	E	74.4	Confident	68.8	Low	159 Å²	159	98.7 Å²	98.7	74%	0.743	54%	0.542	S	S	*	.	H	α-helix	trans	-79.1	-36.1	174.8	-68.7	174.2	179	0	0	112.6	T196 A197	T196-E200 WeakPolarHBondContact O-CG 3.4Å; T196-E200 PolarHBondContact O-N 3.48Å; A197-E200 PolarHBondContact O-N 2.9Å
201	S	59.2	Low	66.9	Low	90 Å²	90	102 Å²	102	63%	0.629	55%	0.55	S	S	*	*	S	Bend	trans	-97	7.8	-178.6	93.2	0	0	0	0	113.7	A197 P203	A197-S201 WeakPolarHBondContact O-CA 3.38Å; A197-S201 WeakPolarHBondContact O-CB 3.39Å; A197-S201 PolarHBondContact O-N 3.39Å; A197-S201 PolarHBondContact O-OG 3.49Å; A197-S201 VanDerWaalsContact O-OG 3.08Å; S201-P203 VanDerWaalsContact O-CD 3.29Å; S201-P203 WeakPolarHBondContact O-CD 3.4Å
202	S	50.7	Low	64.9	Low	74 Å²	74	102.9 Å²	102.9	52%	0.517	56%	0.564	S	S	.	*	S	Bend	trans	-61.9	121.9	161.5	-176.9	0	0	0	0	106.2	M198 L204	M198-S202 WeakPolarHBondContact O-CB 3.27Å; M198-S202 PolarHBondContact O-N 3.09Å; S202-L204 PolarHBondContact O-N 2.84Å
203	P	47.8	Very low	63.2	Low	107 Å²	107	108.8 Å²	108.8	70%	0.695	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-53.2	140.7	161.8	-19.1	32.4	0	0	0	107.3	S201	S201-P203 VanDerWaalsContact O-CD 3.29Å; S201-P203 WeakPolarHBondContact O-CD 3.4Å
204	L	46.3	Very low	61.8	Low	137 Å²	137	110.3 Å²	110.3	72%	0.717	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-56.8	150.5	149.3	-75.3	77.3	0	0	0	106.2	S202 D206	S202-L204 PolarHBondContact O-N 2.84Å; L204-D206 HydrophobicContact CB-CB 3.87Å; L204-D206 PolarHBondContact O-N 2.84Å
205	F	47.4	Very low	60.8	Low	180 Å²	180	107.4 Å²	107.4	79%	0.789	59%	0.587	S	S	*	*	S	Bend	trans	-75.7	44.7	-178.3	-142.3	-91.7	0	0	0	110.8	K223	F205-K223 WeakPolarHBondContact O-CE 3.44Å; F205-K223 PolarHBondContact O-NZ 3.42Å
206	D	50.6	Low	59.7	Low	99 Å²	99	113.2 Å²	113.2	53%	0.529	61%	0.614	S	S	.	*			trans	-168.8	54.8	-143.6	-160.8	34.2	0	0	0	111.6	L204 K223	L204-D206 HydrophobicContact CB-CB 3.87Å; L204-D206 PolarHBondContact O-N 2.84Å; D206-K223 IonicContact OD1-NZ 2.68Å; D206-K223 PolarHBondContact OD1-NZ 3.13Å
207	D	43.1	Very low	58.7	Low	164 Å²	164	117.5 Å²	117.5	88%	0.877	64%	0.635	S	S	*	*	S	Bend	trans	-153.7	129.9	135.2	-135.1	-22.1	0	0	0	111.1	Q209	D207-Q209 PolarHBondContact O-N 3.38Å
208	G	47.3	Very low	58.1	Low	71 Å²	71	117.1 Å²	117.1	73%	0.732	64%	0.636	S	S	*	*	S	Bend	trans	84.1	-16	164.3	0	0	0	0	0	120.8	P210	G208-P210 WeakPolarHBondContact O-CD 2.82Å
209	Q	48.9	Very low	57.9	Low	117 Å²	117	113.4 Å²	113.4	55%	0.547	62%	0.618	S	S	.	*			trans	-68	127	168.6	-100.6	-159.7	-65.7	0	0	109.7	D207 E213	D207-Q209 PolarHBondContact O-N 3.38Å; Q209-E213 PolarHBondContact NE2-OE1 3.33Å; Q209-E213 VanDerWaalsContact NE2-OE1 3.08Å; Q209-E213 PolarHBondContact NE2-OE2 2.79Å
210	P	47.7	Very low	57.5	Low	99 Å²	99	110.2 Å²	110.2	64%	0.643	61%	0.607	S	S	*	*			trans	-60.8	143.5	176.7	-21.9	33.2	0	0	0	110.9	G208 G212	G208-P210 WeakPolarHBondContact O-CD 2.82Å; P210-G212 PolarHBondContact O-N 3.32Å
211	W	53	Low	57.6	Low	135 Å²	135	104.1 Å²	104.1	51%	0.511	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.7	0.8	178.2	-63.4	85.4	0	0	0	114.7	H221 K223 L224 L257	W211-H221 WeakPolarHBondContact O-CA 3.32Å; W211-H221 PolarHBondContact O-ND1 2.67Å; W211-K223 HydrophobicContact CZ3-CD 4.49Å; W211-K223 HydrophobicContact CZ3-CG 4.33Å; W211-L224 HydrophobicContact CE3-CB 4.3Å; W211-L224 HydrophobicContact CZ3-CB 4Å; W211-L257 HydrophobicContact CB-CD1 4.45Å
212	G	51.4	Low	58.6	Low	47 Å²	47	101.8 Å²	101.8	49%	0.485	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.7	19.1	-163.9	0	0	0	0	0	116.8	P210 E214	P210-G212 PolarHBondContact O-N 3.32Å; G212-E214 PolarHBondContact O-N 3.43Å
213	E	57.1	Low	60	Low	127 Å²	127	102.1 Å²	102.1	59%	0.593	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-79.8	116.3	167.1	-80.1	177.1	-165.4	0	0	110.2	Q209	Q209-E213 PolarHBondContact NE2-OE1 3.33Å; Q209-E213 VanDerWaalsContact NE2-OE1 3.08Å; Q209-E213 PolarHBondContact NE2-OE2 2.79Å
214	E	60	Low	61.7	Low	130 Å²	130	97.4 Å²	97.4	61%	0.607	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-72.3	127.3	169.9	-168.6	173.9	-169	0	0	108.7	G212 M220	G212-E214 PolarHBondContact O-N 3.43Å; E214-M220 HydrophobicContact CB-SD 3.64Å; E214-M220 HydrophobicContact CG-SD 3.72Å
215	T	69.4	Low	63.6	Low	42 Å²	42	95.2 Å²	95.2	26%	0.258	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-74.5	154.5	172.4	-56.1	0	0	0	0	109.8	D217 G218 I219 N222	T215-D217 PolarHBondContact O-N 2.78Å; T215-G218 PolarHBondContact O-N 3.25Å; T215-I219 PolarHBondContact N-O 3.25Å; T215-N222 VanDerWaalsContact OG1-CB 3.31Å; T215-N222 WeakPolarHBondContact OG1-CB 3.42Å; T215-N222 VanDerWaalsContact OG1-CG 3.31Å; T215-N222 PolarHBondContact OG1-ND2 3.39Å
216	E	63.8	Low	65.5	Low	204 Å²	204	90.5 Å²	90.5	95%	0.953	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.7	-176	-162.5	166	-174.7	0	0	113.6	G218	E216-G218 VanDerWaalsContact C-N 3.35Å
217	D	66.9	Low	67.2	Low	144 Å²	144	88.3 Å²	88.3	77%	0.77	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	7.4	171.5	-57.7	-66.3	0	0	0	115.2	T215	T215-D217 PolarHBondContact O-N 2.78Å
218	G	74.4	Confident	69.5	Low	40 Å²	40	82.9 Å²	82.9	41%	0.412	44%	0.443	S	S	.	.	S	Bend	trans	82.4	14.4	179.9	0	0	0	0	0	115.6	T215 E216 M220	T215-G218 PolarHBondContact O-N 3.25Å; E216-G218 VanDerWaalsContact C-N 3.35Å; G218-M220 PolarHBondContact O-N 3.43Å
219	I	76.5	Confident	71.5	Confident	50 Å²	50	82 Å²	82	26%	0.256	42%	0.424	S	S	.	.			trans	-82.2	102.2	-179.7	-54.4	-179.5	0	0	0	109.9	T215 N222 F225	T215-I219 PolarHBondContact N-O 3.25Å; I219-N222 HydrophobicContact CG2-CB 4.05Å; I219-F225 HydrophobicContact CD1-CD1 4.07Å; I219-F225 HydrophobicContact CD1-CE1 3.85Å; I219-F225 HydrophobicContact CD1-CZ 4.42Å; I219-F225 HydrophobicContact CG2-CB 4.02Å; I219-F225 HydrophobicContact CG2-CD1 4.02Å; I219-F225 HydrophobicContact CG2-CG 4.03Å
220	M	70.9	Confident	73.6	Confident	99 Å²	99	81 Å²	81	49%	0.488	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	143.7	166.8	-65.7	-63	-72.2	0	0	110.8	E214 G218 N222	E214-M220 HydrophobicContact CB-SD 3.64Å; E214-M220 HydrophobicContact CG-SD 3.72Å; G218-M220 PolarHBondContact O-N 3.43Å; M220-N222 VanDerWaalsContact C-N 3.31Å; M220-N222 PolarHBondContact O-N 3.31Å
221	H	77.3	Confident	75.6	Confident	31 Å²	31	78.5 Å²	78.5	14%	0.144	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	40.6	-179.6	-48.1	-55.6	0	0	0	113.4	W211 K223 L224 F225 F258	W211-H221 WeakPolarHBondContact O-CA 3.32Å; W211-H221 PolarHBondContact O-ND1 2.67Å; H221-K223 PolarHBondContact O-N 2.64Å; H221-L224 HydrophobicContact CB-CB 4.19Å; H221-L224 WeakPolarHBondContact O-CA 3.48Å; H221-L224 WeakPolarHBondContact O-CB 3.35Å; H221-L224 PolarHBondContact O-N 2.79Å; H221-F225 PolarHBondContact O-N 3.04Å; H221-F258 AromaticContact NE2-CZ 3.83Å
222	N	80.8	Confident	77.5	Confident	40 Å²	40	72.7 Å²	72.7	21%	0.214	38%	0.38	C	S	.	.	H	α-helix	trans	-50.9	-36.1	-172	-171	17.6	0	0	0	114.2	T215 I219 M220 L224 F225 L226	T215-N222 VanDerWaalsContact OG1-CB 3.31Å; T215-N222 WeakPolarHBondContact OG1-CB 3.42Å; T215-N222 VanDerWaalsContact OG1-CG 3.31Å; T215-N222 PolarHBondContact OG1-ND2 3.39Å; I219-N222 HydrophobicContact CG2-CB 4.05Å; M220-N222 VanDerWaalsContact C-N 3.31Å; M220-N222 PolarHBondContact O-N 3.31Å; N222-L224 VanDerWaalsContact C-N 3.33Å; N222-L224 PolarHBondContact O-N 3.13Å; N222-F225 WeakPolarHBondContact O-CB 3.12Å; N222-F225 PolarHBondContact O-N 2.98Å; N222-L226 WeakPolarHBondContact O-CB 2.95Å; N222-L226 VanDerWaalsContact O-CG 3.31Å; N222-L226 WeakPolarHBondContact O-CG 3.44Å; N222-L226 PolarHBondContact O-N 3.29Å; N222-L226 WeakPolarHBondContact OD1-CG 3.41Å
223	K	79.6	Confident	79.4	Confident	81 Å²	81	77 Å²	77	35%	0.352	38%	0.382	S	S	.	.	H	α-helix	trans	-59.2	-38.8	173.5	178.8	173.2	170.2	177.3	0	113.9	F205 D206 W211 H221 D227	F205-K223 WeakPolarHBondContact O-CE 3.44Å; F205-K223 PolarHBondContact O-NZ 3.42Å; D206-K223 IonicContact OD1-NZ 2.68Å; D206-K223 PolarHBondContact OD1-NZ 3.13Å; W211-K223 HydrophobicContact CZ3-CD 4.49Å; W211-K223 HydrophobicContact CZ3-CG 4.33Å; H221-K223 PolarHBondContact O-N 2.64Å; K223-D227 WeakPolarHBondContact O-CB 3.44Å; K223-D227 PolarHBondContact O-N 2.91Å
224	L	83.9	Confident	81.1	Confident	8 Å²	8	76.5 Å²	76.5	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-69.9	-39.6	175.5	177.3	58.8	0	0	0	111.2	W211 H221 N222 Y228 L250 K253 L254	W211-L224 HydrophobicContact CE3-CB 4.3Å; W211-L224 HydrophobicContact CZ3-CB 4Å; H221-L224 HydrophobicContact CB-CB 4.19Å; H221-L224 WeakPolarHBondContact O-CA 3.48Å; H221-L224 WeakPolarHBondContact O-CB 3.35Å; H221-L224 PolarHBondContact O-N 2.79Å; N222-L224 VanDerWaalsContact C-N 3.33Å; N222-L224 PolarHBondContact O-N 3.13Å; L224-Y228 WeakPolarHBondContact O-CB 3.39Å; L224-Y228 PolarHBondContact O-N 3.03Å; L224-Y228 VanDerWaalsContact O-N 3.14Å; L224-L250 HydrophobicContact CD1-CD1 3.84Å; L224-L250 HydrophobicContact CD2-CD1 3.9Å; L224-L250 HydrophobicContact CG-CD1 3.66Å; L224-K253 HydrophobicContact CD1-CB 3.96Å; L224-K253 HydrophobicContact CD1-CD 3.62Å; L224-K253 HydrophobicContact CD1-CG 4.38Å; L224-K253 HydrophobicContact CD2-CB 4.47Å; L224-L254 HydrophobicContact CD2-CD2 3.69Å; L224-L254 HydrophobicContact CD2-CG 4.18Å
225	F	85.7	Confident	82.6	Confident	92 Å²	92	71.7 Å²	71.7	40%	0.404	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-45.7	173.1	172.6	-104.1	0	0	0	111.4	I219 H221 N222 Y228 T229	I219-F225 HydrophobicContact CD1-CD1 4.07Å; I219-F225 HydrophobicContact CD1-CE1 3.85Å; I219-F225 HydrophobicContact CD1-CZ 4.42Å; I219-F225 HydrophobicContact CG2-CB 4.02Å; I219-F225 HydrophobicContact CG2-CD1 4.02Å; I219-F225 HydrophobicContact CG2-CG 4.03Å; H221-F225 PolarHBondContact O-N 3.04Å; N222-F225 WeakPolarHBondContact O-CB 3.12Å; N222-F225 PolarHBondContact O-N 2.98Å; F225-Y228 PolarHBondContact O-N 2.91Å; F225-T229 WeakPolarHBondContact O-CB 3.43Å; F225-T229 PolarHBondContact O-N 2.99Å; F225-T229 PolarHBondContact O-OG1 2.94Å
226	L	86.6	Confident	83.7	Confident	80 Å²	80	75.2 Å²	75.2	42%	0.419	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-42.1	178.3	-69.7	168.7	0	0	0	113	N222 Y228 T229 I230	N222-L226 WeakPolarHBondContact O-CB 2.95Å; N222-L226 VanDerWaalsContact O-CG 3.31Å; N222-L226 WeakPolarHBondContact O-CG 3.44Å; N222-L226 PolarHBondContact O-N 3.29Å; N222-L226 WeakPolarHBondContact OD1-CG 3.41Å; L226-Y228 VanDerWaalsContact C-N 3.34Å; L226-Y228 PolarHBondContact O-N 3.14Å; L226-T229 PolarHBondContact O-N 2.82Å; L226-I230 WeakPolarHBondContact O-CB 3.41Å; L226-I230 WeakPolarHBondContact O-CD1 3.46Å; L226-I230 WeakPolarHBondContact O-CG1 3.32Å; L226-I230 PolarHBondContact O-N 2.77Å
227	D	87.6	Confident	85.2	Confident	53 Å²	53	71.3 Å²	71.3	28%	0.283	36%	0.356	S	S	.	.	H	α-helix	trans	-55.5	-48.9	172.7	174.1	54.5	0	0	0	111.3	K223 K231 K253	K223-D227 WeakPolarHBondContact O-CB 3.44Å; K223-D227 PolarHBondContact O-N 2.91Å; D227-K231 VanDerWaalsContact CG-NZ 3.26Å; D227-K231 WeakPolarHBondContact O-CD 3.45Å; D227-K231 WeakPolarHBondContact O-CG 3.41Å; D227-K231 PolarHBondContact O-N 2.9Å; D227-K231 WeakPolarHBondContact OD1-CE 3.43Å; D227-K231 IonicContact OD1-NZ 2.84Å; D227-K231 PolarHBondContact OD1-NZ 3.49Å; D227-K231 IonicContact OD2-NZ 2.8Å; D227-K231 PolarHBondContact OD2-NZ 3.13Å; D227-K253 IonicContact OD2-NZ 3.42Å; D227-K253 PolarHBondContact OD2-NZ 3.47Å
228	Y	90.5	Very high	86.4	Confident	51 Å²	51	69.6 Å²	69.6	20%	0.2	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-48.8	174.6	169.4	-92.9	0	0	0	112.3	L224 F225 L226 I230 K231 C232 M246 N247 L250	L224-Y228 WeakPolarHBondContact O-CB 3.39Å; L224-Y228 PolarHBondContact O-N 3.03Å; L224-Y228 VanDerWaalsContact O-N 3.14Å; F225-Y228 PolarHBondContact O-N 2.91Å; L226-Y228 VanDerWaalsContact C-N 3.34Å; L226-Y228 PolarHBondContact O-N 3.14Å; Y228-I230 PolarHBondContact O-N 2.82Å; Y228-K231 PolarHBondContact O-N 3.34Å; Y228-C232 WeakPolarHBondContact CE2-SG 3.36Å; Y228-C232 VanDerWaalsContact CZ-SG 3.5Å; Y228-C232 WeakPolarHBondContact O-CB 3.33Å; Y228-C232 PolarHBondContact O-N 3.12Å; Y228-C232 PolarHBondContact O-SG 3.42Å; Y228-M246 HydrophobicContact CD2-CB 3.9Å; Y228-M246 HydrophobicContact CE2-CB 3.86Å; Y228-N247 PolarHBondContact OH-OD1 3.29Å; Y228-N247 VanDerWaalsContact OH-OD1 3.12Å; Y228-L250 HydrophobicContact CD1-CD2 4.38Å; Y228-L250 HydrophobicContact CD2-CB 3.98Å; Y228-L250 HydrophobicContact CD2-CD2 3.71Å; Y228-L250 HydrophobicContact CD2-CG 4.4Å; Y228-L250 HydrophobicContact CE2-CD2 3.98Å; Y228-L250 HydrophobicContact CG-CD2 3.93Å
229	T	90.5	Very high	87.1	Confident	53 Å²	53	70.7 Å²	70.7	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-64	-39.3	-177.6	-62.4	0	0	0	0	112.4	F225 L226 Y233	F225-T229 WeakPolarHBondContact O-CB 3.43Å; F225-T229 PolarHBondContact O-N 2.99Å; F225-T229 PolarHBondContact O-OG1 2.94Å; L226-T229 PolarHBondContact O-N 2.82Å; T229-Y233 VanDerWaalsContact O-CB 3.23Å; T229-Y233 WeakPolarHBondContact O-CB 3.41Å; T229-Y233 PolarHBondContact O-N 3.47Å
230	I	91.5	Very high	87.8	Confident	94 Å²	94	70 Å²	70	48%	0.482	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-50.1	176.7	-70.1	164.8	0	0	0	109.9	L226 Y228 C232 Y233 E234	L226-I230 WeakPolarHBondContact O-CB 3.41Å; L226-I230 WeakPolarHBondContact O-CD1 3.46Å; L226-I230 WeakPolarHBondContact O-CG1 3.32Å; L226-I230 PolarHBondContact O-N 2.77Å; Y228-I230 PolarHBondContact O-N 2.82Å; I230-C232 PolarHBondContact O-N 2.86Å; I230-Y233 CarbonylContact O-C 3.45Å; I230-Y233 PolarHBondContact O-N 3.25Å; I230-Y233 VanDerWaalsContact O-N 3.12Å; I230-E234 HydrophobicContact CG2-CG 4.48Å; I230-E234 WeakPolarHBondContact O-CG 3.26Å; I230-E234 PolarHBondContact O-N 2.96Å
231	K	91.1	Very high	88.6	Confident	47 Å²	47	72.6 Å²	72.6	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-58.6	-48.3	177.6	-71	165.3	177.2	166.5	0	112.2	D227 Y228 Y233 E234 S235 M246 E249	D227-K231 VanDerWaalsContact CG-NZ 3.26Å; D227-K231 WeakPolarHBondContact O-CD 3.45Å; D227-K231 WeakPolarHBondContact O-CG 3.41Å; D227-K231 PolarHBondContact O-N 2.9Å; D227-K231 WeakPolarHBondContact OD1-CE 3.43Å; D227-K231 IonicContact OD1-NZ 2.84Å; D227-K231 PolarHBondContact OD1-NZ 3.49Å; D227-K231 IonicContact OD2-NZ 2.8Å; D227-K231 PolarHBondContact OD2-NZ 3.13Å; Y228-K231 PolarHBondContact O-N 3.34Å; K231-Y233 VanDerWaalsContact C-N 3.27Å; K231-Y233 PolarHBondContact O-N 3.44Å; K231-E234 PolarHBondContact O-N 3.44Å; K231-S235 PolarHBondContact O-N 2.7Å; K231-S235 PolarHBondContact O-OG 3.29Å; K231-M246 HydrophobicContact CB-CG 3.84Å; K231-E249 IonicContact NZ-OE1 2.93Å; K231-E249 PolarHBondContact NZ-OE1 3.37Å; K231-E249 IonicContact NZ-OE2 3.66Å; K231-E249 PolarHBondContact NZ-OE2 2.85Å
232	C	91.6	Very high	89.1	Confident	13 Å²	13	74.3 Å²	74.3	9%	0.088	40%	0.4	C	S	.	.	H	α-helix	trans	-62.2	-35.8	176.9	-66.6	0	0	0	0	111.9	Y228 I230 F236 F243	Y228-C232 WeakPolarHBondContact CE2-SG 3.36Å; Y228-C232 VanDerWaalsContact CZ-SG 3.5Å; Y228-C232 WeakPolarHBondContact O-CB 3.33Å; Y228-C232 PolarHBondContact O-N 3.12Å; Y228-C232 PolarHBondContact O-SG 3.42Å; I230-C232 PolarHBondContact O-N 2.86Å; C232-F236 VanDerWaalsContact O-CB 3.22Å; C232-F236 WeakPolarHBondContact O-CB 3.25Å; C232-F236 PolarHBondContact O-N 2.99Å; C232-F243 HydrophobicContact CB-CD1 3.82Å; C232-F243 HydrophobicContact CB-CE1 4.18Å; C232-F243 HydrophobicContact CB-CG 4.11Å; C232-F243 WeakPolarHBondContact O-CE1 3.33Å
233	Y	92.8	Very high	89.7	Confident	137 Å²	137	74.8 Å²	74.8	54%	0.537	40%	0.4	S	S	.	.	H	α-helix	trans	-69.7	-39.1	174.7	-174.7	-110.6	0	0	0	112.6	T229 I230 K231 F236 M237	T229-Y233 VanDerWaalsContact O-CB 3.23Å; T229-Y233 WeakPolarHBondContact O-CB 3.41Å; T229-Y233 PolarHBondContact O-N 3.47Å; I230-Y233 CarbonylContact O-C 3.45Å; I230-Y233 PolarHBondContact O-N 3.25Å; I230-Y233 VanDerWaalsContact O-N 3.12Å; K231-Y233 VanDerWaalsContact C-N 3.27Å; K231-Y233 PolarHBondContact O-N 3.44Å; Y233-F236 HydrophobicContact CD2-CD1 4.31Å; Y233-F236 HydrophobicContact CE2-CD1 4.39Å; Y233-F236 PolarHBondContact O-N 3.38Å; Y233-M237 HydrophobicContact CD1-CG 4.13Å; Y233-M237 HydrophobicContact CD2-CG 4.2Å; Y233-M237 HydrophobicContact CE1-CG 3.76Å; Y233-M237 HydrophobicContact CE1-SD 4.42Å; Y233-M237 HydrophobicContact CE2-CG 3.81Å; Y233-M237 HydrophobicContact CE2-SD 3.94Å; Y233-M237 HydrophobicContact CG-CG 4.34Å; Y233-M237 VanDerWaalsContact O-CB 3.32Å; Y233-M237 WeakPolarHBondContact O-CB 3.26Å; Y233-M237 WeakPolarHBondContact O-CG 3.24Å; Y233-M237 PolarHBondContact O-N 3.45Å; Y233-M237 PolarHBondContact OH-SD 3.46Å
234	E	92.8	Very high	90.2	Very high	118 Å²	118	76.2 Å²	76.2	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-43.5	173.2	-72.1	176.4	171.2	0	0	111.8	I230 K231 S238	I230-E234 HydrophobicContact CG2-CG 4.48Å; I230-E234 WeakPolarHBondContact O-CG 3.26Å; I230-E234 PolarHBondContact O-N 2.96Å; K231-E234 PolarHBondContact O-N 3.44Å; E234-S238 WeakPolarHBondContact O-CB 3.3Å; E234-S238 PolarHBondContact O-N 2.9Å; E234-S238 PolarHBondContact O-OG 2.83Å
235	S	90.8	Very high	90.4	Very high	29 Å²	29	83.2 Å²	83.2	20%	0.203	44%	0.444	C	S	.	.	H	α-helix	trans	-62.9	-43.6	172.8	-59	0	0	0	0	112.2	K231 S238 G239 A240	K231-S235 PolarHBondContact O-N 2.7Å; K231-S235 PolarHBondContact O-OG 3.29Å; S235-S238 CarbonylContact O-C 3.43Å; S235-S238 WeakPolarHBondContact O-CA 3.15Å; S235-S238 WeakPolarHBondContact O-CB 3.2Å; S235-S238 PolarHBondContact O-N 3.24Å; S235-S238 VanDerWaalsContact O-N 3.12Å; S235-G239 PolarHBondContact O-N 3.28Å; S235-A240 WeakPolarHBondContact O-CB 3.13Å; S235-A240 PolarHBondContact O-N 3.48Å
236	F	93.4	Very high	90.6	Very high	116 Å²	116	80.4 Å²	80.4	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-45	176.9	173.4	-103.4	0	0	0	112.3	C232 Y233 S238 G239 F243	C232-F236 VanDerWaalsContact O-CB 3.22Å; C232-F236 WeakPolarHBondContact O-CB 3.25Å; C232-F236 PolarHBondContact O-N 2.99Å; Y233-F236 HydrophobicContact CD2-CD1 4.31Å; Y233-F236 HydrophobicContact CE2-CD1 4.39Å; Y233-F236 PolarHBondContact O-N 3.38Å; F236-S238 PolarHBondContact O-N 3.24Å; F236-G239 WeakPolarHBondContact O-CA 3.37Å; F236-G239 PolarHBondContact O-N 2.81Å; F236-F243 HydrophobicContact CB-CE1 4.2Å; F236-F243 HydrophobicContact CB-CZ 4.13Å
237	M	93.4	Very high	90.7	Very high	122 Å²	122	79.9 Å²	79.9	60%	0.601	43%	0.43	S	S	*	.	H	α-helix	trans	-66.2	-18.1	174.6	-69.3	-65	-68.6	0	0	112.7	Y233	Y233-M237 HydrophobicContact CD1-CG 4.13Å; Y233-M237 HydrophobicContact CD2-CG 4.2Å; Y233-M237 HydrophobicContact CE1-CG 3.76Å; Y233-M237 HydrophobicContact CE1-SD 4.42Å; Y233-M237 HydrophobicContact CE2-CG 3.81Å; Y233-M237 HydrophobicContact CE2-SD 3.94Å; Y233-M237 HydrophobicContact CG-CG 4.34Å; Y233-M237 VanDerWaalsContact O-CB 3.32Å; Y233-M237 WeakPolarHBondContact O-CB 3.26Å; Y233-M237 WeakPolarHBondContact O-CG 3.24Å; Y233-M237 PolarHBondContact O-N 3.45Å; Y233-M237 PolarHBondContact OH-SD 3.46Å
238	S	93.1	Very high	90.9	Very high	107 Å²	107	80.2 Å²	80.2	75%	0.748	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.8	169.9	-54.2	0	0	0	0	113.6	E234 S235 F236	E234-S238 WeakPolarHBondContact O-CB 3.3Å; E234-S238 PolarHBondContact O-N 2.9Å; E234-S238 PolarHBondContact O-OG 2.83Å; S235-S238 CarbonylContact O-C 3.43Å; S235-S238 WeakPolarHBondContact O-CA 3.15Å; S235-S238 WeakPolarHBondContact O-CB 3.2Å; S235-S238 PolarHBondContact O-N 3.24Å; S235-S238 VanDerWaalsContact O-N 3.12Å; F236-S238 PolarHBondContact O-N 3.24Å
239	G	89	Confident	90.8	Very high	63 Å²	63	81 Å²	81	65%	0.649	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	21.3	176.7	0	0	0	0	0	116	S235 F236	S235-G239 PolarHBondContact O-N 3.28Å; F236-G239 WeakPolarHBondContact O-CA 3.37Å; F236-G239 PolarHBondContact O-N 2.81Å
240	A	90.5	Very high	90.8	Very high	35 Å²	35	80.3 Å²	80.3	29%	0.289	44%	0.44	S	S	.	.			trans	-91.7	130.5	176.2	0	0	0	0	0	112.9	S235	S235-A240 WeakPolarHBondContact O-CB 3.13Å; S235-A240 PolarHBondContact O-N 3.48Å
241	D	87.6	Confident	90.6	Very high	155 Å²	155	81.1 Å²	81.1	83%	0.829	44%	0.442	S	S	*	.	S	Bend	trans	-97	-2.1	176	-72.7	-39.7	0	0	0	114
242	S	89.4	Confident	90.4	Very high	67 Å²	67	81.6 Å²	81.6	47%	0.469	45%	0.451	S	S	.	.			trans	-132.2	153.9	172.2	-163.9	0	0	0	0	112	D244	S242-D244 VanDerWaalsContact OG-CG 3.28Å; S242-D244 PolarHBondContact OG-OD2 3.42Å
243	F	92	Very high	90.1	Very high	49 Å²	49	84.2 Å²	84.2	22%	0.215	46%	0.461	C	S	.	.			trans	-131.1	28.5	-172.2	-48.2	-70.2	0	0	0	111.7	C232 F236 E245 M246 N247	C232-F243 HydrophobicContact CB-CD1 3.82Å; C232-F243 HydrophobicContact CB-CE1 4.18Å; C232-F243 HydrophobicContact CB-CG 4.11Å; C232-F243 WeakPolarHBondContact O-CE1 3.33Å; F236-F243 HydrophobicContact CB-CE1 4.2Å; F236-F243 HydrophobicContact CB-CZ 4.13Å; F243-E245 PolarHBondContact O-N 3.2Å; F243-E245 VanDerWaalsContact O-N 3.17Å; F243-M246 HydrophobicContact CB-CB 4.46Å; F243-M246 PolarHBondContact O-N 2.68Å; F243-N247 PolarHBondContact O-N 3.48Å; F243-N247 PolarHBondContact O-ND2 2.88Å
244	D	89.8	Confident	89.7	Confident	111 Å²	111	80.4 Å²	80.4	59%	0.594	45%	0.45	S	S	*	.	H	α-helix	trans	-56.7	-32.8	-173	-66.3	-56.3	0	0	0	113.8	S242 A248	S242-D244 VanDerWaalsContact OG-CG 3.28Å; S242-D244 PolarHBondContact OG-OD2 3.42Å; D244-A248 WeakPolarHBondContact O-CB 3.14Å; D244-A248 PolarHBondContact O-N 2.83Å
245	E	88.1	Confident	89.4	Confident	155 Å²	155	79.1 Å²	79.1	72%	0.724	44%	0.442	S	S	*	.	H	α-helix	trans	-67.2	-47	174.7	-61.6	-175.7	174.9	0	0	111.7	F243 N247 A248 E249	F243-E245 PolarHBondContact O-N 3.2Å; F243-E245 VanDerWaalsContact O-N 3.17Å; E245-N247 VanDerWaalsContact C-N 3.34Å; E245-A248 PolarHBondContact O-N 3.42Å; E245-E249 PolarHBondContact O-N 3.5Å
246	M	90.6	Very high	89.1	Confident	34 Å²	34	82.9 Å²	82.9	17%	0.167	46%	0.46	C	S	.	.	H	α-helix	trans	-67.5	-35	176.3	-63.9	74.5	-135	0	0	111.5	Y228 K231 F243 E249 L250	Y228-M246 HydrophobicContact CD2-CB 3.9Å; Y228-M246 HydrophobicContact CE2-CB 3.86Å; K231-M246 HydrophobicContact CB-CG 3.84Å; F243-M246 HydrophobicContact CB-CB 4.46Å; F243-M246 PolarHBondContact O-N 2.68Å; M246-E249 PolarHBondContact O-N 2.93Å; M246-L250 WeakPolarHBondContact O-CB 3.15Å; M246-L250 PolarHBondContact O-N 3.2Å
247	N	89.8	Confident	88.5	Confident	68 Å²	68	80 Å²	80	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-61.7	-43.5	171.6	-73.7	-35.2	0	0	0	111.3	Y228 F243 E245 Q251	Y228-N247 PolarHBondContact OH-OD1 3.29Å; Y228-N247 VanDerWaalsContact OH-OD1 3.12Å; F243-N247 PolarHBondContact O-N 3.48Å; F243-N247 PolarHBondContact O-ND2 2.88Å; E245-N247 VanDerWaalsContact C-N 3.34Å; N247-Q251 VanDerWaalsContact O-CB 3.29Å; N247-Q251 WeakPolarHBondContact O-CB 3.3Å; N247-Q251 PolarHBondContact O-N 2.86Å
248	A	90.3	Very high	88	Confident	60 Å²	60	80.3 Å²	80.3	50%	0.496	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-41.4	176.9	0	0	0	0	0	112.2	D244 E245 Q251 S252	D244-A248 WeakPolarHBondContact O-CB 3.14Å; D244-A248 PolarHBondContact O-N 2.83Å; E245-A248 PolarHBondContact O-N 3.42Å; A248-Q251 PolarHBondContact O-N 2.87Å; A248-S252 PolarHBondContact O-N 3.43Å
249	E	89.9	Confident	87.5	Confident	69 Å²	69	82 Å²	82	32%	0.322	45%	0.448	S	S	.	.	H	α-helix	trans	-60	-49.5	174.4	-165.4	-162.2	168.6	0	0	111	K231 E245 M246 Q251 S252 K253	K231-E249 IonicContact NZ-OE1 2.93Å; K231-E249 PolarHBondContact NZ-OE1 3.37Å; K231-E249 IonicContact NZ-OE2 3.66Å; K231-E249 PolarHBondContact NZ-OE2 2.85Å; E245-E249 PolarHBondContact O-N 3.5Å; M246-E249 PolarHBondContact O-N 2.93Å; E249-Q251 PolarHBondContact O-N 3.18Å; E249-S252 PolarHBondContact O-N 2.84Å; E249-K253 HydrophobicContact CG-CD 4.31Å; E249-K253 WeakPolarHBondContact O-CG 3.46Å; E249-K253 PolarHBondContact O-N 3.36Å; E249-K253 WeakPolarHBondContact OE1-CE 3.16Å; E249-K253 IonicContact OE1-NZ 3.9Å; E249-K253 PolarHBondContact OE1-NZ 2.81Å
250	L	89.1	Confident	87	Confident	38 Å²	38	82 Å²	82	20%	0.199	44%	0.436	C	S	.	.	H	α-helix	trans	-59.9	-45	175.7	177.5	61.4	0	0	0	111.2	L224 Y228 M246 S252 K253 L254	L224-L250 HydrophobicContact CD1-CD1 3.84Å; L224-L250 HydrophobicContact CD2-CD1 3.9Å; L224-L250 HydrophobicContact CG-CD1 3.66Å; Y228-L250 HydrophobicContact CD1-CD2 4.38Å; Y228-L250 HydrophobicContact CD2-CB 3.98Å; Y228-L250 HydrophobicContact CD2-CD2 3.71Å; Y228-L250 HydrophobicContact CD2-CG 4.4Å; Y228-L250 HydrophobicContact CE2-CD2 3.98Å; Y228-L250 HydrophobicContact CG-CD2 3.93Å; M246-L250 WeakPolarHBondContact O-CB 3.15Å; M246-L250 PolarHBondContact O-N 3.2Å; L250-S252 VanDerWaalsContact C-N 3.3Å; L250-S252 PolarHBondContact O-N 2.78Å; L250-K253 PolarHBondContact O-N 3.39Å; L250-L254 HydrophobicContact CD1-CD1 3.93Å; L250-L254 HydrophobicContact CD1-CG 4.04Å; L250-L254 HydrophobicContact CG-CD1 3.86Å; L250-L254 HydrophobicContact CG-CG 4.39Å; L250-L254 WeakPolarHBondContact O-CB 3.3Å; L250-L254 VanDerWaalsContact O-CG 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.32Å; L250-L254 PolarHBondContact O-N 3.32Å
251	Q	86.9	Confident	86.5	Confident	110 Å²	110	84.3 Å²	84.3	51%	0.514	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-34.1	178.3	-159.6	-163.5	60.9	0	0	112.2	N247 A248 E249 K255	N247-Q251 VanDerWaalsContact O-CB 3.29Å; N247-Q251 WeakPolarHBondContact O-CB 3.3Å; N247-Q251 PolarHBondContact O-N 2.86Å; A248-Q251 PolarHBondContact O-N 2.87Å; E249-Q251 PolarHBondContact O-N 3.18Å; Q251-K255 WeakPolarHBondContact O-CD 3.4Å; Q251-K255 VanDerWaalsContact O-CG 3.25Å; Q251-K255 WeakPolarHBondContact O-CG 3.27Å; Q251-K255 PolarHBondContact O-N 2.74Å
252	S	87.1	Confident	86.1	Confident	57 Å²	57	80.3 Å²	80.3	40%	0.399	43%	0.431	S	S	.	.	H	α-helix	trans	-66.2	-54.4	172.4	-160.4	0	0	0	0	110.8	A248 E249 L250 L254 K255 D256	A248-S252 PolarHBondContact O-N 3.43Å; E249-S252 PolarHBondContact O-N 2.84Å; L250-S252 VanDerWaalsContact C-N 3.3Å; L250-S252 PolarHBondContact O-N 2.78Å; S252-L254 PolarHBondContact O-N 3.45Å; S252-L254 VanDerWaalsContact O-N 3.15Å; S252-K255 WeakPolarHBondContact O-CA 3.42Å; S252-K255 WeakPolarHBondContact O-CB 3.42Å; S252-K255 PolarHBondContact O-N 2.76Å; S252-D256 PolarHBondContact O-N 2.73Å; S252-D256 VanDerWaalsContact O-OD2 3.11Å
253	K	85.8	Confident	85.8	Confident	69 Å²	69	84.4 Å²	84.4	30%	0.3	44%	0.441	S	S	.	.	H	α-helix	trans	-53.7	-38.2	178.4	-75.7	170.9	161.6	171.8	0	112.5	L224 D227 E249 L250 L257	L224-K253 HydrophobicContact CD1-CB 3.96Å; L224-K253 HydrophobicContact CD1-CD 3.62Å; L224-K253 HydrophobicContact CD1-CG 4.38Å; L224-K253 HydrophobicContact CD2-CB 4.47Å; D227-K253 IonicContact OD2-NZ 3.42Å; D227-K253 PolarHBondContact OD2-NZ 3.47Å; E249-K253 HydrophobicContact CG-CD 4.31Å; E249-K253 WeakPolarHBondContact O-CG 3.46Å; E249-K253 PolarHBondContact O-N 3.36Å; E249-K253 WeakPolarHBondContact OE1-CE 3.16Å; E249-K253 IonicContact OE1-NZ 3.9Å; E249-K253 PolarHBondContact OE1-NZ 2.81Å; L250-K253 PolarHBondContact O-N 3.39Å; K253-L257 WeakPolarHBondContact O-CB 3.45Å; K253-L257 PolarHBondContact O-N 2.91Å
254	L	85.4	Confident	85.3	Confident	57 Å²	57	88.3 Å²	88.3	30%	0.298	46%	0.458	S	S	.	.	H	α-helix	trans	-71.8	-39.1	174.9	-69.2	171.1	0	0	0	113.3	L224 L250 S252 D256 F258	L224-L254 HydrophobicContact CD2-CD2 3.69Å; L224-L254 HydrophobicContact CD2-CG 4.18Å; L250-L254 HydrophobicContact CD1-CD1 3.93Å; L250-L254 HydrophobicContact CD1-CG 4.04Å; L250-L254 HydrophobicContact CG-CD1 3.86Å; L250-L254 HydrophobicContact CG-CG 4.39Å; L250-L254 WeakPolarHBondContact O-CB 3.3Å; L250-L254 VanDerWaalsContact O-CG 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.32Å; L250-L254 PolarHBondContact O-N 3.32Å; S252-L254 PolarHBondContact O-N 3.45Å; S252-L254 VanDerWaalsContact O-N 3.15Å; L254-D256 VanDerWaalsContact C-N 3.32Å; L254-F258 HydrophobicContact CD2-CE2 4.05Å; L254-F258 WeakPolarHBondContact O-CB 3.06Å; L254-F258 VanDerWaalsContact O-CD2 3.29Å; L254-F258 WeakPolarHBondContact O-CD2 3.29Å; L254-F258 PolarHBondContact O-N 3.5Å
255	K	84.9	Confident	85	Confident	90 Å²	90	87.6 Å²	87.6	39%	0.391	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-43.9	173.4	-75.8	164.3	-173.3	162.2	0	110.9	Q251 S252 N259 V260	Q251-K255 WeakPolarHBondContact O-CD 3.4Å; Q251-K255 VanDerWaalsContact O-CG 3.25Å; Q251-K255 WeakPolarHBondContact O-CG 3.27Å; Q251-K255 PolarHBondContact O-N 2.74Å; S252-K255 WeakPolarHBondContact O-CA 3.42Å; S252-K255 WeakPolarHBondContact O-CB 3.42Å; S252-K255 PolarHBondContact O-N 2.76Å; K255-N259 WeakPolarHBondContact O-CA 3.44Å; K255-N259 PolarHBondContact O-N 2.68Å; K255-V260 HydrophobicContact CB-CB 4.31Å; K255-V260 HydrophobicContact CG-CB 4.37Å; K255-V260 PolarHBondContact O-N 3.32Å
256	D	84.2	Confident	85	Confident	109 Å²	109	86 Å²	86	58%	0.583	45%	0.446	S	S	*	.	H	α-helix	trans	-66.4	-49.1	179.3	-60.9	-40	0	0	0	110.8	S252 L254 F258 N259	S252-D256 PolarHBondContact O-N 2.73Å; S252-D256 VanDerWaalsContact O-OD2 3.11Å; L254-D256 VanDerWaalsContact C-N 3.32Å; D256-F258 PolarHBondContact O-N 2.81Å; D256-N259 PolarHBondContact O-N 3.23Å; D256-N259 PolarHBondContact O-ND2 2.97Å
257	L	82.6	Confident	84.9	Confident	54 Å²	54	86.1 Å²	86.1	28%	0.283	45%	0.45	S	S	.	.	H	α-helix	trans	-58.5	-43.9	178.6	-175.8	151.7	0	0	0	112.5	W211 K253 N259	W211-L257 HydrophobicContact CB-CD1 4.45Å; K253-L257 WeakPolarHBondContact O-CB 3.45Å; K253-L257 PolarHBondContact O-N 2.91Å; L257-N259 VanDerWaalsContact C-N 3.31Å; L257-N259 PolarHBondContact O-N 3.46Å; L257-N259 PolarHBondContact O-ND2 2.81Å
258	F	82.3	Confident	84.9	Confident	130 Å²	130	87.9 Å²	87.9	57%	0.57	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	5.7	177.1	-68.4	-62.3	0	0	0	114.2	H221 L254 D256 V260	H221-F258 AromaticContact NE2-CZ 3.83Å; L254-F258 HydrophobicContact CD2-CE2 4.05Å; L254-F258 WeakPolarHBondContact O-CB 3.06Å; L254-F258 VanDerWaalsContact O-CD2 3.29Å; L254-F258 WeakPolarHBondContact O-CD2 3.29Å; L254-F258 PolarHBondContact O-N 3.5Å; D256-F258 PolarHBondContact O-N 2.81Å; F258-V260 VanDerWaalsContact C-N 3.29Å; F258-V260 HydrophobicContact CB-CG2 3.67Å; F258-V260 PolarHBondContact O-N 2.89Å
259	N	81.8	Confident	84.9	Confident	142 Å²	142	89.6 Å²	89.6	76%	0.759	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	42.6	179.4	-67.4	-105.9	0	0	0	113.1	K255 D256 L257 D261	K255-N259 WeakPolarHBondContact O-CA 3.44Å; K255-N259 PolarHBondContact O-N 2.68Å; D256-N259 PolarHBondContact O-N 3.23Å; D256-N259 PolarHBondContact O-ND2 2.97Å; L257-N259 VanDerWaalsContact C-N 3.31Å; L257-N259 PolarHBondContact O-N 3.46Å; L257-N259 PolarHBondContact O-ND2 2.81Å; N259-D261 PolarHBondContact O-N 3.19Å
260	V	79.8	Confident	85	Confident	63 Å²	63	88.4 Å²	88.4	38%	0.382	46%	0.459	S	S	.	.			trans	-81.6	83.1	-173.4	-171.4	0	0	0	0	111.1	K255 F258 A262 L265	K255-V260 HydrophobicContact CB-CB 4.31Å; K255-V260 HydrophobicContact CG-CB 4.37Å; K255-V260 PolarHBondContact O-N 3.32Å; F258-V260 VanDerWaalsContact C-N 3.29Å; F258-V260 HydrophobicContact CB-CG2 3.67Å; F258-V260 PolarHBondContact O-N 2.89Å; V260-A262 PolarHBondContact O-N 2.75Å; V260-L265 HydrophobicContact CG1-CD1 4.01Å
261	D	79.4	Confident	85.2	Confident	84 Å²	84	92.2 Å²	92.2	45%	0.449	47%	0.474	S	S	.	.			trans	-64	103.7	166.2	176	-8.9	0	0	0	110.2	N259 F263 K264 L265	N259-D261 PolarHBondContact O-N 3.19Å; D261-F263 VanDerWaalsContact C-N 3.34Å; D261-F263 PolarHBondContact O-N 3.43Å; D261-F263 WeakPolarHBondContact OD1-CB 3.21Å; D261-F263 PolarHBondContact OD1-N 3.31Å; D261-K264 HydrophobicContact CB-CB 3.81Å; D261-K264 HydrophobicContact CB-CD 4.28Å; D261-K264 PolarHBondContact O-N 2.79Å; D261-K264 PolarHBondContact OD1-N 2.87Å; D261-K264 WeakPolarHBondContact OD2-CB 3.42Å; D261-L265 WeakPolarHBondContact O-CB 3.49Å; D261-L265 PolarHBondContact O-N 3.38Å
262	A	79.7	Confident	85.4	Confident	70 Å²	70	91.3 Å²	91.3	58%	0.579	47%	0.473	S	S	*	.	H	α-helix	trans	-63.3	-36.2	-179.2	0	0	0	0	0	113	V260 L265 E266	V260-A262 PolarHBondContact O-N 2.75Å; A262-L265 PolarHBondContact O-N 3.48Å; A262-E266 PolarHBondContact O-N 2.85Å
263	F	81.8	Confident	85.7	Confident	154 Å²	154	95.1 Å²	95.1	68%	0.675	48%	0.478	S	S	*	.	H	α-helix	trans	-69.7	-39.6	178.8	176.3	-100.2	0	0	0	111.1	D261 S267	D261-F263 VanDerWaalsContact C-N 3.34Å; D261-F263 PolarHBondContact O-N 3.43Å; D261-F263 WeakPolarHBondContact OD1-CB 3.21Å; D261-F263 PolarHBondContact OD1-N 3.31Å; F263-S267 WeakPolarHBondContact O-CB 3.46Å; F263-S267 PolarHBondContact O-N 3.08Å
264	K	82.3	Confident	86.1	Confident	130 Å²	130	94.2 Å²	94.2	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-64.2	-39.1	171.6	177.7	179.5	179	-174.1	0	112.1	D261 S267 L268	D261-K264 HydrophobicContact CB-CB 3.81Å; D261-K264 HydrophobicContact CB-CD 4.28Å; D261-K264 PolarHBondContact O-N 2.79Å; D261-K264 PolarHBondContact OD1-N 2.87Å; D261-K264 WeakPolarHBondContact OD2-CB 3.42Å; K264-S267 PolarHBondContact O-N 3.48Å; K264-L268 HydrophobicContact CG-CD1 4.12Å; K264-L268 WeakPolarHBondContact O-CB 3.37Å; K264-L268 PolarHBondContact O-N 2.89Å
265	L	84.4	Confident	86.4	Confident	96 Å²	96	96.1 Å²	96.1	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-49.1	177.7	-160.2	158.1	0	0	0	111.2	V260 D261 A262 S267 L268 E269	V260-L265 HydrophobicContact CG1-CD1 4.01Å; D261-L265 WeakPolarHBondContact O-CB 3.49Å; D261-L265 PolarHBondContact O-N 3.38Å; A262-L265 PolarHBondContact O-N 3.48Å; L265-S267 VanDerWaalsContact C-N 3.34Å; L265-S267 PolarHBondContact O-N 3.4Å; L265-L268 WeakPolarHBondContact O-CB 3.29Å; L265-L268 PolarHBondContact O-N 2.66Å; L265-E269 PolarHBondContact O-N 3.22Å
266	E	87.6	Confident	86.8	Confident	122 Å²	122	95.9 Å²	95.9	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-60.6	-41.8	173.7	-175.4	177.5	-161.3	0	0	111.8	A262 L268 E269 A270	A262-E266 PolarHBondContact O-N 2.85Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.5Å; E266-E269 PolarHBondContact O-N 3.14Å; E266-A270 WeakPolarHBondContact O-CB 3.4Å; E266-A270 PolarHBondContact O-N 2.82Å
267	S	89	Confident	87.2	Confident	37 Å²	37	95.9 Å²	95.9	26%	0.259	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-37.1	175.7	-167.8	0	0	0	0	112.7	F263 K264 L265 K271	F263-S267 WeakPolarHBondContact O-CB 3.46Å; F263-S267 PolarHBondContact O-N 3.08Å; K264-S267 PolarHBondContact O-N 3.48Å; L265-S267 VanDerWaalsContact C-N 3.34Å; L265-S267 PolarHBondContact O-N 3.4Å; S267-K271 WeakPolarHBondContact O-CB 3.38Å; S267-K271 VanDerWaalsContact O-CD 3.25Å; S267-K271 WeakPolarHBondContact O-CD 3.28Å; S267-K271 WeakPolarHBondContact O-CG 3.38Å; S267-K271 PolarHBondContact O-N 2.9Å; S267-K271 VanDerWaalsContact O-N 3.11Å; S267-K271 PolarHBondContact OG-NZ 2.9Å
268	L	88.4	Confident	87.6	Confident	104 Å²	104	98.7 Å²	98.7	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-69	-42.5	173.7	-94.3	151.7	0	0	0	111.7	K264 L265 E266 K271 N272	K264-L268 HydrophobicContact CG-CD1 4.12Å; K264-L268 WeakPolarHBondContact O-CB 3.37Å; K264-L268 PolarHBondContact O-N 2.89Å; L265-L268 WeakPolarHBondContact O-CB 3.29Å; L265-L268 PolarHBondContact O-N 2.66Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.5Å; L268-K271 PolarHBondContact O-N 3.33Å; L268-N272 VanDerWaalsContact O-CB 3.31Å; L268-N272 WeakPolarHBondContact O-CB 3.36Å; L268-N272 PolarHBondContact O-N 2.83Å
269	E	91.6	Very high	87.9	Confident	97 Å²	97	96.5 Å²	96.5	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-44.7	177.5	-159.1	-147.7	113.5	0	0	111.7	L265 E266 K271 N272 R273	L265-E269 PolarHBondContact O-N 3.22Å; E266-E269 PolarHBondContact O-N 3.14Å; E269-K271 PolarHBondContact O-N 3.44Å; E269-N272 WeakPolarHBondContact O-CB 3.49Å; E269-N272 PolarHBondContact O-N 3.48Å; E269-R273 PolarHBondContact O-N 3.26Å; E269-R273 IonicContact OE1-CZ 3.86Å; E269-R273 IonicContact OE1-NE 2.78Å; E269-R273 PolarHBondContact OE1-NE 3.08Å; E269-R273 IonicContact OE1-NH2 2.73Å; E269-R273 PolarHBondContact OE1-NH2 3.44Å
270	A	91.7	Very high	88.3	Confident	43 Å²	43	92.5 Å²	92.5	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-40.7	175.6	0	0	0	0	0	112.3	E266 A274	E266-A270 WeakPolarHBondContact O-CB 3.4Å; E266-A270 PolarHBondContact O-N 2.82Å; A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 3.46Å
271	K	91.8	Very high	88.7	Confident	118 Å²	118	96.9 Å²	96.9	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-41.5	172.6	-75.4	163	-174.9	142.7	0	111.9	S267 L268 E269 A274 L275	S267-K271 WeakPolarHBondContact O-CB 3.38Å; S267-K271 VanDerWaalsContact O-CD 3.25Å; S267-K271 WeakPolarHBondContact O-CD 3.28Å; S267-K271 WeakPolarHBondContact O-CG 3.38Å; S267-K271 PolarHBondContact O-N 2.9Å; S267-K271 VanDerWaalsContact O-N 3.11Å; S267-K271 PolarHBondContact OG-NZ 2.9Å; L268-K271 PolarHBondContact O-N 3.33Å; E269-K271 PolarHBondContact O-N 3.44Å; K271-A274 PolarHBondContact O-N 2.98Å; K271-L275 WeakPolarHBondContact O-CB 3.47Å; K271-L275 VanDerWaalsContact O-CG 3.31Å; K271-L275 WeakPolarHBondContact O-CG 3.42Å; K271-L275 PolarHBondContact O-N 3.07Å
272	N	91.3	Very high	88.9	Confident	92 Å²	92	97.9 Å²	97.9	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-46.5	178.3	-163.7	-24.1	0	0	0	110.6	L268 E269 A274 L275 N276	L268-N272 VanDerWaalsContact O-CB 3.31Å; L268-N272 WeakPolarHBondContact O-CB 3.36Å; L268-N272 PolarHBondContact O-N 2.83Å; E269-N272 WeakPolarHBondContact O-CB 3.49Å; E269-N272 PolarHBondContact O-N 3.48Å; N272-A274 PolarHBondContact O-N 3.23Å; N272-L275 PolarHBondContact O-N 3.07Å; N272-N276 WeakPolarHBondContact O-CB 3.43Å; N272-N276 VanDerWaalsContact O-CG 3.22Å; N272-N276 PolarHBondContact O-N 2.67Å; N272-N276 PolarHBondContact O-ND2 2.73Å; N272-N276 VanDerWaalsContact O-ND2 3.1Å; N272-N276 PolarHBondContact OD1-ND2 2.97Å
273	R	94.1	Very high	89	Confident	137 Å²	137	98.6 Å²	98.6	52%	0.517	49%	0.49	S	S	.	.	H	α-helix	trans	-55.6	-48.6	171.2	-76.7	-169.8	-98	125.4	-9.6	112.4	E269 L275 N276 E277	E269-R273 PolarHBondContact O-N 3.26Å; E269-R273 IonicContact OE1-CZ 3.86Å; E269-R273 IonicContact OE1-NE 2.78Å; E269-R273 PolarHBondContact OE1-NE 3.08Å; E269-R273 IonicContact OE1-NH2 2.73Å; E269-R273 PolarHBondContact OE1-NH2 3.44Å; R273-L275 PolarHBondContact O-N 3.34Å; R273-N276 PolarHBondContact O-N 3.48Å; R273-E277 PolarHBondContact O-N 3.04Å
274	A	93.1	Very high	88.9	Confident	49 Å²	49	96.5 Å²	96.5	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-64.5	-37.8	179.4	0	0	0	0	0	113.4	A270 K271 N272 Q278	A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 3.46Å; K271-A274 PolarHBondContact O-N 2.98Å; N272-A274 PolarHBondContact O-N 3.23Å; A274-Q278 WeakPolarHBondContact O-CG 3.27Å; A274-Q278 PolarHBondContact O-N 2.85Å; A274-Q278 VanDerWaalsContact O-N 3.09Å
275	L	92.8	Very high	88.6	Confident	97 Å²	97	95.4 Å²	95.4	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-68.4	-42.3	174.7	-74.6	168.9	0	0	0	111.7	K271 N272 R273 E277 Q278 I279	K271-L275 WeakPolarHBondContact O-CB 3.47Å; K271-L275 VanDerWaalsContact O-CG 3.31Å; K271-L275 WeakPolarHBondContact O-CG 3.42Å; K271-L275 PolarHBondContact O-N 3.07Å; N272-L275 PolarHBondContact O-N 3.07Å; R273-L275 PolarHBondContact O-N 3.34Å; L275-E277 VanDerWaalsContact C-N 3.33Å; L275-E277 PolarHBondContact O-N 2.84Å; L275-Q278 PolarHBondContact O-N 3.43Å; L275-Q278 VanDerWaalsContact O-N 3.14Å; L275-I279 VanDerWaalsContact O-CG1 3.31Å; L275-I279 WeakPolarHBondContact O-CG1 3.28Å; L275-I279 PolarHBondContact O-N 2.75Å
276	N	92.4	Very high	87.8	Confident	85 Å²	85	97.9 Å²	97.9	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-65.1	-35.7	176.7	-67.1	-30.9	0	0	0	112	N272 R273 I279 A280	N272-N276 WeakPolarHBondContact O-CB 3.43Å; N272-N276 VanDerWaalsContact O-CG 3.22Å; N272-N276 PolarHBondContact O-N 2.67Å; N272-N276 PolarHBondContact O-ND2 2.73Å; N272-N276 VanDerWaalsContact O-ND2 3.1Å; N272-N276 PolarHBondContact OD1-ND2 2.97Å; R273-N276 PolarHBondContact O-N 3.48Å; N276-I279 PolarHBondContact O-N 3.12Å; N276-A280 VanDerWaalsContact O-CB 3.3Å; N276-A280 WeakPolarHBondContact O-CB 3.35Å; N276-A280 PolarHBondContact O-N 2.81Å
277	E	93.7	Very high	86.9	Confident	109 Å²	109	99.4 Å²	99.4	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-41.3	169.6	-83.6	-161	-166.4	0	0	112.8	R273 L275 A280 R281	R273-E277 PolarHBondContact O-N 3.04Å; L275-E277 VanDerWaalsContact C-N 3.33Å; L275-E277 PolarHBondContact O-N 2.84Å; E277-A280 PolarHBondContact O-N 3.28Å; E277-R281 WeakPolarHBondContact O-CB 3.42Å; E277-R281 WeakPolarHBondContact O-CG 3.41Å; E277-R281 PolarHBondContact O-N 3.19Å; E277-R281 IonicContact OE2-CZ 2.68Å; E277-R281 IonicContact OE2-NE 3.44Å; E277-R281 IonicContact OE2-NH2 2.73Å; E277-R281 PolarHBondContact OE2-NH2 2.77Å
278	Q	91.4	Very high	85.8	Confident	113 Å²	113	104 Å²	104	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-42.2	175.9	-73.8	-178.5	23.2	0	0	111.6	A274 L275 R281 L282	A274-Q278 WeakPolarHBondContact O-CG 3.27Å; A274-Q278 PolarHBondContact O-N 2.85Å; A274-Q278 VanDerWaalsContact O-N 3.09Å; L275-Q278 PolarHBondContact O-N 3.43Å; L275-Q278 VanDerWaalsContact O-N 3.14Å; Q278-R281 PolarHBondContact O-N 2.83Å; Q278-L282 WeakPolarHBondContact O-CB 3.31Å; Q278-L282 VanDerWaalsContact O-CG 3.26Å; Q278-L282 WeakPolarHBondContact O-CG 3.24Å; Q278-L282 PolarHBondContact O-N 3.46Å
279	I	88.6	Confident	84.5	Confident	85 Å²	85	104.2 Å²	104.2	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-52	174	-67.7	164	0	0	0	109.6	L275 N276 R281 L282 E283	L275-I279 VanDerWaalsContact O-CG1 3.31Å; L275-I279 WeakPolarHBondContact O-CG1 3.28Å; L275-I279 PolarHBondContact O-N 2.75Å; N276-I279 PolarHBondContact O-N 3.12Å; I279-R281 VanDerWaalsContact C-N 3.3Å; I279-R281 PolarHBondContact O-N 2.74Å; I279-L282 CarbonylContact O-C 3.54Å; I279-L282 PolarHBondContact O-N 2.76Å; I279-L282 VanDerWaalsContact O-N 3.14Å; I279-E283 HydrophobicContact CG2-CG 4.11Å; I279-E283 WeakPolarHBondContact O-CB 3.4Å; I279-E283 WeakPolarHBondContact O-CG 3.34Å; I279-E283 PolarHBondContact O-N 2.78Å
280	A	89.5	Confident	82.9	Confident	58 Å²	58	103 Å²	103	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-59.6	-37.2	179.7	0	0	0	0	0	113.1	N276 E277 Q284	N276-A280 VanDerWaalsContact O-CB 3.3Å; N276-A280 WeakPolarHBondContact O-CB 3.35Å; N276-A280 PolarHBondContact O-N 2.81Å; E277-A280 PolarHBondContact O-N 3.28Å; A280-Q284 VanDerWaalsContact O-CB 3.29Å; A280-Q284 WeakPolarHBondContact O-CB 3.39Å; A280-Q284 PolarHBondContact O-N 2.91Å
281	R	88.4	Confident	81.5	Confident	154 Å²	154	107.2 Å²	107.2	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-65.3	-50.7	172.8	-69.9	168.7	-161	-152.7	8.5	111.3	E277 Q278 I279 E283 Q284 E285	E277-R281 WeakPolarHBondContact O-CB 3.42Å; E277-R281 WeakPolarHBondContact O-CG 3.41Å; E277-R281 PolarHBondContact O-N 3.19Å; E277-R281 IonicContact OE2-CZ 2.68Å; E277-R281 IonicContact OE2-NE 3.44Å; E277-R281 IonicContact OE2-NH2 2.73Å; E277-R281 PolarHBondContact OE2-NH2 2.77Å; Q278-R281 PolarHBondContact O-N 2.83Å; I279-R281 VanDerWaalsContact C-N 3.3Å; I279-R281 PolarHBondContact O-N 2.74Å; R281-E283 VanDerWaalsContact C-N 3.31Å; R281-E283 PolarHBondContact O-N 2.8Å; R281-Q284 PolarHBondContact O-N 3.48Å; R281-E285 WeakPolarHBondContact O-CB 3.39Å; R281-E285 WeakPolarHBondContact O-CG 3.41Å; R281-E285 PolarHBondContact O-N 2.77Å
282	L	82.8	Confident	80.5	Confident	106 Å²	106	108.1 Å²	108.1	56%	0.555	52%	0.52	S	S	*	.	H	α-helix	trans	-63.6	-33.6	179	-72.1	169.1	0	0	0	112.7	Q278 I279 R286	Q278-L282 WeakPolarHBondContact O-CB 3.31Å; Q278-L282 VanDerWaalsContact O-CG 3.26Å; Q278-L282 WeakPolarHBondContact O-CG 3.24Å; Q278-L282 PolarHBondContact O-N 3.46Å; I279-L282 CarbonylContact O-C 3.54Å; I279-L282 PolarHBondContact O-N 2.76Å; I279-L282 VanDerWaalsContact O-N 3.14Å; L282-R286 WeakPolarHBondContact O-CB 3.42Å; L282-R286 PolarHBondContact O-N 3.32Å
283	E	82.1	Confident	79.5	Confident	84 Å²	84	108.2 Å²	108.2	39%	0.393	52%	0.52	S	S	.	.	H	α-helix	trans	-72.9	-40.4	174.3	-68.4	-153.7	112	0	0	111.8	I279 R281 E285 R286 E287	I279-E283 HydrophobicContact CG2-CG 4.11Å; I279-E283 WeakPolarHBondContact O-CB 3.4Å; I279-E283 WeakPolarHBondContact O-CG 3.34Å; I279-E283 PolarHBondContact O-N 2.78Å; R281-E283 VanDerWaalsContact C-N 3.31Å; R281-E283 PolarHBondContact O-N 2.8Å; E283-E285 VanDerWaalsContact C-N 3.31Å; E283-E285 PolarHBondContact O-N 2.86Å; E283-R286 CarbonylContact O-C 3.56Å; E283-R286 WeakPolarHBondContact O-CB 3.3Å; E283-R286 PolarHBondContact O-N 2.93Å; E283-R286 IonicContact OE1-CZ 3.52Å; E283-R286 IonicContact OE1-NH1 2.73Å; E283-R286 PolarHBondContact OE1-NH1 3.17Å; E283-R286 IonicContact OE1-NH2 3.47Å; E283-R286 PolarHBondContact OE1-NH2 2.87Å; E283-E287 VanDerWaalsContact O-CB 3.28Å; E283-E287 WeakPolarHBondContact O-CB 3.43Å; E283-E287 PolarHBondContact O-N 2.73Å
284	Q	80.9	Confident	78.8	Confident	110 Å²	110	105.2 Å²	105.2	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-26.9	174.7	-159.2	-170	92.8	0	0	112.3	A280 R281 K288	A280-Q284 VanDerWaalsContact O-CB 3.29Å; A280-Q284 WeakPolarHBondContact O-CB 3.39Å; A280-Q284 PolarHBondContact O-N 2.91Å; R281-Q284 PolarHBondContact O-N 3.48Å; Q284-K288 VanDerWaalsContact O-CD 3.3Å; Q284-K288 WeakPolarHBondContact O-CD 3.31Å; Q284-K288 VanDerWaalsContact O-CG 3.26Å; Q284-K288 WeakPolarHBondContact O-CG 3.08Å; Q284-K288 PolarHBondContact O-N 2.79Å
285	E	75.3	Confident	78.2	Confident	108 Å²	108	105.3 Å²	105.3	51%	0.505	51%	0.51	S	S	.	.	H	α-helix	trans	-69.1	-52.4	166.2	-75.8	173.4	175.2	0	0	110.2	R281 E283 E287 K288 E289	R281-E285 WeakPolarHBondContact O-CB 3.39Å; R281-E285 WeakPolarHBondContact O-CG 3.41Å; R281-E285 PolarHBondContact O-N 2.77Å; E283-E285 VanDerWaalsContact C-N 3.31Å; E283-E285 PolarHBondContact O-N 2.86Å; E285-E287 PolarHBondContact O-N 2.93Å; E285-E287 VanDerWaalsContact O-N 3.12Å; E285-K288 CarbonylContact O-C 3.58Å; E285-K288 WeakPolarHBondContact O-CA 3.38Å; E285-K288 PolarHBondContact O-N 3.47Å; E285-E289 WeakPolarHBondContact O-CB 3.48Å; E285-E289 WeakPolarHBondContact O-CG 3.38Å; E285-E289 PolarHBondContact O-N 2.74Å
286	R	67.8	Low	77.7	Confident	148 Å²	148	104.3 Å²	104.3	56%	0.558	50%	0.504	S	S	*	.	H	α-helix	trans	-54.4	-30.4	175.3	-174	-166.6	70.4	-152.4	-5.9	113.4	L282 E283 P290	L282-R286 WeakPolarHBondContact O-CB 3.42Å; L282-R286 PolarHBondContact O-N 3.32Å; E283-R286 CarbonylContact O-C 3.56Å; E283-R286 WeakPolarHBondContact O-CB 3.3Å; E283-R286 PolarHBondContact O-N 2.93Å; E283-R286 IonicContact OE1-CZ 3.52Å; E283-R286 IonicContact OE1-NH1 2.73Å; E283-R286 PolarHBondContact OE1-NH1 3.17Å; E283-R286 IonicContact OE1-NH2 3.47Å; E283-R286 PolarHBondContact OE1-NH2 2.87Å; R286-P290 WeakPolarHBondContact O-CD 3.42Å; R286-P290 WeakPolarHBondContact O-CG 3.34Å
287	E	68.9	Low	77.4	Confident	153 Å²	153	107.1 Å²	107.1	72%	0.715	51%	0.509	S	S	*	.	H	α-helix	trans	-85.1	-19.2	178.2	-169	168.2	-120.4	0	0	113.7	E283 E285 P290	E283-E287 VanDerWaalsContact O-CB 3.28Å; E283-E287 WeakPolarHBondContact O-CB 3.43Å; E283-E287 PolarHBondContact O-N 2.73Å; E285-E287 PolarHBondContact O-N 2.93Å; E285-E287 VanDerWaalsContact O-N 3.12Å; E287-P290 WeakPolarHBondContact O-CD 3.47Å; E287-P290 WeakPolarHBondContact O-CG 3.1Å
288	K	65.9	Low	77	Confident	134 Å²	134	108.3 Å²	108.3	58%	0.583	51%	0.512	S	S	*	.	H	α-helix	trans	-88.1	-31.5	166	-66.8	163.4	-168.6	161.5	0	112.2	Q284 E285 P290	Q284-K288 VanDerWaalsContact O-CD 3.3Å; Q284-K288 WeakPolarHBondContact O-CD 3.31Å; Q284-K288 VanDerWaalsContact O-CG 3.26Å; Q284-K288 WeakPolarHBondContact O-CG 3.08Å; Q284-K288 PolarHBondContact O-N 2.79Å; E285-K288 CarbonylContact O-C 3.58Å; E285-K288 WeakPolarHBondContact O-CA 3.38Å; E285-K288 PolarHBondContact O-N 3.47Å; K288-P290 WeakPolarHBondContact O-CD 3.39Å
289	E	59.8	Low	76.9	Confident	109 Å²	109	107.3 Å²	107.3	51%	0.509	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-4.3	176.5	-75.5	-143.2	119.7	0	0	118.6	E285 N291 R292 L293	E285-E289 WeakPolarHBondContact O-CB 3.48Å; E285-E289 WeakPolarHBondContact O-CG 3.38Å; E285-E289 PolarHBondContact O-N 2.74Å; E289-N291 PolarHBondContact O-N 2.95Å; E289-R292 HydrophobicContact CB-CB 4.24Å; E289-R292 HydrophobicContact CG-CB 4.23Å; E289-R292 WeakPolarHBondContact O-CA 3.33Å; E289-R292 WeakPolarHBondContact O-CB 3.1Å; E289-R292 PolarHBondContact O-N 3.05Å; E289-L293 PolarHBondContact O-N 3.34Å
290	P	58.1	Low	77	Confident	71 Å²	71	109.6 Å²	109.6	46%	0.461	52%	0.517	S	S	.	.	H	α-helix	trans	-58.5	-39.2	174.9	-20.8	34.1	0	0	0	109.9	R286 E287 K288 R292 E294	R286-P290 WeakPolarHBondContact O-CD 3.42Å; R286-P290 WeakPolarHBondContact O-CG 3.34Å; E287-P290 WeakPolarHBondContact O-CD 3.47Å; E287-P290 WeakPolarHBondContact O-CG 3.1Å; K288-P290 WeakPolarHBondContact O-CD 3.39Å; P290-R292 VanDerWaalsContact C-N 3.33Å; P290-R292 PolarHBondContact O-N 3.42Å; P290-E294 WeakPolarHBondContact O-CB 3.2Å; P290-E294 PolarHBondContact O-N 3.49Å
291	N	62.6	Low	77.1	Confident	131 Å²	131	109.8 Å²	109.8	70%	0.701	52%	0.518	S	S	*	.	H	α-helix	trans	-65.6	-29	171.5	-78.2	-45.5	0	0	0	113.5	E289 S295	E289-N291 PolarHBondContact O-N 2.95Å; N291-S295 WeakPolarHBondContact O-CB 3.48Å; N291-S295 PolarHBondContact O-N 2.67Å; N291-S295 PolarHBondContact O-OG 2.71Å
292	R	70.1	Confident	77.3	Confident	138 Å²	138	105.4 Å²	105.4	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-75.7	-48.1	177.9	-173.8	52.1	172.1	172.1	-2.7	111.5	E289 P290 S295 L296	E289-R292 HydrophobicContact CB-CB 4.24Å; E289-R292 HydrophobicContact CG-CB 4.23Å; E289-R292 WeakPolarHBondContact O-CA 3.33Å; E289-R292 WeakPolarHBondContact O-CB 3.1Å; E289-R292 PolarHBondContact O-N 3.05Å; P290-R292 VanDerWaalsContact C-N 3.33Å; P290-R292 PolarHBondContact O-N 3.42Å; R292-S295 PolarHBondContact O-OG 2.91Å; R292-S295 VanDerWaalsContact O-OG 3.11Å; R292-L296 HydrophobicContact CG-CD1 4.14Å; R292-L296 WeakPolarHBondContact O-CB 3.4Å; R292-L296 VanDerWaalsContact O-CG 3.23Å; R292-L296 WeakPolarHBondContact O-CG 3.12Å; R292-L296 PolarHBondContact O-N 3.04Å
293	L	71.6	Confident	77.9	Confident	94 Å²	94	105 Å²	105	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-41	175.4	-178	59.4	0	0	0	111.4	E289 L296 R297	E289-L293 PolarHBondContact O-N 3.34Å; L293-L296 PolarHBondContact O-N 3.26Å; L293-R297 WeakPolarHBondContact O-CB 3.31Å; L293-R297 VanDerWaalsContact O-CG 3.3Å; L293-R297 WeakPolarHBondContact O-CG 3.41Å; L293-R297 PolarHBondContact O-N 3.1Å
294	E	78.7	Confident	78.4	Confident	73 Å²	73	105.9 Å²	105.9	34%	0.341	51%	0.514	S	S	.	.	H	α-helix	trans	-72	-36.6	-179.9	-170.5	60.9	-164.3	0	0	112.6	P290 R297 K298	P290-E294 WeakPolarHBondContact O-CB 3.2Å; P290-E294 PolarHBondContact O-N 3.49Å; E294-R297 PolarHBondContact O-N 3.1Å; E294-R297 IonicContact OE2-NH1 3.36Å; E294-R297 PolarHBondContact OE2-NH1 2.61Å; E294-K298 HydrophobicContact CG-CD 4.36Å; E294-K298 WeakPolarHBondContact O-CB 3.36Å; E294-K298 VanDerWaalsContact O-CG 3.32Å; E294-K298 WeakPolarHBondContact O-CG 3.07Å; E294-K298 PolarHBondContact O-N 3.1Å; E294-K298 WeakPolarHBondContact OE1-CE 3.38Å; E294-K298 IonicContact OE1-NZ 2.87Å; E294-K298 PolarHBondContact OE1-NZ 2.97Å
295	S	81.5	Confident	79.1	Confident	52 Å²	52	101.8 Å²	101.8	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-69.2	-36.6	170.9	60	0	0	0	0	112.4	N291 R292 K298 L299	N291-S295 WeakPolarHBondContact O-CB 3.48Å; N291-S295 PolarHBondContact O-N 2.67Å; N291-S295 PolarHBondContact O-OG 2.71Å; R292-S295 PolarHBondContact O-OG 2.91Å; R292-S295 VanDerWaalsContact O-OG 3.11Å; S295-K298 PolarHBondContact O-N 3.48Å; S295-L299 VanDerWaalsContact O-CB 3.23Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.03Å
296	L	82.5	Confident	79.9	Confident	75 Å²	75	98.6 Å²	98.6	39%	0.393	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-35.8	172.7	-74.4	170.9	0	0	0	112.3	R292 L293 K300	R292-L296 HydrophobicContact CG-CD1 4.14Å; R292-L296 WeakPolarHBondContact O-CB 3.4Å; R292-L296 VanDerWaalsContact O-CG 3.23Å; R292-L296 WeakPolarHBondContact O-CG 3.12Å; R292-L296 PolarHBondContact O-N 3.04Å; L293-L296 PolarHBondContact O-N 3.26Å; L296-K300 VanDerWaalsContact O-CB 3.27Å; L296-K300 WeakPolarHBondContact O-CB 3.4Å; L296-K300 PolarHBondContact O-N 3.48Å
297	R	84.6	Confident	81.2	Confident	145 Å²	145	95.3 Å²	95.3	55%	0.547	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-46.8	170.9	-76.4	169.3	175.7	172.7	-1.8	111.9	L293 E294 K300 A301	L293-R297 WeakPolarHBondContact O-CB 3.31Å; L293-R297 VanDerWaalsContact O-CG 3.3Å; L293-R297 WeakPolarHBondContact O-CG 3.41Å; L293-R297 PolarHBondContact O-N 3.1Å; E294-R297 PolarHBondContact O-N 3.1Å; E294-R297 IonicContact OE2-NH1 3.36Å; E294-R297 PolarHBondContact OE2-NH1 2.61Å; R297-K300 PolarHBondContact O-N 3.27Å; R297-A301 WeakPolarHBondContact O-CB 3.45Å; R297-A301 PolarHBondContact O-N 3.11Å
298	K	86.6	Confident	82.4	Confident	133 Å²	133	94.1 Å²	94.1	58%	0.578	48%	0.477	S	S	*	.	H	α-helix	trans	-63.8	-41.2	177	-73.3	165.5	-178.6	165.4	0	112	E294 S295 A301 S302	E294-K298 HydrophobicContact CG-CD 4.36Å; E294-K298 WeakPolarHBondContact O-CB 3.36Å; E294-K298 VanDerWaalsContact O-CG 3.32Å; E294-K298 WeakPolarHBondContact O-CG 3.07Å; E294-K298 PolarHBondContact O-N 3.1Å; E294-K298 WeakPolarHBondContact OE1-CE 3.38Å; E294-K298 IonicContact OE1-NZ 2.87Å; E294-K298 PolarHBondContact OE1-NZ 2.97Å; S295-K298 PolarHBondContact O-N 3.48Å; K298-A301 PolarHBondContact O-N 3.48Å; K298-S302 PolarHBondContact O-N 2.85Å
299	L	89.1	Confident	83.8	Confident	93 Å²	93	94 Å²	94	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-45.7	174.1	-178.7	61.5	0	0	0	111.5	S295 A301 S302 L303	S295-L299 VanDerWaalsContact O-CB 3.23Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.03Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 2.88Å; L299-S302 PolarHBondContact O-N 2.83Å; L299-L303 HydrophobicContact CD1-CD1 4.11Å; L299-L303 HydrophobicContact CD1-CG 4.21Å; L299-L303 HydrophobicContact CG-CD1 3.95Å; L299-L303 HydrophobicContact CG-CG 4.46Å; L299-L303 WeakPolarHBondContact O-CB 3.5Å; L299-L303 VanDerWaalsContact O-CG 3.31Å; L299-L303 WeakPolarHBondContact O-CG 3.3Å; L299-L303 PolarHBondContact O-N 2.82Å
300	K	90.7	Very high	85.4	Confident	132 Å²	132	96.4 Å²	96.4	57%	0.574	48%	0.482	S	S	*	.	H	α-helix	trans	-58.5	-43.6	173.8	178.5	178.6	174.3	179.6	0	111.6	L296 R297 L303 Q304	L296-K300 VanDerWaalsContact O-CB 3.27Å; L296-K300 WeakPolarHBondContact O-CB 3.4Å; L296-K300 PolarHBondContact O-N 3.48Å; R297-K300 PolarHBondContact O-N 3.27Å; K300-L303 PolarHBondContact O-N 3.29Å; K300-Q304 HydrophobicContact CG-CG 4.48Å; K300-Q304 WeakPolarHBondContact O-CB 3.4Å; K300-Q304 WeakPolarHBondContact O-CG 3.19Å; K300-Q304 PolarHBondContact O-N 3.46Å
301	A	91.6	Very high	87.1	Confident	62 Å²	62	98.8 Å²	98.8	51%	0.512	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-42.9	177.5	0	0	0	0	0	112.1	R297 K298 L299 Q304 G305	R297-A301 WeakPolarHBondContact O-CB 3.45Å; R297-A301 PolarHBondContact O-N 3.11Å; K298-A301 PolarHBondContact O-N 3.48Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 2.88Å; A301-Q304 PolarHBondContact O-N 3.28Å; A301-G305 PolarHBondContact O-N 3.32Å
302	S	93.1	Very high	88.6	Confident	63 Å²	63	95.6 Å²	95.6	44%	0.441	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-54	172.7	-166.6	0	0	0	0	110.9	K298 L299 Q304 G305 D306	K298-S302 PolarHBondContact O-N 2.85Å; L299-S302 PolarHBondContact O-N 2.83Å; S302-Q304 VanDerWaalsContact C-N 3.3Å; S302-Q304 PolarHBondContact O-N 3.05Å; S302-G305 CarbonylContact O-C 3.54Å; S302-G305 WeakPolarHBondContact O-CA 3.34Å; S302-G305 PolarHBondContact O-N 3.4Å; S302-D306 VanDerWaalsContact O-CG 3.31Å; S302-D306 PolarHBondContact O-N 3.48Å; S302-D306 PolarHBondContact OG-OD2 3.42Å
303	L	93.6	Very high	89.8	Confident	97 Å²	97	95.5 Å²	95.5	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-35.2	-178.4	-69.1	172.3	0	0	0	112.7	L299 K300 D306 V307	L299-L303 HydrophobicContact CD1-CD1 4.11Å; L299-L303 HydrophobicContact CD1-CG 4.21Å; L299-L303 HydrophobicContact CG-CD1 3.95Å; L299-L303 HydrophobicContact CG-CG 4.46Å; L299-L303 WeakPolarHBondContact O-CB 3.5Å; L299-L303 VanDerWaalsContact O-CG 3.31Å; L299-L303 WeakPolarHBondContact O-CG 3.3Å; L299-L303 PolarHBondContact O-N 2.82Å; K300-L303 PolarHBondContact O-N 3.29Å; L303-D306 PolarHBondContact O-N 2.93Å; L303-V307 WeakPolarHBondContact O-CB 3.47Å; L303-V307 VanDerWaalsContact O-CG2 3.27Å; L303-V307 WeakPolarHBondContact O-CG2 3.42Å; L303-V307 PolarHBondContact O-N 3.29Å
304	Q	94.3	Very high	90.9	Very high	103 Å²	103	96.1 Å²	96.1	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-66.8	-40.4	171.7	-76.7	-170.9	-106.7	0	0	112.2	K300 A301 S302 D306 Q308	K300-Q304 HydrophobicContact CG-CG 4.48Å; K300-Q304 WeakPolarHBondContact O-CB 3.4Å; K300-Q304 WeakPolarHBondContact O-CG 3.19Å; K300-Q304 PolarHBondContact O-N 3.46Å; A301-Q304 PolarHBondContact O-N 3.28Å; S302-Q304 VanDerWaalsContact C-N 3.3Å; S302-Q304 PolarHBondContact O-N 3.05Å; Q304-D306 VanDerWaalsContact C-N 3.34Å; Q304-Q308 WeakPolarHBondContact O-CG 3.34Å; Q304-Q308 PolarHBondContact O-N 3.01Å
305	G	93.9	Very high	91.6	Very high	23 Å²	23	95.9 Å²	95.9	24%	0.237	49%	0.488	C	S	.	.	H	α-helix	trans	-64.4	-37.4	172.9	0	0	0	0	0	112.7	A301 S302 Q308 K309	A301-G305 PolarHBondContact O-N 3.32Å; S302-G305 CarbonylContact O-C 3.54Å; S302-G305 WeakPolarHBondContact O-CA 3.34Å; S302-G305 PolarHBondContact O-N 3.4Å; G305-Q308 PolarHBondContact O-N 2.67Å; G305-K309 VanDerWaalsContact O-CG 3.32Å; G305-K309 WeakPolarHBondContact O-CG 3.3Å; G305-K309 PolarHBondContact O-N 2.74Å
306	D	93.5	Very high	92.3	Very high	42 Å²	42	98.1 Å²	98.1	23%	0.225	50%	0.496	C	S	.	.	H	α-helix	trans	-71.5	-40.9	176.9	-63.2	-42.8	0	0	0	111.6	S302 L303 Q304 Q308 K309 Y310	S302-D306 VanDerWaalsContact O-CG 3.31Å; S302-D306 PolarHBondContact O-N 3.48Å; S302-D306 PolarHBondContact OG-OD2 3.42Å; L303-D306 PolarHBondContact O-N 2.93Å; Q304-D306 VanDerWaalsContact C-N 3.34Å; D306-Q308 VanDerWaalsContact C-N 3.32Å; D306-Q308 PolarHBondContact O-N 3.28Å; D306-K309 WeakPolarHBondContact O-CB 3.36Å; D306-K309 PolarHBondContact O-N 2.94Å; D306-K309 IonicContact OD1-NZ 3.51Å; D306-K309 PolarHBondContact OD1-NZ 3.43Å; D306-Y310 HydrophobicContact CB-CE2 4.32Å; D306-Y310 WeakPolarHBondContact O-CD2 3.21Å; D306-Y310 PolarHBondContact O-N 3.27Å
307	V	95	Very high	92.9	Very high	78 Å²	78	98.4 Å²	98.4	47%	0.473	50%	0.497	S	S	.	.	H	α-helix	trans	-57.6	-43.2	169.6	166	0	0	0	0	111.3	L303 Y310 Q311	L303-V307 WeakPolarHBondContact O-CB 3.47Å; L303-V307 VanDerWaalsContact O-CG2 3.27Å; L303-V307 WeakPolarHBondContact O-CG2 3.42Å; L303-V307 PolarHBondContact O-N 3.29Å; V307-Y310 PolarHBondContact O-N 3.49Å; V307-Q311 HydrophobicContact CG1-CG 4.36Å; V307-Q311 WeakPolarHBondContact O-CB 3.48Å; V307-Q311 WeakPolarHBondContact O-CG 3.37Å; V307-Q311 PolarHBondContact O-N 2.61Å
308	Q	94.2	Very high	93.4	Very high	128 Å²	128	97.1 Å²	97.1	60%	0.598	50%	0.498	S	S	*	.	H	α-helix	trans	-63.4	-40.6	175.8	-75.1	175.1	-8.7	0	0	112.5	Q304 G305 D306 Q311 A312	Q304-Q308 WeakPolarHBondContact O-CG 3.34Å; Q304-Q308 PolarHBondContact O-N 3.01Å; G305-Q308 PolarHBondContact O-N 2.67Å; D306-Q308 VanDerWaalsContact C-N 3.32Å; D306-Q308 PolarHBondContact O-N 3.28Å; Q308-Q311 PolarHBondContact O-N 2.76Å; Q308-A312 WeakPolarHBondContact O-CB 3.29Å; Q308-A312 PolarHBondContact O-N 2.73Å
309	K	94.3	Very high	93.7	Very high	132 Å²	132	93.4 Å²	93.4	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-61	-45.8	172.8	-66.8	165.6	-155.9	165.3	0	111.4	G305 D306 A312 Y313	G305-K309 VanDerWaalsContact O-CG 3.32Å; G305-K309 WeakPolarHBondContact O-CG 3.3Å; G305-K309 PolarHBondContact O-N 2.74Å; D306-K309 WeakPolarHBondContact O-CB 3.36Å; D306-K309 PolarHBondContact O-N 2.94Å; D306-K309 IonicContact OD1-NZ 3.51Å; D306-K309 PolarHBondContact OD1-NZ 3.43Å; K309-A312 PolarHBondContact O-N 3.05Å; K309-Y313 VanDerWaalsContact O-CB 3.31Å; K309-Y313 WeakPolarHBondContact O-CB 3.32Å; K309-Y313 PolarHBondContact O-N 3.03Å
310	Y	94.1	Very high	94	Very high	159 Å²	159	93.6 Å²	93.6	62%	0.624	49%	0.486	S	S	*	.	H	α-helix	trans	-67.6	-38.2	179.8	-70.5	-56.1	0	0	0	112.4	D306 V307 Y313 M314	D306-Y310 HydrophobicContact CB-CE2 4.32Å; D306-Y310 WeakPolarHBondContact O-CD2 3.21Å; D306-Y310 PolarHBondContact O-N 3.27Å; V307-Y310 PolarHBondContact O-N 3.49Å; Y310-Y313 PolarHBondContact O-N 3.36Å; Y310-M314 WeakPolarHBondContact O-CB 3.34Å; Y310-M314 WeakPolarHBondContact O-CG 3.3Å; Y310-M314 PolarHBondContact O-N 3.28Å
311	Q	94.5	Very high	94.2	Very high	122 Å²	122	90 Å²	90	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-64.1	-43.6	173	-74.5	179.3	-46.2	0	0	112.1	V307 Q308 Y313 M314 S315	V307-Q311 HydrophobicContact CG1-CG 4.36Å; V307-Q311 WeakPolarHBondContact O-CB 3.48Å; V307-Q311 WeakPolarHBondContact O-CG 3.37Å; V307-Q311 PolarHBondContact O-N 2.61Å; Q308-Q311 PolarHBondContact O-N 2.76Å; Q311-Y313 VanDerWaalsContact C-N 3.33Å; Q311-Y313 PolarHBondContact O-N 3.33Å; Q311-M314 PolarHBondContact O-N 2.81Å; Q311-S315 WeakPolarHBondContact O-CB 3.28Å; Q311-S315 PolarHBondContact O-N 2.87Å
312	A	93.4	Very high	94.4	Very high	63 Å²	63	89.9 Å²	89.9	52%	0.521	48%	0.477	S	S	.	.	H	α-helix	trans	-63.8	-38.6	174.5	0	0	0	0	0	112.1	Q308 K309 N316	Q308-A312 WeakPolarHBondContact O-CB 3.29Å; Q308-A312 PolarHBondContact O-N 2.73Å; K309-A312 PolarHBondContact O-N 3.05Å; A312-N316 VanDerWaalsContact O-CB 3.32Å; A312-N316 WeakPolarHBondContact O-CB 3.15Å; A312-N316 PolarHBondContact O-N 3.35Å
313	Y	94.8	Very high	94.4	Very high	137 Å²	137	90.5 Å²	90.5	54%	0.537	47%	0.474	S	S	.	.	H	α-helix	trans	-67.5	-43.6	175.7	-179.1	-108.9	0	0	0	112.4	K309 Y310 Q311 N316 L317	K309-Y313 VanDerWaalsContact O-CB 3.31Å; K309-Y313 WeakPolarHBondContact O-CB 3.32Å; K309-Y313 PolarHBondContact O-N 3.03Å; Y310-Y313 PolarHBondContact O-N 3.36Å; Q311-Y313 VanDerWaalsContact C-N 3.33Å; Q311-Y313 PolarHBondContact O-N 3.33Å; Y313-N316 PolarHBondContact O-N 3.19Å; Y313-L317 HydrophobicContact CD1-CD1 4.01Å; Y313-L317 HydrophobicContact CE1-CD1 3.44Å; Y313-L317 VanDerWaalsContact CE1-CD1 3.44Å; Y313-L317 HydrophobicContact CE1-CG 4.12Å; Y313-L317 HydrophobicContact CE2-CG 4.37Å; Y313-L317 WeakPolarHBondContact O-CG 3.47Å; Y313-L317 PolarHBondContact O-N 3.1Å
314	M	94.1	Very high	94.5	Very high	106 Å²	106	90 Å²	90	52%	0.522	47%	0.472	S	S	.	.	H	α-helix	trans	-60.5	-49.6	173.6	-76.7	-179.2	65.4	0	0	111.4	Y310 Q311 N316 L317 E318	Y310-M314 WeakPolarHBondContact O-CB 3.34Å; Y310-M314 WeakPolarHBondContact O-CG 3.3Å; Y310-M314 PolarHBondContact O-N 3.28Å; Q311-M314 PolarHBondContact O-N 2.81Å; M314-N316 VanDerWaalsContact C-N 3.26Å; M314-N316 PolarHBondContact O-N 2.89Å; M314-L317 CarbonylContact O-C 3.51Å; M314-L317 WeakPolarHBondContact O-CA 3.41Å; M314-L317 WeakPolarHBondContact O-CB 3.45Å; M314-L317 PolarHBondContact O-N 2.88Å; M314-E318 WeakPolarHBondContact O-CB 3.42Å; M314-E318 VanDerWaalsContact O-CG 3.31Å; M314-E318 WeakPolarHBondContact O-CG 3.39Å; M314-E318 PolarHBondContact O-N 2.88Å
315	S	94.9	Very high	94.5	Very high	69 Å²	69	89 Å²	89	48%	0.483	47%	0.469	S	S	.	.	H	α-helix	trans	-61.4	-34.9	178.3	-173.4	0	0	0	0	112.4	Q311 S319	Q311-S315 WeakPolarHBondContact O-CB 3.28Å; Q311-S315 PolarHBondContact O-N 2.87Å; S315-S319 WeakPolarHBondContact O-CB 3.46Å; S315-S319 PolarHBondContact O-N 3.46Å
316	N	94.8	Very high	94.5	Very high	99 Å²	99	94.8 Å²	94.8	53%	0.529	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-44.4	172.2	-173.5	45.8	0	0	0	111.8	A312 Y313 M314 S319 H320	A312-N316 VanDerWaalsContact O-CB 3.32Å; A312-N316 WeakPolarHBondContact O-CB 3.15Å; A312-N316 PolarHBondContact O-N 3.35Å; Y313-N316 PolarHBondContact O-N 3.19Å; M314-N316 VanDerWaalsContact C-N 3.26Å; M314-N316 PolarHBondContact O-N 2.89Å; N316-S319 PolarHBondContact O-N 2.83Å; N316-S319 PolarHBondContact O-OG 3.35Å; N316-H320 WeakPolarHBondContact O-CB 3.49Å; N316-H320 PolarHBondContact O-N 3.26Å
317	L	95	Very high	94.5	Very high	81 Å²	81	98.9 Å²	98.9	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-41.8	174.6	-74.1	-179.4	0	0	0	112.7	Y313 M314 H320 S321	Y313-L317 HydrophobicContact CD1-CD1 4.01Å; Y313-L317 HydrophobicContact CE1-CD1 3.44Å; Y313-L317 VanDerWaalsContact CE1-CD1 3.44Å; Y313-L317 HydrophobicContact CE1-CG 4.12Å; Y313-L317 HydrophobicContact CE2-CG 4.37Å; Y313-L317 WeakPolarHBondContact O-CG 3.47Å; Y313-L317 PolarHBondContact O-N 3.1Å; M314-L317 CarbonylContact O-C 3.51Å; M314-L317 WeakPolarHBondContact O-CA 3.41Å; M314-L317 WeakPolarHBondContact O-CB 3.45Å; M314-L317 PolarHBondContact O-N 2.88Å; L317-H320 CarbonylContact O-C 3.59Å; L317-H320 PolarHBondContact O-N 3.28Å; L317-S321 PolarHBondContact O-N 2.88Å
318	E	95.3	Very high	94.5	Very high	118 Å²	118	99.8 Å²	99.8	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-60.9	-44.9	175.1	-72.1	163.7	180	0	0	110.6	M314 H320 S321 A322	M314-E318 WeakPolarHBondContact O-CB 3.42Å; M314-E318 VanDerWaalsContact O-CG 3.31Å; M314-E318 WeakPolarHBondContact O-CG 3.39Å; M314-E318 PolarHBondContact O-N 2.88Å; E318-H320 VanDerWaalsContact C-N 3.3Å; E318-H320 PolarHBondContact O-N 3.15Å; E318-S321 PolarHBondContact O-N 3.18Å; E318-A322 PolarHBondContact O-N 3.44Å
319	S	94.5	Very high	94.5	Very high	54 Å²	54	98 Å²	98	38%	0.378	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-35.8	174.5	82.5	0	0	0	0	112.3	S315 N316 I323	S315-S319 WeakPolarHBondContact O-CB 3.46Å; S315-S319 PolarHBondContact O-N 3.46Å; N316-S319 PolarHBondContact O-N 2.83Å; N316-S319 PolarHBondContact O-OG 3.35Å; S319-I323 WeakPolarHBondContact O-CD1 3.32Å; S319-I323 VanDerWaalsContact O-CG1 3.25Å; S319-I323 WeakPolarHBondContact O-CG1 3.45Å; S319-I323 PolarHBondContact O-N 2.92Å; S319-I323 VanDerWaalsContact O-N 3.09Å
320	H	94.3	Very high	94.5	Very high	97 Å²	97	93.4 Å²	93.4	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-72.3	-38.7	177.2	-165.5	53.3	0	0	0	112.1	N316 L317 E318 I323 L324	N316-H320 WeakPolarHBondContact O-CB 3.49Å; N316-H320 PolarHBondContact O-N 3.26Å; L317-H320 CarbonylContact O-C 3.59Å; L317-H320 PolarHBondContact O-N 3.28Å; E318-H320 VanDerWaalsContact C-N 3.3Å; E318-H320 PolarHBondContact O-N 3.15Å; H320-I323 PolarHBondContact O-N 2.91Å; H320-L324 WeakPolarHBondContact O-CG 3.43Å; H320-L324 PolarHBondContact O-N 2.94Å
321	S	95.1	Very high	94.5	Very high	58 Å²	58	91.1 Å²	91.1	41%	0.406	49%	0.491	S	S	.	.	H	α-helix	trans	-57.5	-54.1	170.1	-166.5	0	0	0	0	109.8	L317 E318 I323 L324 D325	L317-S321 PolarHBondContact O-N 2.88Å; E318-S321 PolarHBondContact O-N 3.18Å; S321-I323 PolarHBondContact O-N 2.76Å; S321-I323 VanDerWaalsContact O-N 3.13Å; S321-L324 CarbonylContact O-C 3.59Å; S321-L324 WeakPolarHBondContact O-CA 3.49Å; S321-L324 WeakPolarHBondContact O-CB 3.35Å; S321-L324 PolarHBondContact O-N 3.02Å; S321-D325 WeakPolarHBondContact O-CB 3.2Å; S321-D325 VanDerWaalsContact O-CG 3.25Å; S321-D325 PolarHBondContact O-N 2.84Å; S321-D325 PolarHBondContact OG-OD2 3.42Å
322	A	95.1	Very high	94.5	Very high	58 Å²	58	89.3 Å²	89.3	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-56.3	-35.9	-180	0	0	0	0	0	113.3	E318 Q326	E318-A322 PolarHBondContact O-N 3.44Å; A322-Q326 VanDerWaalsContact O-CB 3.3Å; A322-Q326 WeakPolarHBondContact O-CB 3.48Å; A322-Q326 PolarHBondContact O-N 2.93Å
323	I	94.8	Very high	94.5	Very high	76 Å²	76	92.6 Å²	92.6	39%	0.39	49%	0.489	S	S	.	.	H	α-helix	trans	-69.4	-37.3	173.3	-70.4	164.3	0	0	0	112.1	S319 H320 S321 K327	S319-I323 WeakPolarHBondContact O-CD1 3.32Å; S319-I323 VanDerWaalsContact O-CG1 3.25Å; S319-I323 WeakPolarHBondContact O-CG1 3.45Å; S319-I323 PolarHBondContact O-N 2.92Å; S319-I323 VanDerWaalsContact O-N 3.09Å; H320-I323 PolarHBondContact O-N 2.91Å; S321-I323 PolarHBondContact O-N 2.76Å; S321-I323 VanDerWaalsContact O-N 3.13Å; I323-K327 HydrophobicContact CG2-CD 4.31Å; I323-K327 WeakPolarHBondContact O-CB 3.45Å; I323-K327 VanDerWaalsContact O-CG 3.24Å; I323-K327 WeakPolarHBondContact O-CG 3.34Å; I323-K327 PolarHBondContact O-N 2.9Å; I323-K327 VanDerWaalsContact O-N 3.1Å
324	L	94.1	Very high	94.5	Very high	88 Å²	88	90 Å²	90	46%	0.461	48%	0.482	S	S	.	.	H	α-helix	trans	-70.9	-42.1	175	-69.9	170.3	0	0	0	111.5	H320 S321 K327 L328	H320-L324 WeakPolarHBondContact O-CG 3.43Å; H320-L324 PolarHBondContact O-N 2.94Å; S321-L324 CarbonylContact O-C 3.59Å; S321-L324 WeakPolarHBondContact O-CA 3.49Å; S321-L324 WeakPolarHBondContact O-CB 3.35Å; S321-L324 PolarHBondContact O-N 3.02Å; L324-K327 PolarHBondContact O-N 2.9Å; L324-L328 WeakPolarHBondContact O-CB 3.19Å; L324-L328 PolarHBondContact O-N 3.47Å
325	D	94.6	Very high	94.5	Very high	80 Å²	80	88.9 Å²	88.9	43%	0.428	48%	0.477	S	S	.	.	H	α-helix	trans	-62.3	-43.9	175.7	-63.9	-48.1	0	0	0	110.7	S321 K327 L328 N329	S321-D325 WeakPolarHBondContact O-CB 3.2Å; S321-D325 VanDerWaalsContact O-CG 3.25Å; S321-D325 PolarHBondContact O-N 2.84Å; S321-D325 PolarHBondContact OG-OD2 3.42Å; D325-K327 PolarHBondContact O-N 3.41Å; D325-L328 PolarHBondContact O-N 3.48Å; D325-N329 WeakPolarHBondContact O-CB 3.37Å; D325-N329 VanDerWaalsContact O-CG 3.27Å; D325-N329 PolarHBondContact O-N 3.38Å; D325-N329 PolarHBondContact O-ND2 2.91Å
326	Q	94.6	Very high	94.4	Very high	145 Å²	145	88.2 Å²	88.2	68%	0.678	48%	0.476	S	S	*	.	H	α-helix	trans	-61.8	-42	173.2	-171.9	-177.7	15.9	0	0	112.2	A322 G330	A322-Q326 VanDerWaalsContact O-CB 3.3Å; A322-Q326 WeakPolarHBondContact O-CB 3.48Å; A322-Q326 PolarHBondContact O-N 2.93Å; Q326-G330 PolarHBondContact O-N 2.79Å
327	K	94.1	Very high	94.4	Very high	129 Å²	129	89.5 Å²	89.5	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-66.1	-39.7	175.9	-77.1	170.9	-179.5	-179.7	0	112.4	I323 L324 D325 G330 L331	I323-K327 HydrophobicContact CG2-CD 4.31Å; I323-K327 WeakPolarHBondContact O-CB 3.45Å; I323-K327 VanDerWaalsContact O-CG 3.24Å; I323-K327 WeakPolarHBondContact O-CG 3.34Å; I323-K327 PolarHBondContact O-N 2.9Å; I323-K327 VanDerWaalsContact O-N 3.1Å; L324-K327 PolarHBondContact O-N 2.9Å; D325-K327 PolarHBondContact O-N 3.41Å; K327-G330 PolarHBondContact O-N 3.32Å; K327-L331 WeakPolarHBondContact O-CB 3.35Å; K327-L331 PolarHBondContact O-N 3.34Å
328	L	94.9	Very high	94.3	Very high	96 Å²	96	88.7 Å²	88.7	50%	0.503	47%	0.471	S	S	.	.	H	α-helix	trans	-66.8	-41.8	178.7	-178.8	141.5	0	0	0	110.9	L324 D325 L331 N332	L324-L328 WeakPolarHBondContact O-CB 3.19Å; L324-L328 PolarHBondContact O-N 3.47Å; D325-L328 PolarHBondContact O-N 3.48Å; L328-L331 PolarHBondContact O-N 2.85Å; L328-N332 WeakPolarHBondContact CD2-ND2 3.35Å; L328-N332 PolarHBondContact O-N 3.44Å; L328-N332 PolarHBondContact O-ND2 3.49Å
329	N	94.4	Very high	94.3	Very high	91 Å²	91	89.1 Å²	89.1	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-61.5	-47	172.2	-69.6	-23.6	0	0	0	111.7	D325 L331 N332 E333	D325-N329 WeakPolarHBondContact O-CB 3.37Å; D325-N329 VanDerWaalsContact O-CG 3.27Å; D325-N329 PolarHBondContact O-N 3.38Å; D325-N329 PolarHBondContact O-ND2 2.91Å; N329-L331 VanDerWaalsContact C-N 3.3Å; N329-L331 PolarHBondContact O-N 3.25Å; N329-N332 PolarHBondContact O-N 2.88Å; N329-N332 VanDerWaalsContact O-N 3.13Å; N329-E333 WeakPolarHBondContact O-CG 3.41Å; N329-E333 PolarHBondContact O-N 3.18Å
330	G	93.8	Very high	94.3	Very high	35 Å²	35	92.3 Å²	92.3	36%	0.361	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-33.7	175.2	0	0	0	0	0	113.8	Q326 K327 E334	Q326-G330 PolarHBondContact O-N 2.79Å; K327-G330 PolarHBondContact O-N 3.32Å; G330-E334 PolarHBondContact O-N 2.87Å
331	L	93.7	Very high	94.2	Very high	112 Å²	112	92.9 Å²	92.9	59%	0.586	49%	0.489	S	S	*	.	H	α-helix	trans	-69.1	-39.9	172.1	-117.9	72.5	0	0	0	112	K327 L328 N329 E333 E334 I335	K327-L331 WeakPolarHBondContact O-CB 3.35Å; K327-L331 PolarHBondContact O-N 3.34Å; L328-L331 PolarHBondContact O-N 2.85Å; N329-L331 VanDerWaalsContact C-N 3.3Å; N329-L331 PolarHBondContact O-N 3.25Å; L331-E333 VanDerWaalsContact C-N 3.34Å; L331-E334 PolarHBondContact O-N 3.11Å; L331-I335 WeakPolarHBondContact O-CB 3.32Å; L331-I335 WeakPolarHBondContact O-CD1 3.4Å; L331-I335 VanDerWaalsContact O-CG1 3.24Å; L331-I335 WeakPolarHBondContact O-CG1 3.46Å; L331-I335 PolarHBondContact O-N 3.41Å
332	N	94.6	Very high	94	Very high	84 Å²	84	93.1 Å²	93.1	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-37.1	176.3	-68	-23.8	0	0	0	111.6	L328 N329 I335 A336	L328-N332 WeakPolarHBondContact CD2-ND2 3.35Å; L328-N332 PolarHBondContact O-N 3.44Å; L328-N332 PolarHBondContact O-ND2 3.49Å; N329-N332 PolarHBondContact O-N 2.88Å; N329-N332 VanDerWaalsContact O-N 3.13Å; N332-I335 PolarHBondContact O-N 3.32Å; N332-A336 WeakPolarHBondContact O-CB 3.34Å; N332-A336 PolarHBondContact O-N 2.84Å
333	E	94.3	Very high	94	Very high	131 Å²	131	93.9 Å²	93.9	61%	0.612	48%	0.483	S	S	*	.	H	α-helix	trans	-65.7	-37.3	172.3	-72.1	174.7	-168.1	0	0	112.5	N329 L331 R337	N329-E333 WeakPolarHBondContact O-CG 3.41Å; N329-E333 PolarHBondContact O-N 3.18Å; L331-E333 VanDerWaalsContact C-N 3.34Å; E333-R337 WeakPolarHBondContact O-CB 3.4Å; E333-R337 PolarHBondContact O-N 2.79Å; E333-R337 VanDerWaalsContact O-N 3.12Å
334	E	93.5	Very high	93.9	Very high	84 Å²	84	93.8 Å²	93.8	39%	0.393	49%	0.486	S	S	.	.	H	α-helix	trans	-67.1	-46.2	172.2	-170.3	68	-98.2	0	0	111.5	G330 L331 A336 R337 V338	G330-E334 PolarHBondContact O-N 2.87Å; L331-E334 PolarHBondContact O-N 3.11Å; E334-A336 PolarHBondContact O-N 3.36Å; E334-R337 WeakPolarHBondContact O-CB 3.41Å; E334-R337 PolarHBondContact O-N 3.4Å; E334-R337 IonicContact OE1-CZ 3.51Å; E334-R337 VanDerWaalsContact OE1-CZ 3.24Å; E334-R337 IonicContact OE1-NE 3.47Å; E334-R337 PolarHBondContact OE1-NE 3.39Å; E334-R337 IonicContact OE1-NH2 2.61Å; E334-R337 PolarHBondContact OE1-NH2 3.28Å; E334-R337 IonicContact OE2-CZ 3.1Å; E334-R337 IonicContact OE2-NE 3.51Å; E334-R337 IonicContact OE2-NH2 2.67Å; E334-R337 PolarHBondContact OE2-NH2 3.37Å; E334-V338 HydrophobicContact CG-CG2 4.43Å; E334-V338 WeakPolarHBondContact O-CG2 3.5Å; E334-V338 PolarHBondContact O-N 3.34Å
335	I	93.8	Very high	93.8	Very high	82 Å²	82	93.6 Å²	93.6	42%	0.421	49%	0.485	S	S	.	.	H	α-helix	trans	-58.8	-49.4	177.3	-70.7	162.5	0	0	0	110	L331 N332 R337 V338 E339	L331-I335 WeakPolarHBondContact O-CB 3.32Å; L331-I335 WeakPolarHBondContact O-CD1 3.4Å; L331-I335 VanDerWaalsContact O-CG1 3.24Å; L331-I335 WeakPolarHBondContact O-CG1 3.46Å; L331-I335 PolarHBondContact O-N 3.41Å; N332-I335 PolarHBondContact O-N 3.32Å; I335-R337 VanDerWaalsContact C-N 3.29Å; I335-R337 PolarHBondContact O-N 2.99Å; I335-V338 PolarHBondContact O-N 3.09Å; I335-E339 HydrophobicContact CG2-CG 4.18Å; I335-E339 WeakPolarHBondContact O-CB 3.47Å; I335-E339 VanDerWaalsContact O-CG 3.32Å; I335-E339 WeakPolarHBondContact O-CG 3.48Å; I335-E339 PolarHBondContact O-N 2.95Å
336	A	94.2	Very high	93.7	Very high	54 Å²	54	95.2 Å²	95.2	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-34.4	178.3	0	0	0	0	0	113	N332 E334 L340	N332-A336 WeakPolarHBondContact O-CB 3.34Å; N332-A336 PolarHBondContact O-N 2.84Å; E334-A336 PolarHBondContact O-N 3.36Å; A336-L340 WeakPolarHBondContact O-CB 3.33Å; A336-L340 PolarHBondContact O-N 2.73Å; A336-L340 VanDerWaalsContact O-N 3.16Å
337	R	94.6	Very high	93.6	Very high	126 Å²	126	93.5 Å²	93.5	48%	0.475	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-48.5	172.3	163.8	168.1	54	-107.7	5.4	111.8	E333 E334 I335 L340 E341	E333-R337 WeakPolarHBondContact O-CB 3.4Å; E333-R337 PolarHBondContact O-N 2.79Å; E333-R337 VanDerWaalsContact O-N 3.12Å; E334-R337 WeakPolarHBondContact O-CB 3.41Å; E334-R337 PolarHBondContact O-N 3.4Å; E334-R337 IonicContact OE1-CZ 3.51Å; E334-R337 VanDerWaalsContact OE1-CZ 3.24Å; E334-R337 IonicContact OE1-NE 3.47Å; E334-R337 PolarHBondContact OE1-NE 3.39Å; E334-R337 IonicContact OE1-NH2 2.61Å; E334-R337 PolarHBondContact OE1-NH2 3.28Å; E334-R337 IonicContact OE2-CZ 3.1Å; E334-R337 IonicContact OE2-NE 3.51Å; E334-R337 IonicContact OE2-NH2 2.67Å; E334-R337 PolarHBondContact OE2-NH2 3.37Å; I335-R337 VanDerWaalsContact C-N 3.29Å; I335-R337 PolarHBondContact O-N 2.99Å; R337-L340 PolarHBondContact O-N 3.15Å; R337-E341 PolarHBondContact O-N 3.02Å
338	V	93.3	Very high	93.5	Very high	64 Å²	64	91 Å²	91	39%	0.388	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-35.5	-178.8	172.7	0	0	0	0	111.3	E334 I335 E341 C342	E334-V338 HydrophobicContact CG-CG2 4.43Å; E334-V338 WeakPolarHBondContact O-CG2 3.5Å; E334-V338 PolarHBondContact O-N 3.34Å; I335-V338 PolarHBondContact O-N 3.09Å; V338-E341 PolarHBondContact O-N 3.24Å; V338-C342 VanDerWaalsContact O-CB 3.31Å; V338-C342 WeakPolarHBondContact O-CB 3.43Å; V338-C342 PolarHBondContact O-N 3.27Å; V338-C342 PolarHBondContact O-SG 3.09Å
339	E	95.1	Very high	93.3	Very high	128 Å²	128	91 Å²	91	60%	0.598	47%	0.471	S	S	*	.	H	α-helix	trans	-63.2	-43.4	172.4	-75.5	-179.5	155.6	0	0	111.6	I335 C342 E343	I335-E339 HydrophobicContact CG2-CG 4.18Å; I335-E339 WeakPolarHBondContact O-CB 3.47Å; I335-E339 VanDerWaalsContact O-CG 3.32Å; I335-E339 WeakPolarHBondContact O-CG 3.48Å; I335-E339 PolarHBondContact O-N 2.95Å; E339-C342 PolarHBondContact O-N 3.44Å; E339-E343 WeakPolarHBondContact O-CB 3.41Å; E339-E343 PolarHBondContact O-N 2.78Å
340	L	94.3	Very high	93.1	Very high	120 Å²	120	90.6 Å²	90.6	63%	0.628	47%	0.472	S	S	*	.	H	α-helix	trans	-64.1	-42.4	174.8	-177.6	65.2	0	0	0	111.8	A336 R337 E343 T344	A336-L340 WeakPolarHBondContact O-CB 3.33Å; A336-L340 PolarHBondContact O-N 2.73Å; A336-L340 VanDerWaalsContact O-N 3.16Å; R337-L340 PolarHBondContact O-N 3.15Å; L340-E343 PolarHBondContact O-N 2.78Å; L340-T344 PolarHBondContact O-N 3.18Å; L340-T344 PolarHBondContact O-OG1 2.73Å
341	E	92.3	Very high	93	Very high	110 Å²	110	95 Å²	95	51%	0.514	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-43	175.4	-176.1	172.4	-161.2	0	0	111.9	R337 V338 E343 T344 I345	R337-E341 PolarHBondContact O-N 3.02Å; V338-E341 PolarHBondContact O-N 3.24Å; E341-E343 PolarHBondContact O-N 2.86Å; E341-T344 PolarHBondContact O-N 3.47Å; E341-T344 PolarHBondContact O-OG1 3.44Å; E341-I345 HydrophobicContact CG-CD1 3.83Å; E341-I345 HydrophobicContact CG-CG1 4.47Å; E341-I345 WeakPolarHBondContact O-CB 3.4Å; E341-I345 VanDerWaalsContact O-CG1 3.24Å; E341-I345 WeakPolarHBondContact O-CG1 3.38Å; E341-I345 PolarHBondContact O-N 3.46Å
342	C	91.3	Very high	92.7	Very high	62 Å²	62	93 Å²	93	42%	0.419	47%	0.467	S	S	.	.	H	α-helix	trans	-60.8	-34.2	172.9	-75.5	0	0	0	0	112.2	V338 E339 K346	V338-C342 VanDerWaalsContact O-CB 3.31Å; V338-C342 WeakPolarHBondContact O-CB 3.43Å; V338-C342 PolarHBondContact O-N 3.27Å; V338-C342 PolarHBondContact O-SG 3.09Å; E339-C342 PolarHBondContact O-N 3.44Å; C342-K346 WeakPolarHBondContact O-CB 3.35Å; C342-K346 VanDerWaalsContact O-CE 3.26Å; C342-K346 WeakPolarHBondContact O-CE 3.28Å; C342-K346 WeakPolarHBondContact O-CG 3.47Å; C342-K346 PolarHBondContact O-N 3.18Å
343	E	93.8	Very high	92.3	Very high	75 Å²	75	93.5 Å²	93.5	35%	0.35	47%	0.467	S	S	.	.	H	α-helix	trans	-74.4	-40.9	177.4	-172.3	51.3	-143	0	0	112.4	E339 L340 E341 I345 K346 Q347	E339-E343 WeakPolarHBondContact O-CB 3.41Å; E339-E343 PolarHBondContact O-N 2.78Å; L340-E343 PolarHBondContact O-N 2.78Å; E341-E343 PolarHBondContact O-N 2.86Å; E343-I345 VanDerWaalsContact C-N 3.34Å; E343-I345 PolarHBondContact O-N 2.8Å; E343-K346 WeakPolarHBondContact O-CB 3.44Å; E343-K346 PolarHBondContact O-N 2.99Å; E343-K346 WeakPolarHBondContact OE2-CE 3.41Å; E343-K346 IonicContact OE2-NZ 2.61Å; E343-K346 PolarHBondContact OE2-NZ 3.01Å; E343-Q347 WeakPolarHBondContact O-CG 3.35Å; E343-Q347 PolarHBondContact O-N 3.04Å; E343-Q347 PolarHBondContact OE1-NE2 3.46Å
344	T	93.4	Very high	92	Very high	74 Å²	74	91.8 Å²	91.8	45%	0.454	46%	0.462	S	S	.	.	H	α-helix	trans	-65.8	-36.3	171.7	60	0	0	0	0	112	L340 E341 Q347 E348	L340-T344 PolarHBondContact O-N 3.18Å; L340-T344 PolarHBondContact O-OG1 2.73Å; E341-T344 PolarHBondContact O-N 3.47Å; E341-T344 PolarHBondContact O-OG1 3.44Å; T344-Q347 PolarHBondContact O-N 2.68Å; T344-E348 WeakPolarHBondContact O-CB 3.5Å; T344-E348 PolarHBondContact O-N 3.03Å
345	I	92.3	Very high	91.5	Very high	83 Å²	83	91 Å²	91	43%	0.426	46%	0.459	S	S	.	.	H	α-helix	trans	-67.4	-33.9	173.3	-69.4	170	0	0	0	112	E341 E343 N349	E341-I345 HydrophobicContact CG-CD1 3.83Å; E341-I345 HydrophobicContact CG-CG1 4.47Å; E341-I345 WeakPolarHBondContact O-CB 3.4Å; E341-I345 VanDerWaalsContact O-CG1 3.24Å; E341-I345 WeakPolarHBondContact O-CG1 3.38Å; E341-I345 PolarHBondContact O-N 3.46Å; E343-I345 VanDerWaalsContact C-N 3.34Å; E343-I345 PolarHBondContact O-N 2.8Å; I345-N349 VanDerWaalsContact O-CB 3.31Å; I345-N349 WeakPolarHBondContact O-CB 3.39Å; I345-N349 PolarHBondContact O-N 3.2Å; I345-N349 PolarHBondContact O-ND2 2.81Å; I345-N349 VanDerWaalsContact O-ND2 3.17Å
346	K	92.8	Very high	90.9	Very high	114 Å²	114	91.5 Å²	91.5	50%	0.496	46%	0.462	S	S	.	.	H	α-helix	trans	-65.7	-41.9	170.6	-87.6	177.2	-94.8	154.9	0	111.6	C342 E343 N349 T350	C342-K346 WeakPolarHBondContact O-CB 3.35Å; C342-K346 VanDerWaalsContact O-CE 3.26Å; C342-K346 WeakPolarHBondContact O-CE 3.28Å; C342-K346 WeakPolarHBondContact O-CG 3.47Å; C342-K346 PolarHBondContact O-N 3.18Å; E343-K346 WeakPolarHBondContact O-CB 3.44Å; E343-K346 PolarHBondContact O-N 2.99Å; E343-K346 WeakPolarHBondContact OE2-CE 3.41Å; E343-K346 IonicContact OE2-NZ 2.61Å; E343-K346 PolarHBondContact OE2-NZ 3.01Å; K346-N349 PolarHBondContact O-N 3.04Å; K346-T350 PolarHBondContact O-N 3.42Å; K346-T350 PolarHBondContact O-OG1 2.8Å
347	Q	92.4	Very high	90.1	Very high	109 Å²	109	94 Å²	94	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-67.4	-39.6	177.7	-70	169.6	22.2	0	0	111.5	E343 T344 T350 R351	E343-Q347 WeakPolarHBondContact O-CG 3.35Å; E343-Q347 PolarHBondContact O-N 3.04Å; E343-Q347 PolarHBondContact OE1-NE2 3.46Å; T344-Q347 PolarHBondContact O-N 2.68Å; Q347-T350 WeakPolarHBondContact CA-OG1 3.31Å; Q347-T350 PolarHBondContact O-OG1 2.92Å; Q347-T350 VanDerWaalsContact O-OG1 3.04Å; Q347-R351 WeakPolarHBondContact O-CB 3.4Å; Q347-R351 PolarHBondContact O-N 3.36Å
348	E	90.8	Very high	89.5	Confident	76 Å²	76	94 Å²	94	36%	0.355	48%	0.477	S	S	.	.	H	α-helix	trans	-69.4	-41.3	173.5	-178	58.2	-167.1	0	0	112.3	T344 T350 R351 L352	T344-E348 WeakPolarHBondContact O-CB 3.5Å; T344-E348 PolarHBondContact O-N 3.03Å; E348-T350 PolarHBondContact O-N 2.78Å; E348-R351 WeakPolarHBondContact O-CB 3.47Å; E348-R351 PolarHBondContact O-N 3.02Å; E348-R351 IonicContact OE1-CZ 3.8Å; E348-R351 IonicContact OE1-NE 2.71Å; E348-R351 PolarHBondContact OE1-NE 3.23Å; E348-R351 IonicContact OE1-NH2 2.76Å; E348-R351 PolarHBondContact OE1-NH2 2.77Å; E348-R351 IonicContact OE2-CZ 3.26Å; E348-R351 IonicContact OE2-NE 2.67Å; E348-R351 PolarHBondContact OE2-NE 2.82Å; E348-R351 IonicContact OE2-NH2 3.14Å; E348-R351 PolarHBondContact OE2-NH2 3.17Å; E348-L352 HydrophobicContact CG-CD1 3.99Å; E348-L352 HydrophobicContact CG-CG 4.35Å; E348-L352 WeakPolarHBondContact O-CB 3.31Å; E348-L352 VanDerWaalsContact O-CG 3.28Å; E348-L352 WeakPolarHBondContact O-CG 3.33Å; E348-L352 PolarHBondContact O-N 2.88Å
349	N	90.1	Very high	88.6	Confident	97 Å²	97	96 Å²	96	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-41.8	173.7	-92.2	-53.7	0	0	0	112.3	I345 K346 R351 L352 Q353	I345-N349 VanDerWaalsContact O-CB 3.31Å; I345-N349 WeakPolarHBondContact O-CB 3.39Å; I345-N349 PolarHBondContact O-N 3.2Å; I345-N349 PolarHBondContact O-ND2 2.81Å; I345-N349 VanDerWaalsContact O-ND2 3.17Å; K346-N349 PolarHBondContact O-N 3.04Å; N349-R351 VanDerWaalsContact C-N 3.35Å; N349-L352 PolarHBondContact O-N 3.17Å; N349-Q353 VanDerWaalsContact O-CB 3.31Å; N349-Q353 WeakPolarHBondContact O-CB 3.23Å; N349-Q353 PolarHBondContact O-N 3.19Å
350	T	91	Very high	87.5	Confident	83 Å²	83	98.9 Å²	98.9	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-69.5	-32.4	175.4	47.5	0	0	0	0	112	K346 Q347 E348 N354	K346-T350 PolarHBondContact O-N 3.42Å; K346-T350 PolarHBondContact O-OG1 2.8Å; Q347-T350 WeakPolarHBondContact CA-OG1 3.31Å; Q347-T350 PolarHBondContact O-OG1 2.92Å; Q347-T350 VanDerWaalsContact O-OG1 3.04Å; E348-T350 PolarHBondContact O-N 2.78Å; T350-N354 WeakPolarHBondContact O-CB 3.46Å; T350-N354 PolarHBondContact O-N 3.12Å; T350-N354 PolarHBondContact O-ND2 3.2Å
351	R	92.1	Very high	86.3	Confident	127 Å²	127	100.4 Å²	100.4	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-45.4	169.5	-166.3	-171.4	74.1	86.4	4.9	112	Q347 E348 N349 N354 I355	Q347-R351 WeakPolarHBondContact O-CB 3.4Å; Q347-R351 PolarHBondContact O-N 3.36Å; E348-R351 WeakPolarHBondContact O-CB 3.47Å; E348-R351 PolarHBondContact O-N 3.02Å; E348-R351 IonicContact OE1-CZ 3.8Å; E348-R351 IonicContact OE1-NE 2.71Å; E348-R351 PolarHBondContact OE1-NE 3.23Å; E348-R351 IonicContact OE1-NH2 2.76Å; E348-R351 PolarHBondContact OE1-NH2 2.77Å; E348-R351 IonicContact OE2-CZ 3.26Å; E348-R351 IonicContact OE2-NE 2.67Å; E348-R351 PolarHBondContact OE2-NE 2.82Å; E348-R351 IonicContact OE2-NH2 3.14Å; E348-R351 PolarHBondContact OE2-NH2 3.17Å; N349-R351 VanDerWaalsContact C-N 3.35Å; R351-N354 PolarHBondContact O-N 2.95Å; R351-I355 HydrophobicContact CG-CD1 4.38Å; R351-I355 VanDerWaalsContact NH1-CD1 3.34Å; R351-I355 WeakPolarHBondContact O-CG1 3.39Å; R351-I355 PolarHBondContact O-N 3.41Å
352	L	87.6	Confident	85.6	Confident	69 Å²	69	98.4 Å²	98.4	36%	0.361	49%	0.49	S	S	.	.	H	α-helix	trans	-68.2	-40	179	-70.5	171.7	0	0	0	112	E348 N349 I355 I356	E348-L352 HydrophobicContact CG-CD1 3.99Å; E348-L352 HydrophobicContact CG-CG 4.35Å; E348-L352 WeakPolarHBondContact O-CB 3.31Å; E348-L352 VanDerWaalsContact O-CG 3.28Å; E348-L352 WeakPolarHBondContact O-CG 3.33Å; E348-L352 PolarHBondContact O-N 2.88Å; N349-L352 PolarHBondContact O-N 3.17Å; L352-I355 WeakPolarHBondContact O-CA 3.48Å; L352-I355 WeakPolarHBondContact O-CB 3.31Å; L352-I355 PolarHBondContact O-N 3.04Å; L352-I355 VanDerWaalsContact O-N 3.12Å; L352-I356 WeakPolarHBondContact O-CG1 3.43Å; L352-I356 PolarHBondContact O-N 2.94Å
353	Q	86.4	Confident	84.8	Confident	95 Å²	95	100.2 Å²	100.2	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-47	173.6	-170.4	62.9	53	0	0	110.8	N349 I355 I356 D357	N349-Q353 VanDerWaalsContact O-CB 3.31Å; N349-Q353 WeakPolarHBondContact O-CB 3.23Å; N349-Q353 PolarHBondContact O-N 3.19Å; Q353-I355 PolarHBondContact O-N 2.94Å; Q353-I356 PolarHBondContact O-N 3.24Å; Q353-D357 PolarHBondContact NE2-OD1 3.17Å; Q353-D357 WeakPolarHBondContact O-CB 3.24Å; Q353-D357 PolarHBondContact O-N 3.42Å
354	N	87.4	Confident	83.9	Confident	96 Å²	96	99.4 Å²	99.4	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-58	-31.6	172.7	-84.1	-71	0	0	0	112.8	T350 R351 N358	T350-N354 WeakPolarHBondContact O-CB 3.46Å; T350-N354 PolarHBondContact O-N 3.12Å; T350-N354 PolarHBondContact O-ND2 3.2Å; R351-N354 PolarHBondContact O-N 2.95Å; N354-N358 WeakPolarHBondContact O-CB 3.37Å; N354-N358 PolarHBondContact O-N 3.48Å; N354-N358 PolarHBondContact O-ND2 2.88Å
355	I	83.8	Confident	83.2	Confident	66 Å²	66	98.1 Å²	98.1	34%	0.338	50%	0.495	S	S	.	.	H	α-helix	trans	-71.4	-43.8	173.8	-74	163.6	0	0	0	111.1	R351 L352 Q353 N358 Q359	R351-I355 HydrophobicContact CG-CD1 4.38Å; R351-I355 VanDerWaalsContact NH1-CD1 3.34Å; R351-I355 WeakPolarHBondContact O-CG1 3.39Å; R351-I355 PolarHBondContact O-N 3.41Å; L352-I355 WeakPolarHBondContact O-CA 3.48Å; L352-I355 WeakPolarHBondContact O-CB 3.31Å; L352-I355 PolarHBondContact O-N 3.04Å; L352-I355 VanDerWaalsContact O-N 3.12Å; Q353-I355 PolarHBondContact O-N 2.94Å; I355-N358 CarbonylContact O-C 3.57Å; I355-N358 PolarHBondContact O-N 3.34Å; I355-Q359 WeakPolarHBondContact O-CG 3.47Å; I355-Q359 PolarHBondContact O-N 2.85Å; I355-Q359 VanDerWaalsContact O-N 3.11Å
356	I	79.4	Confident	82.6	Confident	94 Å²	94	97.7 Å²	97.7	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-46.8	177.4	-69	163.3	0	0	0	110.8	L352 Q353 N358 Q359	L352-I356 WeakPolarHBondContact O-CG1 3.43Å; L352-I356 PolarHBondContact O-N 2.94Å; Q353-I356 PolarHBondContact O-N 3.24Å; I356-N358 PolarHBondContact O-N 2.87Å; I356-N358 VanDerWaalsContact O-N 3.15Å; I356-Q359 WeakPolarHBondContact O-CB 3.38Å; I356-Q359 PolarHBondContact O-N 3.48Å
357	D	79.1	Confident	82	Confident	105 Å²	105	98.2 Å²	98.2	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-22.2	179.9	-62.6	-20.2	0	0	0	112.8	Q353	Q353-D357 PolarHBondContact NE2-OD1 3.17Å; Q353-D357 WeakPolarHBondContact O-CB 3.24Å; Q353-D357 PolarHBondContact O-N 3.42Å
358	N	80.6	Confident	81.6	Confident	127 Å²	127	98.8 Å²	98.8	68%	0.679	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	4.3	175.8	-73.3	-82.7	0	0	0	113.7	N354 I355 I356	N354-N358 WeakPolarHBondContact O-CB 3.37Å; N354-N358 PolarHBondContact O-N 3.48Å; N354-N358 PolarHBondContact O-ND2 2.88Å; I355-N358 CarbonylContact O-C 3.57Å; I355-N358 PolarHBondContact O-N 3.34Å; I356-N358 PolarHBondContact O-N 2.87Å; I356-N358 VanDerWaalsContact O-N 3.15Å
359	Q	75.6	Confident	81.2	Confident	106 Å²	106	99 Å²	99	50%	0.495	50%	0.497	S	S	.	.			trans	-77.8	139.8	173.4	-85.1	170.8	20	0	0	111.5	I355 I356 Y361	I355-Q359 WeakPolarHBondContact O-CG 3.47Å; I355-Q359 PolarHBondContact O-N 2.85Å; I355-Q359 VanDerWaalsContact O-N 3.11Å; I356-Q359 WeakPolarHBondContact O-CB 3.38Å; I356-Q359 PolarHBondContact O-N 3.48Å; Q359-Y361 VanDerWaalsContact C-N 3.31Å; Q359-Y361 PolarHBondContact O-N 3.27Å
360	K	70.8	Confident	80.9	Confident	189 Å²	189	97 Å²	97	82%	0.822	49%	0.486	S	S	*	.	S	Bend	trans	-83.2	-0.9	-174.3	-64.1	-174.5	178	-178.4	0	114.9
361	Y	69.5	Low	80.6	Confident	151 Å²	151	98.6 Å²	98.6	59%	0.592	49%	0.488	S	S	*	.	S	Bend	trans	-139	133.8	-173.1	-59.8	-69.5	0	0	0	109	Q359 D365	Q359-Y361 VanDerWaalsContact C-N 3.31Å; Q359-Y361 PolarHBondContact O-N 3.27Å; Y361-D365 HydrophobicContact CD1-CB 4.48Å
362	S	77.1	Confident	80.2	Confident	68 Å²	68	97 Å²	97	48%	0.476	49%	0.486	S	S	.	.			trans	-72.9	162.6	176.7	-177.5	0	0	0	0	111.2	A364 D365 I366	S362-A364 PolarHBondContact O-N 2.95Å; S362-A364 PolarHBondContact OG-N 2.85Å; S362-D365 WeakPolarHBondContact CB-OD2 3.44Å; S362-D365 PolarHBondContact N-OD2 3.16Å; S362-D365 WeakPolarHBondContact O-CA 3.26Å; S362-D365 WeakPolarHBondContact O-CB 3.42Å; S362-D365 PolarHBondContact O-N 2.96Å; S362-I366 PolarHBondContact O-N 3.28Å
363	V	74.6	Confident	80.2	Confident	101 Å²	101	100 Å²	100	61%	0.612	49%	0.492	S	S	*	.	H	α-helix	trans	-52.8	-39	166.5	-179.1	0	0	0	0	110.2	D365 I366 E367	V363-D365 VanDerWaalsContact C-N 3.35Å; V363-D365 PolarHBondContact O-N 3.45Å; V363-I366 CarbonylContact O-C 3.51Å; V363-I366 PolarHBondContact O-N 2.95Å; V363-E367 HydrophobicContact CG1-CG 4.47Å; V363-E367 WeakPolarHBondContact O-CG 3.35Å; V363-E367 PolarHBondContact O-N 3.32Å
364	A	75.7	Confident	80.2	Confident	58 Å²	58	98.9 Å²	98.9	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-30.1	175.8	0	0	0	0	0	113.8	S362 R368	S362-A364 PolarHBondContact O-N 2.95Å; S362-A364 PolarHBondContact OG-N 2.85Å; A364-R368 WeakPolarHBondContact O-CB 3.31Å; A364-R368 PolarHBondContact O-N 3.45Å
365	D	78.4	Confident	80.2	Confident	46 Å²	46	98.5 Å²	98.5	25%	0.246	49%	0.485	C	S	.	.	H	α-helix	trans	-71.8	-40.4	171.3	-69.6	-66.2	0	0	0	110.9	Y361 S362 V363 E367 R368 I369	Y361-D365 HydrophobicContact CD1-CB 4.48Å; S362-D365 WeakPolarHBondContact CB-OD2 3.44Å; S362-D365 PolarHBondContact N-OD2 3.16Å; S362-D365 WeakPolarHBondContact O-CA 3.26Å; S362-D365 WeakPolarHBondContact O-CB 3.42Å; S362-D365 PolarHBondContact O-N 2.96Å; V363-D365 VanDerWaalsContact C-N 3.35Å; V363-D365 PolarHBondContact O-N 3.45Å; D365-E367 VanDerWaalsContact C-N 3.35Å; D365-R368 PolarHBondContact O-N 2.91Å; D365-R368 IonicContact OD1-CZ 3.69Å; D365-R368 IonicContact OD1-NH1 2.88Å; D365-R368 PolarHBondContact OD1-NH1 2.92Å; D365-R368 IonicContact OD1-NH2 3.25Å; D365-R368 PolarHBondContact OD1-NH2 3.32Å; D365-I369 WeakPolarHBondContact O-CB 3.47Å; D365-I369 WeakPolarHBondContact O-CD1 3.36Å; D365-I369 WeakPolarHBondContact O-CG1 3.37Å; D365-I369 PolarHBondContact O-N 3.1Å
366	I	79.1	Confident	80.3	Confident	74 Å²	74	100.8 Å²	100.8	38%	0.379	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.6	-65.4	169.2	0	0	0	110.4	S362 V363 N370	S362-I366 PolarHBondContact O-N 3.28Å; V363-I366 CarbonylContact O-C 3.51Å; V363-I366 PolarHBondContact O-N 2.95Å; I366-N370 WeakPolarHBondContact CG2-ND2 3.37Å; I366-N370 WeakPolarHBondContact O-CB 3.32Å; I366-N370 PolarHBondContact O-N 3.39Å; I366-N370 PolarHBondContact O-ND2 3.05Å
367	E	80.9	Confident	80.7	Confident	126 Å²	126	100.7 Å²	100.7	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-64.4	-45.4	172.7	-74.7	178.1	159.2	0	0	111.6	V363 D365 I369 N370 H371	V363-E367 HydrophobicContact CG1-CG 4.47Å; V363-E367 WeakPolarHBondContact O-CG 3.35Å; V363-E367 PolarHBondContact O-N 3.32Å; D365-E367 VanDerWaalsContact C-N 3.35Å; E367-I369 PolarHBondContact O-N 2.8Å; E367-N370 PolarHBondContact O-N 2.67Å; E367-H371 WeakPolarHBondContact O-CB 3.36Å; E367-H371 PolarHBondContact O-N 3.35Å
368	R	83.5	Confident	81	Confident	121 Å²	121	101 Å²	101	46%	0.457	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-47.2	175.2	-165	-172.4	66.1	-108.4	-2.7	111.6	A364 D365 N370 H371 E372	A364-R368 WeakPolarHBondContact O-CB 3.31Å; A364-R368 PolarHBondContact O-N 3.45Å; D365-R368 PolarHBondContact O-N 2.91Å; D365-R368 IonicContact OD1-CZ 3.69Å; D365-R368 IonicContact OD1-NH1 2.88Å; D365-R368 PolarHBondContact OD1-NH1 2.92Å; D365-R368 IonicContact OD1-NH2 3.25Å; D365-R368 PolarHBondContact OD1-NH2 3.32Å; R368-N370 VanDerWaalsContact C-N 3.34Å; R368-N370 PolarHBondContact O-N 2.86Å; R368-H371 PolarHBondContact O-N 2.74Å; R368-E372 WeakPolarHBondContact CD-OE1 3.5Å; R368-E372 WeakPolarHBondContact CG-OE1 3.24Å; R368-E372 IonicContact NE-OE1 2.69Å; R368-E372 PolarHBondContact NE-OE1 2.73Å; R368-E372 WeakPolarHBondContact O-CB 3.39Å; R368-E372 WeakPolarHBondContact O-CG 3.38Å; R368-E372 PolarHBondContact O-N 3.03Å
369	I	82.8	Confident	81.4	Confident	79 Å²	79	98.4 Å²	98.4	41%	0.405	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-38.9	176.9	-69.9	163.4	0	0	0	111.3	D365 E367 R373	D365-I369 WeakPolarHBondContact O-CB 3.47Å; D365-I369 WeakPolarHBondContact O-CD1 3.36Å; D365-I369 WeakPolarHBondContact O-CG1 3.37Å; D365-I369 PolarHBondContact O-N 3.1Å; E367-I369 PolarHBondContact O-N 2.8Å; I369-R373 WeakPolarHBondContact O-CB 3.47Å; I369-R373 PolarHBondContact O-N 2.93Å
370	N	83.6	Confident	81.9	Confident	55 Å²	55	97.4 Å²	97.4	29%	0.294	48%	0.479	S	S	.	.	H	α-helix	trans	-68.3	-35.4	174.8	-83.7	-71.8	0	0	0	112.3	I366 E367 R368 R373 N374	I366-N370 WeakPolarHBondContact CG2-ND2 3.37Å; I366-N370 WeakPolarHBondContact O-CB 3.32Å; I366-N370 PolarHBondContact O-N 3.39Å; I366-N370 PolarHBondContact O-ND2 3.05Å; E367-N370 PolarHBondContact O-N 2.67Å; R368-N370 VanDerWaalsContact C-N 3.34Å; R368-N370 PolarHBondContact O-N 2.86Å; N370-R373 PolarHBondContact OD1-NH1 3.12Å; N370-R373 PolarHBondContact OD1-NH2 3.31Å; N370-N374 WeakPolarHBondContact O-CB 3.3Å; N370-N374 PolarHBondContact O-N 3.47Å; N370-N374 PolarHBondContact O-ND2 3.18Å; N370-N374 PolarHBondContact O-OD1 2.78Å
371	H	84.3	Confident	82.6	Confident	118 Å²	118	92.4 Å²	92.4	55%	0.546	46%	0.461	S	S	.	.	H	α-helix	trans	-67.5	-51.2	174.1	-177.7	55.1	0	0	0	111.1	E367 R368 R373 N374 E375	E367-H371 WeakPolarHBondContact O-CB 3.36Å; E367-H371 PolarHBondContact O-N 3.35Å; R368-H371 PolarHBondContact O-N 2.74Å; H371-R373 VanDerWaalsContact C-N 3.31Å; H371-R373 PolarHBondContact O-N 2.92Å; H371-N374 PolarHBondContact O-N 2.83Å; H371-E375 PolarHBondContact O-N 3.28Å
372	E	84.9	Confident	83.6	Confident	94 Å²	94	91.7 Å²	91.7	44%	0.439	46%	0.461	S	S	.	.	H	α-helix	trans	-53.6	-45.7	173.2	-71	169.7	-158.9	0	0	111.4	R368 N374 E375 L376	R368-E372 WeakPolarHBondContact CD-OE1 3.5Å; R368-E372 WeakPolarHBondContact CG-OE1 3.24Å; R368-E372 IonicContact NE-OE1 2.69Å; R368-E372 PolarHBondContact NE-OE1 2.73Å; R368-E372 WeakPolarHBondContact O-CB 3.39Å; R368-E372 WeakPolarHBondContact O-CG 3.38Å; R368-E372 PolarHBondContact O-N 3.03Å; E372-N374 PolarHBondContact O-N 2.85Å; E372-E375 PolarHBondContact O-N 2.78Å; E372-L376 WeakPolarHBondContact O-CB 3.5Å; E372-L376 VanDerWaalsContact O-CG 3.28Å; E372-L376 WeakPolarHBondContact O-CG 3.24Å; E372-L376 PolarHBondContact O-N 3.03Å
373	R	86.5	Confident	84.1	Confident	130 Å²	130	93.5 Å²	93.5	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-41.2	174.5	-173.1	-155.2	68.9	-155.9	-8.3	112.4	I369 N370 H371 L376 Q377	I369-R373 WeakPolarHBondContact O-CB 3.47Å; I369-R373 PolarHBondContact O-N 2.93Å; N370-R373 PolarHBondContact OD1-NH1 3.12Å; N370-R373 PolarHBondContact OD1-NH2 3.31Å; H371-R373 VanDerWaalsContact C-N 3.31Å; H371-R373 PolarHBondContact O-N 2.92Å; R373-L376 PolarHBondContact O-N 3.45Å; R373-Q377 WeakPolarHBondContact O-CB 3.46Å; R373-Q377 PolarHBondContact O-N 3.19Å
374	N	86.1	Confident	84.7	Confident	72 Å²	72	91.7 Å²	91.7	39%	0.385	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-36.4	-179.8	-72.4	-6	0	0	0	112	N370 H371 E372 Q377 Q378	N370-N374 WeakPolarHBondContact O-CB 3.3Å; N370-N374 PolarHBondContact O-N 3.47Å; N370-N374 PolarHBondContact O-ND2 3.18Å; N370-N374 PolarHBondContact O-OD1 2.78Å; H371-N374 PolarHBondContact O-N 2.83Å; E372-N374 PolarHBondContact O-N 2.85Å; N374-Q377 PolarHBondContact O-N 3.36Å; N374-Q378 WeakPolarHBondContact O-CB 3.48Å; N374-Q378 WeakPolarHBondContact O-CG 3.48Å; N374-Q378 PolarHBondContact O-N 3.06Å; N374-Q378 PolarHBondContact O-NE2 3.27Å
375	E	87.1	Confident	85.2	Confident	89 Å²	89	95.8 Å²	95.8	42%	0.416	46%	0.461	S	S	.	.	H	α-helix	trans	-66.6	-42.2	172	-70.6	-58.2	115.3	0	0	111.7	H371 E372 Q378 T379	H371-E375 PolarHBondContact O-N 3.28Å; E372-E375 PolarHBondContact O-N 2.78Å; E375-Q378 PolarHBondContact O-N 3.4Å; E375-Q378 PolarHBondContact OE1-NE2 3.29Å; E375-T379 WeakPolarHBondContact O-CB 3.41Å; E375-T379 PolarHBondContact O-N 3.42Å; E375-T379 PolarHBondContact O-OG1 2.84Å
376	L	87.1	Confident	85.6	Confident	113 Å²	113	97.2 Å²	97.2	59%	0.592	47%	0.469	S	S	*	.	H	α-helix	trans	-62.6	-41.2	172.2	-72.5	169.8	0	0	0	111.8	E372 R373 T379 I380	E372-L376 WeakPolarHBondContact O-CB 3.5Å; E372-L376 VanDerWaalsContact O-CG 3.28Å; E372-L376 WeakPolarHBondContact O-CG 3.24Å; E372-L376 PolarHBondContact O-N 3.03Å; R373-L376 PolarHBondContact O-N 3.45Å; L376-T379 WeakPolarHBondContact O-CB 3.32Å; L376-T379 PolarHBondContact O-N 2.87Å; L376-I380 VanDerWaalsContact O-CG1 3.29Å; L376-I380 WeakPolarHBondContact O-CG1 3.25Å; L376-I380 PolarHBondContact O-N 2.89Å
377	Q	87.3	Confident	86.1	Confident	92 Å²	92	98.4 Å²	98.4	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-67.8	-38.2	177.1	-170.8	63.8	64.8	0	0	112.2	R373 N374 T379 I380 N381	R373-Q377 WeakPolarHBondContact O-CB 3.46Å; R373-Q377 PolarHBondContact O-N 3.19Å; N374-Q377 PolarHBondContact O-N 3.36Å; Q377-T379 VanDerWaalsContact C-N 3.33Å; Q377-I380 PolarHBondContact O-N 3.3Å; Q377-N381 PolarHBondContact NE2-OD1 3.29Å; Q377-N381 WeakPolarHBondContact O-CB 3.41Å; Q377-N381 PolarHBondContact O-N 3.21Å; Q377-N381 PolarHBondContact O-ND2 2.94Å; Q377-N381 PolarHBondContact O-OD1 3.31Å
378	Q	85.3	Confident	86.4	Confident	111 Å²	111	97.6 Å²	97.6	52%	0.519	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-41.7	171.2	-77.2	175.5	88.9	0	0	111.5	N374 E375 N381 K382	N374-Q378 WeakPolarHBondContact O-CB 3.48Å; N374-Q378 WeakPolarHBondContact O-CG 3.48Å; N374-Q378 PolarHBondContact O-N 3.06Å; N374-Q378 PolarHBondContact O-NE2 3.27Å; E375-Q378 PolarHBondContact O-N 3.4Å; E375-Q378 PolarHBondContact OE1-NE2 3.29Å; Q378-N381 PolarHBondContact O-N 3.1Å; Q378-K382 WeakPolarHBondContact O-CB 3.32Å; Q378-K382 PolarHBondContact O-N 2.93Å
379	T	88.6	Confident	86.5	Confident	73 Å²	73	94 Å²	94	45%	0.448	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-45.3	176.5	-57.9	0	0	0	0	111.4	E375 L376 Q377 K382 L383	E375-T379 WeakPolarHBondContact O-CB 3.41Å; E375-T379 PolarHBondContact O-N 3.42Å; E375-T379 PolarHBondContact O-OG1 2.84Å; L376-T379 WeakPolarHBondContact O-CB 3.32Å; L376-T379 PolarHBondContact O-N 2.87Å; Q377-T379 VanDerWaalsContact C-N 3.33Å; T379-K382 PolarHBondContact O-N 3.13Å; T379-L383 HydrophobicContact CG2-CD1 4.03Å; T379-L383 WeakPolarHBondContact O-CB 3.42Å; T379-L383 WeakPolarHBondContact O-CG 3.38Å; T379-L383 PolarHBondContact O-N 2.76Å
380	I	85.9	Confident	86.7	Confident	85 Å²	85	95.2 Å²	95.2	44%	0.436	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-52.2	173.2	-70.6	163.4	0	0	0	110	L376 Q377 K382 L383 T384	L376-I380 VanDerWaalsContact O-CG1 3.29Å; L376-I380 WeakPolarHBondContact O-CG1 3.25Å; L376-I380 PolarHBondContact O-N 2.89Å; Q377-I380 PolarHBondContact O-N 3.3Å; I380-K382 PolarHBondContact O-N 2.71Å; I380-L383 PolarHBondContact O-N 3.48Å; I380-L383 VanDerWaalsContact O-N 3.1Å; I380-T384 PolarHBondContact O-N 3.29Å; I380-T384 PolarHBondContact O-OG1 3.18Å; I380-T384 VanDerWaalsContact O-OG1 3.05Å
381	N	87	Confident	86.8	Confident	85 Å²	85	97.9 Å²	97.9	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-59.4	-32.6	-179.2	-68.1	-4.4	0	0	0	112.7	Q377 Q378 K385	Q377-N381 PolarHBondContact NE2-OD1 3.29Å; Q377-N381 WeakPolarHBondContact O-CB 3.41Å; Q377-N381 PolarHBondContact O-N 3.21Å; Q377-N381 PolarHBondContact O-ND2 2.94Å; Q377-N381 PolarHBondContact O-OD1 3.31Å; Q378-N381 PolarHBondContact O-N 3.1Å; N381-K385 WeakPolarHBondContact O-CG 3.4Å; N381-K385 PolarHBondContact O-N 3.42Å
382	K	90.3	Very high	86.9	Confident	135 Å²	135	97.1 Å²	97.1	59%	0.587	48%	0.479	S	S	*	.	H	α-helix	trans	-70.1	-53.1	172.4	-175.3	-171.9	171	-171.5	0	111	Q378 T379 I380 T384 K385 D386	Q378-K382 WeakPolarHBondContact O-CB 3.32Å; Q378-K382 PolarHBondContact O-N 2.93Å; T379-K382 PolarHBondContact O-N 3.13Å; I380-K382 PolarHBondContact O-N 2.71Å; K382-T384 PolarHBondContact O-N 3.09Å; K382-K385 PolarHBondContact O-N 3.09Å; K382-D386 WeakPolarHBondContact CE-OD2 3.31Å; K382-D386 PolarHBondContact O-N 3.33Å
383	L	87	Confident	87	Confident	107 Å²	107	98 Å²	98	56%	0.56	48%	0.481	S	S	*	.	H	α-helix	trans	-60.4	-33.3	-180	-70.6	171.7	0	0	0	112.6	T379 I380 L387	T379-L383 HydrophobicContact CG2-CD1 4.03Å; T379-L383 WeakPolarHBondContact O-CB 3.42Å; T379-L383 WeakPolarHBondContact O-CG 3.38Å; T379-L383 PolarHBondContact O-N 2.76Å; I380-L383 PolarHBondContact O-N 3.48Å; I380-L383 VanDerWaalsContact O-N 3.1Å; L383-L387 WeakPolarHBondContact O-CB 3.49Å; L383-L387 PolarHBondContact O-N 2.81Å
384	T	86.6	Confident	87	Confident	62 Å²	62	96.6 Å²	96.6	38%	0.38	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-44.6	172.1	-58.4	0	0	0	0	111.5	I380 K382 L387 E388	I380-T384 PolarHBondContact O-N 3.29Å; I380-T384 PolarHBondContact O-OG1 3.18Å; I380-T384 VanDerWaalsContact O-OG1 3.05Å; K382-T384 PolarHBondContact O-N 3.09Å; T384-L387 PolarHBondContact O-N 2.91Å; T384-E388 WeakPolarHBondContact O-CB 3.47Å; T384-E388 VanDerWaalsContact O-CG 3.3Å; T384-E388 WeakPolarHBondContact O-CG 3.49Å; T384-E388 PolarHBondContact O-N 2.96Å
385	K	87.3	Confident	87.1	Confident	144 Å²	144	100.8 Å²	100.8	63%	0.626	49%	0.494	S	S	*	.	H	α-helix	trans	-67.2	-39.2	175.9	-74.5	179.9	176.8	-175.4	0	113.1	N381 K382 L387 E388 A389	N381-K385 WeakPolarHBondContact O-CG 3.4Å; N381-K385 PolarHBondContact O-N 3.42Å; K382-K385 PolarHBondContact O-N 3.09Å; K385-L387 VanDerWaalsContact C-N 3.3Å; K385-E388 PolarHBondContact O-N 3.13Å; K385-A389 WeakPolarHBondContact O-CB 3.45Å; K385-A389 PolarHBondContact O-N 3.34Å
386	D	87.3	Confident	87.1	Confident	77 Å²	77	100 Å²	100	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-39.6	175.4	-66.2	-22.1	0	0	0	109.9	K382 A389 E390	K382-D386 WeakPolarHBondContact CE-OD2 3.31Å; K382-D386 PolarHBondContact O-N 3.33Å; D386-A389 PolarHBondContact O-N 2.95Å; D386-E390 PolarHBondContact O-N 2.97Å
387	L	88.3	Confident	87.1	Confident	98 Å²	98	99.5 Å²	99.5	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-45.3	173.2	179.2	65.1	0	0	0	112.9	L383 T384 K385 A389 E390 Q391	L383-L387 WeakPolarHBondContact O-CB 3.49Å; L383-L387 PolarHBondContact O-N 2.81Å; T384-L387 PolarHBondContact O-N 2.91Å; K385-L387 VanDerWaalsContact C-N 3.3Å; L387-A389 VanDerWaalsContact C-N 3.27Å; L387-A389 PolarHBondContact O-N 3.36Å; L387-E390 PolarHBondContact O-N 3.35Å; L387-Q391 HydrophobicContact CD1-CG 4.31Å; L387-Q391 HydrophobicContact CG-CG 4.44Å; L387-Q391 WeakPolarHBondContact O-CB 3.32Å; L387-Q391 VanDerWaalsContact O-CG 3.3Å; L387-Q391 WeakPolarHBondContact O-CG 3.39Å; L387-Q391 PolarHBondContact O-N 2.8Å
388	E	87.4	Confident	87	Confident	109 Å²	109	100 Å²	100	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-58.1	-40.2	174.3	-76	168.8	175.8	0	0	111.1	T384 K385 Q391 Q392	T384-E388 WeakPolarHBondContact O-CB 3.47Å; T384-E388 VanDerWaalsContact O-CG 3.3Å; T384-E388 WeakPolarHBondContact O-CG 3.49Å; T384-E388 PolarHBondContact O-N 2.96Å; K385-E388 PolarHBondContact O-N 3.13Å; E388-Q391 PolarHBondContact O-N 2.85Å; E388-Q392 WeakPolarHBondContact O-CB 3.35Å; E388-Q392 PolarHBondContact O-N 3.46Å
389	A	86.5	Confident	87	Confident	46 Å²	46	98 Å²	98	38%	0.38	48%	0.482	S	S	.	.	H	α-helix	trans	-67	-41.5	176.9	0	0	0	0	0	112.7	K385 D386 L387 Q392 K393	K385-A389 WeakPolarHBondContact O-CB 3.45Å; K385-A389 PolarHBondContact O-N 3.34Å; D386-A389 PolarHBondContact O-N 2.95Å; L387-A389 VanDerWaalsContact C-N 3.27Å; L387-A389 PolarHBondContact O-N 3.36Å; A389-Q392 PolarHBondContact O-N 3.1Å; A389-K393 WeakPolarHBondContact O-CG 3.31Å; A389-K393 PolarHBondContact O-N 3.25Å
390	E	86.9	Confident	86.9	Confident	105 Å²	105	100.2 Å²	100.2	49%	0.491	49%	0.485	S	S	.	.	H	α-helix	trans	-70.6	-35.7	173.7	-65.4	-50.5	138.8	0	0	112.7	D386 L387 K393 L394	D386-E390 PolarHBondContact O-N 2.97Å; L387-E390 PolarHBondContact O-N 3.35Å; E390-K393 WeakPolarHBondContact O-CB 3.45Å; E390-K393 PolarHBondContact O-N 3.3Å; E390-K393 IonicContact OE1-NZ 2.97Å; E390-K393 PolarHBondContact OE1-NZ 2.79Å; E390-K393 WeakPolarHBondContact OE2-CD 3.33Å; E390-K393 IonicContact OE2-NZ 3.72Å; E390-L394 WeakPolarHBondContact O-CB 3.42Å; E390-L394 PolarHBondContact O-N 3.05Å
391	Q	85.8	Confident	86.8	Confident	110 Å²	110	103 Å²	103	51%	0.514	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-41.6	171.8	-75.3	176.7	-2	0	0	111.5	L387 E388 K393 L394 W395	L387-Q391 HydrophobicContact CD1-CG 4.31Å; L387-Q391 HydrophobicContact CG-CG 4.44Å; L387-Q391 WeakPolarHBondContact O-CB 3.32Å; L387-Q391 VanDerWaalsContact O-CG 3.3Å; L387-Q391 WeakPolarHBondContact O-CG 3.39Å; L387-Q391 PolarHBondContact O-N 2.8Å; E388-Q391 PolarHBondContact O-N 2.85Å; Q391-K393 VanDerWaalsContact C-N 3.34Å; Q391-K393 PolarHBondContact O-N 2.92Å; Q391-L394 PolarHBondContact O-N 2.96Å; Q391-W395 WeakPolarHBondContact O-CB 3.45Å; Q391-W395 PolarHBondContact O-N 3.29Å
392	Q	86.3	Confident	86.6	Confident	103 Å²	103	101.3 Å²	101.3	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-67.2	-33.9	176	-173	59.7	81.4	0	0	112.3	E388 A389 N396	E388-Q392 WeakPolarHBondContact O-CB 3.35Å; E388-Q392 PolarHBondContact O-N 3.46Å; A389-Q392 PolarHBondContact O-N 3.1Å; Q392-N396 PolarHBondContact NE2-OD1 3.34Å; Q392-N396 WeakPolarHBondContact O-CB 3.32Å; Q392-N396 PolarHBondContact O-N 2.99Å; Q392-N396 VanDerWaalsContact O-N 3.11Å; Q392-N396 PolarHBondContact O-ND2 2.81Å; Q392-N396 VanDerWaalsContact O-ND2 3.1Å; Q392-N396 PolarHBondContact O-OD1 3.49Å
393	K	86.8	Confident	86.4	Confident	111 Å²	111	102.4 Å²	102.4	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-47.5	170.3	-73.9	165.2	178.9	176.9	0	111.6	A389 E390 Q391 W395 N396 E397	A389-K393 WeakPolarHBondContact O-CG 3.31Å; A389-K393 PolarHBondContact O-N 3.25Å; E390-K393 WeakPolarHBondContact O-CB 3.45Å; E390-K393 PolarHBondContact O-N 3.3Å; E390-K393 IonicContact OE1-NZ 2.97Å; E390-K393 PolarHBondContact OE1-NZ 2.79Å; E390-K393 WeakPolarHBondContact OE2-CD 3.33Å; E390-K393 IonicContact OE2-NZ 3.72Å; Q391-K393 VanDerWaalsContact C-N 3.34Å; Q391-K393 PolarHBondContact O-N 2.92Å; K393-W395 PolarHBondContact O-N 2.78Å; K393-N396 WeakPolarHBondContact O-CB 3.46Å; K393-N396 PolarHBondContact O-N 2.85Å; K393-N396 VanDerWaalsContact O-N 3.1Å; K393-E397 PolarHBondContact O-N 2.87Å
394	L	86.3	Confident	86.2	Confident	101 Å²	101	98.9 Å²	98.9	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-56.6	-50.9	177.5	178.9	62.4	0	0	0	110.8	E390 Q391 N396 E397 E398	E390-L394 WeakPolarHBondContact O-CB 3.42Å; E390-L394 PolarHBondContact O-N 3.05Å; Q391-L394 PolarHBondContact O-N 2.96Å; L394-N396 VanDerWaalsContact C-N 3.26Å; L394-N396 PolarHBondContact O-N 3.43Å; L394-E397 PolarHBondContact O-N 3.4Å; L394-E398 HydrophobicContact CD1-CG 4.35Å; L394-E398 HydrophobicContact CG-CG 4.44Å; L394-E398 WeakPolarHBondContact O-CG 3.39Å; L394-E398 PolarHBondContact O-N 3.02Å
395	W	87.9	Confident	86.1	Confident	161 Å²	161	99.9 Å²	99.9	61%	0.61	48%	0.478	S	S	*	.	H	α-helix	trans	-55.9	-39	174.9	179.5	-91.1	0	0	0	112.9	Q391 K393 E398 L399	Q391-W395 WeakPolarHBondContact O-CB 3.45Å; Q391-W395 PolarHBondContact O-N 3.29Å; K393-W395 PolarHBondContact O-N 2.78Å; W395-E398 PolarHBondContact O-N 2.91Å; W395-L399 VanDerWaalsContact O-CB 3.27Å; W395-L399 WeakPolarHBondContact O-CB 3.36Å; W395-L399 PolarHBondContact O-N 3.34Å
396	N	87.4	Confident	85.9	Confident	72 Å²	72	99 Å²	99	39%	0.385	48%	0.477	S	S	.	.	H	α-helix	trans	-69.1	-34.8	177.3	-71.2	-19.9	0	0	0	112.6	Q392 K393 L394 K400	Q392-N396 PolarHBondContact NE2-OD1 3.34Å; Q392-N396 WeakPolarHBondContact O-CB 3.32Å; Q392-N396 PolarHBondContact O-N 2.99Å; Q392-N396 VanDerWaalsContact O-N 3.11Å; Q392-N396 PolarHBondContact O-ND2 2.81Å; Q392-N396 VanDerWaalsContact O-ND2 3.1Å; Q392-N396 PolarHBondContact O-OD1 3.49Å; K393-N396 WeakPolarHBondContact O-CB 3.46Å; K393-N396 PolarHBondContact O-N 2.85Å; K393-N396 VanDerWaalsContact O-N 3.1Å; L394-N396 VanDerWaalsContact C-N 3.26Å; L394-N396 PolarHBondContact O-N 3.43Å; N396-K400 WeakPolarHBondContact O-CD 3.42Å; N396-K400 VanDerWaalsContact O-CG 3.31Å; N396-K400 WeakPolarHBondContact O-CG 3.27Å; N396-K400 PolarHBondContact O-N 3.49Å; N396-K400 VanDerWaalsContact O-N 3.14Å
397	E	86.3	Confident	85.8	Confident	103 Å²	103	98 Å²	98	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-74.9	-38.3	172.4	-61.7	-49.1	137.3	0	0	112.5	K393 L394 L399 K400 Y401	K393-E397 PolarHBondContact O-N 2.87Å; L394-E397 PolarHBondContact O-N 3.4Å; E397-L399 VanDerWaalsContact C-N 3.31Å; E397-L399 PolarHBondContact O-N 3.19Å; E397-K400 WeakPolarHBondContact O-CB 3.04Å; E397-K400 PolarHBondContact O-N 2.97Å; E397-K400 IonicContact OE1-NZ 2.66Å; E397-K400 PolarHBondContact OE1-NZ 3Å; E397-K400 WeakPolarHBondContact OE2-CD 3.44Å; E397-K400 IonicContact OE2-NZ 3.35Å; E397-K400 PolarHBondContact OE2-NZ 3.41Å; E397-K400 VanDerWaalsContact OE2-NZ 3.1Å; E397-Y401 WeakPolarHBondContact O-CB 3.39Å; E397-Y401 PolarHBondContact O-N 3.41Å
398	E	84.9	Confident	85.6	Confident	102 Å²	102	96.7 Å²	96.7	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-59.6	-42	171.6	-73	179.5	163.8	0	0	111.3	L394 W395 Y401 A402	L394-E398 HydrophobicContact CD1-CG 4.35Å; L394-E398 HydrophobicContact CG-CG 4.44Å; L394-E398 WeakPolarHBondContact O-CG 3.39Å; L394-E398 PolarHBondContact O-N 3.02Å; W395-E398 PolarHBondContact O-N 2.91Å; E398-Y401 PolarHBondContact O-N 3.28Å; E398-A402 WeakPolarHBondContact O-CB 3.27Å; E398-A402 PolarHBondContact O-N 2.86Å
399	L	87.1	Confident	85.4	Confident	69 Å²	69	95.6 Å²	95.6	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-36.8	175.5	-176.7	62.5	0	0	0	112.7	W395 E397 R403	W395-L399 VanDerWaalsContact O-CB 3.27Å; W395-L399 WeakPolarHBondContact O-CB 3.36Å; W395-L399 PolarHBondContact O-N 3.34Å; E397-L399 VanDerWaalsContact C-N 3.31Å; E397-L399 PolarHBondContact O-N 3.19Å; L399-R403 WeakPolarHBondContact O-CB 3.3Å; L399-R403 VanDerWaalsContact O-CG 3.28Å; L399-R403 WeakPolarHBondContact O-CG 3.44Å; L399-R403 PolarHBondContact O-N 2.87Å; L399-R403 VanDerWaalsContact O-N 3.12Å
400	K	84.7	Confident	85.3	Confident	120 Å²	120	97 Å²	97	52%	0.522	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-45.3	171.6	-75.9	162.2	171	-179.9	0	111.2	N396 E397 R403 G404	N396-K400 WeakPolarHBondContact O-CD 3.42Å; N396-K400 VanDerWaalsContact O-CG 3.31Å; N396-K400 WeakPolarHBondContact O-CG 3.27Å; N396-K400 PolarHBondContact O-N 3.49Å; N396-K400 VanDerWaalsContact O-N 3.14Å; E397-K400 WeakPolarHBondContact O-CB 3.04Å; E397-K400 PolarHBondContact O-N 2.97Å; E397-K400 IonicContact OE1-NZ 2.66Å; E397-K400 PolarHBondContact OE1-NZ 3Å; E397-K400 WeakPolarHBondContact OE2-CD 3.44Å; E397-K400 IonicContact OE2-NZ 3.35Å; E397-K400 PolarHBondContact OE2-NZ 3.41Å; E397-K400 VanDerWaalsContact OE2-NZ 3.1Å; K400-R403 PolarHBondContact O-N 3.29Å; K400-G404 PolarHBondContact O-N 3.03Å
401	Y	84.3	Confident	85.2	Confident	142 Å²	142	98.8 Å²	98.8	56%	0.557	48%	0.479	S	S	*	.	H	α-helix	trans	-62.3	-44.8	178.1	173	-101.2	0	0	0	111.6	E397 E398 G404 K405 P443	E397-Y401 WeakPolarHBondContact O-CB 3.39Å; E397-Y401 PolarHBondContact O-N 3.41Å; E398-Y401 PolarHBondContact O-N 3.28Å; Y401-G404 PolarHBondContact O-N 3.42Å; Y401-K405 WeakPolarHBondContact O-CB 3.5Å; Y401-K405 PolarHBondContact O-N 2.8Å; Y401-P443 HydrophobicContact CE2-CB 4.4Å; Y401-P443 WeakPolarHBondContact OH-CB 3.44Å
402	A	83.9	Confident	85.2	Confident	50 Å²	50	95 Å²	95	41%	0.413	46%	0.461	S	S	.	.	H	α-helix	trans	-59.3	-48	175.7	0	0	0	0	0	112	E398 G404 K405 E406	E398-A402 WeakPolarHBondContact O-CB 3.27Å; E398-A402 PolarHBondContact O-N 2.86Å; A402-G404 PolarHBondContact O-N 2.89Å; A402-K405 PolarHBondContact O-N 3.48Å; A402-E406 WeakPolarHBondContact O-CB 3.31Å; A402-E406 PolarHBondContact O-N 2.67Å
403	R	85.3	Confident	85.1	Confident	158 Å²	158	92.6 Å²	92.6	60%	0.596	46%	0.459	S	S	*	.	H	α-helix	trans	-62.4	-39.6	175.2	-72.5	171.2	177.1	179.6	0.2	112.7	L399 K400 E406 A407	L399-R403 WeakPolarHBondContact O-CB 3.3Å; L399-R403 VanDerWaalsContact O-CG 3.28Å; L399-R403 WeakPolarHBondContact O-CG 3.44Å; L399-R403 PolarHBondContact O-N 2.87Å; L399-R403 VanDerWaalsContact O-N 3.12Å; K400-R403 PolarHBondContact O-N 3.29Å; R403-E406 PolarHBondContact O-N 2.88Å; R403-A407 WeakPolarHBondContact O-CB 3.22Å; R403-A407 PolarHBondContact O-N 2.89Å
404	G	83.7	Confident	85	Confident	33 Å²	33	92.8 Å²	92.8	34%	0.34	46%	0.462	S	S	.	.	H	α-helix	trans	-63.7	-43.1	175.5	0	0	0	0	0	112.2	K400 Y401 A402 I408	K400-G404 PolarHBondContact O-N 3.03Å; Y401-G404 PolarHBondContact O-N 3.42Å; A402-G404 PolarHBondContact O-N 2.89Å; G404-I408 VanDerWaalsContact O-CG1 3.32Å; G404-I408 WeakPolarHBondContact O-CG1 3.01Å; G404-I408 PolarHBondContact O-N 3.35Å; G404-I408 VanDerWaalsContact O-N 3.13Å
405	K	82.8	Confident	84.9	Confident	83 Å²	83	90.8 Å²	90.8	36%	0.361	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-49.7	173.9	175.5	179.9	171.9	-174.1	0	111.6	Y401 A402 A407 I408 E409 F441	Y401-K405 WeakPolarHBondContact O-CB 3.5Å; Y401-K405 PolarHBondContact O-N 2.8Å; A402-K405 PolarHBondContact O-N 3.48Å; K405-A407 VanDerWaalsContact C-N 3.32Å; K405-A407 PolarHBondContact O-N 3.42Å; K405-I408 PolarHBondContact O-N 2.97Å; K405-I408 VanDerWaalsContact O-N 3.13Å; K405-E409 WeakPolarHBondContact CE-OE1 3.48Å; K405-E409 WeakPolarHBondContact CE-OE2 3.23Å; K405-E409 HydrophobicContact CG-CG 4.32Å; K405-E409 IonicContact NZ-OE1 3.64Å; K405-E409 WeakPolarHBondContact O-CG 3.32Å; K405-E409 PolarHBondContact O-N 2.87Å; K405-F441 HydrophobicContact CG-CE1 4.31Å
406	E	84.6	Confident	84.7	Confident	127 Å²	127	84.7 Å²	84.7	59%	0.593	43%	0.426	S	S	*	.	H	α-helix	trans	-58.6	-41.6	179.1	-177.8	178.6	-155.4	0	0	112.2	A402 R403 E409 T410	A402-E406 WeakPolarHBondContact O-CB 3.31Å; A402-E406 PolarHBondContact O-N 2.67Å; R403-E406 PolarHBondContact O-N 2.88Å; E406-E409 PolarHBondContact O-N 2.93Å; E406-T410 WeakPolarHBondContact O-CB 3.32Å; E406-T410 PolarHBondContact O-N 3.34Å; E406-T410 PolarHBondContact O-OG1 3.5Å
407	A	85.6	Confident	84.6	Confident	54 Å²	54	88.2 Å²	88.2	45%	0.446	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-41	175.2	0	0	0	0	0	112.6	R403 K405 T410 Q411	R403-A407 WeakPolarHBondContact O-CB 3.22Å; R403-A407 PolarHBondContact O-N 2.89Å; K405-A407 VanDerWaalsContact C-N 3.32Å; K405-A407 PolarHBondContact O-N 3.42Å; A407-T410 PolarHBondContact O-N 3.43Å; A407-Q411 PolarHBondContact O-N 3.47Å; A407-Q411 VanDerWaalsContact O-N 3.09Å
408	I	83.2	Confident	84.4	Confident	72 Å²	72	88.4 Å²	88.4	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-67.2	-44.6	175.5	-67.8	165.7	0	0	0	110.9	G404 K405 T410 Q411 L412 F441	G404-I408 VanDerWaalsContact O-CG1 3.32Å; G404-I408 WeakPolarHBondContact O-CG1 3.01Å; G404-I408 PolarHBondContact O-N 3.35Å; G404-I408 VanDerWaalsContact O-N 3.13Å; K405-I408 PolarHBondContact O-N 2.97Å; K405-I408 VanDerWaalsContact O-N 3.13Å; I408-T410 VanDerWaalsContact C-N 3.27Å; I408-T410 PolarHBondContact O-N 2.8Å; I408-Q411 PolarHBondContact O-N 2.96Å; I408-L412 VanDerWaalsContact O-CB 3.25Å; I408-L412 WeakPolarHBondContact O-CB 3.23Å; I408-L412 PolarHBondContact O-N 3.36Å; I408-F441 HydrophobicContact CB-CE1 4.31Å; I408-F441 HydrophobicContact CB-CZ 4.41Å; I408-F441 HydrophobicContact CD1-CE1 4.35Å; I408-F441 HydrophobicContact CD1-CE2 4.2Å; I408-F441 HydrophobicContact CD1-CZ 3.75Å; I408-F441 HydrophobicContact CG2-CD1 3.87Å; I408-F441 HydrophobicContact CG2-CD2 3.82Å; I408-F441 HydrophobicContact CG2-CE1 3.9Å; I408-F441 HydrophobicContact CG2-CE2 3.87Å; I408-F441 HydrophobicContact CG2-CG 3.83Å; I408-F441 HydrophobicContact CG2-CZ 3.91Å
409	E	83.1	Confident	84.1	Confident	85 Å²	85	83.7 Å²	83.7	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-33.7	177.8	-72.5	177.9	156.2	0	0	111.8	K405 E406 L412 A413 F441	K405-E409 WeakPolarHBondContact CE-OE1 3.48Å; K405-E409 WeakPolarHBondContact CE-OE2 3.23Å; K405-E409 HydrophobicContact CG-CG 4.32Å; K405-E409 IonicContact NZ-OE1 3.64Å; K405-E409 WeakPolarHBondContact O-CG 3.32Å; K405-E409 PolarHBondContact O-N 2.87Å; E406-E409 PolarHBondContact O-N 2.93Å; E409-L412 PolarHBondContact O-N 3.28Å; E409-A413 WeakPolarHBondContact O-CB 3.13Å; E409-A413 PolarHBondContact O-N 3.43Å; E409-F441 HydrophobicContact CG-CD1 4.42Å
410	T	84.9	Confident	83.8	Confident	77 Å²	77	87.2 Å²	87.2	47%	0.472	43%	0.429	S	S	.	.	H	α-helix	trans	-64.5	-52	172.1	-58.3	0	0	0	0	111.5	E406 A407 I408 L412 A413 E414	E406-T410 WeakPolarHBondContact O-CB 3.32Å; E406-T410 PolarHBondContact O-N 3.34Å; E406-T410 PolarHBondContact O-OG1 3.5Å; A407-T410 PolarHBondContact O-N 3.43Å; I408-T410 VanDerWaalsContact C-N 3.27Å; I408-T410 PolarHBondContact O-N 2.8Å; T410-L412 VanDerWaalsContact C-N 3.28Å; T410-L412 PolarHBondContact O-N 3.21Å; T410-A413 WeakPolarHBondContact O-CB 3.49Å; T410-A413 PolarHBondContact O-N 2.89Å; T410-A413 VanDerWaalsContact O-N 3.16Å; T410-E414 PolarHBondContact O-N 2.93Å
411	Q	85.2	Confident	83.7	Confident	142 Å²	142	90 Å²	90	66%	0.664	44%	0.441	S	S	*	.	H	α-helix	trans	-62.3	-35.6	176.7	-71.5	-173.7	-3.6	0	0	112.3	A407 I408 E414 Y415	A407-Q411 PolarHBondContact O-N 3.47Å; A407-Q411 VanDerWaalsContact O-N 3.09Å; I408-Q411 PolarHBondContact O-N 2.96Å; Q411-E414 PolarHBondContact O-N 2.91Å; Q411-Y415 WeakPolarHBondContact O-CB 3.19Å; Q411-Y415 PolarHBondContact O-N 2.93Å
412	L	85.1	Confident	83.3	Confident	29 Å²	29	88 Å²	88	15%	0.152	44%	0.44	C	S	.	.	H	α-helix	trans	-63.4	-42.2	174.8	-169.5	74.5	0	0	0	111.6	I408 E409 T410 Y415 H416 I439 F441	I408-L412 VanDerWaalsContact O-CB 3.25Å; I408-L412 WeakPolarHBondContact O-CB 3.23Å; I408-L412 PolarHBondContact O-N 3.36Å; E409-L412 PolarHBondContact O-N 3.28Å; T410-L412 VanDerWaalsContact C-N 3.28Å; T410-L412 PolarHBondContact O-N 3.21Å; L412-Y415 PolarHBondContact O-N 3.11Å; L412-H416 WeakPolarHBondContact CD2-NE2 3.09Å; L412-H416 WeakPolarHBondContact CG-NE2 3.33Å; L412-H416 WeakPolarHBondContact O-CB 3.41Å; L412-H416 PolarHBondContact O-CE1 3.21Å; L412-H416 VanDerWaalsContact O-CG 3.27Å; L412-H416 PolarHBondContact O-N 2.71Å; L412-H416 PolarHBondContact O-ND1 2.94Å; L412-I439 HydrophobicContact CD1-CB 3.64Å; L412-I439 HydrophobicContact CD1-CG2 3.49Å; L412-I439 VanDerWaalsContact CD1-CG2 3.49Å; L412-F441 HydrophobicContact CD2-CB 3.92Å
413	A	83.6	Confident	83	Confident	53 Å²	53	90.8 Å²	90.8	44%	0.438	44%	0.442	S	S	.	.	H	α-helix	trans	-65.5	-39.1	176.3	0	0	0	0	0	112.2	E409 T410 K417	E409-A413 WeakPolarHBondContact O-CB 3.13Å; E409-A413 PolarHBondContact O-N 3.43Å; T410-A413 WeakPolarHBondContact O-CB 3.49Å; T410-A413 PolarHBondContact O-N 2.89Å; T410-A413 VanDerWaalsContact O-N 3.16Å; A413-K417 VanDerWaalsContact O-CB 3.23Å; A413-K417 WeakPolarHBondContact O-CB 3.45Å; A413-K417 PolarHBondContact O-N 3.41Å
414	E	84.8	Confident	82.4	Confident	116 Å²	116	83.8 Å²	83.8	54%	0.542	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-44.6	172.8	-67.2	-161	134.1	0	0	112.4	T410 Q411 K417 L418	T410-E414 PolarHBondContact O-N 2.93Å; Q411-E414 PolarHBondContact O-N 2.91Å; E414-K417 WeakPolarHBondContact O-CB 3.46Å; E414-K417 PolarHBondContact O-N 2.81Å; E414-L418 WeakPolarHBondContact O-CG 3.38Å; E414-L418 PolarHBondContact O-N 3.07Å
415	Y	84.7	Confident	81.8	Confident	59 Å²	59	83.1 Å²	83.1	23%	0.231	41%	0.405	C	S	.	.	H	α-helix	trans	-58.2	-49.8	174.4	171.5	-101.2	0	0	0	111.6	Q411 L412 K417 L418 A419 F437 I439 V457	Q411-Y415 WeakPolarHBondContact O-CB 3.19Å; Q411-Y415 PolarHBondContact O-N 2.93Å; L412-Y415 PolarHBondContact O-N 3.11Å; Y415-K417 VanDerWaalsContact C-N 3.31Å; Y415-K417 PolarHBondContact O-N 2.64Å; Y415-L418 PolarHBondContact O-N 3.38Å; Y415-A419 WeakPolarHBondContact O-CB 3.31Å; Y415-A419 PolarHBondContact O-N 3.43Å; Y415-F437 WeakPolarHBondContact CE1-O 3.17Å; Y415-F437 PolarHBondContact OH-O 3Å; Y415-I439 HydrophobicContact CD1-CD1 3.94Å; Y415-I439 HydrophobicContact CD1-CG1 4.42Å; Y415-I439 HydrophobicContact CE1-CD1 3.68Å; Y415-I439 HydrophobicContact CE1-CG1 3.95Å; Y415-V457 WeakPolarHBondContact OH-CG1 3.5Å
416	H	83.9	Confident	81.1	Confident	33 Å²	33	83.9 Å²	83.9	15%	0.153	42%	0.418	C	S	.	.	H	α-helix	trans	-62.3	-36.1	176.3	-68.6	158.7	0	0	0	112.7	L412 A419 R420 I439	L412-H416 WeakPolarHBondContact CD2-NE2 3.09Å; L412-H416 WeakPolarHBondContact CG-NE2 3.33Å; L412-H416 WeakPolarHBondContact O-CB 3.41Å; L412-H416 PolarHBondContact O-CE1 3.21Å; L412-H416 VanDerWaalsContact O-CG 3.27Å; L412-H416 PolarHBondContact O-N 2.71Å; L412-H416 PolarHBondContact O-ND1 2.94Å; H416-A419 PolarHBondContact O-N 2.88Å; H416-R420 WeakPolarHBondContact O-CB 3.34Å; H416-R420 VanDerWaalsContact O-CG 3.24Å; H416-R420 WeakPolarHBondContact O-CG 3.45Å; H416-R420 PolarHBondContact O-N 3.08Å; H416-I439 PolarHBondContact NE2-O 3.45Å
417	K	84.9	Confident	80.3	Confident	145 Å²	145	83.1 Å²	83.1	63%	0.63	41%	0.413	S	S	*	.	H	α-helix	trans	-63.1	-42.3	175	178.1	-176.2	177.7	-174.8	0	111.4	A413 E414 Y415 K421	A413-K417 VanDerWaalsContact O-CB 3.23Å; A413-K417 WeakPolarHBondContact O-CB 3.45Å; A413-K417 PolarHBondContact O-N 3.41Å; E414-K417 WeakPolarHBondContact O-CB 3.46Å; E414-K417 PolarHBondContact O-N 2.81Å; Y415-K417 VanDerWaalsContact C-N 3.31Å; Y415-K417 PolarHBondContact O-N 2.64Å; K417-K421 PolarHBondContact O-N 3.14Å; K417-K421 VanDerWaalsContact O-N 3.15Å
418	L	82.6	Confident	79.3	Confident	107 Å²	107	84.3 Å²	84.3	56%	0.56	43%	0.43	S	S	*	.	H	α-helix	trans	-67.7	-47.1	174.5	-71.5	168.2	0	0	0	112	E414 Y415 R420 K421 L422	E414-L418 WeakPolarHBondContact O-CG 3.38Å; E414-L418 PolarHBondContact O-N 3.07Å; Y415-L418 PolarHBondContact O-N 3.38Å; L418-R420 VanDerWaalsContact C-N 3.34Å; L418-R420 PolarHBondContact O-N 3.34Å; L418-K421 WeakPolarHBondContact O-CA 3.28Å; L418-K421 WeakPolarHBondContact O-CB 3.4Å; L418-K421 PolarHBondContact O-N 2.77Å; L418-K421 VanDerWaalsContact O-N 3.07Å; L418-L422 WeakPolarHBondContact O-CG 3.49Å; L418-L422 PolarHBondContact O-N 3Å
419	A	77.7	Confident	78.5	Confident	3 Å²	3	81.9 Å²	81.9	3%	0.025	42%	0.421	C	S	.	.	H	α-helix	trans	-64.4	-34.6	-179.8	0	0	0	0	0	112.9	Y415 H416 L422 K423 L424 I425	Y415-A419 WeakPolarHBondContact O-CB 3.31Å; Y415-A419 PolarHBondContact O-N 3.43Å; H416-A419 PolarHBondContact O-N 2.88Å; A419-L422 PolarHBondContact O-N 3.23Å; A419-K423 PolarHBondContact O-N 2.83Å; A419-L424 HydrophobicContact CB-CB 4.4Å; A419-L424 WeakPolarHBondContact O-CB 3.26Å; A419-L424 PolarHBondContact O-N 2.85Å; A419-I425 HydrophobicContact CB-CD1 3.55Å; A419-I425 HydrophobicContact CB-CG1 3.86Å
420	R	81.3	Confident	77.7	Confident	144 Å²	144	84.8 Å²	84.8	54%	0.543	44%	0.435	S	S	.	.	H	α-helix	trans	-65	-44.5	168.4	-72	178.3	-140.2	127.5	-0.8	111.9	H416 L418 L422 K423 I425	H416-R420 WeakPolarHBondContact O-CB 3.34Å; H416-R420 VanDerWaalsContact O-CG 3.24Å; H416-R420 WeakPolarHBondContact O-CG 3.45Å; H416-R420 PolarHBondContact O-N 3.08Å; L418-R420 VanDerWaalsContact C-N 3.34Å; L418-R420 PolarHBondContact O-N 3.34Å; R420-L422 PolarHBondContact O-N 2.72Å; R420-K423 PolarHBondContact O-N 3.28Å; R420-I425 HydrophobicContact CG-CB 4.34Å
421	K	82.2	Confident	76.8	Confident	178 Å²	178	85 Å²	85	77%	0.774	43%	0.433	S	S	*	.	H	α-helix	trans	-59.9	-34.3	176.9	-173	-177.1	177.5	-173.6	0	112.3	K417 L418 K423	K417-K421 PolarHBondContact O-N 3.14Å; K417-K421 VanDerWaalsContact O-N 3.15Å; L418-K421 WeakPolarHBondContact O-CA 3.28Å; L418-K421 WeakPolarHBondContact O-CB 3.4Å; L418-K421 PolarHBondContact O-N 2.77Å; L418-K421 VanDerWaalsContact O-N 3.07Å; K421-K423 VanDerWaalsContact C-N 3.31Å
422	L	76.8	Confident	75.8	Confident	101 Å²	101	78.4 Å²	78.4	53%	0.529	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	2.4	177.3	-66.6	172.6	0	0	0	114.3	L418 A419 R420 L424 N431	L418-L422 WeakPolarHBondContact O-CG 3.49Å; L418-L422 PolarHBondContact O-N 3Å; A419-L422 PolarHBondContact O-N 3.23Å; R420-L422 PolarHBondContact O-N 2.72Å; L422-L424 VanDerWaalsContact C-N 3.33Å; L422-L424 HydrophobicContact CB-CD1 3.97Å; L422-L424 HydrophobicContact CB-CG 3.97Å; L422-L424 HydrophobicContact CD1-CD1 4.19Å; L422-L424 PolarHBondContact O-N 3.4Å; L422-N431 PolarHBondContact O-ND2 3.14Å
423	K	76.9	Confident	74.8	Confident	107 Å²	107	82.9 Å²	82.9	47%	0.465	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	41.9	-173.9	-51.9	-174.7	-173.2	-176.8	0	113.5	A419 R420 K421 A429 E430 N431	A419-K423 PolarHBondContact O-N 2.83Å; R420-K423 PolarHBondContact O-N 3.28Å; K421-K423 VanDerWaalsContact C-N 3.31Å; K423-A429 HydrophobicContact CB-CB 4.33Å; K423-A429 CarbonylContact O-C 3.55Å; K423-A429 WeakPolarHBondContact O-CB 3.31Å; K423-E430 HydrophobicContact CB-CB 4.39Å; K423-E430 HydrophobicContact CD-CB 3.98Å; K423-E430 WeakPolarHBondContact CD-OE2 3.26Å; K423-E430 WeakPolarHBondContact CE-OE2 3.37Å; K423-E430 IonicContact NZ-OE2 2.57Å; K423-E430 PolarHBondContact NZ-OE2 3.12Å; K423-N431 PolarHBondContact O-N 3.49Å; K423-N431 VanDerWaalsContact O-N 3.15Å
424	L	73.1	Confident	74	Confident	12 Å²	12	83 Å²	83	6%	0.063	43%	0.428	C	S	.	.			trans	-101.9	-23.7	175.7	-62.6	174.6	0	0	0	113.4	A419 L422 N431 S432 F437 L461 L464	A419-L424 HydrophobicContact CB-CB 4.4Å; A419-L424 WeakPolarHBondContact O-CB 3.26Å; A419-L424 PolarHBondContact O-N 2.85Å; L422-L424 VanDerWaalsContact C-N 3.33Å; L422-L424 HydrophobicContact CB-CD1 3.97Å; L422-L424 HydrophobicContact CB-CG 3.97Å; L422-L424 HydrophobicContact CD1-CD1 4.19Å; L422-L424 PolarHBondContact O-N 3.4Å; L424-N431 HydrophobicContact CD2-CB 3.88Å; L424-N431 WeakPolarHBondContact CD2-O 3.3Å; L424-S432 WeakPolarHBondContact O-CB 3.38Å; L424-F437 HydrophobicContact CB-CB 4.36Å; L424-F437 HydrophobicContact CB-CD2 3.88Å; L424-F437 HydrophobicContact CB-CE2 4.48Å; L424-F437 HydrophobicContact CB-CG 4.19Å; L424-F437 HydrophobicContact CD2-CD2 4.4Å; L424-F437 HydrophobicContact CD2-CE2 4.16Å; L424-F437 WeakPolarHBondContact O-CD2 3.31Å; L424-L461 HydrophobicContact CD1-CD2 4.07Å; L424-L464 HydrophobicContact CD2-CD1 4.22Å
425	I	72.1	Confident	73.5	Confident	19 Å²	19	82.6 Å²	82.6	10%	0.097	42%	0.422	C	S	.	.	S	Bend	trans	-122.3	131.6	174.9	-58.6	175	0	0	0	107.7	A419 R420 F437 E438	A419-I425 HydrophobicContact CB-CD1 3.55Å; A419-I425 HydrophobicContact CB-CG1 3.86Å; R420-I425 HydrophobicContact CG-CB 4.34Å; I425-F437 HydrophobicContact CD1-CB 4.4Å; I425-F437 WeakPolarHBondContact CD1-O 3.41Å; I425-F437 HydrophobicContact CG1-CB 3.87Å; I425-E438 HydrophobicContact CD1-CB 4.44Å
426	P	68.2	Low	73.1	Confident	98 Å²	98	81.4 Å²	81.4	64%	0.636	42%	0.419	S	S	*	.	S	Bend	cis	-74.7	178.2	3.2	-16.3	32.7	0	0	0	114.9	G428 A429	P426-G428 PolarHBondContact O-N 3.3Å; P426-A429 WeakPolarHBondContact O-CB 3.41Å; P426-A429 PolarHBondContact O-N 2.95Å
427	K	66.9	Low	72.7	Confident	111 Å²	111	79.9 Å²	79.9	48%	0.483	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-12.6	-179	-42.2	-170.9	-173	-148.6	0	116.6	S432 G434 D436	K427-S432 PolarHBondContact O-OG 2.85Å; K427-G434 WeakPolarHBondContact O-CA 3.25Å; K427-D436 HydrophobicContact CD-CB 3.89Å; K427-D436 WeakPolarHBondContact CE-OD1 3.39Å; K427-D436 WeakPolarHBondContact CE-OD2 3.07Å; K427-D436 HydrophobicContact CG-CB 4.15Å; K427-D436 IonicContact NZ-OD1 2.65Å; K427-D436 IonicContact NZ-OD2 3.53Å; K427-D436 PolarHBondContact NZ-OD2 2.75Å
428	G	64.3	Low	72.5	Confident	79 Å²	79	76.2 Å²	76.2	81%	0.814	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	11.6	176.3	0	0	0	0	0	113.3	P426	P426-G428 PolarHBondContact O-N 3.3Å
429	A	66.4	Low	72.3	Confident	21 Å²	21	72.8 Å²	72.8	17%	0.174	38%	0.379	C	S	.	.	S	Bend	trans	-75.1	151.8	177.9	0	0	0	0	0	111.3	K423 P426 N431 S432	K423-A429 HydrophobicContact CB-CB 4.33Å; K423-A429 CarbonylContact O-C 3.55Å; K423-A429 WeakPolarHBondContact O-CB 3.31Å; P426-A429 WeakPolarHBondContact O-CB 3.41Å; P426-A429 PolarHBondContact O-N 2.95Å; A429-N431 VanDerWaalsContact C-N 3.26Å; A429-N431 PolarHBondContact O-N 3.5Å; A429-S432 PolarHBondContact N-OG 3.3Å; A429-S432 VanDerWaalsContact O-CB 3.31Å; A429-S432 WeakPolarHBondContact O-CB 3.45Å; A429-S432 PolarHBondContact O-N 3.45Å; A429-S432 PolarHBondContact O-OG 3.39Å
430	E	67.4	Low	72.2	Confident	146 Å²	146	78.2 Å²	78.2	68%	0.682	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-37	-166.6	-165.8	173	-158.2	0	0	115.2	K423	K423-E430 HydrophobicContact CB-CB 4.39Å; K423-E430 HydrophobicContact CD-CB 3.98Å; K423-E430 WeakPolarHBondContact CD-OE2 3.26Å; K423-E430 WeakPolarHBondContact CE-OE2 3.37Å; K423-E430 IonicContact NZ-OE2 2.57Å; K423-E430 PolarHBondContact NZ-OE2 3.12Å
431	N	65.1	Low	71.8	Confident	82 Å²	82	74.3 Å²	74.3	44%	0.439	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-3.1	-178.4	-63.4	-31.5	0	0	0	113.7	L422 K423 L424 A429 K433	L422-N431 PolarHBondContact O-ND2 3.14Å; K423-N431 PolarHBondContact O-N 3.49Å; K423-N431 VanDerWaalsContact O-N 3.15Å; L424-N431 HydrophobicContact CD2-CB 3.88Å; L424-N431 WeakPolarHBondContact CD2-O 3.3Å; A429-N431 VanDerWaalsContact C-N 3.26Å; A429-N431 PolarHBondContact O-N 3.5Å; N431-K433 VanDerWaalsContact C-N 3.33Å; N431-K433 PolarHBondContact O-N 2.9Å
432	S	63.4	Low	71.2	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.021	37%	0.371	C	S	.	.	S	Bend	trans	-73.6	-18.9	-171.8	66.9	0	0	0	0	114.7	L424 K427 A429 G434 Y435	L424-S432 WeakPolarHBondContact O-CB 3.38Å; K427-S432 PolarHBondContact O-OG 2.85Å; A429-S432 PolarHBondContact N-OG 3.3Å; A429-S432 VanDerWaalsContact O-CB 3.31Å; A429-S432 WeakPolarHBondContact O-CB 3.45Å; A429-S432 PolarHBondContact O-N 3.45Å; A429-S432 PolarHBondContact O-OG 3.39Å; S432-G434 PolarHBondContact O-N 2.81Å; S432-Y435 PolarHBondContact O-N 2.82Å
433	K	64.4	Low	70.6	Confident	124 Å²	124	66.6 Å²	66.6	54%	0.539	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	24.7	-171.9	-65.3	-169.2	179.3	177.5	0	114.8	N431 Y435 L464 E467	N431-K433 VanDerWaalsContact C-N 3.33Å; N431-K433 PolarHBondContact O-N 2.9Å; K433-Y435 HydrophobicContact CB-CD2 4.04Å; K433-Y435 HydrophobicContact CB-CE2 4.22Å; K433-L464 HydrophobicContact CD-CD2 3.66Å; K433-L464 HydrophobicContact CG-CD2 4.07Å; K433-E467 IonicContact NZ-OE1 3.47Å; K433-E467 PolarHBondContact NZ-OE1 2.97Å; K433-E467 IonicContact NZ-OE2 3.5Å; K433-E467 PolarHBondContact NZ-OE2 2.98Å
434	G	67.8	Low	70.1	Confident	56 Å²	56	69.9 Å²	69.9	58%	0.577	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-3.2	-178.1	0	0	0	0	0	115.7	K427 S432	K427-G434 WeakPolarHBondContact O-CA 3.25Å; S432-G434 PolarHBondContact O-N 2.81Å
435	Y	74.1	Confident	69.6	Low	107 Å²	107	71.6 Å²	71.6	42%	0.42	39%	0.392	S	S	.	.			trans	-79	157.3	178.9	-67.2	-91.7	0	0	0	112.5	S432 K433 P460	S432-Y435 PolarHBondContact O-N 2.82Å; K433-Y435 HydrophobicContact CB-CD2 4.04Å; K433-Y435 HydrophobicContact CB-CE2 4.22Å; Y435-P460 HydrophobicContact CD1-CB 3.58Å; Y435-P460 HydrophobicContact CD1-CG 3.34Å; Y435-P460 HydrophobicContact CD2-CB 4.19Å; Y435-P460 HydrophobicContact CE1-CB 3.87Å; Y435-P460 HydrophobicContact CE1-CG 3.57Å; Y435-P460 HydrophobicContact CE2-CB 4.48Å; Y435-P460 HydrophobicContact CG-CB 3.74Å; Y435-P460 HydrophobicContact CG-CG 4.01Å
436	D	76.1	Confident	69.3	Low	33 Å²	33	72.6 Å²	72.6	18%	0.176	41%	0.407	C	S	.	.			trans	-103.3	91.2	-176.7	-171.9	15	0	0	0	112.5	K427 E438 Q456	K427-D436 HydrophobicContact CD-CB 3.89Å; K427-D436 WeakPolarHBondContact CE-OD1 3.39Å; K427-D436 WeakPolarHBondContact CE-OD2 3.07Å; K427-D436 HydrophobicContact CG-CB 4.15Å; K427-D436 IonicContact NZ-OD1 2.65Å; K427-D436 IonicContact NZ-OD2 3.53Å; K427-D436 PolarHBondContact NZ-OD2 2.75Å; D436-E438 PolarHBondContact O-N 3Å; D436-E438 WeakPolarHBondContact OD1-CB 3.45Å; D436-E438 PolarHBondContact OD1-N 2.82Å; D436-Q456 HydrophobicContact CB-CG 4.49Å; D436-Q456 WeakPolarHBondContact O-CG 3.49Å; D436-Q456 PolarHBondContact O-NE2 2.91Å; D436-Q456 PolarHBondContact OD2-NE2 2.88Å
437	F	75.8	Confident	69.1	Low	1 Å²	1	71.6 Å²	71.6	0%	0.004	41%	0.407	C	S	.	.			trans	-81.3	5.6	177.6	-59.5	-77.7	0	0	0	113.8	Y415 L424 I425 I439 V457 P460 L461 L464	Y415-F437 WeakPolarHBondContact CE1-O 3.17Å; Y415-F437 PolarHBondContact OH-O 3Å; L424-F437 HydrophobicContact CB-CB 4.36Å; L424-F437 HydrophobicContact CB-CD2 3.88Å; L424-F437 HydrophobicContact CB-CE2 4.48Å; L424-F437 HydrophobicContact CB-CG 4.19Å; L424-F437 HydrophobicContact CD2-CD2 4.4Å; L424-F437 HydrophobicContact CD2-CE2 4.16Å; L424-F437 WeakPolarHBondContact O-CD2 3.31Å; I425-F437 HydrophobicContact CD1-CB 4.4Å; I425-F437 WeakPolarHBondContact CD1-O 3.41Å; I425-F437 HydrophobicContact CG1-CB 3.87Å; F437-I439 PolarHBondContact O-N 2.88Å; F437-V457 HydrophobicContact CD1-CG1 4.09Å; F437-P460 HydrophobicContact CE1-CB 4.04Å; F437-P460 HydrophobicContact CZ-CB 3.96Å; F437-L461 HydrophobicContact CD1-CD1 3.76Å; F437-L461 HydrophobicContact CD1-CG 3.96Å; F437-L461 HydrophobicContact CE1-CB 4.27Å; F437-L461 HydrophobicContact CE1-CD1 3.96Å; F437-L461 HydrophobicContact CE1-CG 3.63Å; F437-L464 HydrophobicContact CE2-CD1 4.33Å; F437-L464 HydrophobicContact CZ-CD1 3.76Å
438	E	79.3	Confident	69.1	Low	69 Å²	69	72.3 Å²	72.3	32%	0.322	42%	0.416	S	S	.	.			trans	-82.7	106.3	178.2	-168.9	176.7	-139.9	0	0	112.2	I425 D436 K440	I425-E438 HydrophobicContact CD1-CB 4.44Å; D436-E438 PolarHBondContact O-N 3Å; D436-E438 WeakPolarHBondContact OD1-CB 3.45Å; D436-E438 PolarHBondContact OD1-N 2.82Å; E438-K440 HydrophobicContact CG-CG 4.49Å; E438-K440 WeakPolarHBondContact OE2-CE 3.29Å; E438-K440 IonicContact OE2-NZ 2.7Å; E438-K440 PolarHBondContact OE2-NZ 3.03Å
439	I	79.2	Confident	69.2	Low	34 Å²	34	69.4 Å²	69.4	17%	0.174	38%	0.383	C	S	.	.			trans	-82.3	126.8	175.3	-61.4	174.7	0	0	0	109.1	L412 Y415 H416 F437 Y453 V457	L412-I439 HydrophobicContact CD1-CB 3.64Å; L412-I439 HydrophobicContact CD1-CG2 3.49Å; L412-I439 VanDerWaalsContact CD1-CG2 3.49Å; Y415-I439 HydrophobicContact CD1-CD1 3.94Å; Y415-I439 HydrophobicContact CD1-CG1 4.42Å; Y415-I439 HydrophobicContact CE1-CD1 3.68Å; Y415-I439 HydrophobicContact CE1-CG1 3.95Å; H416-I439 PolarHBondContact NE2-O 3.45Å; F437-I439 PolarHBondContact O-N 2.88Å; I439-Y453 HydrophobicContact CB-CD1 4.32Å; I439-Y453 HydrophobicContact CB-CE1 4.37Å; I439-Y453 HydrophobicContact CG1-CD1 4.05Å; I439-Y453 HydrophobicContact CG1-CG 4.32Å; I439-Y453 HydrophobicContact CG2-CD1 4.07Å; I439-Y453 HydrophobicContact CG2-CD2 3.86Å; I439-Y453 HydrophobicContact CG2-CE1 4.09Å; I439-Y453 HydrophobicContact CG2-CE2 3.84Å; I439-Y453 HydrophobicContact CG2-CG 4Å; I439-V457 HydrophobicContact CD1-CG1 4.33Å; I439-V457 HydrophobicContact CD1-CG2 4.49Å; I439-V457 HydrophobicContact CG1-CG1 4.48Å; I439-V457 HydrophobicContact CG1-CG2 3.89Å
440	K	75.3	Confident	69.2	Low	118 Å²	118	74.1 Å²	74.1	51%	0.513	41%	0.405	S	S	.	.			trans	-112.9	98.4	177.3	-73.7	172.2	178	151.7	0	110.3	E438 N442 Y453	E438-K440 HydrophobicContact CG-CG 4.49Å; E438-K440 WeakPolarHBondContact OE2-CE 3.29Å; E438-K440 IonicContact OE2-NZ 2.7Å; E438-K440 PolarHBondContact OE2-NZ 3.03Å; K440-N442 PolarHBondContact O-N 3.45Å; K440-Y453 WeakPolarHBondContact CA-OH 3.14Å; K440-Y453 PolarHBondContact N-OH 2.97Å; K440-Y453 VanDerWaalsContact N-OH 3.11Å; K440-Y453 PolarHBondContact O-OH 2.95Å
441	F	72.5	Confident	69.3	Low	61 Å²	61	71.9 Å²	71.9	27%	0.268	40%	0.401	S	S	.	.			trans	-66.2	119	-178.8	-175.5	-120	0	0	0	110.7	K405 I408 E409 L412 P443	K405-F441 HydrophobicContact CG-CE1 4.31Å; I408-F441 HydrophobicContact CB-CE1 4.31Å; I408-F441 HydrophobicContact CB-CZ 4.41Å; I408-F441 HydrophobicContact CD1-CE1 4.35Å; I408-F441 HydrophobicContact CD1-CE2 4.2Å; I408-F441 HydrophobicContact CD1-CZ 3.75Å; I408-F441 HydrophobicContact CG2-CD1 3.87Å; I408-F441 HydrophobicContact CG2-CD2 3.82Å; I408-F441 HydrophobicContact CG2-CE1 3.9Å; I408-F441 HydrophobicContact CG2-CE2 3.87Å; I408-F441 HydrophobicContact CG2-CG 3.83Å; I408-F441 HydrophobicContact CG2-CZ 3.91Å; E409-F441 HydrophobicContact CG-CD1 4.42Å; L412-F441 HydrophobicContact CD2-CB 3.92Å; F441-P443 HydrophobicContact CD1-CG 4.35Å; F441-P443 HydrophobicContact CE1-CG 3.76Å; F441-P443 HydrophobicContact CZ-CB 4.45Å; F441-P443 HydrophobicContact CZ-CG 4.12Å
442	N	69.7	Low	69.6	Low	73 Å²	73	75 Å²	75	39%	0.39	41%	0.411	S	S	.	.			trans	-123.8	114.5	167.2	-179.7	-6.5	0	0	0	107.6	K440 E444 A445	K440-N442 PolarHBondContact O-N 3.45Å; N442-E444 VanDerWaalsContact C-N 3.28Å; N442-E444 PolarHBondContact O-N 3.08Å; N442-E444 WeakPolarHBondContact OD1-CB 3.2Å; N442-E444 PolarHBondContact OD1-N 2.81Å; N442-A445 HydrophobicContact CB-CB 4.31Å; N442-A445 PolarHBondContact O-N 3.05Å
443	P	65.1	Low	70.1	Confident	44 Å²	44	77.1 Å²	77.1	29%	0.286	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-58.9	-35.7	177.8	-23.2	32.6	0	0	0	114	Y401 F441 A445	Y401-P443 HydrophobicContact CE2-CB 4.4Å; Y401-P443 WeakPolarHBondContact OH-CB 3.44Å; F441-P443 HydrophobicContact CD1-CG 4.35Å; F441-P443 HydrophobicContact CE1-CG 3.76Å; F441-P443 HydrophobicContact CZ-CB 4.45Å; F441-P443 HydrophobicContact CZ-CG 4.12Å; P443-A445 VanDerWaalsContact C-N 3.26Å; P443-A445 PolarHBondContact O-N 3.5Å
444	E	65.9	Low	70.5	Confident	177 Å²	177	79.3 Å²	79.3	83%	0.827	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-73.4	-18.4	-172.3	-58.6	175.3	162.6	0	0	112.9	N442 G446	N442-E444 VanDerWaalsContact C-N 3.28Å; N442-E444 PolarHBondContact O-N 3.08Å; N442-E444 WeakPolarHBondContact OD1-CB 3.2Å; N442-E444 PolarHBondContact OD1-N 2.81Å; E444-G446 PolarHBondContact O-N 2.73Å
445	A	62.8	Low	70.7	Confident	47 Å²	47	79.8 Å²	79.8	39%	0.388	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-74.9	-7.7	-177.7	0	0	0	0	0	114.2	N442 P443 C449	N442-A445 HydrophobicContact CB-CB 4.31Å; N442-A445 PolarHBondContact O-N 3.05Å; P443-A445 VanDerWaalsContact C-N 3.26Å; P443-A445 PolarHBondContact O-N 3.5Å; A445-C449 HydrophobicContact CB-CB 3.88Å
446	G	66	Low	70.7	Confident	40 Å²	40	77.6 Å²	77.6	41%	0.412	42%	0.415	S	S	.	.			trans	59.9	-167	177.5	0	0	0	0	0	114.6	E444 N448 C449	E444-G446 PolarHBondContact O-N 2.73Å; G446-N448 PolarHBondContact O-N 3.49Å; G446-C449 PolarHBondContact O-N 3.24Å; G446-C449 PolarHBondContact O-SG 3.39Å
447	A	64.5	Low	70.6	Confident	77 Å²	77	76.4 Å²	76.4	64%	0.636	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-21	-177.3	0	0	0	0	0	114.2	C449 L450	A447-C449 PolarHBondContact O-N 2.97Å; A447-L450 WeakPolarHBondContact O-CB 3.46Å; A447-L450 PolarHBondContact O-N 2.82Å; A447-L450 VanDerWaalsContact O-N 3.15Å
448	N	66.3	Low	70.7	Confident	127 Å²	127	82.9 Å²	82.9	68%	0.679	43%	0.434	S	S	*	.	H	α-helix	trans	-64.4	-22.7	176.9	-71.4	-26.2	0	0	0	113.3	G446 K452	G446-N448 PolarHBondContact O-N 3.49Å; N448-K452 PolarHBondContact O-N 3.1Å
449	C	65.1	Low	70.6	Confident	18 Å²	18	82.7 Å²	82.7	12%	0.122	44%	0.438	C	S	.	.	H	α-helix	trans	-69.8	-35.1	173.7	78.1	0	0	0	0	112	A445 G446 A447 V451 K452 Y453	A445-C449 HydrophobicContact CB-CB 3.88Å; G446-C449 PolarHBondContact O-N 3.24Å; G446-C449 PolarHBondContact O-SG 3.39Å; A447-C449 PolarHBondContact O-N 2.97Å; C449-V451 VanDerWaalsContact C-N 3.34Å; C449-V451 PolarHBondContact O-N 3.34Å; C449-K452 WeakPolarHBondContact O-CB 3.29Å; C449-K452 PolarHBondContact O-N 2.98Å; C449-Y453 HydrophobicContact CB-CD2 4.48Å; C449-Y453 HydrophobicContact CB-CE2 4.16Å; C449-Y453 WeakPolarHBondContact O-CD2 3.3Å; C449-Y453 PolarHBondContact O-N 3.48Å
450	L	66.8	Low	70.3	Confident	119 Å²	119	81.3 Å²	81.3	62%	0.623	43%	0.431	S	S	*	.	H	α-helix	trans	-66.2	-37.1	178.5	-58.5	176.4	0	0	0	111.6	A447 Y453 R454	A447-L450 WeakPolarHBondContact O-CB 3.46Å; A447-L450 PolarHBondContact O-N 2.82Å; A447-L450 VanDerWaalsContact O-N 3.15Å; L450-Y453 PolarHBondContact O-N 3.04Å; L450-R454 WeakPolarHBondContact O-CB 3.46Å; L450-R454 PolarHBondContact O-N 3.46Å
451	V	70.1	Confident	70.4	Confident	99 Å²	99	78.5 Å²	78.5	60%	0.6	42%	0.421	S	S	*	.	H	α-helix	trans	-64.2	-43.8	174.2	-176	0	0	0	0	110.7	C449 R454 A455	C449-V451 VanDerWaalsContact C-N 3.34Å; C449-V451 PolarHBondContact O-N 3.34Å; V451-R454 PolarHBondContact O-N 3.37Å; V451-A455 PolarHBondContact O-N 2.98Å; V451-A455 VanDerWaalsContact O-N 3.13Å
452	K	72.3	Confident	70.6	Confident	149 Å²	149	79.2 Å²	79.2	65%	0.648	42%	0.424	S	S	*	.	H	α-helix	trans	-60.2	-48.9	174.5	-72.8	-176.5	177.4	-177.4	0	111.8	N448 C449 R454 A455 Q456	N448-K452 PolarHBondContact O-N 3.1Å; C449-K452 WeakPolarHBondContact O-CB 3.29Å; C449-K452 PolarHBondContact O-N 2.98Å; K452-R454 VanDerWaalsContact C-N 3.32Å; K452-R454 PolarHBondContact O-N 2.86Å; K452-A455 PolarHBondContact O-N 3.44Å; K452-Q456 VanDerWaalsContact O-CB 3.23Å; K452-Q456 WeakPolarHBondContact O-CB 3.29Å; K452-Q456 PolarHBondContact O-N 3.31Å
453	Y	73.1	Confident	71	Confident	46 Å²	46	80 Å²	80	18%	0.18	43%	0.426	C	S	.	.	H	α-helix	trans	-66.9	-30.9	179.1	-65.6	-50.7	0	0	0	113.1	I439 K440 C449 L450 A455 V457 Y458	I439-Y453 HydrophobicContact CB-CD1 4.32Å; I439-Y453 HydrophobicContact CB-CE1 4.37Å; I439-Y453 HydrophobicContact CG1-CD1 4.05Å; I439-Y453 HydrophobicContact CG1-CG 4.32Å; I439-Y453 HydrophobicContact CG2-CD1 4.07Å; I439-Y453 HydrophobicContact CG2-CD2 3.86Å; I439-Y453 HydrophobicContact CG2-CE1 4.09Å; I439-Y453 HydrophobicContact CG2-CE2 3.84Å; I439-Y453 HydrophobicContact CG2-CG 4Å; K440-Y453 WeakPolarHBondContact CA-OH 3.14Å; K440-Y453 PolarHBondContact N-OH 2.97Å; K440-Y453 VanDerWaalsContact N-OH 3.11Å; K440-Y453 PolarHBondContact O-OH 2.95Å; C449-Y453 HydrophobicContact CB-CD2 4.48Å; C449-Y453 HydrophobicContact CB-CE2 4.16Å; C449-Y453 WeakPolarHBondContact O-CD2 3.3Å; C449-Y453 PolarHBondContact O-N 3.48Å; L450-Y453 PolarHBondContact O-N 3.04Å; Y453-A455 PolarHBondContact O-N 2.84Å; Y453-V457 HydrophobicContact CD1-CG2 4.34Å; Y453-V457 WeakPolarHBondContact O-CA 3.31Å; Y453-V457 VanDerWaalsContact O-CB 3.25Å; Y453-V457 WeakPolarHBondContact O-CB 3.46Å; Y453-V457 PolarHBondContact O-N 3.04Å; Y453-Y458 PolarHBondContact O-N 3.01Å
454	R	72.1	Confident	71.4	Confident	171 Å²	171	79.1 Å²	79.1	65%	0.645	42%	0.419	S	S	*	.	I	π-helix	trans	-64	-39.9	171.9	-166	173.4	-174.2	168.1	1.3	112.3	L450 V451 K452 Y458 V459	L450-R454 WeakPolarHBondContact O-CB 3.46Å; L450-R454 PolarHBondContact O-N 3.46Å; V451-R454 PolarHBondContact O-N 3.37Å; K452-R454 VanDerWaalsContact C-N 3.32Å; K452-R454 PolarHBondContact O-N 2.86Å; R454-Y458 HydrophobicContact CG-CD1 4.35Å; R454-Y458 WeakPolarHBondContact O-CB 3.38Å; R454-Y458 PolarHBondContact O-N 3.24Å; R454-V459 PolarHBondContact O-N 3.38Å; R454-V459 VanDerWaalsContact O-N 3.16Å
455	A	72.6	Confident	72	Confident	65 Å²	65	75 Å²	75	54%	0.537	40%	0.402	S	S	.	.	I	π-helix	trans	-75.3	-42.8	175.8	0	0	0	0	0	113.1	V451 K452 Y453 P460	V451-A455 PolarHBondContact O-N 2.98Å; V451-A455 VanDerWaalsContact O-N 3.13Å; K452-A455 PolarHBondContact O-N 3.44Å; Y453-A455 PolarHBondContact O-N 2.84Å; A455-P460 WeakPolarHBondContact O-CD 3.5Å
456	Q	74.4	Confident	72.8	Confident	61 Å²	61	76.2 Å²	76.2	29%	0.285	40%	0.402	S	S	.	.	I	π-helix	trans	-74.1	-38.3	-175.5	179.1	-173.1	-29.8	0	0	113.2	D436 K452 P460	D436-Q456 HydrophobicContact CB-CG 4.49Å; D436-Q456 WeakPolarHBondContact O-CG 3.49Å; D436-Q456 PolarHBondContact O-NE2 2.91Å; D436-Q456 PolarHBondContact OD2-NE2 2.88Å; K452-Q456 VanDerWaalsContact O-CB 3.23Å; K452-Q456 WeakPolarHBondContact O-CB 3.29Å; K452-Q456 PolarHBondContact O-N 3.31Å; Q456-P460 WeakPolarHBondContact O-CG 3.5Å
457	V	73.5	Confident	73.2	Confident	8 Å²	8	78.4 Å²	78.4	5%	0.048	40%	0.401	C	S	.	.	I	π-helix	trans	-112.9	-53.1	-167.6	-179.6	0	0	0	0	111.1	Y415 F437 I439 Y453 L461	Y415-V457 WeakPolarHBondContact OH-CG1 3.5Å; F437-V457 HydrophobicContact CD1-CG1 4.09Å; I439-V457 HydrophobicContact CD1-CG1 4.33Å; I439-V457 HydrophobicContact CD1-CG2 4.49Å; I439-V457 HydrophobicContact CG1-CG1 4.48Å; I439-V457 HydrophobicContact CG1-CG2 3.89Å; Y453-V457 HydrophobicContact CD1-CG2 4.34Å; Y453-V457 WeakPolarHBondContact O-CA 3.31Å; Y453-V457 VanDerWaalsContact O-CB 3.25Å; Y453-V457 WeakPolarHBondContact O-CB 3.46Å; Y453-V457 PolarHBondContact O-N 3.04Å; V457-L461 HydrophobicContact CG1-CD1 3.95Å; V457-L461 WeakPolarHBondContact O-CB 3.45Å; V457-L461 PolarHBondContact O-N 3.44Å; V457-L461 VanDerWaalsContact O-N 3.13Å
458	Y	77.4	Confident	73.6	Confident	137 Å²	137	78.2 Å²	78.2	54%	0.537	39%	0.392	S	S	.	.	I	π-helix	trans	-71.5	-39.9	-172.7	177.2	-85.2	0	0	0	113.2	Y453 R454 K462	Y453-Y458 PolarHBondContact O-N 3.01Å; R454-Y458 HydrophobicContact CG-CD1 4.35Å; R454-Y458 WeakPolarHBondContact O-CB 3.38Å; R454-Y458 PolarHBondContact O-N 3.24Å; Y458-K462 WeakPolarHBondContact O-CB 3.19Å; Y458-K462 PolarHBondContact O-N 3.18Å
459	V	77.2	Confident	74	Confident	65 Å²	65	77 Å²	77	39%	0.394	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-53.4	178.2	172	0	0	0	0	111.5	R454 L461 K462 E463	R454-V459 PolarHBondContact O-N 3.38Å; R454-V459 VanDerWaalsContact O-N 3.16Å; V459-L461 VanDerWaalsContact C-N 3.32Å; V459-L461 PolarHBondContact O-N 2.86Å; V459-K462 PolarHBondContact O-N 2.89Å; V459-E463 HydrophobicContact CG1-CG 4.47Å; V459-E463 WeakPolarHBondContact O-CG 3.2Å; V459-E463 PolarHBondContact O-N 2.87Å
460	P	74.6	Confident	74.5	Confident	6 Å²	6	81.5 Å²	81.5	4%	0.039	40%	0.402	C	S	.	.	H	α-helix	trans	-64.1	-31.7	177.5	-25.1	36.8	0	0	0	114	Y435 F437 A455 Q456 E463 L464	Y435-P460 HydrophobicContact CD1-CB 3.58Å; Y435-P460 HydrophobicContact CD1-CG 3.34Å; Y435-P460 HydrophobicContact CD2-CB 4.19Å; Y435-P460 HydrophobicContact CE1-CB 3.87Å; Y435-P460 HydrophobicContact CE1-CG 3.57Å; Y435-P460 HydrophobicContact CE2-CB 4.48Å; Y435-P460 HydrophobicContact CG-CB 3.74Å; Y435-P460 HydrophobicContact CG-CG 4.01Å; F437-P460 HydrophobicContact CE1-CB 4.04Å; F437-P460 HydrophobicContact CZ-CB 3.96Å; A455-P460 WeakPolarHBondContact O-CD 3.5Å; Q456-P460 WeakPolarHBondContact O-CG 3.5Å; P460-E463 PolarHBondContact O-N 2.88Å; P460-L464 WeakPolarHBondContact O-CB 3.48Å; P460-L464 WeakPolarHBondContact O-CG 3.16Å; P460-L464 PolarHBondContact O-N 3.19Å
461	L	75.5	Confident	74.7	Confident	58 Å²	58	81 Å²	81	30%	0.304	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-36.2	171.7	-101.8	155.2	0	0	0	112.4	L424 F437 V457 V459 L465	L424-L461 HydrophobicContact CD1-CD2 4.07Å; F437-L461 HydrophobicContact CD1-CD1 3.76Å; F437-L461 HydrophobicContact CD1-CG 3.96Å; F437-L461 HydrophobicContact CE1-CB 4.27Å; F437-L461 HydrophobicContact CE1-CD1 3.96Å; F437-L461 HydrophobicContact CE1-CG 3.63Å; V457-L461 HydrophobicContact CG1-CD1 3.95Å; V457-L461 WeakPolarHBondContact O-CB 3.45Å; V457-L461 PolarHBondContact O-N 3.44Å; V457-L461 VanDerWaalsContact O-N 3.13Å; V459-L461 VanDerWaalsContact C-N 3.32Å; V459-L461 PolarHBondContact O-N 2.86Å; L461-L465 VanDerWaalsContact O-CB 3.25Å; L461-L465 WeakPolarHBondContact O-CB 3.4Å; L461-L465 PolarHBondContact O-N 3.46Å
462	K	78.5	Confident	74.8	Confident	76 Å²	76	81.6 Å²	81.6	33%	0.33	40%	0.395	S	S	.	.	H	α-helix	trans	-76.9	-30.9	176.8	-172.5	50	178	146.8	0	112	Y458 V459 L465 N466	Y458-K462 WeakPolarHBondContact O-CB 3.19Å; Y458-K462 PolarHBondContact O-N 3.18Å; V459-K462 PolarHBondContact O-N 2.89Å; K462-L465 HydrophobicContact CD-CB 4.35Å; K462-L465 HydrophobicContact CD-CD2 3.98Å; K462-L465 PolarHBondContact O-N 3.34Å; K462-N466 WeakPolarHBondContact CE-OD1 3.49Å; K462-N466 PolarHBondContact NZ-OD1 3.09Å; K462-N466 WeakPolarHBondContact O-CB 3.44Å; K462-N466 PolarHBondContact O-N 3.47Å; K462-N466 PolarHBondContact O-OD1 3.36Å
463	E	76.3	Confident	74.9	Confident	90 Å²	90	77.8 Å²	77.8	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-52.1	169.6	-71	168.6	167	0	0	110.7	V459 P460 L465 N466 E467	V459-E463 HydrophobicContact CG1-CG 4.47Å; V459-E463 WeakPolarHBondContact O-CG 3.2Å; V459-E463 PolarHBondContact O-N 2.87Å; P460-E463 PolarHBondContact O-N 2.88Å; E463-L465 VanDerWaalsContact C-N 3.28Å; E463-L465 PolarHBondContact O-N 2.9Å; E463-N466 PolarHBondContact O-N 3.31Å; E463-E467 WeakPolarHBondContact O-CG 3.22Å; E463-E467 PolarHBondContact O-N 3.44Å
464	L	74.6	Confident	75	Confident	26 Å²	26	80.1 Å²	80.1	14%	0.136	39%	0.393	C	S	.	.	H	α-helix	trans	-55.8	-39.7	173	-78.1	169.4	0	0	0	113	L424 K433 F437 P460 T468	L424-L464 HydrophobicContact CD2-CD1 4.22Å; K433-L464 HydrophobicContact CD-CD2 3.66Å; K433-L464 HydrophobicContact CG-CD2 4.07Å; F437-L464 HydrophobicContact CE2-CD1 4.33Å; F437-L464 HydrophobicContact CZ-CD1 3.76Å; P460-L464 WeakPolarHBondContact O-CB 3.48Å; P460-L464 WeakPolarHBondContact O-CG 3.16Å; P460-L464 PolarHBondContact O-N 3.19Å; L464-T468 WeakPolarHBondContact O-CB 3.38Å; L464-T468 WeakPolarHBondContact O-CG2 3.42Å; L464-T468 PolarHBondContact O-N 2.93Å; L464-T468 PolarHBondContact O-OG1 2.9Å
465	L	77.8	Confident	75	Confident	91 Å²	91	74.9 Å²	74.9	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-66.4	-43	175.9	-173.7	67.2	0	0	0	111.3	L461 K462 E463 T468 E469	L461-L465 VanDerWaalsContact O-CB 3.25Å; L461-L465 WeakPolarHBondContact O-CB 3.4Å; L461-L465 PolarHBondContact O-N 3.46Å; K462-L465 HydrophobicContact CD-CB 4.35Å; K462-L465 HydrophobicContact CD-CD2 3.98Å; K462-L465 PolarHBondContact O-N 3.34Å; E463-L465 VanDerWaalsContact C-N 3.28Å; E463-L465 PolarHBondContact O-N 2.9Å; L465-T468 WeakPolarHBondContact CA-OG1 3.45Å; L465-T468 PolarHBondContact O-N 2.99Å; L465-T468 PolarHBondContact O-OG1 2.91Å; L465-T468 VanDerWaalsContact O-OG1 3.13Å; L465-E469 WeakPolarHBondContact O-CB 3.38Å; L465-E469 PolarHBondContact O-N 3.46Å
466	N	79.4	Confident	75.1	Confident	71 Å²	71	79.2 Å²	79.2	38%	0.38	39%	0.388	S	S	.	.	H	α-helix	trans	-65.2	-43	176.6	-68.5	-5.8	0	0	0	111.8	K462 E463 E469 E470	K462-N466 WeakPolarHBondContact CE-OD1 3.49Å; K462-N466 PolarHBondContact NZ-OD1 3.09Å; K462-N466 WeakPolarHBondContact O-CB 3.44Å; K462-N466 PolarHBondContact O-N 3.47Å; K462-N466 PolarHBondContact O-OD1 3.36Å; E463-N466 PolarHBondContact O-N 3.31Å; N466-E469 PolarHBondContact O-N 2.88Å; N466-E470 WeakPolarHBondContact O-CB 3.3Å; N466-E470 PolarHBondContact O-N 2.69Å
467	E	74.6	Confident	75	Confident	87 Å²	87	81.2 Å²	81.2	41%	0.407	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-42.9	177.1	-70.4	175.8	112.8	0	0	111.9	K433 E463 E470 E471	K433-E467 IonicContact NZ-OE1 3.47Å; K433-E467 PolarHBondContact NZ-OE1 2.97Å; K433-E467 IonicContact NZ-OE2 3.5Å; K433-E467 PolarHBondContact NZ-OE2 2.98Å; E463-E467 WeakPolarHBondContact O-CG 3.22Å; E463-E467 PolarHBondContact O-N 3.44Å; E467-E470 PolarHBondContact O-N 3.2Å; E467-E471 PolarHBondContact O-N 3.02Å
468	T	73.6	Confident	75	Confident	73 Å²	73	88.7 Å²	88.7	45%	0.448	43%	0.433	S	S	.	.	H	α-helix	trans	-71	-34.2	176.7	49.3	0	0	0	0	112	L464 L465 E471 I472	L464-T468 WeakPolarHBondContact O-CB 3.38Å; L464-T468 WeakPolarHBondContact O-CG2 3.42Å; L464-T468 PolarHBondContact O-N 2.93Å; L464-T468 PolarHBondContact O-OG1 2.9Å; L465-T468 WeakPolarHBondContact CA-OG1 3.45Å; L465-T468 PolarHBondContact O-N 2.99Å; L465-T468 PolarHBondContact O-OG1 2.91Å; L465-T468 VanDerWaalsContact O-OG1 3.13Å; T468-E471 PolarHBondContact O-N 2.83Å; T468-I472 VanDerWaalsContact O-CB 3.3Å; T468-I472 WeakPolarHBondContact O-CB 3.3Å; T468-I472 WeakPolarHBondContact O-CD1 3.37Å; T468-I472 WeakPolarHBondContact O-CG1 3.29Å; T468-I472 PolarHBondContact O-N 2.97Å
469	E	75	Confident	74.9	Confident	100 Å²	100	87.6 Å²	87.6	47%	0.467	43%	0.431	S	S	.	.	H	α-helix	trans	-66.1	-36.3	171.1	-171.6	159.6	-144.9	0	0	111.6	L465 N466 N473	L465-E469 WeakPolarHBondContact O-CB 3.38Å; L465-E469 PolarHBondContact O-N 3.46Å; N466-E469 PolarHBondContact O-N 2.88Å; E469-N473 WeakPolarHBondContact O-CB 3.31Å; E469-N473 VanDerWaalsContact O-CG 3.25Å; E469-N473 PolarHBondContact O-N 3.4Å; E469-N473 PolarHBondContact O-ND2 3.11Å
470	E	74.3	Confident	74.7	Confident	113 Å²	113	88.9 Å²	88.9	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-65.6	-46.1	170.1	-84.3	-167	-165.4	0	0	113.2	N466 E467 N473 K474	N466-E470 WeakPolarHBondContact O-CB 3.3Å; N466-E470 PolarHBondContact O-N 2.69Å; E467-E470 PolarHBondContact O-N 3.2Å; E470-N473 CarbonylContact O-C 3.53Å; E470-N473 PolarHBondContact O-N 3.35Å; E470-N473 VanDerWaalsContact O-N 3.16Å; E470-K474 WeakPolarHBondContact O-CG 3.49Å; E470-K474 PolarHBondContact O-N 2.94Å; E470-K474 IonicContact OE2-NZ 2.68Å
471	E	72.6	Confident	74.6	Confident	109 Å²	109	90.2 Å²	90.2	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-66	-37.5	176.5	-73	-54.5	133.9	0	0	112	E467 T468 N473 K474 A475	E467-E471 PolarHBondContact O-N 3.02Å; T468-E471 PolarHBondContact O-N 2.83Å; E471-N473 VanDerWaalsContact C-N 3.31Å; E471-N473 PolarHBondContact O-N 2.69Å; E471-K474 PolarHBondContact O-N 2.83Å; E471-K474 VanDerWaalsContact OE1-CD 3.27Å; E471-K474 WeakPolarHBondContact OE1-CD 3.39Å; E471-K474 WeakPolarHBondContact OE1-CE 3.49Å; E471-K474 IonicContact OE1-NZ 2.67Å; E471-K474 PolarHBondContact OE1-NZ 2.88Å; E471-A475 WeakPolarHBondContact O-CB 3.45Å; E471-A475 PolarHBondContact O-N 3.25Å
472	I	71.9	Confident	74.4	Confident	112 Å²	112	93.1 Å²	93.1	57%	0.574	46%	0.463	S	S	*	.	H	α-helix	trans	-60.2	-41.8	169.8	-73.6	165	0	0	0	110.5	T468 A475 R476	T468-I472 VanDerWaalsContact O-CB 3.3Å; T468-I472 WeakPolarHBondContact O-CB 3.3Å; T468-I472 WeakPolarHBondContact O-CD1 3.37Å; T468-I472 WeakPolarHBondContact O-CG1 3.29Å; T468-I472 PolarHBondContact O-N 2.97Å; I472-A475 PolarHBondContact O-N 3.43Å; I472-R476 WeakPolarHBondContact O-CB 3.46Å; I472-R476 PolarHBondContact O-N 2.88Å
473	N	74.5	Confident	74.1	Confident	68 Å²	68	93.8 Å²	93.8	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-70.6	-36.5	177.1	-76.2	-44.3	0	0	0	112.9	E469 E470 E471 R476 N477	E469-N473 WeakPolarHBondContact O-CB 3.31Å; E469-N473 VanDerWaalsContact O-CG 3.25Å; E469-N473 PolarHBondContact O-N 3.4Å; E469-N473 PolarHBondContact O-ND2 3.11Å; E470-N473 CarbonylContact O-C 3.53Å; E470-N473 PolarHBondContact O-N 3.35Å; E470-N473 VanDerWaalsContact O-N 3.16Å; E471-N473 VanDerWaalsContact C-N 3.31Å; E471-N473 PolarHBondContact O-N 2.69Å; N473-R476 PolarHBondContact O-N 3.45Å; N473-N477 WeakPolarHBondContact O-CB 3.4Å; N473-N477 PolarHBondContact O-N 2.87Å; N473-N477 PolarHBondContact O-OD1 2.78Å
474	K	74.8	Confident	74	Confident	96 Å²	96	94 Å²	94	42%	0.417	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-42.9	171.2	-69.3	164.1	-158.2	165.7	0	111.1	E470 E471 N477 K478	E470-K474 WeakPolarHBondContact O-CG 3.49Å; E470-K474 PolarHBondContact O-N 2.94Å; E470-K474 IonicContact OE2-NZ 2.68Å; E471-K474 PolarHBondContact O-N 2.83Å; E471-K474 VanDerWaalsContact OE1-CD 3.27Å; E471-K474 WeakPolarHBondContact OE1-CD 3.39Å; E471-K474 WeakPolarHBondContact OE1-CE 3.49Å; E471-K474 IonicContact OE1-NZ 2.67Å; E471-K474 PolarHBondContact OE1-NZ 2.88Å; K474-N477 PolarHBondContact O-N 3.24Å; K474-K478 PolarHBondContact O-N 2.99Å; K474-K478 VanDerWaalsContact O-N 3.07Å
475	A	72	Confident	74	Confident	60 Å²	60	96.3 Å²	96.3	50%	0.496	49%	0.487	S	S	.	.	H	α-helix	trans	-65.8	-40.9	174.3	0	0	0	0	0	112.2	E471 I472 K478 K479	E471-A475 WeakPolarHBondContact O-CB 3.45Å; E471-A475 PolarHBondContact O-N 3.25Å; I472-A475 PolarHBondContact O-N 3.43Å; A475-K478 PolarHBondContact O-N 3.16Å; A475-K479 WeakPolarHBondContact O-CB 3.31Å; A475-K479 PolarHBondContact O-N 3.01Å
476	R	74.4	Confident	73.8	Confident	156 Å²	156	96.6 Å²	96.6	59%	0.589	49%	0.489	S	S	*	.	H	α-helix	trans	-64	-39.1	176.1	-173.2	178.1	-174.8	167.6	2.1	112.3	I472 N473 K479 M480	I472-R476 WeakPolarHBondContact O-CB 3.46Å; I472-R476 PolarHBondContact O-N 2.88Å; N473-R476 PolarHBondContact O-N 3.45Å; R476-K479 WeakPolarHBondContact O-CB 3.43Å; R476-K479 PolarHBondContact O-N 3.09Å; R476-M480 WeakPolarHBondContact O-CB 3.32Å; R476-M480 PolarHBondContact O-N 2.87Å
477	N	73.1	Confident	73.7	Confident	103 Å²	103	100 Å²	100	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-71.7	-35.5	176.6	-67.9	-4.3	0	0	0	111.6	N473 K474 M480 G481	N473-N477 WeakPolarHBondContact O-CB 3.4Å; N473-N477 PolarHBondContact O-N 2.87Å; N473-N477 PolarHBondContact O-OD1 2.78Å; K474-N477 PolarHBondContact O-N 3.24Å; N477-M480 PolarHBondContact O-N 3.29Å; N477-G481 PolarHBondContact O-N 3.44Å
478	K	73.8	Confident	73.6	Confident	165 Å²	165	102.7 Å²	102.7	72%	0.717	52%	0.515	S	S	*	.	H	α-helix	trans	-63.8	-40	168.1	-79.3	-178.1	175.1	177.3	0	112.5	K474 A475 L482	K474-K478 PolarHBondContact O-N 2.99Å; K474-K478 VanDerWaalsContact O-N 3.07Å; A475-K478 PolarHBondContact O-N 3.16Å; K478-L482 WeakPolarHBondContact O-CG 3.47Å; K478-L482 PolarHBondContact O-N 3.38Å; K478-L482 VanDerWaalsContact O-N 3.13Å
479	K	75.3	Confident	73.6	Confident	115 Å²	115	104.2 Å²	104.2	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-47.7	173.6	-176.5	-173.6	172.7	-77.1	0	110.7	A475 R476 L482 E483	A475-K479 WeakPolarHBondContact O-CB 3.31Å; A475-K479 PolarHBondContact O-N 3.01Å; R476-K479 WeakPolarHBondContact O-CB 3.43Å; R476-K479 PolarHBondContact O-N 3.09Å; K479-L482 WeakPolarHBondContact O-CB 3.45Å; K479-L482 PolarHBondContact O-N 3.01Å; K479-E483 WeakPolarHBondContact CG-OE2 3.24Å; K479-E483 IonicContact NZ-OE1 2.71Å; K479-E483 PolarHBondContact NZ-OE1 3.03Å; K479-E483 IonicContact NZ-OE2 2.64Å; K479-E483 PolarHBondContact NZ-OE2 3.48Å; K479-E483 WeakPolarHBondContact O-CG 3.46Å; K479-E483 PolarHBondContact O-N 3.39Å
480	M	72.9	Confident	73.6	Confident	92 Å²	92	103.3 Å²	103.3	45%	0.453	52%	0.518	S	S	.	.	H	α-helix	trans	-59.4	-48.4	178.7	-167.8	174.8	-64.9	0	0	112.1	R476 N477 L482 E483 D484	R476-M480 WeakPolarHBondContact O-CB 3.32Å; R476-M480 PolarHBondContact O-N 2.87Å; N477-M480 PolarHBondContact O-N 3.29Å; M480-L482 VanDerWaalsContact C-N 3.27Å; M480-L482 PolarHBondContact O-N 3.41Å; M480-E483 CarbonylContact O-C 3.53Å; M480-E483 WeakPolarHBondContact O-CA 3.38Å; M480-E483 WeakPolarHBondContact O-CB 3.32Å; M480-E483 PolarHBondContact O-N 3.37Å; M480-D484 PolarHBondContact O-N 2.93Å
481	G	72.9	Confident	73.6	Confident	34 Å²	34	100.4 Å²	100.4	35%	0.351	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-28.2	176.4	0	0	0	0	0	114.2	N477 T485	N477-G481 PolarHBondContact O-N 3.44Å; G481-T485 WeakPolarHBondContact O-CG2 3.23Å; G481-T485 PolarHBondContact O-N 2.7Å
482	L	70.9	Confident	73.6	Confident	118 Å²	118	101.9 Å²	101.9	62%	0.618	52%	0.522	S	S	*	.	H	α-helix	trans	-72.8	-40.3	169.6	-73.5	169.2	0	0	0	111.5	K478 K479 M480 T485 L486	K478-L482 WeakPolarHBondContact O-CG 3.47Å; K478-L482 PolarHBondContact O-N 3.38Å; K478-L482 VanDerWaalsContact O-N 3.13Å; K479-L482 WeakPolarHBondContact O-CB 3.45Å; K479-L482 PolarHBondContact O-N 3.01Å; M480-L482 VanDerWaalsContact C-N 3.27Å; M480-L482 PolarHBondContact O-N 3.41Å; L482-T485 PolarHBondContact O-N 2.86Å; L482-T485 PolarHBondContact O-OG1 3.36Å; L482-L486 WeakPolarHBondContact O-CB 3.43Å; L482-L486 PolarHBondContact O-N 3.38Å
483	E	72.4	Confident	73.7	Confident	91 Å²	91	99.9 Å²	99.9	43%	0.425	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.4	-72.3	174.3	133.1	0	0	111.7	K479 M480 T485 L486 E487	K479-E483 WeakPolarHBondContact CG-OE2 3.24Å; K479-E483 IonicContact NZ-OE1 2.71Å; K479-E483 PolarHBondContact NZ-OE1 3.03Å; K479-E483 IonicContact NZ-OE2 2.64Å; K479-E483 PolarHBondContact NZ-OE2 3.48Å; K479-E483 WeakPolarHBondContact O-CG 3.46Å; K479-E483 PolarHBondContact O-N 3.39Å; M480-E483 CarbonylContact O-C 3.53Å; M480-E483 WeakPolarHBondContact O-CA 3.38Å; M480-E483 WeakPolarHBondContact O-CB 3.32Å; M480-E483 PolarHBondContact O-N 3.37Å; E483-T485 VanDerWaalsContact C-N 3.35Å; E483-T485 PolarHBondContact O-N 2.8Å; E483-L486 CarbonylContact O-C 3.53Å; E483-L486 WeakPolarHBondContact O-CA 3.39Å; E483-L486 WeakPolarHBondContact O-CB 3.5Å; E483-L486 PolarHBondContact O-N 2.92Å; E483-L486 VanDerWaalsContact O-N 3.09Å; E483-E487 WeakPolarHBondContact O-CB 3.28Å; E483-E487 PolarHBondContact O-N 3.38Å
484	D	73.9	Confident	73.8	Confident	93 Å²	93	99.7 Å²	99.7	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-58.2	-43.4	172.6	-67.2	-32.6	0	0	0	111.9	M480 L486 E487 Q488	M480-D484 PolarHBondContact O-N 2.93Å; D484-L486 VanDerWaalsContact C-N 3.32Å; D484-L486 PolarHBondContact O-N 2.76Å; D484-E487 PolarHBondContact O-N 2.95Å; D484-Q488 PolarHBondContact O-N 3Å
485	T	73.2	Confident	73.8	Confident	75 Å²	75	100.4 Å²	100.4	46%	0.46	52%	0.518	S	S	.	.	H	α-helix	trans	-69	-30.8	175.9	60.9	0	0	0	0	112.9	G481 L482 E483 L489	G481-T485 WeakPolarHBondContact O-CG2 3.23Å; G481-T485 PolarHBondContact O-N 2.7Å; L482-T485 PolarHBondContact O-N 2.86Å; L482-T485 PolarHBondContact O-OG1 3.36Å; E483-T485 VanDerWaalsContact C-N 3.35Å; E483-T485 PolarHBondContact O-N 2.8Å; T485-L489 WeakPolarHBondContact O-CB 3.08Å; T485-L489 PolarHBondContact O-N 3.18Å
486	L	73.5	Confident	73.8	Confident	98 Å²	98	100.8 Å²	100.8	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-71.9	-36	175.2	-145.8	169.3	0	0	0	110.4	L482 E483 D484 L489 N490	L482-L486 WeakPolarHBondContact O-CB 3.43Å; L482-L486 PolarHBondContact O-N 3.38Å; E483-L486 CarbonylContact O-C 3.53Å; E483-L486 WeakPolarHBondContact O-CA 3.39Å; E483-L486 WeakPolarHBondContact O-CB 3.5Å; E483-L486 PolarHBondContact O-N 2.92Å; E483-L486 VanDerWaalsContact O-N 3.09Å; D484-L486 VanDerWaalsContact C-N 3.32Å; D484-L486 PolarHBondContact O-N 2.76Å; L486-L489 PolarHBondContact O-N 3.39Å; L486-N490 VanDerWaalsContact CD2-ND2 3.26Å; L486-N490 WeakPolarHBondContact CD2-ND2 3.44Å; L486-N490 WeakPolarHBondContact O-CB 3.07Å; L486-N490 PolarHBondContact O-N 3.36Å; L486-N490 PolarHBondContact O-ND2 2.79Å
487	E	77.3	Confident	73.8	Confident	143 Å²	143	99.5 Å²	99.5	67%	0.668	52%	0.516	S	S	*	.	H	α-helix	trans	-69.9	-39.2	174.2	-171.6	136.6	-147.5	0	0	112	E483 D484 N490 A491	E483-E487 WeakPolarHBondContact O-CB 3.28Å; E483-E487 PolarHBondContact O-N 3.38Å; D484-E487 PolarHBondContact O-N 2.95Å; E487-N490 PolarHBondContact O-N 2.71Å; E487-A491 WeakPolarHBondContact O-CB 3.43Å; E487-A491 PolarHBondContact O-N 2.82Å
488	Q	73.8	Confident	73.9	Confident	142 Å²	142	100.7 Å²	100.7	66%	0.664	51%	0.512	S	S	*	.	H	α-helix	trans	-62.1	-43.3	169.9	-72.9	-174.7	1.2	0	0	112.6	D484 A491 M492	D484-Q488 PolarHBondContact O-N 3Å; Q488-A491 WeakPolarHBondContact O-CB 3.49Å; Q488-A491 PolarHBondContact O-N 3.21Å; Q488-M492 PolarHBondContact O-N 2.89Å
489	L	72.4	Confident	73.9	Confident	105 Å²	105	95.6 Å²	95.6	55%	0.55	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-41.8	173.4	-97.2	162.9	0	0	0	111.9	T485 L486 A491 M492 I493	T485-L489 WeakPolarHBondContact O-CB 3.08Å; T485-L489 PolarHBondContact O-N 3.18Å; L486-L489 PolarHBondContact O-N 3.39Å; L489-A491 VanDerWaalsContact C-N 3.34Å; L489-A491 PolarHBondContact O-N 3.35Å; L489-M492 PolarHBondContact O-N 3.41Å; L489-I493 WeakPolarHBondContact O-CB 3.04Å; L489-I493 VanDerWaalsContact O-CG1 3.25Å; L489-I493 WeakPolarHBondContact O-CG1 3.3Å; L489-I493 PolarHBondContact O-N 3.05Å
490	N	75.3	Confident	73.8	Confident	81 Å²	81	93.8 Å²	93.8	43%	0.433	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-38.8	173.8	-82.6	-41	0	0	0	112	L486 E487 I493 T494	L486-N490 VanDerWaalsContact CD2-ND2 3.26Å; L486-N490 WeakPolarHBondContact CD2-ND2 3.44Å; L486-N490 WeakPolarHBondContact O-CB 3.07Å; L486-N490 PolarHBondContact O-N 3.36Å; L486-N490 PolarHBondContact O-ND2 2.79Å; E487-N490 PolarHBondContact O-N 2.71Å; N490-I493 CarbonylContact O-C 3.58Å; N490-I493 PolarHBondContact O-N 2.95Å; N490-T494 WeakPolarHBondContact O-CG2 3.44Å; N490-T494 PolarHBondContact O-N 2.92Å
491	A	75.5	Confident	74	Confident	52 Å²	52	96.5 Å²	96.5	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-48.2	174.6	0	0	0	0	0	111.3	E487 Q488 L489 I493 T494 E495	E487-A491 WeakPolarHBondContact O-CB 3.43Å; E487-A491 PolarHBondContact O-N 2.82Å; Q488-A491 WeakPolarHBondContact O-CB 3.49Å; Q488-A491 PolarHBondContact O-N 3.21Å; L489-A491 VanDerWaalsContact C-N 3.34Å; L489-A491 PolarHBondContact O-N 3.35Å; A491-I493 VanDerWaalsContact C-N 3.31Å; A491-I493 PolarHBondContact O-N 2.95Å; A491-T494 PolarHBondContact O-N 2.7Å; A491-T494 PolarHBondContact O-OG1 2.63Å; A491-E495 PolarHBondContact O-N 3.4Å
492	M	72.4	Confident	74.1	Confident	140 Å²	140	98.7 Å²	98.7	69%	0.69	51%	0.508	S	S	*	.	H	α-helix	trans	-59.6	-39.4	173	-69.4	-175.4	69.7	0	0	112.4	Q488 L489 E495 S496	Q488-M492 PolarHBondContact O-N 2.89Å; L489-M492 PolarHBondContact O-N 3.41Å; M492-E495 PolarHBondContact O-N 3.15Å; M492-S496 WeakPolarHBondContact O-CB 3.33Å; M492-S496 PolarHBondContact O-N 3.48Å
493	I	73.9	Confident	74.2	Confident	71 Å²	71	98.2 Å²	98.2	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-35.8	174.3	-70.4	164.3	0	0	0	111.3	L489 N490 A491 K497	L489-I493 WeakPolarHBondContact O-CB 3.04Å; L489-I493 VanDerWaalsContact O-CG1 3.25Å; L489-I493 WeakPolarHBondContact O-CG1 3.3Å; L489-I493 PolarHBondContact O-N 3.05Å; N490-I493 CarbonylContact O-C 3.58Å; N490-I493 PolarHBondContact O-N 2.95Å; A491-I493 VanDerWaalsContact C-N 3.31Å; A491-I493 PolarHBondContact O-N 2.95Å; I493-K497 HydrophobicContact CG2-CD 3.92Å; I493-K497 HydrophobicContact CG2-CG 4.46Å; I493-K497 VanDerWaalsContact O-CB 3.25Å; I493-K497 WeakPolarHBondContact O-CB 3.47Å; I493-K497 WeakPolarHBondContact O-CG 3.3Å; I493-K497 PolarHBondContact O-N 3.06Å
494	T	75.3	Confident	74.2	Confident	64 Å²	64	101.1 Å²	101.1	39%	0.393	52%	0.517	S	S	.	.	H	α-helix	trans	-68	-36.8	173.3	64.1	0	0	0	0	112.1	N490 A491 K497 R498	N490-T494 WeakPolarHBondContact O-CG2 3.44Å; N490-T494 PolarHBondContact O-N 2.92Å; A491-T494 PolarHBondContact O-N 2.7Å; A491-T494 PolarHBondContact O-OG1 2.63Å; T494-K497 CarbonylContact O-C 3.58Å; T494-K497 PolarHBondContact O-N 3.23Å; T494-R498 WeakPolarHBondContact O-CG 3.41Å; T494-R498 PolarHBondContact O-N 3.19Å; T494-R498 PolarHBondContact OG1-NH1 2.72Å
495	E	75.6	Confident	74.2	Confident	110 Å²	110	101.4 Å²	101.4	51%	0.514	52%	0.515	S	S	.	.	H	α-helix	trans	-69.7	-43.3	178	-160	57.9	-150.6	0	0	111.5	A491 M492 K497 R498 S499	A491-E495 PolarHBondContact O-N 3.4Å; M492-E495 PolarHBondContact O-N 3.15Å; E495-K497 VanDerWaalsContact C-N 3.29Å; E495-K497 PolarHBondContact O-N 3.18Å; E495-R498 WeakPolarHBondContact O-CB 3.41Å; E495-R498 PolarHBondContact O-N 2.86Å; E495-R498 WeakPolarHBondContact OE2-CD 3.41Å; E495-R498 IonicContact OE2-CZ 3.14Å; E495-R498 IonicContact OE2-NE 3.86Å; E495-R498 IonicContact OE2-NH1 2.72Å; E495-R498 PolarHBondContact OE2-NH1 3.08Å; E495-S499 PolarHBondContact O-N 3.48Å; E495-S499 PolarHBondContact O-OG 3.48Å
496	S	71.1	Confident	74.3	Confident	69 Å²	69	103.2 Å²	103.2	48%	0.483	52%	0.518	S	S	.	.	H	α-helix	trans	-59.5	-38.9	169.4	-174.6	0	0	0	0	111.9	M492 R498 S499 V500	M492-S496 WeakPolarHBondContact O-CB 3.33Å; M492-S496 PolarHBondContact O-N 3.48Å; S496-R498 VanDerWaalsContact C-N 3.31Å; S496-R498 PolarHBondContact O-N 2.93Å; S496-S499 PolarHBondContact O-OG 2.98Å; S496-V500 WeakPolarHBondContact O-CB 3.48Å; S496-V500 VanDerWaalsContact O-CG2 3.26Å; S496-V500 WeakPolarHBondContact O-CG2 3.39Å; S496-V500 PolarHBondContact O-N 2.97Å
497	K	74.8	Confident	74.4	Confident	128 Å²	128	103.1 Å²	103.1	56%	0.557	52%	0.521	S	S	*	.	H	α-helix	trans	-73.3	-13.8	173	-75.2	171.5	-179.6	173.4	0	114.4	I493 T494 E495 R501	I493-K497 HydrophobicContact CG2-CD 3.92Å; I493-K497 HydrophobicContact CG2-CG 4.46Å; I493-K497 VanDerWaalsContact O-CB 3.25Å; I493-K497 WeakPolarHBondContact O-CB 3.47Å; I493-K497 WeakPolarHBondContact O-CG 3.3Å; I493-K497 PolarHBondContact O-N 3.06Å; T494-K497 CarbonylContact O-C 3.58Å; T494-K497 PolarHBondContact O-N 3.23Å; E495-K497 VanDerWaalsContact C-N 3.29Å; E495-K497 PolarHBondContact O-N 3.18Å; K497-R501 WeakPolarHBondContact O-CB 3.43Å
498	R	75.9	Confident	74.3	Confident	128 Å²	128	100.8 Å²	100.8	48%	0.483	51%	0.511	S	S	.	.	H	α-helix	trans	-79.9	-50.7	168.8	-75	178.1	-173.8	98.7	6.6	109.7	T494 E495 S496 V500 R501 T502	T494-R498 WeakPolarHBondContact O-CG 3.41Å; T494-R498 PolarHBondContact O-N 3.19Å; T494-R498 PolarHBondContact OG1-NH1 2.72Å; E495-R498 WeakPolarHBondContact O-CB 3.41Å; E495-R498 PolarHBondContact O-N 2.86Å; E495-R498 WeakPolarHBondContact OE2-CD 3.41Å; E495-R498 IonicContact OE2-CZ 3.14Å; E495-R498 IonicContact OE2-NE 3.86Å; E495-R498 IonicContact OE2-NH1 2.72Å; E495-R498 PolarHBondContact OE2-NH1 3.08Å; S496-R498 VanDerWaalsContact C-N 3.31Å; S496-R498 PolarHBondContact O-N 2.93Å; R498-V500 PolarHBondContact O-N 3.06Å; R498-R501 WeakPolarHBondContact O-CA 3.49Å; R498-R501 VanDerWaalsContact O-CB 3.27Å; R498-R501 WeakPolarHBondContact O-CB 3.32Å; R498-R501 PolarHBondContact O-N 3.41Å; R498-T502 PolarHBondContact O-N 3.31Å
499	S	72.8	Confident	74.5	Confident	59 Å²	59	100.4 Å²	100.4	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-66.1	-35.2	179.8	48.5	0	0	0	0	113.4	E495 S496 R501 T502 L503	E495-S499 PolarHBondContact O-N 3.48Å; E495-S499 PolarHBondContact O-OG 3.48Å; S496-S499 PolarHBondContact O-OG 2.98Å; S499-R501 PolarHBondContact O-N 3.35Å; S499-T502 PolarHBondContact O-OG1 3.34Å; S499-L503 WeakPolarHBondContact O-CB 3.4Å; S499-L503 WeakPolarHBondContact O-CG 3.46Å; S499-L503 PolarHBondContact O-N 2.9Å
500	V	73.3	Confident	74.7	Confident	77 Å²	77	100.8 Å²	100.8	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-27.4	168.3	168.8	0	0	0	0	112.3	S496 R498 K504	S496-V500 WeakPolarHBondContact O-CB 3.48Å; S496-V500 VanDerWaalsContact O-CG2 3.26Å; S496-V500 WeakPolarHBondContact O-CG2 3.39Å; S496-V500 PolarHBondContact O-N 2.97Å; R498-V500 PolarHBondContact O-N 3.06Å; V500-K504 WeakPolarHBondContact O-CB 3.43Å; V500-K504 WeakPolarHBondContact O-CG 3.37Å; V500-K504 PolarHBondContact O-N 3.11Å; V500-K504 VanDerWaalsContact O-N 3.08Å
501	R	77.9	Confident	74.8	Confident	149 Å²	149	100.3 Å²	100.3	56%	0.562	51%	0.506	S	S	*	.	H	α-helix	trans	-79	-44.4	178.8	-156.3	-174.9	-52.4	176.5	4.3	111.8	K497 R498 S499 L503 K504 E505	K497-R501 WeakPolarHBondContact O-CB 3.43Å; R498-R501 WeakPolarHBondContact O-CA 3.49Å; R498-R501 VanDerWaalsContact O-CB 3.27Å; R498-R501 WeakPolarHBondContact O-CB 3.32Å; R498-R501 PolarHBondContact O-N 3.41Å; S499-R501 PolarHBondContact O-N 3.35Å; R501-L503 VanDerWaalsContact C-N 3.32Å; R501-L503 PolarHBondContact O-N 3.43Å; R501-K504 CarbonylContact O-C 3.54Å; R501-K504 WeakPolarHBondContact O-CA 3.26Å; R501-K504 WeakPolarHBondContact O-CB 3.45Å; R501-K504 PolarHBondContact O-N 3.3Å; R501-E505 WeakPolarHBondContact CG-OE1 3.38Å; R501-E505 WeakPolarHBondContact O-CG 3.37Å; R501-E505 PolarHBondContact O-N 2.91Å
502	T	74	Confident	74.9	Confident	79 Å²	79	102 Å²	102	49%	0.485	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-42	173.4	54.6	0	0	0	0	111	R498 S499 K504 E505 E506	R498-T502 PolarHBondContact O-N 3.31Å; S499-T502 PolarHBondContact O-OG1 3.34Å; T502-K504 VanDerWaalsContact C-N 3.31Å; T502-K504 PolarHBondContact O-N 3.38Å; T502-E505 PolarHBondContact O-N 2.92Å; T502-E506 WeakPolarHBondContact O-CB 3.32Å; T502-E506 PolarHBondContact O-N 3.19Å
503	L	73.4	Confident	75.2	Confident	108 Å²	108	100.1 Å²	100.1	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-36.2	172.2	-81.5	163.9	0	0	0	112.8	S499 R501 E506 V507	S499-L503 WeakPolarHBondContact O-CB 3.4Å; S499-L503 WeakPolarHBondContact O-CG 3.46Å; S499-L503 PolarHBondContact O-N 2.9Å; R501-L503 VanDerWaalsContact C-N 3.32Å; R501-L503 PolarHBondContact O-N 3.43Å; L503-E506 PolarHBondContact O-N 3.33Å; L503-V507 WeakPolarHBondContact O-CB 3.48Å; L503-V507 VanDerWaalsContact O-CG2 3.32Å; L503-V507 WeakPolarHBondContact O-CG2 3.35Å; L503-V507 PolarHBondContact O-N 3.35Å
504	K	72.1	Confident	75.2	Confident	152 Å²	152	104.6 Å²	104.6	66%	0.661	51%	0.514	S	S	*	.	H	α-helix	trans	-69.2	-38.4	172.7	-85.7	-166.1	170	-156.8	0	113.3	V500 R501 T502 E506 V507 Q508	V500-K504 WeakPolarHBondContact O-CB 3.43Å; V500-K504 WeakPolarHBondContact O-CG 3.37Å; V500-K504 PolarHBondContact O-N 3.11Å; V500-K504 VanDerWaalsContact O-N 3.08Å; R501-K504 CarbonylContact O-C 3.54Å; R501-K504 WeakPolarHBondContact O-CA 3.26Å; R501-K504 WeakPolarHBondContact O-CB 3.45Å; R501-K504 PolarHBondContact O-N 3.3Å; T502-K504 VanDerWaalsContact C-N 3.31Å; T502-K504 PolarHBondContact O-N 3.38Å; K504-E506 PolarHBondContact O-N 2.96Å; K504-V507 PolarHBondContact O-N 3.01Å; K504-Q508 WeakPolarHBondContact O-CB 3.47Å; K504-Q508 PolarHBondContact O-N 3.41Å
505	E	75.4	Confident	75.3	Confident	99 Å²	99	106.2 Å²	106.2	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-28.2	174.9	-69.9	161.1	-157.7	0	0	111.6	R501 T502 K509	R501-E505 WeakPolarHBondContact CG-OE1 3.38Å; R501-E505 WeakPolarHBondContact O-CG 3.37Å; R501-E505 PolarHBondContact O-N 2.91Å; T502-E505 PolarHBondContact O-N 2.92Å; E505-K509 WeakPolarHBondContact O-CD 3.14Å; E505-K509 VanDerWaalsContact O-CG 3.27Å; E505-K509 WeakPolarHBondContact O-CG 3.46Å; E505-K509 PolarHBondContact O-N 2.96Å
506	E	75.4	Confident	75.3	Confident	114 Å²	114	106.1 Å²	106.1	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-78.9	-38.8	174.9	-154.5	139.6	-117.4	0	0	112.1	T502 L503 K504 K509 L510	T502-E506 WeakPolarHBondContact O-CB 3.32Å; T502-E506 PolarHBondContact O-N 3.19Å; L503-E506 PolarHBondContact O-N 3.33Å; K504-E506 PolarHBondContact O-N 2.96Å; E506-K509 PolarHBondContact O-N 3.25Å; E506-L510 PolarHBondContact O-N 2.91Å
507	V	74.1	Confident	75.5	Confident	95 Å²	95	108.7 Å²	108.7	58%	0.576	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-40.6	167.9	168.1	0	0	0	0	111.5	L503 K504 K509 L510 D511	L503-V507 WeakPolarHBondContact O-CB 3.48Å; L503-V507 VanDerWaalsContact O-CG2 3.32Å; L503-V507 WeakPolarHBondContact O-CG2 3.35Å; L503-V507 PolarHBondContact O-N 3.35Å; K504-V507 PolarHBondContact O-N 3.01Å; V507-K509 PolarHBondContact O-N 3.42Å; V507-L510 PolarHBondContact O-N 3.27Å; V507-L510 VanDerWaalsContact O-N 3.15Å; V507-D511 PolarHBondContact O-N 2.9Å
508	Q	76.6	Confident	75.6	Confident	95 Å²	95	105.3 Å²	105.3	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-43.6	177.3	-170.4	63.4	58.4	0	0	111.2	K504 L510 D511 D512	K504-Q508 WeakPolarHBondContact O-CB 3.47Å; K504-Q508 PolarHBondContact O-N 3.41Å; Q508-L510 PolarHBondContact O-N 3.47Å; Q508-D511 PolarHBondContact O-N 3.16Å; Q508-D511 VanDerWaalsContact O-N 3.15Å; Q508-D512 PolarHBondContact NE2-OD1 2.94Å; Q508-D512 WeakPolarHBondContact O-CB 3.4Å; Q508-D512 PolarHBondContact O-N 3.17Å
509	K	77.6	Confident	75.6	Confident	133 Å²	133	105.2 Å²	105.2	58%	0.578	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-33	174.6	-71	162.8	-169.2	165.8	0	113	E505 E506 V507 L513	E505-K509 WeakPolarHBondContact O-CD 3.14Å; E505-K509 VanDerWaalsContact O-CG 3.27Å; E505-K509 WeakPolarHBondContact O-CG 3.46Å; E505-K509 PolarHBondContact O-N 2.96Å; E506-K509 PolarHBondContact O-N 3.25Å; V507-K509 PolarHBondContact O-N 3.42Å; K509-L513 VanDerWaalsContact O-CB 3.32Å; K509-L513 WeakPolarHBondContact O-CB 3.41Å; K509-L513 PolarHBondContact O-N 3.37Å; K509-L513 VanDerWaalsContact O-N 3.14Å
510	L	76.6	Confident	75.7	Confident	113 Å²	113	106 Å²	106	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-74	-38.2	174.7	-75.8	167	0	0	0	112	E506 V507 Q508 L513 Y514	E506-L510 PolarHBondContact O-N 2.91Å; V507-L510 PolarHBondContact O-N 3.27Å; V507-L510 VanDerWaalsContact O-N 3.15Å; Q508-L510 PolarHBondContact O-N 3.47Å; L510-L513 PolarHBondContact O-N 2.98Å; L510-Y514 WeakPolarHBondContact O-CB 3.43Å; L510-Y514 PolarHBondContact O-N 3.2Å
511	D	76	Confident	75.7	Confident	71 Å²	71	104.8 Å²	104.8	38%	0.38	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-47.5	173.8	-169.9	46	0	0	0	110.8	V507 Q508 L513 Y514 Q515	V507-D511 PolarHBondContact O-N 2.9Å; Q508-D511 PolarHBondContact O-N 3.16Å; Q508-D511 VanDerWaalsContact O-N 3.15Å; D511-L513 VanDerWaalsContact C-N 3.29Å; D511-L513 PolarHBondContact O-N 2.94Å; D511-Y514 CarbonylContact O-C 3.58Å; D511-Y514 WeakPolarHBondContact O-CA 3.44Å; D511-Y514 WeakPolarHBondContact O-CB 3.5Å; D511-Y514 PolarHBondContact O-N 2.96Å; D511-Q515 VanDerWaalsContact O-CG 3.32Å; D511-Q515 WeakPolarHBondContact O-CG 3.46Å; D511-Q515 PolarHBondContact O-N 2.8Å
512	D	77.9	Confident	75.6	Confident	87 Å²	87	103.2 Å²	103.2	47%	0.465	50%	0.504	S	S	.	.	H	α-helix	trans	-56.1	-42.1	174.4	-61	-18.1	0	0	0	111.5	Q508 Q516	Q508-D512 PolarHBondContact NE2-OD1 2.94Å; Q508-D512 WeakPolarHBondContact O-CB 3.4Å; Q508-D512 PolarHBondContact O-N 3.17Å; D512-Q516 PolarHBondContact O-N 3.31Å
513	L	79.8	Confident	75.8	Confident	102 Å²	102	105.7 Å²	105.7	53%	0.534	51%	0.51	S	S	.	.	H	α-helix	trans	-67.8	-35	175	-163.7	83.8	0	0	0	112.3	K509 L510 D511 K517	K509-L513 VanDerWaalsContact O-CB 3.32Å; K509-L513 WeakPolarHBondContact O-CB 3.41Å; K509-L513 PolarHBondContact O-N 3.37Å; K509-L513 VanDerWaalsContact O-N 3.14Å; L510-L513 PolarHBondContact O-N 2.98Å; D511-L513 VanDerWaalsContact C-N 3.29Å; D511-L513 PolarHBondContact O-N 2.94Å; L513-K517 WeakPolarHBondContact O-CG 3.48Å; L513-K517 PolarHBondContact O-N 3.05Å
514	Y	73.9	Confident	75.8	Confident	165 Å²	165	105.5 Å²	105.5	65%	0.647	51%	0.506	S	S	*	.	H	α-helix	trans	-71.5	-41	176.8	-155.9	-94.1	0	0	0	111.2	L510 D511 K517 I518	L510-Y514 WeakPolarHBondContact O-CB 3.43Å; L510-Y514 PolarHBondContact O-N 3.2Å; D511-Y514 CarbonylContact O-C 3.58Å; D511-Y514 WeakPolarHBondContact O-CA 3.44Å; D511-Y514 WeakPolarHBondContact O-CB 3.5Å; D511-Y514 PolarHBondContact O-N 2.96Å; Y514-K517 CarbonylContact O-C 3.55Å; Y514-K517 PolarHBondContact O-N 2.97Å; Y514-K517 VanDerWaalsContact O-N 3.16Å; Y514-I518 HydrophobicContact CD1-CD1 3.7Å; Y514-I518 HydrophobicContact CD1-CG1 4.21Å; Y514-I518 HydrophobicContact CE1-CD1 3.9Å; Y514-I518 HydrophobicContact CE1-CG1 4.31Å; Y514-I518 WeakPolarHBondContact O-CG1 3.38Å; Y514-I518 PolarHBondContact O-N 2.91Å
515	Q	76.1	Confident	75.7	Confident	98 Å²	98	103.9 Å²	103.9	46%	0.458	51%	0.505	S	S	.	.	H	α-helix	trans	-63	-39.7	171.8	-65.3	-62.3	-31.3	0	0	111.6	D511 K517 I518 K519	D511-Q515 VanDerWaalsContact O-CG 3.32Å; D511-Q515 WeakPolarHBondContact O-CG 3.46Å; D511-Q515 PolarHBondContact O-N 2.8Å; Q515-K517 VanDerWaalsContact C-N 3.34Å; Q515-I518 PolarHBondContact O-N 3.01Å; Q515-K519 PolarHBondContact O-N 2.88Å
516	Q	76.8	Confident	75.8	Confident	107 Å²	107	106.2 Å²	106.2	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-42.2	171.3	-176.9	178.2	-21.1	0	0	111.3	D512 K519 E520	D512-Q516 PolarHBondContact O-N 3.31Å; Q516-K519 PolarHBondContact O-N 3.06Å; Q516-E520 WeakPolarHBondContact CG-OE1 3.36Å; Q516-E520 PolarHBondContact NE2-OE1 3.01Å; Q516-E520 WeakPolarHBondContact O-CG 3.26Å; Q516-E520 PolarHBondContact O-N 2.98Å
517	K	75.1	Confident	75.8	Confident	124 Å²	124	106 Å²	106	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-70.7	-29.2	177.1	-76.7	-71.3	167.6	-161.8	0	114.2	L513 Y514 Q515 E520 A521	L513-K517 WeakPolarHBondContact O-CG 3.48Å; L513-K517 PolarHBondContact O-N 3.05Å; Y514-K517 CarbonylContact O-C 3.55Å; Y514-K517 PolarHBondContact O-N 2.97Å; Y514-K517 VanDerWaalsContact O-N 3.16Å; Q515-K517 VanDerWaalsContact C-N 3.34Å; K517-E520 WeakPolarHBondContact CE-OE2 3.48Å; K517-E520 IonicContact NZ-OE2 2.69Å; K517-E520 PolarHBondContact NZ-OE2 2.85Å; K517-A521 WeakPolarHBondContact O-CB 3.33Å; K517-A521 PolarHBondContact O-N 3.29Å; K517-A521 VanDerWaalsContact O-N 3.13Å
518	I	76.3	Confident	75.7	Confident	57 Å²	57	104.8 Å²	104.8	29%	0.292	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-50.3	168.1	-72.9	167.1	0	0	0	109.1	Y514 Q515 E520 A521 E522	Y514-I518 HydrophobicContact CD1-CD1 3.7Å; Y514-I518 HydrophobicContact CD1-CG1 4.21Å; Y514-I518 HydrophobicContact CE1-CD1 3.9Å; Y514-I518 HydrophobicContact CE1-CG1 4.31Å; Y514-I518 WeakPolarHBondContact O-CG1 3.38Å; Y514-I518 PolarHBondContact O-N 2.91Å; Q515-I518 PolarHBondContact O-N 3.01Å; I518-E520 PolarHBondContact O-N 2.82Å; I518-A521 CarbonylContact O-C 3.57Å; I518-A521 WeakPolarHBondContact O-CA 3.08Å; I518-A521 WeakPolarHBondContact O-CB 3.49Å; I518-A521 PolarHBondContact O-N 3.18Å; I518-E522 HydrophobicContact CG2-CG 4.1Å; I518-E522 WeakPolarHBondContact O-CG 3.2Å; I518-E522 PolarHBondContact O-N 2.87Å
519	K	76.7	Confident	75.7	Confident	126 Å²	126	103 Å²	103	55%	0.548	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-43.9	177.7	-80.1	-165.1	165.2	-156.2	0	114.2	Q515 Q516 A521 E522 E523	Q515-K519 PolarHBondContact O-N 2.88Å; Q516-K519 PolarHBondContact O-N 3.06Å; K519-A521 PolarHBondContact O-N 3.47Å; K519-E522 PolarHBondContact O-N 2.65Å; K519-E523 WeakPolarHBondContact O-CB 3.48Å; K519-E523 WeakPolarHBondContact O-CG 3.49Å; K519-E523 PolarHBondContact O-N 2.84Å
520	E	75.6	Confident	75.6	Confident	75 Å²	75	99.9 Å²	99.9	35%	0.35	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-29.1	175.5	-72.2	173.1	-163.8	0	0	111.9	Q516 K517 I518 E524	Q516-E520 WeakPolarHBondContact CG-OE1 3.36Å; Q516-E520 PolarHBondContact NE2-OE1 3.01Å; Q516-E520 WeakPolarHBondContact O-CG 3.26Å; Q516-E520 PolarHBondContact O-N 2.98Å; K517-E520 WeakPolarHBondContact CE-OE2 3.48Å; K517-E520 IonicContact NZ-OE2 2.69Å; K517-E520 PolarHBondContact NZ-OE2 2.85Å; I518-E520 PolarHBondContact O-N 2.82Å; E520-E524 PolarHBondContact O-N 2.93Å
521	A	72.3	Confident	75.6	Confident	52 Å²	52	100.3 Å²	100.3	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-78.8	-41.3	172.5	0	0	0	0	0	112.6	K517 I518 K519 E524 D525	K517-A521 WeakPolarHBondContact O-CB 3.33Å; K517-A521 PolarHBondContact O-N 3.29Å; K517-A521 VanDerWaalsContact O-N 3.13Å; I518-A521 CarbonylContact O-C 3.57Å; I518-A521 WeakPolarHBondContact O-CA 3.08Å; I518-A521 WeakPolarHBondContact O-CB 3.49Å; I518-A521 PolarHBondContact O-N 3.18Å; K519-A521 PolarHBondContact O-N 3.47Å; A521-E524 PolarHBondContact O-N 3.14Å; A521-D525 WeakPolarHBondContact O-CB 3.25Å; A521-D525 PolarHBondContact O-N 3.33Å
522	E	76.6	Confident	75.6	Confident	115 Å²	115	101.9 Å²	101.9	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-61.6	-42.1	175.4	-71.5	173.7	153.6	0	0	111.4	I518 K519 E524 D525 E526	I518-E522 HydrophobicContact CG2-CG 4.1Å; I518-E522 WeakPolarHBondContact O-CG 3.2Å; I518-E522 PolarHBondContact O-N 2.87Å; K519-E522 PolarHBondContact O-N 2.65Å; E522-E524 VanDerWaalsContact C-N 3.34Å; E522-E524 PolarHBondContact O-N 2.68Å; E522-D525 PolarHBondContact O-N 3.39Å; E522-E526 WeakPolarHBondContact O-CB 3.29Å; E522-E526 PolarHBondContact O-N 3.23Å
523	E	77.1	Confident	75.5	Confident	131 Å²	131	102.7 Å²	102.7	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-67.6	-29.9	176.2	-73.3	177.9	-163.1	0	0	112.6	K519 K527	K519-E523 WeakPolarHBondContact O-CB 3.48Å; K519-E523 WeakPolarHBondContact O-CG 3.49Å; K519-E523 PolarHBondContact O-N 2.84Å; E523-K527 WeakPolarHBondContact O-CB 3.49Å
524	E	73.5	Confident	75.2	Confident	104 Å²	104	101 Å²	101	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-85.3	-30.2	175.2	-154.3	89.4	-103.8	0	0	112.1	E520 A521 E522 K527 C528	E520-E524 PolarHBondContact O-N 2.93Å; A521-E524 PolarHBondContact O-N 3.14Å; E522-E524 VanDerWaalsContact C-N 3.34Å; E522-E524 PolarHBondContact O-N 2.68Å; E524-K527 WeakPolarHBondContact O-CB 3.39Å; E524-K527 PolarHBondContact O-N 2.88Å; E524-K527 VanDerWaalsContact OE1-CD 3.29Å; E524-K527 WeakPolarHBondContact OE1-CD 3.4Å; E524-K527 WeakPolarHBondContact OE1-CE 3.36Å; E524-K527 IonicContact OE1-NZ 2.61Å; E524-K527 PolarHBondContact OE1-NZ 2.93Å; E524-C528 WeakPolarHBondContact O-CB 3.36Å; E524-C528 PolarHBondContact O-N 2.74Å; E524-C528 PolarHBondContact O-SG 3.06Å; E524-C528 VanDerWaalsContact O-SG 3.33Å
525	D	71.3	Confident	75.3	Confident	118 Å²	118	98.4 Å²	98.4	63%	0.631	51%	0.506	S	S	*	.	H	α-helix	trans	-70.9	-39.7	172.3	-94.8	-9.1	0	0	0	111.6	A521 E522 K527 C528 A529	A521-D525 WeakPolarHBondContact O-CB 3.25Å; A521-D525 PolarHBondContact O-N 3.33Å; E522-D525 PolarHBondContact O-N 3.39Å; D525-K527 PolarHBondContact O-N 2.88Å; D525-C528 PolarHBondContact O-N 2.96Å; D525-A529 WeakPolarHBondContact O-CB 3.32Å; D525-A529 PolarHBondContact O-N 3.08Å
526	E	76.7	Confident	75.2	Confident	148 Å²	148	98.1 Å²	98.1	69%	0.692	50%	0.504	S	S	*	.	H	α-helix	trans	-65.8	-30.7	174.7	-171.4	167.1	-132	0	0	111.5	E522 S530	E522-E526 WeakPolarHBondContact O-CB 3.29Å; E522-E526 PolarHBondContact O-N 3.23Å; E526-S530 WeakPolarHBondContact O-CB 3.45Å; E526-S530 PolarHBondContact O-N 3.41Å; E526-S530 PolarHBondContact O-OG 3.49Å
527	K	75.4	Confident	75.1	Confident	109 Å²	109	98.7 Å²	98.7	47%	0.474	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-47.6	172.3	-150.7	173.4	168.6	-165.6	0	111.7	E523 E524 D525 A529 S530 E531	E523-K527 WeakPolarHBondContact O-CB 3.49Å; E524-K527 WeakPolarHBondContact O-CB 3.39Å; E524-K527 PolarHBondContact O-N 2.88Å; E524-K527 VanDerWaalsContact OE1-CD 3.29Å; E524-K527 WeakPolarHBondContact OE1-CD 3.4Å; E524-K527 WeakPolarHBondContact OE1-CE 3.36Å; E524-K527 IonicContact OE1-NZ 2.61Å; E524-K527 PolarHBondContact OE1-NZ 2.93Å; D525-K527 PolarHBondContact O-N 2.88Å; K527-A529 VanDerWaalsContact C-N 3.3Å; K527-A529 PolarHBondContact O-N 3.37Å; K527-S530 WeakPolarHBondContact CA-OG 3.38Å; K527-S530 PolarHBondContact O-N 2.77Å; K527-S530 PolarHBondContact O-OG 3.34Å; K527-S530 VanDerWaalsContact O-OG 3.08Å; K527-E531 WeakPolarHBondContact O-CB 3.47Å; K527-E531 PolarHBondContact O-N 3.29Å
528	C	73	Confident	75.1	Confident	70 Å²	70	98.2 Å²	98.2	47%	0.473	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-38.4	172.7	-74.4	0	0	0	0	111.7	E524 D525 L532	E524-C528 WeakPolarHBondContact O-CB 3.36Å; E524-C528 PolarHBondContact O-N 2.74Å; E524-C528 PolarHBondContact O-SG 3.06Å; E524-C528 VanDerWaalsContact O-SG 3.33Å; D525-C528 PolarHBondContact O-N 2.96Å; C528-L532 WeakPolarHBondContact O-CB 3.34Å; C528-L532 PolarHBondContact O-N 2.87Å
529	A	74.8	Confident	75.1	Confident	58 Å²	58	99.9 Å²	99.9	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-40.8	177.2	0	0	0	0	0	111.9	D525 K527 L532 E533	D525-A529 WeakPolarHBondContact O-CB 3.32Å; D525-A529 PolarHBondContact O-N 3.08Å; K527-A529 VanDerWaalsContact C-N 3.3Å; K527-A529 PolarHBondContact O-N 3.37Å; A529-L532 PolarHBondContact O-N 3.18Å; A529-E533 VanDerWaalsContact O-CB 3.29Å; A529-E533 WeakPolarHBondContact O-CB 3.28Å; A529-E533 PolarHBondContact O-N 3.08Å
530	S	77.3	Confident	74.9	Confident	68 Å²	68	100.1 Å²	100.1	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-73.9	-36.4	176.9	49.4	0	0	0	0	113	E526 K527 S534	E526-S530 WeakPolarHBondContact O-CB 3.45Å; E526-S530 PolarHBondContact O-N 3.41Å; E526-S530 PolarHBondContact O-OG 3.49Å; K527-S530 WeakPolarHBondContact CA-OG 3.38Å; K527-S530 PolarHBondContact O-N 2.77Å; K527-S530 PolarHBondContact O-OG 3.34Å; K527-S530 VanDerWaalsContact O-OG 3.08Å; S530-S534 WeakPolarHBondContact O-CB 3.35Å; S530-S534 PolarHBondContact O-N 3.09Å
531	E	76.1	Confident	74.9	Confident	121 Å²	121	101.8 Å²	101.8	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-45.3	168.3	-74.6	-170.9	-175.5	0	0	111.3	K527 S534 L535	K527-E531 WeakPolarHBondContact O-CB 3.47Å; K527-E531 PolarHBondContact O-N 3.29Å; E531-S534 WeakPolarHBondContact O-CB 3.46Å; E531-S534 PolarHBondContact O-N 2.88Å; E531-S534 PolarHBondContact O-OG 2.98Å; E531-L535 WeakPolarHBondContact O-CG 3.4Å; E531-L535 PolarHBondContact O-N 2.89Å
532	L	75.1	Confident	74.9	Confident	105 Å²	105	103.9 Å²	103.9	55%	0.55	53%	0.527	S	S	.	.	H	α-helix	trans	-67.2	-38	178.9	-170.7	145.6	0	0	0	112.2	C528 A529 S534 L535 E536	C528-L532 WeakPolarHBondContact O-CB 3.34Å; C528-L532 PolarHBondContact O-N 2.87Å; A529-L532 PolarHBondContact O-N 3.18Å; L532-S534 VanDerWaalsContact C-N 3.3Å; L532-S534 PolarHBondContact O-N 3.27Å; L532-L535 CarbonylContact O-C 3.59Å; L532-L535 PolarHBondContact O-N 2.8Å; L532-E536 WeakPolarHBondContact O-CB 3.33Å; L532-E536 PolarHBondContact O-N 2.85Å
533	E	75.2	Confident	74.6	Confident	104 Å²	104	102.7 Å²	102.7	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-34.5	172.9	-157.6	-147.1	-178.8	0	0	111.3	A529 K537	A529-E533 VanDerWaalsContact O-CB 3.29Å; A529-E533 WeakPolarHBondContact O-CB 3.28Å; A529-E533 PolarHBondContact O-N 3.08Å; E533-K537 WeakPolarHBondContact O-CB 3.48Å; E533-K537 WeakPolarHBondContact O-CD 3.23Å; E533-K537 WeakPolarHBondContact O-CG 3.22Å; E533-K537 PolarHBondContact O-N 2.92Å; E533-K537 WeakPolarHBondContact OE1-CE 3.16Å; E533-K537 IonicContact OE1-NZ 2.68Å; E533-K537 PolarHBondContact OE1-NZ 3.45Å; E533-K537 IonicContact OE2-NZ 2.64Å; E533-K537 PolarHBondContact OE2-NZ 3.4Å
534	S	75.4	Confident	74.2	Confident	66 Å²	66	99.3 Å²	99.3	46%	0.462	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-39.2	172.4	87.9	0	0	0	0	112.2	S530 E531 L532 K537 H538	S530-S534 WeakPolarHBondContact O-CB 3.35Å; S530-S534 PolarHBondContact O-N 3.09Å; E531-S534 WeakPolarHBondContact O-CB 3.46Å; E531-S534 PolarHBondContact O-N 2.88Å; E531-S534 PolarHBondContact O-OG 2.98Å; L532-S534 VanDerWaalsContact C-N 3.3Å; L532-S534 PolarHBondContact O-N 3.27Å; S534-K537 PolarHBondContact O-N 2.8Å; S534-H538 WeakPolarHBondContact O-CB 3.36Å; S534-H538 PolarHBondContact O-N 3.28Å
535	L	75.9	Confident	74	Confident	111 Å²	111	98.5 Å²	98.5	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-72.3	-36.1	176.8	-75.4	166.2	0	0	0	112.1	E531 L532 H538 K539	E531-L535 WeakPolarHBondContact O-CG 3.4Å; E531-L535 PolarHBondContact O-N 2.89Å; L532-L535 CarbonylContact O-C 3.59Å; L532-L535 PolarHBondContact O-N 2.8Å; L535-H538 PolarHBondContact O-N 3.11Å; L535-K539 WeakPolarHBondContact O-CB 3.45Å; L535-K539 PolarHBondContact O-N 2.94Å
536	E	72.3	Confident	74.1	Confident	92 Å²	92	97.2 Å²	97.2	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-67.9	-39.4	174.2	-160.5	75.7	-113.8	0	0	110.3	L532 K539 H540	L532-E536 WeakPolarHBondContact O-CB 3.33Å; L532-E536 PolarHBondContact O-N 2.85Å; E536-K539 PolarHBondContact O-N 2.89Å; E536-K539 WeakPolarHBondContact OE1-CD 3.21Å; E536-K539 WeakPolarHBondContact OE1-CE 3.43Å; E536-K539 IonicContact OE1-NZ 2.63Å; E536-K539 PolarHBondContact OE1-NZ 2.95Å; E536-H540 VanDerWaalsContact O-CB 3.3Å; E536-H540 WeakPolarHBondContact O-CB 3.09Å; E536-H540 PolarHBondContact O-N 3.12Å
537	K	76	Confident	73.8	Confident	118 Å²	118	94.9 Å²	94.9	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-43.6	170.2	-74	163.7	-175.5	168.6	0	111.9	E533 S534 L541	E533-K537 WeakPolarHBondContact O-CB 3.48Å; E533-K537 WeakPolarHBondContact O-CD 3.23Å; E533-K537 WeakPolarHBondContact O-CG 3.22Å; E533-K537 PolarHBondContact O-N 2.92Å; E533-K537 WeakPolarHBondContact OE1-CE 3.16Å; E533-K537 IonicContact OE1-NZ 2.68Å; E533-K537 PolarHBondContact OE1-NZ 3.45Å; E533-K537 IonicContact OE2-NZ 2.64Å; E533-K537 PolarHBondContact OE2-NZ 3.4Å; S534-K537 PolarHBondContact O-N 2.8Å; K537-L541 WeakPolarHBondContact O-CB 3.42Å; K537-L541 PolarHBondContact O-N 3.22Å
538	H	74.8	Confident	73.6	Confident	114 Å²	114	94.9 Å²	94.9	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-68.2	-38.3	177.3	-166.8	-73.7	0	0	0	112.1	S534 L535 L541 L542	S534-H538 WeakPolarHBondContact O-CB 3.36Å; S534-H538 PolarHBondContact O-N 3.28Å; L535-H538 PolarHBondContact O-N 3.11Å; H538-L541 PolarHBondContact O-N 3.1Å; H538-L542 PolarHBondContact O-N 3.1Å
539	K	75.3	Confident	73.6	Confident	93 Å²	93	93 Å²	93	40%	0.404	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-50.1	172.9	172.6	-171.8	150.8	-152.7	0	110.7	L535 E536 L541 L542 E543	L535-K539 WeakPolarHBondContact O-CB 3.45Å; L535-K539 PolarHBondContact O-N 2.94Å; E536-K539 PolarHBondContact O-N 2.89Å; E536-K539 WeakPolarHBondContact OE1-CD 3.21Å; E536-K539 WeakPolarHBondContact OE1-CE 3.43Å; E536-K539 IonicContact OE1-NZ 2.63Å; E536-K539 PolarHBondContact OE1-NZ 2.95Å; K539-L541 PolarHBondContact O-N 3.32Å; K539-L542 CarbonylContact O-C 3.58Å; K539-L542 WeakPolarHBondContact O-CA 3.34Å; K539-L542 WeakPolarHBondContact O-CB 3.5Å; K539-L542 PolarHBondContact O-N 3.31Å; K539-E543 VanDerWaalsContact CE-CD 3.45Å; K539-E543 WeakPolarHBondContact CE-OE1 3.39Å; K539-E543 WeakPolarHBondContact CE-OE2 3.47Å; K539-E543 HydrophobicContact CG-CG 4.21Å; K539-E543 WeakPolarHBondContact O-CB 3.5Å; K539-E543 WeakPolarHBondContact O-CG 3.44Å; K539-E543 PolarHBondContact O-N 3.22Å
540	H	72.9	Confident	73.4	Confident	131 Å²	131	94.8 Å²	94.8	61%	0.606	50%	0.498	S	S	*	.	H	α-helix	trans	-63.2	-32.1	177.7	-168.1	-38.9	0	0	0	111.6	E536 S544	E536-H540 VanDerWaalsContact O-CB 3.3Å; E536-H540 WeakPolarHBondContact O-CB 3.09Å; E536-H540 PolarHBondContact O-N 3.12Å; H540-S544 WeakPolarHBondContact O-CB 3.2Å; H540-S544 PolarHBondContact O-N 3.25Å
541	L	76.5	Confident	73.2	Confident	109 Å²	109	94.4 Å²	94.4	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-68.2	-40.9	171.4	-173.8	64.9	0	0	0	111.9	K537 H538 K539 T545	K537-L541 WeakPolarHBondContact O-CB 3.42Å; K537-L541 PolarHBondContact O-N 3.22Å; H538-L541 PolarHBondContact O-N 3.1Å; K539-L541 PolarHBondContact O-N 3.32Å; L541-T545 WeakPolarHBondContact O-CB 3.48Å; L541-T545 PolarHBondContact O-N 3.12Å; L541-T545 PolarHBondContact O-OG1 3Å
542	L	71.3	Confident	73.1	Confident	97 Å²	97	93.2 Å²	93.2	51%	0.508	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-47.6	174.7	-122.7	74.7	0	0	0	112	H538 K539 S544 T545 V546	H538-L542 PolarHBondContact O-N 3.1Å; K539-L542 CarbonylContact O-C 3.58Å; K539-L542 WeakPolarHBondContact O-CA 3.34Å; K539-L542 WeakPolarHBondContact O-CB 3.5Å; K539-L542 PolarHBondContact O-N 3.31Å; L542-S544 VanDerWaalsContact C-N 3.31Å; L542-S544 PolarHBondContact O-N 3.36Å; L542-T545 CarbonylContact O-C 3.5Å; L542-T545 PolarHBondContact O-N 2.7Å; L542-T545 VanDerWaalsContact O-N 3.17Å; L542-V546 VanDerWaalsContact O-CB 3.3Å; L542-V546 WeakPolarHBondContact O-CB 3.45Å; L542-V546 VanDerWaalsContact O-CG2 3.27Å; L542-V546 WeakPolarHBondContact O-CG2 3.26Å; L542-V546 PolarHBondContact O-N 3.17Å
543	E	70	Confident	73.1	Confident	90 Å²	90	90.5 Å²	90.5	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-63.5	-37.8	176.8	-72.2	175.3	162.8	0	0	110.8	K539 N547	K539-E543 VanDerWaalsContact CE-CD 3.45Å; K539-E543 WeakPolarHBondContact CE-OE1 3.39Å; K539-E543 WeakPolarHBondContact CE-OE2 3.47Å; K539-E543 HydrophobicContact CG-CG 4.21Å; K539-E543 WeakPolarHBondContact O-CB 3.5Å; K539-E543 WeakPolarHBondContact O-CG 3.44Å; K539-E543 PolarHBondContact O-N 3.22Å; E543-N547 WeakPolarHBondContact O-CB 3.39Å; E543-N547 PolarHBondContact O-N 3.44Å; E543-N547 PolarHBondContact O-ND2 2.9Å
544	S	69.4	Low	72.8	Confident	59 Å²	59	91.4 Å²	91.4	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-49.8	170	-174.7	0	0	0	0	111	H540 L542 V546 N547 Q548	H540-S544 WeakPolarHBondContact O-CB 3.2Å; H540-S544 PolarHBondContact O-N 3.25Å; L542-S544 VanDerWaalsContact C-N 3.31Å; L542-S544 PolarHBondContact O-N 3.36Å; S544-V546 PolarHBondContact O-N 2.94Å; S544-N547 PolarHBondContact O-N 3.42Å; S544-Q548 WeakPolarHBondContact O-CB 3.37Å; S544-Q548 PolarHBondContact O-N 3.09Å
545	T	69.5	Low	72.7	Confident	87 Å²	87	92.8 Å²	92.8	53%	0.534	49%	0.49	S	S	.	.	H	α-helix	trans	-68.1	-36.2	-177.6	-54.8	0	0	0	0	112.7	L541 L542 G549	L541-T545 WeakPolarHBondContact O-CB 3.48Å; L541-T545 PolarHBondContact O-N 3.12Å; L541-T545 PolarHBondContact O-OG1 3Å; L542-T545 CarbonylContact O-C 3.5Å; L542-T545 PolarHBondContact O-N 2.7Å; L542-T545 VanDerWaalsContact O-N 3.17Å; T545-G549 PolarHBondContact O-N 2.85Å
546	V	72.5	Confident	72.7	Confident	92 Å²	92	93.9 Å²	93.9	56%	0.558	49%	0.492	S	S	*	.	H	α-helix	trans	-75.6	-39.4	177.1	170.6	0	0	0	0	111	L542 S544 G549 L550	L542-V546 VanDerWaalsContact O-CB 3.3Å; L542-V546 WeakPolarHBondContact O-CB 3.45Å; L542-V546 VanDerWaalsContact O-CG2 3.27Å; L542-V546 WeakPolarHBondContact O-CG2 3.26Å; L542-V546 PolarHBondContact O-N 3.17Å; S544-V546 PolarHBondContact O-N 2.94Å; V546-G549 PolarHBondContact O-N 2.8Å; V546-L550 WeakPolarHBondContact O-CB 3.27Å; V546-L550 PolarHBondContact O-N 2.83Å
547	N	70.2	Confident	72.9	Confident	99 Å²	99	94.7 Å²	94.7	53%	0.529	50%	0.499	S	S	.	.	H	α-helix	trans	-72.6	-32.9	174.3	-70.5	-44.9	0	0	0	112.1	E543 S544 S551	E543-N547 WeakPolarHBondContact O-CB 3.39Å; E543-N547 PolarHBondContact O-N 3.44Å; E543-N547 PolarHBondContact O-ND2 2.9Å; S544-N547 PolarHBondContact O-N 3.42Å; N547-S551 WeakPolarHBondContact O-CB 3.32Å; N547-S551 PolarHBondContact O-N 3.23Å
548	Q	72	Confident	72.8	Confident	108 Å²	108	92.9 Å²	92.9	51%	0.505	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-56.1	168	-177.6	81.7	30.8	0	0	109.5	S544 L550 S551 E552	S544-Q548 WeakPolarHBondContact O-CB 3.37Å; S544-Q548 PolarHBondContact O-N 3.09Å; Q548-L550 VanDerWaalsContact C-N 3.35Å; Q548-L550 PolarHBondContact O-N 3.47Å; Q548-S551 WeakPolarHBondContact O-CB 3.13Å; Q548-S551 PolarHBondContact O-N 2.95Å; Q548-E552 WeakPolarHBondContact CG-OE1 3.49Å; Q548-E552 PolarHBondContact NE2-OE1 3.42Å; Q548-E552 WeakPolarHBondContact O-CB 3.44Å; Q548-E552 WeakPolarHBondContact O-CG 3.18Å; Q548-E552 PolarHBondContact O-N 3.08Å
549	G	72.3	Confident	73	Confident	31 Å²	31	88.9 Å²	88.9	32%	0.32	48%	0.482	S	S	.	.	H	α-helix	trans	-65.1	-31.6	179.3	0	0	0	0	0	114.4	T545 V546 A553	T545-G549 PolarHBondContact O-N 2.85Å; V546-G549 PolarHBondContact O-N 2.8Å; G549-A553 WeakPolarHBondContact O-CB 3.27Å; G549-A553 PolarHBondContact O-N 2.75Å
550	L	72.2	Confident	73.1	Confident	95 Å²	95	88.7 Å²	88.7	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-71.8	-40.9	173.2	-175.5	69	0	0	0	111.1	V546 Q548 M554	V546-L550 WeakPolarHBondContact O-CB 3.27Å; V546-L550 PolarHBondContact O-N 2.83Å; Q548-L550 VanDerWaalsContact C-N 3.35Å; Q548-L550 PolarHBondContact O-N 3.47Å; L550-M554 HydrophobicContact CG-SD 4.27Å; L550-M554 VanDerWaalsContact O-CB 3.3Å; L550-M554 WeakPolarHBondContact O-CB 3.42Å; L550-M554 VanDerWaalsContact O-CG 3.24Å; L550-M554 WeakPolarHBondContact O-CG 3.49Å; L550-M554 PolarHBondContact O-N 2.89Å
551	S	71.8	Confident	73.1	Confident	61 Å²	61	87.7 Å²	87.7	43%	0.427	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-45.4	172.8	-178.2	0	0	0	0	110.8	N547 Q548 M554 N555	N547-S551 WeakPolarHBondContact O-CB 3.32Å; N547-S551 PolarHBondContact O-N 3.23Å; Q548-S551 WeakPolarHBondContact O-CB 3.13Å; Q548-S551 PolarHBondContact O-N 2.95Å; S551-M554 PolarHBondContact O-N 3.48Å; S551-N555 VanDerWaalsContact O-CB 3.3Å; S551-N555 WeakPolarHBondContact O-CB 3.46Å; S551-N555 PolarHBondContact O-N 3.06Å; S551-N555 PolarHBondContact O-ND2 2.99Å; S551-N555 PolarHBondContact OG-ND2 3.38Å
552	E	74.7	Confident	73	Confident	96 Å²	96	88.2 Å²	88.2	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-50.5	175.3	-74.1	165.6	177.1	0	0	110.6	Q548 M554 N555 E556	Q548-E552 WeakPolarHBondContact CG-OE1 3.49Å; Q548-E552 PolarHBondContact NE2-OE1 3.42Å; Q548-E552 WeakPolarHBondContact O-CB 3.44Å; Q548-E552 WeakPolarHBondContact O-CG 3.18Å; Q548-E552 PolarHBondContact O-N 3.08Å; E552-M554 VanDerWaalsContact C-N 3.35Å; E552-M554 PolarHBondContact O-N 3.5Å; E552-N555 CarbonylContact O-C 3.59Å; E552-N555 PolarHBondContact O-N 3.14Å; E552-E556 WeakPolarHBondContact O-CB 3.48Å; E552-E556 WeakPolarHBondContact O-CG 3.36Å; E552-E556 PolarHBondContact O-N 3.31Å
553	A	74	Confident	73.1	Confident	48 Å²	48	89.4 Å²	89.4	40%	0.397	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-33.4	176.8	0	0	0	0	0	113.9	G549 L557	G549-A553 WeakPolarHBondContact O-CB 3.27Å; G549-A553 PolarHBondContact O-N 2.75Å; A553-L557 VanDerWaalsContact O-CB 3.26Å; A553-L557 WeakPolarHBondContact O-CB 3.32Å; A553-L557 PolarHBondContact O-N 3.36Å
554	M	69.8	Low	73.4	Confident	123 Å²	123	93 Å²	93	61%	0.606	49%	0.492	S	S	*	.	H	α-helix	trans	-73.4	-37.4	173.6	-74.9	-177.6	72.4	0	0	112	L550 S551 E552 L557 D558	L550-M554 HydrophobicContact CG-SD 4.27Å; L550-M554 VanDerWaalsContact O-CB 3.3Å; L550-M554 WeakPolarHBondContact O-CB 3.42Å; L550-M554 VanDerWaalsContact O-CG 3.24Å; L550-M554 WeakPolarHBondContact O-CG 3.49Å; L550-M554 PolarHBondContact O-N 2.89Å; S551-M554 PolarHBondContact O-N 3.48Å; E552-M554 VanDerWaalsContact C-N 3.35Å; E552-M554 PolarHBondContact O-N 3.5Å; M554-L557 PolarHBondContact O-N 3.39Å; M554-D558 WeakPolarHBondContact O-CB 3.25Å; M554-D558 PolarHBondContact O-N 2.87Å
555	N	73.1	Confident	73.5	Confident	94 Å²	94	95.8 Å²	95.8	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-68.8	-37.3	173.5	-78.4	-61.2	0	0	0	111.6	S551 E552 A559	S551-N555 VanDerWaalsContact O-CB 3.3Å; S551-N555 WeakPolarHBondContact O-CB 3.46Å; S551-N555 PolarHBondContact O-N 3.06Å; S551-N555 PolarHBondContact O-ND2 2.99Å; S551-N555 PolarHBondContact OG-ND2 3.38Å; E552-N555 CarbonylContact O-C 3.59Å; E552-N555 PolarHBondContact O-N 3.14Å; N555-A559 WeakPolarHBondContact O-CB 3.41Å; N555-A559 PolarHBondContact O-N 3.02Å
556	E	77	Confident	73.8	Confident	134 Å²	134	96.5 Å²	96.5	63%	0.626	50%	0.499	S	S	*	.	H	α-helix	trans	-65.7	-45	171.4	-76.6	-176	169.1	0	0	111.4	E552 A559 V560	E552-E556 WeakPolarHBondContact O-CB 3.48Å; E552-E556 WeakPolarHBondContact O-CG 3.36Å; E552-E556 PolarHBondContact O-N 3.31Å; E556-A559 PolarHBondContact O-N 3.12Å; E556-V560 WeakPolarHBondContact O-CB 3.35Å; E556-V560 VanDerWaalsContact O-CG2 3.31Å; E556-V560 WeakPolarHBondContact O-CG2 3.45Å; E556-V560 PolarHBondContact O-N 3.13Å
557	L	76.3	Confident	74	Confident	110 Å²	110	96 Å²	96	58%	0.576	50%	0.496	S	S	*	.	H	α-helix	trans	-61	-47.9	176.3	180	62.9	0	0	0	111.3	A553 M554 A559 V560 Q561	A553-L557 VanDerWaalsContact O-CB 3.26Å; A553-L557 WeakPolarHBondContact O-CB 3.32Å; A553-L557 PolarHBondContact O-N 3.36Å; M554-L557 PolarHBondContact O-N 3.39Å; L557-A559 VanDerWaalsContact C-N 3.33Å; L557-A559 PolarHBondContact O-N 3.34Å; L557-V560 PolarHBondContact O-N 2.97Å; L557-Q561 WeakPolarHBondContact O-CB 3.47Å; L557-Q561 PolarHBondContact O-N 2.79Å
558	D	74.3	Confident	74	Confident	80 Å²	80	95 Å²	95	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-70	-29.7	178.2	-166.9	62.7	0	0	0	111.9	M554 R562	M554-D558 WeakPolarHBondContact O-CB 3.25Å; M554-D558 PolarHBondContact O-N 2.87Å; D558-R562 VanDerWaalsContact O-CB 3.25Å; D558-R562 WeakPolarHBondContact O-CB 3.43Å; D558-R562 VanDerWaalsContact O-CG 3.26Å; D558-R562 WeakPolarHBondContact O-CG 3.44Å; D558-R562 PolarHBondContact O-N 2.82Å; D558-R562 PolarHBondContact O-NE 3.42Å; D558-R562 IonicContact OD2-CZ 3.65Å; D558-R562 IonicContact OD2-NE 2.67Å; D558-R562 PolarHBondContact OD2-NE 2.84Å; D558-R562 IonicContact OD2-NH2 3.85Å; D558-R562 PolarHBondContact OD2-NH2 2.89Å
559	A	77.8	Confident	74.1	Confident	30 Å²	30	95.9 Å²	95.9	25%	0.248	50%	0.497	C	S	.	.	H	α-helix	trans	-66.9	-50.1	170.3	0	0	0	0	0	112	N555 E556 L557 Q561 R562 E563	N555-A559 WeakPolarHBondContact O-CB 3.41Å; N555-A559 PolarHBondContact O-N 3.02Å; E556-A559 PolarHBondContact O-N 3.12Å; L557-A559 VanDerWaalsContact C-N 3.33Å; L557-A559 PolarHBondContact O-N 3.34Å; A559-Q561 VanDerWaalsContact C-N 3.3Å; A559-Q561 PolarHBondContact O-N 3.47Å; A559-R562 CarbonylContact O-C 3.56Å; A559-R562 PolarHBondContact O-N 3.28Å; A559-E563 WeakPolarHBondContact O-CB 3.2Å; A559-E563 WeakPolarHBondContact O-CG 3.1Å; A559-E563 PolarHBondContact O-N 3.25Å
560	V	77.6	Confident	73.8	Confident	89 Å²	89	97.4 Å²	97.4	54%	0.539	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-35.8	176.8	169.8	0	0	0	0	111.2	E556 L557 E563 Y564	E556-V560 WeakPolarHBondContact O-CB 3.35Å; E556-V560 VanDerWaalsContact O-CG2 3.31Å; E556-V560 WeakPolarHBondContact O-CG2 3.45Å; E556-V560 PolarHBondContact O-N 3.13Å; L557-V560 PolarHBondContact O-N 2.97Å; V560-E563 PolarHBondContact O-N 2.94Å; V560-Y564 WeakPolarHBondContact O-CB 3.39Å; V560-Y564 PolarHBondContact O-N 3.3Å
561	Q	72.3	Confident	73.6	Confident	109 Å²	109	96.4 Å²	96.4	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-71.5	-36.9	176.3	-170.7	164.8	-13.8	0	0	111.9	L557 A559 Q565	L557-Q561 WeakPolarHBondContact O-CB 3.47Å; L557-Q561 PolarHBondContact O-N 2.79Å; A559-Q561 VanDerWaalsContact C-N 3.3Å; A559-Q561 PolarHBondContact O-N 3.47Å; Q561-Q565 PolarHBondContact O-N 2.96Å
562	R	74.6	Confident	73.3	Confident	121 Å²	121	97.4 Å²	97.4	46%	0.457	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-46.7	167.9	-80.2	-179.9	-91.9	109.6	-4.5	111.6	D558 A559 Y564 Q565 L566	D558-R562 VanDerWaalsContact O-CB 3.25Å; D558-R562 WeakPolarHBondContact O-CB 3.43Å; D558-R562 VanDerWaalsContact O-CG 3.26Å; D558-R562 WeakPolarHBondContact O-CG 3.44Å; D558-R562 PolarHBondContact O-N 2.82Å; D558-R562 PolarHBondContact O-NE 3.42Å; D558-R562 IonicContact OD2-CZ 3.65Å; D558-R562 IonicContact OD2-NE 2.67Å; D558-R562 PolarHBondContact OD2-NE 2.84Å; D558-R562 IonicContact OD2-NH2 3.85Å; D558-R562 PolarHBondContact OD2-NH2 2.89Å; A559-R562 CarbonylContact O-C 3.56Å; A559-R562 PolarHBondContact O-N 3.28Å; R562-Y564 PolarHBondContact O-N 2.98Å; R562-Q565 PolarHBondContact O-N 3.45Å; R562-L566 WeakPolarHBondContact O-CB 3.37Å; R562-L566 PolarHBondContact O-N 2.83Å
563	E	74	Confident	73	Confident	121 Å²	121	95.6 Å²	95.6	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-61.6	-39.7	177.3	-78	-171.7	162.9	0	0	112.1	A559 V560 Q565 L566 V567	A559-E563 WeakPolarHBondContact O-CB 3.2Å; A559-E563 WeakPolarHBondContact O-CG 3.1Å; A559-E563 PolarHBondContact O-N 3.25Å; V560-E563 PolarHBondContact O-N 2.94Å; E563-Q565 PolarHBondContact O-N 2.91Å; E563-L566 CarbonylContact O-C 3.57Å; E563-L566 PolarHBondContact O-N 3.32Å; E563-V567 WeakPolarHBondContact O-CB 3.2Å; E563-V567 VanDerWaalsContact O-CG2 3.28Å; E563-V567 WeakPolarHBondContact O-CG2 3.25Å; E563-V567 PolarHBondContact O-N 3.44Å
564	Y	75.5	Confident	72.3	Confident	165 Å²	165	99.4 Å²	99.4	65%	0.647	50%	0.503	S	S	*	.	H	α-helix	trans	-61	-45	174.7	179.3	-104.1	0	0	0	111.6	V560 R562 V567 V568	V560-Y564 WeakPolarHBondContact O-CB 3.39Å; V560-Y564 PolarHBondContact O-N 3.3Å; R562-Y564 PolarHBondContact O-N 2.98Å; Y564-V567 PolarHBondContact O-N 3.42Å; Y564-V568 HydrophobicContact CE1-CG2 4.29Å; Y564-V568 HydrophobicContact CE2-CG2 4.34Å; Y564-V568 WeakPolarHBondContact O-CG2 3.41Å; Y564-V568 PolarHBondContact O-N 3.47Å
565	Q	71.9	Confident	71.9	Confident	119 Å²	119	103.1 Å²	103.1	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-41.7	173	-69.2	-175.7	5.2	0	0	111.9	Q561 R562 E563 V568 Q569	Q561-Q565 PolarHBondContact O-N 2.96Å; R562-Q565 PolarHBondContact O-N 3.45Å; E563-Q565 PolarHBondContact O-N 2.91Å; Q565-V568 PolarHBondContact O-N 3.46Å; Q565-Q569 WeakPolarHBondContact O-CG 3.26Å; Q565-Q569 PolarHBondContact O-N 3.01Å
566	L	76.8	Confident	71.6	Confident	101 Å²	101	104.6 Å²	104.6	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-39.3	178	-121	161.8	0	0	0	111.8	R562 E563 Q569 T570	R562-L566 WeakPolarHBondContact O-CB 3.37Å; R562-L566 PolarHBondContact O-N 2.83Å; E563-L566 CarbonylContact O-C 3.57Å; E563-L566 PolarHBondContact O-N 3.32Å; L566-Q569 PolarHBondContact O-N 3.06Å; L566-T570 HydrophobicContact CD2-CG2 4.05Å; L566-T570 WeakPolarHBondContact O-CG2 3.16Å; L566-T570 PolarHBondContact O-N 3.2Å; L566-T570 PolarHBondContact O-OG1 3.05Å; L566-T570 VanDerWaalsContact O-OG1 3.12Å
567	V	75.6	Confident	70.9	Confident	82 Å²	82	103.7 Å²	103.7	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-75	-37.3	178.8	170.8	0	0	0	0	111.4	E563 Y564 Q569 T570 T571	E563-V567 WeakPolarHBondContact O-CB 3.2Å; E563-V567 VanDerWaalsContact O-CG2 3.28Å; E563-V567 WeakPolarHBondContact O-CG2 3.25Å; E563-V567 PolarHBondContact O-N 3.44Å; Y564-V567 PolarHBondContact O-N 3.42Å; V567-Q569 VanDerWaalsContact C-N 3.28Å; V567-Q569 PolarHBondContact O-N 2.89Å; V567-T570 WeakPolarHBondContact CA-OG1 3.22Å; V567-T570 PolarHBondContact O-N 3.13Å; V567-T570 PolarHBondContact O-OG1 2.99Å; V567-T571 VanDerWaalsContact O-CB 3.24Å; V567-T571 WeakPolarHBondContact O-CB 3.48Å; V567-T571 PolarHBondContact O-N 2.84Å; V567-T571 PolarHBondContact O-OG1 3.12Å
568	V	71.5	Confident	70.7	Confident	77 Å²	77	103.1 Å²	103.1	47%	0.467	50%	0.504	S	S	.	.	H	α-helix	trans	-59.4	-43.2	169.3	169.8	0	0	0	0	110.2	Y564 Q565 T572	Y564-V568 HydrophobicContact CE1-CG2 4.29Å; Y564-V568 HydrophobicContact CE2-CG2 4.34Å; Y564-V568 WeakPolarHBondContact O-CG2 3.41Å; Y564-V568 PolarHBondContact O-N 3.47Å; Q565-V568 PolarHBondContact O-N 3.46Å; V568-T572 PolarHBondContact O-N 3.02Å; V568-T572 PolarHBondContact O-OG1 3.36Å
569	Q	72.2	Confident	69.8	Low	128 Å²	128	101.7 Å²	101.7	60%	0.598	51%	0.507	S	S	*	.	H	α-helix	trans	-65.8	-51.2	174	-72.3	-176.2	9.9	0	0	112.7	Q565 L566 V567 T571 T572 E573	Q565-Q569 WeakPolarHBondContact O-CG 3.26Å; Q565-Q569 PolarHBondContact O-N 3.01Å; L566-Q569 PolarHBondContact O-N 3.06Å; V567-Q569 VanDerWaalsContact C-N 3.28Å; V567-Q569 PolarHBondContact O-N 2.89Å; Q569-T571 VanDerWaalsContact C-N 3.3Å; Q569-T571 PolarHBondContact O-N 3.21Å; Q569-T572 CarbonylContact O-C 3.57Å; Q569-T572 PolarHBondContact O-N 3.45Å; Q569-T572 PolarHBondContact O-OG1 2.88Å; Q569-E573 WeakPolarHBondContact O-CB 3.36Å; Q569-E573 PolarHBondContact O-N 2.92Å
570	T	67.5	Low	69.3	Low	63 Å²	63	104.1 Å²	104.1	39%	0.387	52%	0.516	S	S	.	.	H	α-helix	trans	-67.9	-27.5	-177.5	57.7	0	0	0	0	112.7	L566 V567 T572 E573 E574	L566-T570 HydrophobicContact CD2-CG2 4.05Å; L566-T570 WeakPolarHBondContact O-CG2 3.16Å; L566-T570 PolarHBondContact O-N 3.2Å; L566-T570 PolarHBondContact O-OG1 3.05Å; L566-T570 VanDerWaalsContact O-OG1 3.12Å; V567-T570 WeakPolarHBondContact CA-OG1 3.22Å; V567-T570 PolarHBondContact O-N 3.13Å; V567-T570 PolarHBondContact O-OG1 2.99Å; T570-T572 VanDerWaalsContact C-N 3.35Å; T570-E573 CarbonylContact O-C 3.57Å; T570-E573 PolarHBondContact O-N 3.16Å; T570-E574 VanDerWaalsContact O-CB 3.3Å; T570-E574 WeakPolarHBondContact O-CB 3.28Å; T570-E574 VanDerWaalsContact O-CG 3.31Å; T570-E574 WeakPolarHBondContact O-CG 3.23Å; T570-E574 PolarHBondContact O-N 3.31Å
571	T	68.1	Low	68.7	Low	73 Å²	73	104 Å²	104	45%	0.448	51%	0.513	S	S	.	.	H	α-helix	trans	-73.5	-26.1	172.6	-48.3	0	0	0	0	112.2	V567 Q569	V567-T571 VanDerWaalsContact O-CB 3.24Å; V567-T571 WeakPolarHBondContact O-CB 3.48Å; V567-T571 PolarHBondContact O-N 2.84Å; V567-T571 PolarHBondContact O-OG1 3.12Å; Q569-T571 VanDerWaalsContact C-N 3.3Å; Q569-T571 PolarHBondContact O-N 3.21Å
572	T	65.6	Low	68.1	Low	83 Å²	83	105.3 Å²	105.3	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-77.3	-32.8	165.9	54.1	0	0	0	0	112.5	V568 Q569 T570 R575	V568-T572 PolarHBondContact O-N 3.02Å; V568-T572 PolarHBondContact O-OG1 3.36Å; Q569-T572 CarbonylContact O-C 3.57Å; Q569-T572 PolarHBondContact O-N 3.45Å; Q569-T572 PolarHBondContact O-OG1 2.88Å; T570-T572 VanDerWaalsContact C-N 3.35Å; T572-R575 WeakPolarHBondContact O-CB 3.37Å; T572-R575 PolarHBondContact O-N 3.21Å
573	E	68.6	Low	67.5	Low	57 Å²	57	106.2 Å²	106.2	27%	0.266	53%	0.532	S	S	.	.	H	α-helix	trans	-79.4	-31.3	-178.2	-166.8	64.4	-174.7	0	0	112.7	Q569 T570 R575 R576 K577	Q569-E573 WeakPolarHBondContact O-CB 3.36Å; Q569-E573 PolarHBondContact O-N 2.92Å; T570-E573 CarbonylContact O-C 3.57Å; T570-E573 PolarHBondContact O-N 3.16Å; E573-R575 VanDerWaalsContact C-N 3.31Å; E573-R575 PolarHBondContact O-N 2.93Å; E573-R576 CarbonylContact O-C 3.6Å; E573-R576 PolarHBondContact O-N 2.99Å; E573-R576 VanDerWaalsContact O-N 3.08Å; E573-R576 IonicContact OE1-CZ 2.68Å; E573-R576 IonicContact OE1-NE 2.68Å; E573-R576 PolarHBondContact OE1-NE 3.05Å; E573-R576 IonicContact OE1-NH2 3.83Å; E573-R576 PolarHBondContact OE1-NH2 2.6Å; E573-R576 IonicContact OE2-CZ 3.88Å; E573-R576 IonicContact OE2-NE 3.6Å; E573-R576 PolarHBondContact OE2-NE 3.17Å; E573-R576 IonicContact OE2-NH2 3.38Å; E573-K577 HydrophobicContact CG-CD 3.95Å; E573-K577 HydrophobicContact CG-CG 4.21Å; E573-K577 WeakPolarHBondContact O-CB 3.25Å; E573-K577 PolarHBondContact O-N 2.63Å; E573-K577 WeakPolarHBondContact OE1-CE 3.33Å
574	E	57.9	Low	66.9	Low	128 Å²	128	106.5 Å²	106.5	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-45.6	-56.2	162.8	-93.2	-84.3	114.4	0	0	110.1	T570 R576 K577 V578	T570-E574 VanDerWaalsContact O-CB 3.3Å; T570-E574 WeakPolarHBondContact O-CB 3.28Å; T570-E574 VanDerWaalsContact O-CG 3.31Å; T570-E574 WeakPolarHBondContact O-CG 3.23Å; T570-E574 PolarHBondContact O-N 3.31Å; E574-R576 PolarHBondContact O-N 3.33Å; E574-K577 PolarHBondContact O-N 2.89Å; E574-V578 WeakPolarHBondContact O-CB 3.19Å; E574-V578 WeakPolarHBondContact O-CG2 3.32Å; E574-V578 PolarHBondContact O-N 3.43Å
575	R	61.8	Low	66.2	Low	201 Å²	201	105.4 Å²	105.4	76%	0.758	53%	0.532	S	S	*	.	H	α-helix	trans	-60.8	-19.6	-178.5	-153.5	-179.9	-57.6	-173.4	3.3	113.1	T572 E573	T572-R575 WeakPolarHBondContact O-CB 3.37Å; T572-R575 PolarHBondContact O-N 3.21Å; E573-R575 VanDerWaalsContact C-N 3.31Å; E573-R575 PolarHBondContact O-N 2.93Å
576	R	67.7	Low	65.4	Low	126 Å²	126	106.7 Å²	106.7	48%	0.475	54%	0.542	S	S	.	.	H	α-helix	trans	-99.2	-42.5	178.5	-159.7	-176.9	72.9	81.6	-4.4	112.8	E573 E574 G579 N580	E573-R576 CarbonylContact O-C 3.6Å; E573-R576 PolarHBondContact O-N 2.99Å; E573-R576 VanDerWaalsContact O-N 3.08Å; E573-R576 IonicContact OE1-CZ 2.68Å; E573-R576 IonicContact OE1-NE 2.68Å; E573-R576 PolarHBondContact OE1-NE 3.05Å; E573-R576 IonicContact OE1-NH2 3.83Å; E573-R576 PolarHBondContact OE1-NH2 2.6Å; E573-R576 IonicContact OE2-CZ 3.88Å; E573-R576 IonicContact OE2-NE 3.6Å; E573-R576 PolarHBondContact OE2-NE 3.17Å; E573-R576 IonicContact OE2-NH2 3.38Å; E574-R576 PolarHBondContact O-N 3.33Å; R576-G579 PolarHBondContact O-N 3.34Å; R576-N580 PolarHBondContact O-N 3.09Å; R576-N580 PolarHBondContact O-OD1 3.48Å
577	K	62.2	Low	65	Low	115 Å²	115	107.6 Å²	107.6	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-74.1	-33	-177.7	-78	179.8	179.3	167.9	0	113.2	E573 E574 G579 N580 N581	E573-K577 HydrophobicContact CG-CD 3.95Å; E573-K577 HydrophobicContact CG-CG 4.21Å; E573-K577 WeakPolarHBondContact O-CB 3.25Å; E573-K577 PolarHBondContact O-N 2.63Å; E573-K577 WeakPolarHBondContact OE1-CE 3.33Å; E574-K577 PolarHBondContact O-N 2.89Å; K577-G579 VanDerWaalsContact C-N 3.27Å; K577-G579 PolarHBondContact O-N 3.01Å; K577-N580 PolarHBondContact O-N 3.39Å; K577-N581 PolarHBondContact O-N 2.69Å
578	V	70.2	Confident	64	Low	98 Å²	98	108.9 Å²	108.9	59%	0.594	55%	0.546	S	S	*	.	H	α-helix	trans	-61.7	-39	169.7	173.8	0	0	0	0	110.4	E574 L582	E574-V578 WeakPolarHBondContact O-CB 3.19Å; E574-V578 WeakPolarHBondContact O-CG2 3.32Å; E574-V578 PolarHBondContact O-N 3.43Å; V578-L582 WeakPolarHBondContact O-CB 3.47Å
579	G	57.4	Low	63.5	Low	49 Å²	49	111.2 Å²	111.2	51%	0.505	56%	0.56	S	S	.	*	H	α-helix	trans	-63.9	-48.4	170.5	0	0	0	0	0	113.1	R576 K577	R576-G579 PolarHBondContact O-N 3.34Å; K577-G579 VanDerWaalsContact C-N 3.27Å; K577-G579 PolarHBondContact O-N 3.01Å
580	N	66.8	Low	62.5	Low	82 Å²	82	108.8 Å²	108.8	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-75.2	-40	-172.8	-93.3	59.2	0	0	0	115.4	R576 K577 Q583	R576-N580 PolarHBondContact O-N 3.09Å; R576-N580 PolarHBondContact O-OD1 3.48Å; K577-N580 PolarHBondContact O-N 3.39Å; N580-Q583 WeakPolarHBondContact O-CA 3.22Å; N580-Q583 WeakPolarHBondContact O-CB 3.4Å; N580-Q583 PolarHBondContact O-N 2.91Å; N580-Q583 VanDerWaalsContact O-N 3.15Å
581	N	63.8	Low	62.2	Low	87 Å²	87	110.3 Å²	110.3	47%	0.465	57%	0.571	S	S	.	*	H	α-helix	trans	-94.2	-10.7	-171	-78.4	-11.2	0	0	0	114.5	K577 Q583 R584 L585	K577-N581 PolarHBondContact O-N 2.69Å; N581-Q583 PolarHBondContact O-N 3.12Å; N581-R584 PolarHBondContact O-N 3.26Å; N581-R584 VanDerWaalsContact O-N 3.09Å; N581-L585 PolarHBondContact O-N 2.97Å; N581-L585 VanDerWaalsContact O-N 3.09Å
582	L	61.1	Low	61.8	Low	136 Å²	136	115.3 Å²	115.3	71%	0.712	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-27.3	153.1	-173.7	63.6	0	0	0	111.3	V578	V578-L582 WeakPolarHBondContact O-CB 3.47Å
583	Q	61.7	Low	61.4	Low	139 Å²	139	118 Å²	118	65%	0.65	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-17	175.2	-156.6	176.2	-18	0	0	113.9	N580 N581 L586	N580-Q583 WeakPolarHBondContact O-CA 3.22Å; N580-Q583 WeakPolarHBondContact O-CB 3.4Å; N580-Q583 PolarHBondContact O-N 2.91Å; N580-Q583 VanDerWaalsContact O-N 3.15Å; N581-Q583 PolarHBondContact O-N 3.12Å; Q583-L586 WeakPolarHBondContact O-CB 3.38Å
584	R	60.2	Low	60.6	Low	127 Å²	127	117.9 Å²	117.9	48%	0.479	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.1	-20.7	-176.7	-162.2	168.2	-172	-155	-6.4	114.7	N581 L586 E587 M588	N581-R584 PolarHBondContact O-N 3.26Å; N581-R584 VanDerWaalsContact O-N 3.09Å; R584-L586 PolarHBondContact O-N 3.3Å; R584-E587 HydrophobicContact CG-CB 4.34Å; R584-E587 IonicContact NE-OE2 2.7Å; R584-E587 WeakPolarHBondContact O-CB 3.35Å; R584-E587 PolarHBondContact O-N 3.41Å; R584-M588 PolarHBondContact O-N 3.33Å
585	L	61.4	Low	59.6	Low	143 Å²	143	116.6 Å²	116.6	75%	0.749	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-22.2	162.7	-107.6	165.7	0	0	0	112.2	N581 E587	N581-L585 PolarHBondContact O-N 2.97Å; N581-L585 VanDerWaalsContact O-N 3.09Å; L585-E587 PolarHBondContact O-N 3.48Å
586	L	54.3	Low	59.4	Low	146 Å²	146	114.3 Å²	114.3	76%	0.764	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-6.7	171.9	-54.2	174.7	0	0	0	113.8	Q583 R584	Q583-L586 WeakPolarHBondContact O-CB 3.38Å; R584-L586 PolarHBondContact O-N 3.3Å
587	E	68.9	Low	57.9	Low	120 Å²	120	116.5 Å²	116.5	56%	0.561	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	-60.3	-160.4	-165.9	179.3	-112.4	0	0	113.1	R584 L585 V589 A590	R584-E587 HydrophobicContact CG-CB 4.34Å; R584-E587 IonicContact NE-OE2 2.7Å; R584-E587 WeakPolarHBondContact O-CB 3.35Å; R584-E587 PolarHBondContact O-N 3.41Å; L585-E587 PolarHBondContact O-N 3.48Å; E587-V589 VanDerWaalsContact C-N 3.28Å; E587-V589 PolarHBondContact O-N 2.56Å; E587-A590 VanDerWaalsContact O-CB 3.31Å; E587-A590 WeakPolarHBondContact O-CB 3.44Å; E587-A590 PolarHBondContact O-N 3.42Å; E587-A590 VanDerWaalsContact O-N 3.17Å
588	M	55.6	Low	56.2	Low	109 Å²	109	120.3 Å²	120.3	54%	0.537	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-83.6	3.9	-164.4	-150	165.1	69.7	0	0	115.6	R584 A590 T591	R584-M588 PolarHBondContact O-N 3.33Å; M588-A590 PolarHBondContact O-N 3.14Å; M588-A590 VanDerWaalsContact O-N 3.17Å; M588-T591 HydrophobicContact CG-CG2 4.46Å; M588-T591 VanDerWaalsContact CG-OG1 3.23Å; M588-T591 WeakPolarHBondContact CG-OG1 3.19Å; M588-T591 PolarHBondContact O-N 3.21Å
589	V	60.6	Low	54	Low	125 Å²	125	122.5 Å²	122.5	76%	0.758	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-58.8	-18.1	160.3	175.3	0	0	0	0	111	E587	E587-V589 VanDerWaalsContact C-N 3.28Å; E587-V589 PolarHBondContact O-N 2.56Å
590	A	51.5	Low	53.1	Low	77 Å²	77	127.8 Å²	127.8	64%	0.636	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-75.8	-19	179.3	0	0	0	0	0	116.8	E587 M588	E587-A590 VanDerWaalsContact O-CB 3.31Å; E587-A590 WeakPolarHBondContact O-CB 3.44Å; E587-A590 PolarHBondContact O-N 3.42Å; E587-A590 VanDerWaalsContact O-N 3.17Å; M588-A590 PolarHBondContact O-N 3.14Å; M588-A590 VanDerWaalsContact O-N 3.17Å
591	T	60.9	Low	51.2	Low	96 Å²	96	131.3 Å²	131.3	59%	0.589	70%	0.698	S	S	*	*	S	Bend	trans	-115.1	-4.4	-161.8	64.3	0	0	0	0	117.2	M588 V593	M588-T591 HydrophobicContact CG-CG2 4.46Å; M588-T591 VanDerWaalsContact CG-OG1 3.23Å; M588-T591 WeakPolarHBondContact CG-OG1 3.19Å; M588-T591 PolarHBondContact O-N 3.21Å; T591-V593 PolarHBondContact O-N 3.01Å; T591-V593 VanDerWaalsContact O-N 3.1Å
592	H	58.6	Low	49	Very low	177 Å²	177	136.4 Å²	136.4	82%	0.819	72%	0.719	S	S	*	*			trans	-60.6	-18.8	179.9	164.3	-92.3	0	0	0	114.2	G594	H592-G594 PolarHBondContact O-N 2.83Å
593	V	59.2	Low	47.9	Very low	139 Å²	139	138.4 Å²	138.4	84%	0.842	72%	0.724	S	S	*	*	S	Bend	trans	-79.5	53.1	-173.7	-163.6	0	0	0	0	111.4	T591	T591-V593 PolarHBondContact O-N 3.01Å; T591-V593 VanDerWaalsContact O-N 3.1Å
594	G	50.6	Low	46.8	Very low	56 Å²	56	139.6 Å²	139.6	58%	0.577	73%	0.734	S	S	*	*			trans	-102.5	-122.4	-162.2	0	0	0	0	0	116.9	H592	H592-G594 PolarHBondContact O-N 2.83Å
595	S	36.2	Very low	45.5	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	74%	0.742	S	S	*	*			trans	-139.6	50.9	-137.9	64.2	0	0	0	0	116.3	E597	S595-E597 PolarHBondContact O-N 3.36Å
596	V	57.5	Low	44.4	Very low	153 Å²	153	140.8 Å²	140.8	93%	0.927	75%	0.751	S	S	*	*			trans	-80.1	25.7	-176.8	174.8	0	0	0	0	113.1
597	E	37.5	Very low	43.5	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	74%	0.744	S	S	*	*			trans	-97.3	4.8	-154.5	-59.2	176.3	113.5	0	0	116.2	S595	S595-E597 PolarHBondContact O-N 3.36Å
598	K	26.9	Very low	42.4	Very low	194 Å²	194	138.5 Å²	138.5	84%	0.843	75%	0.754	S	S	*	*			trans	-142.9	69.5	-153.2	-141.8	171.8	-173.8	177.9	0	122
599	H	22.9	Very low	42.3	Very low	145 Å²	145	144.4 Å²	144.4	67%	0.671	77%	0.77	S	S	*	*				81.4	163.7	121	-136.6	40.2	0	0	0	123.1	E601	H599-E601 IonicContact CD2-OE1 2.72Å; H599-E601 PolarHBondContact CD2-OE1 2.89Å; H599-E601 IonicContact CD2-OE2 2.63Å; H599-E601 PolarHBondContact CD2-OE2 2.75Å; H599-E601 IonicContact CE1-OE1 2.7Å; H599-E601 WeakPolarHBondContact NE2-CG 3.34Å; H599-E601 IonicContact NE2-OE1 3.13Å; H599-E601 PolarHBondContact NE2-OE1 3.24Å; H599-E601 IonicContact NE2-OE2 3.68Å
600	L	39.6	Very low	41.5	Very low	160 Å²	160	147.9 Å²	147.9	84%	0.838	78%	0.778	S	S	*	*			trans	-167.2	88.9	-143.9	-158.9	170.1	0	0	0	112.8
601	E	26.1	Very low	41.5	Very low	156 Å²	156	154.9 Å²	154.9	73%	0.729	79%	0.79	S	S	*	*			trans	-140.8	-163.6	-165	-60.5	-172.3	128.4	0	0	116.3	H599	H599-E601 IonicContact CD2-OE1 2.72Å; H599-E601 PolarHBondContact CD2-OE1 2.89Å; H599-E601 IonicContact CD2-OE2 2.63Å; H599-E601 PolarHBondContact CD2-OE2 2.75Å; H599-E601 IonicContact CE1-OE1 2.7Å; H599-E601 WeakPolarHBondContact NE2-CG 3.34Å; H599-E601 IonicContact NE2-OE1 3.13Å; H599-E601 PolarHBondContact NE2-OE1 3.24Å; H599-E601 IonicContact NE2-OE2 3.68Å
602	E	18.6	Very low	41.2	Very low	194 Å²	194	158.7 Å²	158.7	91%	0.907	80%	0.801	S	S	*	*			trans	75.1	-151.1	-178.7	-60.3	-153.6	78.5	0	0	118.1
603	Q	37.1	Very low	41.2	Very low	177 Å²	177	159.1 Å²	159.1	83%	0.827	80%	0.803	S	S	*	*			trans	77.9	146.7	-162.1	-65	-75.2	10.9	0	0	117.5
604	I	37.9	Very low	40.6	Very low	165 Å²	165	158.6 Å²	158.6	85%	0.846	80%	0.804	S	S	*	*				170.8	-59.9	100.9	-164.5	164.4	0	0	0	117.9
605	A	32.7	Very low	40.9	Very low	80 Å²	80	162.2 Å²	162.2	66%	0.661	82%	0.815	S	S	*	*			trans	-131.5	145.1	-151.5	0	0	0	0	0	119.2
606	K	38.2	Very low	41.9	Very low	215 Å²	215	163.3 Å²	163.3	94%	0.935	82%	0.822	S	S	*	*			trans	-178	156.5	156	-101.9	147.8	-172.6	168.5	0	112.2
607	A	37.1	Very low	41.9	Very low	75 Å²	75	165.1 Å²	165.1	62%	0.62	82%	0.821	S	S	*	*			trans	-154.1	-88	176.9	0	0	0	0	0	116.9
608	D	44.3	Very low	42.8	Very low	142 Å²	142	163.4 Å²	163.4	76%	0.759	82%	0.817	S	S	*	*				-81.4	162.2	-129.2	-35.3	-93.1	0	0	0	117.7
609	R	54.3	Low	44.1	Very low	233 Å²	233	161.4 Å²	161.4	88%	0.879	82%	0.815	S	S	*	*			trans	-176.9	20.7	163.4	-114	159.7	-62.1	171.6	12.8	125
610	E	44.4	Very low	45.5	Very low	199 Å²	199	159.7 Å²	159.7	93%	0.93	82%	0.819	S	S	*	*			trans	-82.7	159.2	-175	-56.1	175.7	150.7	0	0	115.8
611	Y	50.7	Low	46.2	Very low	223 Å²	223	160.7 Å²	160.7	88%	0.875	82%	0.82	S	S	*	*				173.7	-67.6	129.9	-157.6	-120.5	0	0	0	121.7
612	E	55.5	Low	47.7	Very low	176 Å²	176	161 Å²	161	82%	0.822	83%	0.826	S	S	*	*				-79.2	-98.7	-123.9	-52.6	-173.2	87.4	0	0	126.8
613	E	56.8	Low	49.8	Very low	187 Å²	187	158.4 Å²	158.4	87%	0.874	82%	0.817	S	S	*	*			trans	-91.7	157	-134.7	-54.4	-176	85.3	0	0	123.1
614	C	48.3	Very low	50.9	Low	128 Å²	128	159.1 Å²	159.1	87%	0.865	82%	0.818	S	S	*	*			trans	-173.8	142.2	153.6	-170.8	0	0	0	0	115.7
615	V	55.8	Low	51.9	Low	132 Å²	132	158.2 Å²	158.2	80%	0.8	81%	0.81	S	S	*	*			trans	-163.6	160.1	176	-127.6	0	0	0	0	119.2
616	S	56.9	Low	53.3	Low	122 Å²	122	160.2 Å²	160.2	85%	0.853	81%	0.808	S	S	*	*			trans	101.5	149.1	142.1	72.8	0	0	0	0	124.9
617	E	57.2	Low	54.4	Low	192 Å²	192	158.8 Å²	158.8	90%	0.897	80%	0.797	S	S	*	*			trans	-166	167.7	-154.6	-151.8	176.1	-147.3	0	0	118.1
618	D	56.8	Low	55.5	Low	136 Å²	136	161.3 Å²	161.3	73%	0.727	80%	0.8	S	S	*	*			trans	96.2	-171.8	139.9	-141.5	44.2	0	0	0	129.6
619	L	54.1	Low	56.3	Low	152 Å²	152	161.3 Å²	161.3	80%	0.796	79%	0.793	S	S	*	*			trans	-112.4	166.9	-140.7	-86.4	160.5	0	0	0	119.9
620	S	52.1	Low	56.5	Low	110 Å²	110	159.1 Å²	159.1	77%	0.769	79%	0.786	S	S	*	*			trans	179.3	126.9	141.8	-173.7	0	0	0	0	117.4
621	E	54.4	Low	57.3	Low	181 Å²	181	156.5 Å²	156.5	85%	0.846	77%	0.774	S	S	*	*			trans	-158.7	-31.5	155.7	-162.2	162.2	-143.1	0	0	116.4	I623	E621-I623 VanDerWaalsContact C-N 3.29Å; E621-I623 PolarHBondContact O-N 3.03Å
622	N	58.3	Low	57.7	Low	161 Å²	161	155.1 Å²	155.1	86%	0.861	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	5.7	-162.8	-85.7	-34.9	0	0	0	120.6
623	I	61.7	Low	57.9	Low	141 Å²	141	155.5 Å²	155.5	72%	0.723	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-20.4	-161.4	-66.9	177	0	0	0	115.1	E621	E621-I623 VanDerWaalsContact C-N 3.29Å; E621-I623 PolarHBondContact O-N 3.03Å
624	K	60.4	Low	58	Low	191 Å²	191	150.6 Å²	150.6	83%	0.83	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-76.6	-30.8	-168.2	-73	176.8	-178.9	166.9	0	115.8	I626	K624-I626 VanDerWaalsContact C-N 3.33Å; K624-I626 PolarHBondContact O-N 3.12Å
625	E	59.5	Low	58.4	Low	146 Å²	146	149 Å²	149	68%	0.682	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-79	-8.9	-165.8	-144.6	-150.1	130.8	0	0	115.5	K629	E625-K629 IonicContact OE1-NZ 3.18Å; E625-K629 PolarHBondContact OE1-NZ 2.62Å
626	I	61.5	Low	58.5	Low	122 Å²	122	150.7 Å²	150.7	63%	0.626	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-86.5	-23.6	-173.6	-65.2	176.2	0	0	0	112.3	K624	K624-I626 VanDerWaalsContact C-N 3.33Å; K624-I626 PolarHBondContact O-N 3.12Å
627	R	61.6	Low	58.7	Low	186 Å²	186	152 Å²	152	70%	0.702	76%	0.758	S	S	*	*	S	Bend	trans	-69.2	-52.9	-169.1	-169.4	174.4	-178.9	165.4	0.6	113.7	K629 Y630	R627-K629 PolarHBondContact O-N 2.98Å; R627-K629 VanDerWaalsContact O-N 3.09Å; R627-Y630 PolarHBondContact O-N 3.19Å
628	D	59.9	Low	58.6	Low	128 Å²	128	152.8 Å²	152.8	68%	0.684	76%	0.759	S	S	*	*	H	α-helix	trans	-66.1	-17.1	-169	-70.5	21.7	0	0	0	114.6
629	K	60.9	Low	58	Low	141 Å²	141	152.1 Å²	152.1	61%	0.613	77%	0.765	S	S	*	*	H	α-helix	trans	-79	-14.1	-178.1	-72.7	166.7	-174.5	150.9	0	113.5	E625 R627	E625-K629 IonicContact OE1-NZ 3.18Å; E625-K629 PolarHBondContact OE1-NZ 2.62Å; R627-K629 PolarHBondContact O-N 2.98Å; R627-K629 VanDerWaalsContact O-N 3.09Å
630	Y	60.5	Low	57.4	Low	188 Å²	188	150.2 Å²	150.2	74%	0.737	76%	0.764	S	S	*	*	H	α-helix	trans	-93.9	-38	-176.8	-95.3	-88.8	0	0	0	115.1	R627 K632 K633	R627-Y630 PolarHBondContact O-N 3.19Å; Y630-K632 VanDerWaalsContact C-N 3.34Å; Y630-K632 PolarHBondContact O-N 2.96Å; Y630-K633 PolarHBondContact O-N 2.87Å
631	E	60.1	Low	57	Low	143 Å²	143	154 Å²	154	67%	0.668	77%	0.77	S	S	*	*	H	α-helix	trans	-63.8	-35.8	-172.5	-66.8	-174.6	168.9	0	0	113.2	K633 A634	E631-K633 PolarHBondContact O-N 2.61Å; E631-K633 VanDerWaalsContact O-N 3.1Å; E631-A634 PolarHBondContact O-N 3.47Å
632	K	59.8	Low	56.3	Low	195 Å²	195	158.5 Å²	158.5	85%	0.848	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-8.2	-179.3	-76.4	179.9	177.2	170.8	0	115.1	Y630	Y630-K632 VanDerWaalsContact C-N 3.34Å; Y630-K632 PolarHBondContact O-N 2.96Å
633	K	58.8	Low	56.2	Low	183 Å²	183	158.4 Å²	158.4	80%	0.796	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-7.7	-176.8	-133.2	177.8	-175.9	-178.1	0	114.6	Y630 E631	Y630-K633 PolarHBondContact O-N 2.87Å; E631-K633 PolarHBondContact O-N 2.61Å; E631-K633 VanDerWaalsContact O-N 3.1Å
634	A	58.3	Low	55.9	Low	84 Å²	84	159.3 Å²	159.3	69%	0.694	79%	0.791	S	S	*	*	S	Bend	trans	-92.3	-16.7	-173.6	0	0	0	0	0	115.1	E631	E631-A634 PolarHBondContact O-N 3.47Å
635	A	58.1	Low	55.7	Low	96 Å²	96	157.5 Å²	157.5	79%	0.793	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-0.8	-165.3	0	0	0	0	0	116.1
636	L	57.6	Low	55.5	Low	166 Å²	166	158.2 Å²	158.2	87%	0.869	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	11.4	-169.6	-103.8	153.3	0	0	0	114.6
637	I	60.1	Low	55.1	Low	149 Å²	149	160.4 Å²	160.4	76%	0.764	81%	0.805	S	S	*	*	S	Bend	trans	-126.5	65.2	180	-48.3	179.3	0	0	0	109.6
638	K	55.8	Low	54.6	Low	210 Å²	210	158.7 Å²	158.7	91%	0.913	81%	0.812	S	S	*	*			trans	-167	53.4	171.6	-119.9	170.1	-174.2	-178.6	0	116.1
639	S	44.9	Very low	54.3	Low	121 Å²	121	160.9 Å²	160.9	85%	0.846	82%	0.821	S	S	*	*			trans	-159.2	92.6	164.3	59.9	0	0	0	0	112.5
640	S	41.1	Very low	53.8	Low	112 Å²	112	162.5 Å²	162.5	78%	0.783	84%	0.837	S	S	*	*			trans	-157.7	158.7	168.1	-176.5	0	0	0	0	107
641	E	44.5	Very low	53.2	Low	189 Å²	189	160.3 Å²	160.3	88%	0.883	85%	0.846	S	S	*	*			trans	72.8	84.6	-177.1	-51.3	174.9	169	0	0	114
642	E	39.4	Very low	52.6	Low	276 Å²	276	161.9 Å²	161.9	100%	1.29	86%	0.862	S	S	*	*				-145.5	0	82	-84.2	-171.5	148	0	0	110.3

Retrieved 642 of 642 residues in 3094 ms (Link to these results)

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