A0A061INN0_CRIGR Loading...

Striatin-interacting protein 1

Plays a role in the regulation of cell morphology and cytoskeletal organization. Required in the cortical actin filament dynamics and cell shape. Part of the striatin-interacting phosphatase and kinase (STRIPAK) complexes. STRIPAK complexes have critical roles in protein (de)phosphorylation and are regulators of multiple signaling pathways including Hippo, MAPK, nuclear receptor and cytoskeleton remodeling. Different types of STRIPAK complexes are involved in a variety of biological processes such as cell growth, differentiation, apoptosis, metabolism and immune regulation.

AlphaFold DB , UniProt , Accession A0A061INN0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Strip1, Length 837 aa.

						>A0A061INN0_CRIGR|A0A061INN0|Strip1
MEPAAAGPGPLIVNNKQPQPPPPPPPATAQPPPGAPRAAGGLLPGGKAREFNRNQRKDSEGYSESPDLEFEYADTDKWAAELAELYSYTEGPEFLMNRKCFEEDFRIHVTDKKWTELDTNQHRTHAMRLLDGLEVTAREKRLKVARAILYVAQGTFGECSSEAEVQFWMRYNIFLLLEVGTFNALVELLNMEIDNSAACSSAVRKPAISLADSTDLRVLLNIMYLIVETVHQDCEGDKAEWRTMRQTFRAELGSPLYNNEPFAIMLFGMVTKFCSGHAPHFPMKKVLLLLWKTVLCTLGGFEELQSMKAEKRTLLGLPPLPEDSIKVIRNMRAASPPASASDLIEQQQKRGRREHKALIKQDNLDAFNERDPYKTDDSREEEEENDDDNSLEGETFPLERDEVMPPPLQHPQTDRLTCPKGLPWAPKVREKDIEMFLESSRSKFIGYTLGSDTNTVVGLPRPIHESIKTLKQHKYTSIAEVQAQMEEEFLRSPLSGGEEEVEQVPAETLYQGLLPSLPQYMIALLKILLAAAPTSKAKTDSINILADVLPEEMPTTVLQSMKLGVDVNRHKEVIVKAISAVLLLLLKHFKLNHIYQFEYMAQHLVFANCIPLILKFFNQNIMSYITAKNSISVLDYPHCVVNELPELTAESLEAGDNNQFCWRNLFSCINLLRILNKLTKWKHSRTMMLVVFKSAPILKRALKVKQAMMQLYVLKLLKVQTKYLGRQWRKSNMKTMSAIYQKVRHRLNDDWAYGNDLDARPWDFQAEECALRANIERFNARRYDRTHSNPDFLPVDNCLQSVLGQRVDLPEDFQMNYDLWLEREVFSKPISWEELLQ
					

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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	33.8	Very low	33.7	Very low	247 Å²	247	130.5 Å²	130.5	100%	1.217	86%	0.862	S	S	*	*				0	110.3	0	-91.2	173.6	164.2	0	0	107.2
2	E	33.8	Very low	33.6	Very low	187 Å²	187	132.9 Å²	132.9	87%	0.874	86%	0.858	S	S	*	*			trans	-74.5	172.5	152.3	-96.5	-167.5	162.3	0	0	109.2
3	P	51.9	Low	33.3	Very low	112 Å²	112	132.3 Å²	132.3	73%	0.727	85%	0.851	S	S	*	*			cis	-143.8	-174.1	14.8	29.7	-4.5	0	0	0	117.5
4	A	32.4	Very low	33.2	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	85%	0.846	S	S	*	*			trans	94.2	134.5	142.4	0	0	0	0	0	117.8
5	A	30.4	Very low	33.4	Very low	97 Å²	97	134.3 Å²	134.3	80%	0.802	84%	0.842	S	S	*	*			cis	-168.6	170.4	10.5	0	0	0	0	0	111.8
6	A	30.8	Very low	33.6	Very low	110 Å²	110	137.5 Å²	137.5	91%	0.909	84%	0.84	S	S	*	*			trans	85.1	121.5	162.4	0	0	0	0	0	117.6
7	G	30.9	Very low	33.8	Very low	74 Å²	74	140 Å²	140	76%	0.763	84%	0.84	S	S	*	*			cis	157.9	130.8	4	0	0	0	0	0	108
8	P	32.6	Very low	33.9	Very low	141 Å²	141	139.3 Å²	139.3	92%	0.916	84%	0.839	S	S	*	*			trans	-102.8	150.3	-178.5	37	-29.6	0	0	0	112.4
9	G	29.4	Very low	34.2	Very low	73 Å²	73	141.9 Å²	141.9	75%	0.753	84%	0.842	S	S	*	*			trans	-151.3	166.3	165.4	0	0	0	0	0	110.6
10	P	34.6	Very low	34.6	Very low	125 Å²	125	140.7 Å²	140.7	81%	0.812	84%	0.837	S	S	*	*				-116.7	155.2	-56.6	35.4	-28	0	0	0	112.1
11	L	29.5	Very low	35.2	Very low	170 Å²	170	139.5 Å²	139.5	89%	0.89	83%	0.834	S	S	*	*			trans	-73.3	119.6	169.2	-75.3	158.3	0	0	0	110.3
12	I	32.7	Very low	35.6	Very low	160 Å²	160	133.5 Å²	133.5	82%	0.821	81%	0.813	S	S	*	*			trans	-89.5	111.1	164	-63.7	178.6	0	0	0	108.1	N14	I12-N14 PolarHBondContact O-N 2.93Å
13	V	30.6	Very low	36	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	81%	0.809	S	S	*	*			trans	-70.3	113.5	172.6	179.1	0	0	0	0	108.7
14	N	31.8	Very low	35.7	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	81%	0.812	S	S	*	*			trans	-100.6	102.6	171.9	-145.6	2.8	0	0	0	109.4	I12 K16	I12-N14 PolarHBondContact O-N 2.93Å; N14-K16 PolarHBondContact O-N 2.72Å
15	N	35.5	Very low	36.1	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	81%	0.81	S	S	*	*			trans	-85.3	103.8	179	-137.5	7.6	0	0	0	108.6
16	K	36.6	Very low	36.4	Very low	186 Å²	186	133.2 Å²	133.2	81%	0.809	81%	0.811	S	S	*	*			trans	-138.4	109.5	164.7	-82	-167.9	177	-179.2	0	110.8	N14	N14-K16 PolarHBondContact O-N 2.72Å
17	Q	36.8	Very low	36.4	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63	150.4	166.9	-76.2	173.4	-23.4	0	0	111.4
18	P	35.6	Very low	36.5	Very low	128 Å²	128	136.1 Å²	136.1	83%	0.831	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.2	132.3	177.3	28.9	-31	0	0	0	112.3
19	Q	39.8	Very low	36.4	Very low	188 Å²	188	134.1 Å²	134.1	88%	0.879	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-84.6	148.5	170	-77.1	-174.3	-12	0	0	111.6
20	P	42	Very low	36.5	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-79.8	159.1	178.7	32.1	-33.3	0	0	0	113.2
21	P	47.2	Very low	36.4	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.6	155.7	-176.6	31.1	-34.5	0	0	0	113.6
22	P	42.1	Very low	36.7	Very low	121 Å²	121	137.2 Å²	137.2	79%	0.786	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.2	155.9	-179.9	31.5	-33.7	0	0	0	113.6
23	P	42.4	Very low	37.1	Very low	122 Å²	122	136 Å²	136	79%	0.792	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-81	159.7	-176.2	32.4	-34.4	0	0	0	114
24	P	45.5	Very low	37.1	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.8	158.8	-177.8	32.3	-34.1	0	0	0	113.7
25	P	41.1	Very low	36.8	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.3	155.5	-177.6	30.4	-33.9	0	0	0	113.5
26	P	36	Very low	36.9	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82.1	144.1	-171.6	26.3	-22.7	0	0	0	114.1
27	A	31.5	Very low	36.5	Very low	103 Å²	103	132.7 Å²	132.7	85%	0.851	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.3	134	176.4	0	0	0	0	0	112
28	T	32.5	Very low	36	Very low	143 Å²	143	128.5 Å²	128.5	88%	0.877	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-93.4	140.2	171.8	37	0	0	0	0	111.2
29	A	31.2	Very low	35.5	Very low	98 Å²	98	127.6 Å²	127.6	81%	0.81	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.9	147.1	-164.2	0	0	0	0	0	114.8
30	Q	30.8	Very low	34.9	Very low	190 Å²	190	122.6 Å²	122.6	89%	0.888	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.5	148.9	162	-68.1	176.5	-18.5	0	0	110.9
31	P	33.4	Very low	34.1	Very low	119 Å²	119	120.3 Å²	120.3	77%	0.773	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-100.1	159.1	159	33.5	-23.8	0	0	0	112.6
32	P	35.6	Very low	33.2	Very low	125 Å²	125	123.4 Å²	123.4	81%	0.812	82%	0.823	S	S	*	*			trans	-93.9	176.4	-164.7	38.4	-35.8	0	0	0	114.7
33	P	41.6	Very low	32.6	Very low	134 Å²	134	125.3 Å²	125.3	87%	0.87	83%	0.826	S	S	*	*			trans	-104.6	151.9	-173.4	37.3	-28.7	0	0	0	115.5
34	G	29.9	Very low	32.3	Very low	77 Å²	77	125.6 Å²	125.6	79%	0.794	83%	0.828	S	S	*	*			trans	134.6	102	150.9	0	0	0	0	0	120.2
35	A	25.1	Very low	31.4	Very low	99 Å²	99	123.3 Å²	123.3	82%	0.818	83%	0.826	S	S	*	*			trans	45.9	167.1	133.8	0	0	0	0	0	123.9
36	P	39.1	Very low	31	Very low	112 Å²	112	120.9 Å²	120.9	73%	0.727	82%	0.824	S	S	*	*			cis	-137	170.3	-21.9	34	-13.4	0	0	0	117.2
37	R	26.6	Very low	30.8	Very low	247 Å²	247	124.8 Å²	124.8	93%	0.932	83%	0.828	S	S	*	*			trans	57.9	146.6	145.9	-78.1	178.2	174.2	-177.4	-1.4	119.9
38	A	26.1	Very low	30.7	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	82%	0.824	S	S	*	*			cis	-165.7	156.9	9.9	0	0	0	0	0	111.9
39	A	26.7	Very low	30.6	Very low	110 Å²	110	128.5 Å²	128.5	91%	0.909	82%	0.823	S	S	*	*			trans	55.7	123.4	140.5	0	0	0	0	0	123.6
40	G	26.1	Very low	30.6	Very low	83 Å²	83	131.5 Å²	131.5	86%	0.856	82%	0.82	S	S	*	*			trans	175.8	91.2	155.4	0	0	0	0	0	110.7
41	G	25.8	Very low	30.7	Very low	69 Å²	69	131.2 Å²	131.2	71%	0.711	82%	0.817	S	S	*	*			trans	-83.6	166.1	-173	0	0	0	0	0	115
42	L	27.5	Very low	30.5	Very low	181 Å²	181	130.7 Å²	130.7	95%	0.948	81%	0.807	S	S	*	*			trans	176	118.3	136.4	-92.4	152	0	0	0	109
43	L	29.7	Very low	30.2	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	80%	0.8	S	S	*	*			trans	-84.5	157	166.3	-84.9	170.5	0	0	0	108.2
44	P	35.8	Very low	29.7	Very low	128 Å²	128	132.2 Å²	132.2	83%	0.831	79%	0.788	S	S	*	*				-150.8	166.8	55.2	38	-16.1	0	0	0	118.1
45	G	27.1	Very low	29.8	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	78%	0.783	S	S	*	*			trans	107.2	91.6	139.6	0	0	0	0	0	118.1
46	G	32.6	Very low	29.9	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	78%	0.782	S	S	*	*			trans	66.8	90.1	136	0	0	0	0	0	118.8
47	K	32.2	Very low	29.4	Very low	207 Å²	207	142.3 Å²	142.3	90%	0.9	78%	0.777	S	S	*	*			trans	-171.3	22.5	148.2	-105.5	165.1	-167.1	-170.3	0	115.1
48	A	29.8	Very low	29.6	Very low	92 Å²	92	136.1 Å²	136.1	76%	0.76	76%	0.762	S	S	*	*	S	Bend	trans	-114.7	13.7	-176.8	0	0	0	0	0	114.6
49	R	29.8	Very low	30	Very low	232 Å²	232	136.6 Å²	136.6	88%	0.875	76%	0.76	S	S	*	*	S	Bend	trans	-103.4	-5.9	179.8	-142	176.6	-178	-179.9	0.2	114.5
50	E	31.1	Very low	30.1	Very low	160 Å²	160	140.3 Å²	140.3	75%	0.748	76%	0.759	S	S	*	*	S	Bend	trans	-94	-31.7	177.8	-77	-179.3	151.5	0	0	113.4	N52 R53	E50-N52 PolarHBondContact O-N 2.74Å; E50-R53 PolarHBondContact O-N 2.89Å
51	F	32.3	Very low	30.3	Very low	184 Å²	184	139.5 Å²	139.5	81%	0.807	75%	0.751	S	S	*	*	H	α-helix	trans	-72.4	-26.1	-179.6	-111.9	-93.1	0	0	0	114.2
52	N	29.2	Very low	30.8	Very low	108 Å²	108	146.8 Å²	146.8	58%	0.578	76%	0.758	S	S	*	*	H	α-helix	trans	-95.2	-1.2	-179.4	-136.4	-23.6	0	0	0	113.5	E50	E50-N52 PolarHBondContact O-N 2.74Å
53	R	29.9	Very low	31.3	Very low	176 Å²	176	143.6 Å²	143.6	66%	0.664	75%	0.751	S	S	*	*	H	α-helix	trans	-90.2	-19.2	172.3	-160.5	173.3	172.8	-173.8	-3.8	112.1	E50	E50-R53 PolarHBondContact O-N 2.89Å
54	N	31.8	Very low	31.8	Very low	115 Å²	115	143.7 Å²	143.7	62%	0.615	75%	0.747	S	S	*	*	H	α-helix	trans	-84.7	-29.9	174.7	-81	8.9	0	0	0	113.6	R56	N54-R56 PolarHBondContact O-N 3.47Å
55	Q	32	Very low	32.5	Very low	149 Å²	149	140.4 Å²	140.4	70%	0.696	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-12	175.1	-86.4	-176.5	22.5	0	0	115
56	R	27.6	Very low	34	Very low	209 Å²	209	141 Å²	141	79%	0.789	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-0.7	173.8	-80.5	-176.1	175.8	179.9	-0.5	114.1	N54	N54-R56 PolarHBondContact O-N 3.47Å
57	K	28.4	Very low	35.7	Very low	143 Å²	143	141.7 Å²	141.7	62%	0.622	71%	0.705	S	S	*	*	S	Bend	trans	-88.9	-11.1	171.4	-93.9	-175.2	169.7	-172.4	0	113.8
58	D	30.8	Very low	37.9	Very low	116 Å²	116	133.2 Å²	133.2	62%	0.62	67%	0.669	S	S	*	*	S	Bend	trans	-87.7	0.4	179.6	-69.2	-25.1	0	0	0	114.6
59	S	33.5	Very low	40.1	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	67%	0.673	S	S	*	*	S	Bend	trans	-120.4	4.1	-176.1	-59.8	0	0	0	0	115.4
60	E	29.2	Very low	42.7	Very low	188 Å²	188	127.3 Å²	127.3	88%	0.879	64%	0.636	S	S	*	*	S	Bend	trans	-138.2	80.2	172.2	-70.7	-164.7	163.2	0	0	109.8
61	G	30.6	Very low	45.2	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	62%	0.624	S	S	*	*			trans	171.2	23.5	-179.4	0	0	0	0	0	117.2	S63	G61-S63 PolarHBondContact O-N 3.31Å
62	Y	36.2	Very low	48	Very low	221 Å²	221	117.1 Å²	117.1	87%	0.867	59%	0.589	S	S	*	*			trans	-99.7	63.7	168.6	-76.1	-81.6	0	0	0	110.3
63	S	37.5	Very low	50.9	Low	114 Å²	114	113.7 Å²	113.7	80%	0.797	58%	0.576	S	S	*	*			trans	-109.8	118.7	163.5	-78.1	0	0	0	0	108.8	G61	G61-S63 PolarHBondContact O-N 3.31Å
64	E	40.8	Very low	53.8	Low	164 Å²	164	106.7 Å²	106.7	77%	0.766	55%	0.552	S	S	*	*			trans	56.1	91.4	166.2	-63.4	-173	145	0	0	117.2
65	S	50.3	Low	56.7	Low	59 Å²	59	102.9 Å²	102.9	41%	0.413	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-53.8	133	149.7	49.8	0	0	0	0	108.8	K705	S65-K705 VanDerWaalsContact O-CD 3.25Å; S65-K705 WeakPolarHBondContact O-CD 3.38Å; S65-K705 WeakPolarHBondContact O-CE 3.28Å; S65-K705 PolarHBondContact O-NZ 3.12Å
66	P	59.4	Low	59.5	Low	85 Å²	85	97.4 Å²	97.4	55%	0.552	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-62.9	156.6	176.4	24.5	-31.7	0	0	0	110.6	L68	P66-L68 PolarHBondContact O-N 3.44Å
67	D	67.4	Low	62.5	Low	84 Å²	84	95.4 Å²	95.4	45%	0.449	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-62.3	134.9	170.5	-75.8	-14.8	0	0	0	108.8	E69	D67-E69 PolarHBondContact O-N 3.15Å
68	L	77.4	Confident	65.4	Low	29 Å²	29	90 Å²	90	15%	0.152	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-75.1	120.7	-179.8	-60.4	176.7	0	0	0	109.6	P66 F70 I625 Q659 F660 L665 V704 K705	P66-L68 PolarHBondContact O-N 3.44Å; L68-F70 VanDerWaalsContact C-N 3.26Å; L68-F70 PolarHBondContact O-N 2.87Å; L68-I625 HydrophobicContact CD1-CD1 3.95Å; L68-Q659 HydrophobicContact CD2-CB 4.44Å; L68-F660 HydrophobicContact CB-CD1 4.19Å; L68-F660 HydrophobicContact CB-CE1 4.33Å; L68-F660 HydrophobicContact CD2-CD1 3.95Å; L68-F660 HydrophobicContact CG-CD1 4.44Å; L68-L665 HydrophobicContact CD1-CD2 4.2Å; L68-V704 HydrophobicContact CD1-CG1 4Å; L68-K705 PolarHBondContact N-O 3.21Å
69	E	76.8	Confident	68.3	Low	180 Å²	180	86.3 Å²	86.3	84%	0.841	47%	0.467	S	S	*	.			trans	-76.3	78.3	173	-168	174.1	-171.2	0	0	110	D67 F660	D67-E69 PolarHBondContact O-N 3.15Å; E69-F660 WeakPolarHBondContact O-CZ 3.42Å
70	F	84.1	Confident	71	Confident	21 Å²	21	82.9 Å²	82.9	9%	0.092	45%	0.445	C	S	.	.			trans	-117.5	121	-178.9	173.1	-98.9	0	0	0	111.2	L68 Y72 F660 W662 L665 F666 I669 Q706	L68-F70 VanDerWaalsContact C-N 3.26Å; L68-F70 PolarHBondContact O-N 2.87Å; F70-Y72 AromaticContact CE1-CD2 3.85Å; F70-Y72 HydrophobicContact CE1-CD2 3.85Å; F70-Y72 HydrophobicContact CE1-CG 4.26Å; F70-Y72 HydrophobicContact CZ-CD2 4.13Å; F70-F660 HydrophobicContact CB-CE1 4.31Å; F70-F660 HydrophobicContact CB-CE2 4.2Å; F70-F660 HydrophobicContact CB-CZ 3.8Å; F70-F660 HydrophobicContact CD2-CD2 4.31Å; F70-F660 AromaticContact CD2-CE2 3.54Å; F70-F660 HydrophobicContact CD2-CE2 3.54Å; F70-F660 AromaticContact CD2-CZ 3.96Å; F70-F660 HydrophobicContact CD2-CZ 3.96Å; F70-F660 HydrophobicContact CE2-CE2 4.42Å; F70-F660 HydrophobicContact CG-CE2 4.32Å; F70-F660 HydrophobicContact CG-CZ 4.39Å; F70-W662 AromaticContact CD2-CD1 3.79Å; F70-W662 HydrophobicContact CD2-CG 4.48Å; F70-W662 AromaticContact CE2-CD1 3.38Å; F70-W662 HydrophobicContact CE2-CD2 4.16Å; F70-W662 AromaticContact CE2-CE2 3.93Å; F70-W662 AromaticContact CE2-CG 3.83Å; F70-W662 HydrophobicContact CE2-CG 3.83Å; F70-W662 AromaticContact CE2-NE1 3.4Å; F70-L665 HydrophobicContact CB-CD2 3.68Å; F70-L665 HydrophobicContact CD1-CD2 3.93Å; F70-L665 HydrophobicContact CD1-CG 4.2Å; F70-L665 HydrophobicContact CD2-CB 4.49Å; F70-L665 HydrophobicContact CD2-CD2 3.57Å; F70-L665 HydrophobicContact CD2-CG 4.13Å; F70-L665 HydrophobicContact CE1-CD2 4.44Å; F70-L665 HydrophobicContact CE1-CG 4.25Å; F70-L665 HydrophobicContact CE2-CB 4.27Å; F70-L665 HydrophobicContact CE2-CD2 4.11Å; F70-L665 HydrophobicContact CE2-CG 4.16Å; F70-L665 HydrophobicContact CG-CD2 3.44Å; F70-L665 VanDerWaalsContact CG-CD2 3.44Å; F70-L665 HydrophobicContact CG-CG 4.13Å; F70-L665 HydrophobicContact CZ-CG 4.24Å; F70-F666 HydrophobicContact CZ-CB 4.23Å; F70-I669 HydrophobicContact CD1-CD1 4.06Å; F70-I669 HydrophobicContact CE1-CD1 3.44Å; F70-I669 VanDerWaalsContact CE1-CD1 3.44Å; F70-I669 HydrophobicContact CZ-CD1 4.2Å; F70-Q706 HydrophobicContact CB-CG 4.3Å; F70-Q706 HydrophobicContact CD1-CG 4.24Å
71	E	84.4	Confident	74.1	Confident	106 Å²	106	73.9 Å²	73.9	50%	0.495	40%	0.403	S	S	.	.			trans	-91.8	118.6	169.5	-176.6	164.9	-171.3	0	0	110.4	R329	E71-R329 IonicContact OE1-CZ 3Å; E71-R329 IonicContact OE1-NH1 2.97Å; E71-R329 PolarHBondContact OE1-NH1 2.64Å; E71-R329 IonicContact OE1-NH2 2.75Å; E71-R329 PolarHBondContact OE1-NH2 3.33Å; E71-R329 IonicContact OE2-NH2 2.89Å; E71-R329 PolarHBondContact OE2-NH2 2.76Å; E71-R329 VanDerWaalsContact OE2-NH2 3.15Å
72	Y	89.9	Confident	77.1	Confident	23 Å²	23	70.8 Å²	70.8	9%	0.09	37%	0.37	C	S	.	.			trans	-86.4	112.6	174.9	-175.8	-93.6	0	0	0	109.8	F70 F301 F666 I669 N670 R673 M708	F70-Y72 AromaticContact CE1-CD2 3.85Å; F70-Y72 HydrophobicContact CE1-CD2 3.85Å; F70-Y72 HydrophobicContact CE1-CG 4.26Å; F70-Y72 HydrophobicContact CZ-CD2 4.13Å; Y72-F301 AromaticContact CE1-CD2 3.89Å; Y72-F301 HydrophobicContact CE1-CD2 3.89Å; Y72-F301 AromaticContact CE1-CE2 3.46Å; Y72-F301 HydrophobicContact CE1-CE2 3.46Å; Y72-F301 VanDerWaalsContact CE1-CE2 3.46Å; Y72-F301 HydrophobicContact CE1-CZ 4.33Å; Y72-F301 AromaticContact CZ-CE2 3.76Å; Y72-F301 WeakPolarHBondContact OH-CE2 3.48Å; Y72-F301 WeakPolarHBondContact OH-CZ 3.27Å; Y72-F666 AromaticContact CD2-CD2 3.95Å; Y72-F666 HydrophobicContact CD2-CD2 3.95Å; Y72-F666 HydrophobicContact CD2-CE2 4.45Å; Y72-F666 AromaticContact CE2-CD2 3.51Å; Y72-F666 HydrophobicContact CE2-CD2 3.51Å; Y72-F666 AromaticContact CE2-CE2 3.74Å; Y72-F666 HydrophobicContact CE2-CE2 3.74Å; Y72-F666 HydrophobicContact CE2-CG 4.49Å; Y72-I669 HydrophobicContact CD2-CB 4.31Å; Y72-I669 HydrophobicContact CD2-CD1 4.02Å; Y72-I669 HydrophobicContact CD2-CG2 3.81Å; Y72-I669 HydrophobicContact CE2-CB 4.07Å; Y72-I669 HydrophobicContact CE2-CG2 3.51Å; Y72-N670 WeakPolarHBondContact CE2-OD1 3.49Å; Y72-N670 PolarHBondContact OH-OD1 3.1Å; Y72-R673 VanDerWaalsContact CZ-NH1 3.32Å; Y72-R673 PolarHBondContact OH-NH1 2.83Å; Y72-M708 HydrophobicContact CD1-CE 3.99Å; Y72-M708 HydrophobicContact CD1-SD 3.72Å; Y72-M708 HydrophobicContact CD2-SD 4.1Å; Y72-M708 HydrophobicContact CE1-SD 4.19Å; Y72-M708 HydrophobicContact CG-CE 4.19Å; Y72-M708 HydrophobicContact CG-SD 3.65Å
73	A	90.8	Very high	79.9	Confident	37 Å²	37	60.5 Å²	60.5	31%	0.306	33%	0.331	S	S	.	.			trans	-129.9	171.5	177.4	0	0	0	0	0	110.9	T75 F666	A73-T75 VanDerWaalsContact C-N 3.33Å; A73-F666 VanDerWaalsContact O-CE2 3.27Å; A73-F666 WeakPolarHBondContact O-CE2 3.42Å
74	D	91.4	Very high	82.6	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.15	29%	0.294	C	S	.	.	S	Bend	trans	-67.4	-32.1	175.9	-74.6	-72.1	0	0	0	112.3	W291 L295 F301	D74-W291 WeakPolarHBondContact O-CZ2 3.36Å; D74-L295 HydrophobicContact CB-CD1 4.05Å; D74-L295 HydrophobicContact CB-CD2 4.28Å; D74-F301 VanDerWaalsContact CG-CD2 3.48Å; D74-F301 WeakPolarHBondContact OD1-CD2 3.37Å; D74-F301 WeakPolarHBondContact OD1-CE2 3.37Å; D74-F301 VanDerWaalsContact OD1-CG 3.3Å; D74-F301 WeakPolarHBondContact OD1-CG 3.27Å; D74-F301 PolarHBondContact OD1-N 3.41Å; D74-F301 PolarHBondContact OD2-N 3.27Å
75	T	91.3	Very high	85.2	Confident	36 Å²	36	47.3 Å²	47.3	22%	0.221	26%	0.257	C	S	.	.	S	Bend	trans	-135.3	159.5	178	60.2	0	0	0	0	111	A73 K292 L295	A73-T75 VanDerWaalsContact C-N 3.33Å; T75-K292 VanDerWaalsContact CG2-NZ 3.32Å; T75-L295 HydrophobicContact CG2-CD2 3.6Å
76	D	90.9	Very high	87.4	Confident	33 Å²	33	45 Å²	45	18%	0.176	24%	0.239	C	C	.	.			trans	-81.2	-174.6	167.7	-152	-21.7	0	0	0	110.3	A80 E81 W662	D76-A80 HydrophobicContact CB-CB 4.2Å; D76-E81 HydrophobicContact CB-CG 4.27Å; D76-E81 VanDerWaalsContact CB-OE1 3.22Å; D76-E81 WeakPolarHBondContact CB-OE1 3.37Å; D76-E81 PolarHBondContact N-OE1 3.5Å; D76-W662 HydrophobicContact CB-CD2 4.1Å; D76-W662 HydrophobicContact CB-CE3 4.01Å; D76-W662 HydrophobicContact CB-CH2 4.1Å; D76-W662 HydrophobicContact CB-CZ2 4.14Å; D76-W662 HydrophobicContact CB-CZ3 4.05Å; D76-W662 VanDerWaalsContact OD2-CD2 3.26Å; D76-W662 VanDerWaalsContact OD2-CG 3.3Å
77	K	90.3	Very high	89	Confident	167 Å²	167	41.1 Å²	41.1	73%	0.726	21%	0.214	S	C	*	.			trans	-62.3	148.8	175	-61.3	-179.3	-177	179.1	0	111.2	A79 A80 E81	K77-A79 VanDerWaalsContact C-N 3.35Å; K77-A79 PolarHBondContact O-N 3Å; K77-A80 WeakPolarHBondContact O-CB 3.4Å; K77-A80 PolarHBondContact O-N 3.13Å; K77-E81 PolarHBondContact O-N 3.3Å
78	W	90.3	Very high	90.2	Very high	30 Å²	30	37.6 Å²	37.6	11%	0.114	19%	0.194	C	C	.	.	H	α-helix	trans	-45.5	-52	-180	175.4	85.2	0	0	0	113.8	A80 E81 L82 Q166 M169 P637	W78-A80 VanDerWaalsContact C-N 3.33Å; W78-A80 PolarHBondContact O-N 3.04Å; W78-E81 PolarHBondContact O-N 2.98Å; W78-L82 HydrophobicContact CD2-CD1 3.94Å; W78-L82 HydrophobicContact CE3-CD1 4.38Å; W78-L82 HydrophobicContact CH2-CD1 3.71Å; W78-L82 HydrophobicContact CZ2-CD1 3.17Å; W78-L82 HydrophobicContact CZ2-CG 4.45Å; W78-L82 HydrophobicContact CZ3-CD1 4.28Å; W78-L82 WeakPolarHBondContact O-CG 3.38Å; W78-L82 PolarHBondContact O-N 3.08Å; W78-L82 VanDerWaalsContact O-N 3.07Å; W78-Q166 HydrophobicContact CD2-CG 4Å; W78-Q166 HydrophobicContact CE3-CB 4.43Å; W78-Q166 HydrophobicContact CE3-CG 4.22Å; W78-Q166 HydrophobicContact CH2-CB 3.5Å; W78-Q166 HydrophobicContact CH2-CG 3.92Å; W78-Q166 HydrophobicContact CZ2-CB 3.66Å; W78-Q166 HydrophobicContact CZ2-CG 3.63Å; W78-Q166 HydrophobicContact CZ3-CB 3.92Å; W78-Q166 HydrophobicContact CZ3-CG 4.19Å; W78-M169 HydrophobicContact CZ2-CE 4.26Å; W78-M169 HydrophobicContact CZ2-SD 3.74Å; W78-P637 HydrophobicContact CH2-CG 3.99Å; W78-P637 HydrophobicContact CZ3-CG 3.91Å
79	A	91.2	Very high	90.9	Very high	38 Å²	38	37.8 Å²	37.8	31%	0.314	20%	0.197	S	C	.	.	H	α-helix	trans	-62.4	-37.3	-179.6	0	0	0	0	0	112.9	K77 L82 A83	K77-A79 VanDerWaalsContact C-N 3.35Å; K77-A79 PolarHBondContact O-N 3Å; A79-L82 PolarHBondContact O-N 3.12Å; A79-A83 VanDerWaalsContact O-CB 3.31Å; A79-A83 WeakPolarHBondContact O-CB 3.48Å; A79-A83 PolarHBondContact O-N 2.95Å
80	A	91.8	Very high	91.7	Very high	31 Å²	31	29.4 Å²	29.4	26%	0.256	16%	0.158	S	C	.	.	H	α-helix	trans	-69.2	-41	178.2	0	0	0	0	0	111.8	D76 K77 W78 L82 A83 E84	D76-A80 HydrophobicContact CB-CB 4.2Å; K77-A80 WeakPolarHBondContact O-CB 3.4Å; K77-A80 PolarHBondContact O-N 3.13Å; W78-A80 VanDerWaalsContact C-N 3.33Å; W78-A80 PolarHBondContact O-N 3.04Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-L82 PolarHBondContact O-N 3.1Å; A80-A83 PolarHBondContact O-N 2.61Å; A80-E84 WeakPolarHBondContact O-CG 3.48Å; A80-E84 PolarHBondContact O-N 3.3Å; A80-E84 VanDerWaalsContact O-N 3.09Å
81	E	93.6	Very high	92	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-37.1	177.2	-66.6	-66.9	144.4	0	0	112.1	D76 K77 W78 Y224 K292 K576	D76-E81 HydrophobicContact CB-CG 4.27Å; D76-E81 VanDerWaalsContact CB-OE1 3.22Å; D76-E81 WeakPolarHBondContact CB-OE1 3.37Å; D76-E81 PolarHBondContact N-OE1 3.5Å; K77-E81 PolarHBondContact O-N 3.3Å; W78-E81 PolarHBondContact O-N 2.98Å; E81-Y224 PolarHBondContact O-OH 3.47Å; E81-K292 VanDerWaalsContact OE2-CE 3.23Å; E81-K292 WeakPolarHBondContact OE2-CE 3.41Å; E81-K292 IonicContact OE2-NZ 2.88Å; E81-K292 PolarHBondContact OE2-NZ 3.32Å; E81-K576 IonicContact OE1-NZ 2.83Å; E81-K576 PolarHBondContact OE1-NZ 3.39Å; E81-K576 IonicContact OE2-NZ 2.93Å
82	L	93.7	Very high	92.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-73.2	-39.2	174.8	-67	-170.8	0	0	0	112.9	W78 A79 A80 E84 L85 M169 L225 Y636	W78-L82 HydrophobicContact CD2-CD1 3.94Å; W78-L82 HydrophobicContact CE3-CD1 4.38Å; W78-L82 HydrophobicContact CH2-CD1 3.71Å; W78-L82 HydrophobicContact CZ2-CD1 3.17Å; W78-L82 HydrophobicContact CZ2-CG 4.45Å; W78-L82 HydrophobicContact CZ3-CD1 4.28Å; W78-L82 WeakPolarHBondContact O-CG 3.38Å; W78-L82 PolarHBondContact O-N 3.08Å; W78-L82 VanDerWaalsContact O-N 3.07Å; A79-L82 PolarHBondContact O-N 3.12Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-L82 PolarHBondContact O-N 3.1Å; L82-E84 PolarHBondContact O-N 3.33Å; L82-L85 WeakPolarHBondContact O-CB 3.39Å; L82-L85 PolarHBondContact O-N 3.43Å; L82-M169 HydrophobicContact CD1-CE 3.83Å; L82-M169 HydrophobicContact CD1-SD 3.77Å; L82-M169 HydrophobicContact CD2-SD 4.5Å; L82-L225 HydrophobicContact CD2-CD2 3.47Å; L82-L225 VanDerWaalsContact CD2-CD2 3.47Å; L82-Y636 HydrophobicContact CB-CD1 4.14Å; L82-Y636 HydrophobicContact CD1-CD1 4.44Å; L82-Y636 HydrophobicContact CD1-CE1 4.08Å
83	A	93.7	Very high	92.6	Very high	5 Å²	5	30 Å²	30	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-56.9	-41.8	174.5	0	0	0	0	0	110.7	A79 A80 L85 Y86 R569 D635 Y636	A79-A83 VanDerWaalsContact O-CB 3.31Å; A79-A83 WeakPolarHBondContact O-CB 3.48Å; A79-A83 PolarHBondContact O-N 2.95Å; A80-A83 PolarHBondContact O-N 2.61Å; A83-L85 VanDerWaalsContact C-N 3.28Å; A83-L85 PolarHBondContact O-N 3.42Å; A83-Y86 PolarHBondContact O-N 2.92Å; A83-Y86 VanDerWaalsContact O-O 3.12Å; A83-R569 PolarHBondContact O-NH1 3.48Å; A83-R569 PolarHBondContact O-NH2 2.91Å; A83-D635 HydrophobicContact CB-CB 3.68Å; A83-Y636 PolarHBondContact N-O 3.43Å
84	E	94.6	Very high	92.9	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-67.6	-25.2	-177.1	-73.5	177.7	-172.2	0	0	113.8	A80 L82 K284 V573 K576 R663	A80-E84 WeakPolarHBondContact O-CG 3.48Å; A80-E84 PolarHBondContact O-N 3.3Å; A80-E84 VanDerWaalsContact O-N 3.09Å; L82-E84 PolarHBondContact O-N 3.33Å; E84-K284 PolarHBondContact O-NZ 2.95Å; E84-V573 HydrophobicContact CB-CG1 4.35Å; E84-V573 HydrophobicContact CB-CG2 4.01Å; E84-V573 HydrophobicContact CG-CG2 3.84Å; E84-K576 IonicContact OE1-NZ 3.53Å; E84-K576 PolarHBondContact OE1-NZ 3.22Å; E84-K576 WeakPolarHBondContact OE2-CE 3.22Å; E84-K576 IonicContact OE2-NZ 3.91Å; E84-K576 PolarHBondContact OE2-NZ 3.39Å; E84-R663 WeakPolarHBondContact OE1-CD 3.47Å; E84-R663 WeakPolarHBondContact OE1-CG 3.39Å; E84-R663 IonicContact OE1-NE 3.69Å; E84-R663 IonicContact OE1-NH1 3.6Å; E84-R663 PolarHBondContact OE1-NH1 3.41Å
85	L	95.9	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-45.4	177.1	-178.8	61.8	0	0	0	111.5	L82 A83 N221 Y224 L225 K284 K285	L82-L85 WeakPolarHBondContact O-CB 3.39Å; L82-L85 PolarHBondContact O-N 3.43Å; A83-L85 VanDerWaalsContact C-N 3.28Å; A83-L85 PolarHBondContact O-N 3.42Å; L85-N221 WeakPolarHBondContact CD1-OD1 3.12Å; L85-N221 HydrophobicContact CD2-CB 4.45Å; L85-Y224 HydrophobicContact CB-CD1 4.37Å; L85-Y224 HydrophobicContact CB-CE1 4.22Å; L85-Y224 HydrophobicContact CD1-CD1 3.73Å; L85-Y224 HydrophobicContact CD1-CD2 4.27Å; L85-Y224 HydrophobicContact CD1-CE1 4.24Å; L85-Y224 HydrophobicContact CD1-CG 3.71Å; L85-Y224 HydrophobicContact CD2-CD1 3.59Å; L85-Y224 HydrophobicContact CD2-CE1 4.18Å; L85-Y224 HydrophobicContact CD2-CG 4.27Å; L85-Y224 HydrophobicContact CG-CD1 4.09Å; L85-Y224 HydrophobicContact CG-CE1 4.45Å; L85-L225 HydrophobicContact CD2-CD2 4.1Å; L85-L225 HydrophobicContact CD2-CG 4.2Å; L85-K284 WeakPolarHBondContact O-CE 3.47Å; L85-K284 PolarHBondContact O-NZ 3.4Å; L85-K285 HydrophobicContact CD1-CG 4.35Å
86	Y	95.9	Very high	93.3	Very high	10 Å²	10	36 Å²	36	4%	0.039	20%	0.201	C	C	.	.	S	Bend	trans	-93.8	140	-175.9	-57.6	-74.5	0	0	0	112.2	A83 F94 Q153 N221 R569 Y636	A83-Y86 PolarHBondContact O-N 2.92Å; A83-Y86 VanDerWaalsContact O-O 3.12Å; Y86-F94 AromaticContact CD1-CE1 3.97Å; Y86-F94 HydrophobicContact CD1-CE1 3.97Å; Y86-F94 AromaticContact CD1-CZ 3.89Å; Y86-F94 HydrophobicContact CD1-CZ 3.89Å; Y86-F94 HydrophobicContact CD2-CE1 4.08Å; Y86-F94 AromaticContact CD2-CZ 3.85Å; Y86-F94 HydrophobicContact CD2-CZ 3.85Å; Y86-F94 AromaticContact CE1-CE1 3.95Å; Y86-F94 HydrophobicContact CE1-CE1 3.95Å; Y86-F94 HydrophobicContact CE1-CZ 4.34Å; Y86-F94 HydrophobicContact CE2-CE1 4.04Å; Y86-F94 HydrophobicContact CE2-CZ 4.29Å; Y86-F94 HydrophobicContact CG-CE1 4.04Å; Y86-F94 AromaticContact CG-CZ 3.63Å; Y86-F94 HydrophobicContact CG-CZ 3.63Å; Y86-F94 AromaticContact CZ-CE1 3.99Å; Y86-Q153 VanDerWaalsContact CZ-NE2 3.34Å; Y86-Q153 PolarHBondContact OH-NE2 3.06Å; Y86-N221 HydrophobicContact CE1-CB 4.46Å; Y86-R569 PolarHBondContact O-NH1 3.32Å; Y86-Y636 HydrophobicContact CD2-CD1 4.2Å; Y86-Y636 HydrophobicContact CD2-CG 4.11Å; Y86-Y636 AromaticContact CE2-CD1 3.91Å; Y86-Y636 HydrophobicContact CE2-CD1 3.91Å; Y86-Y636 HydrophobicContact CE2-CE1 4.35Å; Y86-Y636 HydrophobicContact CE2-CG 4.1Å
87	S	93.8	Very high	93.6	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	19%	0.194	C	C	.	.			trans	-80.8	157.7	163.8	63.3	0	0	0	0	110.2	T89 E90 D566	S87-T89 PolarHBondContact O-N 3.24Å; S87-E90 WeakPolarHBondContact CB-OE2 3.21Å; S87-E90 PolarHBondContact N-OE2 3.47Å; S87-E90 WeakPolarHBondContact O-CB 3.49Å; S87-E90 PolarHBondContact O-N 3.35Å; S87-E90 VanDerWaalsContact O-N 3.16Å; S87-E90 WeakPolarHBondContact OG-CG 3.15Å; S87-E90 PolarHBondContact OG-N 2.97Å; S87-E90 PolarHBondContact OG-OE2 3.11Å; S87-D566 WeakPolarHBondContact CB-OD2 3.37Å
88	Y	92.9	Very high	93.9	Very high	10 Å²	10	30.8 Å²	30.8	4%	0.039	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-73.1	-15.1	175.8	-59.2	-41.9	0	0	0	112.9	E90 K562 D566 R569 I631 L634 D635	Y88-E90 VanDerWaalsContact C-N 3.32Å; Y88-K562 VanDerWaalsContact CB-CE 3.5Å; Y88-K562 PolarHBondContact O-NZ 3.43Å; Y88-K562 VanDerWaalsContact O-NZ 3.08Å; Y88-D566 HydrophobicContact CD2-CB 3.87Å; Y88-D566 PolarHBondContact N-OD2 3.17Å; Y88-R569 PolarHBondContact OH-NE 3.01Å; Y88-I631 HydrophobicContact CD2-CD1 3.84Å; Y88-I631 HydrophobicContact CD2-CG1 4.39Å; Y88-I631 HydrophobicContact CE2-CB 3.93Å; Y88-I631 HydrophobicContact CE2-CD1 3.81Å; Y88-I631 HydrophobicContact CE2-CG1 3.84Å; Y88-I631 PolarHBondContact OH-N 3.28Å; Y88-L634 HydrophobicContact CD1-CB 3.57Å; Y88-L634 HydrophobicContact CD1-CD1 4.26Å; Y88-L634 HydrophobicContact CE1-CB 3.71Å; Y88-L634 HydrophobicContact CG-CB 4.28Å; Y88-L634 HydrophobicContact CG-CD1 4.14Å; Y88-D635 VanDerWaalsContact CE1-OD1 3.23Å; Y88-D635 WeakPolarHBondContact CE1-OD1 3.19Å; Y88-D635 PolarHBondContact OH-OD1 3.06Å
89	T	91.6	Very high	94.2	Very high	34 Å²	34	35 Å²	35	21%	0.209	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-75.1	-22.5	171	-41.4	0	0	0	0	112	S87 G91 P92 L210 V548 P550	S87-T89 PolarHBondContact O-N 3.24Å; T89-G91 VanDerWaalsContact C-N 3.28Å; T89-G91 PolarHBondContact O-N 3Å; T89-P92 WeakPolarHBondContact O-CD 3.32Å; T89-L210 HydrophobicContact CG2-CD2 3.23Å; T89-V548 PolarHBondContact OG1-O 3.32Å; T89-P550 HydrophobicContact CG2-CB 3.75Å; T89-P550 HydrophobicContact CG2-CG 4.47Å
90	E	93.1	Very high	94.5	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.019	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-76.6	-7.5	177.5	-79.2	170.9	110.4	0	0	114.3	S87 Y88 P92 E93 R217 K285	S87-E90 WeakPolarHBondContact CB-OE2 3.21Å; S87-E90 PolarHBondContact N-OE2 3.47Å; S87-E90 WeakPolarHBondContact O-CB 3.49Å; S87-E90 PolarHBondContact O-N 3.35Å; S87-E90 VanDerWaalsContact O-N 3.16Å; S87-E90 WeakPolarHBondContact OG-CG 3.15Å; S87-E90 PolarHBondContact OG-N 2.97Å; S87-E90 PolarHBondContact OG-OE2 3.11Å; Y88-E90 VanDerWaalsContact C-N 3.32Å; E90-P92 VanDerWaalsContact C-CD 3.5Å; E90-E93 VanDerWaalsContact O-CB 3.25Å; E90-E93 WeakPolarHBondContact O-CB 3.48Å; E90-E93 PolarHBondContact O-N 3.29Å; E90-R217 VanDerWaalsContact CD-NH1 3.27Å; E90-R217 IonicContact OE1-CZ 3.99Å; E90-R217 IonicContact OE1-NH1 3.33Å; E90-R217 PolarHBondContact OE1-NH1 2.89Å; E90-K285 VanDerWaalsContact CD-NZ 3.3Å; E90-K285 WeakPolarHBondContact OE1-CE 3.43Å; E90-K285 IonicContact OE1-NZ 2.68Å; E90-K285 PolarHBondContact OE1-NZ 3.29Å; E90-K285 IonicContact OE2-NZ 3.67Å; E90-K285 PolarHBondContact OE2-NZ 3.35Å
91	G	91.7	Very high	94.7	Very high	31 Å²	31	32.4 Å²	32.4	32%	0.32	17%	0.171	S	C	.	.	H	α-helix	trans	-46.5	-48.6	-175.7	0	0	0	0	0	115.5	T89 E93 F94	T89-G91 VanDerWaalsContact C-N 3.28Å; T89-G91 PolarHBondContact O-N 3Å; G91-E93 PolarHBondContact O-N 3.31Å; G91-E93 VanDerWaalsContact O-N 3.15Å; G91-F94 VanDerWaalsContact O-CD2 3.24Å; G91-F94 WeakPolarHBondContact O-CD2 3Å; G91-F94 PolarHBondContact O-N 3.4Å
92	P	92.4	Very high	94.8	Very high	101 Å²	101	34.8 Å²	34.8	66%	0.656	18%	0.182	S	C	*	.	H	α-helix	trans	-60.4	-24.4	178.3	-24.8	35.5	0	0	0	114.2	T89 E90 F94 L95 M96	T89-P92 WeakPolarHBondContact O-CD 3.32Å; E90-P92 VanDerWaalsContact C-CD 3.5Å; P92-F94 VanDerWaalsContact C-N 3.3Å; P92-F94 PolarHBondContact O-N 2.94Å; P92-L95 PolarHBondContact O-N 3.34Å; P92-M96 PolarHBondContact O-N 3.38Å
93	E	94.8	Very high	94.8	Very high	29 Å²	29	39 Å²	39	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-71.5	-23.5	-177.9	-60	-163	-138.1	0	0	113.2	E90 G91 L95 M96 N97 R146 R217	E90-E93 VanDerWaalsContact O-CB 3.25Å; E90-E93 WeakPolarHBondContact O-CB 3.48Å; E90-E93 PolarHBondContact O-N 3.29Å; G91-E93 PolarHBondContact O-N 3.31Å; G91-E93 VanDerWaalsContact O-N 3.15Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.2Å; E93-M96 WeakPolarHBondContact O-CB 3.31Å; E93-M96 PolarHBondContact O-N 3.47Å; E93-N97 PolarHBondContact O-N 3.1Å; E93-N97 PolarHBondContact O-ND2 3.25Å; E93-N97 PolarHBondContact O-OD1 3.3Å; E93-R146 IonicContact OE2-CZ 3.55Å; E93-R146 IonicContact OE2-NH1 3.09Å; E93-R146 PolarHBondContact OE2-NH1 3.43Å; E93-R146 IonicContact OE2-NH2 2.74Å; E93-R146 PolarHBondContact OE2-NH2 2.9Å; E93-R217 IonicContact OE1-CZ 3.92Å; E93-R217 IonicContact OE1-NH1 2.96Å; E93-R217 PolarHBondContact OE1-NH1 3.07Å; E93-R217 IonicContact OE1-NH2 3.28Å; E93-R217 PolarHBondContact OE1-NH2 3.31Å; E93-R217 IonicContact OE2-NH1 3.2Å; E93-R217 IonicContact OE2-NH2 3.98Å
94	F	95.9	Very high	94.7	Very high	13 Å²	13	40.9 Å²	40.9	6%	0.057	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-45.9	174.8	-66	-61.2	0	0	0	111.3	Y86 G91 P92 N97 R98 Q153 F156 Y636 V640	Y86-F94 AromaticContact CD1-CE1 3.97Å; Y86-F94 HydrophobicContact CD1-CE1 3.97Å; Y86-F94 AromaticContact CD1-CZ 3.89Å; Y86-F94 HydrophobicContact CD1-CZ 3.89Å; Y86-F94 HydrophobicContact CD2-CE1 4.08Å; Y86-F94 AromaticContact CD2-CZ 3.85Å; Y86-F94 HydrophobicContact CD2-CZ 3.85Å; Y86-F94 AromaticContact CE1-CE1 3.95Å; Y86-F94 HydrophobicContact CE1-CE1 3.95Å; Y86-F94 HydrophobicContact CE1-CZ 4.34Å; Y86-F94 HydrophobicContact CE2-CE1 4.04Å; Y86-F94 HydrophobicContact CE2-CZ 4.29Å; Y86-F94 HydrophobicContact CG-CE1 4.04Å; Y86-F94 AromaticContact CG-CZ 3.63Å; Y86-F94 HydrophobicContact CG-CZ 3.63Å; Y86-F94 AromaticContact CZ-CE1 3.99Å; G91-F94 VanDerWaalsContact O-CD2 3.24Å; G91-F94 WeakPolarHBondContact O-CD2 3Å; G91-F94 PolarHBondContact O-N 3.4Å; P92-F94 VanDerWaalsContact C-N 3.3Å; P92-F94 PolarHBondContact O-N 2.94Å; F94-N97 PolarHBondContact O-N 2.8Å; F94-R98 PolarHBondContact O-N 3.45Å; F94-R98 VanDerWaalsContact O-N 3.13Å; F94-Q153 VanDerWaalsContact CE1-NE2 3.34Å; F94-F156 HydrophobicContact CB-CE1 4.45Å; F94-F156 HydrophobicContact CB-CZ 3.91Å; F94-Y636 HydrophobicContact CD1-CD2 4.2Å; F94-Y636 HydrophobicContact CD1-CE2 4.45Å; F94-Y636 AromaticContact CE1-CD2 3.62Å; F94-Y636 HydrophobicContact CE1-CD2 3.62Å; F94-Y636 HydrophobicContact CE1-CE2 4.14Å; F94-Y636 HydrophobicContact CE1-CG 4.2Å; F94-Y636 AromaticContact CZ-CD2 3.84Å; F94-Y636 HydrophobicContact CZ-CD2 3.84Å; F94-Y636 HydrophobicContact CZ-CG 4.14Å; F94-V640 HydrophobicContact CB-CG1 4.03Å; F94-V640 HydrophobicContact CD1-CG1 4.35Å; F94-V640 HydrophobicContact CD2-CG1 3.99Å; F94-V640 HydrophobicContact CG-CG1 3.89Å
95	L	95.4	Very high	94.7	Very high	112 Å²	112	41.3 Å²	41.3	59%	0.586	21%	0.213	S	C	*	.	H	α-helix	trans	-68.6	-35.9	177	-65.9	176.6	0	0	0	111.9	P92 E93 R98 K99	P92-L95 PolarHBondContact O-N 3.34Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.2Å; L95-R98 PolarHBondContact O-N 3.34Å; L95-K99 WeakPolarHBondContact O-CB 3.36Å; L95-K99 PolarHBondContact O-N 3.24Å
96	M	95.9	Very high	94.5	Very high	103 Å²	103	49.3 Å²	49.3	51%	0.507	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-45.5	174.5	-168.8	84.6	172.2	0	0	111.3	P92 E93 K99 C100	P92-M96 PolarHBondContact O-N 3.38Å; E93-M96 WeakPolarHBondContact O-CB 3.31Å; E93-M96 PolarHBondContact O-N 3.47Å; M96-K99 PolarHBondContact O-N 3.25Å; M96-C100 PolarHBondContact O-N 3.03Å; M96-C100 PolarHBondContact O-SG 3.15Å; M96-C100 VanDerWaalsContact O-SG 3.4Å
97	N	97.4	Very high	94.2	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-46.7	178.9	-63.3	-16.6	0	0	0	111.4	E93 F94 K99 C100 F101 R146 L149 Q153	E93-N97 PolarHBondContact O-N 3.1Å; E93-N97 PolarHBondContact O-ND2 3.25Å; E93-N97 PolarHBondContact O-OD1 3.3Å; F94-N97 PolarHBondContact O-N 2.8Å; N97-K99 VanDerWaalsContact C-N 3.35Å; N97-K99 PolarHBondContact O-N 3.19Å; N97-C100 PolarHBondContact O-N 2.98Å; N97-F101 PolarHBondContact O-N 2.86Å; N97-F101 VanDerWaalsContact O-N 3.1Å; N97-R146 WeakPolarHBondContact CB-O 3.25Å; N97-R146 WeakPolarHBondContact OD1-CG 3.48Å; N97-R146 PolarHBondContact OD1-NH1 2.89Å; N97-L149 VanDerWaalsContact ND2-CD2 3.34Å; N97-L149 WeakPolarHBondContact ND2-CD2 3.41Å; N97-Q153 PolarHBondContact ND2-OE1 3.2Å
98	R	96.8	Very high	93.8	Very high	87 Å²	87	58.9 Å²	58.9	33%	0.328	29%	0.29	S	S	.	.	H	α-helix	trans	-56.8	-47.4	174.5	177.6	-179.7	147.9	-174.2	-7.4	111.7	F94 L95 C100 F101 E102 Y150	F94-R98 PolarHBondContact O-N 3.45Å; F94-R98 VanDerWaalsContact O-N 3.13Å; L95-R98 PolarHBondContact O-N 3.34Å; R98-C100 VanDerWaalsContact C-N 3.35Å; R98-C100 PolarHBondContact O-N 3.36Å; R98-F101 PolarHBondContact O-N 2.91Å; R98-E102 HydrophobicContact CG-CG 4.36Å; R98-E102 IonicContact CZ-OE1 2.82Å; R98-E102 IonicContact NE-OE1 3.1Å; R98-E102 PolarHBondContact NE-OE1 3.38Å; R98-E102 IonicContact NH2-OE1 3.84Å; R98-E102 PolarHBondContact NH2-OE1 2.93Å; R98-E102 VanDerWaalsContact NH2-OE1 3.09Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.35Å; R98-Y150 HydrophobicContact CB-CD2 3.65Å; R98-Y150 HydrophobicContact CB-CE2 3.49Å; R98-Y150 VanDerWaalsContact CB-CE2 3.49Å; R98-Y150 HydrophobicContact CB-CG 4.28Å; R98-Y150 HydrophobicContact CG-CD2 4.28Å; R98-Y150 HydrophobicContact CG-CE1 4.35Å; R98-Y150 HydrophobicContact CG-CE2 3.68Å
99	K	96.9	Very high	93.5	Very high	120 Å²	120	59.7 Å²	59.7	52%	0.522	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-43.9	179.2	-175.7	179.2	174.6	-179.3	0	111.9	L95 M96 N97 F101 E102 E103	L95-K99 WeakPolarHBondContact O-CB 3.36Å; L95-K99 PolarHBondContact O-N 3.24Å; M96-K99 PolarHBondContact O-N 3.25Å; N97-K99 VanDerWaalsContact C-N 3.35Å; N97-K99 PolarHBondContact O-N 3.19Å; K99-F101 VanDerWaalsContact C-N 3.31Å; K99-F101 PolarHBondContact O-N 3.22Å; K99-E102 PolarHBondContact O-N 3.01Å; K99-E103 WeakPolarHBondContact CE-OE1 3.47Å; K99-E103 HydrophobicContact CG-CG 4.46Å; K99-E103 IonicContact NZ-OE1 3.49Å; K99-E103 WeakPolarHBondContact O-CB 3.48Å; K99-E103 WeakPolarHBondContact O-CG 3.13Å; K99-E103 PolarHBondContact O-N 2.99Å
100	C	96.6	Very high	93.1	Very high	12 Å²	12	63.1 Å²	63.1	8%	0.081	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-40.5	176.4	-69.4	0	0	0	0	112.3	M96 N97 R98 D104 K143 R146	M96-C100 PolarHBondContact O-N 3.03Å; M96-C100 PolarHBondContact O-SG 3.15Å; M96-C100 VanDerWaalsContact O-SG 3.4Å; N97-C100 PolarHBondContact O-N 2.98Å; R98-C100 VanDerWaalsContact C-N 3.35Å; R98-C100 PolarHBondContact O-N 3.36Å; C100-D104 PolarHBondContact O-N 2.9Å; C100-K143 WeakPolarHBondContact CB-O 3.38Å; C100-R146 HydrophobicContact CB-CB 4.04Å
101	F	96.8	Very high	92.7	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.009	36%	0.359	C	S	.	.	H	α-helix	trans	-65.6	-50	174.4	174.3	-98.6	0	0	0	112	N97 R98 K99 E103 D104 F105 W114 H125 A147 Y150 V151	N97-F101 PolarHBondContact O-N 2.86Å; N97-F101 VanDerWaalsContact O-N 3.1Å; R98-F101 PolarHBondContact O-N 2.91Å; K99-F101 VanDerWaalsContact C-N 3.31Å; K99-F101 PolarHBondContact O-N 3.22Å; F101-E103 VanDerWaalsContact C-N 3.31Å; F101-E103 PolarHBondContact O-N 3.47Å; F101-D104 PolarHBondContact O-N 3.07Å; F101-F105 HydrophobicContact CD1-CB 4.35Å; F101-F105 HydrophobicContact CE1-CB 4.04Å; F101-F105 HydrophobicContact CE1-CD1 4.46Å; F101-F105 HydrophobicContact CE1-CD2 4.13Å; F101-F105 AromaticContact CE1-CG 3.97Å; F101-F105 HydrophobicContact CE1-CG 3.97Å; F101-F105 HydrophobicContact CE2-CB 4.43Å; F101-F105 HydrophobicContact CE2-CD2 4.11Å; F101-F105 HydrophobicContact CZ-CB 4.08Å; F101-F105 AromaticContact CZ-CD2 3.54Å; F101-F105 HydrophobicContact CZ-CD2 3.54Å; F101-F105 HydrophobicContact CZ-CE2 4.09Å; F101-F105 AromaticContact CZ-CG 3.85Å; F101-F105 HydrophobicContact CZ-CG 3.85Å; F101-F105 WeakPolarHBondContact O-CB 3.45Å; F101-F105 PolarHBondContact O-N 3.12Å; F101-W114 HydrophobicContact CE2-CE3 4.21Å; F101-W114 HydrophobicContact CE2-CZ3 4.38Å; F101-W114 HydrophobicContact CZ-CB 4.42Å; F101-W114 HydrophobicContact CZ-CD2 4.19Å; F101-W114 AromaticContact CZ-CE3 3.7Å; F101-W114 HydrophobicContact CZ-CE3 3.7Å; F101-W114 HydrophobicContact CZ-CZ3 4.31Å; F101-H125 AromaticContact CE2-CD2 3.96Å; F101-H125 AromaticContact CE2-NE2 3.65Å; F101-A147 HydrophobicContact CB-CB 3.93Å; F101-A147 HydrophobicContact CD2-CB 4.36Å; F101-Y150 HydrophobicContact CB-CD1 3.56Å; F101-Y150 HydrophobicContact CB-CE1 4.32Å; F101-Y150 HydrophobicContact CB-CG 4.19Å; F101-Y150 AromaticContact CD1-CD1 3.54Å; F101-Y150 HydrophobicContact CD1-CD1 3.54Å; F101-Y150 AromaticContact CD1-CE1 3.54Å; F101-Y150 HydrophobicContact CD1-CE1 3.54Å; F101-Y150 HydrophobicContact CD2-CD1 4.3Å; F101-Y150 HydrophobicContact CE1-CD1 4.31Å; F101-Y150 HydrophobicContact CE1-CE1 4.08Å; F101-Y150 AromaticContact CG-CD1 3.53Å; F101-Y150 HydrophobicContact CG-CD1 3.53Å; F101-Y150 HydrophobicContact CG-CE1 4.05Å; F101-V151 HydrophobicContact CD2-CG2 3.63Å; F101-V151 HydrophobicContact CE2-CG2 3.48Å; F101-V151 VanDerWaalsContact CE2-CG2 3.48Å; F101-V151 HydrophobicContact CZ-CG2 4.33Å
102	E	95.1	Very high	92.6	Very high	49 Å²	49	74.3 Å²	74.3	23%	0.229	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-37.4	-178.1	-72.8	-178.1	-167.5	0	0	112.9	R98 K99 R106	R98-E102 HydrophobicContact CG-CG 4.36Å; R98-E102 IonicContact CZ-OE1 2.82Å; R98-E102 IonicContact NE-OE1 3.1Å; R98-E102 PolarHBondContact NE-OE1 3.38Å; R98-E102 IonicContact NH2-OE1 3.84Å; R98-E102 PolarHBondContact NH2-OE1 2.93Å; R98-E102 VanDerWaalsContact NH2-OE1 3.09Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.35Å; K99-E102 PolarHBondContact O-N 3.01Å; E102-R106 WeakPolarHBondContact O-CB 3.42Å; E102-R106 WeakPolarHBondContact O-CG 3.46Å; E102-R106 PolarHBondContact O-N 3.42Å; E102-R106 VanDerWaalsContact O-N 3.1Å; E102-R106 IonicContact OE2-NH2 3.77Å; E102-R106 PolarHBondContact OE2-NH2 3.11Å
103	E	93.6	Very high	92.6	Very high	90 Å²	90	74.7 Å²	74.7	42%	0.421	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-43.6	176	-77.4	178.4	-179.4	0	0	111.9	K99 F101 I107	K99-E103 WeakPolarHBondContact CE-OE1 3.47Å; K99-E103 HydrophobicContact CG-CG 4.46Å; K99-E103 IonicContact NZ-OE1 3.49Å; K99-E103 WeakPolarHBondContact O-CB 3.48Å; K99-E103 WeakPolarHBondContact O-CG 3.13Å; K99-E103 PolarHBondContact O-N 2.99Å; F101-E103 VanDerWaalsContact C-N 3.31Å; F101-E103 PolarHBondContact O-N 3.47Å; E103-I107 WeakPolarHBondContact O-CG1 3.4Å
104	D	91.8	Very high	92.6	Very high	43 Å²	43	73.3 Å²	73.3	23%	0.23	35%	0.35	C	S	.	.	H	α-helix	trans	-73.1	-45.8	177.6	-173.5	81.7	0	0	0	111.9	C100 F101 R106 I107 H125	C100-D104 PolarHBondContact O-N 2.9Å; F101-D104 PolarHBondContact O-N 3.07Å; D104-R106 PolarHBondContact O-N 2.91Å; D104-I107 WeakPolarHBondContact O-CB 3.45Å; D104-I107 PolarHBondContact O-N 3.45Å; D104-I107 VanDerWaalsContact O-N 3.13Å; D104-H125 IonicContact OD2-CE1 2.61Å; D104-H125 PolarHBondContact OD2-CE1 3.02Å; D104-H125 VanDerWaalsContact OD2-CE1 3.28Å; D104-H125 IonicContact OD2-NE2 3.42Å
105	F	93.6	Very high	92.5	Very high	12 Å²	12	74.8 Å²	74.8	5%	0.053	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-43	-176.6	-172.3	-103.8	0	0	0	112.3	F101 I107 H108 V109 K112 W114 L117 H125	F101-F105 HydrophobicContact CD1-CB 4.35Å; F101-F105 HydrophobicContact CE1-CB 4.04Å; F101-F105 HydrophobicContact CE1-CD1 4.46Å; F101-F105 HydrophobicContact CE1-CD2 4.13Å; F101-F105 AromaticContact CE1-CG 3.97Å; F101-F105 HydrophobicContact CE1-CG 3.97Å; F101-F105 HydrophobicContact CE2-CB 4.43Å; F101-F105 HydrophobicContact CE2-CD2 4.11Å; F101-F105 HydrophobicContact CZ-CB 4.08Å; F101-F105 AromaticContact CZ-CD2 3.54Å; F101-F105 HydrophobicContact CZ-CD2 3.54Å; F101-F105 HydrophobicContact CZ-CE2 4.09Å; F101-F105 AromaticContact CZ-CG 3.85Å; F101-F105 HydrophobicContact CZ-CG 3.85Å; F101-F105 WeakPolarHBondContact O-CB 3.45Å; F101-F105 PolarHBondContact O-N 3.12Å; F105-I107 PolarHBondContact O-N 3.41Å; F105-H108 PolarHBondContact O-N 2.94Å; F105-H108 VanDerWaalsContact O-N 3.1Å; F105-V109 HydrophobicContact CD1-CB 4.29Å; F105-V109 HydrophobicContact CD2-CG2 4.39Å; F105-V109 HydrophobicContact CE1-CB 3.88Å; F105-V109 HydrophobicContact CE1-CG1 3.88Å; F105-V109 HydrophobicContact CE2-CB 4.13Å; F105-V109 HydrophobicContact CE2-CG1 4.49Å; F105-V109 HydrophobicContact CE2-CG2 3.9Å; F105-V109 HydrophobicContact CZ-CB 3.8Å; F105-V109 HydrophobicContact CZ-CG1 3.75Å; F105-V109 HydrophobicContact CZ-CG2 4Å; F105-V109 PolarHBondContact O-N 2.97Å; F105-K112 WeakPolarHBondContact CE1-O 3.39Å; F105-W114 HydrophobicContact CD2-CE3 4.41Å; F105-W114 AromaticContact CE2-CE3 3.81Å; F105-W114 HydrophobicContact CE2-CE3 3.81Å; F105-W114 HydrophobicContact CE2-CZ3 4.36Å; F105-L117 HydrophobicContact CE2-CD1 3.64Å; F105-L117 HydrophobicContact CZ-CD1 3.69Å; F105-L117 HydrophobicContact CZ-CG 4.31Å; F105-H125 AromaticContact CD2-CD2 3.99Å; F105-H125 AromaticContact CD2-CE1 3.78Å; F105-H125 AromaticContact CD2-NE2 3.65Å
106	R	91.8	Very high	92.3	Very high	167 Å²	167	74.6 Å²	74.6	63%	0.63	36%	0.356	S	S	*	.	H	α-helix	trans	-66.5	-19.3	179.6	-73.5	177.3	-172.2	-176	9.1	114.4	E102 D104 H108	E102-R106 WeakPolarHBondContact O-CB 3.42Å; E102-R106 WeakPolarHBondContact O-CG 3.46Å; E102-R106 PolarHBondContact O-N 3.42Å; E102-R106 VanDerWaalsContact O-N 3.1Å; E102-R106 IonicContact OE2-NH2 3.77Å; E102-R106 PolarHBondContact OE2-NH2 3.11Å; D104-R106 PolarHBondContact O-N 2.91Å; R106-H108 PolarHBondContact O-N 3.01Å
107	I	89.6	Confident	92.2	Very high	122 Å²	122	70.5 Å²	70.5	63%	0.626	34%	0.336	S	S	*	.	H	α-helix	trans	-69.4	-30.7	175.2	-63	168.2	0	0	0	110.3	E103 D104 F105	E103-I107 WeakPolarHBondContact O-CG1 3.4Å; D104-I107 WeakPolarHBondContact O-CB 3.45Å; D104-I107 PolarHBondContact O-N 3.45Å; D104-I107 VanDerWaalsContact O-N 3.13Å; F105-I107 PolarHBondContact O-N 3.41Å
108	H	86.9	Confident	92.1	Very high	92 Å²	92	74.1 Å²	74.1	43%	0.426	36%	0.355	S	S	.	.	H	α-helix	trans	-113.9	-25	-168.2	-66.2	-51.1	0	0	0	114.2	F105 R106	F105-H108 PolarHBondContact O-N 2.94Å; F105-H108 VanDerWaalsContact O-N 3.1Å; R106-H108 PolarHBondContact O-N 3.01Å
109	V	86.7	Confident	91.9	Very high	27 Å²	27	73.9 Å²	73.9	16%	0.164	36%	0.364	C	S	.	.			trans	-129.7	113.2	-179.4	-178.3	0	0	0	0	107.8	F105 K112 L117	F105-V109 HydrophobicContact CD1-CB 4.29Å; F105-V109 HydrophobicContact CD2-CG2 4.39Å; F105-V109 HydrophobicContact CE1-CB 3.88Å; F105-V109 HydrophobicContact CE1-CG1 3.88Å; F105-V109 HydrophobicContact CE2-CB 4.13Å; F105-V109 HydrophobicContact CE2-CG1 4.49Å; F105-V109 HydrophobicContact CE2-CG2 3.9Å; F105-V109 HydrophobicContact CZ-CB 3.8Å; F105-V109 HydrophobicContact CZ-CG1 3.75Å; F105-V109 HydrophobicContact CZ-CG2 4Å; F105-V109 PolarHBondContact O-N 2.97Å; V109-K112 HydrophobicContact CG1-CB 3.86Å; V109-L117 HydrophobicContact CG1-CD2 4.06Å
110	T	82.7	Confident	91.8	Very high	107 Å²	107	73.9 Å²	73.9	66%	0.656	37%	0.37	S	S	*	.			trans	-95.7	134.1	175.5	53.8	0	0	0	0	109.8	K112	T110-K112 VanDerWaalsContact C-N 3.3Å; T110-K112 PolarHBondContact O-N 3.33Å
111	D	83.8	Confident	91.7	Very high	164 Å²	164	76.8 Å²	76.8	88%	0.877	38%	0.382	S	S	*	.	S	Bend	trans	60.9	24.5	168.3	-52	-40.7	0	0	0	117
112	K	90.9	Very high	91.7	Very high	105 Å²	105	76.9 Å²	76.9	46%	0.457	38%	0.383	S	S	.	.			trans	-128.7	155.9	170.3	-67.3	-171.6	175.8	-170.8	0	111.5	F105 V109 T110 E116 L117	F105-K112 WeakPolarHBondContact CE1-O 3.39Å; V109-K112 HydrophobicContact CG1-CB 3.86Å; T110-K112 VanDerWaalsContact C-N 3.3Å; T110-K112 PolarHBondContact O-N 3.33Å; K112-E116 WeakPolarHBondContact CA-OE2 3.33Å; K112-L117 HydrophobicContact CB-CD2 4.23Å; K112-L117 HydrophobicContact CD-CD2 4.07Å
113	K	91.6	Very high	91.7	Very high	110 Å²	110	78.9 Å²	78.9	48%	0.478	39%	0.388	S	S	.	.			trans	-90.9	160	171	-66.4	-175.8	-177.3	176.6	0	111.6	T115 E116 E158	K113-T115 VanDerWaalsContact C-N 3.27Å; K113-T115 PolarHBondContact O-N 3.35Å; K113-E116 HydrophobicContact CB-CB 4.42Å; K113-E116 HydrophobicContact CB-CG 3.98Å; K113-E116 PolarHBondContact N-OE2 3.38Å; K113-E116 PolarHBondContact O-N 3.22Å; K113-E116 VanDerWaalsContact O-N 3.15Å; K113-E158 WeakPolarHBondContact CB-OE2 3.46Å
114	W	94.9	Very high	91.8	Very high	0 Å²	0	77.5 Å²	77.5	0%	0	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-55.2	-47.9	173.1	178.6	-102.5	0	0	0	110.5	F101 F105 E116 L117 H122 H125 V151 T155 E158 N172 L175	F101-W114 HydrophobicContact CE2-CE3 4.21Å; F101-W114 HydrophobicContact CE2-CZ3 4.38Å; F101-W114 HydrophobicContact CZ-CB 4.42Å; F101-W114 HydrophobicContact CZ-CD2 4.19Å; F101-W114 AromaticContact CZ-CE3 3.7Å; F101-W114 HydrophobicContact CZ-CE3 3.7Å; F101-W114 HydrophobicContact CZ-CZ3 4.31Å; F105-W114 HydrophobicContact CD2-CE3 4.41Å; F105-W114 AromaticContact CE2-CE3 3.81Å; F105-W114 HydrophobicContact CE2-CE3 3.81Å; F105-W114 HydrophobicContact CE2-CZ3 4.36Å; W114-E116 PolarHBondContact O-N 3Å; W114-L117 HydrophobicContact CE3-CD1 4.09Å; W114-L117 HydrophobicContact CZ3-CD1 4.45Å; W114-L117 WeakPolarHBondContact O-CB 3.21Å; W114-L117 PolarHBondContact O-N 3.39Å; W114-L117 VanDerWaalsContact O-N 3.1Å; W114-H122 AromaticContact CD2-CD2 3.65Å; W114-H122 AromaticContact CD2-NE2 3.88Å; W114-H122 AromaticContact CE2-CD2 3.39Å; W114-H122 AromaticContact CE2-NE2 3.73Å; W114-H122 AromaticContact CE3-CD2 3.84Å; W114-H122 HydrophobicContact CH2-CB 4.32Å; W114-H122 AromaticContact CH2-CD2 3.63Å; W114-H122 HydrophobicContact CZ2-CB 4.47Å; W114-H122 AromaticContact CZ2-CD2 3.4Å; W114-H122 WeakPolarHBondContact CZ2-CD2 3.37Å; W114-H122 AromaticContact CZ3-CD2 3.83Å; W114-H122 AromaticContact NE1-CD2 3.93Å; W114-H122 AromaticContact NE1-NE2 3.81Å; W114-H122 PolarHBondContact O-NE2 3.05Å; W114-H125 HydrophobicContact CZ3-CB 4.11Å; W114-H125 AromaticContact CZ3-CD2 3.66Å; W114-V151 HydrophobicContact CZ2-CG1 4.01Å; W114-T155 HydrophobicContact CB-CG2 4.42Å; W114-T155 HydrophobicContact CD2-CG2 4.45Å; W114-T155 HydrophobicContact CG-CG2 3.91Å; W114-E158 WeakPolarHBondContact CB-OE1 3.43Å; W114-E158 PolarHBondContact N-OE1 2.98Å; W114-E158 PolarHBondContact N-OE2 3.2Å; W114-N172 PolarHBondContact NE1-OD1 3.35Å; W114-L175 HydrophobicContact CH2-CD2 4.16Å; W114-L175 HydrophobicContact CZ2-CD2 3.97Å
115	T	92.7	Very high	92	Very high	43 Å²	43	75.6 Å²	75.6	26%	0.264	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-60.9	-15.1	179.5	50.6	0	0	0	0	115.4	K113 E158 W168	K113-T115 VanDerWaalsContact C-N 3.27Å; K113-T115 PolarHBondContact O-N 3.35Å; T115-E158 WeakPolarHBondContact CB-OE2 3.46Å; T115-E158 HydrophobicContact CG2-CB 4.06Å; T115-E158 VanDerWaalsContact CG2-OE2 3.29Å; T115-E158 WeakPolarHBondContact CG2-OE2 3.31Å; T115-E158 PolarHBondContact N-OE2 3.44Å; T115-E158 PolarHBondContact OG1-OE2 3.42Å; T115-W168 HydrophobicContact CG2-CD2 4.07Å; T115-W168 HydrophobicContact CG2-CH2 4.25Å; T115-W168 HydrophobicContact CG2-CZ2 3.51Å
116	E	92.9	Very high	92.1	Very high	109 Å²	109	75.1 Å²	75.1	51%	0.509	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-98.3	-4.6	-179.3	-65.9	166.3	-179.1	0	0	113.3	K112 K113 W114	K112-E116 WeakPolarHBondContact CA-OE2 3.33Å; K113-E116 HydrophobicContact CB-CB 4.42Å; K113-E116 HydrophobicContact CB-CG 3.98Å; K113-E116 PolarHBondContact N-OE2 3.38Å; K113-E116 PolarHBondContact O-N 3.22Å; K113-E116 VanDerWaalsContact O-N 3.15Å; W114-E116 PolarHBondContact O-N 3Å
117	L	93.9	Very high	92.3	Very high	16 Å²	16	70.7 Å²	70.7	8%	0.084	36%	0.361	C	S	.	.	S	Bend	trans	-79.3	152.7	-178.7	-63	-174.4	0	0	0	112.5	F105 V109 K112 W114 Q121 H122	F105-L117 HydrophobicContact CE2-CD1 3.64Å; F105-L117 HydrophobicContact CZ-CD1 3.69Å; F105-L117 HydrophobicContact CZ-CG 4.31Å; V109-L117 HydrophobicContact CG1-CD2 4.06Å; K112-L117 HydrophobicContact CB-CD2 4.23Å; K112-L117 HydrophobicContact CD-CD2 4.07Å; W114-L117 HydrophobicContact CE3-CD1 4.09Å; W114-L117 HydrophobicContact CZ3-CD1 4.45Å; W114-L117 WeakPolarHBondContact O-CB 3.21Å; W114-L117 PolarHBondContact O-N 3.39Å; W114-L117 VanDerWaalsContact O-N 3.1Å; L117-Q121 HydrophobicContact CB-CB 4.04Å; L117-Q121 HydrophobicContact CD1-CB 4.3Å; L117-Q121 HydrophobicContact CD2-CB 4.39Å; L117-Q121 HydrophobicContact CG-CB 4.48Å; L117-H122 PolarHBondContact O-CE1 2.91Å
118	D	93.9	Very high	92.6	Very high	79 Å²	79	70 Å²	70	42%	0.422	35%	0.35	S	S	.	.			trans	-77.4	166.5	169.5	72.3	40.1	0	0	0	111.9	N120 Q121 H122	D118-N120 VanDerWaalsContact C-N 3.27Å; D118-N120 PolarHBondContact O-N 3.43Å; D118-N120 WeakPolarHBondContact OD1-CA 3.48Å; D118-N120 WeakPolarHBondContact OD1-CB 3.37Å; D118-N120 PolarHBondContact OD1-N 3.34Å; D118-Q121 VanDerWaalsContact N-OE1 3.16Å; D118-Q121 PolarHBondContact O-N 2.89Å; D118-Q121 WeakPolarHBondContact OD1-CB 3.49Å; D118-Q121 VanDerWaalsContact OD1-CG 3.27Å; D118-Q121 WeakPolarHBondContact OD1-CG 3.48Å; D118-Q121 PolarHBondContact OD1-N 3.2Å; D118-H122 PolarHBondContact O-N 3.35Å; D118-H122 PolarHBondContact O-ND1 3.44Å
119	T	93.1	Very high	93	Very high	83 Å²	83	65.7 Å²	65.7	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-31.6	-179	-52	0	0	0	0	113.2	R123	T119-R123 WeakPolarHBondContact O-CB 3.27Å; T119-R123 PolarHBondContact O-N 3.1Å
120	N	94.4	Very high	93.4	Very high	119 Å²	119	65.6 Å²	65.6	64%	0.636	33%	0.329	S	S	*	.	H	α-helix	trans	-73.9	-37.2	179.5	-69.7	-31.2	0	0	0	111.6	D118 R123 T124	D118-N120 VanDerWaalsContact C-N 3.27Å; D118-N120 PolarHBondContact O-N 3.43Å; D118-N120 WeakPolarHBondContact OD1-CA 3.48Å; D118-N120 WeakPolarHBondContact OD1-CB 3.37Å; D118-N120 PolarHBondContact OD1-N 3.34Å; N120-R123 PolarHBondContact O-N 2.99Å; N120-T124 WeakPolarHBondContact O-CB 3.47Å; N120-T124 PolarHBondContact O-N 3.37Å; N120-T124 PolarHBondContact O-OG1 3.08Å
121	Q	94.9	Very high	93.9	Very high	74 Å²	74	65.2 Å²	65.2	35%	0.346	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-44.6	174.6	-72.9	173.4	-23.3	0	0	110.7	L117 D118 R123 T124 H125	L117-Q121 HydrophobicContact CB-CB 4.04Å; L117-Q121 HydrophobicContact CD1-CB 4.3Å; L117-Q121 HydrophobicContact CD2-CB 4.39Å; L117-Q121 HydrophobicContact CG-CB 4.48Å; D118-Q121 VanDerWaalsContact N-OE1 3.16Å; D118-Q121 PolarHBondContact O-N 2.89Å; D118-Q121 WeakPolarHBondContact OD1-CB 3.49Å; D118-Q121 VanDerWaalsContact OD1-CG 3.27Å; D118-Q121 WeakPolarHBondContact OD1-CG 3.48Å; D118-Q121 PolarHBondContact OD1-N 3.2Å; Q121-R123 PolarHBondContact O-N 2.98Å; Q121-T124 PolarHBondContact O-N 2.86Å; Q121-H125 PolarHBondContact O-N 3.14Å
122	H	96.2	Very high	94.4	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-54.3	-51.3	171.4	-73	132	0	0	0	111.7	W114 L117 D118 T124 H125 A126 Y171 L175	W114-H122 AromaticContact CD2-CD2 3.65Å; W114-H122 AromaticContact CD2-NE2 3.88Å; W114-H122 AromaticContact CE2-CD2 3.39Å; W114-H122 AromaticContact CE2-NE2 3.73Å; W114-H122 AromaticContact CE3-CD2 3.84Å; W114-H122 HydrophobicContact CH2-CB 4.32Å; W114-H122 AromaticContact CH2-CD2 3.63Å; W114-H122 HydrophobicContact CZ2-CB 4.47Å; W114-H122 AromaticContact CZ2-CD2 3.4Å; W114-H122 WeakPolarHBondContact CZ2-CD2 3.37Å; W114-H122 AromaticContact CZ3-CD2 3.83Å; W114-H122 AromaticContact NE1-CD2 3.93Å; W114-H122 AromaticContact NE1-NE2 3.81Å; W114-H122 PolarHBondContact O-NE2 3.05Å; L117-H122 PolarHBondContact O-CE1 2.91Å; D118-H122 PolarHBondContact O-N 3.35Å; D118-H122 PolarHBondContact O-ND1 3.44Å; H122-T124 PolarHBondContact O-N 3.33Å; H122-H125 PolarHBondContact O-N 3.11Å; H122-A126 WeakPolarHBondContact O-CB 3.49Å; H122-A126 PolarHBondContact O-N 3.34Å; H122-Y171 AromaticContact ND1-CE1 3.85Å; H122-Y171 AromaticContact ND1-CZ 3.88Å; H122-Y171 PolarHBondContact ND1-OH 3.02Å; H122-Y171 VanDerWaalsContact ND1-OH 3.08Å; H122-L175 HydrophobicContact CB-CD2 3.79Å
123	R	96.5	Very high	94.5	Very high	90 Å²	90	53.3 Å²	53.3	34%	0.34	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-46	177.8	-172.3	-173.1	-172.4	119.2	13.6	112.3	T119 N120 Q121 H125 A126 M127 L175 E178 V179	T119-R123 WeakPolarHBondContact O-CB 3.27Å; T119-R123 PolarHBondContact O-N 3.1Å; N120-R123 PolarHBondContact O-N 2.99Å; Q121-R123 PolarHBondContact O-N 2.98Å; R123-H125 VanDerWaalsContact C-N 3.33Å; R123-H125 PolarHBondContact O-N 3.29Å; R123-A126 PolarHBondContact O-N 3.14Å; R123-M127 HydrophobicContact CG-CE 4.01Å; R123-M127 HydrophobicContact CG-SD 4.17Å; R123-M127 VanDerWaalsContact NE-CE 3.28Å; R123-M127 WeakPolarHBondContact O-CG 3.32Å; R123-M127 PolarHBondContact O-N 3.14Å; R123-L175 HydrophobicContact CB-CD1 4.23Å; R123-E178 IonicContact CZ-OE1 3.86Å; R123-E178 IonicContact NH1-OE1 3.63Å; R123-E178 PolarHBondContact NH1-OE1 2.93Å; R123-E178 IonicContact NH2-OE1 3.66Å; R123-V179 HydrophobicContact CG-CG1 4.16Å
124	T	95.8	Very high	94.4	Very high	61 Å²	61	55.6 Å²	55.6	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-42.7	-180	-58.4	0	0	0	0	111.3	N120 Q121 H122 R128	N120-T124 WeakPolarHBondContact O-CB 3.47Å; N120-T124 PolarHBondContact O-N 3.37Å; N120-T124 PolarHBondContact O-OG1 3.08Å; Q121-T124 PolarHBondContact O-N 2.86Å; H122-T124 PolarHBondContact O-N 3.33Å; T124-R128 WeakPolarHBondContact O-CG 3.46Å; T124-R128 PolarHBondContact O-N 3.49Å; T124-R128 VanDerWaalsContact O-N 3.15Å
125	H	95.7	Very high	94.1	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-40.7	178.3	-166.9	72	0	0	0	111.9	F101 D104 F105 W114 Q121 H122 R123 M127 R128 L129	F101-H125 AromaticContact CE2-CD2 3.96Å; F101-H125 AromaticContact CE2-NE2 3.65Å; D104-H125 IonicContact OD2-CE1 2.61Å; D104-H125 PolarHBondContact OD2-CE1 3.02Å; D104-H125 VanDerWaalsContact OD2-CE1 3.28Å; D104-H125 IonicContact OD2-NE2 3.42Å; F105-H125 AromaticContact CD2-CD2 3.99Å; F105-H125 AromaticContact CD2-CE1 3.78Å; F105-H125 AromaticContact CD2-NE2 3.65Å; W114-H125 HydrophobicContact CZ3-CB 4.11Å; W114-H125 AromaticContact CZ3-CD2 3.66Å; Q121-H125 PolarHBondContact O-N 3.14Å; H122-H125 PolarHBondContact O-N 3.11Å; R123-H125 VanDerWaalsContact C-N 3.33Å; R123-H125 PolarHBondContact O-N 3.29Å; H125-M127 VanDerWaalsContact C-N 3.33Å; H125-M127 PolarHBondContact O-N 3.38Å; H125-R128 PolarHBondContact O-N 3.32Å; H125-R128 VanDerWaalsContact O-N 3.17Å; H125-L129 WeakPolarHBondContact O-CG 3.48Å; H125-L129 PolarHBondContact O-N 3.4Å
126	A	96.3	Very high	93.6	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.017	32%	0.324	C	S	.	.	H	α-helix	trans	-60.5	-40.4	174.8	0	0	0	0	0	112.6	H122 R123 L129 L130 L175 V179	H122-A126 WeakPolarHBondContact O-CB 3.49Å; H122-A126 PolarHBondContact O-N 3.34Å; R123-A126 PolarHBondContact O-N 3.14Å; A126-L129 PolarHBondContact O-N 2.88Å; A126-L130 PolarHBondContact O-N 3.12Å; A126-L175 HydrophobicContact CB-CD2 4.08Å; A126-L175 HydrophobicContact CB-CG 4.14Å; A126-V179 HydrophobicContact CB-CG1 4.07Å; A126-V179 HydrophobicContact CB-CG2 4.21Å
127	M	96.1	Very high	93.5	Very high	74 Å²	74	59.4 Å²	59.4	37%	0.365	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-41.7	173.2	-74.3	173.4	166	0	0	112.2	R123 H125 L129 L130 D131 V179	R123-M127 HydrophobicContact CG-CE 4.01Å; R123-M127 HydrophobicContact CG-SD 4.17Å; R123-M127 VanDerWaalsContact NE-CE 3.28Å; R123-M127 WeakPolarHBondContact O-CG 3.32Å; R123-M127 PolarHBondContact O-N 3.14Å; H125-M127 VanDerWaalsContact C-N 3.33Å; H125-M127 PolarHBondContact O-N 3.38Å; M127-L129 PolarHBondContact O-N 3.35Å; M127-L130 WeakPolarHBondContact O-CA 3.42Å; M127-L130 WeakPolarHBondContact O-CB 2.99Å; M127-L130 PolarHBondContact O-N 3.11Å; M127-L130 VanDerWaalsContact O-N 3.11Å; M127-D131 VanDerWaalsContact O-CG 3.31Å; M127-D131 PolarHBondContact O-N 2.98Å; M127-V179 HydrophobicContact CE-CG1 4.34Å; M127-V179 HydrophobicContact CG-CB 4.25Å; M127-V179 HydrophobicContact CG-CG1 3.89Å
128	R	94.6	Very high	93.4	Very high	107 Å²	107	64.4 Å²	64.4	40%	0.404	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-40.3	176.1	-71.2	174.6	-169.1	163.3	5.6	112.8	T124 H125 L130 D131 G132	T124-R128 WeakPolarHBondContact O-CG 3.46Å; T124-R128 PolarHBondContact O-N 3.49Å; T124-R128 VanDerWaalsContact O-N 3.15Å; H125-R128 PolarHBondContact O-N 3.32Å; H125-R128 VanDerWaalsContact O-N 3.17Å; R128-L130 VanDerWaalsContact C-N 3.25Å; R128-L130 PolarHBondContact O-N 2.94Å; R128-D131 PolarHBondContact O-N 3.1Å; R128-G132 PolarHBondContact O-N 3.49Å
129	L	95.3	Very high	93.3	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-37.3	173.5	-69.5	175.7	0	0	0	110.7	H125 A126 M127 G132 L133 V144 A147 I148 V151	H125-L129 WeakPolarHBondContact O-CG 3.48Å; H125-L129 PolarHBondContact O-N 3.4Å; A126-L129 PolarHBondContact O-N 2.88Å; M127-L129 PolarHBondContact O-N 3.35Å; L129-G132 PolarHBondContact O-N 3.02Å; L129-L133 PolarHBondContact O-N 3.44Å; L129-V144 HydrophobicContact CB-CG1 4.41Å; L129-V144 HydrophobicContact CD2-CG1 4.29Å; L129-V144 WeakPolarHBondContact O-CG1 3.49Å; L129-A147 HydrophobicContact CD2-CB 4.05Å; L129-I148 HydrophobicContact CB-CD1 4.12Å; L129-I148 HydrophobicContact CB-CG1 3.84Å; L129-I148 HydrophobicContact CD1-CG1 4.17Å; L129-V151 HydrophobicContact CD1-CG2 4.39Å
130	L	95.2	Very high	93.3	Very high	24 Å²	24	71.1 Å²	71.1	13%	0.126	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-46.9	174.3	-171.4	59.9	0	0	0	111.8	A126 M127 R128 G132 L133 V179 A184	A126-L130 PolarHBondContact O-N 3.12Å; M127-L130 WeakPolarHBondContact O-CA 3.42Å; M127-L130 WeakPolarHBondContact O-CB 2.99Å; M127-L130 PolarHBondContact O-N 3.11Å; M127-L130 VanDerWaalsContact O-N 3.11Å; R128-L130 VanDerWaalsContact C-N 3.25Å; R128-L130 PolarHBondContact O-N 2.94Å; L130-G132 PolarHBondContact O-N 3.49Å; L130-L133 HydrophobicContact CD1-CD1 4.17Å; L130-L133 VanDerWaalsContact O-CB 3.31Å; L130-L133 WeakPolarHBondContact O-CB 3.45Å; L130-L133 PolarHBondContact O-N 3.18Å; L130-V179 HydrophobicContact CD2-CG2 4.46Å; L130-V179 WeakPolarHBondContact CD2-O 3.14Å; L130-A184 HydrophobicContact CD1-CB 3.54Å
131	D	94.1	Very high	93.4	Very high	100 Å²	100	67.2 Å²	67.2	54%	0.535	33%	0.331	S	S	.	.	H	α-helix	trans	-58.2	-36.3	174.4	-61.1	-21.3	0	0	0	111.3	M127 R128 L133 E134	M127-D131 VanDerWaalsContact O-CG 3.31Å; M127-D131 PolarHBondContact O-N 2.98Å; R128-D131 PolarHBondContact O-N 3.1Å; D131-L133 PolarHBondContact O-N 3.34Å; D131-E134 PolarHBondContact O-N 3.28Å
132	G	92.6	Very high	93.4	Very high	16 Å²	16	65.4 Å²	65.4	17%	0.165	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-21	176.2	0	0	0	0	0	114.6	R128 L129 L130 E134 V135	R128-G132 PolarHBondContact O-N 3.49Å; L129-G132 PolarHBondContact O-N 3.02Å; L130-G132 PolarHBondContact O-N 3.49Å; G132-E134 VanDerWaalsContact C-N 3.33Å; G132-V135 WeakPolarHBondContact O-CG2 3.47Å
133	L	93.1	Very high	93.4	Very high	3 Å²	3	70.6 Å²	70.6	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-74.2	-23.5	174.3	-74.3	-178.6	0	0	0	112.9	L129 L130 D131 V135 R141 V144 A145 I148 L188	L129-L133 PolarHBondContact O-N 3.44Å; L130-L133 HydrophobicContact CD1-CD1 4.17Å; L130-L133 VanDerWaalsContact O-CB 3.31Å; L130-L133 WeakPolarHBondContact O-CB 3.45Å; L130-L133 PolarHBondContact O-N 3.18Å; D131-L133 PolarHBondContact O-N 3.34Å; L133-V135 PolarHBondContact O-N 3.08Å; L133-R141 HydrophobicContact CD2-CG 4.31Å; L133-R141 WeakPolarHBondContact O-CD 3.49Å; L133-R141 WeakPolarHBondContact O-CG 3.49Å; L133-V144 HydrophobicContact CD2-CB 4.38Å; L133-V144 HydrophobicContact CD2-CG1 4.02Å; L133-V144 HydrophobicContact CG-CG1 4.1Å; L133-A145 HydrophobicContact CD2-CB 3.91Å; L133-I148 HydrophobicContact CD1-CD1 3.47Å; L133-I148 VanDerWaalsContact CD1-CD1 3.47Å; L133-I148 HydrophobicContact CD2-CD1 4.05Å; L133-I148 HydrophobicContact CG-CD1 3.68Å; L133-L188 HydrophobicContact CB-CD1 4.1Å; L133-L188 HydrophobicContact CD1-CD1 4.14Å; L133-L188 HydrophobicContact CD2-CD1 4.01Å; L133-L188 HydrophobicContact CG-CD1 4.33Å
134	E	89.6	Confident	93.4	Very high	157 Å²	157	67.3 Å²	67.3	73%	0.734	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-6.8	-179.4	-58.2	-172.8	167.9	0	0	113.1	D131 G132 T136	D131-E134 PolarHBondContact O-N 3.28Å; G132-E134 VanDerWaalsContact C-N 3.33Å; E134-T136 PolarHBondContact O-N 3.17Å
135	V	89.7	Confident	93.5	Very high	55 Å²	55	64.7 Å²	64.7	33%	0.333	32%	0.32	S	S	.	.			trans	-64.5	132.5	-179.1	178	0	0	0	0	111.2	G132 L133 A137 K140	G132-V135 WeakPolarHBondContact O-CG2 3.47Å; L133-V135 PolarHBondContact O-N 3.08Å; V135-A137 VanDerWaalsContact C-N 3.3Å; V135-A137 HydrophobicContact CG1-CB 4.05Å; V135-A137 PolarHBondContact O-N 3.3Å; V135-K140 HydrophobicContact CG1-CB 4.23Å; V135-K140 HydrophobicContact CG1-CD 4.36Å
136	T	82	Confident	93.6	Very high	137 Å²	137	65.4 Å²	65.4	84%	0.84	32%	0.323	S	S	*	.	S	Bend	trans	-66.8	-27.7	-179	55.6	0	0	0	0	113.9	E134 R138	E134-T136 PolarHBondContact O-N 3.17Å; T136-R138 PolarHBondContact O-N 2.84Å
137	A	91.6	Very high	93.7	Very high	41 Å²	41	65.3 Å²	65.3	34%	0.339	32%	0.322	S	S	.	.			trans	-73.6	109.1	179.4	0	0	0	0	0	111.5	V135 E139 K140 R141	V135-A137 VanDerWaalsContact C-N 3.3Å; V135-A137 HydrophobicContact CG1-CB 4.05Å; V135-A137 PolarHBondContact O-N 3.3Å; A137-E139 PolarHBondContact O-N 3.26Å; A137-K140 HydrophobicContact CB-CB 4.24Å; A137-K140 HydrophobicContact CB-CD 4.17Å; A137-K140 HydrophobicContact CB-CG 4.16Å; A137-K140 PolarHBondContact O-N 2.83Å; A137-K140 VanDerWaalsContact O-N 3.12Å; A137-R141 PolarHBondContact O-N 3.42Å
138	R	90.4	Very high	93.8	Very high	121 Å²	121	61.9 Å²	61.9	46%	0.457	31%	0.305	S	S	.	.	H	α-helix	trans	-50.6	-47.2	-177.5	-177.8	179.6	173.9	-166.2	-0.5	113.8	T136 K140 R141 L142 D215	T136-R138 PolarHBondContact O-N 2.84Å; R138-K140 PolarHBondContact O-N 2.96Å; R138-R141 PolarHBondContact O-N 3.15Å; R138-L142 WeakPolarHBondContact O-CB 3.48Å; R138-L142 PolarHBondContact O-N 3.17Å; R138-D215 IonicContact CZ-OD2 2.64Å; R138-D215 IonicContact NE-OD1 2.72Å; R138-D215 PolarHBondContact NE-OD1 2.87Å; R138-D215 IonicContact NE-OD2 3.94Å; R138-D215 IonicContact NH2-OD1 3.64Å; R138-D215 IonicContact NH2-OD2 3.33Å; R138-D215 PolarHBondContact NH2-OD2 3.09Å
139	E	92.6	Very high	94	Very high	163 Å²	163	56.9 Å²	56.9	76%	0.762	29%	0.286	S	S	*	.	H	α-helix	trans	-64.1	-39.4	-178.2	-67.7	-176.5	177.2	0	0	112.8	A137 L142 K143	A137-E139 PolarHBondContact O-N 3.26Å; E139-L142 PolarHBondContact O-N 3.41Å; E139-K143 WeakPolarHBondContact O-CG 3.46Å; E139-K143 PolarHBondContact O-N 3.02Å; E139-K143 VanDerWaalsContact O-N 3.14Å
140	K	93.3	Very high	94.2	Very high	140 Å²	140	56.9 Å²	56.9	61%	0.609	29%	0.286	S	S	*	.	H	α-helix	trans	-67.2	-46.2	177.1	-67.3	-172.7	178	-177.3	0	110.4	V135 A137 R138 L142 K143 V144	V135-K140 HydrophobicContact CG1-CB 4.23Å; V135-K140 HydrophobicContact CG1-CD 4.36Å; A137-K140 HydrophobicContact CB-CB 4.24Å; A137-K140 HydrophobicContact CB-CD 4.17Å; A137-K140 HydrophobicContact CB-CG 4.16Å; A137-K140 PolarHBondContact O-N 2.83Å; A137-K140 VanDerWaalsContact O-N 3.12Å; R138-K140 PolarHBondContact O-N 2.96Å; K140-L142 VanDerWaalsContact C-N 3.31Å; K140-L142 PolarHBondContact O-N 2.93Å; K140-K143 WeakPolarHBondContact O-CB 3.28Å; K140-K143 PolarHBondContact O-N 3.45Å; K140-K143 VanDerWaalsContact O-N 3.14Å; K140-V144 WeakPolarHBondContact O-CG2 3.29Å; K140-V144 PolarHBondContact O-N 2.81Å; K140-V144 VanDerWaalsContact O-N 3.08Å
141	R	95.3	Very high	94.3	Very high	37 Å²	37	55.8 Å²	55.8	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-41.6	176.3	-178	171.9	58.7	-160.8	-1.2	112.2	L133 A137 R138 V144 A145 M191	L133-R141 HydrophobicContact CD2-CG 4.31Å; L133-R141 WeakPolarHBondContact O-CD 3.49Å; L133-R141 WeakPolarHBondContact O-CG 3.49Å; A137-R141 PolarHBondContact O-N 3.42Å; R138-R141 PolarHBondContact O-N 3.15Å; R141-V144 PolarHBondContact O-N 3.43Å; R141-A145 WeakPolarHBondContact O-CB 3.27Å; R141-A145 PolarHBondContact O-N 3.3Å; R141-M191 VanDerWaalsContact CZ-CE 3.47Å; R141-M191 VanDerWaalsContact NH2-CE 3.26Å
142	L	95.4	Very high	94.5	Very high	36 Å²	36	51 Å²	51	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-40.1	176	180	60.1	0	0	0	112.3	R138 E139 K140 V144 A145 R146 T214 V218	R138-L142 WeakPolarHBondContact O-CB 3.48Å; R138-L142 PolarHBondContact O-N 3.17Å; E139-L142 PolarHBondContact O-N 3.41Å; K140-L142 VanDerWaalsContact C-N 3.31Å; K140-L142 PolarHBondContact O-N 2.93Å; L142-V144 VanDerWaalsContact C-N 3.33Å; L142-V144 PolarHBondContact O-N 3.33Å; L142-A145 PolarHBondContact O-N 3.22Å; L142-R146 HydrophobicContact CD1-CG 4.45Å; L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 WeakPolarHBondContact O-CG 3.3Å; L142-R146 PolarHBondContact O-N 3.41Å; L142-T214 HydrophobicContact CD1-CG2 4.33Å; L142-T214 HydrophobicContact CD2-CG2 4.15Å; L142-V218 HydrophobicContact CD1-CG2 4.23Å
143	K	96.6	Very high	94.7	Very high	113 Å²	113	50.3 Å²	50.3	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-43.5	174.5	-72.7	-176.5	177.9	-165.9	0	111.6	C100 E139 K140 R146 A147	C100-K143 WeakPolarHBondContact CB-O 3.38Å; E139-K143 WeakPolarHBondContact O-CG 3.46Å; E139-K143 PolarHBondContact O-N 3.02Å; E139-K143 VanDerWaalsContact O-N 3.14Å; K140-K143 WeakPolarHBondContact O-CB 3.28Å; K140-K143 PolarHBondContact O-N 3.45Å; K140-K143 VanDerWaalsContact O-N 3.14Å; K143-R146 WeakPolarHBondContact O-CB 3.3Å; K143-R146 PolarHBondContact O-N 3.37Å; K143-A147 PolarHBondContact O-N 3.36Å
144	V	97	Very high	94.9	Very high	21 Å²	21	50.2 Å²	50.2	13%	0.127	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-44.9	176.6	176.6	0	0	0	0	111.1	L129 L133 K140 R141 L142 R146 A147 I148	L129-V144 HydrophobicContact CB-CG1 4.41Å; L129-V144 HydrophobicContact CD2-CG1 4.29Å; L129-V144 WeakPolarHBondContact O-CG1 3.49Å; L133-V144 HydrophobicContact CD2-CB 4.38Å; L133-V144 HydrophobicContact CD2-CG1 4.02Å; L133-V144 HydrophobicContact CG-CG1 4.1Å; K140-V144 WeakPolarHBondContact O-CG2 3.29Å; K140-V144 PolarHBondContact O-N 2.81Å; K140-V144 VanDerWaalsContact O-N 3.08Å; R141-V144 PolarHBondContact O-N 3.43Å; L142-V144 VanDerWaalsContact C-N 3.33Å; L142-V144 PolarHBondContact O-N 3.33Å; V144-R146 VanDerWaalsContact C-N 3.28Å; V144-R146 PolarHBondContact O-N 3.5Å; V144-A147 WeakPolarHBondContact O-CA 3.16Å; V144-A147 WeakPolarHBondContact O-CB 3.43Å; V144-A147 PolarHBondContact O-N 2.82Å; V144-I148 HydrophobicContact CG1-CD1 4.19Å; V144-I148 WeakPolarHBondContact O-CG1 3.46Å; V144-I148 PolarHBondContact O-N 3.49Å
145	A	97.8	Very high	95.2	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-38.9	175.4	0	0	0	0	0	112	L133 R141 L142 I148 L149 V218	L133-A145 HydrophobicContact CD2-CB 3.91Å; R141-A145 WeakPolarHBondContact O-CB 3.27Å; R141-A145 PolarHBondContact O-N 3.3Å; L142-A145 PolarHBondContact O-N 3.22Å; A145-I148 PolarHBondContact O-N 3.3Å; A145-L149 WeakPolarHBondContact O-CB 3.4Å; A145-L149 PolarHBondContact O-N 2.81Å; A145-V218 HydrophobicContact CB-CG1 3.76Å
146	R	98.1	Very high	95.4	Very high	19 Å²	19	40.4 Å²	40.4	7%	0.072	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-38.4	173	-77.7	-171.2	176.9	-80.1	0.9	112.6	E93 N97 C100 L142 K143 V144 L149 Y150 V218	E93-R146 IonicContact OE2-CZ 3.55Å; E93-R146 IonicContact OE2-NH1 3.09Å; E93-R146 PolarHBondContact OE2-NH1 3.43Å; E93-R146 IonicContact OE2-NH2 2.74Å; E93-R146 PolarHBondContact OE2-NH2 2.9Å; N97-R146 WeakPolarHBondContact CB-O 3.25Å; N97-R146 WeakPolarHBondContact OD1-CG 3.48Å; N97-R146 PolarHBondContact OD1-NH1 2.89Å; C100-R146 HydrophobicContact CB-CB 4.04Å; L142-R146 HydrophobicContact CD1-CG 4.45Å; L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 WeakPolarHBondContact O-CG 3.3Å; L142-R146 PolarHBondContact O-N 3.41Å; K143-R146 WeakPolarHBondContact O-CB 3.3Å; K143-R146 PolarHBondContact O-N 3.37Å; V144-R146 VanDerWaalsContact C-N 3.28Å; V144-R146 PolarHBondContact O-N 3.5Å; R146-L149 PolarHBondContact O-N 3.45Å; R146-Y150 PolarHBondContact O-N 3.01Å; R146-V218 HydrophobicContact CG-CG1 4.46Å; R146-V218 HydrophobicContact CG-CG2 4.06Å
147	A	97.9	Very high	96	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-44.4	174.1	0	0	0	0	0	111.6	F101 L129 K143 V144 L149 Y150 V151	F101-A147 HydrophobicContact CB-CB 3.93Å; F101-A147 HydrophobicContact CD2-CB 4.36Å; L129-A147 HydrophobicContact CD2-CB 4.05Å; K143-A147 PolarHBondContact O-N 3.36Å; V144-A147 WeakPolarHBondContact O-CA 3.16Å; V144-A147 WeakPolarHBondContact O-CB 3.43Å; V144-A147 PolarHBondContact O-N 2.82Å; A147-L149 VanDerWaalsContact C-N 3.32Å; A147-L149 PolarHBondContact O-N 2.89Å; A147-Y150 WeakPolarHBondContact O-CB 3.45Å; A147-Y150 PolarHBondContact O-N 3.25Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 3.12Å
148	I	98.4	Very high	96	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-41.3	173.9	-66.2	169.6	0	0	0	110.9	L129 L133 V144 A145 Y150 V151 A152 L176 T181 I222	L129-I148 HydrophobicContact CB-CD1 4.12Å; L129-I148 HydrophobicContact CB-CG1 3.84Å; L129-I148 HydrophobicContact CD1-CG1 4.17Å; L133-I148 HydrophobicContact CD1-CD1 3.47Å; L133-I148 VanDerWaalsContact CD1-CD1 3.47Å; L133-I148 HydrophobicContact CD2-CD1 4.05Å; L133-I148 HydrophobicContact CG-CD1 3.68Å; V144-I148 HydrophobicContact CG1-CD1 4.19Å; V144-I148 WeakPolarHBondContact O-CG1 3.46Å; V144-I148 PolarHBondContact O-N 3.49Å; A145-I148 PolarHBondContact O-N 3.3Å; I148-Y150 VanDerWaalsContact C-N 3.32Å; I148-Y150 PolarHBondContact O-N 3.38Å; I148-V151 PolarHBondContact O-N 3.26Å; I148-A152 WeakPolarHBondContact O-CB 3.36Å; I148-A152 PolarHBondContact O-N 2.84Å; I148-L176 HydrophobicContact CG2-CD1 4.11Å; I148-L176 HydrophobicContact CG2-CD2 4.07Å; I148-T181 HydrophobicContact CG2-CG2 4.16Å; I148-I222 HydrophobicContact CB-CD1 4.24Å; I148-I222 HydrophobicContact CG2-CD1 3.89Å; I148-I222 HydrophobicContact CG2-CG1 4.42Å; I148-I222 HydrophobicContact CG2-CG2 4.15Å
149	L	98.4	Very high	96.2	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-61.5	-39.8	175.3	178.3	57	0	0	0	112	N97 A145 R146 A147 A152 Q153 V218 N221 I222 L225	N97-L149 VanDerWaalsContact ND2-CD2 3.34Å; N97-L149 WeakPolarHBondContact ND2-CD2 3.41Å; A145-L149 WeakPolarHBondContact O-CB 3.4Å; A145-L149 PolarHBondContact O-N 2.81Å; R146-L149 PolarHBondContact O-N 3.45Å; A147-L149 VanDerWaalsContact C-N 3.32Å; A147-L149 PolarHBondContact O-N 2.89Å; L149-A152 CarbonylContact O-C 3.58Å; L149-A152 PolarHBondContact O-N 3.03Å; L149-Q153 HydrophobicContact CD1-CG 4.08Å; L149-Q153 HydrophobicContact CG-CG 4.38Å; L149-Q153 WeakPolarHBondContact O-CB 3.3Å; L149-Q153 WeakPolarHBondContact O-CG 3.43Å; L149-Q153 PolarHBondContact O-N 3.21Å; L149-V218 HydrophobicContact CB-CG1 4.22Å; L149-V218 HydrophobicContact CD2-CB 4.41Å; L149-V218 HydrophobicContact CD2-CG1 4.1Å; L149-V218 HydrophobicContact CD2-CG2 4.29Å; L149-N221 HydrophobicContact CD1-CB 3.72Å; L149-N221 HydrophobicContact CD2-CB 4.18Å; L149-I222 HydrophobicContact CB-CD1 4.1Å; L149-I222 HydrophobicContact CB-CG1 3.76Å; L149-I222 HydrophobicContact CD1-CG1 3.85Å; L149-I222 HydrophobicContact CG-CG1 4.35Å; L149-L225 HydrophobicContact CD1-CD1 4.02Å
150	Y	98.4	Very high	96.2	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-41.4	174.4	177.7	-107.7	0	0	0	112.6	R98 F101 R146 A147 I148 Q153 T155 F156 G157	R98-Y150 HydrophobicContact CB-CD2 3.65Å; R98-Y150 HydrophobicContact CB-CE2 3.49Å; R98-Y150 VanDerWaalsContact CB-CE2 3.49Å; R98-Y150 HydrophobicContact CB-CG 4.28Å; R98-Y150 HydrophobicContact CG-CD2 4.28Å; R98-Y150 HydrophobicContact CG-CE1 4.35Å; R98-Y150 HydrophobicContact CG-CE2 3.68Å; F101-Y150 HydrophobicContact CB-CD1 3.56Å; F101-Y150 HydrophobicContact CB-CE1 4.32Å; F101-Y150 HydrophobicContact CB-CG 4.19Å; F101-Y150 AromaticContact CD1-CD1 3.54Å; F101-Y150 HydrophobicContact CD1-CD1 3.54Å; F101-Y150 AromaticContact CD1-CE1 3.54Å; F101-Y150 HydrophobicContact CD1-CE1 3.54Å; F101-Y150 HydrophobicContact CD2-CD1 4.3Å; F101-Y150 HydrophobicContact CE1-CD1 4.31Å; F101-Y150 HydrophobicContact CE1-CE1 4.08Å; F101-Y150 AromaticContact CG-CD1 3.53Å; F101-Y150 HydrophobicContact CG-CD1 3.53Å; F101-Y150 HydrophobicContact CG-CE1 4.05Å; R146-Y150 PolarHBondContact O-N 3.01Å; A147-Y150 WeakPolarHBondContact O-CB 3.45Å; A147-Y150 PolarHBondContact O-N 3.25Å; I148-Y150 VanDerWaalsContact C-N 3.32Å; I148-Y150 PolarHBondContact O-N 3.38Å; Y150-Q153 CarbonylContact O-C 3.56Å; Y150-Q153 WeakPolarHBondContact O-CB 3.36Å; Y150-Q153 PolarHBondContact O-N 2.87Å; Y150-T155 HydrophobicContact CD1-CG2 4.23Å; Y150-T155 HydrophobicContact CE1-CG2 3.93Å; Y150-T155 PolarHBondContact O-N 2.71Å; Y150-F156 HydrophobicContact CD2-CD1 4.12Å; Y150-F156 AromaticContact CD2-CE1 3.54Å; Y150-F156 HydrophobicContact CD2-CE1 3.54Å; Y150-F156 AromaticContact CD2-CZ 3.83Å; Y150-F156 HydrophobicContact CD2-CZ 3.83Å; Y150-F156 AromaticContact CE2-CD1 3.84Å; Y150-F156 HydrophobicContact CE2-CD1 3.84Å; Y150-F156 HydrophobicContact CE2-CD2 4.26Å; Y150-F156 AromaticContact CE2-CE1 3.53Å; Y150-F156 HydrophobicContact CE2-CE1 3.53Å; Y150-F156 AromaticContact CE2-CE2 3.97Å; Y150-F156 HydrophobicContact CE2-CE2 3.97Å; Y150-F156 HydrophobicContact CE2-CG 4.2Å; Y150-F156 AromaticContact CE2-CZ 3.59Å; Y150-F156 HydrophobicContact CE2-CZ 3.59Å; Y150-G157 WeakPolarHBondContact OH-CA 3.42Å; Y150-G157 PolarHBondContact OH-N 3.37Å; Y150-G157 VanDerWaalsContact OH-N 3.08Å
151	V	97.9	Very high	96.3	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-46.9	174.2	173.2	0	0	0	0	110.5	F101 W114 L129 A147 I148 Q153 G154 T155 N172 L176	F101-V151 HydrophobicContact CD2-CG2 3.63Å; F101-V151 HydrophobicContact CE2-CG2 3.48Å; F101-V151 VanDerWaalsContact CE2-CG2 3.48Å; F101-V151 HydrophobicContact CZ-CG2 4.33Å; W114-V151 HydrophobicContact CZ2-CG1 4.01Å; L129-V151 HydrophobicContact CD1-CG2 4.39Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 3.12Å; I148-V151 PolarHBondContact O-N 3.26Å; V151-Q153 PolarHBondContact O-N 3.33Å; V151-G154 PolarHBondContact O-N 3.33Å; V151-T155 HydrophobicContact CG2-CG2 4.48Å; V151-N172 HydrophobicContact CG1-CB 3.8Å; V151-N172 VanDerWaalsContact O-CB 3.3Å; V151-N172 WeakPolarHBondContact O-CB 3.41Å; V151-N172 PolarHBondContact O-ND2 2.96Å; V151-L176 HydrophobicContact CG1-CD1 4.38Å
152	A	98.1	Very high	96.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-28.8	175.2	0	0	0	0	0	112.9	I148 L149 G154 M169 I173 L176 I222 L225	I148-A152 WeakPolarHBondContact O-CB 3.36Å; I148-A152 PolarHBondContact O-N 2.84Å; L149-A152 CarbonylContact O-C 3.58Å; L149-A152 PolarHBondContact O-N 3.03Å; A152-G154 PolarHBondContact O-N 3.31Å; A152-G154 VanDerWaalsContact O-N 3.14Å; A152-M169 WeakPolarHBondContact O-CG 3.44Å; A152-I173 HydrophobicContact CB-CD1 3.85Å; A152-L176 HydrophobicContact CB-CD1 4.01Å; A152-I222 HydrophobicContact CB-CG2 4.32Å; A152-L225 HydrophobicContact CB-CD1 3.93Å
153	Q	97.4	Very high	96.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	16.7	172.4	-73.8	171.6	-26.3	0	0	113.2	Y86 F94 N97 L149 Y150 V151 T155 F156 L225 Y636	Y86-Q153 VanDerWaalsContact CZ-NE2 3.34Å; Y86-Q153 PolarHBondContact OH-NE2 3.06Å; F94-Q153 VanDerWaalsContact CE1-NE2 3.34Å; N97-Q153 PolarHBondContact ND2-OE1 3.2Å; L149-Q153 HydrophobicContact CD1-CG 4.08Å; L149-Q153 HydrophobicContact CG-CG 4.38Å; L149-Q153 WeakPolarHBondContact O-CB 3.3Å; L149-Q153 WeakPolarHBondContact O-CG 3.43Å; L149-Q153 PolarHBondContact O-N 3.21Å; Y150-Q153 CarbonylContact O-C 3.56Å; Y150-Q153 WeakPolarHBondContact O-CB 3.36Å; Y150-Q153 PolarHBondContact O-N 2.87Å; V151-Q153 PolarHBondContact O-N 3.33Å; Q153-T155 VanDerWaalsContact C-N 3.29Å; Q153-T155 PolarHBondContact O-N 3.09Å; Q153-F156 HydrophobicContact CB-CD1 4.03Å; Q153-F156 HydrophobicContact CB-CE1 4.18Å; Q153-L225 HydrophobicContact CG-CD1 4.1Å; Q153-Y636 VanDerWaalsContact C-OH 3.25Å; Q153-Y636 WeakPolarHBondContact CA-OH 3.38Å; Q153-Y636 HydrophobicContact CB-CE2 4.49Å; Q153-Y636 WeakPolarHBondContact CB-OH 3.39Å; Q153-Y636 PolarHBondContact O-OH 3.38Å
154	G	96.3	Very high	96.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	25.2	174.8	0	0	0	0	0	114.4	V151 A152 F156 W168 M169	V151-G154 PolarHBondContact O-N 3.33Å; A152-G154 PolarHBondContact O-N 3.31Å; A152-G154 VanDerWaalsContact O-N 3.14Å; G154-F156 PolarHBondContact O-N 3.08Å; G154-F156 VanDerWaalsContact O-N 3.08Å; G154-W168 WeakPolarHBondContact O-CB 3.35Å; G154-M169 VanDerWaalsContact CA-N 3.32Å
155	T	96	Very high	96	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	43.4	174.6	49	0	0	0	0	113	W114 Y150 V151 Q153 G157 E158	W114-T155 HydrophobicContact CB-CG2 4.42Å; W114-T155 HydrophobicContact CD2-CG2 4.45Å; W114-T155 HydrophobicContact CG-CG2 3.91Å; Y150-T155 HydrophobicContact CD1-CG2 4.23Å; Y150-T155 HydrophobicContact CE1-CG2 3.93Å; Y150-T155 PolarHBondContact O-N 2.71Å; V151-T155 HydrophobicContact CG2-CG2 4.48Å; Q153-T155 VanDerWaalsContact C-N 3.29Å; Q153-T155 PolarHBondContact O-N 3.09Å; T155-G157 PolarHBondContact O-N 2.73Å; T155-E158 PolarHBondContact O-N 3.03Å
156	F	95.4	Very high	95.8	Very high	6 Å²	6	26.9 Å²	26.9	3%	0.026	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-55	-20.9	-168.2	60.1	-101.6	0	0	0	115.4	F94 Y150 Q153 G154 E158 C159 V165 Y636 V640	F94-F156 HydrophobicContact CB-CE1 4.45Å; F94-F156 HydrophobicContact CB-CZ 3.91Å; Y150-F156 HydrophobicContact CD2-CD1 4.12Å; Y150-F156 AromaticContact CD2-CE1 3.54Å; Y150-F156 HydrophobicContact CD2-CE1 3.54Å; Y150-F156 AromaticContact CD2-CZ 3.83Å; Y150-F156 HydrophobicContact CD2-CZ 3.83Å; Y150-F156 AromaticContact CE2-CD1 3.84Å; Y150-F156 HydrophobicContact CE2-CD1 3.84Å; Y150-F156 HydrophobicContact CE2-CD2 4.26Å; Y150-F156 AromaticContact CE2-CE1 3.53Å; Y150-F156 HydrophobicContact CE2-CE1 3.53Å; Y150-F156 AromaticContact CE2-CE2 3.97Å; Y150-F156 HydrophobicContact CE2-CE2 3.97Å; Y150-F156 HydrophobicContact CE2-CG 4.2Å; Y150-F156 AromaticContact CE2-CZ 3.59Å; Y150-F156 HydrophobicContact CE2-CZ 3.59Å; Q153-F156 HydrophobicContact CB-CD1 4.03Å; Q153-F156 HydrophobicContact CB-CE1 4.18Å; G154-F156 PolarHBondContact O-N 3.08Å; G154-F156 VanDerWaalsContact O-N 3.08Å; F156-E158 PolarHBondContact O-N 3.24Å; F156-C159 PolarHBondContact O-N 3.17Å; F156-V165 HydrophobicContact CB-CG1 4.39Å; F156-V165 HydrophobicContact CB-CG2 3.89Å; F156-Y636 HydrophobicContact CD1-CE2 4.17Å; F156-V640 HydrophobicContact CB-CB 4.44Å; F156-V640 HydrophobicContact CB-CG2 3.74Å; F156-V640 HydrophobicContact CD1-CB 4.5Å; F156-V640 HydrophobicContact CD1-CG2 4.14Å; F156-V640 HydrophobicContact CD2-CB 3.54Å; F156-V640 HydrophobicContact CD2-CG1 4.21Å; F156-V640 HydrophobicContact CD2-CG2 3.8Å; F156-V640 HydrophobicContact CE2-CB 3.85Å; F156-V640 HydrophobicContact CE2-CG1 4.05Å; F156-V640 HydrophobicContact CE2-CG2 4.47Å; F156-V640 HydrophobicContact CG-CB 3.91Å; F156-V640 HydrophobicContact CG-CG2 3.62Å; F156-V640 HydrophobicContact CZ-CB 4.44Å; F156-V640 HydrophobicContact CZ-CG1 4.23Å
157	G	93.2	Very high	95.7	Very high	37 Å²	37	32.1 Å²	32.1	38%	0.381	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-68.8	-14	178.8	0	0	0	0	0	113.6	Y150 T155	Y150-G157 WeakPolarHBondContact OH-CA 3.42Å; Y150-G157 PolarHBondContact OH-N 3.37Å; Y150-G157 VanDerWaalsContact OH-N 3.08Å; T155-G157 PolarHBondContact O-N 2.73Å
158	E	92.7	Very high	95.6	Very high	51 Å²	51	34.1 Å²	34.1	24%	0.238	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-105.1	-1.6	175.8	-58.5	-174.4	-173.2	0	0	112.9	K113 W114 T115 T155 F156	K113-E158 WeakPolarHBondContact CB-OE2 3.46Å; W114-E158 WeakPolarHBondContact CB-OE1 3.43Å; W114-E158 PolarHBondContact N-OE1 2.98Å; W114-E158 PolarHBondContact N-OE2 3.2Å; T115-E158 WeakPolarHBondContact CB-OE2 3.46Å; T115-E158 HydrophobicContact CG2-CB 4.06Å; T115-E158 VanDerWaalsContact CG2-OE2 3.29Å; T115-E158 WeakPolarHBondContact CG2-OE2 3.31Å; T115-E158 PolarHBondContact N-OE2 3.44Å; T115-E158 PolarHBondContact OG1-OE2 3.42Å; T155-E158 PolarHBondContact O-N 3.03Å; F156-E158 PolarHBondContact O-N 3.24Å
159	C	94.4	Very high	95.5	Very high	19 Å²	19	34 Å²	34	13%	0.128	19%	0.194	C	C	.	.			trans	-96.9	148.3	-176.5	-60.3	0	0	0	0	111.6	F156 E164 V165	F156-C159 PolarHBondContact O-N 3.17Å; C159-E164 HydrophobicContact CB-CB 3.95Å; C159-V165 HydrophobicContact CB-CG2 3.62Å
160	S	92.3	Very high	95.3	Very high	92 Å²	92	35.4 Å²	35.4	64%	0.643	20%	0.199	S	C	*	.	S	Bend	trans	-105.4	-12.4	177.4	67.2	0	0	0	0	113.7	E164	S160-E164 PolarHBondContact N-OE2 3.46Å; S160-E164 VanDerWaalsContact OG-CD 3.28Å; S160-E164 PolarHBondContact OG-OE1 3.3Å; S160-E164 PolarHBondContact OG-OE2 2.93Å
161	S	94.9	Very high	95.2	Very high	43 Å²	43	36.7 Å²	36.7	30%	0.301	20%	0.204	S	C	.	.	S	Bend	trans	-147.2	159.1	-179.8	69.3	0	0	0	0	112.2	A163 E164 V165	S161-A163 PolarHBondContact O-N 3.33Å; S161-E164 PolarHBondContact O-N 3.44Å; S161-E164 PolarHBondContact OG-N 3.13Å; S161-V165 PolarHBondContact O-N 3.28Å
162	E	93.9	Very high	95.2	Very high	64 Å²	64	36.6 Å²	36.6	30%	0.299	20%	0.203	S	C	.	.	H	α-helix	trans	-62.1	-31	175.6	-62.2	-177.1	-158.6	0	0	112.6	V165 Q166 P637 H638 V641	E162-V165 PolarHBondContact O-N 3.19Å; E162-Q166 PolarHBondContact O-N 2.98Å; E162-P637 HydrophobicContact CB-CG 4.08Å; E162-P637 HydrophobicContact CG-CG 3.97Å; E162-H638 WeakPolarHBondContact OE1-CA 3.48Å; E162-H638 WeakPolarHBondContact OE1-CB 3.31Å; E162-H638 IonicContact OE1-CD2 3.49Å; E162-H638 PolarHBondContact OE1-CD2 3.44Å; E162-H638 IonicContact OE1-CG 3.12Å; E162-V641 HydrophobicContact CG-CG2 4.48Å
163	A	93.9	Very high	95.1	Very high	67 Å²	67	36.6 Å²	36.6	55%	0.554	20%	0.203	S	C	*	.	H	α-helix	trans	-66.4	-37.8	176.3	0	0	0	0	0	112	S161 Q166 F167	S161-A163 PolarHBondContact O-N 3.33Å; A163-Q166 PolarHBondContact O-N 2.88Å; A163-F167 PolarHBondContact O-N 2.9Å
164	E	95.1	Very high	95.1	Very high	76 Å²	76	36.6 Å²	36.6	36%	0.355	20%	0.203	S	C	.	.	H	α-helix	trans	-66.6	-40.9	173.5	-74.6	176.9	178.8	0	0	111.5	C159 S160 S161 Q166 F167 W168	C159-E164 HydrophobicContact CB-CB 3.95Å; S160-E164 PolarHBondContact N-OE2 3.46Å; S160-E164 VanDerWaalsContact OG-CD 3.28Å; S160-E164 PolarHBondContact OG-OE1 3.3Å; S160-E164 PolarHBondContact OG-OE2 2.93Å; S161-E164 PolarHBondContact O-N 3.44Å; S161-E164 PolarHBondContact OG-N 3.13Å; E164-Q166 VanDerWaalsContact C-N 3.32Å; E164-Q166 PolarHBondContact O-N 3.46Å; E164-F167 PolarHBondContact O-N 2.88Å; E164-W168 PolarHBondContact O-N 3.02Å
165	V	95.8	Very high	95.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-44.6	173.5	178.4	0	0	0	0	110.6	F156 C159 S161 E162 F167 W168 M169 P637 V641	F156-V165 HydrophobicContact CB-CG1 4.39Å; F156-V165 HydrophobicContact CB-CG2 3.89Å; C159-V165 HydrophobicContact CB-CG2 3.62Å; S161-V165 PolarHBondContact O-N 3.28Å; E162-V165 PolarHBondContact O-N 3.19Å; V165-F167 PolarHBondContact O-N 3.13Å; V165-W168 PolarHBondContact O-N 3.29Å; V165-M169 WeakPolarHBondContact O-CB 3.15Å; V165-M169 PolarHBondContact O-N 3.49Å; V165-P637 HydrophobicContact CB-CB 4.44Å; V165-P637 HydrophobicContact CG1-CB 4.02Å; V165-V641 HydrophobicContact CG2-CG2 3.62Å
166	Q	94.3	Very high	95.3	Very high	82 Å²	82	36.9 Å²	36.9	38%	0.383	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-43.9	177.3	-173.6	175.8	17.1	0	0	112.1	W78 E162 A163 E164 R170	W78-Q166 HydrophobicContact CD2-CG 4Å; W78-Q166 HydrophobicContact CE3-CB 4.43Å; W78-Q166 HydrophobicContact CE3-CG 4.22Å; W78-Q166 HydrophobicContact CH2-CB 3.5Å; W78-Q166 HydrophobicContact CH2-CG 3.92Å; W78-Q166 HydrophobicContact CZ2-CB 3.66Å; W78-Q166 HydrophobicContact CZ2-CG 3.63Å; W78-Q166 HydrophobicContact CZ3-CB 3.92Å; W78-Q166 HydrophobicContact CZ3-CG 4.19Å; E162-Q166 PolarHBondContact O-N 2.98Å; A163-Q166 PolarHBondContact O-N 2.88Å; E164-Q166 VanDerWaalsContact C-N 3.32Å; E164-Q166 PolarHBondContact O-N 3.46Å; Q166-R170 WeakPolarHBondContact O-CB 3.48Å; Q166-R170 PolarHBondContact O-N 2.83Å
167	F	94.1	Very high	95.3	Very high	128 Å²	128	37.5 Å²	37.5	56%	0.561	21%	0.208	S	C	*	.	H	α-helix	trans	-61.5	-52.6	177.9	174.5	-94.1	0	0	0	111.7	A163 E164 V165 R170 Y171	A163-F167 PolarHBondContact O-N 2.9Å; E164-F167 PolarHBondContact O-N 2.88Å; V165-F167 PolarHBondContact O-N 3.13Å; F167-R170 PolarHBondContact O-N 3.28Å; F167-Y171 PolarHBondContact O-N 3.39Å
168	W	96.1	Very high	95.4	Very high	42 Å²	42	40 Å²	40	16%	0.159	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-37.1	-179	-79.8	111.6	0	0	0	112.4	T115 G154 E164 V165 R170 Y171 N172	T115-W168 HydrophobicContact CG2-CD2 4.07Å; T115-W168 HydrophobicContact CG2-CH2 4.25Å; T115-W168 HydrophobicContact CG2-CZ2 3.51Å; G154-W168 WeakPolarHBondContact O-CB 3.35Å; E164-W168 PolarHBondContact O-N 3.02Å; V165-W168 PolarHBondContact O-N 3.29Å; W168-R170 VanDerWaalsContact C-N 3.32Å; W168-R170 PolarHBondContact O-N 2.96Å; W168-Y171 AromaticContact CE3-CD1 3.83Å; W168-Y171 HydrophobicContact CE3-CD1 3.83Å; W168-Y171 HydrophobicContact CE3-CE1 4.49Å; W168-Y171 HydrophobicContact CE3-CG 4.46Å; W168-Y171 AromaticContact CZ3-CD1 3.72Å; W168-Y171 HydrophobicContact CZ3-CD1 3.72Å; W168-Y171 AromaticContact CZ3-CE1 3.95Å; W168-Y171 HydrophobicContact CZ3-CE1 3.95Å; W168-Y171 HydrophobicContact CZ3-CG 4.46Å; W168-Y171 PolarHBondContact O-N 2.98Å; W168-N172 WeakPolarHBondContact O-CB 3.15Å; W168-N172 PolarHBondContact O-N 3.31Å; W168-N172 PolarHBondContact O-ND2 3.16Å; W168-N172 PolarHBondContact O-OD1 3.23Å
169	M	96.2	Very high	95.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55.8	-50.5	171.3	173.2	174.9	-61.7	0	0	110.2	W78 L82 A152 G154 V165 Y171 N172 I173 L225 Y636	W78-M169 HydrophobicContact CZ2-CE 4.26Å; W78-M169 HydrophobicContact CZ2-SD 3.74Å; L82-M169 HydrophobicContact CD1-CE 3.83Å; L82-M169 HydrophobicContact CD1-SD 3.77Å; L82-M169 HydrophobicContact CD2-SD 4.5Å; A152-M169 WeakPolarHBondContact O-CG 3.44Å; G154-M169 VanDerWaalsContact CA-N 3.32Å; V165-M169 WeakPolarHBondContact O-CB 3.15Å; V165-M169 PolarHBondContact O-N 3.49Å; M169-Y171 PolarHBondContact O-N 3.37Å; M169-N172 PolarHBondContact O-N 2.94Å; M169-I173 HydrophobicContact CG-CG1 4.26Å; M169-I173 WeakPolarHBondContact O-CB 3.36Å; M169-I173 WeakPolarHBondContact O-CG1 3.47Å; M169-I173 PolarHBondContact O-N 3.42Å; M169-L225 HydrophobicContact CE-CD2 4.12Å; M169-L225 HydrophobicContact SD-CD2 4.16Å; M169-Y636 HydrophobicContact CE-CE1 3.92Å; M169-Y636 WeakPolarHBondContact CE-OH 3.33Å
170	R	95.1	Very high	95.6	Very high	31 Å²	31	38.9 Å²	38.9	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-49.7	179.6	-170.6	174.4	-165.3	76.8	-9.1	112	Q166 F167 W168 I173 F174 T229 Q232 D237 W241	Q166-R170 WeakPolarHBondContact O-CB 3.48Å; Q166-R170 PolarHBondContact O-N 2.83Å; F167-R170 PolarHBondContact O-N 3.28Å; W168-R170 VanDerWaalsContact C-N 3.32Å; W168-R170 PolarHBondContact O-N 2.96Å; R170-I173 PolarHBondContact O-N 2.83Å; R170-F174 HydrophobicContact CG-CD2 4.13Å; R170-F174 HydrophobicContact CG-CE2 4.01Å; R170-F174 VanDerWaalsContact O-CD2 3.3Å; R170-F174 WeakPolarHBondContact O-CD2 3.46Å; R170-F174 PolarHBondContact O-N 3.43Å; R170-T229 HydrophobicContact CB-CG2 4.22Å; R170-T229 HydrophobicContact CG-CG2 4.11Å; R170-T229 PolarHBondContact NH1-O 2.86Å; R170-T229 VanDerWaalsContact NH1-O 3.09Å; R170-Q232 PolarHBondContact NH1-O 3.26Å; R170-Q232 PolarHBondContact NH2-O 2.98Å; R170-D237 IonicContact CZ-OD1 2.77Å; R170-D237 VanDerWaalsContact CZ-OD1 3.28Å; R170-D237 IonicContact CZ-OD2 3.76Å; R170-D237 IonicContact NE-OD1 3.4Å; R170-D237 PolarHBondContact NE-OD1 2.86Å; R170-D237 IonicContact NE-OD2 2.63Å; R170-D237 IonicContact NH2-OD1 2.74Å; R170-D237 PolarHBondContact NH2-OD1 2.93Å; R170-D237 IonicContact NH2-OD2 3.66Å; R170-D237 PolarHBondContact NH2-OD2 3.44Å; R170-W241 HydrophobicContact CG-CZ3 4.1Å
171	Y	96.1	Very high	95.8	Very high	30 Å²	30	34.5 Å²	34.5	12%	0.118	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-49.5	177.9	174.2	-96.1	0	0	0	112.1	H122 F167 W168 M169 I173 F174 L175 W241	H122-Y171 AromaticContact ND1-CE1 3.85Å; H122-Y171 AromaticContact ND1-CZ 3.88Å; H122-Y171 PolarHBondContact ND1-OH 3.02Å; H122-Y171 VanDerWaalsContact ND1-OH 3.08Å; F167-Y171 PolarHBondContact O-N 3.39Å; W168-Y171 AromaticContact CE3-CD1 3.83Å; W168-Y171 HydrophobicContact CE3-CD1 3.83Å; W168-Y171 HydrophobicContact CE3-CE1 4.49Å; W168-Y171 HydrophobicContact CE3-CG 4.46Å; W168-Y171 AromaticContact CZ3-CD1 3.72Å; W168-Y171 HydrophobicContact CZ3-CD1 3.72Å; W168-Y171 AromaticContact CZ3-CE1 3.95Å; W168-Y171 HydrophobicContact CZ3-CE1 3.95Å; W168-Y171 HydrophobicContact CZ3-CG 4.46Å; W168-Y171 PolarHBondContact O-N 2.98Å; M169-Y171 PolarHBondContact O-N 3.37Å; Y171-I173 VanDerWaalsContact C-N 3.33Å; Y171-I173 PolarHBondContact O-N 3.34Å; Y171-F174 PolarHBondContact O-N 2.74Å; Y171-L175 PolarHBondContact O-N 2.95Å; Y171-W241 HydrophobicContact CD2-CH2 4.3Å; Y171-W241 AromaticContact CD2-CZ2 4Å; Y171-W241 HydrophobicContact CD2-CZ2 4Å
172	N	97.4	Very high	95.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-37.5	-178.3	-69.8	-12.7	0	0	0	111.9	W114 V151 W168 M169 L175 L176	W114-N172 PolarHBondContact NE1-OD1 3.35Å; V151-N172 HydrophobicContact CG1-CB 3.8Å; V151-N172 VanDerWaalsContact O-CB 3.3Å; V151-N172 WeakPolarHBondContact O-CB 3.41Å; V151-N172 PolarHBondContact O-ND2 2.96Å; W168-N172 WeakPolarHBondContact O-CB 3.15Å; W168-N172 PolarHBondContact O-N 3.31Å; W168-N172 PolarHBondContact O-ND2 3.16Å; W168-N172 PolarHBondContact O-OD1 3.23Å; M169-N172 PolarHBondContact O-N 2.94Å; N172-L175 WeakPolarHBondContact O-CB 3.1Å; N172-L175 PolarHBondContact O-N 2.99Å; N172-L176 WeakPolarHBondContact O-CB 3.45Å; N172-L176 VanDerWaalsContact O-CG 3.25Å; N172-L176 WeakPolarHBondContact O-CG 3.37Å; N172-L176 PolarHBondContact O-N 3.48Å
173	I	97.6	Very high	95.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-44.7	176.8	-70.9	-63.9	0	0	0	111.6	A152 M169 R170 Y171 L175 L176 L177 L225 I226 T229 V230	A152-I173 HydrophobicContact CB-CD1 3.85Å; M169-I173 HydrophobicContact CG-CG1 4.26Å; M169-I173 WeakPolarHBondContact O-CB 3.36Å; M169-I173 WeakPolarHBondContact O-CG1 3.47Å; M169-I173 PolarHBondContact O-N 3.42Å; R170-I173 PolarHBondContact O-N 2.83Å; Y171-I173 VanDerWaalsContact C-N 3.33Å; Y171-I173 PolarHBondContact O-N 3.34Å; I173-L175 VanDerWaalsContact C-N 3.31Å; I173-L175 PolarHBondContact O-N 2.55Å; I173-L176 PolarHBondContact O-N 2.88Å; I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 PolarHBondContact O-N 3.4Å; I173-L225 HydrophobicContact CD1-CB 3.94Å; I173-I226 HydrophobicContact CD1-CG1 3.73Å; I173-I226 HydrophobicContact CG2-CB 4.36Å; I173-I226 HydrophobicContact CG2-CG1 4.24Å; I173-I226 HydrophobicContact CG2-CG2 4.43Å; I173-T229 HydrophobicContact CB-CG2 4.15Å; I173-T229 HydrophobicContact CG1-CG2 4.28Å; I173-T229 HydrophobicContact CG2-CG2 4.17Å; I173-V230 HydrophobicContact CG2-CG2 3.81Å
174	F	97.1	Very high	95.9	Very high	1 Å²	1	31 Å²	31	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-36.9	175.9	-81.5	-73.4	0	0	0	111.9	R170 Y171 L177 E178 V230 W241 M244	R170-F174 HydrophobicContact CG-CD2 4.13Å; R170-F174 HydrophobicContact CG-CE2 4.01Å; R170-F174 VanDerWaalsContact O-CD2 3.3Å; R170-F174 WeakPolarHBondContact O-CD2 3.46Å; R170-F174 PolarHBondContact O-N 3.43Å; Y171-F174 PolarHBondContact O-N 2.74Å; F174-L177 PolarHBondContact O-N 3.31Å; F174-E178 WeakPolarHBondContact O-CB 3.32Å; F174-E178 PolarHBondContact O-N 3.42Å; F174-V230 HydrophobicContact CE1-CG2 4.45Å; F174-W241 HydrophobicContact CB-CD2 4.19Å; F174-W241 HydrophobicContact CB-CG 4.34Å; F174-W241 HydrophobicContact CB-CZ2 4.12Å; F174-W241 HydrophobicContact CD1-CB 3.93Å; F174-W241 AromaticContact CD1-CD1 3.83Å; F174-W241 HydrophobicContact CD1-CD2 4.21Å; F174-W241 AromaticContact CD1-CG 3.74Å; F174-W241 HydrophobicContact CD1-CG 3.74Å; F174-W241 HydrophobicContact CD2-CB 4.44Å; F174-W241 AromaticContact CD2-CD2 3.52Å; F174-W241 HydrophobicContact CD2-CD2 3.52Å; F174-W241 AromaticContact CD2-CE2 3.86Å; F174-W241 AromaticContact CD2-CE3 3.58Å; F174-W241 HydrophobicContact CD2-CE3 3.58Å; F174-W241 AromaticContact CD2-CG 3.94Å; F174-W241 HydrophobicContact CD2-CG 3.94Å; F174-W241 HydrophobicContact CD2-CH2 4.3Å; F174-W241 HydrophobicContact CD2-CZ2 4.24Å; F174-W241 AromaticContact CD2-CZ3 3.99Å; F174-W241 HydrophobicContact CD2-CZ3 3.99Å; F174-W241 HydrophobicContact CE1-CB 3.65Å; F174-W241 AromaticContact CE1-CG 3.98Å; F174-W241 HydrophobicContact CE1-CG 3.98Å; F174-W241 WeakPolarHBondContact CE1-O 3.21Å; F174-W241 HydrophobicContact CE2-CB 4.21Å; F174-W241 AromaticContact CE2-CD2 3.91Å; F174-W241 HydrophobicContact CE2-CD2 3.91Å; F174-W241 AromaticContact CE2-CE3 3.7Å; F174-W241 HydrophobicContact CE2-CE3 3.7Å; F174-W241 HydrophobicContact CE2-CG 4.17Å; F174-W241 HydrophobicContact CE2-CZ3 4.32Å; F174-W241 HydrophobicContact CG-CB 4.33Å; F174-W241 AromaticContact CG-CD1 3.82Å; F174-W241 AromaticContact CG-CD2 3.71Å; F174-W241 HydrophobicContact CG-CD2 3.71Å; F174-W241 AromaticContact CG-CE2 3.8Å; F174-W241 HydrophobicContact CG-CE3 4.26Å; F174-W241 AromaticContact CG-CG 3.74Å; F174-W241 HydrophobicContact CG-CG 3.74Å; F174-W241 HydrophobicContact CG-CZ2 4.42Å; F174-W241 AromaticContact CG-NE1 3.86Å; F174-W241 HydrophobicContact CZ-CB 3.82Å; F174-W241 HydrophobicContact CZ-CD2 4.41Å; F174-W241 HydrophobicContact CZ-CE3 4.44Å; F174-W241 HydrophobicContact CZ-CG 4.19Å; F174-M244 HydrophobicContact CD1-CE 4.33Å; F174-M244 HydrophobicContact CD1-SD 4.39Å; F174-M244 WeakPolarHBondContact O-CE 3.43Å
175	L	97.4	Very high	95.9	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-47.3	173.1	178.4	69.7	0	0	0	112.3	W114 H122 R123 A126 Y171 N172 I173 L177 E178 V179	W114-L175 HydrophobicContact CH2-CD2 4.16Å; W114-L175 HydrophobicContact CZ2-CD2 3.97Å; H122-L175 HydrophobicContact CB-CD2 3.79Å; R123-L175 HydrophobicContact CB-CD1 4.23Å; A126-L175 HydrophobicContact CB-CD2 4.08Å; A126-L175 HydrophobicContact CB-CG 4.14Å; Y171-L175 PolarHBondContact O-N 2.95Å; N172-L175 WeakPolarHBondContact O-CB 3.1Å; N172-L175 PolarHBondContact O-N 2.99Å; I173-L175 VanDerWaalsContact C-N 3.31Å; I173-L175 PolarHBondContact O-N 2.55Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.22Å; L175-E178 WeakPolarHBondContact O-CB 3.47Å; L175-E178 PolarHBondContact O-N 3.16Å; L175-V179 PolarHBondContact O-N 3.02Å; L175-V179 VanDerWaalsContact O-N 3.11Å
176	L	97.8	Very high	95.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-38	178	-71.4	173.2	0	0	0	111.6	I148 V151 A152 N172 I173 V179 G180 T181	I148-L176 HydrophobicContact CG2-CD1 4.11Å; I148-L176 HydrophobicContact CG2-CD2 4.07Å; V151-L176 HydrophobicContact CG1-CD1 4.38Å; A152-L176 HydrophobicContact CB-CD1 4.01Å; N172-L176 WeakPolarHBondContact O-CB 3.45Å; N172-L176 VanDerWaalsContact O-CG 3.25Å; N172-L176 WeakPolarHBondContact O-CG 3.37Å; N172-L176 PolarHBondContact O-N 3.48Å; I173-L176 PolarHBondContact O-N 2.88Å; L176-V179 VanDerWaalsContact O-CG2 3.31Å; L176-V179 WeakPolarHBondContact O-CG2 3.49Å; L176-G180 PolarHBondContact O-N 3Å; L176-T181 HydrophobicContact CD2-CG2 4.38Å; L176-T181 WeakPolarHBondContact O-CB 3.2Å; L176-T181 PolarHBondContact O-N 3.29Å; L176-T181 PolarHBondContact O-OG1 3.18Å
177	L	96.1	Very high	95.8	Very high	20 Å²	20	29.2 Å²	29.2	11%	0.105	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-42.3	174.7	-175.2	61.5	0	0	0	111.4	I173 F174 L175 V179 G180 F182 V230 M244 F248	I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 PolarHBondContact O-N 3.4Å; F174-L177 PolarHBondContact O-N 3.31Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.22Å; L177-V179 VanDerWaalsContact C-N 3.34Å; L177-V179 PolarHBondContact O-N 3.48Å; L177-G180 PolarHBondContact O-N 3.19Å; L177-G180 VanDerWaalsContact O-N 3.12Å; L177-F182 HydrophobicContact CD1-CB 4.37Å; L177-V230 HydrophobicContact CD2-CG2 4.1Å; L177-M244 HydrophobicContact CB-CE 3.95Å; L177-M244 HydrophobicContact CD2-CE 3.96Å; L177-M244 HydrophobicContact CG-CE 3.85Å; L177-F248 HydrophobicContact CD1-CD2 3.54Å; L177-F248 HydrophobicContact CD1-CE2 3.93Å; L177-F248 HydrophobicContact CD1-CG 4.15Å; L177-F248 HydrophobicContact CD2-CB 4.02Å; L177-F248 HydrophobicContact CD2-CD2 4.35Å; L177-F248 HydrophobicContact CD2-CG 4.12Å
178	E	95.5	Very high	95.8	Very high	90 Å²	90	24.1 Å²	24.1	42%	0.421	13%	0.125	S	C	.	.	H	α-helix	trans	-61.6	-38.8	179	-172.6	-176.8	-180	0	0	112.9	R123 F174 L175 G180 M244	R123-E178 IonicContact CZ-OE1 3.86Å; R123-E178 IonicContact NH1-OE1 3.63Å; R123-E178 PolarHBondContact NH1-OE1 2.93Å; R123-E178 IonicContact NH2-OE1 3.66Å; F174-E178 WeakPolarHBondContact O-CB 3.32Å; F174-E178 PolarHBondContact O-N 3.42Å; L175-E178 WeakPolarHBondContact O-CB 3.47Å; L175-E178 PolarHBondContact O-N 3.16Å; E178-G180 PolarHBondContact O-N 3.27Å; E178-M244 HydrophobicContact CB-CE 3.87Å
179	V	96.1	Very high	95.8	Very high	18 Å²	18	22.1 Å²	22.1	11%	0.109	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-5.7	178.2	-58.1	0	0	0	0	113.3	R123 A126 M127 L130 L175 L176 L177 T181	R123-V179 HydrophobicContact CG-CG1 4.16Å; A126-V179 HydrophobicContact CB-CG1 4.07Å; A126-V179 HydrophobicContact CB-CG2 4.21Å; M127-V179 HydrophobicContact CE-CG1 4.34Å; M127-V179 HydrophobicContact CG-CB 4.25Å; M127-V179 HydrophobicContact CG-CG1 3.89Å; L130-V179 HydrophobicContact CD2-CG2 4.46Å; L130-V179 WeakPolarHBondContact CD2-O 3.14Å; L175-V179 PolarHBondContact O-N 3.02Å; L175-V179 VanDerWaalsContact O-N 3.11Å; L176-V179 VanDerWaalsContact O-CG2 3.31Å; L176-V179 WeakPolarHBondContact O-CG2 3.49Å; L177-V179 VanDerWaalsContact C-N 3.34Å; L177-V179 PolarHBondContact O-N 3.48Å; V179-T181 WeakPolarHBondContact CG2-OG1 3.19Å
180	G	94.9	Very high	95.7	Very high	27 Å²	27	23.1 Å²	23.1	28%	0.278	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	19.5	178.2	0	0	0	0	0	115.1	L176 L177 E178 F182 N183	L176-G180 PolarHBondContact O-N 3Å; L177-G180 PolarHBondContact O-N 3.19Å; L177-G180 VanDerWaalsContact O-N 3.12Å; E178-G180 PolarHBondContact O-N 3.27Å; G180-F182 VanDerWaalsContact C-N 3.25Å; G180-F182 PolarHBondContact O-N 2.84Å; G180-N183 PolarHBondContact O-N 2.77Å
181	T	96.6	Very high	95.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-34.9	-177.7	-57.3	0	0	0	0	113	I148 L176 V179 N183 A184 L185	I148-T181 HydrophobicContact CG2-CG2 4.16Å; L176-T181 HydrophobicContact CD2-CG2 4.38Å; L176-T181 WeakPolarHBondContact O-CB 3.2Å; L176-T181 PolarHBondContact O-N 3.29Å; L176-T181 PolarHBondContact O-OG1 3.18Å; V179-T181 WeakPolarHBondContact CG2-OG1 3.19Å; T181-N183 PolarHBondContact O-N 2.82Å; T181-A184 PolarHBondContact O-N 2.79Å; T181-L185 HydrophobicContact CG2-CD1 3.88Å; T181-L185 HydrophobicContact CG2-CG 4.09Å; T181-L185 VanDerWaalsContact O-CG 3.27Å; T181-L185 WeakPolarHBondContact O-CG 3.24Å; T181-L185 PolarHBondContact O-N 3.35Å
182	F	95.9	Very high	95.3	Very high	5 Å²	5	24.6 Å²	24.6	2%	0.022	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-42.3	-177	-170.1	-94.2	0	0	0	113	L177 G180 L185 V186 M223 I226 V227 F248 L252 L256 F262	L177-F182 HydrophobicContact CD1-CB 4.37Å; G180-F182 VanDerWaalsContact C-N 3.25Å; G180-F182 PolarHBondContact O-N 2.84Å; F182-L185 WeakPolarHBondContact O-CB 3.41Å; F182-L185 PolarHBondContact O-N 2.68Å; F182-V186 HydrophobicContact CD1-CG2 3.98Å; F182-V186 HydrophobicContact CE1-CG2 3.64Å; F182-V186 HydrophobicContact CZ-CG2 4.24Å; F182-V186 WeakPolarHBondContact O-CG2 3.03Å; F182-V186 PolarHBondContact O-N 2.96Å; F182-M223 HydrophobicContact CD2-CE 4.27Å; F182-M223 HydrophobicContact CE1-CE 4.26Å; F182-M223 HydrophobicContact CE2-CB 4.24Å; F182-M223 HydrophobicContact CE2-CE 3.69Å; F182-M223 HydrophobicContact CE2-CG 4.26Å; F182-M223 HydrophobicContact CZ-CE 3.68Å; F182-I226 HydrophobicContact CD2-CB 4.45Å; F182-I226 HydrophobicContact CD2-CD1 4.13Å; F182-I226 HydrophobicContact CD2-CG2 4.05Å; F182-V227 HydrophobicContact CE2-CG2 4.17Å; F182-F248 HydrophobicContact CB-CE2 4.28Å; F182-F248 AromaticContact CD1-CE2 3.77Å; F182-F248 HydrophobicContact CD1-CE2 3.77Å; F182-F248 HydrophobicContact CD1-CZ 4.49Å; F182-F248 AromaticContact CD2-CE2 3.89Å; F182-F248 HydrophobicContact CD2-CE2 3.89Å; F182-F248 AromaticContact CD2-CZ 3.97Å; F182-F248 HydrophobicContact CD2-CZ 3.97Å; F182-F248 HydrophobicContact CE1-CE2 4.03Å; F182-F248 HydrophobicContact CE1-CZ 4.44Å; F182-F248 HydrophobicContact CE2-CE2 4.15Å; F182-F248 AromaticContact CE2-CZ 3.92Å; F182-F248 HydrophobicContact CE2-CZ 3.92Å; F182-F248 AromaticContact CG-CE2 3.7Å; F182-F248 HydrophobicContact CG-CE2 3.7Å; F182-F248 HydrophobicContact CG-CZ 4.26Å; F182-F248 HydrophobicContact CZ-CE2 4.22Å; F182-F248 HydrophobicContact CZ-CZ 4.18Å; F182-L252 HydrophobicContact CE1-CD2 3.58Å; F182-L252 HydrophobicContact CE2-CD2 4.44Å; F182-L252 HydrophobicContact CZ-CD2 3.46Å; F182-L252 VanDerWaalsContact CZ-CD2 3.46Å; F182-L256 HydrophobicContact CE1-CD1 4.26Å; F182-F262 HydrophobicContact CZ-CD1 4.16Å; F182-F262 HydrophobicContact CZ-CE1 4.09Å; F182-F262 HydrophobicContact CZ-CE2 4.47Å; F182-F262 HydrophobicContact CZ-CG 4.41Å; F182-F262 HydrophobicContact CZ-CZ 4.28Å
183	N	93.6	Very high	95.2	Very high	73 Å²	73	25.3 Å²	25.3	39%	0.39	14%	0.137	S	C	.	.	H	α-helix	trans	-65.1	-44	179.6	-68.8	-33.2	0	0	0	111.4	G180 T181 L185 V186 E187	G180-N183 PolarHBondContact O-N 2.77Å; T181-N183 PolarHBondContact O-N 2.82Å; N183-L185 VanDerWaalsContact C-N 3.28Å; N183-L185 PolarHBondContact O-N 3.45Å; N183-V186 WeakPolarHBondContact O-CB 3.49Å; N183-V186 PolarHBondContact O-N 3.09Å; N183-V186 VanDerWaalsContact O-N 3.11Å; N183-E187 PolarHBondContact O-N 3.24Å; N183-E187 VanDerWaalsContact O-N 3.14Å
184	A	94.5	Very high	94.8	Very high	23 Å²	23	29.8 Å²	29.8	19%	0.19	16%	0.16	C	C	.	.	H	α-helix	trans	-59.6	-38.7	173.8	0	0	0	0	0	112.2	L130 T181 E187 L188	L130-A184 HydrophobicContact CD1-CB 3.54Å; T181-A184 PolarHBondContact O-N 2.79Å; A184-E187 PolarHBondContact O-N 3.04Å; A184-L188 WeakPolarHBondContact O-CB 3.49Å; A184-L188 WeakPolarHBondContact O-CG 3.47Å; A184-L188 PolarHBondContact O-N 2.93Å
185	L	96.2	Very high	94.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.5	-36.3	175.4	-67.8	171.2	0	0	0	112.6	T181 F182 N183 L189 L219 I222 M223 I226	T181-L185 HydrophobicContact CG2-CD1 3.88Å; T181-L185 HydrophobicContact CG2-CG 4.09Å; T181-L185 VanDerWaalsContact O-CG 3.27Å; T181-L185 WeakPolarHBondContact O-CG 3.24Å; T181-L185 PolarHBondContact O-N 3.35Å; F182-L185 WeakPolarHBondContact O-CB 3.41Å; F182-L185 PolarHBondContact O-N 2.68Å; N183-L185 VanDerWaalsContact C-N 3.28Å; N183-L185 PolarHBondContact O-N 3.45Å; L185-L189 WeakPolarHBondContact O-CB 3.34Å; L185-L189 PolarHBondContact O-N 3.5Å; L185-L219 HydrophobicContact CD2-CD2 3.41Å; L185-L219 VanDerWaalsContact CD2-CD2 3.41Å; L185-I222 HydrophobicContact CD1-CB 3.92Å; L185-I222 HydrophobicContact CD1-CG2 3.48Å; L185-I222 VanDerWaalsContact CD1-CG2 3.48Å; L185-I222 HydrophobicContact CD2-CD1 4.08Å; L185-M223 HydrophobicContact CB-CE 4.15Å; L185-M223 HydrophobicContact CB-CG 3.95Å; L185-M223 HydrophobicContact CB-SD 4.12Å; L185-M223 HydrophobicContact CD1-CG 3.89Å; L185-I226 HydrophobicContact CD1-CD1 4.13Å
186	V	95.3	Very high	93.8	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.03	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-46.5	175.3	170.7	0	0	0	0	110.5	F182 N183 L189 N190 M223 Y257 F262 M265	F182-V186 HydrophobicContact CD1-CG2 3.98Å; F182-V186 HydrophobicContact CE1-CG2 3.64Å; F182-V186 HydrophobicContact CZ-CG2 4.24Å; F182-V186 WeakPolarHBondContact O-CG2 3.03Å; F182-V186 PolarHBondContact O-N 2.96Å; N183-V186 WeakPolarHBondContact O-CB 3.49Å; N183-V186 PolarHBondContact O-N 3.09Å; N183-V186 VanDerWaalsContact O-N 3.11Å; V186-L189 PolarHBondContact O-N 3.27Å; V186-N190 PolarHBondContact O-N 2.84Å; V186-M223 HydrophobicContact CB-CE 4.41Å; V186-M223 HydrophobicContact CG2-CE 3.51Å; V186-Y257 HydrophobicContact CG1-CG 4.3Å; V186-F262 HydrophobicContact CG2-CD2 4.07Å; V186-F262 HydrophobicContact CG2-CE2 4.13Å; V186-M265 HydrophobicContact CG1-CE 4.16Å
187	E	92.8	Very high	93.1	Very high	116 Å²	116	38.6 Å²	38.6	54%	0.542	22%	0.223	S	C	.	.	H	α-helix	trans	-63.5	-45.9	178.4	-65.8	-179	-174.4	0	0	112	N183 A184 N190 M191 Y257	N183-E187 PolarHBondContact O-N 3.24Å; N183-E187 VanDerWaalsContact O-N 3.14Å; A184-E187 PolarHBondContact O-N 3.04Å; E187-N190 PolarHBondContact O-N 2.74Å; E187-M191 PolarHBondContact O-N 2.97Å; E187-Y257 HydrophobicContact CG-CD2 4.14Å; E187-Y257 HydrophobicContact CG-CE2 3.95Å
188	L	94.4	Very high	92.5	Very high	21 Å²	21	38.7 Å²	38.7	11%	0.11	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-40	176.8	-72.3	179.9	0	0	0	112.6	L133 A184 N190 M191 E192 L219	L133-L188 HydrophobicContact CB-CD1 4.1Å; L133-L188 HydrophobicContact CD1-CD1 4.14Å; L133-L188 HydrophobicContact CD2-CD1 4.01Å; L133-L188 HydrophobicContact CG-CD1 4.33Å; A184-L188 WeakPolarHBondContact O-CB 3.49Å; A184-L188 WeakPolarHBondContact O-CG 3.47Å; A184-L188 PolarHBondContact O-N 2.93Å; L188-N190 VanDerWaalsContact C-N 3.33Å; L188-M191 HydrophobicContact CD2-CE 4.12Å; L188-M191 PolarHBondContact O-N 3.48Å; L188-E192 PolarHBondContact O-N 3.45Å; L188-L219 HydrophobicContact CB-CD1 4.09Å; L188-L219 HydrophobicContact CB-CD2 4.22Å; L188-L219 HydrophobicContact CD1-CD2 4.24Å
189	L	95.6	Very high	91.9	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176.1	177.9	61.2	0	0	0	110.2	L185 V186 M191 E192 I193 L216 L219 L220 M223 F262 M265 M269	L185-L189 WeakPolarHBondContact O-CB 3.34Å; L185-L189 PolarHBondContact O-N 3.5Å; V186-L189 PolarHBondContact O-N 3.27Å; L189-M191 PolarHBondContact O-N 3.37Å; L189-E192 PolarHBondContact O-N 3.19Å; L189-I193 HydrophobicContact CD1-CD1 4.15Å; L189-I193 HydrophobicContact CD1-CG1 4.26Å; L189-I193 HydrophobicContact CD2-CD1 4.49Å; L189-I193 HydrophobicContact CG-CD1 3.82Å; L189-I193 HydrophobicContact CG-CG1 4.39Å; L189-I193 WeakPolarHBondContact O-CB 3.38Å; L189-I193 WeakPolarHBondContact O-CG1 3.43Å; L189-I193 PolarHBondContact O-N 3.32Å; L189-L216 HydrophobicContact CD1-CD2 3.73Å; L189-L219 HydrophobicContact CB-CD1 4.49Å; L189-L220 HydrophobicContact CD1-CD2 4.15Å; L189-L220 HydrophobicContact CD1-CG 4.35Å; L189-L220 HydrophobicContact CD2-CD2 4.04Å; L189-M223 HydrophobicContact CB-SD 4.47Å; L189-M223 HydrophobicContact CD2-CE 4.44Å; L189-M223 HydrophobicContact CD2-SD 3.75Å; L189-F262 HydrophobicContact CD2-CE2 4.17Å; L189-F262 HydrophobicContact CD2-CZ 4.42Å; L189-M265 HydrophobicContact CD2-CE 3.75Å; L189-M265 HydrophobicContact CG-CE 4.32Å; L189-M269 HydrophobicContact CD1-CE 4.27Å; L189-M269 HydrophobicContact CD1-SD 4.36Å
190	N	93.1	Very high	91.3	Very high	20 Å²	20	37.7 Å²	37.7	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177.5	-168.6	60.2	0	0	0	112	V186 E187 L188 E192 I193 D194 Y257 M265	V186-N190 PolarHBondContact O-N 2.84Å; E187-N190 PolarHBondContact O-N 2.74Å; L188-N190 VanDerWaalsContact C-N 3.33Å; N190-E192 VanDerWaalsContact C-N 3.34Å; N190-E192 PolarHBondContact O-N 3.34Å; N190-I193 WeakPolarHBondContact O-CB 3.2Å; N190-I193 PolarHBondContact O-N 3.19Å; N190-D194 PolarHBondContact O-N 3.05Å; N190-D194 VanDerWaalsContact O-N 3.16Å; N190-Y257 HydrophobicContact CB-CD1 4.31Å; N190-Y257 HydrophobicContact CB-CE1 3.97Å; N190-Y257 WeakPolarHBondContact ND2-CE1 3.13Å; N190-M265 HydrophobicContact CB-SD 4.13Å
191	M	92	Very high	90.8	Very high	79 Å²	79	39.1 Å²	39.1	39%	0.389	24%	0.236	S	C	.	.	H	α-helix	trans	-59	-42.5	174	179.9	-159.3	70.6	0	0	112.1	R141 E187 L188 L189 D194 N195	R141-M191 VanDerWaalsContact CZ-CE 3.47Å; R141-M191 VanDerWaalsContact NH2-CE 3.26Å; E187-M191 PolarHBondContact O-N 2.97Å; L188-M191 HydrophobicContact CD2-CE 4.12Å; L188-M191 PolarHBondContact O-N 3.48Å; L189-M191 PolarHBondContact O-N 3.37Å; M191-D194 PolarHBondContact O-N 3.4Å; M191-N195 PolarHBondContact O-N 2.89Å
192	E	92.8	Very high	90.1	Very high	13 Å²	13	39.2 Å²	39.2	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-74.1	-28.8	177	-72.9	-57.8	160.8	0	0	113.4	L188 L189 N190 D194 N195 D215 L216 L219	L188-E192 PolarHBondContact O-N 3.45Å; L189-E192 PolarHBondContact O-N 3.19Å; N190-E192 VanDerWaalsContact C-N 3.34Å; N190-E192 PolarHBondContact O-N 3.34Å; E192-D194 PolarHBondContact O-N 3.48Å; E192-N195 VanDerWaalsContact O-CB 3.3Å; E192-N195 WeakPolarHBondContact O-CB 3.31Å; E192-N195 PolarHBondContact O-N 2.97Å; E192-N195 PolarHBondContact OE2-ND2 2.71Å; E192-D215 HydrophobicContact CG-CB 4.3Å; E192-L216 HydrophobicContact CB-CD2 3.69Å; E192-L216 HydrophobicContact CB-CG 4.31Å; E192-L219 HydrophobicContact CG-CD1 4.4Å
193	I	93.3	Very high	89.5	Confident	16 Å²	16	43.3 Å²	43.3	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-33.4	172.6	-76.3	166.3	0	0	0	111.5	L189 N190 M265 M269 K272 F281	L189-I193 HydrophobicContact CD1-CD1 4.15Å; L189-I193 HydrophobicContact CD1-CG1 4.26Å; L189-I193 HydrophobicContact CD2-CD1 4.49Å; L189-I193 HydrophobicContact CG-CD1 3.82Å; L189-I193 HydrophobicContact CG-CG1 4.39Å; L189-I193 WeakPolarHBondContact O-CB 3.38Å; L189-I193 WeakPolarHBondContact O-CG1 3.43Å; L189-I193 PolarHBondContact O-N 3.32Å; N190-I193 WeakPolarHBondContact O-CB 3.2Å; N190-I193 PolarHBondContact O-N 3.19Å; I193-M265 HydrophobicContact CD1-CG 3.91Å; I193-M265 HydrophobicContact CD1-SD 4.04Å; I193-M269 HydrophobicContact CD1-CE 4.2Å; I193-M269 HydrophobicContact CD1-CG 3.47Å; I193-M269 VanDerWaalsContact CD1-CG 3.47Å; I193-M269 HydrophobicContact CD1-SD 3.6Å; I193-M269 HydrophobicContact CG1-CE 3.91Å; I193-M269 HydrophobicContact CG1-CG 3.83Å; I193-M269 HydrophobicContact CG1-SD 4Å; I193-K272 HydrophobicContact CG2-CD 4.08Å; I193-F281 HydrophobicContact CB-CZ 4.41Å; I193-F281 HydrophobicContact CG1-CZ 4.26Å; I193-F281 HydrophobicContact CG2-CZ 4.35Å
194	D	90.1	Very high	89	Confident	94 Å²	94	49.8 Å²	49.8	50%	0.503	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	9.4	179.9	-69	-28	0	0	0	113.5	N190 M191 E192 S196 K272	N190-D194 PolarHBondContact O-N 3.05Å; N190-D194 VanDerWaalsContact O-N 3.16Å; M191-D194 PolarHBondContact O-N 3.4Å; E192-D194 PolarHBondContact O-N 3.48Å; D194-S196 PolarHBondContact O-N 2.83Å; D194-K272 IonicContact OD1-NZ 3.51Å; D194-K272 PolarHBondContact OD1-NZ 3.09Å
195	N	89.9	Confident	88.4	Confident	38 Å²	38	52.9 Å²	52.9	20%	0.203	29%	0.29	C	S	.	.			trans	-70.5	89.5	179	-171.6	-15.3	0	0	0	112.4	M191 E192 A197 A198 C199	M191-N195 PolarHBondContact O-N 2.89Å; E192-N195 VanDerWaalsContact O-CB 3.3Å; E192-N195 WeakPolarHBondContact O-CB 3.31Å; E192-N195 PolarHBondContact O-N 2.97Å; E192-N195 PolarHBondContact OE2-ND2 2.71Å; N195-A197 VanDerWaalsContact C-N 3.25Å; N195-A197 PolarHBondContact O-N 3.08Å; N195-A197 PolarHBondContact OD1-N 3.28Å; N195-A198 HydrophobicContact CB-CB 4.17Å; N195-A198 PolarHBondContact O-N 3.18Å; N195-A198 PolarHBondContact OD1-N 3.01Å; N195-C199 PolarHBondContact O-N 3.31Å; N195-C199 VanDerWaalsContact O-N 3.13Å
196	S	83.8	Confident	87.4	Confident	87 Å²	87	59.8 Å²	59.8	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-61.7	-28	-178.8	63.1	0	0	0	0	114.1	D194 C199 S200	D194-S196 PolarHBondContact O-N 2.83Å; S196-C199 WeakPolarHBondContact O-CB 3.39Å; S196-S200 WeakPolarHBondContact O-CB 3.18Å; S196-S200 PolarHBondContact O-N 2.95Å; S196-S200 PolarHBondContact O-OG 3.39Å
197	A	83.9	Confident	86.7	Confident	65 Å²	65	62.7 Å²	62.7	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-72.1	-44.2	178.1	0	0	0	0	0	111.6	N195 C199 S200 S201	N195-A197 VanDerWaalsContact C-N 3.25Å; N195-A197 PolarHBondContact O-N 3.08Å; N195-A197 PolarHBondContact OD1-N 3.28Å; A197-C199 VanDerWaalsContact C-N 3.35Å; A197-S200 PolarHBondContact O-N 3.44Å; A197-S201 WeakPolarHBondContact O-CB 3.45Å; A197-S201 PolarHBondContact O-N 3.38Å
198	A	82.5	Confident	86.5	Confident	22 Å²	22	57.8 Å²	57.8	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-62.1	-44.1	174.5	0	0	0	0	0	111.2	N195 S201 A202	N195-A198 HydrophobicContact CB-CB 4.17Å; N195-A198 PolarHBondContact O-N 3.18Å; N195-A198 PolarHBondContact OD1-N 3.01Å; A198-S201 PolarHBondContact O-N 3.22Å; A198-A202 WeakPolarHBondContact O-CB 3.12Å; A198-A202 PolarHBondContact O-N 3.49Å
199	C	82.6	Confident	86.2	Confident	33 Å²	33	57.4 Å²	57.4	22%	0.223	34%	0.336	C	S	.	.	H	α-helix	trans	-53.9	-54.7	171.5	165.3	0	0	0	0	112.2	N195 S196 A197 S201 A202 V203 H277	N195-C199 PolarHBondContact O-N 3.31Å; N195-C199 VanDerWaalsContact O-N 3.13Å; S196-C199 WeakPolarHBondContact O-CB 3.39Å; A197-C199 VanDerWaalsContact C-N 3.35Å; C199-S201 VanDerWaalsContact C-N 3.28Å; C199-S201 PolarHBondContact O-N 2.95Å; C199-A202 PolarHBondContact O-N 2.89Å; C199-V203 WeakPolarHBondContact O-CG2 3.39Å; C199-V203 PolarHBondContact O-N 3.31Å; C199-H277 PolarHBondContact SG-O 2.87Å
200	S	83.2	Confident	85.8	Confident	54 Å²	54	58.4 Å²	58.4	38%	0.378	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-36.7	-177.4	-63.7	0	0	0	0	112.6	S196 A197 R204	S196-S200 WeakPolarHBondContact O-CB 3.18Å; S196-S200 PolarHBondContact O-N 2.95Å; S196-S200 PolarHBondContact O-OG 3.39Å; A197-S200 PolarHBondContact O-N 3.44Å; S200-R204 WeakPolarHBondContact O-CG 3.12Å
201	S	84.3	Confident	85.6	Confident	57 Å²	57	59.1 Å²	59.1	40%	0.399	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-49.8	175.1	-177.6	0	0	0	0	111.3	A197 A198 C199 V203 R204 K205	A197-S201 WeakPolarHBondContact O-CB 3.45Å; A197-S201 PolarHBondContact O-N 3.38Å; A198-S201 PolarHBondContact O-N 3.22Å; C199-S201 VanDerWaalsContact C-N 3.28Å; C199-S201 PolarHBondContact O-N 2.95Å; S201-V203 PolarHBondContact O-N 2.83Å; S201-R204 PolarHBondContact O-N 3.08Å; S201-K205 PolarHBondContact O-N 3.14Å
202	A	82	Confident	85.4	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-40.4	-177.1	0	0	0	0	0	112.7	A198 C199 R204 K205 I208 P279 H280	A198-A202 WeakPolarHBondContact O-CB 3.12Å; A198-A202 PolarHBondContact O-N 3.49Å; C199-A202 PolarHBondContact O-N 2.89Å; A202-R204 VanDerWaalsContact C-N 3.26Å; A202-R204 PolarHBondContact O-N 3.4Å; A202-K205 PolarHBondContact O-N 2.66Å; A202-I208 HydrophobicContact CB-CD1 4.24Å; A202-P279 HydrophobicContact CB-CG 4.11Å; A202-H280 HydrophobicContact CB-CB 3.77Å
203	V	82.9	Confident	85.4	Confident	90 Å²	90	56.4 Å²	56.4	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-29.5	179.6	173.2	0	0	0	0	112.2	C199 S201 P279	C199-V203 WeakPolarHBondContact O-CG2 3.39Å; C199-V203 PolarHBondContact O-N 3.31Å; S201-V203 PolarHBondContact O-N 2.83Å; V203-P279 HydrophobicContact CG2-CG 4.01Å
204	R	83.9	Confident	85.5	Confident	210 Å²	210	56.7 Å²	56.7	79%	0.792	34%	0.34	S	S	*	.	H	α-helix	trans	-84	-20.7	179.6	-67.4	175.3	-169.2	175	4.9	113.2	S200 S201 A202	S200-R204 WeakPolarHBondContact O-CG 3.12Å; S201-R204 PolarHBondContact O-N 3.08Å; A202-R204 VanDerWaalsContact C-N 3.26Å; A202-R204 PolarHBondContact O-N 3.4Å
205	K	82.4	Confident	85.7	Confident	88 Å²	88	53 Å²	53	38%	0.383	32%	0.321	S	S	.	.			trans	-75.1	130.3	-177.8	-79.4	-173.5	177.5	-171.8	0	111	S201 A202 A207 D212	S201-K205 PolarHBondContact O-N 3.14Å; A202-K205 PolarHBondContact O-N 2.66Å; K205-A207 VanDerWaalsContact C-N 3.27Å; K205-A207 PolarHBondContact O-N 3.1Å; K205-D212 WeakPolarHBondContact CD-OD1 3.45Å; K205-D212 WeakPolarHBondContact CE-OD1 3.37Å; K205-D212 IonicContact NZ-OD1 3.15Å; K205-D212 PolarHBondContact NZ-OD1 3.41Å; K205-D212 IonicContact NZ-OD2 2.74Å
206	P	75.1	Confident	86	Confident	144 Å²	144	51.4 Å²	51.4	94%	0.935	31%	0.312	S	S	*	.	S	Bend	trans	-63.7	-32.5	177	-21.4	31.8	0	0	0	113.5
207	A	81.4	Confident	86.6	Confident	66 Å²	66	47.3 Å²	47.3	55%	0.545	28%	0.283	S	S	.	.	S	Bend	trans	-135.3	123	177.3	0	0	0	0	0	108.9	K205	K205-A207 VanDerWaalsContact C-N 3.27Å; K205-A207 PolarHBondContact O-N 3.1Å
208	I	86.9	Confident	87.2	Confident	14 Å²	14	44.3 Å²	44.3	7%	0.072	26%	0.258	C	S	.	.			trans	-92.5	137.1	175.3	-56.7	173.1	0	0	0	107.8	A202 D212 P279 H280 A546	A202-I208 HydrophobicContact CB-CD1 4.24Å; I208-D212 HydrophobicContact CG2-CB 3.86Å; I208-P279 HydrophobicContact CD1-CB 3.56Å; I208-P279 HydrophobicContact CD1-CG 3.64Å; I208-H280 HydrophobicContact CG2-CB 4.01Å; I208-A546 HydrophobicContact CB-CB 4.2Å; I208-A546 HydrophobicContact CG2-CB 3.78Å
209	S	88.2	Confident	87.9	Confident	12 Å²	12	43.7 Å²	43.7	8%	0.084	25%	0.252	C	S	.	.			trans	-124.5	174.1	-178.5	69.2	0	0	0	0	111.2	A211 D212 A546 L549	S209-A211 PolarHBondContact O-N 2.88Å; S209-A211 VanDerWaalsContact O-N 3.15Å; S209-A211 PolarHBondContact OG-N 3.37Å; S209-D212 PolarHBondContact N-OD2 2.92Å; S209-D212 WeakPolarHBondContact O-CB 3.27Å; S209-D212 PolarHBondContact O-N 3.16Å; S209-D212 VanDerWaalsContact O-N 3.1Å; S209-D212 PolarHBondContact OG-OD2 3.22Å; S209-A546 CarbonylContact C-O 3.56Å; S209-L549 WeakPolarHBondContact CA-O 3.44Å; S209-L549 WeakPolarHBondContact CB-O 3.43Å
210	L	88.8	Confident	88.7	Confident	21 Å²	21	42.1 Å²	42.1	11%	0.11	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.6	-24.3	176.1	65.9	100.5	0	0	0	113.5	T89 D212 S213 R217 A546 L549	T89-L210 HydrophobicContact CG2-CD2 3.23Å; L210-D212 PolarHBondContact O-N 3.18Å; L210-S213 PolarHBondContact O-N 3.35Å; L210-S213 PolarHBondContact O-OG 3.39Å; L210-R217 VanDerWaalsContact CD1-NH2 3.28Å; L210-R217 VanDerWaalsContact O-CZ 3.32Å; L210-R217 PolarHBondContact O-NE 2.93Å; L210-R217 VanDerWaalsContact O-NE 3.09Å; L210-R217 PolarHBondContact O-NH2 3.02Å; L210-A546 PolarHBondContact N-O 2.98Å; L210-A546 VanDerWaalsContact N-O 3.08Å; L210-L549 WeakPolarHBondContact CD2-O 3.33Å; L210-L549 PolarHBondContact N-O 3.39Å
211	A	87	Confident	89.4	Confident	36 Å²	36	39.8 Å²	39.8	30%	0.298	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-63.2	-31.2	177.2	0	0	0	0	0	112.3	S209 S213 T214	S209-A211 PolarHBondContact O-N 2.88Å; S209-A211 VanDerWaalsContact O-N 3.15Å; S209-A211 PolarHBondContact OG-N 3.37Å; A211-S213 PolarHBondContact O-N 2.99Å; A211-T214 PolarHBondContact O-OG1 3.44Å
212	D	89.3	Confident	90.1	Very high	31 Å²	31	37 Å²	37	17%	0.166	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-73.6	-10.5	-176.7	-62.9	-64.6	0	0	0	113.9	K205 I208 S209 L210 H280	K205-D212 WeakPolarHBondContact CD-OD1 3.45Å; K205-D212 WeakPolarHBondContact CE-OD1 3.37Å; K205-D212 IonicContact NZ-OD1 3.15Å; K205-D212 PolarHBondContact NZ-OD1 3.41Å; K205-D212 IonicContact NZ-OD2 2.74Å; I208-D212 HydrophobicContact CG2-CB 3.86Å; S209-D212 PolarHBondContact N-OD2 2.92Å; S209-D212 WeakPolarHBondContact O-CB 3.27Å; S209-D212 PolarHBondContact O-N 3.16Å; S209-D212 VanDerWaalsContact O-N 3.1Å; S209-D212 PolarHBondContact OG-OD2 3.22Å; L210-D212 PolarHBondContact O-N 3.18Å; D212-H280 HydrophobicContact CB-CB 4.22Å
213	S	93	Very high	90.9	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.021	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-125.7	15.6	-174.9	61.5	0	0	0	0	113.6	L210 A211 D215 L216 R217 H280	L210-S213 PolarHBondContact O-N 3.35Å; L210-S213 PolarHBondContact O-OG 3.39Å; A211-S213 PolarHBondContact O-N 2.99Å; S213-D215 PolarHBondContact O-N 3.45Å; S213-L216 PolarHBondContact O-N 3.33Å; S213-R217 WeakPolarHBondContact O-CG 3.32Å; S213-R217 PolarHBondContact O-N 3.26Å; S213-R217 WeakPolarHBondContact OG-CD 3.34Å; S213-R217 PolarHBondContact OG-NE 3.43Å; S213-H280 WeakPolarHBondContact CB-O 2.9Å
214	T	93.8	Very high	91.6	Very high	23 Å²	23	32.6 Å²	32.6	14%	0.141	18%	0.178	C	C	.	.	H	α-helix	trans	-52.6	-52.5	-171.3	-58.6	0	0	0	0	113.6	L142 A211 L216 R217 V218	L142-T214 HydrophobicContact CD1-CG2 4.33Å; L142-T214 HydrophobicContact CD2-CG2 4.15Å; A211-T214 PolarHBondContact O-OG1 3.44Å; T214-L216 PolarHBondContact O-N 3.26Å; T214-R217 PolarHBondContact O-N 2.89Å; T214-V218 WeakPolarHBondContact O-CG2 3.31Å; T214-V218 PolarHBondContact O-N 3.12Å
215	D	94.1	Very high	92.3	Very high	16 Å²	16	22.6 Å²	22.6	9%	0.086	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-49.3	179.4	-55.4	-114.2	0	0	0	111.1	R138 E192 S213 R217 V218 L219	R138-D215 IonicContact CZ-OD2 2.64Å; R138-D215 IonicContact NE-OD1 2.72Å; R138-D215 PolarHBondContact NE-OD1 2.87Å; R138-D215 IonicContact NE-OD2 3.94Å; R138-D215 IonicContact NH2-OD1 3.64Å; R138-D215 IonicContact NH2-OD2 3.33Å; R138-D215 PolarHBondContact NH2-OD2 3.09Å; E192-D215 HydrophobicContact CG-CB 4.3Å; S213-D215 PolarHBondContact O-N 3.45Å; D215-R217 PolarHBondContact O-N 3.33Å; D215-V218 PolarHBondContact O-N 2.81Å; D215-L219 WeakPolarHBondContact O-CG 3.15Å; D215-L219 PolarHBondContact O-N 2.93Å; D215-L219 VanDerWaalsContact O-N 3.07Å
216	L	96.1	Very high	93	Very high	5 Å²	5	18.4 Å²	18.4	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-44	177.3	-70.3	170.2	0	0	0	112.1	L189 E192 S213 T214 L219 L220 M269 F281 P282	L189-L216 HydrophobicContact CD1-CD2 3.73Å; E192-L216 HydrophobicContact CB-CD2 3.69Å; E192-L216 HydrophobicContact CB-CG 4.31Å; S213-L216 PolarHBondContact O-N 3.33Å; T214-L216 PolarHBondContact O-N 3.26Å; L216-L219 PolarHBondContact O-N 3.24Å; L216-L220 HydrophobicContact CB-CD1 4.47Å; L216-L220 VanDerWaalsContact O-CB 3.27Å; L216-L220 WeakPolarHBondContact O-CB 3.24Å; L216-L220 WeakPolarHBondContact O-CD1 3.35Å; L216-L220 WeakPolarHBondContact O-CG 3.4Å; L216-L220 PolarHBondContact O-N 3.42Å; L216-M269 HydrophobicContact CD2-CE 4.34Å; L216-F281 HydrophobicContact CD1-CD1 3.44Å; L216-F281 VanDerWaalsContact CD1-CD1 3.44Å; L216-F281 HydrophobicContact CD1-CE1 3.66Å; L216-F281 HydrophobicContact CD1-CG 4.46Å; L216-P282 HydrophobicContact CB-CG 4.21Å
217	R	96.4	Very high	94.1	Very high	1 Å²	1	11.6 Å²	11.6	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-63.6	-43	-179.9	-70.4	-172.3	-58.9	121.9	-2.9	111.4	E90 E93 L210 S213 T214 D215 N221 P282 K285 D547	E90-R217 VanDerWaalsContact CD-NH1 3.27Å; E90-R217 IonicContact OE1-CZ 3.99Å; E90-R217 IonicContact OE1-NH1 3.33Å; E90-R217 PolarHBondContact OE1-NH1 2.89Å; E93-R217 IonicContact OE1-CZ 3.92Å; E93-R217 IonicContact OE1-NH1 2.96Å; E93-R217 PolarHBondContact OE1-NH1 3.07Å; E93-R217 IonicContact OE1-NH2 3.28Å; E93-R217 PolarHBondContact OE1-NH2 3.31Å; E93-R217 IonicContact OE2-NH1 3.2Å; E93-R217 IonicContact OE2-NH2 3.98Å; L210-R217 VanDerWaalsContact CD1-NH2 3.28Å; L210-R217 VanDerWaalsContact O-CZ 3.32Å; L210-R217 PolarHBondContact O-NE 2.93Å; L210-R217 VanDerWaalsContact O-NE 3.09Å; L210-R217 PolarHBondContact O-NH2 3.02Å; S213-R217 WeakPolarHBondContact O-CG 3.32Å; S213-R217 PolarHBondContact O-N 3.26Å; S213-R217 WeakPolarHBondContact OG-CD 3.34Å; S213-R217 PolarHBondContact OG-NE 3.43Å; T214-R217 PolarHBondContact O-N 2.89Å; D215-R217 PolarHBondContact O-N 3.33Å; R217-N221 VanDerWaalsContact O-CB 3.24Å; R217-N221 WeakPolarHBondContact O-CB 3.42Å; R217-N221 PolarHBondContact O-N 3.23Å; R217-N221 PolarHBondContact O-ND2 3.39Å; R217-N221 VanDerWaalsContact O-ND2 3.12Å; R217-P282 HydrophobicContact CG-CB 3.63Å; R217-P282 HydrophobicContact CG-CG 3.75Å; R217-K285 HydrophobicContact CB-CD 4.15Å; R217-K285 HydrophobicContact CG-CD 4Å; R217-D547 WeakPolarHBondContact CD-OD1 3.38Å
218	V	97.6	Very high	94.7	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-61.3	-49.8	177.3	172.7	0	0	0	0	110.6	L142 A145 R146 L149 T214 D215 N221 I222	L142-V218 HydrophobicContact CD1-CG2 4.23Å; A145-V218 HydrophobicContact CB-CG1 3.76Å; R146-V218 HydrophobicContact CG-CG1 4.46Å; R146-V218 HydrophobicContact CG-CG2 4.06Å; L149-V218 HydrophobicContact CB-CG1 4.22Å; L149-V218 HydrophobicContact CD2-CB 4.41Å; L149-V218 HydrophobicContact CD2-CG1 4.1Å; L149-V218 HydrophobicContact CD2-CG2 4.29Å; T214-V218 WeakPolarHBondContact O-CG2 3.31Å; T214-V218 PolarHBondContact O-N 3.12Å; D215-V218 PolarHBondContact O-N 2.81Å; V218-N221 PolarHBondContact O-N 2.87Å; V218-I222 HydrophobicContact CG1-CD1 4.18Å; V218-I222 WeakPolarHBondContact O-CG1 3.25Å; V218-I222 PolarHBondContact O-N 3.15Å; V218-I222 VanDerWaalsContact O-N 3.16Å
219	L	98.1	Very high	95.1	Very high	9 Å²	9	8 Å²	8	5%	0.047	5%	0.05	C	C	.	.	H	α-helix	trans	-60.6	-51.5	179	-63.4	174.2	0	0	0	111.7	L185 L188 L189 E192 D215 L216 N221 I222 M223	L185-L219 HydrophobicContact CD2-CD2 3.41Å; L185-L219 VanDerWaalsContact CD2-CD2 3.41Å; L188-L219 HydrophobicContact CB-CD1 4.09Å; L188-L219 HydrophobicContact CB-CD2 4.22Å; L188-L219 HydrophobicContact CD1-CD2 4.24Å; L189-L219 HydrophobicContact CB-CD1 4.49Å; E192-L219 HydrophobicContact CG-CD1 4.4Å; D215-L219 WeakPolarHBondContact O-CG 3.15Å; D215-L219 PolarHBondContact O-N 2.93Å; D215-L219 VanDerWaalsContact O-N 3.07Å; L216-L219 PolarHBondContact O-N 3.24Å; L219-N221 VanDerWaalsContact C-N 3.29Å; L219-N221 PolarHBondContact O-N 3.26Å; L219-I222 PolarHBondContact O-N 3.37Å; L219-M223 VanDerWaalsContact O-CG 3.31Å; L219-M223 WeakPolarHBondContact O-CG 3.31Å; L219-M223 PolarHBondContact O-N 3.4Å
220	L	98.3	Very high	95.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63	-34.4	-178.9	-69.1	167.3	0	0	0	112.5	L189 L216 Y224 L266 M269 P282 K285 V286 L289	L189-L220 HydrophobicContact CD1-CD2 4.15Å; L189-L220 HydrophobicContact CD1-CG 4.35Å; L189-L220 HydrophobicContact CD2-CD2 4.04Å; L216-L220 HydrophobicContact CB-CD1 4.47Å; L216-L220 VanDerWaalsContact O-CB 3.27Å; L216-L220 WeakPolarHBondContact O-CB 3.24Å; L216-L220 WeakPolarHBondContact O-CD1 3.35Å; L216-L220 WeakPolarHBondContact O-CG 3.4Å; L216-L220 PolarHBondContact O-N 3.42Å; L220-Y224 VanDerWaalsContact O-CB 3.26Å; L220-Y224 WeakPolarHBondContact O-CB 3.41Å; L220-Y224 PolarHBondContact O-N 2.85Å; L220-L266 HydrophobicContact CD2-CD2 4.43Å; L220-M269 HydrophobicContact CD1-CE 4.44Å; L220-P282 HydrophobicContact CD1-CG 3.54Å; L220-K285 HydrophobicContact CB-CB 4.18Å; L220-K285 HydrophobicContact CD1-CB 4.23Å; L220-V286 HydrophobicContact CD1-CG2 3.75Å; L220-V286 HydrophobicContact CD2-CG2 4.49Å; L220-L289 HydrophobicContact CD2-CD2 3.67Å
221	N	98.2	Very high	95.4	Very high	5 Å²	5	8.4 Å²	8.4	3%	0.027	5%	0.05	C	C	.	.	H	α-helix	trans	-64.5	-46.6	174.8	-75.5	-22.3	0	0	0	111.1	L85 Y86 L149 R217 V218 L219 Y224 L225 K285	L85-N221 WeakPolarHBondContact CD1-OD1 3.12Å; L85-N221 HydrophobicContact CD2-CB 4.45Å; Y86-N221 HydrophobicContact CE1-CB 4.46Å; L149-N221 HydrophobicContact CD1-CB 3.72Å; L149-N221 HydrophobicContact CD2-CB 4.18Å; R217-N221 VanDerWaalsContact O-CB 3.24Å; R217-N221 WeakPolarHBondContact O-CB 3.42Å; R217-N221 PolarHBondContact O-N 3.23Å; R217-N221 PolarHBondContact O-ND2 3.39Å; R217-N221 VanDerWaalsContact O-ND2 3.12Å; V218-N221 PolarHBondContact O-N 2.87Å; L219-N221 VanDerWaalsContact C-N 3.29Å; L219-N221 PolarHBondContact O-N 3.26Å; N221-Y224 PolarHBondContact O-N 3.28Å; N221-L225 VanDerWaalsContact O-CG 3.27Å; N221-L225 WeakPolarHBondContact O-CG 3.34Å; N221-L225 PolarHBondContact O-N 3.35Å; N221-K285 WeakPolarHBondContact OD1-CD 3.17Å; N221-K285 WeakPolarHBondContact OD1-CE 3.47Å
222	I	98.5	Very high	95.4	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.1	-48.4	177.7	-58.1	160	0	0	0	109.8	I148 L149 A152 L185 V218 L219 Y224 L225 I226	I148-I222 HydrophobicContact CB-CD1 4.24Å; I148-I222 HydrophobicContact CG2-CD1 3.89Å; I148-I222 HydrophobicContact CG2-CG1 4.42Å; I148-I222 HydrophobicContact CG2-CG2 4.15Å; L149-I222 HydrophobicContact CB-CD1 4.1Å; L149-I222 HydrophobicContact CB-CG1 3.76Å; L149-I222 HydrophobicContact CD1-CG1 3.85Å; L149-I222 HydrophobicContact CG-CG1 4.35Å; A152-I222 HydrophobicContact CB-CG2 4.32Å; L185-I222 HydrophobicContact CD1-CB 3.92Å; L185-I222 HydrophobicContact CD1-CG2 3.48Å; L185-I222 VanDerWaalsContact CD1-CG2 3.48Å; L185-I222 HydrophobicContact CD2-CD1 4.08Å; V218-I222 HydrophobicContact CG1-CD1 4.18Å; V218-I222 WeakPolarHBondContact O-CG1 3.25Å; V218-I222 PolarHBondContact O-N 3.15Å; V218-I222 VanDerWaalsContact O-N 3.16Å; L219-I222 PolarHBondContact O-N 3.37Å; I222-Y224 VanDerWaalsContact C-N 3.33Å; I222-Y224 PolarHBondContact O-N 3.19Å; I222-L225 PolarHBondContact O-N 2.88Å; I222-I226 HydrophobicContact CG2-CD1 3.93Å; I222-I226 HydrophobicContact CG2-CG1 4.44Å; I222-I226 WeakPolarHBondContact O-CG1 3.4Å; I222-I226 PolarHBondContact O-N 3.28Å
223	M	98.5	Very high	95	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.6	-40.2	-179.8	-64.5	-178.9	98.7	0	0	112.1	F182 L185 V186 L189 L219 I226 V227 F262 L289	F182-M223 HydrophobicContact CD2-CE 4.27Å; F182-M223 HydrophobicContact CE1-CE 4.26Å; F182-M223 HydrophobicContact CE2-CB 4.24Å; F182-M223 HydrophobicContact CE2-CE 3.69Å; F182-M223 HydrophobicContact CE2-CG 4.26Å; F182-M223 HydrophobicContact CZ-CE 3.68Å; L185-M223 HydrophobicContact CB-CE 4.15Å; L185-M223 HydrophobicContact CB-CG 3.95Å; L185-M223 HydrophobicContact CB-SD 4.12Å; L185-M223 HydrophobicContact CD1-CG 3.89Å; V186-M223 HydrophobicContact CB-CE 4.41Å; V186-M223 HydrophobicContact CG2-CE 3.51Å; L189-M223 HydrophobicContact CB-SD 4.47Å; L189-M223 HydrophobicContact CD2-CE 4.44Å; L189-M223 HydrophobicContact CD2-SD 3.75Å; L219-M223 VanDerWaalsContact O-CG 3.31Å; L219-M223 WeakPolarHBondContact O-CG 3.31Å; L219-M223 PolarHBondContact O-N 3.4Å; M223-I226 PolarHBondContact O-N 3.09Å; M223-V227 WeakPolarHBondContact O-CG2 3.3Å; M223-V227 PolarHBondContact O-N 3.28Å; M223-F262 HydrophobicContact CE-CD2 4.31Å; M223-F262 HydrophobicContact CE-CE1 4.34Å; M223-F262 HydrophobicContact CE-CE2 3.32Å; M223-F262 HydrophobicContact CE-CZ 3.35Å; M223-F262 HydrophobicContact SD-CE2 4.25Å; M223-F262 HydrophobicContact SD-CZ 3.95Å; M223-L289 HydrophobicContact CB-CD1 4.3Å; M223-L289 HydrophobicContact CB-CD2 3.81Å
224	Y	98.4	Very high	94.5	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-46.4	174.6	-178.5	-86.1	0	0	0	112.1	E81 L85 L220 N221 I222 I226 V227 E228 L288 L289 K292	E81-Y224 PolarHBondContact O-OH 3.47Å; L85-Y224 HydrophobicContact CB-CD1 4.37Å; L85-Y224 HydrophobicContact CB-CE1 4.22Å; L85-Y224 HydrophobicContact CD1-CD1 3.73Å; L85-Y224 HydrophobicContact CD1-CD2 4.27Å; L85-Y224 HydrophobicContact CD1-CE1 4.24Å; L85-Y224 HydrophobicContact CD1-CG 3.71Å; L85-Y224 HydrophobicContact CD2-CD1 3.59Å; L85-Y224 HydrophobicContact CD2-CE1 4.18Å; L85-Y224 HydrophobicContact CD2-CG 4.27Å; L85-Y224 HydrophobicContact CG-CD1 4.09Å; L85-Y224 HydrophobicContact CG-CE1 4.45Å; L220-Y224 VanDerWaalsContact O-CB 3.26Å; L220-Y224 WeakPolarHBondContact O-CB 3.41Å; L220-Y224 PolarHBondContact O-N 2.85Å; N221-Y224 PolarHBondContact O-N 3.28Å; I222-Y224 VanDerWaalsContact C-N 3.33Å; I222-Y224 PolarHBondContact O-N 3.19Å; Y224-I226 VanDerWaalsContact C-N 3.28Å; Y224-I226 PolarHBondContact O-N 2.68Å; Y224-V227 PolarHBondContact O-N 2.9Å; Y224-E228 HydrophobicContact CD1-CB 4.42Å; Y224-E228 HydrophobicContact CE1-CB 4.16Å; Y224-E228 HydrophobicContact CE1-CG 4.41Å; Y224-E228 VanDerWaalsContact O-CB 3.3Å; Y224-E228 WeakPolarHBondContact O-CB 3.38Å; Y224-E228 PolarHBondContact O-N 3.26Å; Y224-L288 HydrophobicContact CD2-CB 4.01Å; Y224-L288 HydrophobicContact CE2-CB 3.67Å; Y224-L288 HydrophobicContact CE2-CG 4.5Å; Y224-L289 HydrophobicContact CD2-CB 4.44Å; Y224-K292 HydrophobicContact CD2-CG 4.22Å; Y224-K292 HydrophobicContact CE2-CG 3.53Å; Y224-K292 WeakPolarHBondContact OH-CE 3.44Å
225	L	98.1	Very high	93.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-38.6	177.9	-68.1	172.8	0	0	0	111.6	L82 L85 L149 A152 Q153 M169 I173 N221 I222 T229	L82-L225 HydrophobicContact CD2-CD2 3.47Å; L82-L225 VanDerWaalsContact CD2-CD2 3.47Å; L85-L225 HydrophobicContact CD2-CD2 4.1Å; L85-L225 HydrophobicContact CD2-CG 4.2Å; L149-L225 HydrophobicContact CD1-CD1 4.02Å; A152-L225 HydrophobicContact CB-CD1 3.93Å; Q153-L225 HydrophobicContact CG-CD1 4.1Å; M169-L225 HydrophobicContact CE-CD2 4.12Å; M169-L225 HydrophobicContact SD-CD2 4.16Å; I173-L225 HydrophobicContact CD1-CB 3.94Å; N221-L225 VanDerWaalsContact O-CG 3.27Å; N221-L225 WeakPolarHBondContact O-CG 3.34Å; N221-L225 PolarHBondContact O-N 3.35Å; I222-L225 PolarHBondContact O-N 2.88Å; L225-T229 WeakPolarHBondContact O-CB 3.34Å; L225-T229 PolarHBondContact O-N 3.25Å; L225-T229 VanDerWaalsContact O-N 3.08Å; L225-T229 PolarHBondContact O-OG1 3.38Å
226	I	97.9	Very high	92.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-56.8	174	-66.3	169.2	0	0	0	110.2	I173 F182 L185 I222 M223 Y224 E228 T229 V230 F248	I173-I226 HydrophobicContact CD1-CG1 3.73Å; I173-I226 HydrophobicContact CG2-CB 4.36Å; I173-I226 HydrophobicContact CG2-CG1 4.24Å; I173-I226 HydrophobicContact CG2-CG2 4.43Å; F182-I226 HydrophobicContact CD2-CB 4.45Å; F182-I226 HydrophobicContact CD2-CD1 4.13Å; F182-I226 HydrophobicContact CD2-CG2 4.05Å; L185-I226 HydrophobicContact CD1-CD1 4.13Å; I222-I226 HydrophobicContact CG2-CD1 3.93Å; I222-I226 HydrophobicContact CG2-CG1 4.44Å; I222-I226 WeakPolarHBondContact O-CG1 3.4Å; I222-I226 PolarHBondContact O-N 3.28Å; M223-I226 PolarHBondContact O-N 3.09Å; Y224-I226 VanDerWaalsContact C-N 3.28Å; Y224-I226 PolarHBondContact O-N 2.68Å; I226-E228 PolarHBondContact O-N 3.4Å; I226-T229 PolarHBondContact O-N 3.29Å; I226-V230 HydrophobicContact CG2-CG2 4.29Å; I226-V230 VanDerWaalsContact O-CB 3.31Å; I226-V230 WeakPolarHBondContact O-CB 3.5Å; I226-V230 WeakPolarHBondContact O-CG2 3.43Å; I226-V230 PolarHBondContact O-N 2.82Å; I226-F248 HydrophobicContact CG2-CE1 4.19Å; I226-F248 HydrophobicContact CG2-CE2 4.31Å; I226-F248 HydrophobicContact CG2-CZ 3.75Å
227	V	97.3	Very high	92.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-45.6	-175.2	175.1	0	0	0	0	111.6	F182 M223 Y224 H231 F248 L252 L289 K292 C296	F182-V227 HydrophobicContact CE2-CG2 4.17Å; M223-V227 WeakPolarHBondContact O-CG2 3.3Å; M223-V227 PolarHBondContact O-N 3.28Å; Y224-V227 PolarHBondContact O-N 2.9Å; V227-H231 WeakPolarHBondContact O-CB 3.23Å; V227-H231 PolarHBondContact O-N 2.92Å; V227-F248 HydrophobicContact CG2-CE1 4.26Å; V227-F248 HydrophobicContact CG2-CZ 4.06Å; V227-L252 HydrophobicContact CG2-CD1 4.29Å; V227-L289 HydrophobicContact CB-CD1 4.22Å; V227-L289 HydrophobicContact CG2-CD1 3.93Å; V227-K292 HydrophobicContact CG1-CB 3.78Å; V227-C296 HydrophobicContact CG1-CB 4.23Å
228	E	95.4	Very high	91.9	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65.6	-45.1	-179.3	-179.3	61	-161.8	0	0	112	Y224 I226 H231 Q232 K292	Y224-E228 HydrophobicContact CD1-CB 4.42Å; Y224-E228 HydrophobicContact CE1-CB 4.16Å; Y224-E228 HydrophobicContact CE1-CG 4.41Å; Y224-E228 VanDerWaalsContact O-CB 3.3Å; Y224-E228 WeakPolarHBondContact O-CB 3.38Å; Y224-E228 PolarHBondContact O-N 3.26Å; I226-E228 PolarHBondContact O-N 3.4Å; E228-H231 PolarHBondContact O-N 3.34Å; E228-Q232 WeakPolarHBondContact O-CG 3.49Å; E228-Q232 PolarHBondContact O-N 2.97Å; E228-Q232 PolarHBondContact OE1-NE2 3.31Å; E228-K292 IonicContact OE1-NZ 2.71Å; E228-K292 PolarHBondContact OE1-NZ 3.13Å; E228-K292 WeakPolarHBondContact OE2-CD 3.19Å; E228-K292 WeakPolarHBondContact OE2-CE 3.48Å; E228-K292 IonicContact OE2-NZ 3.4Å; E228-K292 PolarHBondContact OE2-NZ 3.24Å
229	T	94.4	Very high	91.7	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-70.7	-41	-176.4	-57.4	0	0	0	0	112	R170 I173 L225 I226 H231 Q232	R170-T229 HydrophobicContact CB-CG2 4.22Å; R170-T229 HydrophobicContact CG-CG2 4.11Å; R170-T229 PolarHBondContact NH1-O 2.86Å; R170-T229 VanDerWaalsContact NH1-O 3.09Å; I173-T229 HydrophobicContact CB-CG2 4.15Å; I173-T229 HydrophobicContact CG1-CG2 4.28Å; I173-T229 HydrophobicContact CG2-CG2 4.17Å; L225-T229 WeakPolarHBondContact O-CB 3.34Å; L225-T229 PolarHBondContact O-N 3.25Å; L225-T229 VanDerWaalsContact O-N 3.08Å; L225-T229 PolarHBondContact O-OG1 3.38Å; I226-T229 PolarHBondContact O-N 3.29Å; T229-H231 VanDerWaalsContact C-N 3.32Å; T229-Q232 PolarHBondContact O-N 2.96Å
230	V	93.9	Very high	91.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-71.5	-29.3	178.2	177.9	0	0	0	0	110.9	I173 F174 L177 I226 R245 F248	I173-V230 HydrophobicContact CG2-CG2 3.81Å; F174-V230 HydrophobicContact CE1-CG2 4.45Å; L177-V230 HydrophobicContact CD2-CG2 4.1Å; I226-V230 HydrophobicContact CG2-CG2 4.29Å; I226-V230 VanDerWaalsContact O-CB 3.31Å; I226-V230 WeakPolarHBondContact O-CB 3.5Å; I226-V230 WeakPolarHBondContact O-CG2 3.43Å; I226-V230 PolarHBondContact O-N 2.82Å; V230-R245 HydrophobicContact CG1-CB 3.99Å; V230-R245 HydrophobicContact CG1-CG 4.03Å; V230-R245 WeakPolarHBondContact O-CG 3.31Å; V230-R245 PolarHBondContact O-NH1 3.41Å; V230-F248 HydrophobicContact CB-CD1 4.12Å; V230-F248 HydrophobicContact CB-CE1 4.29Å; V230-F248 HydrophobicContact CG1-CB 4.46Å; V230-F248 HydrophobicContact CG1-CD1 3.59Å; V230-F248 HydrophobicContact CG1-CE1 4.25Å; V230-F248 HydrophobicContact CG1-CG 4.36Å
231	H	89.8	Confident	91.2	Very high	42 Å²	42	44.7 Å²	44.7	19%	0.194	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-36.3	175.4	177.4	52.8	0	0	0	113	V227 E228 T229 D233 R245 L295 C296	V227-H231 WeakPolarHBondContact O-CB 3.23Å; V227-H231 PolarHBondContact O-N 2.92Å; E228-H231 PolarHBondContact O-N 3.34Å; T229-H231 VanDerWaalsContact C-N 3.32Å; H231-D233 PolarHBondContact O-N 3.09Å; H231-R245 PolarHBondContact O-NH1 2.82Å; H231-R245 VanDerWaalsContact O-NH1 3.09Å; H231-L295 WeakPolarHBondContact NE2-CD2 3.15Å; H231-C296 HydrophobicContact CB-CB 4.4Å
232	Q	86.3	Confident	90.9	Very high	45 Å²	45	50.5 Å²	50.5	21%	0.21	27%	0.269	C	S	.	.	S	Bend	trans	-77.9	118.4	-175.6	-69	-176.2	9.7	0	0	112.8	R170 E228 T229 R245	R170-Q232 PolarHBondContact NH1-O 3.26Å; R170-Q232 PolarHBondContact NH2-O 2.98Å; E228-Q232 WeakPolarHBondContact O-CG 3.49Å; E228-Q232 PolarHBondContact O-N 2.97Å; E228-Q232 PolarHBondContact OE1-NE2 3.31Å; T229-Q232 PolarHBondContact O-N 2.96Å; Q232-R245 VanDerWaalsContact O-CZ 3.31Å; Q232-R245 PolarHBondContact O-NH1 3.37Å; Q232-R245 PolarHBondContact O-NH2 3.19Å
233	D	82.1	Confident	90.7	Very high	139 Å²	139	54.4 Å²	54.4	74%	0.743	29%	0.293	S	S	*	.			trans	-71.6	139.7	173.5	-73.6	-30.6	0	0	0	110.6	H231 R245	H231-D233 PolarHBondContact O-N 3.09Å; D233-R245 VanDerWaalsContact N-NH1 3.11Å; D233-R245 IonicContact OD1-CZ 3.35Å; D233-R245 IonicContact OD1-NE 2.71Å; D233-R245 PolarHBondContact OD1-NE 2.95Å; D233-R245 IonicContact OD1-NH1 3.94Å; D233-R245 PolarHBondContact OD1-NH1 2.87Å; D233-R245 IonicContact OD1-NH2 3.33Å
234	C	81.7	Confident	90.5	Very high	66 Å²	66	56.4 Å²	56.4	45%	0.446	30%	0.303	S	S	.	.			trans	-131.2	133.9	175.1	-175.1	0	0	0	0	110.2	G236 D237	C234-G236 PolarHBondContact O-N 3.1Å; C234-D237 WeakPolarHBondContact O-CB 3.39Å; C234-D237 PolarHBondContact O-N 2.68Å
235	E	71.8	Confident	90.3	Very high	202 Å²	202	57.6 Å²	57.6	94%	0.944	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.2	-176.2	-65.2	-169.9	156.5	0	0	113.7
236	G	76.8	Confident	90.1	Very high	67 Å²	67	64.2 Å²	64.2	69%	0.691	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	3.5	175.5	0	0	0	0	0	116.2	C234	C234-G236 PolarHBondContact O-N 3.1Å
237	D	87.8	Confident	89.9	Confident	8 Å²	8	67.4 Å²	67.4	4%	0.043	36%	0.358	C	S	.	.			trans	-66.4	135.5	-175.7	-80.3	-3.8	0	0	0	112.8	R170 C234 R242 R245	R170-D237 IonicContact CZ-OD1 2.77Å; R170-D237 VanDerWaalsContact CZ-OD1 3.28Å; R170-D237 IonicContact CZ-OD2 3.76Å; R170-D237 IonicContact NE-OD1 3.4Å; R170-D237 PolarHBondContact NE-OD1 2.86Å; R170-D237 IonicContact NE-OD2 2.63Å; R170-D237 IonicContact NH2-OD1 2.74Å; R170-D237 PolarHBondContact NH2-OD1 2.93Å; R170-D237 IonicContact NH2-OD2 3.66Å; R170-D237 PolarHBondContact NH2-OD2 3.44Å; C234-D237 WeakPolarHBondContact O-CB 3.39Å; C234-D237 PolarHBondContact O-N 2.68Å; D237-R242 HydrophobicContact CB-CG 4.24Å; D237-R242 PolarHBondContact O-NE 3.09Å; D237-R242 PolarHBondContact O-NH2 3.42Å; D237-R245 IonicContact OD2-CZ 3.28Å; D237-R245 IonicContact OD2-NH2 3.97Å; D237-R245 PolarHBondContact OD2-NH2 3.13Å
238	K	90.2	Very high	89.8	Confident	114 Å²	114	67.6 Å²	67.6	50%	0.496	36%	0.358	S	S	.	.			trans	-60.5	151.2	171	-62.8	-179.5	-178.8	179.4	0	111	E240 W241 R242	K238-E240 PolarHBondContact O-N 3.38Å; K238-W241 HydrophobicContact CB-CD2 4.45Å; K238-W241 HydrophobicContact CB-CG 4.24Å; K238-W241 WeakPolarHBondContact O-CB 3.42Å; K238-W241 PolarHBondContact O-N 2.93Å; K238-W241 VanDerWaalsContact O-N 3.08Å; K238-R242 PolarHBondContact O-N 3.32Å; K238-R242 VanDerWaalsContact O-N 3.17Å
239	A	91.8	Very high	89.8	Confident	72 Å²	72	71.4 Å²	71.4	60%	0.595	37%	0.373	S	S	*	.	H	α-helix	trans	-58.8	-36.2	177.2	0	0	0	0	0	112.6	R242 T243	A239-R242 PolarHBondContact O-N 2.78Å; A239-T243 PolarHBondContact O-N 3.31Å; A239-T243 VanDerWaalsContact O-N 3.1Å; A239-T243 PolarHBondContact O-OG1 2.83Å
240	E	92.2	Very high	89.7	Confident	135 Å²	135	74.4 Å²	74.4	63%	0.631	40%	0.398	S	S	*	.	H	α-helix	trans	-58.6	-46.9	173.7	-66.9	166.6	-176.9	0	0	111.3	K238 R242 T243 M244	K238-E240 PolarHBondContact O-N 3.38Å; E240-R242 VanDerWaalsContact C-N 3.34Å; E240-R242 PolarHBondContact O-N 3.36Å; E240-T243 WeakPolarHBondContact O-CB 3.25Å; E240-T243 PolarHBondContact O-N 3.43Å; E240-T243 VanDerWaalsContact O-N 3.15Å; E240-M244 WeakPolarHBondContact O-CG 3.34Å; E240-M244 PolarHBondContact O-N 2.94Å
241	W	94.1	Very high	89.6	Confident	38 Å²	38	77.9 Å²	77.9	14%	0.144	41%	0.414	C	S	.	.	H	α-helix	trans	-65.2	-35.4	179.5	-68.9	0.4	0	0	0	112.8	R170 Y171 F174 K238 T243 R245	R170-W241 HydrophobicContact CG-CZ3 4.1Å; Y171-W241 HydrophobicContact CD2-CH2 4.3Å; Y171-W241 AromaticContact CD2-CZ2 4Å; Y171-W241 HydrophobicContact CD2-CZ2 4Å; F174-W241 HydrophobicContact CB-CD2 4.19Å; F174-W241 HydrophobicContact CB-CG 4.34Å; F174-W241 HydrophobicContact CB-CZ2 4.12Å; F174-W241 HydrophobicContact CD1-CB 3.93Å; F174-W241 AromaticContact CD1-CD1 3.83Å; F174-W241 HydrophobicContact CD1-CD2 4.21Å; F174-W241 AromaticContact CD1-CG 3.74Å; F174-W241 HydrophobicContact CD1-CG 3.74Å; F174-W241 HydrophobicContact CD2-CB 4.44Å; F174-W241 AromaticContact CD2-CD2 3.52Å; F174-W241 HydrophobicContact CD2-CD2 3.52Å; F174-W241 AromaticContact CD2-CE2 3.86Å; F174-W241 AromaticContact CD2-CE3 3.58Å; F174-W241 HydrophobicContact CD2-CE3 3.58Å; F174-W241 AromaticContact CD2-CG 3.94Å; F174-W241 HydrophobicContact CD2-CG 3.94Å; F174-W241 HydrophobicContact CD2-CH2 4.3Å; F174-W241 HydrophobicContact CD2-CZ2 4.24Å; F174-W241 AromaticContact CD2-CZ3 3.99Å; F174-W241 HydrophobicContact CD2-CZ3 3.99Å; F174-W241 HydrophobicContact CE1-CB 3.65Å; F174-W241 AromaticContact CE1-CG 3.98Å; F174-W241 HydrophobicContact CE1-CG 3.98Å; F174-W241 WeakPolarHBondContact CE1-O 3.21Å; F174-W241 HydrophobicContact CE2-CB 4.21Å; F174-W241 AromaticContact CE2-CD2 3.91Å; F174-W241 HydrophobicContact CE2-CD2 3.91Å; F174-W241 AromaticContact CE2-CE3 3.7Å; F174-W241 HydrophobicContact CE2-CE3 3.7Å; F174-W241 HydrophobicContact CE2-CG 4.17Å; F174-W241 HydrophobicContact CE2-CZ3 4.32Å; F174-W241 HydrophobicContact CG-CB 4.33Å; F174-W241 AromaticContact CG-CD1 3.82Å; F174-W241 AromaticContact CG-CD2 3.71Å; F174-W241 HydrophobicContact CG-CD2 3.71Å; F174-W241 AromaticContact CG-CE2 3.8Å; F174-W241 HydrophobicContact CG-CE3 4.26Å; F174-W241 AromaticContact CG-CG 3.74Å; F174-W241 HydrophobicContact CG-CG 3.74Å; F174-W241 HydrophobicContact CG-CZ2 4.42Å; F174-W241 AromaticContact CG-NE1 3.86Å; F174-W241 HydrophobicContact CZ-CB 3.82Å; F174-W241 HydrophobicContact CZ-CD2 4.41Å; F174-W241 HydrophobicContact CZ-CE3 4.44Å; F174-W241 HydrophobicContact CZ-CG 4.19Å; K238-W241 HydrophobicContact CB-CD2 4.45Å; K238-W241 HydrophobicContact CB-CG 4.24Å; K238-W241 WeakPolarHBondContact O-CB 3.42Å; K238-W241 PolarHBondContact O-N 2.93Å; K238-W241 VanDerWaalsContact O-N 3.08Å; W241-T243 VanDerWaalsContact C-N 3.34Å; W241-R245 VanDerWaalsContact O-CB 3.28Å; W241-R245 WeakPolarHBondContact O-CB 3.3Å; W241-R245 PolarHBondContact O-N 2.91Å
242	R	92.7	Very high	89.8	Confident	128 Å²	128	76 Å²	76	48%	0.483	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-39.9	173.5	-62.7	179.5	-161.9	162	4.3	111.7	D237 K238 A239 E240 Q246	D237-R242 HydrophobicContact CB-CG 4.24Å; D237-R242 PolarHBondContact O-NE 3.09Å; D237-R242 PolarHBondContact O-NH2 3.42Å; K238-R242 PolarHBondContact O-N 3.32Å; K238-R242 VanDerWaalsContact O-N 3.17Å; A239-R242 PolarHBondContact O-N 2.78Å; E240-R242 VanDerWaalsContact C-N 3.34Å; E240-R242 PolarHBondContact O-N 3.36Å; R242-Q246 WeakPolarHBondContact O-CG 3.12Å; R242-Q246 PolarHBondContact O-N 3Å
243	T	93.9	Very high	89.9	Confident	81 Å²	81	74.6 Å²	74.6	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-69	-44.5	177.3	-51.7	0	0	0	0	111.1	A239 E240 W241 R245 Q246 T247	A239-T243 PolarHBondContact O-N 3.31Å; A239-T243 VanDerWaalsContact O-N 3.1Å; A239-T243 PolarHBondContact O-OG1 2.83Å; E240-T243 WeakPolarHBondContact O-CB 3.25Å; E240-T243 PolarHBondContact O-N 3.43Å; E240-T243 VanDerWaalsContact O-N 3.15Å; W241-T243 VanDerWaalsContact C-N 3.34Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.08Å; T243-Q246 PolarHBondContact O-N 3.05Å; T243-T247 PolarHBondContact O-N 3.36Å; T243-T247 PolarHBondContact O-OG1 3.36Å
244	M	94.3	Very high	90.2	Very high	42 Å²	42	70.1 Å²	70.1	21%	0.207	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-42.1	174.9	-74	179.7	66.5	0	0	112	F174 L177 E178 E240 T247 F248	F174-M244 HydrophobicContact CD1-CE 4.33Å; F174-M244 HydrophobicContact CD1-SD 4.39Å; F174-M244 WeakPolarHBondContact O-CE 3.43Å; L177-M244 HydrophobicContact CB-CE 3.95Å; L177-M244 HydrophobicContact CD2-CE 3.96Å; L177-M244 HydrophobicContact CG-CE 3.85Å; E178-M244 HydrophobicContact CB-CE 3.87Å; E240-M244 WeakPolarHBondContact O-CG 3.34Å; E240-M244 PolarHBondContact O-N 2.94Å; M244-T247 PolarHBondContact O-N 3.3Å; M244-F248 VanDerWaalsContact O-CB 3.27Å; M244-F248 WeakPolarHBondContact O-CB 3.29Å; M244-F248 PolarHBondContact O-N 2.88Å
245	R	94.4	Very high	90.3	Very high	25 Å²	25	70.4 Å²	70.4	9%	0.094	38%	0.384	C	S	.	.	H	α-helix	trans	-58.4	-48.3	175.1	171.9	-164.1	-55.3	-101.7	-13.2	112.3	V230 H231 Q232 D233 D237 W241 T243 T247 F248 R249	V230-R245 HydrophobicContact CG1-CB 3.99Å; V230-R245 HydrophobicContact CG1-CG 4.03Å; V230-R245 WeakPolarHBondContact O-CG 3.31Å; V230-R245 PolarHBondContact O-NH1 3.41Å; H231-R245 PolarHBondContact O-NH1 2.82Å; H231-R245 VanDerWaalsContact O-NH1 3.09Å; Q232-R245 VanDerWaalsContact O-CZ 3.31Å; Q232-R245 PolarHBondContact O-NH1 3.37Å; Q232-R245 PolarHBondContact O-NH2 3.19Å; D233-R245 VanDerWaalsContact N-NH1 3.11Å; D233-R245 IonicContact OD1-CZ 3.35Å; D233-R245 IonicContact OD1-NE 2.71Å; D233-R245 PolarHBondContact OD1-NE 2.95Å; D233-R245 IonicContact OD1-NH1 3.94Å; D233-R245 PolarHBondContact OD1-NH1 2.87Å; D233-R245 IonicContact OD1-NH2 3.33Å; D237-R245 IonicContact OD2-CZ 3.28Å; D237-R245 IonicContact OD2-NH2 3.97Å; D237-R245 PolarHBondContact OD2-NH2 3.13Å; W241-R245 VanDerWaalsContact O-CB 3.28Å; W241-R245 WeakPolarHBondContact O-CB 3.3Å; W241-R245 PolarHBondContact O-N 2.91Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.08Å; R245-T247 VanDerWaalsContact C-N 3.32Å; R245-T247 PolarHBondContact O-N 3.07Å; R245-F248 PolarHBondContact O-N 3.02Å; R245-R249 WeakPolarHBondContact O-CB 3.43Å; R245-R249 PolarHBondContact O-N 3Å
246	Q	93.1	Very high	90.6	Very high	140 Å²	140	63.2 Å²	63.2	65%	0.654	35%	0.351	S	S	*	.	H	α-helix	trans	-63	-41.9	178.6	-72.4	178	-11.4	0	0	111.4	R242 T243 R249 A250	R242-Q246 WeakPolarHBondContact O-CG 3.12Å; R242-Q246 PolarHBondContact O-N 3Å; T243-Q246 PolarHBondContact O-N 3.05Å; Q246-R249 PolarHBondContact O-N 3.21Å; Q246-A250 PolarHBondContact O-N 3.34Å
247	T	94.6	Very high	90.5	Very high	67 Å²	67	63.9 Å²	63.9	41%	0.411	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-50.7	176.4	-52.2	0	0	0	0	110.6	T243 M244 R245 R249 A250 E251	T243-T247 PolarHBondContact O-N 3.36Å; T243-T247 PolarHBondContact O-OG1 3.36Å; M244-T247 PolarHBondContact O-N 3.3Å; R245-T247 VanDerWaalsContact C-N 3.32Å; R245-T247 PolarHBondContact O-N 3.07Å; T247-R249 VanDerWaalsContact C-N 3.34Å; T247-R249 PolarHBondContact O-N 3.24Å; T247-A250 WeakPolarHBondContact O-CB 3.48Å; T247-A250 PolarHBondContact O-N 3.32Å; T247-A250 VanDerWaalsContact O-N 3.12Å; T247-E251 WeakPolarHBondContact O-CG 3.27Å; T247-E251 PolarHBondContact O-N 3.47Å
248	F	95.5	Very high	89.9	Confident	3 Å²	3	68.8 Å²	68.8	1%	0.013	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-39.4	177.8	179.6	-113.1	0	0	0	112.9	L177 F182 I226 V227 V230 M244 R245 A250 E251 L252	L177-F248 HydrophobicContact CD1-CD2 3.54Å; L177-F248 HydrophobicContact CD1-CE2 3.93Å; L177-F248 HydrophobicContact CD1-CG 4.15Å; L177-F248 HydrophobicContact CD2-CB 4.02Å; L177-F248 HydrophobicContact CD2-CD2 4.35Å; L177-F248 HydrophobicContact CD2-CG 4.12Å; F182-F248 HydrophobicContact CB-CE2 4.28Å; F182-F248 AromaticContact CD1-CE2 3.77Å; F182-F248 HydrophobicContact CD1-CE2 3.77Å; F182-F248 HydrophobicContact CD1-CZ 4.49Å; F182-F248 AromaticContact CD2-CE2 3.89Å; F182-F248 HydrophobicContact CD2-CE2 3.89Å; F182-F248 AromaticContact CD2-CZ 3.97Å; F182-F248 HydrophobicContact CD2-CZ 3.97Å; F182-F248 HydrophobicContact CE1-CE2 4.03Å; F182-F248 HydrophobicContact CE1-CZ 4.44Å; F182-F248 HydrophobicContact CE2-CE2 4.15Å; F182-F248 AromaticContact CE2-CZ 3.92Å; F182-F248 HydrophobicContact CE2-CZ 3.92Å; F182-F248 AromaticContact CG-CE2 3.7Å; F182-F248 HydrophobicContact CG-CE2 3.7Å; F182-F248 HydrophobicContact CG-CZ 4.26Å; F182-F248 HydrophobicContact CZ-CE2 4.22Å; F182-F248 HydrophobicContact CZ-CZ 4.18Å; I226-F248 HydrophobicContact CG2-CE1 4.19Å; I226-F248 HydrophobicContact CG2-CE2 4.31Å; I226-F248 HydrophobicContact CG2-CZ 3.75Å; V227-F248 HydrophobicContact CG2-CE1 4.26Å; V227-F248 HydrophobicContact CG2-CZ 4.06Å; V230-F248 HydrophobicContact CB-CD1 4.12Å; V230-F248 HydrophobicContact CB-CE1 4.29Å; V230-F248 HydrophobicContact CG1-CB 4.46Å; V230-F248 HydrophobicContact CG1-CD1 3.59Å; V230-F248 HydrophobicContact CG1-CE1 4.25Å; V230-F248 HydrophobicContact CG1-CG 4.36Å; M244-F248 VanDerWaalsContact O-CB 3.27Å; M244-F248 WeakPolarHBondContact O-CB 3.29Å; M244-F248 PolarHBondContact O-N 2.88Å; R245-F248 PolarHBondContact O-N 3.02Å; F248-A250 VanDerWaalsContact C-N 3.34Å; F248-A250 PolarHBondContact O-N 3.45Å; F248-E251 PolarHBondContact O-N 3.41Å; F248-L252 HydrophobicContact CD1-CD1 3.92Å; F248-L252 HydrophobicContact CD1-CG 4.37Å; F248-L252 HydrophobicContact CD2-CG 4.36Å; F248-L252 HydrophobicContact CE1-CD1 3.37Å; F248-L252 HydrophobicContact CE1-CG 3.99Å; F248-L252 HydrophobicContact CE2-CD1 4.26Å; F248-L252 HydrophobicContact CE2-CD2 4.14Å; F248-L252 HydrophobicContact CE2-CG 3.96Å; F248-L252 HydrophobicContact CZ-CD1 3.58Å; F248-L252 HydrophobicContact CZ-CD2 3.96Å; F248-L252 HydrophobicContact CZ-CG 3.78Å; F248-L252 WeakPolarHBondContact O-CB 3.27Å; F248-L252 WeakPolarHBondContact O-CG 3.26Å; F248-L252 PolarHBondContact O-N 3.35Å
249	R	94.1	Very high	89.4	Confident	82 Å²	82	70.4 Å²	70.4	31%	0.309	37%	0.374	S	S	.	.	H	α-helix	trans	-61.9	-42.2	174.7	178.3	175.4	176.9	165.2	5.5	111.7	R245 Q246 T247 G253 C296 T297 E303	R245-R249 WeakPolarHBondContact O-CB 3.43Å; R245-R249 PolarHBondContact O-N 3Å; Q246-R249 PolarHBondContact O-N 3.21Å; T247-R249 VanDerWaalsContact C-N 3.34Å; T247-R249 PolarHBondContact O-N 3.24Å; R249-G253 PolarHBondContact O-N 3.09Å; R249-C296 VanDerWaalsContact CD-O 3.23Å; R249-C296 WeakPolarHBondContact CD-O 3.37Å; R249-C296 WeakPolarHBondContact CG-O 3.24Å; R249-C296 PolarHBondContact NE-O 2.84Å; R249-T297 PolarHBondContact NE-O 3.05Å; R249-T297 PolarHBondContact NH2-O 2.71Å; R249-E303 IonicContact CZ-OE2 3.31Å; R249-E303 VanDerWaalsContact CZ-OE2 3.27Å; R249-E303 IonicContact NH1-OE1 2.84Å; R249-E303 IonicContact NH1-OE2 3.1Å; R249-E303 PolarHBondContact NH1-OE2 2.73Å; R249-E303 IonicContact NH2-OE2 3.82Å; R249-E303 PolarHBondContact NH2-OE2 2.83Å
250	A	92.3	Very high	89.2	Confident	67 Å²	67	71.2 Å²	71.2	55%	0.554	37%	0.366	S	S	*	.	H	α-helix	trans	-66.3	-44.7	176.3	0	0	0	0	0	111.3	Q246 T247 F248 G253 S254	Q246-A250 PolarHBondContact O-N 3.34Å; T247-A250 WeakPolarHBondContact O-CB 3.48Å; T247-A250 PolarHBondContact O-N 3.32Å; T247-A250 VanDerWaalsContact O-N 3.12Å; F248-A250 VanDerWaalsContact C-N 3.34Å; F248-A250 PolarHBondContact O-N 3.45Å; A250-G253 PolarHBondContact O-N 3.43Å; A250-S254 WeakPolarHBondContact O-CB 3.31Å; A250-S254 PolarHBondContact O-N 3.37Å
251	E	92.7	Very high	89.2	Confident	73 Å²	73	65.2 Å²	65.2	34%	0.341	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-49.2	176.1	-76.2	176	-177.3	0	0	111.9	T247 F248 G253 S254 L256	T247-E251 WeakPolarHBondContact O-CG 3.27Å; T247-E251 PolarHBondContact O-N 3.47Å; F248-E251 PolarHBondContact O-N 3.41Å; E251-G253 PolarHBondContact O-N 3.08Å; E251-S254 WeakPolarHBondContact CA-OG 3.17Å; E251-S254 PolarHBondContact O-N 3.45Å; E251-S254 PolarHBondContact O-OG 2.91Å; E251-L256 HydrophobicContact CB-CD2 4.21Å; E251-L256 VanDerWaalsContact O-CG 3.3Å; E251-L256 WeakPolarHBondContact O-CG 3.31Å
252	L	93.5	Very high	89.3	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-33.3	177.3	-79.5	-179.4	0	0	0	114.2	F182 V227 F248 L256 F262 T297	F182-L252 HydrophobicContact CE1-CD2 3.58Å; F182-L252 HydrophobicContact CE2-CD2 4.44Å; F182-L252 HydrophobicContact CZ-CD2 3.46Å; F182-L252 VanDerWaalsContact CZ-CD2 3.46Å; V227-L252 HydrophobicContact CG2-CD1 4.29Å; F248-L252 HydrophobicContact CD1-CD1 3.92Å; F248-L252 HydrophobicContact CD1-CG 4.37Å; F248-L252 HydrophobicContact CD2-CG 4.36Å; F248-L252 HydrophobicContact CE1-CD1 3.37Å; F248-L252 HydrophobicContact CE1-CG 3.99Å; F248-L252 HydrophobicContact CE2-CD1 4.26Å; F248-L252 HydrophobicContact CE2-CD2 4.14Å; F248-L252 HydrophobicContact CE2-CG 3.96Å; F248-L252 HydrophobicContact CZ-CD1 3.58Å; F248-L252 HydrophobicContact CZ-CD2 3.96Å; F248-L252 HydrophobicContact CZ-CG 3.78Å; F248-L252 WeakPolarHBondContact O-CB 3.27Å; F248-L252 WeakPolarHBondContact O-CG 3.26Å; F248-L252 PolarHBondContact O-N 3.35Å; L252-L256 HydrophobicContact CD2-CD1 4.36Å; L252-F262 HydrophobicContact CD2-CB 4.24Å; L252-F262 HydrophobicContact CD2-CD1 4.06Å; L252-F262 HydrophobicContact CD2-CG 4.37Å; L252-T297 HydrophobicContact CB-CG2 3.61Å
253	G	88.5	Confident	89.5	Confident	15 Å²	15	57.6 Å²	57.6	16%	0.155	31%	0.31	C	S	.	.	H	α-helix	trans	-81.9	-20.1	177.7	0	0	0	0	0	113.4	R249 A250 E251	R249-G253 PolarHBondContact O-N 3.09Å; A250-G253 PolarHBondContact O-N 3.43Å; E251-G253 PolarHBondContact O-N 3.08Å
254	S	88.3	Confident	89.6	Confident	45 Å²	45	53.8 Å²	53.8	32%	0.315	29%	0.287	S	S	.	.	S	Bend	trans	-86.4	162.2	178.9	75.7	0	0	0	0	112.2	A250 E251 L256	A250-S254 WeakPolarHBondContact O-CB 3.31Å; A250-S254 PolarHBondContact O-N 3.37Å; E251-S254 WeakPolarHBondContact CA-OG 3.17Å; E251-S254 PolarHBondContact O-N 3.45Å; E251-S254 PolarHBondContact O-OG 2.91Å; S254-L256 PolarHBondContact O-N 3.45Å; S254-L256 VanDerWaalsContact O-N 3.1Å
255	P	84.1	Confident	89.7	Confident	73 Å²	73	53 Å²	53	47%	0.474	28%	0.283	S	S	.	.			trans	-61.4	109.5	171.1	-22.6	35	0	0	0	111.5
256	L	77.9	Confident	89.8	Confident	50 Å²	50	51.8 Å²	51.8	26%	0.262	28%	0.278	S	S	.	.			trans	-96	-44.3	-177.1	-77.2	172.1	0	0	0	112.7	F182 E251 L252 S254 E260 F262	F182-L256 HydrophobicContact CE1-CD1 4.26Å; E251-L256 HydrophobicContact CB-CD2 4.21Å; E251-L256 VanDerWaalsContact O-CG 3.3Å; E251-L256 WeakPolarHBondContact O-CG 3.31Å; L252-L256 HydrophobicContact CD2-CD1 4.36Å; S254-L256 PolarHBondContact O-N 3.45Å; S254-L256 VanDerWaalsContact O-N 3.1Å; L256-E260 PolarHBondContact N-O 2.98Å; L256-F262 HydrophobicContact CD1-CB 4.13Å
257	Y	74.9	Confident	90.1	Very high	82 Å²	82	45.1 Å²	45.1	32%	0.322	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-141.8	140.1	-176.4	-168.4	-88.9	0	0	0	109.3	V186 E187 N190 N259 E260	V186-Y257 HydrophobicContact CG1-CG 4.3Å; E187-Y257 HydrophobicContact CG-CD2 4.14Å; E187-Y257 HydrophobicContact CG-CE2 3.95Å; N190-Y257 HydrophobicContact CB-CD1 4.31Å; N190-Y257 HydrophobicContact CB-CE1 3.97Å; N190-Y257 WeakPolarHBondContact ND2-CE1 3.13Å; Y257-N259 PolarHBondContact O-N 3.34Å; Y257-N259 VanDerWaalsContact O-N 3.13Å; Y257-E260 PolarHBondContact O-N 3.11Å
258	N	75.1	Confident	90.2	Very high	111 Å²	111	42.8 Å²	42.8	59%	0.594	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	29.3	-174.4	-70.3	-19	0	0	0	115	E260	N258-E260 PolarHBondContact O-N 2.96Å
259	N	79.8	Confident	90.3	Very high	148 Å²	148	42.7 Å²	42.7	79%	0.791	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	25.2	-174.2	-62.5	-25	0	0	0	114.6	Y257	Y257-N259 PolarHBondContact O-N 3.34Å; Y257-N259 VanDerWaalsContact O-N 3.13Å
260	E	86.7	Confident	90.4	Very high	89 Å²	89	38.8 Å²	38.8	42%	0.416	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-121.3	144.5	176.4	-66.8	-175	163.7	0	0	112	L256 Y257 N258 I264	L256-E260 PolarHBondContact N-O 2.98Å; Y257-E260 PolarHBondContact O-N 3.11Å; N258-E260 PolarHBondContact O-N 2.96Å; E260-I264 HydrophobicContact CB-CB 4.17Å; E260-I264 HydrophobicContact CB-CG2 4.29Å; E260-I264 HydrophobicContact CG-CG2 4.35Å; E260-I264 VanDerWaalsContact OE2-CG2 3.31Å; E260-I264 WeakPolarHBondContact OE2-CG2 3.17Å
261	P	92.8	Very high	90.6	Very high	9 Å²	9	37.2 Å²	37.2	6%	0.058	21%	0.205	C	C	.	.			trans	-61.7	149.8	169.7	-22.9	32.5	0	0	0	112.3	A263 I264 T508	P261-A263 PolarHBondContact O-N 3.46Å; P261-A263 VanDerWaalsContact O-N 3.09Å; P261-I264 HydrophobicContact CB-CG1 4.31Å; P261-I264 HydrophobicContact CG-CG1 4.28Å; P261-I264 WeakPolarHBondContact O-CB 3.35Å; P261-I264 PolarHBondContact O-N 3.16Å; P261-T508 HydrophobicContact CG-CG2 3.95Å
262	F	96	Very high	90.7	Very high	3 Å²	3	37 Å²	37	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-36.1	-178.3	-177.3	-119	0	0	0	113.6	F182 V186 L189 M223 L252 L256 I264 M265 L266 L289 T293	F182-F262 HydrophobicContact CZ-CD1 4.16Å; F182-F262 HydrophobicContact CZ-CE1 4.09Å; F182-F262 HydrophobicContact CZ-CE2 4.47Å; F182-F262 HydrophobicContact CZ-CG 4.41Å; F182-F262 HydrophobicContact CZ-CZ 4.28Å; V186-F262 HydrophobicContact CG2-CD2 4.07Å; V186-F262 HydrophobicContact CG2-CE2 4.13Å; L189-F262 HydrophobicContact CD2-CE2 4.17Å; L189-F262 HydrophobicContact CD2-CZ 4.42Å; M223-F262 HydrophobicContact CE-CD2 4.31Å; M223-F262 HydrophobicContact CE-CE1 4.34Å; M223-F262 HydrophobicContact CE-CE2 3.32Å; M223-F262 HydrophobicContact CE-CZ 3.35Å; M223-F262 HydrophobicContact SD-CE2 4.25Å; M223-F262 HydrophobicContact SD-CZ 3.95Å; L252-F262 HydrophobicContact CD2-CB 4.24Å; L252-F262 HydrophobicContact CD2-CD1 4.06Å; L252-F262 HydrophobicContact CD2-CG 4.37Å; L256-F262 HydrophobicContact CD1-CB 4.13Å; F262-I264 VanDerWaalsContact C-N 3.27Å; F262-I264 PolarHBondContact O-N 3.46Å; F262-M265 HydrophobicContact CD2-CE 3.38Å; F262-M265 HydrophobicContact CE2-CE 3.21Å; F262-M265 HydrophobicContact CZ-CE 4.4Å; F262-M265 PolarHBondContact O-N 3.48Å; F262-L266 HydrophobicContact CD1-CD1 4.06Å; F262-L266 HydrophobicContact CE1-CD1 3.67Å; F262-L266 HydrophobicContact CE1-CD2 4.46Å; F262-L266 HydrophobicContact CE1-CG 4.21Å; F262-L266 HydrophobicContact CZ-CD1 4.1Å; F262-L266 HydrophobicContact CZ-CD2 4.06Å; F262-L266 HydrophobicContact CZ-CG 4.18Å; F262-L266 PolarHBondContact O-N 3Å; F262-L289 HydrophobicContact CE1-CD1 4.18Å; F262-L289 HydrophobicContact CE1-CD2 3.94Å; F262-L289 HydrophobicContact CE1-CG 3.95Å; F262-L289 HydrophobicContact CZ-CD2 3.76Å; F262-L289 HydrophobicContact CZ-CG 4.29Å; F262-T293 HydrophobicContact CD1-CG2 3.75Å
263	A	96.8	Very high	90.7	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-35.8	176	0	0	0	0	0	112.9	P261 L266 F267 L290 T293 V294 L509	P261-A263 PolarHBondContact O-N 3.46Å; P261-A263 VanDerWaalsContact O-N 3.09Å; A263-L266 PolarHBondContact O-N 2.75Å; A263-F267 WeakPolarHBondContact O-CD2 3.45Å; A263-F267 PolarHBondContact O-N 2.89Å; A263-L290 HydrophobicContact CB-CD1 4.2Å; A263-T293 HydrophobicContact CB-CG2 4.08Å; A263-V294 HydrophobicContact CB-CG2 4.45Å; A263-L509 HydrophobicContact CB-CD1 3.76Å
264	I	96.4	Very high	91	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-40.4	179.1	-56	-56.7	0	0	0	110.8	E260 P261 F262 L266 F267 G268 L509 G512 L513	E260-I264 HydrophobicContact CB-CB 4.17Å; E260-I264 HydrophobicContact CB-CG2 4.29Å; E260-I264 HydrophobicContact CG-CG2 4.35Å; E260-I264 VanDerWaalsContact OE2-CG2 3.31Å; E260-I264 WeakPolarHBondContact OE2-CG2 3.17Å; P261-I264 HydrophobicContact CB-CG1 4.31Å; P261-I264 HydrophobicContact CG-CG1 4.28Å; P261-I264 WeakPolarHBondContact O-CB 3.35Å; P261-I264 PolarHBondContact O-N 3.16Å; F262-I264 VanDerWaalsContact C-N 3.27Å; F262-I264 PolarHBondContact O-N 3.46Å; I264-L266 VanDerWaalsContact C-N 3.32Å; I264-L266 PolarHBondContact O-N 2.76Å; I264-F267 CarbonylContact O-C 3.09Å; I264-F267 WeakPolarHBondContact O-CB 3.2Å; I264-F267 PolarHBondContact O-N 3.39Å; I264-G268 PolarHBondContact O-N 3.16Å; I264-L509 HydrophobicContact CD1-CD1 3.74Å; I264-L509 HydrophobicContact CG1-CD1 4.42Å; I264-G512 VanDerWaalsContact CD1-C 3.48Å; I264-L513 HydrophobicContact CD1-CB 4.37Å; I264-L513 HydrophobicContact CD1-CD2 3.53Å; I264-L513 HydrophobicContact CD1-CG 3.56Å
265	M	95.9	Very high	91.1	Very high	25 Å²	25	38.1 Å²	38.1	12%	0.123	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-43.7	174.1	-176.1	174.7	61.2	0	0	111.6	V186 L189 N190 I193 F262 G268 M269	V186-M265 HydrophobicContact CG1-CE 4.16Å; L189-M265 HydrophobicContact CD2-CE 3.75Å; L189-M265 HydrophobicContact CG-CE 4.32Å; N190-M265 HydrophobicContact CB-SD 4.13Å; I193-M265 HydrophobicContact CD1-CG 3.91Å; I193-M265 HydrophobicContact CD1-SD 4.04Å; F262-M265 HydrophobicContact CD2-CE 3.38Å; F262-M265 HydrophobicContact CE2-CE 3.21Å; F262-M265 HydrophobicContact CZ-CE 4.4Å; F262-M265 PolarHBondContact O-N 3.48Å; M265-G268 WeakPolarHBondContact O-CA 3.4Å; M265-G268 PolarHBondContact O-N 2.93Å; M265-G268 VanDerWaalsContact O-N 3.13Å; M265-M269 PolarHBondContact O-N 2.97Å
266	L	98	Very high	91.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-39.6	176.4	-62.3	175	0	0	0	112.2	L220 F262 A263 I264 G268 M269 V270 V286 L289 L290	L220-L266 HydrophobicContact CD2-CD2 4.43Å; F262-L266 HydrophobicContact CD1-CD1 4.06Å; F262-L266 HydrophobicContact CE1-CD1 3.67Å; F262-L266 HydrophobicContact CE1-CD2 4.46Å; F262-L266 HydrophobicContact CE1-CG 4.21Å; F262-L266 HydrophobicContact CZ-CD1 4.1Å; F262-L266 HydrophobicContact CZ-CD2 4.06Å; F262-L266 HydrophobicContact CZ-CG 4.18Å; F262-L266 PolarHBondContact O-N 3Å; A263-L266 PolarHBondContact O-N 2.75Å; I264-L266 VanDerWaalsContact C-N 3.32Å; I264-L266 PolarHBondContact O-N 2.76Å; L266-G268 VanDerWaalsContact C-N 3.28Å; L266-G268 PolarHBondContact O-N 3.47Å; L266-M269 HydrophobicContact CD2-SD 4.09Å; L266-M269 WeakPolarHBondContact O-CB 3.44Å; L266-M269 PolarHBondContact O-N 2.83Å; L266-V270 WeakPolarHBondContact O-CG2 3.47Å; L266-V270 PolarHBondContact O-N 2.85Å; L266-V270 VanDerWaalsContact O-N 3.09Å; L266-V286 HydrophobicContact CD2-CG1 4.42Å; L266-L289 HydrophobicContact CD1-CB 4.35Å; L266-L289 HydrophobicContact CD1-CD2 4.34Å; L266-L289 HydrophobicContact CD1-CG 3.86Å; L266-L289 HydrophobicContact CD2-CD2 4.09Å; L266-L289 HydrophobicContact CD2-CG 4.44Å; L266-L290 HydrophobicContact CB-CB 4.15Å; L266-L290 HydrophobicContact CB-CD1 4.04Å; L266-L290 HydrophobicContact CD1-CB 4.02Å; L266-L290 HydrophobicContact CD1-CD1 4.38Å
267	F	98	Very high	91.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-39.3	170.1	-89.4	-65.8	0	0	0	112	A263 I264 V270 T271 L290 L513 Y520 L524 V581 L585	A263-F267 WeakPolarHBondContact O-CD2 3.45Å; A263-F267 PolarHBondContact O-N 2.89Å; I264-F267 CarbonylContact O-C 3.09Å; I264-F267 WeakPolarHBondContact O-CB 3.2Å; I264-F267 PolarHBondContact O-N 3.39Å; F267-V270 WeakPolarHBondContact O-CB 3.49Å; F267-V270 PolarHBondContact O-N 3.22Å; F267-T271 PolarHBondContact O-N 3.38Å; F267-T271 PolarHBondContact O-OG1 3.15Å; F267-L290 HydrophobicContact CD1-CD2 4.08Å; F267-L290 HydrophobicContact CD2-CD1 3.73Å; F267-L290 HydrophobicContact CD2-CD2 4.35Å; F267-L290 HydrophobicContact CE1-CD2 3.86Å; F267-L290 HydrophobicContact CE2-CD1 3.6Å; F267-L290 HydrophobicContact CE2-CD2 4.15Å; F267-L290 HydrophobicContact CE2-CG 4.38Å; F267-L290 HydrophobicContact CG-CD1 4.38Å; F267-L290 HydrophobicContact CG-CD2 4.3Å; F267-L290 HydrophobicContact CZ-CD1 4.13Å; F267-L290 HydrophobicContact CZ-CD2 3.88Å; F267-L290 HydrophobicContact CZ-CG 4.45Å; F267-L513 HydrophobicContact CB-CD2 4.34Å; F267-L513 HydrophobicContact CD1-CD2 4.37Å; F267-L513 HydrophobicContact CD2-CD2 3.48Å; F267-L513 VanDerWaalsContact CD2-CD2 3.48Å; F267-L513 HydrophobicContact CE2-CD1 4.3Å; F267-L513 HydrophobicContact CE2-CD2 3.76Å; F267-L513 HydrophobicContact CG-CD2 3.83Å; F267-L513 HydrophobicContact CZ-CD2 4.34Å; F267-Y520 VanDerWaalsContact C-CE1 3.5Å; F267-Y520 HydrophobicContact CB-CD1 3.63Å; F267-Y520 HydrophobicContact CB-CE1 3.59Å; F267-Y520 HydrophobicContact CB-CE2 4.45Å; F267-Y520 HydrophobicContact CB-CG 4.15Å; F267-Y520 AromaticContact CD1-CD1 3.95Å; F267-Y520 HydrophobicContact CD1-CD1 3.95Å; F267-Y520 AromaticContact CD1-CG 3.91Å; F267-Y520 HydrophobicContact CD1-CG 3.91Å; F267-Y520 HydrophobicContact CG-CD1 4.16Å; F267-Y520 HydrophobicContact CG-CG 4.26Å; F267-Y520 WeakPolarHBondContact O-CE1 3.48Å; F267-L524 HydrophobicContact CE1-CD1 3.89Å; F267-L524 HydrophobicContact CE1-CG 4.4Å; F267-V581 HydrophobicContact CZ-CG1 4.01Å; F267-L585 HydrophobicContact CE2-CD1 4.45Å; F267-L585 HydrophobicContact CZ-CD1 3.84Å
268	G	96.5	Very high	92.6	Very high	18 Å²	18	36.7 Å²	36.7	19%	0.186	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-47.5	171.4	0	0	0	0	0	112.3	I264 M265 L266 V270 T271 K272	I264-G268 PolarHBondContact O-N 3.16Å; M265-G268 WeakPolarHBondContact O-CA 3.4Å; M265-G268 PolarHBondContact O-N 2.93Å; M265-G268 VanDerWaalsContact O-N 3.13Å; L266-G268 VanDerWaalsContact C-N 3.28Å; L266-G268 PolarHBondContact O-N 3.47Å; G268-V270 VanDerWaalsContact C-N 3.33Å; G268-V270 PolarHBondContact O-N 3.43Å; G268-T271 WeakPolarHBondContact CA-OG1 3.5Å; G268-T271 PolarHBondContact O-N 3.13Å; G268-T271 PolarHBondContact O-OG1 2.8Å; G268-K272 PolarHBondContact O-N 3.45Å
269	M	97.2	Very high	93.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-43.8	174.7	-64.1	-177	79.1	0	0	112.3	L189 I193 L216 L220 M265 L266 T271 K272 F273 F281 V286	L189-M269 HydrophobicContact CD1-CE 4.27Å; L189-M269 HydrophobicContact CD1-SD 4.36Å; I193-M269 HydrophobicContact CD1-CE 4.2Å; I193-M269 HydrophobicContact CD1-CG 3.47Å; I193-M269 VanDerWaalsContact CD1-CG 3.47Å; I193-M269 HydrophobicContact CD1-SD 3.6Å; I193-M269 HydrophobicContact CG1-CE 3.91Å; I193-M269 HydrophobicContact CG1-CG 3.83Å; I193-M269 HydrophobicContact CG1-SD 4Å; L216-M269 HydrophobicContact CD2-CE 4.34Å; L220-M269 HydrophobicContact CD1-CE 4.44Å; M265-M269 PolarHBondContact O-N 2.97Å; L266-M269 HydrophobicContact CD2-SD 4.09Å; L266-M269 WeakPolarHBondContact O-CB 3.44Å; L266-M269 PolarHBondContact O-N 2.83Å; M269-T271 VanDerWaalsContact C-N 3.33Å; M269-T271 PolarHBondContact O-N 3.18Å; M269-K272 PolarHBondContact O-N 3.39Å; M269-F273 WeakPolarHBondContact O-CB 3.39Å; M269-F273 PolarHBondContact O-N 2.98Å; M269-F281 HydrophobicContact CB-CD2 3.96Å; M269-F281 HydrophobicContact CB-CE2 3.96Å; M269-F281 HydrophobicContact CE-CD2 3.92Å; M269-F281 HydrophobicContact CE-CE2 4.02Å; M269-F281 HydrophobicContact CE-CG 4.18Å; M269-F281 HydrophobicContact CE-CZ 4.36Å; M269-F281 HydrophobicContact CG-CD2 4.43Å; M269-F281 HydrophobicContact CG-CE2 4.08Å; M269-V286 HydrophobicContact CB-CG1 3.98Å; M269-V286 HydrophobicContact CE-CG2 3.66Å; M269-V286 HydrophobicContact SD-CG1 4.24Å; M269-V286 HydrophobicContact SD-CG2 3.97Å
270	V	97.6	Very high	93.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.6	-44.9	177.4	173.2	0	0	0	0	110.7	L266 F267 G268 C274 M283 V286 L287 A523 L524 I527	L266-V270 WeakPolarHBondContact O-CG2 3.47Å; L266-V270 PolarHBondContact O-N 2.85Å; L266-V270 VanDerWaalsContact O-N 3.09Å; F267-V270 WeakPolarHBondContact O-CB 3.49Å; F267-V270 PolarHBondContact O-N 3.22Å; G268-V270 VanDerWaalsContact C-N 3.33Å; G268-V270 PolarHBondContact O-N 3.43Å; V270-C274 PolarHBondContact O-N 2.88Å; V270-M283 HydrophobicContact CB-SD 4.47Å; V270-M283 HydrophobicContact CG2-SD 3.84Å; V270-V286 HydrophobicContact CG2-CG1 4.04Å; V270-L287 HydrophobicContact CG2-CD2 3.95Å; V270-A523 HydrophobicContact CG1-CB 3.78Å; V270-L524 HydrophobicContact CG1-CD2 4.18Å; V270-I527 HydrophobicContact CG1-CD1 3.75Å
271	T	96.1	Very high	94.3	Very high	34 Å²	34	21.8 Å²	21.8	21%	0.209	13%	0.132	C	C	.	.	H	α-helix	trans	-70	-39.7	177.5	48.1	0	0	0	0	113.9	F267 G268 M269 F273 C274 S275 Q519 Y520 A523	F267-T271 PolarHBondContact O-N 3.38Å; F267-T271 PolarHBondContact O-OG1 3.15Å; G268-T271 WeakPolarHBondContact CA-OG1 3.5Å; G268-T271 PolarHBondContact O-N 3.13Å; G268-T271 PolarHBondContact O-OG1 2.8Å; M269-T271 VanDerWaalsContact C-N 3.33Å; M269-T271 PolarHBondContact O-N 3.18Å; T271-F273 VanDerWaalsContact C-N 3.32Å; T271-F273 PolarHBondContact O-N 3.22Å; T271-C274 PolarHBondContact O-N 2.7Å; T271-S275 WeakPolarHBondContact O-CB 3.4Å; T271-S275 PolarHBondContact O-N 2.77Å; T271-S275 PolarHBondContact O-OG 3.32Å; T271-Q519 HydrophobicContact CG2-CB 4.22Å; T271-Y520 HydrophobicContact CG2-CD1 3.4Å; T271-Y520 HydrophobicContact CG2-CE1 3.73Å; T271-Y520 HydrophobicContact CG2-CG 4.45Å; T271-A523 HydrophobicContact CG2-CB 4Å
272	K	94.8	Very high	94.5	Very high	70 Å²	70	21.4 Å²	21.4	30%	0.304	13%	0.129	S	C	.	.	H	α-helix	trans	-61.2	-40.1	175.2	-80.2	-175.9	172.1	-178.7	0	111.5	I193 D194 G268 M269 S275 H277 A278 F281	I193-K272 HydrophobicContact CG2-CD 4.08Å; D194-K272 IonicContact OD1-NZ 3.51Å; D194-K272 PolarHBondContact OD1-NZ 3.09Å; G268-K272 PolarHBondContact O-N 3.45Å; M269-K272 PolarHBondContact O-N 3.39Å; K272-S275 PolarHBondContact O-OG 3.37Å; K272-H277 PolarHBondContact O-N 3.04Å; K272-A278 HydrophobicContact CB-CB 4.29Å; K272-A278 PolarHBondContact O-N 3.07Å; K272-F281 HydrophobicContact CB-CE2 4.14Å
273	F	94.3	Very high	94.5	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-50.3	174	175.8	-95	0	0	0	112.3	M269 T271 S275 G276 A278 F281 M283 I527 I542 N543 I544	M269-F273 WeakPolarHBondContact O-CB 3.39Å; M269-F273 PolarHBondContact O-N 2.98Å; T271-F273 VanDerWaalsContact C-N 3.32Å; T271-F273 PolarHBondContact O-N 3.22Å; F273-S275 PolarHBondContact O-N 3.09Å; F273-G276 PolarHBondContact O-N 2.82Å; F273-A278 VanDerWaalsContact CD2-O 3.3Å; F273-A278 WeakPolarHBondContact CD2-O 3.39Å; F273-F281 HydrophobicContact CB-CD2 4.45Å; F273-F281 HydrophobicContact CD2-CB 4.12Å; F273-M283 HydrophobicContact CB-CE 3.21Å; F273-M283 HydrophobicContact CD1-CE 3.63Å; F273-M283 HydrophobicContact CD1-CG 4.4Å; F273-M283 HydrophobicContact CD2-CE 3.88Å; F273-M283 HydrophobicContact CE1-CE 4.41Å; F273-M283 HydrophobicContact CE1-CG 4.41Å; F273-M283 HydrophobicContact CG-CE 3.31Å; F273-M283 HydrophobicContact CZ-CB 4.47Å; F273-I527 HydrophobicContact CD1-CD1 4.39Å; F273-I527 HydrophobicContact CD1-CG1 4.49Å; F273-I527 HydrophobicContact CE1-CG1 4.41Å; F273-I542 HydrophobicContact CE1-CB 4.25Å; F273-I542 HydrophobicContact CE1-CD1 4.15Å; F273-N543 WeakPolarHBondContact CZ-O 3.42Å; F273-I544 HydrophobicContact CE1-CG2 4.31Å; F273-I544 HydrophobicContact CZ-CG2 4.4Å
274	C	93.5	Very high	94.5	Very high	12 Å²	12	21.4 Å²	21.4	8%	0.081	13%	0.129	C	C	.	.	H	α-helix	trans	-67.6	-19.5	-177.4	-76.5	0	0	0	0	114.9	V270 T271 G276 A523 I527	V270-C274 PolarHBondContact O-N 2.88Å; T271-C274 PolarHBondContact O-N 2.7Å; C274-G276 VanDerWaalsContact C-N 3.31Å; C274-A523 HydrophobicContact CB-CB 3.86Å; C274-A523 PolarHBondContact SG-O 3.39Å; C274-I527 VanDerWaalsContact SG-CG1 3.56Å
275	S	91.3	Very high	94.5	Very high	67 Å²	67	21.4 Å²	21.4	47%	0.469	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-3.5	173.2	54.6	0	0	0	0	113	T271 K272 F273 H277	T271-S275 WeakPolarHBondContact O-CB 3.4Å; T271-S275 PolarHBondContact O-N 2.77Å; T271-S275 PolarHBondContact O-OG 3.32Å; K272-S275 PolarHBondContact O-OG 3.37Å; F273-S275 PolarHBondContact O-N 3.09Å; S275-H277 VanDerWaalsContact C-N 3.27Å; S275-H277 VanDerWaalsContact CB-ND1 3.31Å; S275-H277 WeakPolarHBondContact CB-ND1 3.43Å; S275-H277 PolarHBondContact O-N 3.14Å; S275-H277 PolarHBondContact OG-ND1 3.18Å
276	G	87.5	Confident	94.6	Very high	42 Å²	42	20.2 Å²	20.2	43%	0.433	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	1.3	180	0	0	0	0	0	114.4	F273 C274 A278	F273-G276 PolarHBondContact O-N 2.82Å; C274-G276 VanDerWaalsContact C-N 3.31Å; G276-A278 VanDerWaalsContact C-N 3.32Å
277	H	88.1	Confident	94.7	Very high	127 Å²	127	20.2 Å²	20.2	59%	0.588	12%	0.123	S	C	*	.	S	Bend	trans	-75.3	-20.9	178.3	-64.5	93.8	0	0	0	112.7	C199 K272 S275	C199-H277 PolarHBondContact SG-O 2.87Å; K272-H277 PolarHBondContact O-N 3.04Å; S275-H277 VanDerWaalsContact C-N 3.27Å; S275-H277 VanDerWaalsContact CB-ND1 3.31Å; S275-H277 WeakPolarHBondContact CB-ND1 3.43Å; S275-H277 PolarHBondContact O-N 3.14Å; S275-H277 PolarHBondContact OG-ND1 3.18Å
278	A	91.4	Very high	94.7	Very high	5 Å²	5	20.2 Å²	20.2	4%	0.041	12%	0.123	C	C	.	.			trans	-141.4	67	179.7	0	0	0	0	0	111.9	K272 F273 G276 H280 F281	K272-A278 HydrophobicContact CB-CB 4.29Å; K272-A278 PolarHBondContact O-N 3.07Å; F273-A278 VanDerWaalsContact CD2-O 3.3Å; F273-A278 WeakPolarHBondContact CD2-O 3.39Å; G276-A278 VanDerWaalsContact C-N 3.32Å; A278-H280 PolarHBondContact O-N 2.6Å; A278-H280 VanDerWaalsContact O-N 3.17Å; A278-F281 HydrophobicContact CB-CD1 3.76Å; A278-F281 HydrophobicContact CB-CD2 3.71Å; A278-F281 HydrophobicContact CB-CE1 3.61Å; A278-F281 HydrophobicContact CB-CE2 3.54Å; A278-F281 HydrophobicContact CB-CG 3.83Å; A278-F281 HydrophobicContact CB-CZ 3.5Å; A278-F281 VanDerWaalsContact CB-CZ 3.5Å; A278-F281 PolarHBondContact O-N 2.78Å
279	P	91.1	Very high	94.8	Very high	27 Å²	27	19.3 Å²	19.3	18%	0.175	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-10.9	-172.5	31.2	-37.1	0	0	0	113.9	A202 V203 I208	A202-P279 HydrophobicContact CB-CG 4.11Å; V203-P279 HydrophobicContact CG2-CG 4.01Å; I208-P279 HydrophobicContact CD1-CB 3.56Å; I208-P279 HydrophobicContact CD1-CG 3.64Å
280	H	92.1	Very high	94.8	Very high	6 Å²	6	19.3 Å²	19.3	3%	0.028	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.7	177.7	62.7	-77.8	0	0	0	113.8	A202 I208 D212 S213 A278	A202-H280 HydrophobicContact CB-CB 3.77Å; I208-H280 HydrophobicContact CG2-CB 4.01Å; D212-H280 HydrophobicContact CB-CB 4.22Å; S213-H280 WeakPolarHBondContact CB-O 2.9Å; A278-H280 PolarHBondContact O-N 2.6Å; A278-H280 VanDerWaalsContact O-N 3.17Å
281	F	95.3	Very high	94.9	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.013	12%	0.115	C	C	.	.	S	Bend	trans	-60.5	132.9	-178	-75.9	-0.1	0	0	0	112	I193 L216 M269 K272 F273 A278 M283	I193-F281 HydrophobicContact CB-CZ 4.41Å; I193-F281 HydrophobicContact CG1-CZ 4.26Å; I193-F281 HydrophobicContact CG2-CZ 4.35Å; L216-F281 HydrophobicContact CD1-CD1 3.44Å; L216-F281 VanDerWaalsContact CD1-CD1 3.44Å; L216-F281 HydrophobicContact CD1-CE1 3.66Å; L216-F281 HydrophobicContact CD1-CG 4.46Å; M269-F281 HydrophobicContact CB-CD2 3.96Å; M269-F281 HydrophobicContact CB-CE2 3.96Å; M269-F281 HydrophobicContact CE-CD2 3.92Å; M269-F281 HydrophobicContact CE-CE2 4.02Å; M269-F281 HydrophobicContact CE-CG 4.18Å; M269-F281 HydrophobicContact CE-CZ 4.36Å; M269-F281 HydrophobicContact CG-CD2 4.43Å; M269-F281 HydrophobicContact CG-CE2 4.08Å; K272-F281 HydrophobicContact CB-CE2 4.14Å; F273-F281 HydrophobicContact CB-CD2 4.45Å; F273-F281 HydrophobicContact CD2-CB 4.12Å; A278-F281 HydrophobicContact CB-CD1 3.76Å; A278-F281 HydrophobicContact CB-CD2 3.71Å; A278-F281 HydrophobicContact CB-CE1 3.61Å; A278-F281 HydrophobicContact CB-CE2 3.54Å; A278-F281 HydrophobicContact CB-CG 3.83Å; A278-F281 HydrophobicContact CB-CZ 3.5Å; A278-F281 VanDerWaalsContact CB-CZ 3.5Å; A278-F281 PolarHBondContact O-N 2.78Å; F281-M283 VanDerWaalsContact C-N 3.3Å; F281-M283 HydrophobicContact CB-CE 4.28Å; F281-M283 PolarHBondContact O-N 3.19Å
282	P	95.7	Very high	94.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.105	C	C	.	.			trans	-78.2	80.1	-177.4	32.8	-36.2	0	0	0	110.7	L216 R217 L220 K284 K285 V286 D547	L216-P282 HydrophobicContact CB-CG 4.21Å; R217-P282 HydrophobicContact CG-CB 3.63Å; R217-P282 HydrophobicContact CG-CG 3.75Å; L220-P282 HydrophobicContact CD1-CG 3.54Å; P282-K284 VanDerWaalsContact C-N 3.29Å; P282-K284 PolarHBondContact O-N 2.89Å; P282-K285 HydrophobicContact CB-CB 4.5Å; P282-K285 HydrophobicContact CB-CD 4.27Å; P282-K285 PolarHBondContact O-N 2.97Å; P282-V286 PolarHBondContact O-N 3.15Å; P282-V286 VanDerWaalsContact O-N 3.16Å; P282-D547 HydrophobicContact CB-CB 3.96Å; P282-D547 WeakPolarHBondContact CB-OD1 3.33Å
283	M	96	Very high	95.1	Very high	3 Å²	3	14.5 Å²	14.5	2%	0.015	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-30.1	-163.1	-164.8	49.5	59.2	0	0	114.3	V270 F273 F281 K285 V286 L287 I527	V270-M283 HydrophobicContact CB-SD 4.47Å; V270-M283 HydrophobicContact CG2-SD 3.84Å; F273-M283 HydrophobicContact CB-CE 3.21Å; F273-M283 HydrophobicContact CD1-CE 3.63Å; F273-M283 HydrophobicContact CD1-CG 4.4Å; F273-M283 HydrophobicContact CD2-CE 3.88Å; F273-M283 HydrophobicContact CE1-CE 4.41Å; F273-M283 HydrophobicContact CE1-CG 4.41Å; F273-M283 HydrophobicContact CG-CE 3.31Å; F273-M283 HydrophobicContact CZ-CB 4.47Å; F281-M283 VanDerWaalsContact C-N 3.3Å; F281-M283 HydrophobicContact CB-CE 4.28Å; F281-M283 PolarHBondContact O-N 3.19Å; M283-K285 PolarHBondContact O-N 3.34Å; M283-V286 PolarHBondContact O-N 3.44Å; M283-V286 HydrophobicContact SD-CB 4.07Å; M283-V286 HydrophobicContact SD-CG1 4.17Å; M283-L287 HydrophobicContact CG-CD1 3.81Å; M283-L287 HydrophobicContact CG-CG 4.11Å; M283-L287 WeakPolarHBondContact O-CB 3.48Å; M283-L287 WeakPolarHBondContact O-CG 3.36Å; M283-L287 PolarHBondContact O-N 3.08Å; M283-L287 HydrophobicContact SD-CD1 4.31Å; M283-L287 HydrophobicContact SD-CD2 4.46Å; M283-L287 HydrophobicContact SD-CG 3.98Å; M283-I527 HydrophobicContact CG-CD1 3.72Å; M283-I527 HydrophobicContact CG-CG1 4.49Å; M283-I527 HydrophobicContact CG-CG2 4.4Å; M283-I527 HydrophobicContact SD-CD1 3.9Å
284	K	96.8	Very high	95.2	Very high	3 Å²	3	14.2 Å²	14.2	1%	0.013	9%	0.089	C	C	.	.	H	α-helix	trans	-58	-47.9	172	180	-167.8	64.2	155.6	0	111.3	E84 L85 P282 L287 L288 H570 V573 I574	E84-K284 PolarHBondContact O-NZ 2.95Å; L85-K284 WeakPolarHBondContact O-CE 3.47Å; L85-K284 PolarHBondContact O-NZ 3.4Å; P282-K284 VanDerWaalsContact C-N 3.29Å; P282-K284 PolarHBondContact O-N 2.89Å; K284-L287 PolarHBondContact O-N 3.03Å; K284-L288 HydrophobicContact CG-CD1 4.1Å; K284-L288 WeakPolarHBondContact O-CB 3.32Å; K284-L288 WeakPolarHBondContact O-CG 3.31Å; K284-L288 PolarHBondContact O-N 3.3Å; K284-H570 WeakPolarHBondContact CB-CE1 3.44Å; K284-H570 WeakPolarHBondContact CD-ND1 3.46Å; K284-V573 HydrophobicContact CD-CB 4.23Å; K284-V573 HydrophobicContact CD-CG1 3.94Å; K284-V573 HydrophobicContact CG-CB 4.33Å; K284-V573 HydrophobicContact CG-CG1 3.77Å; K284-I574 HydrophobicContact CB-CD1 4.47Å; K284-I574 HydrophobicContact CB-CG1 4.14Å
285	K	97.6	Very high	95.4	Very high	1 Å²	1	13.7 Å²	13.7	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-67.2	-42.3	-178.8	-63.9	178.4	175.4	68.5	0	111.5	L85 E90 R217 L220 N221 P282 M283 L287 L288 L289 D547	L85-K285 HydrophobicContact CD1-CG 4.35Å; E90-K285 VanDerWaalsContact CD-NZ 3.3Å; E90-K285 WeakPolarHBondContact OE1-CE 3.43Å; E90-K285 IonicContact OE1-NZ 2.68Å; E90-K285 PolarHBondContact OE1-NZ 3.29Å; E90-K285 IonicContact OE2-NZ 3.67Å; E90-K285 PolarHBondContact OE2-NZ 3.35Å; R217-K285 HydrophobicContact CB-CD 4.15Å; R217-K285 HydrophobicContact CG-CD 4Å; L220-K285 HydrophobicContact CB-CB 4.18Å; L220-K285 HydrophobicContact CD1-CB 4.23Å; N221-K285 WeakPolarHBondContact OD1-CD 3.17Å; N221-K285 WeakPolarHBondContact OD1-CE 3.47Å; P282-K285 HydrophobicContact CB-CB 4.5Å; P282-K285 HydrophobicContact CB-CD 4.27Å; P282-K285 PolarHBondContact O-N 2.97Å; M283-K285 PolarHBondContact O-N 3.34Å; K285-L287 PolarHBondContact O-N 3.43Å; K285-L288 PolarHBondContact O-N 3.28Å; K285-L289 VanDerWaalsContact O-CB 3.31Å; K285-L289 WeakPolarHBondContact O-CB 3.38Å; K285-L289 PolarHBondContact O-N 3.25Å; K285-D547 VanDerWaalsContact NZ-CG 3.26Å; K285-D547 IonicContact NZ-OD1 3.35Å; K285-D547 PolarHBondContact NZ-OD1 3.34Å; K285-D547 IonicContact NZ-OD2 3.92Å; K285-D547 PolarHBondContact NZ-OD2 3.1Å
286	V	98.4	Very high	95.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.9	-47.2	174.8	177	0	0	0	0	111.2	L220 L266 M269 V270 P282 M283 L289 L290	L220-V286 HydrophobicContact CD1-CG2 3.75Å; L220-V286 HydrophobicContact CD2-CG2 4.49Å; L266-V286 HydrophobicContact CD2-CG1 4.42Å; M269-V286 HydrophobicContact CB-CG1 3.98Å; M269-V286 HydrophobicContact CE-CG2 3.66Å; M269-V286 HydrophobicContact SD-CG1 4.24Å; M269-V286 HydrophobicContact SD-CG2 3.97Å; V270-V286 HydrophobicContact CG2-CG1 4.04Å; P282-V286 PolarHBondContact O-N 3.15Å; P282-V286 VanDerWaalsContact O-N 3.16Å; M283-V286 PolarHBondContact O-N 3.44Å; M283-V286 HydrophobicContact SD-CB 4.07Å; M283-V286 HydrophobicContact SD-CG1 4.17Å; V286-L289 PolarHBondContact O-N 2.95Å; V286-L290 VanDerWaalsContact O-CB 3.25Å; V286-L290 WeakPolarHBondContact O-CB 3.49Å; V286-L290 PolarHBondContact O-N 3.14Å
287	L	98.6	Very high	95.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-70.6	-38.1	-178.3	-70.6	170.4	0	0	0	113	V270 M283 K284 K285 L290 W291 L524 I527 I574 A577 I578	V270-L287 HydrophobicContact CG2-CD2 3.95Å; M283-L287 HydrophobicContact CG-CD1 3.81Å; M283-L287 HydrophobicContact CG-CG 4.11Å; M283-L287 WeakPolarHBondContact O-CB 3.48Å; M283-L287 WeakPolarHBondContact O-CG 3.36Å; M283-L287 PolarHBondContact O-N 3.08Å; M283-L287 HydrophobicContact SD-CD1 4.31Å; M283-L287 HydrophobicContact SD-CD2 4.46Å; M283-L287 HydrophobicContact SD-CG 3.98Å; K284-L287 PolarHBondContact O-N 3.03Å; K285-L287 PolarHBondContact O-N 3.43Å; L287-L290 PolarHBondContact O-N 3.03Å; L287-W291 WeakPolarHBondContact O-CB 3.49Å; L287-W291 PolarHBondContact O-N 3.2Å; L287-L524 HydrophobicContact CD2-CD2 3.72Å; L287-I527 HydrophobicContact CD1-CG2 4.01Å; L287-I574 HydrophobicContact CD1-CG1 4.35Å; L287-I574 HydrophobicContact CD1-CG2 3.94Å; L287-A577 HydrophobicContact CB-CB 3.99Å; L287-I578 HydrophobicContact CD1-CD1 3.9Å; L287-I578 HydrophobicContact CD1-CG1 3.86Å; L287-I578 HydrophobicContact CD2-CG1 4.05Å
288	L	98.3	Very high	96.3	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61.4	-50	172.7	-81.1	178.6	0	0	0	110.6	Y224 K284 K285 L290 W291 K292 V573 A577	Y224-L288 HydrophobicContact CD2-CB 4.01Å; Y224-L288 HydrophobicContact CE2-CB 3.67Å; Y224-L288 HydrophobicContact CE2-CG 4.5Å; K284-L288 HydrophobicContact CG-CD1 4.1Å; K284-L288 WeakPolarHBondContact O-CB 3.32Å; K284-L288 WeakPolarHBondContact O-CG 3.31Å; K284-L288 PolarHBondContact O-N 3.3Å; K285-L288 PolarHBondContact O-N 3.28Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 3.17Å; L288-W291 HydrophobicContact CD2-CE3 4.12Å; L288-W291 HydrophobicContact CD2-CZ3 4.35Å; L288-W291 WeakPolarHBondContact O-CB 3.1Å; L288-W291 PolarHBondContact O-N 3.36Å; L288-K292 WeakPolarHBondContact O-CG 3.46Å; L288-K292 PolarHBondContact O-N 3.19Å; L288-V573 HydrophobicContact CD1-CG1 3.85Å; L288-V573 HydrophobicContact CD2-CG1 3.79Å; L288-V573 HydrophobicContact CG-CG1 3.93Å; L288-A577 HydrophobicContact CD2-CB 4.36Å
289	L	98.6	Very high	96.4	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.6	-40.3	177.6	-177.4	56.7	0	0	0	112.1	L220 M223 Y224 V227 F262 L266 K285 V286 W291 K292 T293	L220-L289 HydrophobicContact CD2-CD2 3.67Å; M223-L289 HydrophobicContact CB-CD1 4.3Å; M223-L289 HydrophobicContact CB-CD2 3.81Å; Y224-L289 HydrophobicContact CD2-CB 4.44Å; V227-L289 HydrophobicContact CB-CD1 4.22Å; V227-L289 HydrophobicContact CG2-CD1 3.93Å; F262-L289 HydrophobicContact CE1-CD1 4.18Å; F262-L289 HydrophobicContact CE1-CD2 3.94Å; F262-L289 HydrophobicContact CE1-CG 3.95Å; F262-L289 HydrophobicContact CZ-CD2 3.76Å; F262-L289 HydrophobicContact CZ-CG 4.29Å; L266-L289 HydrophobicContact CD1-CB 4.35Å; L266-L289 HydrophobicContact CD1-CD2 4.34Å; L266-L289 HydrophobicContact CD1-CG 3.86Å; L266-L289 HydrophobicContact CD2-CD2 4.09Å; L266-L289 HydrophobicContact CD2-CG 4.44Å; K285-L289 VanDerWaalsContact O-CB 3.31Å; K285-L289 WeakPolarHBondContact O-CB 3.38Å; K285-L289 PolarHBondContact O-N 3.25Å; V286-L289 PolarHBondContact O-N 2.95Å; L289-W291 VanDerWaalsContact C-N 3.33Å; L289-W291 PolarHBondContact O-N 2.88Å; L289-K292 PolarHBondContact O-N 2.66Å; L289-T293 VanDerWaalsContact O-CB 3.27Å; L289-T293 WeakPolarHBondContact O-CB 3.39Å; L289-T293 PolarHBondContact O-N 3.01Å; L289-T293 PolarHBondContact O-OG1 2.98Å
290	L	98.8	Very high	96.5	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.013	C	C	.	.	H	α-helix	trans	-60.2	-45.8	175.4	174.2	60.2	0	0	0	111	A263 L266 F267 V286 L287 L288 T293 V294 V581	A263-L290 HydrophobicContact CB-CD1 4.2Å; L266-L290 HydrophobicContact CB-CB 4.15Å; L266-L290 HydrophobicContact CB-CD1 4.04Å; L266-L290 HydrophobicContact CD1-CB 4.02Å; L266-L290 HydrophobicContact CD1-CD1 4.38Å; F267-L290 HydrophobicContact CD1-CD2 4.08Å; F267-L290 HydrophobicContact CD2-CD1 3.73Å; F267-L290 HydrophobicContact CD2-CD2 4.35Å; F267-L290 HydrophobicContact CE1-CD2 3.86Å; F267-L290 HydrophobicContact CE2-CD1 3.6Å; F267-L290 HydrophobicContact CE2-CD2 4.15Å; F267-L290 HydrophobicContact CE2-CG 4.38Å; F267-L290 HydrophobicContact CG-CD1 4.38Å; F267-L290 HydrophobicContact CG-CD2 4.3Å; F267-L290 HydrophobicContact CZ-CD1 4.13Å; F267-L290 HydrophobicContact CZ-CD2 3.88Å; F267-L290 HydrophobicContact CZ-CG 4.45Å; V286-L290 VanDerWaalsContact O-CB 3.25Å; V286-L290 WeakPolarHBondContact O-CB 3.49Å; V286-L290 PolarHBondContact O-N 3.14Å; L287-L290 PolarHBondContact O-N 3.03Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 3.17Å; L290-T293 PolarHBondContact O-N 3.24Å; L290-V294 HydrophobicContact CD1-CG2 4.07Å; L290-V294 WeakPolarHBondContact O-CB 3.19Å; L290-V294 VanDerWaalsContact O-CG2 3.3Å; L290-V294 WeakPolarHBondContact O-CG2 3.16Å; L290-V294 PolarHBondContact O-N 3.33Å; L290-V581 HydrophobicContact CD2-CG1 4.43Å; L290-V581 HydrophobicContact CG-CG2 4.24Å
291	W	98.4	Very high	96.5	Very high	2 Å²	2	2.6 Å²	2.6	1%	0.008	2%	0.015	C	C	.	.	H	α-helix	trans	-59.9	-50.3	176.8	174.9	27.3	0	0	0	111.9	D74 L287 L288 L289 T293 V294 L295 K576 A577 A580 V581 F666	D74-W291 WeakPolarHBondContact O-CZ2 3.36Å; L287-W291 WeakPolarHBondContact O-CB 3.49Å; L287-W291 PolarHBondContact O-N 3.2Å; L288-W291 HydrophobicContact CD2-CE3 4.12Å; L288-W291 HydrophobicContact CD2-CZ3 4.35Å; L288-W291 WeakPolarHBondContact O-CB 3.1Å; L288-W291 PolarHBondContact O-N 3.36Å; L289-W291 VanDerWaalsContact C-N 3.33Å; L289-W291 PolarHBondContact O-N 2.88Å; W291-T293 VanDerWaalsContact C-N 3.33Å; W291-T293 PolarHBondContact O-N 3.1Å; W291-V294 PolarHBondContact O-N 2.82Å; W291-L295 WeakPolarHBondContact O-CB 3.47Å; W291-L295 PolarHBondContact O-N 3.2Å; W291-K576 HydrophobicContact CH2-CD 4.42Å; W291-K576 HydrophobicContact CH2-CG 4.28Å; W291-K576 HydrophobicContact CZ3-CD 4.37Å; W291-K576 HydrophobicContact CZ3-CG 4.22Å; W291-A577 HydrophobicContact CE3-CB 4.49Å; W291-A580 HydrophobicContact CD2-CB 3.92Å; W291-A580 HydrophobicContact CG-CB 4.04Å; W291-A580 HydrophobicContact CZ2-CB 3.81Å; W291-A580 VanDerWaalsContact NE1-CB 3.26Å; W291-V581 HydrophobicContact CB-CG2 3.7Å; W291-V581 HydrophobicContact CG-CG2 4.34Å; W291-F666 HydrophobicContact CH2-CE1 4.41Å; W291-F666 HydrophobicContact CZ2-CE1 4.19Å; W291-F666 HydrophobicContact CZ2-CZ 4.02Å
292	K	97.6	Very high	96.3	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-66.4	-34.9	-179.7	-59.2	-50.4	-175.5	137.6	0	112.5	T75 E81 Y224 V227 E228 L288 L289 L295 C296	T75-K292 VanDerWaalsContact CG2-NZ 3.32Å; E81-K292 VanDerWaalsContact OE2-CE 3.23Å; E81-K292 WeakPolarHBondContact OE2-CE 3.41Å; E81-K292 IonicContact OE2-NZ 2.88Å; E81-K292 PolarHBondContact OE2-NZ 3.32Å; Y224-K292 HydrophobicContact CD2-CG 4.22Å; Y224-K292 HydrophobicContact CE2-CG 3.53Å; Y224-K292 WeakPolarHBondContact OH-CE 3.44Å; V227-K292 HydrophobicContact CG1-CB 3.78Å; E228-K292 IonicContact OE1-NZ 2.71Å; E228-K292 PolarHBondContact OE1-NZ 3.13Å; E228-K292 WeakPolarHBondContact OE2-CD 3.19Å; E228-K292 WeakPolarHBondContact OE2-CE 3.48Å; E228-K292 IonicContact OE2-NZ 3.4Å; E228-K292 PolarHBondContact OE2-NZ 3.24Å; L288-K292 WeakPolarHBondContact O-CG 3.46Å; L288-K292 PolarHBondContact O-N 3.19Å; L289-K292 PolarHBondContact O-N 2.66Å; K292-L295 PolarHBondContact O-N 3.39Å; K292-C296 WeakPolarHBondContact O-CB 3.46Å; K292-C296 PolarHBondContact O-N 3.13Å
293	T	97.7	Very high	96.1	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63	-47.8	173.8	-58.5	0	0	0	0	111.1	F262 A263 L289 L290 W291 L295 C296 T297	F262-T293 HydrophobicContact CD1-CG2 3.75Å; A263-T293 HydrophobicContact CB-CG2 4.08Å; L289-T293 VanDerWaalsContact O-CB 3.27Å; L289-T293 WeakPolarHBondContact O-CB 3.39Å; L289-T293 PolarHBondContact O-N 3.01Å; L289-T293 PolarHBondContact O-OG1 2.98Å; L290-T293 PolarHBondContact O-N 3.24Å; W291-T293 VanDerWaalsContact C-N 3.33Å; W291-T293 PolarHBondContact O-N 3.1Å; T293-L295 VanDerWaalsContact C-N 3.32Å; T293-L295 PolarHBondContact O-N 2.89Å; T293-C296 PolarHBondContact O-N 2.92Å; T293-T297 HydrophobicContact CG2-CG2 4.47Å; T293-T297 WeakPolarHBondContact O-CB 3.44Å; T293-T297 WeakPolarHBondContact O-CG2 3.4Å; T293-T297 PolarHBondContact O-N 2.92Å; T293-T297 PolarHBondContact O-OG1 2.86Å
294	V	97.5	Very high	96	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-39.2	177.3	171.3	0	0	0	0	111.1	A263 L290 W291 T297 L298 L584 L585	A263-V294 HydrophobicContact CB-CG2 4.45Å; L290-V294 HydrophobicContact CD1-CG2 4.07Å; L290-V294 WeakPolarHBondContact O-CB 3.19Å; L290-V294 VanDerWaalsContact O-CG2 3.3Å; L290-V294 WeakPolarHBondContact O-CG2 3.16Å; L290-V294 PolarHBondContact O-N 3.33Å; W291-V294 PolarHBondContact O-N 2.82Å; V294-T297 PolarHBondContact O-OG1 3.21Å; V294-L298 HydrophobicContact CG1-CD1 3.8Å; V294-L298 HydrophobicContact CG1-CG 4.29Å; V294-L298 WeakPolarHBondContact O-CB 3.32Å; V294-L298 WeakPolarHBondContact O-CG 3.46Å; V294-L298 PolarHBondContact O-N 2.55Å; V294-L584 HydrophobicContact CG1-CB 4.2Å; V294-L584 HydrophobicContact CG1-CD1 4.4Å; V294-L585 HydrophobicContact CG1-CD2 4.06Å
295	L	96.2	Very high	95.8	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-66.7	-44.9	177.5	-175	65.2	0	0	0	111.8	D74 T75 H231 W291 K292 T293 G299 L584	D74-L295 HydrophobicContact CB-CD1 4.05Å; D74-L295 HydrophobicContact CB-CD2 4.28Å; T75-L295 HydrophobicContact CG2-CD2 3.6Å; H231-L295 WeakPolarHBondContact NE2-CD2 3.15Å; W291-L295 WeakPolarHBondContact O-CB 3.47Å; W291-L295 PolarHBondContact O-N 3.2Å; K292-L295 PolarHBondContact O-N 3.39Å; T293-L295 VanDerWaalsContact C-N 3.32Å; T293-L295 PolarHBondContact O-N 2.89Å; L295-G299 CarbonylContact O-C 3.53Å; L295-G299 WeakPolarHBondContact O-CA 3.46Å; L295-G299 PolarHBondContact O-N 2.92Å; L295-L584 HydrophobicContact CB-CD1 4.3Å; L295-L584 HydrophobicContact CD1-CD1 4.07Å; L295-L584 HydrophobicContact CD1-CD2 4.27Å
296	C	95.6	Very high	95.6	Very high	5 Å²	5	19.7 Å²	19.7	3%	0.034	10%	0.104	C	C	.	.	H	α-helix	trans	-65.6	-43.7	179.1	-174.5	0	0	0	0	111.8	V227 H231 R249 K292 T293	V227-C296 HydrophobicContact CG1-CB 4.23Å; H231-C296 HydrophobicContact CB-CB 4.4Å; R249-C296 VanDerWaalsContact CD-O 3.23Å; R249-C296 WeakPolarHBondContact CD-O 3.37Å; R249-C296 WeakPolarHBondContact CG-O 3.24Å; R249-C296 PolarHBondContact NE-O 2.84Å; K292-C296 WeakPolarHBondContact O-CB 3.46Å; K292-C296 PolarHBondContact O-N 3.13Å; T293-C296 PolarHBondContact O-N 2.92Å
297	T	95.3	Very high	95.4	Very high	9 Å²	9	22.8 Å²	22.8	6%	0.055	12%	0.119	C	C	.	.	H	α-helix	trans	-73.5	-52.8	-178.1	51	0	0	0	0	112.5	R249 L252 T293 V294	R249-T297 PolarHBondContact NE-O 3.05Å; R249-T297 PolarHBondContact NH2-O 2.71Å; L252-T297 HydrophobicContact CB-CG2 3.61Å; T293-T297 HydrophobicContact CG2-CG2 4.47Å; T293-T297 WeakPolarHBondContact O-CB 3.44Å; T293-T297 WeakPolarHBondContact O-CG2 3.4Å; T293-T297 PolarHBondContact O-N 2.92Å; T293-T297 PolarHBondContact O-OG1 2.86Å; V294-T297 PolarHBondContact O-OG1 3.21Å
298	L	95.4	Very high	95.2	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-85.4	-22.7	-174.2	-52.7	-173.5	0	0	0	113.7	V294 P505 A506 L509 L585 H588	V294-L298 HydrophobicContact CG1-CD1 3.8Å; V294-L298 HydrophobicContact CG1-CG 4.29Å; V294-L298 WeakPolarHBondContact O-CB 3.32Å; V294-L298 WeakPolarHBondContact O-CG 3.46Å; V294-L298 PolarHBondContact O-N 2.55Å; L298-P505 HydrophobicContact CD2-CB 3.96Å; L298-A506 HydrophobicContact CD2-CB 4.14Å; L298-L509 HydrophobicContact CD1-CD2 3.88Å; L298-L509 HydrophobicContact CD2-CD2 4.31Å; L298-L509 HydrophobicContact CG-CD2 4.38Å; L298-L585 HydrophobicContact CD1-CD2 4.19Å; L298-H588 WeakPolarHBondContact CB-NE2 3.39Å; L298-H588 HydrophobicContact CD1-CB 3.82Å; L298-H588 PolarHBondContact O-CE1 2.88Å; L298-H588 PolarHBondContact O-NE2 2.64Å
299	G	94.3	Very high	95.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.			trans	92.3	159.5	-176	0	0	0	0	0	114.4	L295 E303 H588	L295-G299 CarbonylContact O-C 3.53Å; L295-G299 WeakPolarHBondContact O-CA 3.46Å; L295-G299 PolarHBondContact O-N 2.92Å; G299-E303 WeakPolarHBondContact CA-OE2 3.45Å; G299-H588 PolarHBondContact O-CE1 3.07Å; G299-H588 PolarHBondContact O-NE2 3.25Å
300	G	93.4	Very high	94.9	Very high	5 Å²	5	34.6 Å²	34.6	5%	0.052	18%	0.181	C	C	.	.			trans	-76.4	-170.9	178.6	0	0	0	0	0	114.9	E302 L304	G300-E302 VanDerWaalsContact C-N 3.35Å; G300-E302 PolarHBondContact O-N 3.45Å; G300-L304 VanDerWaalsContact O-CB 3.26Å; G300-L304 WeakPolarHBondContact O-CB 3.33Å; G300-L304 PolarHBondContact O-N 3.27Å
301	F	91.5	Very high	94.6	Very high	16 Å²	16	37.1 Å²	37.1	7%	0.07	19%	0.192	C	C	.	.	H	α-helix	trans	-68.5	-30.9	-179.2	-65.2	-42.1	0	0	0	113.9	Y72 D74 Q305 I325 L583 L584 K587 R673	Y72-F301 AromaticContact CE1-CD2 3.89Å; Y72-F301 HydrophobicContact CE1-CD2 3.89Å; Y72-F301 AromaticContact CE1-CE2 3.46Å; Y72-F301 HydrophobicContact CE1-CE2 3.46Å; Y72-F301 VanDerWaalsContact CE1-CE2 3.46Å; Y72-F301 HydrophobicContact CE1-CZ 4.33Å; Y72-F301 AromaticContact CZ-CE2 3.76Å; Y72-F301 WeakPolarHBondContact OH-CE2 3.48Å; Y72-F301 WeakPolarHBondContact OH-CZ 3.27Å; D74-F301 VanDerWaalsContact CG-CD2 3.48Å; D74-F301 WeakPolarHBondContact OD1-CD2 3.37Å; D74-F301 WeakPolarHBondContact OD1-CE2 3.37Å; D74-F301 VanDerWaalsContact OD1-CG 3.3Å; D74-F301 WeakPolarHBondContact OD1-CG 3.27Å; D74-F301 PolarHBondContact OD1-N 3.41Å; D74-F301 PolarHBondContact OD2-N 3.27Å; F301-Q305 PolarHBondContact O-N 3.25Å; F301-I325 HydrophobicContact CB-CD1 4.02Å; F301-I325 HydrophobicContact CG-CD1 4.39Å; F301-L583 HydrophobicContact CE1-CD2 4.48Å; F301-L583 HydrophobicContact CZ-CD2 4.01Å; F301-L583 HydrophobicContact CZ-CG 4.44Å; F301-L584 HydrophobicContact CD1-CD2 4.36Å; F301-L584 HydrophobicContact CE1-CD2 3.94Å; F301-L584 HydrophobicContact CZ-CD2 4.46Å; F301-K587 HydrophobicContact CD1-CD 3.85Å; F301-K587 HydrophobicContact CE1-CD 3.56Å; F301-R673 VanDerWaalsContact CZ-NH1 3.32Å
302	E	90.6	Very high	94.5	Very high	151 Å²	151	37.3 Å²	37.3	71%	0.706	19%	0.193	S	C	*	.	H	α-helix	trans	-71.5	-49.9	175.9	-62.3	-160.1	151.5	0	0	111.2	G300 L304 Q305 S306	G300-E302 VanDerWaalsContact C-N 3.35Å; G300-E302 PolarHBondContact O-N 3.45Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.04Å; E302-Q305 WeakPolarHBondContact O-CA 3.37Å; E302-Q305 WeakPolarHBondContact O-CB 3.11Å; E302-Q305 PolarHBondContact O-N 2.97Å; E302-S306 PolarHBondContact O-N 3.35Å; E302-S306 PolarHBondContact O-OG 3.42Å
303	E	92.6	Very high	94.4	Very high	69 Å²	69	42.5 Å²	42.5	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-55.1	-46.7	173.4	-71.1	174.1	-118.9	0	0	111.5	R249 G299 Q305 S306 M307	R249-E303 IonicContact CZ-OE2 3.31Å; R249-E303 VanDerWaalsContact CZ-OE2 3.27Å; R249-E303 IonicContact NH1-OE1 2.84Å; R249-E303 IonicContact NH1-OE2 3.1Å; R249-E303 PolarHBondContact NH1-OE2 2.73Å; R249-E303 IonicContact NH2-OE2 3.82Å; R249-E303 PolarHBondContact NH2-OE2 2.83Å; G299-E303 WeakPolarHBondContact CA-OE2 3.45Å; E303-Q305 PolarHBondContact O-N 3.45Å; E303-S306 WeakPolarHBondContact O-CB 3.12Å; E303-S306 PolarHBondContact O-N 3.25Å; E303-S306 VanDerWaalsContact O-N 3.11Å; E303-M307 WeakPolarHBondContact O-CG 3.48Å; E303-M307 PolarHBondContact O-N 3.2Å
304	L	93.4	Very high	94.2	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-56.8	-37.4	175.2	178.5	80.6	0	0	0	112.6	G300 E302 M307 K308 K587 H588 L591	G300-L304 VanDerWaalsContact O-CB 3.26Å; G300-L304 WeakPolarHBondContact O-CB 3.33Å; G300-L304 PolarHBondContact O-N 3.27Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.04Å; L304-M307 HydrophobicContact CB-CE 4.33Å; L304-M307 HydrophobicContact CD1-CE 4.2Å; L304-K308 VanDerWaalsContact O-CB 3.25Å; L304-K308 WeakPolarHBondContact O-CB 3.39Å; L304-K308 PolarHBondContact O-N 3.35Å; L304-K587 HydrophobicContact CD2-CB 3.66Å; L304-K587 HydrophobicContact CD2-CD 3.79Å; L304-K587 HydrophobicContact CD2-CG 4.15Å; L304-H588 VanDerWaalsContact CD1-ND1 3.27Å; L304-H588 WeakPolarHBondContact CD1-ND1 3.46Å; L304-L591 HydrophobicContact CD1-CB 4.19Å; L304-L591 HydrophobicContact CD1-CD2 3.67Å; L304-L591 HydrophobicContact CG-CD2 4.49Å
305	Q	92.3	Very high	94	Very high	52 Å²	52	52.2 Å²	52.2	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-71.9	-37.2	179.1	-179	61.3	20	0	0	111.2	F301 E302 E303 K308 A309	F301-Q305 PolarHBondContact O-N 3.25Å; E302-Q305 WeakPolarHBondContact O-CA 3.37Å; E302-Q305 WeakPolarHBondContact O-CB 3.11Å; E302-Q305 PolarHBondContact O-N 2.97Å; E303-Q305 PolarHBondContact O-N 3.45Å; Q305-K308 PolarHBondContact O-N 3.37Å; Q305-A309 PolarHBondContact O-N 3.07Å
306	S	93.7	Very high	93.9	Very high	81 Å²	81	55.5 Å²	55.5	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-63.8	-51.3	171.9	-62.3	0	0	0	0	111.7	E302 E303 K308 A309 E310	E302-S306 PolarHBondContact O-N 3.35Å; E302-S306 PolarHBondContact O-OG 3.42Å; E303-S306 WeakPolarHBondContact O-CB 3.12Å; E303-S306 PolarHBondContact O-N 3.25Å; E303-S306 VanDerWaalsContact O-N 3.11Å; S306-K308 PolarHBondContact O-N 2.81Å; S306-A309 WeakPolarHBondContact O-CA 3.11Å; S306-A309 WeakPolarHBondContact O-CB 3.37Å; S306-A309 PolarHBondContact O-N 3.27Å; S306-E310 PolarHBondContact O-N 2.95Å
307	M	94.7	Very high	93.8	Very high	66 Å²	66	56.5 Å²	56.5	33%	0.325	32%	0.315	S	S	.	.	H	α-helix	trans	-56.5	-36.8	175.3	-68.2	-169.5	-64.8	0	0	111.9	E303 L304 K311 H588 L591	E303-M307 WeakPolarHBondContact O-CG 3.48Å; E303-M307 PolarHBondContact O-N 3.2Å; L304-M307 HydrophobicContact CB-CE 4.33Å; L304-M307 HydrophobicContact CD1-CE 4.2Å; M307-K311 WeakPolarHBondContact O-CB 3.43Å; M307-K311 PolarHBondContact O-N 3.03Å; M307-H588 VanDerWaalsContact CE-CE1 3.48Å; M307-H588 WeakPolarHBondContact CE-CE1 3.23Å; M307-L591 HydrophobicContact CB-CD2 3.74Å; M307-L591 HydrophobicContact CE-CD2 4.3Å
308	K	94.3	Very high	93.6	Very high	59 Å²	59	60.2 Å²	60.2	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-36.5	175.4	-175.3	-177.7	176.1	-159.3	0	112.7	L304 Q305 S306 R312 L320 I478 L591	L304-K308 VanDerWaalsContact O-CB 3.25Å; L304-K308 WeakPolarHBondContact O-CB 3.39Å; L304-K308 PolarHBondContact O-N 3.35Å; Q305-K308 PolarHBondContact O-N 3.37Å; S306-K308 PolarHBondContact O-N 2.81Å; K308-R312 VanDerWaalsContact O-CG 3.24Å; K308-R312 WeakPolarHBondContact O-CG 3.31Å; K308-R312 PolarHBondContact O-N 3.13Å; K308-R312 VanDerWaalsContact O-N 3.17Å; K308-L320 HydrophobicContact CD-CD1 4.04Å; K308-L320 HydrophobicContact CG-CD1 4.43Å; K308-I478 HydrophobicContact CG-CD1 3.93Å; K308-L591 HydrophobicContact CB-CD1 3.9Å; K308-L591 HydrophobicContact CB-CD2 4.31Å; K308-L591 HydrophobicContact CG-CD1 4.02Å
309	A	94.5	Very high	93.3	Very high	48 Å²	48	65.4 Å²	65.4	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-68.4	-41.9	176.1	0	0	0	0	0	111	Q305 S306 R312 T313	Q305-A309 PolarHBondContact O-N 3.07Å; S306-A309 WeakPolarHBondContact O-CA 3.11Å; S306-A309 WeakPolarHBondContact O-CB 3.37Å; S306-A309 PolarHBondContact O-N 3.27Å; A309-R312 PolarHBondContact O-N 3.46Å; A309-T313 PolarHBondContact O-N 3.48Å; A309-T313 VanDerWaalsContact O-N 3.11Å; A309-T313 PolarHBondContact O-OG1 2.96Å
310	E	94.5	Very high	92.8	Very high	140 Å²	140	67.1 Å²	67.1	65%	0.654	38%	0.382	S	S	*	.	H	α-helix	trans	-60.7	-52.4	174.7	-176.7	176.5	-167.5	0	0	111.8	S306 R312 T313 L314	S306-E310 PolarHBondContact O-N 2.95Å; E310-R312 PolarHBondContact O-N 3.36Å; E310-R312 VanDerWaalsContact O-N 3.17Å; E310-T313 WeakPolarHBondContact O-CA 3.3Å; E310-T313 VanDerWaalsContact O-CB 3.31Å; E310-T313 WeakPolarHBondContact O-CB 3.5Å; E310-T313 PolarHBondContact O-N 2.84Å; E310-L314 PolarHBondContact O-N 3.5Å
311	K	94.4	Very high	92.1	Very high	53 Å²	53	70.7 Å²	70.7	23%	0.23	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-29.9	177.8	-168.9	163.2	-171	164.3	0	113.1	M307 L315 I478 L591 N592	M307-K311 WeakPolarHBondContact O-CB 3.43Å; M307-K311 PolarHBondContact O-N 3.03Å; K311-L315 HydrophobicContact CG-CD1 4.28Å; K311-L315 WeakPolarHBondContact O-CB 3.47Å; K311-L315 VanDerWaalsContact O-CG 3.27Å; K311-L315 WeakPolarHBondContact O-CG 3.38Å; K311-L315 PolarHBondContact O-N 3.46Å; K311-I478 HydrophobicContact CB-CD1 4.29Å; K311-I478 HydrophobicContact CD-CG2 4.33Å; K311-I478 HydrophobicContact CG-CD1 4.28Å; K311-L591 HydrophobicContact CB-CD1 4.47Å; K311-L591 HydrophobicContact CD-CD1 4.03Å; K311-L591 HydrophobicContact CD-CG 4.47Å; K311-L591 WeakPolarHBondContact CE-O 3.46Å; K311-L591 PolarHBondContact NZ-O 3.34Å; K311-N592 PolarHBondContact NZ-O 3.2Å
312	R	94.9	Very high	91.7	Very high	6 Å²	6	71.7 Å²	71.7	2%	0.023	41%	0.409	C	S	.	.	H	α-helix	trans	-68.7	-39.4	172.1	-75.7	179.6	74.4	73.8	-2.8	112.1	K308 A309 E310 L315 G316 L317 P318 T476 I478	K308-R312 VanDerWaalsContact O-CG 3.24Å; K308-R312 WeakPolarHBondContact O-CG 3.31Å; K308-R312 PolarHBondContact O-N 3.13Å; K308-R312 VanDerWaalsContact O-N 3.17Å; A309-R312 PolarHBondContact O-N 3.46Å; E310-R312 PolarHBondContact O-N 3.36Å; E310-R312 VanDerWaalsContact O-N 3.17Å; R312-L315 CarbonylContact O-C 3.59Å; R312-L315 PolarHBondContact O-N 2.9Å; R312-G316 PolarHBondContact O-N 2.72Å; R312-L317 HydrophobicContact CB-CB 4.15Å; R312-L317 HydrophobicContact CG-CB 4.4Å; R312-L317 HydrophobicContact CG-CD1 4.39Å; R312-L317 WeakPolarHBondContact O-CB 3.41Å; R312-L317 PolarHBondContact O-N 2.85Å; R312-P318 PolarHBondContact NE-O 3.47Å; R312-P318 PolarHBondContact NH2-O 3.5Å; R312-T476 PolarHBondContact NH1-O 2.81Å; R312-I478 HydrophobicContact CG-CD1 3.93Å; R312-I478 HydrophobicContact CG-CG1 4.01Å
313	T	95.6	Very high	91.4	Very high	110 Å²	110	66.3 Å²	66.3	68%	0.675	39%	0.385	S	S	*	.	H	α-helix	trans	-65.2	-44.9	177.9	-53	0	0	0	0	110.4	A309 E310 L315 G316	A309-T313 PolarHBondContact O-N 3.48Å; A309-T313 VanDerWaalsContact O-N 3.11Å; A309-T313 PolarHBondContact O-OG1 2.96Å; E310-T313 WeakPolarHBondContact O-CA 3.3Å; E310-T313 VanDerWaalsContact O-CB 3.31Å; E310-T313 WeakPolarHBondContact O-CB 3.5Å; E310-T313 PolarHBondContact O-N 2.84Å; T313-L315 VanDerWaalsContact C-N 3.29Å; T313-L315 PolarHBondContact O-N 3.32Å; T313-G316 PolarHBondContact O-N 3.44Å
314	L	93.8	Very high	90.9	Very high	148 Å²	148	65.2 Å²	65.2	78%	0.775	39%	0.385	S	S	*	.	H	α-helix	trans	-56	-42.5	174.3	-169.7	96.2	0	0	0	112.2	E310 G316	E310-L314 PolarHBondContact O-N 3.5Å; L314-G316 PolarHBondContact O-N 2.89Å
315	L	93.6	Very high	90.3	Very high	56 Å²	56	66.5 Å²	66.5	29%	0.293	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	7.7	179.3	-64.8	173.5	0	0	0	113.9	K311 R312 T313 L317 I478 V481	K311-L315 HydrophobicContact CG-CD1 4.28Å; K311-L315 WeakPolarHBondContact O-CB 3.47Å; K311-L315 VanDerWaalsContact O-CG 3.27Å; K311-L315 WeakPolarHBondContact O-CG 3.38Å; K311-L315 PolarHBondContact O-N 3.46Å; R312-L315 CarbonylContact O-C 3.59Å; R312-L315 PolarHBondContact O-N 2.9Å; T313-L315 VanDerWaalsContact C-N 3.29Å; T313-L315 PolarHBondContact O-N 3.32Å; L315-L317 HydrophobicContact CB-CD1 4.2Å; L315-L317 HydrophobicContact CB-CG 4.02Å; L315-L317 HydrophobicContact CD1-CD1 4.42Å; L315-L317 PolarHBondContact O-N 2.73Å; L315-I478 HydrophobicContact CD1-CG1 4.39Å; L315-I478 HydrophobicContact CD1-CG2 3.99Å; L315-V481 HydrophobicContact CD1-CG1 4.34Å; L315-V481 HydrophobicContact CD2-CG1 4.26Å
316	G	94.3	Very high	89.8	Confident	69 Å²	69	70.1 Å²	70.1	71%	0.711	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	21.1	-178.7	0	0	0	0	0	114.5	R312 T313 L314	R312-G316 PolarHBondContact O-N 2.72Å; T313-G316 PolarHBondContact O-N 3.44Å; L314-G316 PolarHBondContact O-N 2.89Å
317	L	93.9	Very high	89.3	Confident	27 Å²	27	67.5 Å²	67.5	14%	0.141	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-86.7	148.2	-178.4	-62.5	178	0	0	0	111.5	R312 L315 T476 I478 V481	R312-L317 HydrophobicContact CB-CB 4.15Å; R312-L317 HydrophobicContact CG-CB 4.4Å; R312-L317 HydrophobicContact CG-CD1 4.39Å; R312-L317 WeakPolarHBondContact O-CB 3.41Å; R312-L317 PolarHBondContact O-N 2.85Å; L315-L317 HydrophobicContact CB-CD1 4.2Å; L315-L317 HydrophobicContact CB-CG 4.02Å; L315-L317 HydrophobicContact CD1-CD1 4.42Å; L315-L317 PolarHBondContact O-N 2.73Å; L317-T476 HydrophobicContact CD2-CG2 4.17Å; L317-I478 HydrophobicContact CD1-CG1 4.32Å; L317-V481 HydrophobicContact CD1-CG2 4.15Å; L317-V481 HydrophobicContact CD2-CG2 4.28Å
318	P	90.7	Very high	88.7	Confident	86 Å²	86	64.5 Å²	64.5	56%	0.558	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-59	152.3	177.1	-20.5	30.1	0	0	0	112.3	R312	R312-P318 PolarHBondContact NE-O 3.47Å; R312-P318 PolarHBondContact NH2-O 3.5Å
319	P	88.1	Confident	87.9	Confident	117 Å²	117	69.4 Å²	69.4	76%	0.76	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-58.9	155	174	25.9	-34	0	0	0	111.1
320	L	83.4	Confident	87.2	Confident	36 Å²	36	73.8 Å²	73.8	19%	0.188	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-69.4	134.7	176.1	-67.9	171.3	0	0	0	109.2	K308 E322 Y475	K308-L320 HydrophobicContact CD-CD1 4.04Å; K308-L320 HydrophobicContact CG-CD1 4.43Å; L320-E322 PolarHBondContact O-N 3.5Å; L320-Y475 HydrophobicContact CD2-CE2 3.88Å
321	P	78.7	Confident	86.5	Confident	79 Å²	79	68.5 Å²	68.5	51%	0.513	38%	0.382	S	S	.	.	S	Bend	trans	-66.9	-27.8	-178.1	24.7	-33.5	0	0	0	112.8	A425	P321-A425 HydrophobicContact CB-CB 3.9Å; P321-A425 HydrophobicContact CG-CB 4Å
322	E	83.5	Confident	85.6	Confident	37 Å²	37	75.6 Å²	75.6	17%	0.173	41%	0.407	C	S	.	.			trans	-157.8	148.7	-177.3	65.4	-150.2	-170.5	0	0	112.1	L320 V327 W424 A425 R744	L320-E322 PolarHBondContact O-N 3.5Å; E322-V327 HydrophobicContact CB-CG2 4.03Å; E322-V327 HydrophobicContact CG-CG2 4.38Å; E322-W424 WeakPolarHBondContact OE1-CA 3.33Å; E322-A425 PolarHBondContact OE1-N 3.18Å; E322-A425 PolarHBondContact OE2-N 2.86Å; E322-R744 IonicContact OE1-CZ 2.66Å; E322-R744 IonicContact OE1-NE 3.34Å; E322-R744 IonicContact OE1-NH2 3.42Å; E322-R744 PolarHBondContact OE1-NH2 2.85Å
323	D	83.9	Confident	84.8	Confident	39 Å²	39	76.2 Å²	76.2	21%	0.209	41%	0.413	C	S	.	.			trans	-83.3	115	167	-177.8	-15.8	0	0	0	109.5	I325 K326 V327	D323-I325 VanDerWaalsContact C-N 3.3Å; D323-I325 PolarHBondContact O-N 3Å; D323-I325 PolarHBondContact OD1-N 3.5Å; D323-K326 HydrophobicContact CB-CB 4.07Å; D323-K326 HydrophobicContact CB-CD 4.08Å; D323-K326 HydrophobicContact CB-CG 4.13Å; D323-K326 PolarHBondContact O-N 2.92Å; D323-K326 WeakPolarHBondContact OD2-CD 3.32Å; D323-K326 WeakPolarHBondContact OD2-CE 3.4Å; D323-K326 WeakPolarHBondContact OD2-CG 3.34Å; D323-V327 VanDerWaalsContact O-CG2 3.27Å; D323-V327 WeakPolarHBondContact O-CG2 3.38Å; D323-V327 PolarHBondContact O-N 3.36Å
324	S	81.9	Confident	83.6	Confident	45 Å²	45	71.6 Å²	71.6	32%	0.315	39%	0.387	S	S	.	.	H	α-helix	trans	-63.5	-33.2	-177.4	-59.1	0	0	0	0	113	I328	S324-I328 WeakPolarHBondContact O-CB 3.34Å; S324-I328 WeakPolarHBondContact O-CD1 3.49Å; S324-I328 WeakPolarHBondContact O-CG1 3.35Å; S324-I328 PolarHBondContact O-N 3.32Å; S324-I328 VanDerWaalsContact O-N 3.08Å
325	I	81.3	Confident	82.3	Confident	42 Å²	42	69.4 Å²	69.4	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-71.8	-46.3	-178.8	-64.2	176.4	0	0	0	109.5	F301 D323 V327 I328 R329 M708	F301-I325 HydrophobicContact CB-CD1 4.02Å; F301-I325 HydrophobicContact CG-CD1 4.39Å; D323-I325 VanDerWaalsContact C-N 3.3Å; D323-I325 PolarHBondContact O-N 3Å; D323-I325 PolarHBondContact OD1-N 3.5Å; I325-V327 PolarHBondContact O-N 3.49Å; I325-I328 PolarHBondContact O-N 2.93Å; I325-R329 PolarHBondContact O-N 2.82Å; I325-M708 HydrophobicContact CG2-CE 4.3Å
326	K	82	Confident	80.6	Confident	129 Å²	129	68.8 Å²	68.8	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-61.4	-43.2	176.6	-66.3	-178.5	-176.2	-175.5	0	112.3	D323 I328 R329 N330	D323-K326 HydrophobicContact CB-CB 4.07Å; D323-K326 HydrophobicContact CB-CD 4.08Å; D323-K326 HydrophobicContact CB-CG 4.13Å; D323-K326 PolarHBondContact O-N 2.92Å; D323-K326 WeakPolarHBondContact OD2-CD 3.32Å; D323-K326 WeakPolarHBondContact OD2-CE 3.4Å; D323-K326 WeakPolarHBondContact OD2-CG 3.34Å; K326-I328 PolarHBondContact O-N 3.22Å; K326-R329 PolarHBondContact O-N 3.33Å; K326-N330 PolarHBondContact O-N 3.39Å
327	V	83.1	Confident	78.8	Confident	26 Å²	26	66.2 Å²	66.2	16%	0.158	35%	0.354	C	S	.	.	H	α-helix	trans	-59.6	-47.2	175	171.7	0	0	0	0	110.9	E322 D323 I325 R329 N330 M331 P423 W424	E322-V327 HydrophobicContact CB-CG2 4.03Å; E322-V327 HydrophobicContact CG-CG2 4.38Å; D323-V327 VanDerWaalsContact O-CG2 3.27Å; D323-V327 WeakPolarHBondContact O-CG2 3.38Å; D323-V327 PolarHBondContact O-N 3.36Å; I325-V327 PolarHBondContact O-N 3.49Å; V327-R329 VanDerWaalsContact C-N 3.32Å; V327-R329 PolarHBondContact O-N 3.1Å; V327-N330 PolarHBondContact O-N 3.09Å; V327-N330 VanDerWaalsContact O-N 3.17Å; V327-M331 WeakPolarHBondContact O-CG 3.39Å; V327-M331 PolarHBondContact O-N 2.78Å; V327-P423 HydrophobicContact CG1-CB 3.73Å; V327-P423 HydrophobicContact CG1-CG 3.67Å; V327-W424 HydrophobicContact CB-CH2 4.32Å; V327-W424 HydrophobicContact CB-CZ3 3.86Å; V327-W424 HydrophobicContact CG1-CE3 3.88Å; V327-W424 HydrophobicContact CG1-CH2 3.67Å; V327-W424 HydrophobicContact CG1-CZ2 4.34Å; V327-W424 HydrophobicContact CG1-CZ3 3.4Å; V327-W424 VanDerWaalsContact CG1-CZ3 3.4Å
328	I	83.4	Confident	76.7	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.015	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-40.2	-179.4	-68.4	164.2	0	0	0	111.8	S324 I325 K326 N330 M331 W424 M708 L711	S324-I328 WeakPolarHBondContact O-CB 3.34Å; S324-I328 WeakPolarHBondContact O-CD1 3.49Å; S324-I328 WeakPolarHBondContact O-CG1 3.35Å; S324-I328 PolarHBondContact O-N 3.32Å; S324-I328 VanDerWaalsContact O-N 3.08Å; I325-I328 PolarHBondContact O-N 2.93Å; K326-I328 PolarHBondContact O-N 3.22Å; I328-N330 PolarHBondContact O-N 2.75Å; I328-M331 WeakPolarHBondContact O-CB 3.25Å; I328-M331 PolarHBondContact O-N 2.69Å; I328-W424 HydrophobicContact CG1-CH2 3.83Å; I328-M708 HydrophobicContact CB-CE 4.23Å; I328-M708 HydrophobicContact CD1-CE 4.43Å; I328-M708 HydrophobicContact CG2-CB 3.59Å; I328-M708 HydrophobicContact CG2-CE 3.78Å; I328-M708 HydrophobicContact CG2-CG 3.93Å; I328-L711 HydrophobicContact CD1-CD2 3.53Å; I328-L711 HydrophobicContact CG1-CD2 3.46Å; I328-L711 VanDerWaalsContact CG1-CD2 3.46Å
329	R	77.4	Confident	74.8	Confident	161 Å²	161	62.4 Å²	62.4	61%	0.608	33%	0.332	S	S	*	.	H	α-helix	trans	-56.5	-32.2	178.5	-171.4	176.2	178.2	150.4	4.9	112	E71 I325 K326 V327	E71-R329 IonicContact OE1-CZ 3Å; E71-R329 IonicContact OE1-NH1 2.97Å; E71-R329 PolarHBondContact OE1-NH1 2.64Å; E71-R329 IonicContact OE1-NH2 2.75Å; E71-R329 PolarHBondContact OE1-NH2 3.33Å; E71-R329 IonicContact OE2-NH2 2.89Å; E71-R329 PolarHBondContact OE2-NH2 2.76Å; E71-R329 VanDerWaalsContact OE2-NH2 3.15Å; I325-R329 PolarHBondContact O-N 2.82Å; K326-R329 PolarHBondContact O-N 3.33Å; V327-R329 VanDerWaalsContact C-N 3.32Å; V327-R329 PolarHBondContact O-N 3.1Å
330	N	78	Confident	72.9	Confident	140 Å²	140	60.2 Å²	60.2	75%	0.749	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.4	179.7	-62	-17.6	0	0	0	113.6	K326 V327 I328	K326-N330 PolarHBondContact O-N 3.39Å; V327-N330 PolarHBondContact O-N 3.09Å; V327-N330 VanDerWaalsContact O-N 3.17Å; I328-N330 PolarHBondContact O-N 2.75Å
331	M	80.7	Confident	71.2	Confident	29 Å²	29	62 Å²	62	14%	0.143	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-84.9	137.1	177.8	-66	-175	96.9	0	0	111.3	V327 I328 P423 W424 A707 K742	V327-M331 WeakPolarHBondContact O-CG 3.39Å; V327-M331 PolarHBondContact O-N 2.78Å; I328-M331 WeakPolarHBondContact O-CB 3.25Å; I328-M331 PolarHBondContact O-N 2.69Å; M331-P423 HydrophobicContact CE-CG 3.78Å; M331-P423 HydrophobicContact CG-CG 4.44Å; M331-P423 HydrophobicContact SD-CG 4.32Å; M331-W424 HydrophobicContact CE-CZ2 3.86Å; M331-W424 HydrophobicContact SD-CH2 3.94Å; M331-W424 HydrophobicContact SD-CZ2 3.43Å; M331-W424 WeakPolarHBondContact SD-CZ2 3.46Å; M331-A707 HydrophobicContact CB-CB 4.28Å; M331-A707 WeakPolarHBondContact O-CB 3.43Å; M331-K742 HydrophobicContact CE-CB 4.46Å; M331-K742 HydrophobicContact CE-CD 3.98Å
332	R	76.3	Confident	69.9	Low	202 Å²	202	61.7 Å²	61.7	76%	0.762	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-75.6	148.8	167.1	-67.1	-169.1	-172.8	-171.1	0.9	112.1	K742	R332-K742 PolarHBondContact O-NZ 3.06Å
333	A	76.9	Confident	68.8	Low	19 Å²	19	63.7 Å²	63.7	16%	0.157	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-59.6	148	169.5	0	0	0	0	0	110.9	K705 Q710	A333-K705 HydrophobicContact CB-CB 4.06Å; A333-Q710 VanDerWaalsContact CA-OE1 3.32Å
334	A	69.7	Low	67.8	Low	14 Å²	14	66.3 Å²	66.3	12%	0.116	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-83.7	147.8	170.3	0	0	0	0	0	110.2	Q710 A738 K742	A334-Q710 PolarHBondContact O-NE2 3.09Å; A334-Q710 PolarHBondContact O-OE1 3.11Å; A334-A738 HydrophobicContact CB-CB 4.45Å; A334-K742 HydrophobicContact CB-CG 4.48Å
335	S	67.9	Low	66.5	Low	102 Å²	102	68.6 Å²	68.6	71%	0.713	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.7	172.8	-50.8	0	0	0	0	110.2
336	P	57.6	Low	65.2	Low	43 Å²	43	71.9 Å²	71.9	28%	0.279	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-58.3	145.4	-179.5	-21.2	29.6	0	0	0	112	K703 K705	P336-K703 HydrophobicContact CB-CG 4.5Å; P336-K705 HydrophobicContact CG-CG 4.45Å
337	P	56	Low	63.9	Low	14 Å²	14	72.6 Å²	72.6	9%	0.091	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-65.2	144.3	167.3	25.9	-30.2	0	0	0	110.3	S339 K699 L702 K734	P337-S339 PolarHBondContact O-N 2.96Å; P337-K699 HydrophobicContact CB-CG 4.48Å; P337-K699 HydrophobicContact CG-CG 3.78Å; P337-L702 HydrophobicContact CG-CB 4.22Å; P337-L702 HydrophobicContact CG-CD1 3.89Å; P337-K734 HydrophobicContact CB-CB 4.49Å
338	A	50	Low	62.5	Low	16 Å²	16	77.7 Å²	77.7	13%	0.132	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-56.3	134.3	177.8	0	0	0	0	0	111	D342 L343	A338-D342 HydrophobicContact CB-CB 4.05Å; A338-L343 HydrophobicContact CB-CG 4.47Å
339	S	50.3	Low	60.9	Low	17 Å²	17	83.6 Å²	83.6	12%	0.119	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-75.6	165.5	178.2	67.9	0	0	0	0	111.9	P337 S341 D342 L343	P337-S339 PolarHBondContact O-N 2.96Å; S339-S341 PolarHBondContact O-N 3.3Å; S339-S341 PolarHBondContact OG-OG 3.23Å; S339-D342 WeakPolarHBondContact CB-OD2 3.38Å; S339-D342 PolarHBondContact N-OD2 3.22Å; S339-D342 PolarHBondContact O-N 2.97Å; S339-D342 VanDerWaalsContact O-N 3.09Å; S339-D342 PolarHBondContact OG-N 2.94Å; S339-D342 PolarHBondContact OG-OD1 3.37Å; S339-D342 PolarHBondContact OG-OD2 2.88Å; S339-L343 WeakPolarHBondContact O-CG 3.26Å; S339-L343 PolarHBondContact O-N 3.04Å
340	A	48.6	Very low	59.6	Low	72 Å²	72	85.4 Å²	85.4	60%	0.595	44%	0.438	S	S	*	.	H	α-helix	trans	-59.5	-35.8	176.3	0	0	0	0	0	111.8	L343 I344	A340-L343 PolarHBondContact O-N 3.45Å; A340-I344 WeakPolarHBondContact O-CB 3.33Å; A340-I344 WeakPolarHBondContact O-CD1 3.46Å; A340-I344 WeakPolarHBondContact O-CG1 3.37Å; A340-I344 PolarHBondContact O-N 3.44Å
341	S	48.1	Very low	58	Low	74 Å²	74	81.4 Å²	81.4	52%	0.517	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-43.6	171.4	36.1	0	0	0	0	112.3	S339 L343 I344 E345	S339-S341 PolarHBondContact O-N 3.3Å; S339-S341 PolarHBondContact OG-OG 3.23Å; S341-L343 VanDerWaalsContact C-N 3.28Å; S341-L343 PolarHBondContact O-N 3.32Å; S341-I344 PolarHBondContact O-N 2.92Å; S341-E345 WeakPolarHBondContact O-CB 3.2Å; S341-E345 PolarHBondContact O-N 3.48Å
342	D	51.8	Low	56.3	Low	71 Å²	71	91 Å²	91	38%	0.38	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-33.7	177.4	-52.8	-30.6	0	0	0	111.9	A338 S339 Q346	A338-D342 HydrophobicContact CB-CB 4.05Å; S339-D342 WeakPolarHBondContact CB-OD2 3.38Å; S339-D342 PolarHBondContact N-OD2 3.22Å; S339-D342 PolarHBondContact O-N 2.97Å; S339-D342 VanDerWaalsContact O-N 3.09Å; S339-D342 PolarHBondContact OG-N 2.94Å; S339-D342 PolarHBondContact OG-OD1 3.37Å; S339-D342 PolarHBondContact OG-OD2 2.88Å; D342-Q346 WeakPolarHBondContact O-CB 3.45Å; D342-Q346 WeakPolarHBondContact O-CG 3.33Å; D342-Q346 PolarHBondContact O-N 3.01Å
343	L	60.2	Low	54.8	Low	80 Å²	80	91.8 Å²	91.8	42%	0.419	47%	0.468	S	S	.	.	H	α-helix	trans	-71.1	-42.4	175.6	-71.7	166.6	0	0	0	111.4	A338 S339 A340 S341 E345 Q346 Q347	A338-L343 HydrophobicContact CB-CG 4.47Å; S339-L343 WeakPolarHBondContact O-CG 3.26Å; S339-L343 PolarHBondContact O-N 3.04Å; A340-L343 PolarHBondContact O-N 3.45Å; S341-L343 VanDerWaalsContact C-N 3.28Å; S341-L343 PolarHBondContact O-N 3.32Å; L343-E345 VanDerWaalsContact C-N 3.34Å; L343-Q346 PolarHBondContact O-N 2.73Å; L343-Q347 WeakPolarHBondContact O-CB 3.14Å; L343-Q347 PolarHBondContact O-N 3.27Å
344	I	63.3	Low	53	Low	93 Å²	93	98.5 Å²	98.5	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-63.7	-41.2	174.8	-69.1	161.9	0	0	0	110.4	A340 S341 Q347 Q348	A340-I344 WeakPolarHBondContact O-CB 3.33Å; A340-I344 WeakPolarHBondContact O-CD1 3.46Å; A340-I344 WeakPolarHBondContact O-CG1 3.37Å; A340-I344 PolarHBondContact O-N 3.44Å; S341-I344 PolarHBondContact O-N 2.92Å; I344-Q347 PolarHBondContact O-N 3.26Å; I344-Q348 WeakPolarHBondContact O-CB 3.11Å; I344-Q348 WeakPolarHBondContact O-CG 3.27Å; I344-Q348 PolarHBondContact O-N 3.22Å
345	E	53.5	Low	51.4	Low	93 Å²	93	106.9 Å²	106.9	44%	0.435	53%	0.532	S	S	.	.	H	α-helix	trans	-68.9	-37	177.7	-152.7	-164.3	145.1	0	0	112	S341 L343 Q347 Q348 K349	S341-E345 WeakPolarHBondContact O-CB 3.2Å; S341-E345 PolarHBondContact O-N 3.48Å; L343-E345 VanDerWaalsContact C-N 3.34Å; E345-Q347 VanDerWaalsContact C-N 3.34Å; E345-Q348 PolarHBondContact O-N 3.35Å; E345-K349 WeakPolarHBondContact O-CB 3.38Å; E345-K349 WeakPolarHBondContact O-CG 3.46Å; E345-K349 PolarHBondContact O-N 3.48Å; E345-K349 WeakPolarHBondContact OE1-CE 3.13Å; E345-K349 IonicContact OE1-NZ 2.72Å; E345-K349 PolarHBondContact OE1-NZ 3.48Å
346	Q	53.9	Low	49.9	Very low	112 Å²	112	111.8 Å²	111.8	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-35.6	169.7	-86.5	-170.7	-19.3	0	0	112.6	D342 L343 K349 R350	D342-Q346 WeakPolarHBondContact O-CB 3.45Å; D342-Q346 WeakPolarHBondContact O-CG 3.33Å; D342-Q346 PolarHBondContact O-N 3.01Å; L343-Q346 PolarHBondContact O-N 2.73Å; Q346-K349 PolarHBondContact O-N 2.72Å; Q346-R350 WeakPolarHBondContact O-CB 3.4Å; Q346-R350 PolarHBondContact O-N 2.85Å
347	Q	54.9	Low	48.7	Very low	144 Å²	144	114.3 Å²	114.3	67%	0.673	57%	0.565	S	S	*	*	H	α-helix	trans	-71.9	-37.5	177.8	-153.5	166	9.4	0	0	111.1	L343 I344 E345 R350 G351	L343-Q347 WeakPolarHBondContact O-CB 3.14Å; L343-Q347 PolarHBondContact O-N 3.27Å; I344-Q347 PolarHBondContact O-N 3.26Å; E345-Q347 VanDerWaalsContact C-N 3.34Å; Q347-R350 PolarHBondContact O-N 2.93Å; Q347-G351 PolarHBondContact O-N 3.44Å
348	Q	53.8	Low	47.4	Very low	132 Å²	132	122 Å²	122	62%	0.617	61%	0.605	S	S	*	*	H	α-helix	trans	-68.1	-36.6	170.9	-74.2	179.2	-5.4	0	0	112.6	I344 E345 G351 R352	I344-Q348 WeakPolarHBondContact O-CB 3.11Å; I344-Q348 WeakPolarHBondContact O-CG 3.27Å; I344-Q348 PolarHBondContact O-N 3.22Å; E345-Q348 PolarHBondContact O-N 3.35Å; Q348-G351 PolarHBondContact O-N 2.85Å; Q348-R352 PolarHBondContact O-N 3.18Å
349	K	50.5	Low	46.7	Very low	128 Å²	128	128.7 Å²	128.7	56%	0.557	64%	0.637	S	S	*	*	H	α-helix	trans	-69.4	-30.6	172.9	-79.1	172.4	177	158.7	0	112.6	E345 Q346	E345-K349 WeakPolarHBondContact O-CB 3.38Å; E345-K349 WeakPolarHBondContact O-CG 3.46Å; E345-K349 PolarHBondContact O-N 3.48Å; E345-K349 WeakPolarHBondContact OE1-CE 3.13Å; E345-K349 IonicContact OE1-NZ 2.72Å; E345-K349 PolarHBondContact OE1-NZ 3.48Å; Q346-K349 PolarHBondContact O-N 2.72Å
350	R	50.6	Low	45.9	Very low	198 Å²	198	136 Å²	136	75%	0.747	67%	0.666	S	S	*	*	H	α-helix	trans	-70.9	-41.4	171.2	-85.5	-177.4	169.2	-174.9	-4.6	112.2	Q346 Q347 R352 R353	Q346-R350 WeakPolarHBondContact O-CB 3.4Å; Q346-R350 PolarHBondContact O-N 2.85Å; Q347-R350 PolarHBondContact O-N 2.93Å; R350-R352 PolarHBondContact O-N 3.41Å; R350-R353 PolarHBondContact O-N 2.93Å
351	G	43.9	Very low	45	Very low	56 Å²	56	142.3 Å²	142.3	58%	0.577	68%	0.684	S	S	*	*	H	α-helix	trans	-62.6	-20.4	175.9	0	0	0	0	0	114.9	Q347 Q348	Q347-G351 PolarHBondContact O-N 3.44Å; Q348-G351 PolarHBondContact O-N 2.85Å
352	R	45.4	Very low	44.1	Very low	232 Å²	232	144.3 Å²	144.3	88%	0.875	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-8.4	173.3	-87.3	-170.2	177.3	-162.1	0.4	115	Q348 R350	Q348-R352 PolarHBondContact O-N 3.18Å; R350-R352 PolarHBondContact O-N 3.41Å
353	R	43.1	Very low	43	Very low	217 Å²	217	148.1 Å²	148.1	82%	0.819	71%	0.709	S	S	*	*	S	Bend	trans	-97.6	-5.3	-178.5	-76.5	-176.4	175.5	-177.6	-1.5	114.2	R350 H355	R350-R353 PolarHBondContact O-N 2.93Å; R353-H355 VanDerWaalsContact C-N 3.29Å; R353-H355 PolarHBondContact O-N 3.48Å
354	E	39.1	Very low	41.7	Very low	161 Å²	161	152.3 Å²	152.3	75%	0.752	73%	0.73	S	S	*	*			trans	-90.2	34.6	-178.3	-66.9	-174.9	170.6	0	0	114.3
355	H	37.3	Very low	40.1	Very low	189 Å²	189	156.2 Å²	156.2	88%	0.875	75%	0.752	S	S	*	*	S	Bend	trans	-131.7	59.4	167.4	-101.9	28.6	0	0	0	110.7	R353	R353-H355 VanDerWaalsContact C-N 3.29Å; R353-H355 PolarHBondContact O-N 3.48Å
356	K	35.2	Very low	39.2	Very low	205 Å²	205	155.8 Å²	155.8	89%	0.891	77%	0.765	S	S	*	*	S	Bend	trans	-165.7	120.1	147.8	-108.6	170.6	-177.2	-176.1	0	108.5
357	A	32.3	Very low	37.9	Very low	97 Å²	97	160.1 Å²	160.1	80%	0.802	78%	0.783	S	S	*	*			trans	-58.6	146.9	-169.5	0	0	0	0	0	114.8
358	L	30.4	Very low	36.8	Very low	175 Å²	175	160.4 Å²	160.4	92%	0.916	79%	0.788	S	S	*	*			trans	-143.8	146.3	130.8	-145	81.9	0	0	0	109.9
359	I	33.6	Very low	35.9	Very low	157 Å²	157	163.7 Å²	163.7	81%	0.805	80%	0.804	S	S	*	*			trans	-68.9	142.9	-159.4	-73.6	154.4	0	0	0	113.3
360	K	35	Very low	35	Very low	171 Å²	171	168.6 Å²	168.6	74%	0.743	82%	0.819	S	S	*	*			trans	-36.3	137.4	168.1	-92.5	175	161.4	-178.5	0	115.2	D362	K360-D362 WeakPolarHBondContact CE-OD2 3.21Å
361	Q	29.3	Very low	34.4	Very low	204 Å²	204	165.1 Å²	165.1	95%	0.953	82%	0.815	S	S	*	*			trans	-140.2	93.9	134.5	-145.8	172.4	2.6	0	0	107.7
362	D	30	Very low	34.1	Very low	115 Å²	115	168 Å²	168	62%	0.615	82%	0.824	S	S	*	*			trans	-89.4	133.7	172.9	-83.6	-39.2	0	0	0	109.4	K360	K360-D362 WeakPolarHBondContact CE-OD2 3.21Å
363	N	28.7	Very low	33.6	Very low	151 Å²	151	166.5 Å²	166.5	81%	0.807	82%	0.82	S	S	*	*			trans	140.6	105.7	135.7	-76.5	-14.7	0	0	0	112.7
364	L	31.1	Very low	33.2	Very low	168 Å²	168	165.6 Å²	165.6	88%	0.88	82%	0.822	S	S	*	*				-171.8	83	112.4	-136.3	75.7	0	0	0	109.6
365	D	30.6	Very low	32.8	Very low	175 Å²	175	164.4 Å²	164.4	94%	0.936	83%	0.826	S	S	*	*			trans	-147.4	77.8	164.4	-105.7	-18.5	0	0	0	107.3
366	A	33.8	Very low	32.6	Very low	85 Å²	85	162 Å²	162	70%	0.702	82%	0.819	S	S	*	*			trans	-150.5	94.8	167.1	0	0	0	0	0	106.9
367	F	27.4	Very low	32.2	Very low	203 Å²	203	158.8 Å²	158.8	89%	0.89	81%	0.812	S	S	*	*			trans	172.5	88.3	148.7	-102.5	-75.2	0	0	0	109.6
368	N	31.3	Very low	32	Very low	149 Å²	149	159.1 Å²	159.1	80%	0.797	81%	0.808	S	S	*	*				176.2	84.9	128	-113.7	-6.2	0	0	0	110.8
369	E	34.8	Very low	31.9	Very low	201 Å²	201	160.7 Å²	160.7	94%	0.939	80%	0.802	S	S	*	*			trans	-119.1	108.1	148.6	-87.1	-174	161.2	0	0	106.3
370	R	32.3	Very low	31.8	Very low	231 Å²	231	160.4 Å²	160.4	87%	0.872	80%	0.797	S	S	*	*			trans	-124.4	119.2	157.9	-84.4	-171.4	-175.2	178.9	2.8	108.9
371	D	38	Very low	31.5	Very low	125 Å²	125	159.6 Å²	159.6	67%	0.668	80%	0.796	S	S	*	*			trans	-65.3	131.1	173.3	-178.9	-6.2	0	0	0	110.6	Y373	D371-Y373 PolarHBondContact O-N 2.99Å; D371-Y373 VanDerWaalsContact O-N 3.15Å; D371-Y373 PolarHBondContact OD1-N 2.78Å
372	P	36.6	Very low	31.5	Very low	117 Å²	117	158.1 Å²	158.1	76%	0.76	79%	0.789	S	S	*	*	S	Bend	trans	-72.9	7.1	-176.2	-15	29.8	0	0	0	116.8
373	Y	36	Very low	31.5	Very low	201 Å²	201	161 Å²	161	79%	0.788	80%	0.799	S	S	*	*			trans	-122.4	50	-172.3	-71.4	-78.7	0	0	0	115.7	D371	D371-Y373 PolarHBondContact O-N 2.99Å; D371-Y373 VanDerWaalsContact O-N 3.15Å; D371-Y373 PolarHBondContact OD1-N 2.78Å
374	K	34.4	Very low	31.7	Very low	198 Å²	198	161.9 Å²	161.9	86%	0.861	80%	0.798	S	S	*	*			trans	-132.2	122.7	162	-78.9	-167.6	177.3	-178.3	0	112.9
375	T	31.8	Very low	31.6	Very low	136 Å²	136	161.5 Å²	161.5	83%	0.834	80%	0.797	S	S	*	*			trans	-78.9	146.9	176.7	-23.2	0	0	0	0	111.4
376	D	31.1	Very low	31.5	Very low	137 Å²	137	160.3 Å²	160.3	73%	0.733	79%	0.79	S	S	*	*			trans	110.8	120	138.5	-127.4	8.4	0	0	0	120.3
377	D	26.9	Very low	31.4	Very low	139 Å²	139	164.4 Å²	164.4	74%	0.743	80%	0.801	S	S	*	*			trans	31.7	125.6	148.8	-88.6	-14.7	0	0	0	123.4
378	S	28.6	Very low	31.5	Very low	104 Å²	104	161 Å²	161	73%	0.727	79%	0.791	S	S	*	*				147.3	127	100.8	51.2	0	0	0	0	115
379	R	29.6	Very low	31.4	Very low	208 Å²	208	161.8 Å²	161.8	79%	0.785	80%	0.796	S	S	*	*			trans	65.6	131.8	141.2	-71.1	-177.6	174.3	169.1	-2.4	123.4
380	E	30.1	Very low	31.1	Very low	150 Å²	150	156.5 Å²	156.5	70%	0.701	78%	0.781	S	S	*	*			trans	62.6	137.2	134.2	-70.1	158.1	-158.2	0	0	117.1
381	E	29.8	Very low	31	Very low	154 Å²	154	152.3 Å²	152.3	72%	0.72	78%	0.775	S	S	*	*			cis	-162.3	149.5	17.3	-98.3	155.4	-172.9	0	0	106.1
382	E	29.3	Very low	30.6	Very low	174 Å²	174	154.9 Å²	154.9	81%	0.813	78%	0.783	S	S	*	*				44.5	134.5	110.4	-47.8	-169.3	164.5	0	0	115
383	E	30.6	Very low	30.3	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	78%	0.781	S	S	*	*			cis	-163.5	172.1	42.8	-78.1	-174.8	148.1	0	0	111.4
384	E	31.4	Very low	29.8	Very low	170 Å²	170	152.4 Å²	152.4	79%	0.794	79%	0.787	S	S	*	*			trans	-55	158.1	174.3	-60.6	166.2	148.7	0	0	116.4
385	N	28.6	Very low	29.4	Very low	161 Å²	161	149.1 Å²	149.1	86%	0.861	78%	0.784	S	S	*	*				-169.9	135.5	117.2	-98	-51.7	0	0	0	112.6
386	D	30.2	Very low	29.1	Very low	149 Å²	149	152.5 Å²	152.5	80%	0.797	79%	0.788	S	S	*	*			trans	-61.3	153	166.8	-73.9	-48.3	0	0	0	112.1
387	D	30.8	Very low	29.1	Very low	171 Å²	171	152 Å²	152	91%	0.914	79%	0.791	S	S	*	*				-158.5	126.5	127.7	-112	-19.5	0	0	0	111.6
388	D	29.9	Very low	29.3	Very low	131 Å²	131	152.9 Å²	152.9	70%	0.701	80%	0.795	S	S	*	*			trans	-86.1	140.7	-179.5	-166.7	2.3	0	0	0	109.6
389	N	28.5	Very low	29.5	Very low	167 Å²	167	156.5 Å²	156.5	89%	0.893	80%	0.801	S	S	*	*			trans	-160.1	91.2	155.6	-119.1	-24.8	0	0	0	111
390	S	28.9	Very low	29.5	Very low	89 Å²	89	158.5 Å²	158.5	62%	0.622	81%	0.808	S	S	*	*			trans	-78.5	136	157.8	-67.9	0	0	0	0	110.3
391	L	31.2	Very low	29.5	Very low	144 Å²	144	159.2 Å²	159.2	75%	0.754	82%	0.817	S	S	*	*				-173.8	130	124	-120.7	91.9	0	0	0	112.3
392	E	29	Very low	29.6	Very low	178 Å²	178	160.8 Å²	160.8	83%	0.832	83%	0.825	S	S	*	*			trans	57.8	130	144.8	-67	175.9	-176.3	0	0	119.5
393	G	29.1	Very low	29.8	Very low	69 Å²	69	159.4 Å²	159.4	71%	0.711	83%	0.827	S	S	*	*			cis	108.3	73.2	24.8	0	0	0	0	0	110
394	E	26.5	Very low	29.8	Very low	197 Å²	197	159 Å²	159	92%	0.921	83%	0.827	S	S	*	*			trans	-145.5	148.8	161.9	-81.2	-151	161.7	0	0	113.8
395	T	25.8	Very low	30	Very low	130 Å²	130	156 Å²	156	80%	0.798	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-83.1	143.9	-157.6	43.6	0	0	0	0	115.3
396	F	25.1	Very low	30.3	Very low	207 Å²	207	154.1 Å²	154.1	91%	0.908	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-73.6	132	167.5	-75.3	-89.6	0	0	0	112.2
397	P	30.9	Very low	30.4	Very low	125 Å²	125	152.9 Å²	152.9	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-92.9	132.9	162.6	-4.8	24.4	0	0	0	112.2
398	L	31.5	Very low	30.6	Very low	158 Å²	158	152.9 Å²	152.9	83%	0.827	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80	148.4	170.4	-84.5	159.5	0	0	0	112.1
399	E	33.1	Very low	30.6	Very low	181 Å²	181	155.9 Å²	155.9	85%	0.846	83%	0.829	S	S	*	*			trans	69.7	118.9	153.2	-68.6	179.1	-177	0	0	121.2
400	R	29.9	Very low	30.8	Very low	249 Å²	249	156.2 Å²	156.2	94%	0.94	82%	0.824	S	S	*	*			trans	-146.4	123.6	132.7	-99.8	-173.4	-168.9	-165	2.7	110.7
401	D	30.3	Very low	30.9	Very low	166 Å²	166	157.6 Å²	157.6	89%	0.888	83%	0.831	S	S	*	*			trans	-59.1	125.4	167.1	-96.2	-35.7	0	0	0	111.3
402	E	31.2	Very low	30.7	Very low	187 Å²	187	159.8 Å²	159.8	87%	0.874	84%	0.838	S	S	*	*			trans	-121.2	119.2	157.2	-75.8	-163.5	164.7	0	0	109.9	M404	E402-M404 PolarHBondContact O-N 3.4Å
403	V	32.5	Very low	30.9	Very low	144 Å²	144	157 Å²	157	87%	0.873	83%	0.833	S	S	*	*			trans	-72.4	114.7	-175	179.5	0	0	0	0	110.3
404	M	31.8	Very low	31.1	Very low	165 Å²	165	161.5 Å²	161.5	81%	0.813	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-75.4	146.3	168.7	-80	-162	73.7	0	0	111.9	E402	E402-M404 PolarHBondContact O-N 3.4Å
405	P	35.4	Very low	31.4	Very low	107 Å²	107	162.9 Å²	162.9	70%	0.695	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-74.5	153.3	176.7	30.9	-33	0	0	0	111.9
406	P	34.4	Very low	31.9	Very low	123 Å²	123	165 Å²	165	80%	0.799	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-73.1	142.6	-173.6	28.7	-32.4	0	0	0	111.8
407	P	33	Very low	32.2	Very low	122 Å²	122	161.6 Å²	161.6	79%	0.792	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-75.7	138.2	176.4	30	-32.2	0	0	0	111.3	Q409	P407-Q409 PolarHBondContact O-N 3.16Å
408	L	34.3	Very low	32.4	Very low	172 Å²	172	161 Å²	161	90%	0.901	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-57.2	129.2	174	-70.3	160.3	0	0	0	110.8	H410	L408-H410 PolarHBondContact O-N 3.35Å
409	Q	31.1	Very low	33.1	Very low	194 Å²	194	158.6 Å²	158.6	91%	0.907	83%	0.831	S	S	*	*			trans	-71.1	114.2	178.3	-70.5	178.7	-15.6	0	0	110.7	P407	P407-Q409 PolarHBondContact O-N 3.16Å
410	H	32.6	Very low	34.1	Very low	173 Å²	173	161 Å²	161	80%	0.801	84%	0.838	S	S	*	*			trans	-87.4	147.4	159.3	-83.3	-46.5	0	0	0	110.3	L408 Q412	L408-H410 PolarHBondContact O-N 3.35Å; H410-Q412 PolarHBondContact O-N 3.08Å
411	P	31	Very low	35.9	Very low	119 Å²	119	151.7 Å²	151.7	77%	0.773	82%	0.82	S	S	*	*			trans	-62.1	132.1	-176	-15.9	28.4	0	0	0	111.3	T413	P411-T413 PolarHBondContact O-N 2.75Å; P411-T413 VanDerWaalsContact O-N 3.14Å
412	Q	27.2	Very low	38.2	Very low	189 Å²	189	146.3 Å²	146.3	88%	0.883	79%	0.791	S	S	*	*			trans	-65.5	110.8	176.9	-67.8	-174.2	-21.5	0	0	109.7	H410	H410-Q412 PolarHBondContact O-N 3.08Å
413	T	32.3	Very low	40.7	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	77%	0.768	S	S	*	*			trans	-92.4	130	150.5	32.1	0	0	0	0	106.4	P411 R415	P411-T413 PolarHBondContact O-N 2.75Å; P411-T413 VanDerWaalsContact O-N 3.14Å; T413-R415 VanDerWaalsContact C-N 3.28Å; T413-R415 PolarHBondContact O-N 2.86Å
414	D	33.3	Very low	43.3	Very low	163 Å²	163	134.3 Å²	134.3	87%	0.872	73%	0.73	S	S	*	*			trans	-54.9	85.2	179.1	-77	-43	0	0	0	111.7	L416	D414-L416 PolarHBondContact O-N 2.92Å
415	R	33.5	Very low	45.7	Very low	227 Å²	227	127.9 Å²	127.9	86%	0.857	70%	0.703	S	S	*	*			trans	-85.2	97.7	162.6	-79.9	-170.9	171	-175.7	-0.5	107.4	T413 T417	T413-R415 VanDerWaalsContact C-N 3.28Å; T413-R415 PolarHBondContact O-N 2.86Å; R415-T417 PolarHBondContact O-N 2.78Å
416	L	34.5	Very low	48.1	Very low	174 Å²	174	125.1 Å²	125.1	91%	0.911	69%	0.685	S	S	*	*			trans	-40.9	108.8	163.6	-72.6	157.2	0	0	0	109.7	D414 C418	D414-L416 PolarHBondContact O-N 2.92Å; L416-C418 PolarHBondContact O-N 3.25Å; L416-C418 VanDerWaalsContact O-N 3.12Å
417	T	31.6	Very low	50.8	Low	136 Å²	136	120.8 Å²	120.8	83%	0.834	65%	0.653	S	S	*	*			trans	-67.5	106.9	177.3	43.8	0	0	0	0	109.3	R415	R415-T417 PolarHBondContact O-N 2.78Å
418	C	35.8	Very low	53.4	Low	112 Å²	112	115.1 Å²	115.1	76%	0.757	62%	0.617	S	S	*	*			trans	-64.5	131.9	167	-170.1	0	0	0	0	108.8	L416 K420	L416-C418 PolarHBondContact O-N 3.25Å; L416-C418 VanDerWaalsContact O-N 3.12Å; C418-K420 PolarHBondContact O-N 3.12Å
419	P	45.7	Very low	55.9	Low	107 Å²	107	109.3 Å²	109.3	70%	0.695	58%	0.583	S	S	*	*			trans	-57.6	140.3	174.6	-18.2	28.9	0	0	0	110.1	G421	P419-G421 PolarHBondContact O-N 3.3Å
420	K	54.5	Low	58.6	Low	232 Å²	232	102.6 Å²	102.6	100%	1.009	55%	0.551	S	S	*	*	S	Bend	trans	-67.5	20.5	-179.5	-70.9	-177.9	176.1	177.8	0	114.5	C418	C418-K420 PolarHBondContact O-N 3.12Å
421	G	66.9	Low	61.2	Low	53 Å²	53	100.2 Å²	100.2	55%	0.546	54%	0.539	S	S	.	.	S	Bend	trans	-147.5	172.6	-173.6	0	0	0	0	0	114.1	P419	P419-G421 PolarHBondContact O-N 3.3Å
422	L	80.5	Confident	63.8	Low	53 Å²	53	95.1 Å²	95.1	28%	0.277	51%	0.505	S	S	.	.			trans	-59.2	143.9	172	-78.5	170.3	0	0	0	110.4	W424 Q741 V743 H745	L422-W424 HydrophobicContact CB-CG 4.47Å; L422-W424 PolarHBondContact O-N 3.05Å; L422-Q741 WeakPolarHBondContact CD2-O 3.4Å; L422-V743 WeakPolarHBondContact CD1-O 3.39Å; L422-H745 VanDerWaalsContact CD1-CD2 3.44Å; L422-H745 WeakPolarHBondContact CD1-CD2 3.3Å
423	P	82.1	Confident	66.8	Low	61 Å²	61	86.3 Å²	86.3	40%	0.396	46%	0.464	S	S	.	.	S	Bend	trans	-78.3	25.9	176.9	37.3	-38.6	0	0	0	111.7	V327 M331	V327-P423 HydrophobicContact CG1-CB 3.73Å; V327-P423 HydrophobicContact CG1-CG 3.67Å; M331-P423 HydrophobicContact CE-CG 3.78Å; M331-P423 HydrophobicContact CG-CG 4.44Å; M331-P423 HydrophobicContact SD-CG 4.32Å
424	W	86.9	Confident	69.5	Low	18 Å²	18	83.5 Å²	83.5	7%	0.068	44%	0.442	C	S	.	.	S	Bend	trans	-119.8	121.5	-174.6	-47.5	118.7	0	0	0	110.4	E322 V327 I328 M331 L422 L711 K742 R744	E322-W424 WeakPolarHBondContact OE1-CA 3.33Å; V327-W424 HydrophobicContact CB-CH2 4.32Å; V327-W424 HydrophobicContact CB-CZ3 3.86Å; V327-W424 HydrophobicContact CG1-CE3 3.88Å; V327-W424 HydrophobicContact CG1-CH2 3.67Å; V327-W424 HydrophobicContact CG1-CZ2 4.34Å; V327-W424 HydrophobicContact CG1-CZ3 3.4Å; V327-W424 VanDerWaalsContact CG1-CZ3 3.4Å; I328-W424 HydrophobicContact CG1-CH2 3.83Å; M331-W424 HydrophobicContact CE-CZ2 3.86Å; M331-W424 HydrophobicContact SD-CH2 3.94Å; M331-W424 HydrophobicContact SD-CZ2 3.43Å; M331-W424 WeakPolarHBondContact SD-CZ2 3.46Å; L422-W424 HydrophobicContact CB-CG 4.47Å; L422-W424 PolarHBondContact O-N 3.05Å; W424-L711 HydrophobicContact CH2-CD2 3.84Å; W424-L711 HydrophobicContact CZ2-CD1 4.17Å; W424-L711 HydrophobicContact CZ2-CD2 3.72Å; W424-K742 PolarHBondContact NE1-O 3.21Å; W424-R744 HydrophobicContact CB-CB 3.79Å; W424-R744 HydrophobicContact CB-CG 3.75Å; W424-R744 HydrophobicContact CD2-CB 4.44Å; W424-R744 HydrophobicContact CG-CB 3.77Å; W424-R744 HydrophobicContact CG-CG 4.31Å
425	A	83.9	Confident	72.1	Confident	30 Å²	30	80.2 Å²	80.2	25%	0.248	42%	0.423	C	S	.	.			trans	-61.1	134.2	165.4	0	0	0	0	0	110.7	P321 E322 R744	P321-A425 HydrophobicContact CB-CB 3.9Å; P321-A425 HydrophobicContact CG-CB 4Å; E322-A425 PolarHBondContact OE1-N 3.18Å; E322-A425 PolarHBondContact OE2-N 2.86Å; A425-R744 WeakPolarHBondContact O-CD 3.34Å; A425-R744 PolarHBondContact O-NE 3.4Å
426	P	86.1	Confident	74.7	Confident	50 Å²	50	71.9 Å²	71.9	33%	0.325	39%	0.393	S	S	.	.			trans	-56.8	149.7	170.8	-24	33.8	0	0	0	111.7
427	K	89.1	Confident	77.3	Confident	31 Å²	31	63.6 Å²	63.6	14%	0.135	35%	0.35	C	S	.	.			trans	-134.7	129.7	177.6	-65.6	-172.1	175.6	-169.3	0	110.6	Y475	K427-Y475 HydrophobicContact CD-CD1 4.07Å; K427-Y475 HydrophobicContact CD-CD2 4.27Å; K427-Y475 HydrophobicContact CD-CG 3.92Å; K427-Y475 HydrophobicContact CG-CG 4.33Å
428	V	88.8	Confident	80	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.018	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-119.4	132.9	176.4	-177.7	0	0	0	0	108.7	D432 I433 L470 H473 K474 Y475 L747	V428-D432 HydrophobicContact CG1-CB 4.1Å; V428-I433 HydrophobicContact CG1-CD1 4.21Å; V428-I433 HydrophobicContact CG1-CG1 3.69Å; V428-L470 HydrophobicContact CG1-CB 4.17Å; V428-L470 HydrophobicContact CG1-CD2 3.94Å; V428-L470 HydrophobicContact CG2-CD2 3.9Å; V428-H473 HydrophobicContact CG2-CB 3.91Å; V428-H473 PolarHBondContact N-O 2.92Å; V428-K474 CarbonylContact O-C 3.59Å; V428-K474 WeakPolarHBondContact O-CA 2.99Å; V428-Y475 PolarHBondContact O-N 3.45Å; V428-L747 HydrophobicContact CG2-CB 4.4Å; V428-L747 HydrophobicContact CG2-CD1 3.78Å; V428-L747 HydrophobicContact CG2-CG 4.22Å
429	R	87	Confident	82.5	Confident	50 Å²	50	60.3 Å²	60.3	19%	0.189	32%	0.323	C	S	.	.			trans	-89.2	159	172.1	-61.1	178.3	-64.7	172.1	5.3	110.5	K431 D432 I433	R429-K431 VanDerWaalsContact C-N 3.34Å; R429-K431 PolarHBondContact O-N 3.49Å; R429-D432 HydrophobicContact CB-CB 4.47Å; R429-D432 WeakPolarHBondContact CB-OD2 3.3Å; R429-D432 IonicContact CZ-OD1 2.75Å; R429-D432 PolarHBondContact N-OD2 2.99Å; R429-D432 IonicContact NE-OD1 2.73Å; R429-D432 PolarHBondContact NE-OD1 3.18Å; R429-D432 VanDerWaalsContact NE-OD1 3.15Å; R429-D432 IonicContact NE-OD2 3.71Å; R429-D432 PolarHBondContact NE-OD2 2.96Å; R429-D432 IonicContact NH2-OD1 2.67Å; R429-D432 PolarHBondContact NH2-OD1 3.45Å; R429-D432 WeakPolarHBondContact O-CB 3.42Å; R429-D432 PolarHBondContact O-N 2.9Å; R429-I433 PolarHBondContact O-N 3.06Å
430	E	87.8	Confident	84.5	Confident	53 Å²	53	55.7 Å²	55.7	25%	0.248	29%	0.293	C	S	.	.	H	α-helix	trans	-51.3	-51.3	170.2	-173	126.7	-124.7	0	0	112.4	D432 I433 E434 T453 K474	E430-D432 PolarHBondContact O-N 3.05Å; E430-D432 VanDerWaalsContact O-N 3.14Å; E430-I433 WeakPolarHBondContact O-CA 3.31Å; E430-I433 VanDerWaalsContact O-CB 3.3Å; E430-I433 WeakPolarHBondContact O-CB 3.43Å; E430-I433 PolarHBondContact O-N 3.18Å; E430-E434 PolarHBondContact O-N 2.99Å; E430-T453 HydrophobicContact CG-CG2 4.48Å; E430-K474 IonicContact OE1-NZ 2.7Å; E430-K474 PolarHBondContact OE1-NZ 3.2Å; E430-K474 WeakPolarHBondContact OE2-CE 3.21Å; E430-K474 IonicContact OE2-NZ 3.19Å; E430-K474 PolarHBondContact OE2-NZ 2.76Å
431	K	86	Confident	86.2	Confident	123 Å²	123	45 Å²	45	54%	0.535	25%	0.246	S	C	.	.	H	α-helix	trans	-56.5	-32	175.6	-170.6	170.8	-177.1	169.8	0	113.8	R429 I433 E434 M435	R429-K431 VanDerWaalsContact C-N 3.34Å; R429-K431 PolarHBondContact O-N 3.49Å; K431-I433 VanDerWaalsContact C-N 3.3Å; K431-E434 PolarHBondContact O-N 2.85Å; K431-M435 HydrophobicContact CG-CG 4.41Å; K431-M435 HydrophobicContact CG-SD 4.19Å; K431-M435 WeakPolarHBondContact O-CB 3.34Å; K431-M435 VanDerWaalsContact O-CG 3.23Å; K431-M435 WeakPolarHBondContact O-CG 3.32Å; K431-M435 PolarHBondContact O-N 3.22Å
432	D	87.1	Confident	87.3	Confident	13 Å²	13	45.9 Å²	45.9	7%	0.07	24%	0.244	C	C	.	.	H	α-helix	trans	-71.8	-28.4	178.1	-54.2	-29.6	0	0	0	111	V428 R429 E430 F436 R746 N748	V428-D432 HydrophobicContact CG1-CB 4.1Å; R429-D432 HydrophobicContact CB-CB 4.47Å; R429-D432 WeakPolarHBondContact CB-OD2 3.3Å; R429-D432 IonicContact CZ-OD1 2.75Å; R429-D432 PolarHBondContact N-OD2 2.99Å; R429-D432 IonicContact NE-OD1 2.73Å; R429-D432 PolarHBondContact NE-OD1 3.18Å; R429-D432 VanDerWaalsContact NE-OD1 3.15Å; R429-D432 IonicContact NE-OD2 3.71Å; R429-D432 PolarHBondContact NE-OD2 2.96Å; R429-D432 IonicContact NH2-OD1 2.67Å; R429-D432 PolarHBondContact NH2-OD1 3.45Å; R429-D432 WeakPolarHBondContact O-CB 3.42Å; R429-D432 PolarHBondContact O-N 2.9Å; E430-D432 PolarHBondContact O-N 3.05Å; E430-D432 VanDerWaalsContact O-N 3.14Å; D432-F436 WeakPolarHBondContact O-CB 3.39Å; D432-F436 PolarHBondContact O-N 3.06Å; D432-R746 IonicContact OD2-NH1 3.37Å; D432-R746 PolarHBondContact OD2-NH1 3.16Å; D432-N748 PolarHBondContact O-ND2 3.35Å
433	I	89.5	Confident	87.7	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-75.4	-45.4	173.3	-56.9	176.2	0	0	0	110	V428 R429 E430 K431 F436 L437 T453 L470 K471 K474	V428-I433 HydrophobicContact CG1-CD1 4.21Å; V428-I433 HydrophobicContact CG1-CG1 3.69Å; R429-I433 PolarHBondContact O-N 3.06Å; E430-I433 WeakPolarHBondContact O-CA 3.31Å; E430-I433 VanDerWaalsContact O-CB 3.3Å; E430-I433 WeakPolarHBondContact O-CB 3.43Å; E430-I433 PolarHBondContact O-N 3.18Å; K431-I433 VanDerWaalsContact C-N 3.3Å; I433-F436 PolarHBondContact O-N 3.47Å; I433-L437 HydrophobicContact CG2-CD1 4.12Å; I433-L437 WeakPolarHBondContact O-CB 3.28Å; I433-L437 PolarHBondContact O-N 2.98Å; I433-T453 HydrophobicContact CG2-CG2 4.4Å; I433-L470 HydrophobicContact CD1-CB 4.47Å; I433-L470 HydrophobicContact CG1-CB 4.08Å; I433-K471 HydrophobicContact CD1-CG 4.15Å; I433-K474 HydrophobicContact CD1-CB 4.47Å; I433-K474 HydrophobicContact CD1-CD 4.45Å; I433-K474 HydrophobicContact CD1-CG 4.48Å
434	E	88.8	Confident	88.1	Confident	61 Å²	61	53.1 Å²	53.1	29%	0.285	27%	0.267	S	S	.	.	H	α-helix	trans	-56.9	-52.6	176.9	-69.3	170.7	179.5	0	0	111.1	E430 K431 F436 L437 E438 T453	E430-E434 PolarHBondContact O-N 2.99Å; K431-E434 PolarHBondContact O-N 2.85Å; E434-F436 VanDerWaalsContact C-N 3.3Å; E434-F436 PolarHBondContact O-N 2.86Å; E434-L437 PolarHBondContact O-N 2.63Å; E434-L437 VanDerWaalsContact O-N 3.17Å; E434-E438 VanDerWaalsContact O-CB 3.31Å; E434-E438 WeakPolarHBondContact O-CB 3.29Å; E434-E438 PolarHBondContact O-N 3.44Å; E434-T453 HydrophobicContact CG-CG2 3.51Å
435	M	87.5	Confident	88.1	Confident	94 Å²	94	56.2 Å²	56.2	46%	0.463	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-39.8	178.7	-72	174.4	2.5	0	0	112.4	K431 S439	K431-M435 HydrophobicContact CG-CG 4.41Å; K431-M435 HydrophobicContact CG-SD 4.19Å; K431-M435 WeakPolarHBondContact O-CB 3.34Å; K431-M435 VanDerWaalsContact O-CG 3.23Å; K431-M435 WeakPolarHBondContact O-CG 3.32Å; K431-M435 PolarHBondContact O-N 3.22Å; M435-S439 WeakPolarHBondContact O-CB 3.32Å; M435-S439 PolarHBondContact O-N 3.08Å
436	F	89	Confident	88.1	Confident	52 Å²	52	57.9 Å²	57.9	23%	0.228	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-43.9	177.4	177.9	-98.4	0	0	0	111.5	D432 I433 E434 S440 I463 I467 L470	D432-F436 WeakPolarHBondContact O-CB 3.39Å; D432-F436 PolarHBondContact O-N 3.06Å; I433-F436 PolarHBondContact O-N 3.47Å; E434-F436 VanDerWaalsContact C-N 3.3Å; E434-F436 PolarHBondContact O-N 2.86Å; F436-S440 VanDerWaalsContact O-CB 3.28Å; F436-S440 WeakPolarHBondContact O-CB 3.25Å; F436-S440 PolarHBondContact O-N 3.03Å; F436-S440 PolarHBondContact O-OG 3.37Å; F436-I463 HydrophobicContact CE1-CG2 3.79Å; F436-I463 HydrophobicContact CZ-CG2 4.22Å; F436-I467 HydrophobicContact CD1-CG1 4.08Å; F436-I467 HydrophobicContact CE1-CG1 3.9Å; F436-L470 HydrophobicContact CB-CD1 4.06Å; F436-L470 HydrophobicContact CD1-CD1 3.71Å; F436-L470 HydrophobicContact CD2-CD1 4.46Å; F436-L470 HydrophobicContact CE1-CD1 4.28Å; F436-L470 HydrophobicContact CG-CD1 3.81Å
437	L	88.9	Confident	87.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-43.5	176.8	-90	170.5	0	0	0	112.2	I433 E434 S440 R441 T453 L459 I467	I433-L437 HydrophobicContact CG2-CD1 4.12Å; I433-L437 WeakPolarHBondContact O-CB 3.28Å; I433-L437 PolarHBondContact O-N 2.98Å; E434-L437 PolarHBondContact O-N 2.63Å; E434-L437 VanDerWaalsContact O-N 3.17Å; L437-S440 PolarHBondContact O-N 2.78Å; L437-R441 WeakPolarHBondContact O-CB 3.48Å; L437-R441 WeakPolarHBondContact O-CG 3.48Å; L437-R441 PolarHBondContact O-N 3.28Å; L437-T453 WeakPolarHBondContact CD1-O 3.27Å; L437-L459 HydrophobicContact CD2-CD1 3.79Å; L437-I467 HydrophobicContact CD2-CD1 3.36Å; L437-I467 HydrophobicContact CD2-CG1 4.16Å; L437-I467 HydrophobicContact CG-CD1 4.04Å; L437-I467 HydrophobicContact CG-CG1 4.33Å
438	E	88.6	Confident	87.2	Confident	97 Å²	97	63.8 Å²	63.8	45%	0.453	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-48.2	178.7	-170.8	174.2	-163.2	0	0	111.1	E434 S440 R441 S442 T448	E434-E438 VanDerWaalsContact O-CB 3.31Å; E434-E438 WeakPolarHBondContact O-CB 3.29Å; E434-E438 PolarHBondContact O-N 3.44Å; E438-S440 VanDerWaalsContact C-N 3.32Å; E438-S440 PolarHBondContact O-N 3.38Å; E438-R441 PolarHBondContact O-N 3.49Å; E438-S442 WeakPolarHBondContact O-CB 3.24Å; E438-S442 PolarHBondContact O-N 2.82Å; E438-T448 HydrophobicContact CG-CG2 3.54Å
439	S	87.9	Confident	86.4	Confident	82 Å²	82	67.2 Å²	67.2	57%	0.573	34%	0.344	S	S	*	.	H	α-helix	trans	-60.7	-41.5	174.7	-179	0	0	0	0	111.9	M435 K443	M435-S439 WeakPolarHBondContact O-CB 3.32Å; M435-S439 PolarHBondContact O-N 3.08Å; S439-K443 VanDerWaalsContact O-CB 3.3Å; S439-K443 WeakPolarHBondContact O-CB 3.31Å; S439-K443 PolarHBondContact O-N 2.97Å
440	S	88.5	Confident	85.7	Confident	11 Å²	11	67.9 Å²	67.9	8%	0.077	37%	0.367	C	S	.	.	H	α-helix	trans	-66.2	-47.5	178	-62.1	0	0	0	0	112.1	F436 L437 E438 K443 F444	F436-S440 VanDerWaalsContact O-CB 3.28Å; F436-S440 WeakPolarHBondContact O-CB 3.25Å; F436-S440 PolarHBondContact O-N 3.03Å; F436-S440 PolarHBondContact O-OG 3.37Å; L437-S440 PolarHBondContact O-N 2.78Å; E438-S440 VanDerWaalsContact C-N 3.32Å; E438-S440 PolarHBondContact O-N 3.38Å; S440-K443 PolarHBondContact O-N 2.98Å; S440-F444 VanDerWaalsContact O-CD2 3.27Å; S440-F444 WeakPolarHBondContact O-CD2 3.42Å; S440-F444 PolarHBondContact O-N 2.91Å
441	R	90.1	Very high	84.9	Confident	7 Å²	7	70.6 Å²	70.6	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-66.2	-41.7	179.5	-68.4	169.4	-179	154.7	0.9	111.4	L437 E438 K443 F444 I445 G446 Y447 L449 D452 T455 L459	L437-R441 WeakPolarHBondContact O-CB 3.48Å; L437-R441 WeakPolarHBondContact O-CG 3.48Å; L437-R441 PolarHBondContact O-N 3.28Å; E438-R441 PolarHBondContact O-N 3.49Å; R441-K443 VanDerWaalsContact C-N 3.32Å; R441-K443 PolarHBondContact O-N 3.04Å; R441-F444 PolarHBondContact O-N 2.79Å; R441-I445 HydrophobicContact CB-CD1 4.47Å; R441-I445 HydrophobicContact CG-CD1 4.28Å; R441-I445 CarbonylContact O-C 3.51Å; R441-I445 VanDerWaalsContact O-CA 3.3Å; R441-I445 WeakPolarHBondContact O-CA 3.24Å; R441-I445 VanDerWaalsContact O-CB 3.3Å; R441-I445 WeakPolarHBondContact O-CB 3.41Å; R441-I445 PolarHBondContact O-N 3.25Å; R441-G446 PolarHBondContact O-N 3.2Å; R441-Y447 VanDerWaalsContact CB-O 3.3Å; R441-Y447 WeakPolarHBondContact CB-O 3.49Å; R441-L449 PolarHBondContact NH1-O 3.19Å; R441-D452 IonicContact CZ-OD2 2.66Å; R441-D452 PolarHBondContact NH1-O 2.91Å; R441-D452 IonicContact NH1-OD2 3.28Å; R441-D452 PolarHBondContact NH2-O 3.11Å; R441-D452 IonicContact NH2-OD2 3.6Å; R441-D452 PolarHBondContact NH2-OD2 3.32Å; R441-T455 PolarHBondContact NE-O 2.94Å; R441-T455 PolarHBondContact NH2-O 3.02Å; R441-L459 HydrophobicContact CG-CD1 4.2Å; R441-L459 HydrophobicContact CG-CD2 4.18Å
442	S	88.9	Confident	84.8	Confident	71 Å²	71	66.5 Å²	66.5	50%	0.497	38%	0.375	S	S	.	.	H	α-helix	trans	-57.7	-46.1	173.2	-179.2	0	0	0	0	111.2	E438 G446	E438-S442 WeakPolarHBondContact O-CB 3.24Å; E438-S442 PolarHBondContact O-N 2.82Å; S442-G446 WeakPolarHBondContact O-CA 3.41Å; S442-G446 PolarHBondContact O-N 3.35Å
443	K	89.7	Confident	84.6	Confident	163 Å²	163	66.7 Å²	66.7	71%	0.709	38%	0.377	S	S	*	.	H	α-helix	trans	-66.9	-42.2	179.9	-177	175.9	178.6	178.1	0	114.3	S439 S440 R441	S439-K443 VanDerWaalsContact O-CB 3.3Å; S439-K443 WeakPolarHBondContact O-CB 3.31Å; S439-K443 PolarHBondContact O-N 2.97Å; S440-K443 PolarHBondContact O-N 2.98Å; R441-K443 VanDerWaalsContact C-N 3.32Å; R441-K443 PolarHBondContact O-N 3.04Å
444	F	89.1	Confident	84.3	Confident	103 Å²	103	71.8 Å²	71.8	45%	0.452	40%	0.404	S	S	.	.	H	α-helix	trans	-101	-26	-170.4	-73.2	-80.1	0	0	0	114.4	S440 R441 L459 P460 I463	S440-F444 VanDerWaalsContact O-CD2 3.27Å; S440-F444 WeakPolarHBondContact O-CD2 3.42Å; S440-F444 PolarHBondContact O-N 2.91Å; R441-F444 PolarHBondContact O-N 2.79Å; F444-L459 HydrophobicContact CB-CD2 4.14Å; F444-P460 HydrophobicContact CD1-CG 3.86Å; F444-P460 HydrophobicContact CE1-CG 3.68Å; F444-P460 HydrophobicContact CG-CG 4.35Å; F444-P460 HydrophobicContact CZ-CG 4.04Å; F444-I463 HydrophobicContact CD2-CD1 3.65Å; F444-I463 HydrophobicContact CE2-CD1 3.42Å; F444-I463 VanDerWaalsContact CE2-CD1 3.42Å; F444-I463 HydrophobicContact CZ-CD1 4.22Å
445	I	87.6	Confident	84.1	Confident	83 Å²	83	71.5 Å²	71.5	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-119.3	-23.2	-172.3	-50.5	175.4	0	0	0	110.9	R441 Y447 V457 L459	R441-I445 HydrophobicContact CB-CD1 4.47Å; R441-I445 HydrophobicContact CG-CD1 4.28Å; R441-I445 CarbonylContact O-C 3.51Å; R441-I445 VanDerWaalsContact O-CA 3.3Å; R441-I445 WeakPolarHBondContact O-CA 3.24Å; R441-I445 VanDerWaalsContact O-CB 3.3Å; R441-I445 WeakPolarHBondContact O-CB 3.41Å; R441-I445 PolarHBondContact O-N 3.25Å; I445-Y447 PolarHBondContact O-N 3.36Å; I445-V457 VanDerWaalsContact CD1-O 3.27Å; I445-V457 WeakPolarHBondContact CD1-O 3.26Å; I445-L459 HydrophobicContact CD1-CD2 3.82Å; I445-L459 HydrophobicContact CD1-CG 4.19Å; I445-L459 HydrophobicContact CG1-CD2 4.21Å
446	G	84	Confident	84	Confident	65 Å²	65	69 Å²	69	67%	0.67	40%	0.397	S	S	*	.	S	Bend	trans	76	6.7	-178.9	0	0	0	0	0	114.6	R441 S442	R441-G446 PolarHBondContact O-N 3.2Å; S442-G446 WeakPolarHBondContact O-CA 3.41Å; S442-G446 PolarHBondContact O-N 3.35Å
447	Y	80.3	Confident	83.8	Confident	155 Å²	155	72.2 Å²	72.2	61%	0.608	42%	0.42	S	S	*	.			trans	-136.1	147.8	178.5	-177.8	-99.5	0	0	0	111.2	R441 I445 L449	R441-Y447 VanDerWaalsContact CB-O 3.3Å; R441-Y447 WeakPolarHBondContact CB-O 3.49Å; I445-Y447 PolarHBondContact O-N 3.36Å; Y447-L449 HydrophobicContact CD1-CD2 4.5Å; Y447-L449 HydrophobicContact CD1-CG 4.37Å; Y447-L449 HydrophobicContact CE1-CD2 3.75Å; Y447-L449 HydrophobicContact CE1-CG 4.03Å
448	T	75.4	Confident	83.5	Confident	50 Å²	50	75 Å²	75	31%	0.307	45%	0.45	S	S	.	.			trans	-119	129.9	-179.9	57.1	0	0	0	0	111	E438	E438-T448 HydrophobicContact CG-CG2 3.54Å
449	L	73.2	Confident	83.6	Confident	75 Å²	75	71 Å²	71	39%	0.393	43%	0.431	S	S	.	.			trans	-94	107.5	170.3	-68.1	160.7	0	0	0	107.1	R441 Y447 D452 T455	R441-L449 PolarHBondContact NH1-O 3.19Å; Y447-L449 HydrophobicContact CD1-CD2 4.5Å; Y447-L449 HydrophobicContact CD1-CG 4.37Å; Y447-L449 HydrophobicContact CE1-CD2 3.75Å; Y447-L449 HydrophobicContact CE1-CG 4.03Å; L449-D452 HydrophobicContact CB-CB 4.04Å; L449-T455 HydrophobicContact CD1-CG2 4.19Å
450	G	71.6	Confident	83.8	Confident	65 Å²	65	69.3 Å²	69.3	67%	0.67	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	136.8	178.9	0	0	0	0	0	111.6	D452	G450-D452 PolarHBondContact O-N 2.95Å
451	S	71.7	Confident	83.9	Confident	110 Å²	110	78.6 Å²	78.6	77%	0.769	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	4.8	175.7	-51.3	0	0	0	0	116.7
452	D	82.9	Confident	84	Confident	36 Å²	36	82.3 Å²	82.3	19%	0.193	48%	0.477	C	S	.	.			trans	-90.8	119.3	177.5	172.9	49.4	0	0	0	112.2	R441 L449 G450 N454 T455	R441-D452 IonicContact CZ-OD2 2.66Å; R441-D452 PolarHBondContact NH1-O 2.91Å; R441-D452 IonicContact NH1-OD2 3.28Å; R441-D452 PolarHBondContact NH2-O 3.11Å; R441-D452 IonicContact NH2-OD2 3.6Å; R441-D452 PolarHBondContact NH2-OD2 3.32Å; L449-D452 HydrophobicContact CB-CB 4.04Å; G450-D452 PolarHBondContact O-N 2.95Å; D452-N454 PolarHBondContact OD1-N 2.84Å; D452-T455 PolarHBondContact OD1-N 3.17Å; D452-T455 WeakPolarHBondContact OD2-CA 3.49Å; D452-T455 WeakPolarHBondContact OD2-CB 3.36Å; D452-T455 PolarHBondContact OD2-N 2.97Å; D452-T455 PolarHBondContact OD2-OG1 3.06Å
453	T	82.9	Confident	84.1	Confident	17 Å²	17	79.7 Å²	79.7	10%	0.104	46%	0.457	C	S	.	.	S	Bend	trans	-102.5	1.8	178.2	59	0	0	0	0	114	E430 I433 E434 L437 K471	E430-T453 HydrophobicContact CG-CG2 4.48Å; I433-T453 HydrophobicContact CG2-CG2 4.4Å; E434-T453 HydrophobicContact CG-CG2 3.51Å; L437-T453 WeakPolarHBondContact CD1-O 3.27Å; T453-K471 WeakPolarHBondContact O-CE 3.08Å; T453-K471 PolarHBondContact O-NZ 2.88Å
454	N	84.2	Confident	84.2	Confident	110 Å²	110	75.2 Å²	75.2	59%	0.588	44%	0.439	S	S	*	.	S	Bend	trans	-113.6	-33.2	-169.4	-68.2	-42.5	0	0	0	114.4	D452 V456 K471	D452-N454 PolarHBondContact OD1-N 2.84Å; N454-V456 PolarHBondContact O-N 3.17Å; N454-K471 PolarHBondContact OD1-NZ 2.91Å
455	T	84.2	Confident	84.3	Confident	55 Å²	55	76.6 Å²	76.6	34%	0.337	45%	0.447	S	S	.	.			trans	-74.6	111.2	-173.7	-49	0	0	0	0	111.6	R441 L449 D452 V457	R441-T455 PolarHBondContact NE-O 2.94Å; R441-T455 PolarHBondContact NH2-O 3.02Å; L449-T455 HydrophobicContact CD1-CG2 4.19Å; D452-T455 PolarHBondContact OD1-N 3.17Å; D452-T455 WeakPolarHBondContact OD2-CA 3.49Å; D452-T455 WeakPolarHBondContact OD2-CB 3.36Å; D452-T455 PolarHBondContact OD2-N 2.97Å; D452-T455 PolarHBondContact OD2-OG1 3.06Å; T455-V457 HydrophobicContact CG2-CB 4.15Å; T455-V457 HydrophobicContact CG2-CG2 4.02Å
456	V	84.9	Confident	84.4	Confident	43 Å²	43	75 Å²	75	26%	0.261	44%	0.443	S	S	.	.			trans	-110	8.6	177.9	-59.3	0	0	0	0	113.5	N454 G458 L459 H464 I467	N454-V456 PolarHBondContact O-N 3.17Å; V456-G458 PolarHBondContact O-N 2.85Å; V456-L459 WeakPolarHBondContact O-CB 3.25Å; V456-L459 PolarHBondContact O-N 3.2Å; V456-L459 VanDerWaalsContact O-N 3.16Å; V456-H464 PolarHBondContact O-NE2 3.11Å; V456-I467 HydrophobicContact CG1-CD1 3.5Å
457	V	84.5	Confident	84.7	Confident	118 Å²	118	72.1 Å²	72.1	72%	0.715	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	132.9	178.7	-177.4	0	0	0	0	109.5	I445 T455 L459	I445-V457 VanDerWaalsContact CD1-O 3.27Å; I445-V457 WeakPolarHBondContact CD1-O 3.26Å; T455-V457 HydrophobicContact CG2-CB 4.15Å; T455-V457 HydrophobicContact CG2-CG2 4.02Å; V457-L459 VanDerWaalsContact C-N 3.28Å; V457-L459 PolarHBondContact O-N 3.02Å
458	G	83.8	Confident	85.3	Confident	60 Å²	60	72.2 Å²	72.2	62%	0.619	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-4.6	-178.7	0	0	0	0	0	115.4	V456	V456-G458 PolarHBondContact O-N 2.85Å
459	L	89.6	Confident	86	Confident	11 Å²	11	72.8 Å²	72.8	6%	0.058	42%	0.419	C	S	.	.	S	Bend	trans	-92.8	144.5	177.2	-59	177.2	0	0	0	112	L437 R441 F444 I445 V456 V457 I463 H464	L437-L459 HydrophobicContact CD2-CD1 3.79Å; R441-L459 HydrophobicContact CG-CD1 4.2Å; R441-L459 HydrophobicContact CG-CD2 4.18Å; F444-L459 HydrophobicContact CB-CD2 4.14Å; I445-L459 HydrophobicContact CD1-CD2 3.82Å; I445-L459 HydrophobicContact CD1-CG 4.19Å; I445-L459 HydrophobicContact CG1-CD2 4.21Å; V456-L459 WeakPolarHBondContact O-CB 3.25Å; V456-L459 PolarHBondContact O-N 3.2Å; V456-L459 VanDerWaalsContact O-N 3.16Å; V457-L459 VanDerWaalsContact C-N 3.28Å; V457-L459 PolarHBondContact O-N 3.02Å; L459-I463 HydrophobicContact CB-CB 4.32Å; L459-I463 HydrophobicContact CB-CD1 4.48Å; L459-I463 HydrophobicContact CB-CG2 4.32Å; L459-I463 HydrophobicContact CD1-CG2 4.03Å; L459-I463 HydrophobicContact CD2-CD1 4.5Å; L459-H464 PolarHBondContact O-CE1 2.98Å; L459-H464 PolarHBondContact O-NE2 3.47Å
460	P	92.8	Very high	86.8	Confident	48 Å²	48	69.5 Å²	69.5	31%	0.312	40%	0.402	S	S	.	.			trans	-59.6	151.3	174.1	-26.5	33.9	0	0	0	114.5	F444 P462 I463 H464	F444-P460 HydrophobicContact CD1-CG 3.86Å; F444-P460 HydrophobicContact CE1-CG 3.68Å; F444-P460 HydrophobicContact CG-CG 4.35Å; F444-P460 HydrophobicContact CZ-CG 4.04Å; P460-P462 VanDerWaalsContact C-CD 3.48Å; P460-I463 HydrophobicContact CB-CG1 4.5Å; P460-I463 HydrophobicContact CG-CD1 4.37Å; P460-I463 WeakPolarHBondContact O-CB 2.99Å; P460-I463 PolarHBondContact O-N 3.43Å; P460-H464 PolarHBondContact O-N 3.44Å
461	R	90.6	Very high	87.7	Confident	205 Å²	205	70 Å²	70	77%	0.774	39%	0.385	S	S	*	.	H	α-helix	trans	-51.4	-41.6	178.8	-69.3	-175.6	179.7	-178	0.7	114.7	I463 H464 E465	R461-I463 PolarHBondContact O-N 2.99Å; R461-H464 WeakPolarHBondContact O-CA 3.19Å; R461-H464 VanDerWaalsContact O-CB 3.3Å; R461-H464 WeakPolarHBondContact O-CB 3.22Å; R461-H464 PolarHBondContact O-N 3.37Å; R461-E465 PolarHBondContact O-N 2.79Å; R461-E465 VanDerWaalsContact O-N 3.1Å
462	P	92.9	Very high	88.6	Confident	85 Å²	85	71.8 Å²	71.8	55%	0.552	38%	0.382	S	S	*	.	H	α-helix	trans	-59.7	-29.5	176.4	-26.8	36.3	0	0	0	114.1	P460 S466	P460-P462 VanDerWaalsContact C-CD 3.48Å; P462-S466 WeakPolarHBondContact O-CB 3.35Å; P462-S466 PolarHBondContact O-N 2.87Å; P462-S466 PolarHBondContact O-OG 3Å
463	I	90.4	Very high	88.9	Confident	17 Å²	17	73 Å²	73	9%	0.087	39%	0.386	C	S	.	.	H	α-helix	trans	-72.4	-36.9	175.6	-54.9	-170.8	0	0	0	110.2	F436 F444 L459 P460 R461 E465 S466 I467	F436-I463 HydrophobicContact CE1-CG2 3.79Å; F436-I463 HydrophobicContact CZ-CG2 4.22Å; F444-I463 HydrophobicContact CD2-CD1 3.65Å; F444-I463 HydrophobicContact CE2-CD1 3.42Å; F444-I463 VanDerWaalsContact CE2-CD1 3.42Å; F444-I463 HydrophobicContact CZ-CD1 4.22Å; L459-I463 HydrophobicContact CB-CB 4.32Å; L459-I463 HydrophobicContact CB-CD1 4.48Å; L459-I463 HydrophobicContact CB-CG2 4.32Å; L459-I463 HydrophobicContact CD1-CG2 4.03Å; L459-I463 HydrophobicContact CD2-CD1 4.5Å; P460-I463 HydrophobicContact CB-CG1 4.5Å; P460-I463 HydrophobicContact CG-CD1 4.37Å; P460-I463 WeakPolarHBondContact O-CB 2.99Å; P460-I463 PolarHBondContact O-N 3.43Å; R461-I463 PolarHBondContact O-N 2.99Å; I463-E465 VanDerWaalsContact C-N 3.34Å; I463-E465 PolarHBondContact O-N 3.32Å; I463-S466 WeakPolarHBondContact O-CB 3.3Å; I463-S466 PolarHBondContact O-N 2.82Å; I463-I467 HydrophobicContact CG2-CD1 3.84Å; I463-I467 HydrophobicContact CG2-CG1 4.37Å; I463-I467 WeakPolarHBondContact O-CD1 3.49Å; I463-I467 WeakPolarHBondContact O-CG1 3.29Å; I463-I467 PolarHBondContact O-N 3.34Å
464	H	91.4	Very high	89.2	Confident	69 Å²	69	76 Å²	76	32%	0.319	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-45.1	174.1	-58.6	178.5	0	0	0	111.2	V456 L459 P460 R461 I467 K468	V456-H464 PolarHBondContact O-NE2 3.11Å; L459-H464 PolarHBondContact O-CE1 2.98Å; L459-H464 PolarHBondContact O-NE2 3.47Å; P460-H464 PolarHBondContact O-N 3.44Å; R461-H464 WeakPolarHBondContact O-CA 3.19Å; R461-H464 VanDerWaalsContact O-CB 3.3Å; R461-H464 WeakPolarHBondContact O-CB 3.22Å; R461-H464 PolarHBondContact O-N 3.37Å; H464-I467 PolarHBondContact O-N 3.19Å; H464-K468 WeakPolarHBondContact O-CB 3.45Å; H464-K468 PolarHBondContact O-N 2.82Å
465	E	91	Very high	89.5	Confident	132 Å²	132	73 Å²	73	62%	0.617	38%	0.379	S	S	*	.	H	α-helix	trans	-63.9	-40.8	176.3	-68.6	-179.8	-179.1	0	0	112.1	R461 I463 K468 T469	R461-E465 PolarHBondContact O-N 2.79Å; R461-E465 VanDerWaalsContact O-N 3.1Å; I463-E465 VanDerWaalsContact C-N 3.34Å; I463-E465 PolarHBondContact O-N 3.32Å; E465-K468 PolarHBondContact O-N 3.02Å; E465-T469 PolarHBondContact O-N 3.24Å; E465-T469 PolarHBondContact O-OG1 2.74Å
466	S	90.4	Very high	89.9	Confident	49 Å²	49	72 Å²	72	34%	0.343	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-47.1	175.5	-61.6	0	0	0	0	111	P462 I463 K468 T469 L470	P462-S466 WeakPolarHBondContact O-CB 3.35Å; P462-S466 PolarHBondContact O-N 2.87Å; P462-S466 PolarHBondContact O-OG 3Å; I463-S466 WeakPolarHBondContact O-CB 3.3Å; I463-S466 PolarHBondContact O-N 2.82Å; S466-K468 PolarHBondContact O-N 3.08Å; S466-T469 WeakPolarHBondContact O-CB 3.44Å; S466-T469 PolarHBondContact O-N 3.38Å; S466-L470 VanDerWaalsContact O-CG 3.31Å; S466-L470 WeakPolarHBondContact O-CG 3.38Å; S466-L470 PolarHBondContact O-N 3.4Å
467	I	90.5	Very high	90.2	Very high	5 Å²	5	71 Å²	71	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-63.3	-42.5	177.4	-66.6	159.1	0	0	0	111	F436 L437 V456 I463 H464 T469 L470 K471	F436-I467 HydrophobicContact CD1-CG1 4.08Å; F436-I467 HydrophobicContact CE1-CG1 3.9Å; L437-I467 HydrophobicContact CD2-CD1 3.36Å; L437-I467 HydrophobicContact CD2-CG1 4.16Å; L437-I467 HydrophobicContact CG-CD1 4.04Å; L437-I467 HydrophobicContact CG-CG1 4.33Å; V456-I467 HydrophobicContact CG1-CD1 3.5Å; I463-I467 HydrophobicContact CG2-CD1 3.84Å; I463-I467 HydrophobicContact CG2-CG1 4.37Å; I463-I467 WeakPolarHBondContact O-CD1 3.49Å; I463-I467 WeakPolarHBondContact O-CG1 3.29Å; I463-I467 PolarHBondContact O-N 3.34Å; H464-I467 PolarHBondContact O-N 3.19Å; I467-T469 VanDerWaalsContact C-N 3.28Å; I467-T469 PolarHBondContact O-N 2.87Å; I467-L470 PolarHBondContact O-N 3.2Å; I467-K471 HydrophobicContact CG2-CD 4.05Å; I467-K471 HydrophobicContact CG2-CG 4.28Å; I467-K471 WeakPolarHBondContact O-CB 3.13Å; I467-K471 WeakPolarHBondContact O-CG 3.38Å; I467-K471 PolarHBondContact O-N 3.09Å
468	K	91.3	Very high	90.7	Very high	156 Å²	156	65.9 Å²	65.9	68%	0.678	34%	0.335	S	S	*	.	H	α-helix	trans	-57.2	-44.6	175.8	-175.1	-179.8	177.9	-177.7	0	110.9	H464 E465 S466 K471 Q472	H464-K468 WeakPolarHBondContact O-CB 3.45Å; H464-K468 PolarHBondContact O-N 2.82Å; E465-K468 PolarHBondContact O-N 3.02Å; S466-K468 PolarHBondContact O-N 3.08Å; K468-K471 PolarHBondContact O-N 3.43Å; K468-Q472 PolarHBondContact O-N 3.16Å
469	T	90.5	Very high	91.2	Very high	63 Å²	63	63.7 Å²	63.7	39%	0.387	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-44.1	176.6	-54.5	0	0	0	0	112	E465 S466 I467 K471 Q472 H473 L747	E465-T469 PolarHBondContact O-N 3.24Å; E465-T469 PolarHBondContact O-OG1 2.74Å; S466-T469 WeakPolarHBondContact O-CB 3.44Å; S466-T469 PolarHBondContact O-N 3.38Å; I467-T469 VanDerWaalsContact C-N 3.28Å; I467-T469 PolarHBondContact O-N 2.87Å; T469-K471 VanDerWaalsContact C-N 3.34Å; T469-K471 PolarHBondContact O-N 3.33Å; T469-Q472 PolarHBondContact O-N 3.04Å; T469-H473 PolarHBondContact O-CD2 2.77Å; T469-H473 PolarHBondContact O-N 3.38Å; T469-L747 HydrophobicContact CG2-CD1 4.18Å
470	L	90.4	Very high	91.4	Very high	6 Å²	6	66 Å²	66	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-61.4	-42.5	177	-70.4	177.1	0	0	0	111.7	V428 I433 F436 S466 I467 H473 K474 L747	V428-L470 HydrophobicContact CG1-CB 4.17Å; V428-L470 HydrophobicContact CG1-CD2 3.94Å; V428-L470 HydrophobicContact CG2-CD2 3.9Å; I433-L470 HydrophobicContact CD1-CB 4.47Å; I433-L470 HydrophobicContact CG1-CB 4.08Å; F436-L470 HydrophobicContact CB-CD1 4.06Å; F436-L470 HydrophobicContact CD1-CD1 3.71Å; F436-L470 HydrophobicContact CD2-CD1 4.46Å; F436-L470 HydrophobicContact CE1-CD1 4.28Å; F436-L470 HydrophobicContact CG-CD1 3.81Å; S466-L470 VanDerWaalsContact O-CG 3.31Å; S466-L470 WeakPolarHBondContact O-CG 3.38Å; S466-L470 PolarHBondContact O-N 3.4Å; I467-L470 PolarHBondContact O-N 3.2Å; L470-H473 CarbonylContact O-C 3.51Å; L470-H473 PolarHBondContact O-N 3.02Å; L470-K474 PolarHBondContact O-N 3.46Å; L470-L747 HydrophobicContact CD2-CB 3.92Å; L470-L747 HydrophobicContact CD2-CD1 3.93Å
471	K	90.5	Very high	91.4	Very high	75 Å²	75	65 Å²	65	33%	0.326	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-38.5	176.7	-74.3	-175.9	179	-175.4	0	112.3	I433 T453 N454 I467 K468 T469 H473 K474	I433-K471 HydrophobicContact CD1-CG 4.15Å; T453-K471 WeakPolarHBondContact O-CE 3.08Å; T453-K471 PolarHBondContact O-NZ 2.88Å; N454-K471 PolarHBondContact OD1-NZ 2.91Å; I467-K471 HydrophobicContact CG2-CD 4.05Å; I467-K471 HydrophobicContact CG2-CG 4.28Å; I467-K471 WeakPolarHBondContact O-CB 3.13Å; I467-K471 WeakPolarHBondContact O-CG 3.38Å; I467-K471 PolarHBondContact O-N 3.09Å; K468-K471 PolarHBondContact O-N 3.43Å; T469-K471 VanDerWaalsContact C-N 3.34Å; T469-K471 PolarHBondContact O-N 3.33Å; K471-H473 PolarHBondContact O-N 3.29Å; K471-K474 VanDerWaalsContact O-CB 3.26Å; K471-K474 WeakPolarHBondContact O-CB 3.32Å; K471-K474 PolarHBondContact O-N 3.27Å; K471-K474 VanDerWaalsContact O-N 3.1Å
472	Q	89.9	Confident	91.6	Very high	148 Å²	148	55.7 Å²	55.7	69%	0.692	28%	0.281	S	S	*	.	H	α-helix	trans	-59.9	-33.6	175.9	-175.7	178.7	1	0	0	112.5	K468 T469	K468-Q472 PolarHBondContact O-N 3.16Å; T469-Q472 PolarHBondContact O-N 3.04Å
473	H	89.3	Confident	91.6	Very high	60 Å²	60	52.7 Å²	52.7	28%	0.278	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	16.5	177.5	-65.8	-67.3	0	0	0	113.7	V428 T469 L470 K471 Y475	V428-H473 HydrophobicContact CG2-CB 3.91Å; V428-H473 PolarHBondContact N-O 2.92Å; T469-H473 PolarHBondContact O-CD2 2.77Å; T469-H473 PolarHBondContact O-N 3.38Å; L470-H473 CarbonylContact O-C 3.51Å; L470-H473 PolarHBondContact O-N 3.02Å; K471-H473 PolarHBondContact O-N 3.29Å; H473-Y475 PolarHBondContact O-N 3.5Å
474	K	90.2	Very high	91.7	Very high	80 Å²	80	56.6 Å²	56.6	35%	0.348	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-60.9	122.3	176	-176.3	177.8	175.7	176	0	109.3	V428 E430 I433 L470 K471	V428-K474 CarbonylContact O-C 3.59Å; V428-K474 WeakPolarHBondContact O-CA 2.99Å; E430-K474 IonicContact OE1-NZ 2.7Å; E430-K474 PolarHBondContact OE1-NZ 3.2Å; E430-K474 WeakPolarHBondContact OE2-CE 3.21Å; E430-K474 IonicContact OE2-NZ 3.19Å; E430-K474 PolarHBondContact OE2-NZ 2.76Å; I433-K474 HydrophobicContact CD1-CB 4.47Å; I433-K474 HydrophobicContact CD1-CD 4.45Å; I433-K474 HydrophobicContact CD1-CG 4.48Å; L470-K474 PolarHBondContact O-N 3.46Å; K471-K474 VanDerWaalsContact O-CB 3.26Å; K471-K474 WeakPolarHBondContact O-CB 3.32Å; K471-K474 PolarHBondContact O-N 3.27Å; K471-K474 VanDerWaalsContact O-N 3.1Å
475	Y	90.4	Very high	91.6	Very high	49 Å²	49	57.2 Å²	57.2	19%	0.192	29%	0.285	C	S	.	.			trans	-116.7	111.4	174.4	170.9	-95.9	0	0	0	109.2	L320 K427 V428 H473	L320-Y475 HydrophobicContact CD2-CE2 3.88Å; K427-Y475 HydrophobicContact CD-CD1 4.07Å; K427-Y475 HydrophobicContact CD-CD2 4.27Å; K427-Y475 HydrophobicContact CD-CG 3.92Å; K427-Y475 HydrophobicContact CG-CG 4.33Å; V428-Y475 PolarHBondContact O-N 3.45Å; H473-Y475 PolarHBondContact O-N 3.5Å
476	T	91.6	Very high	91.5	Very high	32 Å²	32	51.3 Å²	51.3	20%	0.196	26%	0.257	C	S	.	.			trans	-92.5	124	170.2	-48.9	0	0	0	0	109.9	R312 L317 V481	R312-T476 PolarHBondContact NH1-O 2.81Å; L317-T476 HydrophobicContact CD2-CG2 4.17Å; T476-V481 HydrophobicContact CG2-CG2 3.84Å
477	S	92.4	Very high	91.4	Very high	23 Å²	23	53.5 Å²	53.5	16%	0.161	26%	0.262	C	S	.	.			trans	-88.8	149.9	176.5	74.9	0	0	0	0	111.6	A479 E480 V481	S477-A479 PolarHBondContact O-N 3.37Å; S477-E480 PolarHBondContact N-OE2 3.12Å; S477-E480 PolarHBondContact O-N 3.41Å; S477-E480 VanDerWaalsContact OG-CD 3.29Å; S477-E480 VanDerWaalsContact OG-CG 3.31Å; S477-E480 WeakPolarHBondContact OG-CG 3.46Å; S477-E480 PolarHBondContact OG-N 3.28Å; S477-E480 VanDerWaalsContact OG-N 3.17Å; S477-E480 PolarHBondContact OG-OE2 2.89Å; S477-E480 VanDerWaalsContact OG-OE2 3.06Å; S477-V481 PolarHBondContact O-N 3.3Å
478	I	95.1	Very high	91.3	Very high	10 Å²	10	59.6 Å²	59.6	5%	0.051	29%	0.29	C	S	.	.	H	α-helix	trans	-54	-37.8	172.8	-60	173	0	0	0	110.6	K308 K311 R312 L315 L317 E480 V481 Q482 L591	K308-I478 HydrophobicContact CG-CD1 3.93Å; K311-I478 HydrophobicContact CB-CD1 4.29Å; K311-I478 HydrophobicContact CD-CG2 4.33Å; K311-I478 HydrophobicContact CG-CD1 4.28Å; R312-I478 HydrophobicContact CG-CD1 3.93Å; R312-I478 HydrophobicContact CG-CG1 4.01Å; L315-I478 HydrophobicContact CD1-CG1 4.39Å; L315-I478 HydrophobicContact CD1-CG2 3.99Å; L317-I478 HydrophobicContact CD1-CG1 4.32Å; I478-E480 VanDerWaalsContact C-N 3.32Å; I478-E480 PolarHBondContact O-N 3.18Å; I478-V481 PolarHBondContact O-N 3.45Å; I478-Q482 HydrophobicContact CG2-CG 4.23Å; I478-Q482 WeakPolarHBondContact O-CB 3.1Å; I478-Q482 VanDerWaalsContact O-CG 3.29Å; I478-Q482 WeakPolarHBondContact O-CG 3.27Å; I478-Q482 PolarHBondContact O-N 2.99Å; I478-L591 HydrophobicContact CD1-CD1 3.76Å
479	A	94.1	Very high	90.9	Very high	15 Å²	15	54.3 Å²	54.3	12%	0.124	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-33.4	178.5	0	0	0	0	0	113.7	S477 A483 I594	S477-A479 PolarHBondContact O-N 3.37Å; A479-A483 WeakPolarHBondContact O-CB 3.38Å; A479-A483 PolarHBondContact O-N 3.42Å; A479-I594 HydrophobicContact CB-CB 4.03Å; A479-I594 HydrophobicContact CB-CD1 3.67Å; A479-I594 HydrophobicContact CB-CG1 3.85Å
480	E	92.6	Very high	90.4	Very high	60 Å²	60	55.1 Å²	55.1	28%	0.28	27%	0.269	S	S	.	.	H	α-helix	trans	-71.8	-42	175.5	-75.4	156	170.1	0	0	110.3	S477 I478 Q482 A483 Q484	S477-E480 PolarHBondContact N-OE2 3.12Å; S477-E480 PolarHBondContact O-N 3.41Å; S477-E480 VanDerWaalsContact OG-CD 3.29Å; S477-E480 VanDerWaalsContact OG-CG 3.31Å; S477-E480 WeakPolarHBondContact OG-CG 3.46Å; S477-E480 PolarHBondContact OG-N 3.28Å; S477-E480 VanDerWaalsContact OG-N 3.17Å; S477-E480 PolarHBondContact OG-OE2 2.89Å; S477-E480 VanDerWaalsContact OG-OE2 3.06Å; I478-E480 VanDerWaalsContact C-N 3.32Å; I478-E480 PolarHBondContact O-N 3.18Å; E480-Q482 PolarHBondContact O-N 3.25Å; E480-A483 PolarHBondContact O-N 3.11Å; E480-Q484 WeakPolarHBondContact O-CB 3.37Å; E480-Q484 VanDerWaalsContact O-CG 3.31Å; E480-Q484 WeakPolarHBondContact O-CG 3.32Å; E480-Q484 PolarHBondContact O-N 2.79Å
481	V	94.6	Very high	90.1	Very high	26 Å²	26	64.4 Å²	64.4	16%	0.158	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-47.5	174.5	-179.9	0	0	0	0	110.7	L315 L317 T476 S477 I478 A483 Q484 M485	L315-V481 HydrophobicContact CD1-CG1 4.34Å; L315-V481 HydrophobicContact CD2-CG1 4.26Å; L317-V481 HydrophobicContact CD1-CG2 4.15Å; L317-V481 HydrophobicContact CD2-CG2 4.28Å; T476-V481 HydrophobicContact CG2-CG2 3.84Å; S477-V481 PolarHBondContact O-N 3.3Å; I478-V481 PolarHBondContact O-N 3.45Å; V481-A483 PolarHBondContact O-N 3.06Å; V481-Q484 PolarHBondContact O-N 3.07Å; V481-M485 HydrophobicContact CG1-SD 4.29Å; V481-M485 WeakPolarHBondContact O-CG 3.21Å; V481-M485 PolarHBondContact O-N 3.02Å
482	Q	94.5	Very high	89.5	Confident	10 Å²	10	63.5 Å²	63.5	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-45	177.9	-73	174.6	-27.4	0	0	112.5	I478 E480 Q484 M485 E486 N592 I594	I478-Q482 HydrophobicContact CG2-CG 4.23Å; I478-Q482 WeakPolarHBondContact O-CB 3.1Å; I478-Q482 VanDerWaalsContact O-CG 3.29Å; I478-Q482 WeakPolarHBondContact O-CG 3.27Å; I478-Q482 PolarHBondContact O-N 2.99Å; E480-Q482 PolarHBondContact O-N 3.25Å; Q482-Q484 VanDerWaalsContact C-N 3.3Å; Q482-Q484 PolarHBondContact O-N 3.34Å; Q482-M485 PolarHBondContact O-N 2.88Å; Q482-E486 WeakPolarHBondContact O-CG 3.44Å; Q482-E486 PolarHBondContact O-N 2.97Å; Q482-E486 VanDerWaalsContact O-N 3.12Å; Q482-N592 PolarHBondContact NE2-O 3.32Å; Q482-I594 HydrophobicContact CB-CB 4.49Å; Q482-I594 HydrophobicContact CB-CG2 3.8Å
483	A	92.7	Very high	88.5	Confident	22 Å²	22	59.9 Å²	59.9	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-37.5	176.6	0	0	0	0	0	112.3	A479 E480 V481 E486 E487 I594	A479-A483 WeakPolarHBondContact O-CB 3.38Å; A479-A483 PolarHBondContact O-N 3.42Å; E480-A483 PolarHBondContact O-N 3.11Å; V481-A483 PolarHBondContact O-N 3.06Å; A483-E486 PolarHBondContact O-N 3.2Å; A483-E487 WeakPolarHBondContact O-CG 3.33Å; A483-E487 PolarHBondContact O-N 2.93Å; A483-I594 HydrophobicContact CB-CG2 4.46Å
484	Q	91.3	Very high	87.3	Confident	99 Å²	99	63.4 Å²	63.4	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-41.1	175.5	-75.1	173.2	-13.8	0	0	112.3	E480 V481 Q482 E486 E487 E488	E480-Q484 WeakPolarHBondContact O-CB 3.37Å; E480-Q484 VanDerWaalsContact O-CG 3.31Å; E480-Q484 WeakPolarHBondContact O-CG 3.32Å; E480-Q484 PolarHBondContact O-N 2.79Å; V481-Q484 PolarHBondContact O-N 3.07Å; Q482-Q484 VanDerWaalsContact C-N 3.3Å; Q482-Q484 PolarHBondContact O-N 3.34Å; Q484-E486 VanDerWaalsContact C-N 3.28Å; Q484-E486 PolarHBondContact O-N 3.44Å; Q484-E487 WeakPolarHBondContact O-CB 3.33Å; Q484-E487 PolarHBondContact O-N 3.33Å; Q484-E488 PolarHBondContact O-N 3.34Å
485	M	89.7	Confident	85.9	Confident	82 Å²	82	64.6 Å²	64.6	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-41.2	174.5	-69.4	175.1	69.9	0	0	111.3	V481 Q482 E488 F489	V481-M485 HydrophobicContact CG1-SD 4.29Å; V481-M485 WeakPolarHBondContact O-CG 3.21Å; V481-M485 PolarHBondContact O-N 3.02Å; Q482-M485 PolarHBondContact O-N 2.88Å; M485-E488 WeakPolarHBondContact O-CB 3.44Å; M485-E488 PolarHBondContact O-N 3.44Å; M485-F489 WeakPolarHBondContact O-CD2 3.17Å; M485-F489 PolarHBondContact O-N 3.12Å
486	E	89.7	Confident	84.4	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.033	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-38.7	175.8	-65.7	-65.2	152.4	0	0	112.8	Q482 A483 Q484 E488 F489 L490 H593 Y595 F778 R781	Q482-E486 WeakPolarHBondContact O-CG 3.44Å; Q482-E486 PolarHBondContact O-N 2.97Å; Q482-E486 VanDerWaalsContact O-N 3.12Å; A483-E486 PolarHBondContact O-N 3.2Å; Q484-E486 VanDerWaalsContact C-N 3.28Å; Q484-E486 PolarHBondContact O-N 3.44Å; E486-E488 VanDerWaalsContact C-N 3.28Å; E486-E488 PolarHBondContact O-N 2.68Å; E486-F489 PolarHBondContact O-N 3.08Å; E486-L490 VanDerWaalsContact O-CG 3.28Å; E486-L490 WeakPolarHBondContact O-CG 3.49Å; E486-L490 PolarHBondContact O-N 3.45Å; E486-L490 VanDerWaalsContact O-N 3.08Å; E486-H593 IonicContact OE1-CE1 2.8Å; E486-H593 PolarHBondContact OE1-CE1 3.23Å; E486-H593 IonicContact OE1-NE2 3.44Å; E486-H593 PolarHBondContact OE1-NE2 3.44Å; E486-Y595 HydrophobicContact CB-CD2 4.41Å; E486-Y595 HydrophobicContact CB-CE2 3.65Å; E486-Y595 HydrophobicContact CG-CD2 3.83Å; E486-Y595 HydrophobicContact CG-CE2 3.55Å; E486-F778 VanDerWaalsContact OE1-CD2 3.27Å; E486-F778 WeakPolarHBondContact OE1-CD2 3.41Å; E486-R781 IonicContact OE1-NH2 3.34Å; E486-R781 PolarHBondContact OE1-NH2 3.37Å; E486-R781 IonicContact OE2-CZ 2.68Å; E486-R781 IonicContact OE2-NE 3.27Å; E486-R781 IonicContact OE2-NH2 2.68Å; E486-R781 PolarHBondContact OE2-NH2 2.8Å
487	E	89	Confident	82.9	Confident	95 Å²	95	65.7 Å²	65.7	44%	0.444	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-35.7	172.3	-72.4	176.5	-166.4	0	0	112	A483 Q484 L490 R491	A483-E487 WeakPolarHBondContact O-CG 3.33Å; A483-E487 PolarHBondContact O-N 2.93Å; Q484-E487 WeakPolarHBondContact O-CB 3.33Å; Q484-E487 PolarHBondContact O-N 3.33Å; E487-L490 PolarHBondContact O-N 2.88Å; E487-R491 WeakPolarHBondContact O-CG 3.39Å; E487-R491 PolarHBondContact O-N 3.41Å; E487-R491 VanDerWaalsContact O-N 3.12Å
488	E	87.4	Confident	81.5	Confident	133 Å²	133	74 Å²	74	62%	0.621	40%	0.403	S	S	*	.	H	α-helix	trans	-69.5	-44.3	176.2	-172.8	170.3	-165.1	0	0	112.1	Q484 M485 E486 L490 R491 S492	Q484-E488 PolarHBondContact O-N 3.34Å; M485-E488 WeakPolarHBondContact O-CB 3.44Å; M485-E488 PolarHBondContact O-N 3.44Å; E486-E488 VanDerWaalsContact C-N 3.28Å; E486-E488 PolarHBondContact O-N 2.68Å; E488-L490 PolarHBondContact O-N 2.91Å; E488-R491 PolarHBondContact O-N 3.18Å; E488-S492 PolarHBondContact O-N 3.34Å
489	F	83	Confident	80.5	Confident	45 Å²	45	76.4 Å²	76.4	20%	0.197	42%	0.415	C	S	.	.	H	α-helix	trans	-57	-38.3	172.5	-77.1	-59.1	0	0	0	112.2	M485 E486 S492 E499	M485-F489 WeakPolarHBondContact O-CD2 3.17Å; M485-F489 PolarHBondContact O-N 3.12Å; E486-F489 PolarHBondContact O-N 3.08Å; F489-S492 CarbonylContact O-C 3.47Å; F489-E499 HydrophobicContact CZ-CG 4.4Å
490	L	80.4	Confident	79.7	Confident	81 Å²	81	85 Å²	85	42%	0.424	45%	0.452	S	S	.	.	H	α-helix	trans	-70.2	-29.5	176.1	-70.7	173	0	0	0	113.3	E486 E487 E488	E486-L490 VanDerWaalsContact O-CG 3.28Å; E486-L490 WeakPolarHBondContact O-CG 3.49Å; E486-L490 PolarHBondContact O-N 3.45Å; E486-L490 VanDerWaalsContact O-N 3.08Å; E487-L490 PolarHBondContact O-N 2.88Å; E488-L490 PolarHBondContact O-N 2.91Å
491	R	83.6	Confident	79.3	Confident	200 Å²	200	83.7 Å²	83.7	76%	0.755	45%	0.448	S	S	*	.	H	α-helix	trans	-75.1	-35.1	176.9	-75.2	176	-174.2	-173.9	4.3	112.4	E487 E488 P493	E487-R491 WeakPolarHBondContact O-CG 3.39Å; E487-R491 PolarHBondContact O-N 3.41Å; E487-R491 VanDerWaalsContact O-N 3.12Å; E488-R491 PolarHBondContact O-N 3.18Å; R491-P493 VanDerWaalsContact C-CD 3.45Å; R491-P493 WeakPolarHBondContact O-CD 3.35Å
492	S	77.9	Confident	78.9	Confident	56 Å²	56	89.7 Å²	89.7	39%	0.392	48%	0.475	S	S	.	.			trans	-127.8	61.4	-173.4	-59.2	0	0	0	0	112.4	E488 F489 L494 S495 G496	E488-S492 PolarHBondContact O-N 3.34Å; F489-S492 CarbonylContact O-C 3.47Å; S492-L494 VanDerWaalsContact C-N 3.26Å; S492-L494 PolarHBondContact O-N 3.38Å; S492-S495 PolarHBondContact O-N 2.79Å; S492-G496 PolarHBondContact O-N 3.22Å
493	P	68.6	Low	78.6	Confident	73 Å²	73	94.4 Å²	94.4	47%	0.474	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.6	-172.8	24.8	-34.1	0	0	0	113.7	R491 F792	R491-P493 VanDerWaalsContact C-CD 3.45Å; R491-P493 WeakPolarHBondContact O-CD 3.35Å; P493-F792 HydrophobicContact CB-CE1 4.01Å; P493-F792 HydrophobicContact CB-CE2 4.49Å; P493-F792 HydrophobicContact CB-CZ 3.88Å; P493-F792 HydrophobicContact CG-CE1 4.02Å; P493-F792 HydrophobicContact CG-CZ 4.11Å
494	L	63.9	Low	78.6	Confident	133 Å²	133	95.1 Å²	95.1	70%	0.696	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-22.8	-178.4	-71.1	167.8	0	0	0	113.9	S492 F792	S492-L494 VanDerWaalsContact C-N 3.26Å; S492-L494 PolarHBondContact O-N 3.38Å; L494-F792 HydrophobicContact CD2-CD1 3.67Å; L494-F792 HydrophobicContact CD2-CE1 4.41Å; L494-F792 HydrophobicContact CG-CD1 4.18Å; L494-F792 HydrophobicContact CG-CE1 4.45Å
495	S	61.5	Low	78.7	Confident	106 Å²	106	93.4 Å²	93.4	74%	0.741	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-11.7	-172.4	-48.7	0	0	0	0	113.5	S492	S492-S495 PolarHBondContact O-N 2.79Å
496	G	58.2	Low	79	Confident	39 Å²	39	90.1 Å²	90.1	40%	0.402	48%	0.482	S	S	.	.	S	Bend	trans	-78.8	-14.4	-172.7	0	0	0	0	0	115.9	S492	S492-G496 PolarHBondContact O-N 3.22Å
497	G	60.4	Low	79.2	Confident	64 Å²	64	89.8 Å²	89.8	66%	0.66	48%	0.48	S	S	*	.			trans	64.7	-179.1	-174	0	0	0	0	0	113.8
498	E	64.3	Low	79.5	Confident	197 Å²	197	86.5 Å²	86.5	92%	0.921	47%	0.467	S	S	*	.	S	Bend	trans	-69.1	130.6	166.3	-74.4	-171.3	163.7	0	0	109.3	E500	E498-E500 PolarHBondContact O-N 3.44Å
499	E	74.3	Confident	79.9	Confident	62 Å²	62	80.6 Å²	80.6	29%	0.29	44%	0.439	S	S	.	.			trans	-70.2	118.2	176.8	-173.4	-175.6	175.4	0	0	109.7	F489 V501 R781 R782	F489-E499 HydrophobicContact CZ-CG 4.4Å; E499-V501 HydrophobicContact CB-CG2 4.36Å; E499-V501 HydrophobicContact CG-CG2 3.94Å; E499-V501 PolarHBondContact O-N 3.02Å; E499-V501 VanDerWaalsContact O-N 3.07Å; E499-R781 IonicContact OE2-CZ 2.82Å; E499-R781 IonicContact OE2-NH1 3.38Å; E499-R781 PolarHBondContact OE2-NH1 3.46Å; E499-R781 IonicContact OE2-NH2 2.71Å; E499-R781 PolarHBondContact OE2-NH2 3.34Å; E499-R782 IonicContact OE1-CZ 3.74Å; E499-R782 IonicContact OE1-NH1 3.69Å; E499-R782 PolarHBondContact OE1-NH1 2.99Å; E499-R782 IonicContact OE2-NH1 2.94Å; E499-R782 PolarHBondContact OE2-NH1 3.06Å; E499-R782 VanDerWaalsContact OE2-NH1 3.1Å
500	E	76	Confident	80.5	Confident	195 Å²	195	78.4 Å²	78.4	91%	0.911	43%	0.43	S	S	*	.			trans	-73	100.9	170.2	-73	-169.8	175.6	0	0	110.2	E498	E498-E500 PolarHBondContact O-N 3.44Å
501	V	84.4	Confident	81.2	Confident	32 Å²	32	78 Å²	78	19%	0.194	43%	0.425	C	S	.	.			trans	-94.6	113.4	180	174.5	0	0	0	0	110.9	E499 Q503 E507 R782	E499-V501 HydrophobicContact CB-CG2 4.36Å; E499-V501 HydrophobicContact CG-CG2 3.94Å; E499-V501 PolarHBondContact O-N 3.02Å; E499-V501 VanDerWaalsContact O-N 3.07Å; V501-Q503 PolarHBondContact O-N 3.3Å; V501-Q503 PolarHBondContact O-NE2 3.38Å; V501-Q503 VanDerWaalsContact O-NE2 3.08Å; V501-E507 HydrophobicContact CG1-CG 3.82Å; V501-R782 HydrophobicContact CG2-CG 4.26Å
502	E	86	Confident	81.7	Confident	153 Å²	153	69.3 Å²	69.3	72%	0.715	40%	0.398	S	S	*	.			trans	-60	123.1	170.3	-167.2	-174.7	177	0	0	110.7	V504	E502-V504 HydrophobicContact CB-CG1 4.4Å; E502-V504 HydrophobicContact CG-CG1 3.83Å; E502-V504 PolarHBondContact O-N 2.8Å
503	Q	89.2	Confident	82.5	Confident	108 Å²	108	66.6 Å²	66.6	51%	0.505	38%	0.38	S	S	.	.			trans	-81.5	69.5	179.9	-61.9	-55.5	-50.7	0	0	111.1	V501	V501-Q503 PolarHBondContact O-N 3.3Å; V501-Q503 PolarHBondContact O-NE2 3.38Å; V501-Q503 VanDerWaalsContact O-NE2 3.08Å
504	V	92.3	Very high	83.8	Confident	37 Å²	37	64.5 Å²	64.5	22%	0.224	36%	0.364	C	S	.	.			trans	-76.9	156.1	172.4	-62	0	0	0	0	111	E502 A506 E507 T508 N592	E502-V504 HydrophobicContact CB-CG1 4.4Å; E502-V504 HydrophobicContact CG-CG1 3.83Å; E502-V504 PolarHBondContact O-N 2.8Å; V504-A506 HydrophobicContact CG2-CB 4.43Å; V504-A506 PolarHBondContact O-N 3.34Å; V504-E507 HydrophobicContact CG2-CB 3.84Å; V504-E507 WeakPolarHBondContact O-CA 3.31Å; V504-E507 VanDerWaalsContact O-CB 3.29Å; V504-E507 WeakPolarHBondContact O-CB 3.47Å; V504-E507 PolarHBondContact O-N 3.29Å; V504-T508 PolarHBondContact O-N 2.97Å; V504-T508 VanDerWaalsContact O-N 3.09Å; V504-T508 PolarHBondContact O-OG1 3.02Å; V504-N592 WeakPolarHBondContact CG2-OD1 3.28Å
505	P	93.4	Very high	85.2	Confident	64 Å²	64	63.1 Å²	63.1	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-53.9	-34	-178.3	-29.5	35.9	0	0	0	114.7	L298 L509	L298-P505 HydrophobicContact CD2-CB 3.96Å; P505-L509 VanDerWaalsContact O-CB 3.31Å; P505-L509 WeakPolarHBondContact O-CB 3.26Å; P505-L509 PolarHBondContact O-N 3.35Å
506	A	95.5	Very high	86.8	Confident	12 Å²	12	60.2 Å²	60.2	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-67.9	-33.8	175.9	0	0	0	0	0	112.9	L298 V504 Y510 F589 N592	L298-A506 HydrophobicContact CD2-CB 4.14Å; V504-A506 HydrophobicContact CG2-CB 4.43Å; V504-A506 PolarHBondContact O-N 3.34Å; A506-Y510 WeakPolarHBondContact O-CB 3.23Å; A506-Y510 PolarHBondContact O-N 3.48Å; A506-F589 WeakPolarHBondContact O-CE1 3.37Å; A506-N592 HydrophobicContact CB-CB 4.05Å
507	E	94.9	Very high	88.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-70.8	-50.4	176.7	-175	70.3	-169.8	0	0	110.2	V501 V504 L509 Y510 Q511 N592 Q596 R782 Y783	V501-E507 HydrophobicContact CG1-CG 3.82Å; V504-E507 HydrophobicContact CG2-CB 3.84Å; V504-E507 WeakPolarHBondContact O-CA 3.31Å; V504-E507 VanDerWaalsContact O-CB 3.29Å; V504-E507 WeakPolarHBondContact O-CB 3.47Å; V504-E507 PolarHBondContact O-N 3.29Å; E507-L509 VanDerWaalsContact C-N 3.3Å; E507-L509 PolarHBondContact O-N 2.9Å; E507-Y510 PolarHBondContact O-N 3.43Å; E507-Y510 VanDerWaalsContact O-N 3.11Å; E507-Q511 WeakPolarHBondContact O-CG 3.36Å; E507-Q511 PolarHBondContact O-N 3.33Å; E507-N592 PolarHBondContact OE2-ND2 2.96Å; E507-Q596 PolarHBondContact OE2-NE2 3.07Å; E507-R782 IonicContact OE1-CZ 2.76Å; E507-R782 IonicContact OE1-NE 3.5Å; E507-R782 PolarHBondContact OE1-NE 3.09Å; E507-R782 IonicContact OE1-NH2 3.45Å; E507-R782 PolarHBondContact OE1-NH2 3.38Å; E507-R782 IonicContact OE2-NE 3.96Å; E507-R782 IonicContact OE2-NH2 3.82Å; E507-R782 PolarHBondContact OE2-NH2 3.12Å; E507-Y783 VanDerWaalsContact OE1-CE1 3.25Å; E507-Y783 WeakPolarHBondContact OE1-CE1 3.28Å; E507-Y783 PolarHBondContact OE1-OH 3.36Å
508	T	93.9	Very high	90.4	Very high	27 Å²	27	56.8 Å²	56.8	17%	0.166	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-43.1	177.6	-50	0	0	0	0	111.5	P261 V504 Q511 G512	P261-T508 HydrophobicContact CG-CG2 3.95Å; V504-T508 PolarHBondContact O-N 2.97Å; V504-T508 VanDerWaalsContact O-N 3.09Å; V504-T508 PolarHBondContact O-OG1 3.02Å; T508-Q511 PolarHBondContact O-N 3.37Å; T508-G512 PolarHBondContact O-N 3.37Å; T508-G512 VanDerWaalsContact O-N 3.08Å
509	L	96.1	Very high	91.9	Very high	8 Å²	8	52.1 Å²	52.1	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-65.8	-41.4	176.1	-176.7	65.3	0	0	0	112.2	A263 I264 L298 P505 E507 G512 L513 L585 F589	A263-L509 HydrophobicContact CB-CD1 3.76Å; I264-L509 HydrophobicContact CD1-CD1 3.74Å; I264-L509 HydrophobicContact CG1-CD1 4.42Å; L298-L509 HydrophobicContact CD1-CD2 3.88Å; L298-L509 HydrophobicContact CD2-CD2 4.31Å; L298-L509 HydrophobicContact CG-CD2 4.38Å; P505-L509 VanDerWaalsContact O-CB 3.31Å; P505-L509 WeakPolarHBondContact O-CB 3.26Å; P505-L509 PolarHBondContact O-N 3.35Å; E507-L509 VanDerWaalsContact C-N 3.3Å; E507-L509 PolarHBondContact O-N 2.9Å; L509-G512 PolarHBondContact O-N 3.08Å; L509-L513 HydrophobicContact CD1-CD1 4.35Å; L509-L513 HydrophobicContact CD1-CG 4.36Å; L509-L513 HydrophobicContact CG-CD1 4.06Å; L509-L513 HydrophobicContact CG-CG 4.45Å; L509-L513 WeakPolarHBondContact O-CB 3.38Å; L509-L513 VanDerWaalsContact O-CG 3.31Å; L509-L513 WeakPolarHBondContact O-CG 3.29Å; L509-L513 PolarHBondContact O-N 2.94Å; L509-L585 HydrophobicContact CD2-CD2 3.63Å; L509-F589 HydrophobicContact CD2-CZ 4.4Å; L509-F589 HydrophobicContact CG-CZ 4.41Å
510	Y	96.7	Very high	93	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-44.2	177.1	-178.9	-92.8	0	0	0	111.4	A506 E507 G512 L513 L514 F589 Q596 Y599 N779 Y783	A506-Y510 WeakPolarHBondContact O-CB 3.23Å; A506-Y510 PolarHBondContact O-N 3.48Å; E507-Y510 PolarHBondContact O-N 3.43Å; E507-Y510 VanDerWaalsContact O-N 3.11Å; Y510-G512 VanDerWaalsContact C-N 3.35Å; Y510-G512 PolarHBondContact O-N 2.95Å; Y510-L513 PolarHBondContact O-N 3.44Å; Y510-L514 HydrophobicContact CE1-CB 4.4Å; Y510-L514 HydrophobicContact CE1-CD1 4.02Å; Y510-L514 HydrophobicContact CE1-CD2 4.3Å; Y510-L514 HydrophobicContact CE1-CG 4.48Å; Y510-L514 WeakPolarHBondContact O-CB 3.35Å; Y510-L514 PolarHBondContact O-N 3.13Å; Y510-F589 HydrophobicContact CD2-CD1 4.34Å; Y510-F589 HydrophobicContact CD2-CD2 4.16Å; Y510-F589 HydrophobicContact CD2-CE1 4.32Å; Y510-F589 HydrophobicContact CD2-CE2 4.11Å; Y510-F589 HydrophobicContact CD2-CG 4.29Å; Y510-F589 HydrophobicContact CD2-CZ 4.21Å; Y510-Q596 HydrophobicContact CD1-CG 3.72Å; Y510-Q596 HydrophobicContact CD2-CB 3.61Å; Y510-Q596 HydrophobicContact CD2-CG 3.7Å; Y510-Q596 HydrophobicContact CE1-CB 4.42Å; Y510-Q596 HydrophobicContact CE1-CG 3.69Å; Y510-Q596 HydrophobicContact CE2-CB 3.44Å; Y510-Q596 VanDerWaalsContact CE2-CB 3.44Å; Y510-Q596 HydrophobicContact CE2-CG 3.64Å; Y510-Q596 HydrophobicContact CG-CB 4.15Å; Y510-Q596 HydrophobicContact CG-CG 3.72Å; Y510-Y599 HydrophobicContact CE2-CD1 4.35Å; Y510-Y599 WeakPolarHBondContact OH-CD1 3.42Å; Y510-N779 PolarHBondContact OH-ND2 2.99Å; Y510-N779 PolarHBondContact OH-OD1 3.37Å; Y510-Y783 HydrophobicContact CD1-CE1 4.14Å; Y510-Y783 HydrophobicContact CD1-CE2 4Å; Y510-Y783 AromaticContact CD1-CZ 3.59Å; Y510-Y783 WeakPolarHBondContact CD1-OH 3.3Å; Y510-Y783 HydrophobicContact CE1-CD2 4.22Å; Y510-Y783 HydrophobicContact CE1-CE1 4.42Å; Y510-Y783 AromaticContact CE1-CE2 3.46Å; Y510-Y783 HydrophobicContact CE1-CE2 3.46Å; Y510-Y783 VanDerWaalsContact CE1-CE2 3.46Å; Y510-Y783 AromaticContact CE1-CZ 3.56Å
511	Q	93.9	Very high	94.1	Very high	71 Å²	71	40.7 Å²	40.7	33%	0.332	23%	0.226	S	C	.	.	H	α-helix	trans	-57.4	-46.4	176.5	-72.1	174.1	14.3	0	0	111.7	E507 T508 L513 L514 P515 Y783	E507-Q511 WeakPolarHBondContact O-CG 3.36Å; E507-Q511 PolarHBondContact O-N 3.33Å; T508-Q511 PolarHBondContact O-N 3.37Å; Q511-L513 VanDerWaalsContact C-N 3.34Å; Q511-L513 PolarHBondContact O-N 3.43Å; Q511-L514 PolarHBondContact O-N 3.03Å; Q511-P515 WeakPolarHBondContact O-CD 3.44Å; Q511-Y783 HydrophobicContact CG-CD1 3.66Å; Q511-Y783 HydrophobicContact CG-CE1 3.57Å
512	G	93.7	Very high	94.7	Very high	18 Å²	18	42.6 Å²	42.6	19%	0.186	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-33.9	176.9	0	0	0	0	0	113.5	I264 T508 L509 Y510	I264-G512 VanDerWaalsContact CD1-C 3.48Å; T508-G512 PolarHBondContact O-N 3.37Å; T508-G512 VanDerWaalsContact O-N 3.08Å; L509-G512 PolarHBondContact O-N 3.08Å; Y510-G512 VanDerWaalsContact C-N 3.35Å; Y510-G512 PolarHBondContact O-N 2.95Å
513	L	96.1	Very high	95.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-77.9	-30.7	177.8	-71.3	174.6	0	0	0	113.3	I264 F267 L509 Y510 Q511 P515 S516 L517 Y520 L585 F589	I264-L513 HydrophobicContact CD1-CB 4.37Å; I264-L513 HydrophobicContact CD1-CD2 3.53Å; I264-L513 HydrophobicContact CD1-CG 3.56Å; F267-L513 HydrophobicContact CB-CD2 4.34Å; F267-L513 HydrophobicContact CD1-CD2 4.37Å; F267-L513 HydrophobicContact CD2-CD2 3.48Å; F267-L513 VanDerWaalsContact CD2-CD2 3.48Å; F267-L513 HydrophobicContact CE2-CD1 4.3Å; F267-L513 HydrophobicContact CE2-CD2 3.76Å; F267-L513 HydrophobicContact CG-CD2 3.83Å; F267-L513 HydrophobicContact CZ-CD2 4.34Å; L509-L513 HydrophobicContact CD1-CD1 4.35Å; L509-L513 HydrophobicContact CD1-CG 4.36Å; L509-L513 HydrophobicContact CG-CD1 4.06Å; L509-L513 HydrophobicContact CG-CG 4.45Å; L509-L513 WeakPolarHBondContact O-CB 3.38Å; L509-L513 VanDerWaalsContact O-CG 3.31Å; L509-L513 WeakPolarHBondContact O-CG 3.29Å; L509-L513 PolarHBondContact O-N 2.94Å; Y510-L513 PolarHBondContact O-N 3.44Å; Q511-L513 VanDerWaalsContact C-N 3.34Å; Q511-L513 PolarHBondContact O-N 3.43Å; L513-P515 VanDerWaalsContact C-CD 3.41Å; L513-S516 CarbonylContact O-C 3.59Å; L513-S516 PolarHBondContact O-N 3.09Å; L513-S516 VanDerWaalsContact O-N 3.12Å; L513-L517 HydrophobicContact CB-CD1 3.77Å; L513-L517 HydrophobicContact CD1-CD1 4.14Å; L513-L517 HydrophobicContact CG-CD1 4.47Å; L513-L517 WeakPolarHBondContact O-CA 3.29Å; L513-L517 WeakPolarHBondContact O-CB 3.43Å; L513-L517 PolarHBondContact O-N 3.24Å; L513-Y520 HydrophobicContact CB-CD2 4.49Å; L513-Y520 HydrophobicContact CD2-CD2 3.48Å; L513-Y520 VanDerWaalsContact CD2-CD2 3.48Å; L513-Y520 HydrophobicContact CD2-CE2 3.68Å; L513-Y520 HydrophobicContact CD2-CG 4.27Å; L513-L585 HydrophobicContact CD1-CD1 4.5Å; L513-F589 HydrophobicContact CD1-CE2 4.12Å; L513-F589 HydrophobicContact CD1-CZ 3.8Å
514	L	95	Very high	95.7	Very high	29 Å²	29	30.3 Å²	30.3	15%	0.152	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-48.6	-46.5	-168.8	178.5	62.5	0	0	0	114.1	Y510 Q511 S516 Y599 Y783	Y510-L514 HydrophobicContact CE1-CB 4.4Å; Y510-L514 HydrophobicContact CE1-CD1 4.02Å; Y510-L514 HydrophobicContact CE1-CD2 4.3Å; Y510-L514 HydrophobicContact CE1-CG 4.48Å; Y510-L514 WeakPolarHBondContact O-CB 3.35Å; Y510-L514 PolarHBondContact O-N 3.13Å; Q511-L514 PolarHBondContact O-N 3.03Å; L514-S516 VanDerWaalsContact C-N 3.28Å; L514-S516 PolarHBondContact O-N 3.5Å; L514-Y599 HydrophobicContact CD1-CD1 4Å; L514-Y599 HydrophobicContact CD1-CE1 3.52Å; L514-Y783 HydrophobicContact CD2-CD1 4.47Å; L514-Y783 HydrophobicContact CD2-CD2 3.48Å; L514-Y783 VanDerWaalsContact CD2-CD2 3.48Å; L514-Y783 HydrophobicContact CD2-CE2 4.28Å; L514-Y783 HydrophobicContact CD2-CG 3.62Å
515	P	93.9	Very high	95.9	Very high	104 Å²	104	28.9 Å²	28.9	68%	0.675	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-62.8	-31	-176.4	-23.6	35	0	0	0	114.3	Q511 L513	Q511-P515 WeakPolarHBondContact O-CD 3.44Å; L513-P515 VanDerWaalsContact C-CD 3.41Å
516	S	95.8	Very high	96	Very high	44 Å²	44	30.1 Å²	30.1	31%	0.308	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-126.2	17.6	-175.3	-70	0	0	0	0	113.3	L513 L514 P518 Q519 Y520	L513-S516 CarbonylContact O-C 3.59Å; L513-S516 PolarHBondContact O-N 3.09Å; L513-S516 VanDerWaalsContact O-N 3.12Å; L514-S516 VanDerWaalsContact C-N 3.28Å; L514-S516 PolarHBondContact O-N 3.5Å; S516-P518 VanDerWaalsContact C-CD 3.42Å; S516-Q519 VanDerWaalsContact C-OE1 3.3Å; S516-Q519 WeakPolarHBondContact O-CB 3.45Å; S516-Q519 PolarHBondContact O-N 3.41Å; S516-Q519 PolarHBondContact O-OE1 3.43Å; S516-Y520 VanDerWaalsContact C-CD2 3.47Å; S516-Y520 WeakPolarHBondContact O-CD2 3.44Å; S516-Y520 PolarHBondContact O-N 3.42Å
517	L	96.1	Very high	96	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-54.1	-44.7	-177.5	-169.9	76.1	0	0	0	112.7	L513 Q519 Y520 M521 Y599 M600	L513-L517 HydrophobicContact CB-CD1 3.77Å; L513-L517 HydrophobicContact CD1-CD1 4.14Å; L513-L517 HydrophobicContact CG-CD1 4.47Å; L513-L517 WeakPolarHBondContact O-CA 3.29Å; L513-L517 WeakPolarHBondContact O-CB 3.43Å; L513-L517 PolarHBondContact O-N 3.24Å; L517-Q519 VanDerWaalsContact C-N 3.31Å; L517-Q519 PolarHBondContact O-N 2.95Å; L517-Y520 PolarHBondContact O-N 2.88Å; L517-M521 HydrophobicContact CD1-CE 4.15Å; L517-M521 HydrophobicContact CG-CG 4.44Å; L517-M521 WeakPolarHBondContact O-CG 3.01Å; L517-M521 PolarHBondContact O-N 3.25Å; L517-Y599 HydrophobicContact CB-CE1 4.12Å; L517-Y599 HydrophobicContact CD2-CD1 3.25Å; L517-Y599 HydrophobicContact CD2-CE1 3.53Å; L517-Y599 HydrophobicContact CD2-CG 4.28Å; L517-Y599 HydrophobicContact CG-CE1 4.45Å; L517-M600 HydrophobicContact CD2-CB 4.12Å
518	P	96.2	Very high	96	Very high	31 Å²	31	29.8 Å²	29.8	20%	0.201	16%	0.164	C	C	.	.	H	α-helix	trans	-57.5	-44	176.7	-20.5	30.5	0	0	0	112.4	S516 M521 I522	S516-P518 VanDerWaalsContact C-CD 3.42Å; P518-M521 PolarHBondContact O-N 3.01Å; P518-I522 WeakPolarHBondContact O-CB 3.28Å; P518-I522 WeakPolarHBondContact O-CD1 3.32Å; P518-I522 VanDerWaalsContact O-CG1 3.23Å; P518-I522 WeakPolarHBondContact O-CG1 3.15Å; P518-I522 PolarHBondContact O-N 3.39Å
519	Q	97.1	Very high	96.1	Very high	99 Å²	99	31.5 Å²	31.5	46%	0.463	17%	0.172	S	C	.	.	H	α-helix	trans	-66.1	-43.2	-178.9	-66.1	79.6	-9.2	0	0	110.8	T271 S516 L517 I522 A523	T271-Q519 HydrophobicContact CG2-CB 4.22Å; S516-Q519 VanDerWaalsContact C-OE1 3.3Å; S516-Q519 WeakPolarHBondContact O-CB 3.45Å; S516-Q519 PolarHBondContact O-N 3.41Å; S516-Q519 PolarHBondContact O-OE1 3.43Å; L517-Q519 VanDerWaalsContact C-N 3.31Å; L517-Q519 PolarHBondContact O-N 2.95Å; Q519-I522 PolarHBondContact O-N 3.37Å; Q519-A523 VanDerWaalsContact O-CB 3.27Å; Q519-A523 WeakPolarHBondContact O-CB 3.45Å; Q519-A523 PolarHBondContact O-N 3.36Å
520	Y	97.9	Very high	95.9	Very high	18 Å²	18	31.3 Å²	31.3	7%	0.071	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-45.3	175.1	-61.8	-45	0	0	0	111.8	F267 T271 L513 S516 L517 A523 L524	F267-Y520 VanDerWaalsContact C-CE1 3.5Å; F267-Y520 HydrophobicContact CB-CD1 3.63Å; F267-Y520 HydrophobicContact CB-CE1 3.59Å; F267-Y520 HydrophobicContact CB-CE2 4.45Å; F267-Y520 HydrophobicContact CB-CG 4.15Å; F267-Y520 AromaticContact CD1-CD1 3.95Å; F267-Y520 HydrophobicContact CD1-CD1 3.95Å; F267-Y520 AromaticContact CD1-CG 3.91Å; F267-Y520 HydrophobicContact CD1-CG 3.91Å; F267-Y520 HydrophobicContact CG-CD1 4.16Å; F267-Y520 HydrophobicContact CG-CG 4.26Å; F267-Y520 WeakPolarHBondContact O-CE1 3.48Å; T271-Y520 HydrophobicContact CG2-CD1 3.4Å; T271-Y520 HydrophobicContact CG2-CE1 3.73Å; T271-Y520 HydrophobicContact CG2-CG 4.45Å; L513-Y520 HydrophobicContact CB-CD2 4.49Å; L513-Y520 HydrophobicContact CD2-CD2 3.48Å; L513-Y520 VanDerWaalsContact CD2-CD2 3.48Å; L513-Y520 HydrophobicContact CD2-CE2 3.68Å; L513-Y520 HydrophobicContact CD2-CG 4.27Å; S516-Y520 VanDerWaalsContact C-CD2 3.47Å; S516-Y520 WeakPolarHBondContact O-CD2 3.44Å; S516-Y520 PolarHBondContact O-N 3.42Å; L517-Y520 PolarHBondContact O-N 2.88Å; Y520-A523 PolarHBondContact O-N 3.08Å; Y520-L524 WeakPolarHBondContact O-CG 3.15Å; Y520-L524 PolarHBondContact O-N 2.71Å
521	M	97.9	Very high	95.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-44.2	178.2	-66.5	-52.8	98.9	0	0	111.7	L517 P518 L524 L525 L582 M600 H603 L604	L517-M521 HydrophobicContact CD1-CE 4.15Å; L517-M521 HydrophobicContact CG-CG 4.44Å; L517-M521 WeakPolarHBondContact O-CG 3.01Å; L517-M521 PolarHBondContact O-N 3.25Å; P518-M521 PolarHBondContact O-N 3.01Å; M521-L524 HydrophobicContact CE-CD1 4.2Å; M521-L525 VanDerWaalsContact O-CG 3.24Å; M521-L525 WeakPolarHBondContact O-CG 3.46Å; M521-L525 PolarHBondContact O-N 2.86Å; M521-L525 VanDerWaalsContact O-N 3.11Å; M521-L582 HydrophobicContact CE-CD2 4.49Å; M521-L582 HydrophobicContact SD-CD2 3.9Å; M521-M600 HydrophobicContact CE-CE 3.99Å; M521-M600 HydrophobicContact CG-CG 4.42Å; M521-M600 HydrophobicContact SD-CE 3.42Å; M521-M600 WeakPolarHBondContact SD-CE 3.15Å; M521-M600 HydrophobicContact SD-CG 3.76Å; M521-M600 HydrophobicContact SD-SD 4.44Å; M521-H603 HydrophobicContact CB-CB 4.5Å; M521-H603 HydrophobicContact CG-CB 4.34Å; M521-L604 HydrophobicContact CB-CD2 4.07Å; M521-L604 HydrophobicContact CG-CD2 4.2Å; M521-L604 HydrophobicContact CG-CG 4.32Å; M521-L604 HydrophobicContact SD-CD2 3.76Å; M521-L604 HydrophobicContact SD-CG 4.02Å
522	I	96.9	Very high	95.5	Very high	71 Å²	71	28 Å²	28	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-62.3	-44.1	176.7	-69.4	164	0	0	0	110.9	P518 Q519 L525 K526 A607	P518-I522 WeakPolarHBondContact O-CB 3.28Å; P518-I522 WeakPolarHBondContact O-CD1 3.32Å; P518-I522 VanDerWaalsContact O-CG1 3.23Å; P518-I522 WeakPolarHBondContact O-CG1 3.15Å; P518-I522 PolarHBondContact O-N 3.39Å; Q519-I522 PolarHBondContact O-N 3.37Å; I522-L525 PolarHBondContact O-N 3.05Å; I522-K526 HydrophobicContact CG2-CD 4.1Å; I522-K526 HydrophobicContact CG2-CG 4.3Å; I522-K526 WeakPolarHBondContact O-CG 3.5Å; I522-K526 PolarHBondContact O-N 3.49Å; I522-A607 HydrophobicContact CG1-CB 3.68Å
523	A	97.2	Very high	94.9	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-46.4	-178.6	0	0	0	0	0	111.9	V270 T271 C274 Q519 Y520 L525 K526 I527	V270-A523 HydrophobicContact CG1-CB 3.78Å; T271-A523 HydrophobicContact CG2-CB 4Å; C274-A523 HydrophobicContact CB-CB 3.86Å; C274-A523 PolarHBondContact SG-O 3.39Å; Q519-A523 VanDerWaalsContact O-CB 3.27Å; Q519-A523 WeakPolarHBondContact O-CB 3.45Å; Q519-A523 PolarHBondContact O-N 3.36Å; Y520-A523 PolarHBondContact O-N 3.08Å; A523-L525 VanDerWaalsContact C-N 3.32Å; A523-L525 PolarHBondContact O-N 2.87Å; A523-K526 PolarHBondContact O-N 2.74Å; A523-I527 WeakPolarHBondContact O-CG1 3.23Å; A523-I527 PolarHBondContact O-N 3.15Å; A523-I527 VanDerWaalsContact O-N 3.08Å
524	L	98.2	Very high	94.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-43.4	173.9	-72.7	-179.2	0	0	0	112	F267 V270 L287 Y520 M521 I527 L528 I578 V581 L582	F267-L524 HydrophobicContact CE1-CD1 3.89Å; F267-L524 HydrophobicContact CE1-CG 4.4Å; V270-L524 HydrophobicContact CG1-CD2 4.18Å; L287-L524 HydrophobicContact CD2-CD2 3.72Å; Y520-L524 WeakPolarHBondContact O-CG 3.15Å; Y520-L524 PolarHBondContact O-N 2.71Å; M521-L524 HydrophobicContact CE-CD1 4.2Å; L524-I527 PolarHBondContact O-N 2.71Å; L524-L528 WeakPolarHBondContact O-CB 3.49Å; L524-L528 PolarHBondContact O-N 3.19Å; L524-I578 HydrophobicContact CB-CG2 4.21Å; L524-I578 HydrophobicContact CD2-CG1 4.28Å; L524-V581 HydrophobicContact CD1-CG1 4.25Å; L524-L582 HydrophobicContact CD1-CD2 3.65Å; L524-L582 HydrophobicContact CD1-CG 4.23Å
525	L	97	Very high	93.2	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-70.5	-33.2	179.7	-65	173.6	0	0	0	112.9	M521 I522 A523 L528 L529 L582 L604 A607 C609 L612	M521-L525 VanDerWaalsContact O-CG 3.24Å; M521-L525 WeakPolarHBondContact O-CG 3.46Å; M521-L525 PolarHBondContact O-N 2.86Å; M521-L525 VanDerWaalsContact O-N 3.11Å; I522-L525 PolarHBondContact O-N 3.05Å; A523-L525 VanDerWaalsContact C-N 3.32Å; A523-L525 PolarHBondContact O-N 2.87Å; L525-L528 HydrophobicContact CD2-CD2 4.25Å; L525-L528 PolarHBondContact O-N 2.95Å; L525-L529 WeakPolarHBondContact O-CB 3.32Å; L525-L529 PolarHBondContact O-N 3.48Å; L525-L582 HydrophobicContact CD2-CD1 4.28Å; L525-L604 HydrophobicContact CD1-CD2 3.91Å; L525-L604 HydrophobicContact CD2-CD2 4.24Å; L525-L604 HydrophobicContact CG-CD2 4.2Å; L525-A607 HydrophobicContact CD1-CB 3.56Å; L525-C609 HydrophobicContact CD1-CB 3.83Å; L525-C609 HydrophobicContact CD2-CB 3.98Å; L525-L612 HydrophobicContact CB-CD2 4.08Å; L525-L612 HydrophobicContact CD2-CD2 3.95Å; L525-L612 WeakPolarHBondContact O-CD2 3.46Å
526	K	95.3	Very high	91.9	Very high	91 Å²	91	34 Å²	34	40%	0.396	18%	0.177	S	C	.	.	H	α-helix	trans	-62.3	-45.4	172.8	-78.7	179.5	174.8	-176.3	0	111.4	I522 A523 L529 A530 I542	I522-K526 HydrophobicContact CG2-CD 4.1Å; I522-K526 HydrophobicContact CG2-CG 4.3Å; I522-K526 WeakPolarHBondContact O-CG 3.5Å; I522-K526 PolarHBondContact O-N 3.49Å; A523-K526 PolarHBondContact O-N 2.74Å; K526-L529 PolarHBondContact O-N 2.95Å; K526-A530 PolarHBondContact O-N 3.21Å; K526-A530 VanDerWaalsContact O-N 3.07Å; K526-I542 HydrophobicContact CB-CD1 4.2Å
527	I	95.9	Very high	90	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-42.6	176.4	-61.3	162.8	0	0	0	110.7	V270 F273 C274 M283 L287 A523 L524 L529 A530 A531 I542 I544 I574 I578	V270-I527 HydrophobicContact CG1-CD1 3.75Å; F273-I527 HydrophobicContact CD1-CD1 4.39Å; F273-I527 HydrophobicContact CD1-CG1 4.49Å; F273-I527 HydrophobicContact CE1-CG1 4.41Å; C274-I527 VanDerWaalsContact SG-CG1 3.56Å; M283-I527 HydrophobicContact CG-CD1 3.72Å; M283-I527 HydrophobicContact CG-CG1 4.49Å; M283-I527 HydrophobicContact CG-CG2 4.4Å; M283-I527 HydrophobicContact SD-CD1 3.9Å; L287-I527 HydrophobicContact CD1-CG2 4.01Å; A523-I527 WeakPolarHBondContact O-CG1 3.23Å; A523-I527 PolarHBondContact O-N 3.15Å; A523-I527 VanDerWaalsContact O-N 3.08Å; L524-I527 PolarHBondContact O-N 2.71Å; I527-L529 VanDerWaalsContact C-N 3.26Å; I527-L529 PolarHBondContact O-N 3.35Å; I527-A530 PolarHBondContact O-N 3.01Å; I527-A530 VanDerWaalsContact O-N 3.16Å; I527-A531 WeakPolarHBondContact O-CB 3.27Å; I527-A531 PolarHBondContact O-N 3.49Å; I527-I542 HydrophobicContact CB-CD1 4.4Å; I527-I542 HydrophobicContact CG1-CD1 3.77Å; I527-I544 HydrophobicContact CG2-CG2 4.11Å; I527-I574 HydrophobicContact CG2-CG2 3.57Å; I527-I578 HydrophobicContact CB-CD1 3.86Å; I527-I578 HydrophobicContact CG2-CD1 3.68Å
528	L	95.9	Very high	87.6	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-58.6	-38.9	175.6	-177.3	63.6	0	0	0	112	L524 L525 A531 A532 V575 I578 L612 L671	L524-L528 WeakPolarHBondContact O-CB 3.49Å; L524-L528 PolarHBondContact O-N 3.19Å; L525-L528 HydrophobicContact CD2-CD2 4.25Å; L525-L528 PolarHBondContact O-N 2.95Å; L528-A531 PolarHBondContact O-N 2.91Å; L528-A532 PolarHBondContact O-N 3.23Å; L528-V575 HydrophobicContact CD1-CB 4.27Å; L528-V575 HydrophobicContact CD1-CG1 3.94Å; L528-V575 HydrophobicContact CD1-CG2 4.06Å; L528-I578 HydrophobicContact CB-CD1 4.11Å; L528-I578 HydrophobicContact CB-CG2 4.21Å; L528-I578 HydrophobicContact CD1-CG2 4.47Å; L528-I578 HydrophobicContact CD2-CG2 4.43Å; L528-L612 HydrophobicContact CB-CD2 4.26Å; L528-L612 HydrophobicContact CD2-CD2 3.9Å; L528-L612 HydrophobicContact CG-CD2 4.16Å; L528-L671 HydrophobicContact CD2-CD2 4.09Å
529	L	94.3	Very high	85.5	Confident	64 Å²	64	49 Å²	49	34%	0.335	26%	0.258	S	S	.	.	H	α-helix	trans	-66.3	-43.2	175.5	175.3	61.8	0	0	0	112.1	L525 K526 I527 A531 A532 L612 K615	L525-L529 WeakPolarHBondContact O-CB 3.32Å; L525-L529 PolarHBondContact O-N 3.48Å; K526-L529 PolarHBondContact O-N 2.95Å; I527-L529 VanDerWaalsContact C-N 3.26Å; I527-L529 PolarHBondContact O-N 3.35Å; L529-A531 VanDerWaalsContact C-N 3.31Å; L529-A531 PolarHBondContact O-N 3.28Å; L529-A532 WeakPolarHBondContact O-CB 3.47Å; L529-A532 PolarHBondContact O-N 3.41Å; L529-L612 HydrophobicContact CB-CD1 3.74Å; L529-L612 HydrophobicContact CB-CD2 4.41Å; L529-L612 HydrophobicContact CD1-CD1 3.56Å; L529-L612 HydrophobicContact CG-CD1 4.18Å; L529-K615 HydrophobicContact CD1-CD 4.41Å
530	A	92.8	Very high	83.7	Confident	4 Å²	4	47 Å²	47	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-33.6	176.9	0	0	0	0	0	112.4	K526 I527 I542 I544	K526-A530 PolarHBondContact O-N 3.21Å; K526-A530 VanDerWaalsContact O-N 3.07Å; I527-A530 PolarHBondContact O-N 3.01Å; I527-A530 VanDerWaalsContact O-N 3.16Å; A530-I542 HydrophobicContact CB-CD1 4.25Å; A530-I542 HydrophobicContact CB-CG1 3.94Å; A530-I544 HydrophobicContact CB-CD1 4.12Å; A530-I544 HydrophobicContact CB-CG1 4.36Å; A530-I544 HydrophobicContact CB-CG2 3.82Å
531	A	93.6	Very high	82.3	Confident	1 Å²	1	51 Å²	51	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-82.7	-11	176.6	0	0	0	0	0	113.5	I527 L528 L529 I544 K571 I574 V575	I527-A531 WeakPolarHBondContact O-CB 3.27Å; I527-A531 PolarHBondContact O-N 3.49Å; L528-A531 PolarHBondContact O-N 2.91Å; L529-A531 VanDerWaalsContact C-N 3.31Å; L529-A531 PolarHBondContact O-N 3.28Å; A531-I544 HydrophobicContact CB-CD1 3.76Å; A531-K571 HydrophobicContact CB-CB 4.33Å; A531-I574 HydrophobicContact CB-CB 4.11Å; A531-I574 HydrophobicContact CB-CG2 3.63Å; A531-V575 HydrophobicContact CB-CG2 3.79Å
532	A	89.1	Confident	81.8	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.008	29%	0.286	C	S	.	.	S	Bend	trans	-62.9	135.5	-179.1	0	0	0	0	0	110.6	L528 L529 T534 S535 F616	L528-A532 PolarHBondContact O-N 3.23Å; L529-A532 WeakPolarHBondContact O-CB 3.47Å; L529-A532 PolarHBondContact O-N 3.41Å; A532-T534 PolarHBondContact O-N 3.17Å; A532-S535 WeakPolarHBondContact O-CB 3.38Å; A532-S535 PolarHBondContact O-N 3.04Å; A532-F616 HydrophobicContact CB-CD2 4.22Å
533	P	81.7	Confident	81.3	Confident	57 Å²	57	51.9 Å²	51.9	37%	0.37	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.8	-177.2	-18.8	28.9	0	0	0	113.6	F616 Y624	P533-F616 HydrophobicContact CG-CE2 4.35Å; P533-Y624 HydrophobicContact CB-CD2 4.4Å; P533-Y624 HydrophobicContact CB-CE2 4.5Å; P533-Y624 HydrophobicContact CG-CD2 3.64Å; P533-Y624 HydrophobicContact CG-CE2 3.4Å
534	T	77.4	Confident	81	Confident	42 Å²	42	52 Å²	52	26%	0.258	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-0.2	177	58.1	0	0	0	0	113.7	A532 Q619	A532-T534 PolarHBondContact O-N 3.17Å; T534-Q619 HydrophobicContact CG2-CB 3.82Å; T534-Q619 HydrophobicContact CG2-CG 4.36Å
535	S	76.9	Confident	80.6	Confident	19 Å²	19	53.6 Å²	53.6	13%	0.133	30%	0.295	C	S	.	.			trans	-69.4	138.1	175.4	-161.9	0	0	0	0	110.8	A532 T539 D540	A532-S535 WeakPolarHBondContact O-CB 3.38Å; A532-S535 PolarHBondContact O-N 3.04Å; S535-T539 PolarHBondContact OG-OG1 2.9Å; S535-D540 PolarHBondContact OG-OD1 3.3Å
536	K	65.8	Low	80.1	Confident	158 Å²	158	53.4 Å²	53.4	69%	0.687	29%	0.294	S	S	*	.			trans	-96.8	144.6	172.4	-66.4	-174.9	179.4	-177.8	0	108.4	K538 T539	K536-K538 PolarHBondContact O-N 2.53Å; K536-T539 PolarHBondContact N-OG1 2.73Å; K536-T539 PolarHBondContact O-N 3.5Å; K536-T539 PolarHBondContact O-OG1 2.86Å
537	A	56.6	Low	79.5	Confident	95 Å²	95	49.1 Å²	49.1	79%	0.785	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-55.9	-24.5	-179.6	0	0	0	0	0	114.9	T539	A537-T539 VanDerWaalsContact C-N 3.34Å
538	K	46.8	Very low	79.3	Confident	212 Å²	212	49.1 Å²	49.1	92%	0.922	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-79.9	-9	175.5	-71.4	-172	177.7	-175.4	0	114.5	K536	K536-K538 PolarHBondContact O-N 2.53Å
539	T	50	Low	79	Confident	83 Å²	83	50.4 Å²	50.4	51%	0.509	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-105.3	-1.8	-177.6	54.4	0	0	0	0	113.6	S535 K536 A537 S541	S535-T539 PolarHBondContact OG-OG1 2.9Å; K536-T539 PolarHBondContact N-OG1 2.73Å; K536-T539 PolarHBondContact O-N 3.5Å; K536-T539 PolarHBondContact O-OG1 2.86Å; A537-T539 VanDerWaalsContact C-N 3.34Å; T539-S541 PolarHBondContact O-N 3.29Å
540	D	60.2	Low	78.8	Confident	58 Å²	58	48.5 Å²	48.5	31%	0.31	27%	0.274	S	S	.	.			trans	-81.8	104.9	-177.1	-65.3	-25.8	0	0	0	109.5	S535 I542	S535-D540 PolarHBondContact OG-OD1 3.3Å; D540-I542 PolarHBondContact O-N 3.42Å
541	S	69	Low	78.4	Confident	100 Å²	100	55.6 Å²	55.6	70%	0.699	31%	0.306	S	S	*	.	S	Bend	trans	-73.2	-10.1	174.7	55.2	0	0	0	0	113.3	T539	T539-S541 PolarHBondContact O-N 3.29Å
542	I	86.2	Confident	78	Confident	20 Å²	20	63.9 Å²	63.9	10%	0.103	35%	0.345	C	S	.	.	S	Bend	trans	-141.8	141.8	-177.2	59.1	-178.4	0	0	0	109.9	F273 K526 I527 A530 D540 I544	F273-I542 HydrophobicContact CE1-CB 4.25Å; F273-I542 HydrophobicContact CE1-CD1 4.15Å; K526-I542 HydrophobicContact CB-CD1 4.2Å; I527-I542 HydrophobicContact CB-CD1 4.4Å; I527-I542 HydrophobicContact CG1-CD1 3.77Å; A530-I542 HydrophobicContact CB-CD1 4.25Å; A530-I542 HydrophobicContact CB-CG1 3.94Å; D540-I542 PolarHBondContact O-N 3.42Å; I542-I544 HydrophobicContact CD1-CG2 4.22Å; I542-I544 HydrophobicContact CG1-CG2 4.17Å; I542-I544 PolarHBondContact O-N 2.6Å
543	N	87.3	Confident	77.9	Confident	70 Å²	70	69 Å²	69	37%	0.374	37%	0.37	S	S	.	.			trans	-93.7	96.6	177.9	-179.8	11.5	0	0	0	111.1	F273 L545	F273-N543 WeakPolarHBondContact CZ-O 3.42Å; N543-L545 PolarHBondContact O-N 2.95Å; N543-L545 PolarHBondContact OD1-N 3.46Å
544	I	90.7	Very high	78.1	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.036	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.6	178.6	63	167	0	0	0	114	F273 I527 A530 A531 I542 H570 K571 I574	F273-I544 HydrophobicContact CE1-CG2 4.31Å; F273-I544 HydrophobicContact CZ-CG2 4.4Å; I527-I544 HydrophobicContact CG2-CG2 4.11Å; A530-I544 HydrophobicContact CB-CD1 4.12Å; A530-I544 HydrophobicContact CB-CG1 4.36Å; A530-I544 HydrophobicContact CB-CG2 3.82Å; A531-I544 HydrophobicContact CB-CD1 3.76Å; I542-I544 HydrophobicContact CD1-CG2 4.22Å; I542-I544 HydrophobicContact CG1-CG2 4.17Å; I542-I544 PolarHBondContact O-N 2.6Å; I544-H570 PolarHBondContact O-NE2 3.2Å; I544-H570 VanDerWaalsContact O-NE2 3.08Å; I544-K571 HydrophobicContact CD1-CG 4.09Å; I544-I574 HydrophobicContact CB-CD1 4.28Å; I544-I574 HydrophobicContact CD1-CD1 4.22Å
545	L	89.5	Confident	78.6	Confident	33 Å²	33	72.2 Å²	72.2	17%	0.173	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	1.7	-171.6	-57	-178.9	0	0	0	113.8	N543 D547 V548 L549 V567	N543-L545 PolarHBondContact O-N 2.95Å; N543-L545 PolarHBondContact OD1-N 3.46Å; L545-D547 PolarHBondContact O-N 3.2Å; L545-V548 PolarHBondContact O-N 3.05Å; L545-L549 HydrophobicContact CB-CD1 4.25Å; L545-L549 HydrophobicContact CB-CG 4.2Å; L545-L549 WeakPolarHBondContact O-CG 3.44Å; L545-L549 PolarHBondContact O-N 3.15Å; L545-L549 VanDerWaalsContact O-N 3.16Å; L545-V567 HydrophobicContact CD1-CG1 3.86Å; L545-V567 HydrophobicContact CD2-CG1 3.88Å
546	A	86.3	Confident	79.2	Confident	2 Å²	2	74.3 Å²	74.3	2%	0.017	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-30.3	179.7	0	0	0	0	0	113.5	I208 S209 L210 V548	I208-A546 HydrophobicContact CB-CB 4.2Å; I208-A546 HydrophobicContact CG2-CB 3.78Å; S209-A546 CarbonylContact C-O 3.56Å; L210-A546 PolarHBondContact N-O 2.98Å; L210-A546 VanDerWaalsContact N-O 3.08Å; A546-V548 VanDerWaalsContact C-N 3.34Å; A546-V548 PolarHBondContact O-N 2.9Å
547	D	84.4	Confident	80.3	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.011	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	4.5	-179.1	-174.2	43	0	0	0	114.3	R217 P282 K285 L545 H570	R217-D547 WeakPolarHBondContact CD-OD1 3.38Å; P282-D547 HydrophobicContact CB-CB 3.96Å; P282-D547 WeakPolarHBondContact CB-OD1 3.33Å; K285-D547 VanDerWaalsContact NZ-CG 3.26Å; K285-D547 IonicContact NZ-OD1 3.35Å; K285-D547 PolarHBondContact NZ-OD1 3.34Å; K285-D547 IonicContact NZ-OD2 3.92Å; K285-D547 PolarHBondContact NZ-OD2 3.1Å; L545-D547 PolarHBondContact O-N 3.2Å; D547-H570 IonicContact OD2-CE1 2.9Å
548	V	90	Very high	81.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-29.6	179.7	-179.4	0	0	0	0	112.1	T89 L545 A546 L563 D566 V567 H570	T89-V548 PolarHBondContact OG1-O 3.32Å; L545-V548 PolarHBondContact O-N 3.05Å; A546-V548 VanDerWaalsContact C-N 3.34Å; A546-V548 PolarHBondContact O-N 2.9Å; V548-L563 HydrophobicContact CG1-CD1 3.91Å; V548-D566 HydrophobicContact CG1-CB 4.15Å; V548-V567 HydrophobicContact CG1-CG2 4Å; V548-H570 HydrophobicContact CG2-CB 3.74Å; V548-H570 VanDerWaalsContact CG2-CG 3.4Å; V548-H570 WeakPolarHBondContact CG2-ND1 3.21Å
549	L	90.3	Very high	83.8	Confident	31 Å²	31	65.1 Å²	65.1	16%	0.162	36%	0.357	C	S	.	.			trans	-68.8	124.8	-176.2	-65.9	177	0	0	0	110.8	S209 L210 L545 M553	S209-L549 WeakPolarHBondContact CA-O 3.44Å; S209-L549 WeakPolarHBondContact CB-O 3.43Å; L210-L549 WeakPolarHBondContact CD2-O 3.33Å; L210-L549 PolarHBondContact N-O 3.39Å; L545-L549 HydrophobicContact CB-CD1 4.25Å; L545-L549 HydrophobicContact CB-CG 4.2Å; L545-L549 WeakPolarHBondContact O-CG 3.44Å; L545-L549 PolarHBondContact O-N 3.15Å; L545-L549 VanDerWaalsContact O-N 3.16Å; L549-M553 HydrophobicContact CB-CE 4.49Å; L549-M553 HydrophobicContact CD2-CE 4.35Å
550	P	89.3	Confident	85.7	Confident	24 Å²	24	63.7 Å²	63.7	16%	0.156	35%	0.351	C	S	.	.			trans	-67.2	162	174.6	29.6	-35	0	0	0	111.4	T89 E552 L563	T89-P550 HydrophobicContact CG2-CB 3.75Å; T89-P550 HydrophobicContact CG2-CG 4.47Å; P550-E552 WeakPolarHBondContact CB-O 3.42Å; P550-E552 WeakPolarHBondContact CG-O 3.27Å; P550-L563 HydrophobicContact CG-CD2 4.47Å
551	E	84.8	Confident	87.2	Confident	153 Å²	153	63.7 Å²	63.7	72%	0.715	35%	0.349	S	S	*	.	S	Bend	trans	-66.5	-42.4	173.9	-168.1	169.8	-160	0	0	111
552	E	85.8	Confident	88.2	Confident	174 Å²	174	61.7 Å²	61.7	81%	0.813	33%	0.328	S	S	*	.	S	Bend	trans	-104.4	127.3	171.3	-65.4	-173.5	171.8	0	0	110.8	P550	P550-E552 WeakPolarHBondContact CB-O 3.42Å; P550-E552 WeakPolarHBondContact CG-O 3.27Å
553	M	86.2	Confident	88.5	Confident	109 Å²	109	62 Å²	62	54%	0.537	33%	0.33	S	S	.	.			trans	-68.1	142.7	179.4	-72.8	-67.5	161.7	0	0	111.3	L549 T555	L549-M553 HydrophobicContact CB-CE 4.49Å; L549-M553 HydrophobicContact CD2-CE 4.35Å; M553-T555 PolarHBondContact O-N 3.21Å
554	P	86.1	Confident	88.7	Confident	32 Å²	32	60.2 Å²	60.2	21%	0.208	33%	0.328	C	S	.	.			trans	-61.6	130.8	-177.1	24.4	-33.4	0	0	0	111.5	Q559 L563	P554-Q559 HydrophobicContact CB-CB 3.47Å; P554-Q559 VanDerWaalsContact CB-CB 3.47Å; P554-L563 HydrophobicContact CG-CD2 3.86Å
555	T	88	Confident	88.8	Confident	134 Å²	134	61.1 Å²	61.1	82%	0.822	33%	0.334	S	S	*	.			trans	-92.3	-21.4	-179.9	54.7	0	0	0	0	112.6	M553	M553-T555 PolarHBondContact O-N 3.21Å
556	T	90.7	Very high	89	Confident	63 Å²	63	59.6 Å²	59.6	39%	0.387	33%	0.326	S	S	.	.	S	Bend	trans	-100.6	152.1	-179.8	66.6	0	0	0	0	111.9	L558 Q559 S560	T556-L558 VanDerWaalsContact C-N 3.28Å; T556-L558 PolarHBondContact O-N 3.08Å; T556-Q559 PolarHBondContact O-N 3.34Å; T556-Q559 WeakPolarHBondContact OG1-CB 3.3Å; T556-Q559 VanDerWaalsContact OG1-CD 3.23Å; T556-Q559 WeakPolarHBondContact OG1-CG 3.45Å; T556-Q559 PolarHBondContact OG1-N 2.88Å; T556-Q559 PolarHBondContact OG1-OE1 3.39Å; T556-Q559 VanDerWaalsContact OG1-OE1 3.09Å; T556-S560 WeakPolarHBondContact O-CB 3.31Å; T556-S560 PolarHBondContact O-N 3.5Å; T556-S560 PolarHBondContact O-OG 3.13Å
557	V	88.5	Confident	89.3	Confident	115 Å²	115	60.6 Å²	60.6	70%	0.697	33%	0.332	S	S	*	.	H	α-helix	trans	-59.1	-43	175.3	178.9	0	0	0	0	110.5	Q559 S560 M561	V557-Q559 PolarHBondContact O-N 3.17Å; V557-S560 WeakPolarHBondContact O-CB 3.48Å; V557-S560 PolarHBondContact O-N 2.7Å; V557-M561 HydrophobicContact CG1-CG 4.33Å; V557-M561 HydrophobicContact CG1-SD 4.03Å; V557-M561 WeakPolarHBondContact O-CG 3.38Å; V557-M561 PolarHBondContact O-N 2.9Å
558	L	87.8	Confident	89.8	Confident	60 Å²	60	64 Å²	64	31%	0.314	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-47.5	-179.6	-173.4	72.6	0	0	0	112.3	T556 S560 M561 K562 L647 A649 L652	T556-L558 VanDerWaalsContact C-N 3.28Å; T556-L558 PolarHBondContact O-N 3.08Å; L558-S560 VanDerWaalsContact C-N 3.3Å; L558-S560 PolarHBondContact O-N 3.23Å; L558-M561 PolarHBondContact O-N 3.12Å; L558-K562 PolarHBondContact O-N 3.18Å; L558-L647 HydrophobicContact CD2-CB 4.44Å; L558-L647 VanDerWaalsContact CD2-O 3.31Å; L558-L647 WeakPolarHBondContact CD2-O 3.33Å; L558-A649 HydrophobicContact CD1-CB 4.45Å; L558-L652 HydrophobicContact CD1-CD1 3.3Å; L558-L652 HydrophobicContact CG-CD1 4.18Å
559	Q	88.4	Confident	90	Very high	97 Å²	97	64.1 Å²	64.1	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-35.2	176.9	-69.8	167.7	-20.9	0	0	111.7	P554 T556 V557 K562 L563	P554-Q559 HydrophobicContact CB-CB 3.47Å; P554-Q559 VanDerWaalsContact CB-CB 3.47Å; T556-Q559 PolarHBondContact O-N 3.34Å; T556-Q559 WeakPolarHBondContact OG1-CB 3.3Å; T556-Q559 VanDerWaalsContact OG1-CD 3.23Å; T556-Q559 WeakPolarHBondContact OG1-CG 3.45Å; T556-Q559 PolarHBondContact OG1-N 2.88Å; T556-Q559 PolarHBondContact OG1-OE1 3.39Å; T556-Q559 VanDerWaalsContact OG1-OE1 3.09Å; V557-Q559 PolarHBondContact O-N 3.17Å; Q559-K562 PolarHBondContact O-N 3.46Å; Q559-L563 WeakPolarHBondContact O-CB 3.46Å; Q559-L563 PolarHBondContact O-N 3.01Å
560	S	90.9	Very high	90.2	Very high	54 Å²	54	62.7 Å²	62.7	38%	0.378	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-40.6	174.9	-59.4	0	0	0	0	112	T556 V557 L558 L563 G564	T556-S560 WeakPolarHBondContact O-CB 3.31Å; T556-S560 PolarHBondContact O-N 3.5Å; T556-S560 PolarHBondContact O-OG 3.13Å; V557-S560 WeakPolarHBondContact O-CB 3.48Å; V557-S560 PolarHBondContact O-N 2.7Å; L558-S560 VanDerWaalsContact C-N 3.3Å; L558-S560 PolarHBondContact O-N 3.23Å; S560-L563 PolarHBondContact O-N 3.4Å; S560-G564 PolarHBondContact O-N 3.12Å
561	M	90.8	Very high	90.5	Very high	58 Å²	58	63.5 Å²	63.5	29%	0.286	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-47	173.8	-70.8	174.5	75.3	0	0	111.3	V557 L558 L563 G564 V565 E653	V557-M561 HydrophobicContact CG1-CG 4.33Å; V557-M561 HydrophobicContact CG1-SD 4.03Å; V557-M561 WeakPolarHBondContact O-CG 3.38Å; V557-M561 PolarHBondContact O-N 2.9Å; L558-M561 PolarHBondContact O-N 3.12Å; M561-L563 VanDerWaalsContact C-N 3.32Å; M561-L563 PolarHBondContact O-N 2.93Å; M561-G564 PolarHBondContact O-N 2.91Å; M561-G564 VanDerWaalsContact O-N 3.16Å; M561-V565 WeakPolarHBondContact O-CG2 3.43Å; M561-V565 PolarHBondContact O-N 3.12Å; M561-E653 HydrophobicContact CE-CG 4.18Å
562	K	91.2	Very high	91	Very high	58 Å²	58	56.6 Å²	56.6	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-54.7	-47.6	174.7	178.5	-174.4	168.9	-176.1	0	111.3	Y88 L558 Q559 V565 D566 I631 L634 L652	Y88-K562 VanDerWaalsContact CB-CE 3.5Å; Y88-K562 PolarHBondContact O-NZ 3.43Å; Y88-K562 VanDerWaalsContact O-NZ 3.08Å; L558-K562 PolarHBondContact O-N 3.18Å; Q559-K562 PolarHBondContact O-N 3.46Å; K562-V565 PolarHBondContact O-N 3.26Å; K562-D566 PolarHBondContact O-N 2.66Å; K562-D566 VanDerWaalsContact O-N 3.09Å; K562-I631 HydrophobicContact CG-CD1 4.18Å; K562-L634 HydrophobicContact CD-CD1 4.2Å; K562-L652 HydrophobicContact CB-CD2 4.45Å
563	L	92.1	Very high	91.6	Very high	25 Å²	25	48.3 Å²	48.3	13%	0.131	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-40.9	178	-178.2	61.7	0	0	0	111.9	V548 P550 P554 Q559 S560 M561 V565 D566 V567	V548-L563 HydrophobicContact CG1-CD1 3.91Å; P550-L563 HydrophobicContact CG-CD2 4.47Å; P554-L563 HydrophobicContact CG-CD2 3.86Å; Q559-L563 WeakPolarHBondContact O-CB 3.46Å; Q559-L563 PolarHBondContact O-N 3.01Å; S560-L563 PolarHBondContact O-N 3.4Å; M561-L563 VanDerWaalsContact C-N 3.32Å; M561-L563 PolarHBondContact O-N 2.93Å; L563-V565 PolarHBondContact O-N 3.49Å; L563-D566 PolarHBondContact O-N 3.35Å; L563-V567 HydrophobicContact CD1-CG2 4.28Å; L563-V567 HydrophobicContact CG-CG2 4.39Å; L563-V567 WeakPolarHBondContact O-CB 3.48Å; L563-V567 VanDerWaalsContact O-CG2 3.32Å; L563-V567 WeakPolarHBondContact O-CG2 3.15Å; L563-V567 PolarHBondContact O-N 2.99Å
564	G	91.9	Very high	92.1	Very high	34 Å²	34	43.1 Å²	43.1	35%	0.351	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-41.7	176.8	0	0	0	0	0	113.2	S560 M561 N568	S560-G564 PolarHBondContact O-N 3.12Å; M561-G564 PolarHBondContact O-N 2.91Å; M561-G564 VanDerWaalsContact O-N 3.16Å; G564-N568 PolarHBondContact O-N 2.93Å; G564-N568 PolarHBondContact O-ND2 3.31Å
565	V	92.1	Very high	92.7	Very high	25 Å²	25	41.6 Å²	41.6	15%	0.152	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-47.8	173.7	169.4	0	0	0	0	110.8	M561 K562 L563 N568 R569 I631	M561-V565 WeakPolarHBondContact O-CG2 3.43Å; M561-V565 PolarHBondContact O-N 3.12Å; K562-V565 PolarHBondContact O-N 3.26Å; L563-V565 PolarHBondContact O-N 3.49Å; V565-N568 PolarHBondContact O-N 2.84Å; V565-R569 WeakPolarHBondContact O-CB 3.23Å; V565-R569 PolarHBondContact O-N 3.34Å; V565-I631 HydrophobicContact CB-CD1 4.46Å; V565-I631 HydrophobicContact CG1-CD1 4.05Å; V565-I631 HydrophobicContact CG1-CG1 3.96Å
566	D	92.9	Very high	93.1	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.011	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-38	-178.5	-159.3	15.5	0	0	0	112.7	S87 Y88 V548 K562 L563 N568 R569 H570	S87-D566 WeakPolarHBondContact CB-OD2 3.37Å; Y88-D566 HydrophobicContact CD2-CB 3.87Å; Y88-D566 PolarHBondContact N-OD2 3.17Å; V548-D566 HydrophobicContact CG1-CB 4.15Å; K562-D566 PolarHBondContact O-N 2.66Å; K562-D566 VanDerWaalsContact O-N 3.09Å; L563-D566 PolarHBondContact O-N 3.35Å; D566-N568 VanDerWaalsContact C-N 3.34Å; D566-N568 PolarHBondContact O-N 2.87Å; D566-R569 WeakPolarHBondContact O-CB 3.49Å; D566-R569 PolarHBondContact O-N 3.41Å; D566-H570 VanDerWaalsContact O-CB 3.29Å; D566-H570 WeakPolarHBondContact O-CB 3.32Å; D566-H570 PolarHBondContact O-N 2.98Å
567	V	93.5	Very high	93.5	Very high	22 Å²	22	32.2 Å²	32.2	13%	0.133	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-42.9	174.1	163.8	0	0	0	0	111.4	L545 V548 L563 H570 K571	L545-V567 HydrophobicContact CD1-CG1 3.86Å; L545-V567 HydrophobicContact CD2-CG1 3.88Å; V548-V567 HydrophobicContact CG1-CG2 4Å; L563-V567 HydrophobicContact CD1-CG2 4.28Å; L563-V567 HydrophobicContact CG-CG2 4.39Å; L563-V567 WeakPolarHBondContact O-CB 3.48Å; L563-V567 VanDerWaalsContact O-CG2 3.32Å; L563-V567 WeakPolarHBondContact O-CG2 3.15Å; L563-V567 PolarHBondContact O-N 2.99Å; V567-H570 WeakPolarHBondContact O-CB 3.4Å; V567-H570 PolarHBondContact O-N 3.17Å; V567-K571 WeakPolarHBondContact O-CG 3.45Å; V567-K571 PolarHBondContact O-N 3.15Å
568	N	93.8	Very high	94	Very high	74 Å²	74	26.7 Å²	26.7	40%	0.396	15%	0.147	S	C	.	.	H	α-helix	trans	-67.5	-45.3	176.6	-72	-32.9	0	0	0	111.1	G564 V565 D566 H570 K571 E572 N629	G564-N568 PolarHBondContact O-N 2.93Å; G564-N568 PolarHBondContact O-ND2 3.31Å; V565-N568 PolarHBondContact O-N 2.84Å; D566-N568 VanDerWaalsContact C-N 3.34Å; D566-N568 PolarHBondContact O-N 2.87Å; N568-H570 VanDerWaalsContact C-N 3.27Å; N568-H570 PolarHBondContact O-N 3.03Å; N568-K571 WeakPolarHBondContact O-CB 3.44Å; N568-K571 PolarHBondContact O-N 2.95Å; N568-K571 VanDerWaalsContact O-N 3.15Å; N568-E572 WeakPolarHBondContact O-CG 3.46Å; N568-E572 PolarHBondContact O-N 3.26Å; N568-N629 HydrophobicContact CB-CB 4.19Å; N568-N629 VanDerWaalsContact CB-CG 3.47Å; N568-N629 WeakPolarHBondContact CB-OD1 2.98Å
569	R	94.5	Very high	94.5	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-54.5	-44.6	174.6	-170.7	180	178.3	-99.9	7.5	111.8	A83 Y86 Y88 V565 D566 K571 E572 V573 N629 D635	A83-R569 PolarHBondContact O-NH1 3.48Å; A83-R569 PolarHBondContact O-NH2 2.91Å; Y86-R569 PolarHBondContact O-NH1 3.32Å; Y88-R569 PolarHBondContact OH-NE 3.01Å; V565-R569 WeakPolarHBondContact O-CB 3.23Å; V565-R569 PolarHBondContact O-N 3.34Å; D566-R569 WeakPolarHBondContact O-CB 3.49Å; D566-R569 PolarHBondContact O-N 3.41Å; R569-K571 VanDerWaalsContact C-N 3.35Å; R569-K571 PolarHBondContact O-N 3.3Å; R569-E572 WeakPolarHBondContact O-CB 3.32Å; R569-E572 PolarHBondContact O-N 3.47Å; R569-E572 VanDerWaalsContact O-N 3.17Å; R569-V573 WeakPolarHBondContact O-CG2 3.19Å; R569-V573 PolarHBondContact O-N 2.94Å; R569-N629 HydrophobicContact CB-CB 4.22Å; R569-N629 VanDerWaalsContact CB-O 3.26Å; R569-N629 WeakPolarHBondContact CB-O 3.32Å; R569-N629 VanDerWaalsContact CD-O 3.28Å; R569-N629 WeakPolarHBondContact CD-O 3.49Å; R569-N629 VanDerWaalsContact CG-O 3.26Å; R569-N629 WeakPolarHBondContact CG-O 3.47Å; R569-D635 IonicContact CZ-OD1 3.32Å; R569-D635 IonicContact NH2-OD1 2.88Å; R569-D635 PolarHBondContact NH2-OD1 3.47Å
570	H	95.3	Very high	95	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-58.4	-45.3	177.8	-170.3	93.3	0	0	0	112.2	K284 I544 D547 V548 D566 V567 N568 V573 I574	K284-H570 WeakPolarHBondContact CB-CE1 3.44Å; K284-H570 WeakPolarHBondContact CD-ND1 3.46Å; I544-H570 PolarHBondContact O-NE2 3.2Å; I544-H570 VanDerWaalsContact O-NE2 3.08Å; D547-H570 IonicContact OD2-CE1 2.9Å; V548-H570 HydrophobicContact CG2-CB 3.74Å; V548-H570 VanDerWaalsContact CG2-CG 3.4Å; V548-H570 WeakPolarHBondContact CG2-ND1 3.21Å; D566-H570 VanDerWaalsContact O-CB 3.29Å; D566-H570 WeakPolarHBondContact O-CB 3.32Å; D566-H570 PolarHBondContact O-N 2.98Å; V567-H570 WeakPolarHBondContact O-CB 3.4Å; V567-H570 PolarHBondContact O-N 3.17Å; N568-H570 VanDerWaalsContact C-N 3.27Å; N568-H570 PolarHBondContact O-N 3.03Å; H570-V573 PolarHBondContact O-N 3.43Å; H570-I574 VanDerWaalsContact CD2-CD1 3.48Å; H570-I574 WeakPolarHBondContact CD2-CD1 3.33Å; H570-I574 WeakPolarHBondContact NE2-CD1 3.26Å; H570-I574 WeakPolarHBondContact O-CG1 3.42Å; H570-I574 PolarHBondContact O-N 3.06Å
571	K	95.3	Very high	95.3	Very high	42 Å²	42	16.8 Å²	16.8	18%	0.183	9%	0.093	C	C	.	.	H	α-helix	trans	-61.4	-43.8	174.9	-69.8	179.9	179.1	-173.8	0	111.8	A531 I544 V567 N568 R569 V573 I574 V575	A531-K571 HydrophobicContact CB-CB 4.33Å; I544-K571 HydrophobicContact CD1-CG 4.09Å; V567-K571 WeakPolarHBondContact O-CG 3.45Å; V567-K571 PolarHBondContact O-N 3.15Å; N568-K571 WeakPolarHBondContact O-CB 3.44Å; N568-K571 PolarHBondContact O-N 2.95Å; N568-K571 VanDerWaalsContact O-N 3.15Å; R569-K571 VanDerWaalsContact C-N 3.35Å; R569-K571 PolarHBondContact O-N 3.3Å; K571-V573 PolarHBondContact O-N 3.4Å; K571-I574 PolarHBondContact O-N 3.37Å; K571-V575 VanDerWaalsContact O-CG2 3.28Å; K571-V575 WeakPolarHBondContact O-CG2 3.42Å; K571-V575 PolarHBondContact O-N 3.16Å
572	E	95.8	Very high	95.7	Very high	7 Å²	7	14.1 Å²	14.1	3%	0.033	8%	0.08	C	C	.	.	H	α-helix	trans	-59.6	-44.5	177.4	-63.7	176.7	166.8	0	0	112.4	N568 R569 V575 K576 N629 R663 N664	N568-E572 WeakPolarHBondContact O-CG 3.46Å; N568-E572 PolarHBondContact O-N 3.26Å; R569-E572 WeakPolarHBondContact O-CB 3.32Å; R569-E572 PolarHBondContact O-N 3.47Å; R569-E572 VanDerWaalsContact O-N 3.17Å; E572-V575 PolarHBondContact O-N 3.06Å; E572-K576 WeakPolarHBondContact O-CB 3.22Å; E572-K576 PolarHBondContact O-N 3.5Å; E572-N629 PolarHBondContact OE1-ND2 3Å; E572-R663 IonicContact OE2-CZ 3.96Å; E572-R663 IonicContact OE2-NE 2.85Å; E572-R663 PolarHBondContact OE2-NE 2.99Å; E572-R663 VanDerWaalsContact OE2-NE 3.12Å; E572-R663 IonicContact OE2-NH2 3.46Å; E572-R663 PolarHBondContact OE2-NH2 3.43Å; E572-N664 WeakPolarHBondContact CB-OD1 3.43Å; E572-N664 VanDerWaalsContact CD-ND2 3.35Å; E572-N664 WeakPolarHBondContact CG-OD1 3.45Å; E572-N664 PolarHBondContact OE1-ND2 3.31Å
573	V	97.3	Very high	96.1	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.2	-41.8	178.5	176.3	0	0	0	0	111.3	E84 K284 L288 R569 H570 K571 K576 A577	E84-V573 HydrophobicContact CB-CG1 4.35Å; E84-V573 HydrophobicContact CB-CG2 4.01Å; E84-V573 HydrophobicContact CG-CG2 3.84Å; K284-V573 HydrophobicContact CD-CB 4.23Å; K284-V573 HydrophobicContact CD-CG1 3.94Å; K284-V573 HydrophobicContact CG-CB 4.33Å; K284-V573 HydrophobicContact CG-CG1 3.77Å; L288-V573 HydrophobicContact CD1-CG1 3.85Å; L288-V573 HydrophobicContact CD2-CG1 3.79Å; L288-V573 HydrophobicContact CG-CG1 3.93Å; R569-V573 WeakPolarHBondContact O-CG2 3.19Å; R569-V573 PolarHBondContact O-N 2.94Å; H570-V573 PolarHBondContact O-N 3.43Å; K571-V573 PolarHBondContact O-N 3.4Å; V573-K576 WeakPolarHBondContact O-CB 3.18Å; V573-K576 PolarHBondContact O-N 3.16Å; V573-A577 PolarHBondContact O-N 3.03Å
574	I	97.6	Very high	96.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.6	-46.8	175	-74.3	175.6	0	0	0	111.2	K284 L287 I527 A531 I544 H570 K571 K576 A577 I578	K284-I574 HydrophobicContact CB-CD1 4.47Å; K284-I574 HydrophobicContact CB-CG1 4.14Å; L287-I574 HydrophobicContact CD1-CG1 4.35Å; L287-I574 HydrophobicContact CD1-CG2 3.94Å; I527-I574 HydrophobicContact CG2-CG2 3.57Å; A531-I574 HydrophobicContact CB-CB 4.11Å; A531-I574 HydrophobicContact CB-CG2 3.63Å; I544-I574 HydrophobicContact CB-CD1 4.28Å; I544-I574 HydrophobicContact CD1-CD1 4.22Å; H570-I574 VanDerWaalsContact CD2-CD1 3.48Å; H570-I574 WeakPolarHBondContact CD2-CD1 3.33Å; H570-I574 WeakPolarHBondContact NE2-CD1 3.26Å; H570-I574 WeakPolarHBondContact O-CG1 3.42Å; H570-I574 PolarHBondContact O-N 3.06Å; K571-I574 PolarHBondContact O-N 3.37Å; I574-K576 VanDerWaalsContact C-N 3.32Å; I574-K576 PolarHBondContact O-N 3.31Å; I574-A577 PolarHBondContact O-N 3.41Å; I574-I578 HydrophobicContact CG2-CD1 3.65Å; I574-I578 HydrophobicContact CG2-CG1 4.44Å; I574-I578 WeakPolarHBondContact O-CG1 3.45Å; I574-I578 PolarHBondContact O-N 3.29Å
575	V	97.7	Very high	96.7	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.5	-42.9	178	176.3	0	0	0	0	110.4	L528 A531 K571 E572 S579 F616 L671	L528-V575 HydrophobicContact CD1-CB 4.27Å; L528-V575 HydrophobicContact CD1-CG1 3.94Å; L528-V575 HydrophobicContact CD1-CG2 4.06Å; A531-V575 HydrophobicContact CB-CG2 3.79Å; K571-V575 VanDerWaalsContact O-CG2 3.28Å; K571-V575 WeakPolarHBondContact O-CG2 3.42Å; K571-V575 PolarHBondContact O-N 3.16Å; E572-V575 PolarHBondContact O-N 3.06Å; V575-S579 VanDerWaalsContact O-CB 3.22Å; V575-S579 WeakPolarHBondContact O-CB 3.26Å; V575-S579 PolarHBondContact O-N 3.38Å; V575-S579 PolarHBondContact O-OG 3.33Å; V575-F616 HydrophobicContact CG1-CE2 3.77Å; V575-F616 HydrophobicContact CG1-CZ 3.96Å; V575-F616 HydrophobicContact CG2-CE2 4.26Å; V575-L671 HydrophobicContact CG1-CD1 4.46Å
576	K	97.5	Very high	97	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-55.5	-56.1	174.7	165.9	174.8	165.8	-176.7	0	110.9	E81 E84 W291 E572 V573 I574 I578 S579 A580 W662 R663 F666 S667	E81-K576 IonicContact OE1-NZ 2.83Å; E81-K576 PolarHBondContact OE1-NZ 3.39Å; E81-K576 IonicContact OE2-NZ 2.93Å; E84-K576 IonicContact OE1-NZ 3.53Å; E84-K576 PolarHBondContact OE1-NZ 3.22Å; E84-K576 WeakPolarHBondContact OE2-CE 3.22Å; E84-K576 IonicContact OE2-NZ 3.91Å; E84-K576 PolarHBondContact OE2-NZ 3.39Å; W291-K576 HydrophobicContact CH2-CD 4.42Å; W291-K576 HydrophobicContact CH2-CG 4.28Å; W291-K576 HydrophobicContact CZ3-CD 4.37Å; W291-K576 HydrophobicContact CZ3-CG 4.22Å; E572-K576 WeakPolarHBondContact O-CB 3.22Å; E572-K576 PolarHBondContact O-N 3.5Å; V573-K576 WeakPolarHBondContact O-CB 3.18Å; V573-K576 PolarHBondContact O-N 3.16Å; I574-K576 VanDerWaalsContact C-N 3.32Å; I574-K576 PolarHBondContact O-N 3.31Å; K576-I578 PolarHBondContact O-N 3.33Å; K576-S579 PolarHBondContact O-N 3.04Å; K576-S579 PolarHBondContact O-OG 2.91Å; K576-A580 WeakPolarHBondContact O-CB 3.43Å; K576-A580 PolarHBondContact O-N 3.33Å; K576-A580 VanDerWaalsContact O-N 3.08Å; K576-W662 HydrophobicContact CD-CE3 4.46Å; K576-W662 HydrophobicContact CD-CZ3 3.99Å; K576-R663 HydrophobicContact CB-CB 4.47Å; K576-R663 HydrophobicContact CD-CB 4.11Å; K576-R663 HydrophobicContact CD-CG 3.75Å; K576-F666 HydrophobicContact CD-CD1 4.42Å; K576-F666 HydrophobicContact CG-CD1 3.82Å; K576-F666 HydrophobicContact CG-CE1 3.92Å; K576-S667 WeakPolarHBondContact CA-OG 3.17Å; K576-S667 PolarHBondContact N-OG 2.96Å
577	A	98.4	Very high	97.2	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.8	-49.7	-177.7	0	0	0	0	0	112.5	L287 L288 W291 V573 I574 S579 A580 V581	L287-A577 HydrophobicContact CB-CB 3.99Å; L288-A577 HydrophobicContact CD2-CB 4.36Å; W291-A577 HydrophobicContact CE3-CB 4.49Å; V573-A577 PolarHBondContact O-N 3.03Å; I574-A577 PolarHBondContact O-N 3.41Å; A577-S579 PolarHBondContact O-N 3.43Å; A577-A580 PolarHBondContact O-N 3.11Å; A577-V581 WeakPolarHBondContact O-CG2 3.45Å; A577-V581 PolarHBondContact O-N 3.49Å
578	I	98.6	Very high	97.4	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.3	-44.1	-179	-65.4	169.3	0	0	0	111.1	L287 L524 I527 L528 I574 K576 A580 V581 L582	L287-I578 HydrophobicContact CD1-CD1 3.9Å; L287-I578 HydrophobicContact CD1-CG1 3.86Å; L287-I578 HydrophobicContact CD2-CG1 4.05Å; L524-I578 HydrophobicContact CB-CG2 4.21Å; L524-I578 HydrophobicContact CD2-CG1 4.28Å; I527-I578 HydrophobicContact CB-CD1 3.86Å; I527-I578 HydrophobicContact CG2-CD1 3.68Å; L528-I578 HydrophobicContact CB-CD1 4.11Å; L528-I578 HydrophobicContact CB-CG2 4.21Å; L528-I578 HydrophobicContact CD1-CG2 4.47Å; L528-I578 HydrophobicContact CD2-CG2 4.43Å; I574-I578 HydrophobicContact CG2-CD1 3.65Å; I574-I578 HydrophobicContact CG2-CG1 4.44Å; I574-I578 WeakPolarHBondContact O-CG1 3.45Å; I574-I578 PolarHBondContact O-N 3.29Å; K576-I578 PolarHBondContact O-N 3.33Å; I578-A580 PolarHBondContact O-N 2.92Å; I578-V581 PolarHBondContact O-N 2.91Å; I578-L582 HydrophobicContact CG2-CD1 3.85Å; I578-L582 HydrophobicContact CG2-CG 4.22Å; I578-L582 WeakPolarHBondContact O-CB 3.37Å; I578-L582 WeakPolarHBondContact O-CG 3.22Å; I578-L582 PolarHBondContact O-N 3.01Å
579	S	98.6	Very high	97.6	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.7	-34	179.8	77.2	0	0	0	0	112.2	V575 K576 A577 L583 N670	V575-S579 VanDerWaalsContact O-CB 3.22Å; V575-S579 WeakPolarHBondContact O-CB 3.26Å; V575-S579 PolarHBondContact O-N 3.38Å; V575-S579 PolarHBondContact O-OG 3.33Å; K576-S579 PolarHBondContact O-N 3.04Å; K576-S579 PolarHBondContact O-OG 2.91Å; A577-S579 PolarHBondContact O-N 3.43Å; S579-L583 VanDerWaalsContact O-CB 3.26Å; S579-L583 WeakPolarHBondContact O-CB 3.33Å; S579-L583 PolarHBondContact O-N 3.16Å; S579-N670 WeakPolarHBondContact OG-CB 3.33Å; S579-N670 PolarHBondContact OG-ND2 3.38Å; S579-N670 VanDerWaalsContact OG-ND2 3.13Å
580	A	98.4	Very high	97.8	Very high	3 Å²	3	7.7 Å²	7.7	3%	0.025	3%	0.034	C	C	.	.	H	α-helix	trans	-73.9	-48	177.9	0	0	0	0	0	112	W291 K576 A577 I578 L582 L583 L584 F666	W291-A580 HydrophobicContact CD2-CB 3.92Å; W291-A580 HydrophobicContact CG-CB 4.04Å; W291-A580 HydrophobicContact CZ2-CB 3.81Å; W291-A580 VanDerWaalsContact NE1-CB 3.26Å; K576-A580 WeakPolarHBondContact O-CB 3.43Å; K576-A580 PolarHBondContact O-N 3.33Å; K576-A580 VanDerWaalsContact O-N 3.08Å; A577-A580 PolarHBondContact O-N 3.11Å; I578-A580 PolarHBondContact O-N 2.92Å; A580-L582 PolarHBondContact O-N 3.42Å; A580-L583 PolarHBondContact O-N 3.43Å; A580-L584 WeakPolarHBondContact O-CB 3.28Å; A580-L584 WeakPolarHBondContact O-CG 3.36Å; A580-L584 PolarHBondContact O-N 3.19Å; A580-F666 HydrophobicContact CB-CE1 3.97Å; A580-F666 HydrophobicContact CB-CZ 4.07Å
581	V	98.7	Very high	97.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-54.2	-53.2	175.6	170.4	0	0	0	0	110.7	F267 L290 W291 L524 A577 I578 L583 L584 L585	F267-V581 HydrophobicContact CZ-CG1 4.01Å; L290-V581 HydrophobicContact CD2-CG1 4.43Å; L290-V581 HydrophobicContact CG-CG2 4.24Å; W291-V581 HydrophobicContact CB-CG2 3.7Å; W291-V581 HydrophobicContact CG-CG2 4.34Å; L524-V581 HydrophobicContact CD1-CG1 4.25Å; A577-V581 WeakPolarHBondContact O-CG2 3.45Å; A577-V581 PolarHBondContact O-N 3.49Å; I578-V581 PolarHBondContact O-N 2.91Å; V581-L583 VanDerWaalsContact C-N 3.3Å; V581-L583 PolarHBondContact O-N 3.48Å; V581-L584 PolarHBondContact O-N 2.87Å; V581-L585 HydrophobicContact CG1-CD1 3.96Å; V581-L585 HydrophobicContact CG1-CG 4.44Å; V581-L585 WeakPolarHBondContact O-CG 3.42Å; V581-L585 PolarHBondContact O-N 2.94Å
582	L	98.7	Very high	97.9	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-59.6	-41.6	-179.3	-71	178.8	0	0	0	112	M521 L524 L525 I578 A580 L586 M600 L604 I674	M521-L582 HydrophobicContact CE-CD2 4.49Å; M521-L582 HydrophobicContact SD-CD2 3.9Å; L524-L582 HydrophobicContact CD1-CD2 3.65Å; L524-L582 HydrophobicContact CD1-CG 4.23Å; L525-L582 HydrophobicContact CD2-CD1 4.28Å; I578-L582 HydrophobicContact CG2-CD1 3.85Å; I578-L582 HydrophobicContact CG2-CG 4.22Å; I578-L582 WeakPolarHBondContact O-CB 3.37Å; I578-L582 WeakPolarHBondContact O-CG 3.22Å; I578-L582 PolarHBondContact O-N 3.01Å; A580-L582 PolarHBondContact O-N 3.42Å; L582-L586 VanDerWaalsContact O-CB 3.32Å; L582-L586 WeakPolarHBondContact O-CB 3.45Å; L582-L586 WeakPolarHBondContact O-CD1 3.41Å; L582-L586 WeakPolarHBondContact O-CG 3.43Å; L582-L586 PolarHBondContact O-N 2.85Å; L582-M600 HydrophobicContact CD2-CE 3.85Å; L582-L604 HydrophobicContact CD1-CD2 4.49Å; L582-L604 HydrophobicContact CD2-CD2 3.93Å; L582-I674 HydrophobicContact CB-CD1 3.7Å; L582-I674 HydrophobicContact CD1-CD1 4.41Å
583	L	98.6	Very high	97.9	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-71.1	-39.9	-178.5	-177.6	59.2	0	0	0	112.7	F301 S579 A580 V581 K587 N670 R673 I674 K677	F301-L583 HydrophobicContact CE1-CD2 4.48Å; F301-L583 HydrophobicContact CZ-CD2 4.01Å; F301-L583 HydrophobicContact CZ-CG 4.44Å; S579-L583 VanDerWaalsContact O-CB 3.26Å; S579-L583 WeakPolarHBondContact O-CB 3.33Å; S579-L583 PolarHBondContact O-N 3.16Å; A580-L583 PolarHBondContact O-N 3.43Å; V581-L583 VanDerWaalsContact C-N 3.3Å; V581-L583 PolarHBondContact O-N 3.48Å; L583-K587 HydrophobicContact CD1-CD 4.39Å; L583-K587 HydrophobicContact CD1-CG 4.44Å; L583-K587 HydrophobicContact CG-CD 4.4Å; L583-K587 WeakPolarHBondContact O-CB 3.46Å; L583-K587 VanDerWaalsContact O-CG 3.3Å; L583-K587 WeakPolarHBondContact O-CG 3.48Å; L583-K587 PolarHBondContact O-N 3.2Å; L583-K587 VanDerWaalsContact O-N 3.15Å; L583-N670 HydrophobicContact CD2-CB 4.14Å; L583-N670 WeakPolarHBondContact CD2-OD1 3.45Å; L583-R673 HydrophobicContact CD1-CB 3.84Å; L583-R673 HydrophobicContact CD2-CB 4.01Å; L583-I674 HydrophobicContact CB-CD1 4.28Å; L583-I674 HydrophobicContact CB-CG1 4.07Å; L583-I674 HydrophobicContact CD1-CG1 4.18Å; L583-K677 HydrophobicContact CD1-CD 3.87Å
584	L	98.2	Very high	97.9	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.01	4%	0.041	C	C	.	.	H	α-helix	trans	-63	-50.7	176.6	-75.7	169.4	0	0	0	110.6	V294 L295 F301 A580 V581 L586 K587 H588	V294-L584 HydrophobicContact CG1-CB 4.2Å; V294-L584 HydrophobicContact CG1-CD1 4.4Å; L295-L584 HydrophobicContact CB-CD1 4.3Å; L295-L584 HydrophobicContact CD1-CD1 4.07Å; L295-L584 HydrophobicContact CD1-CD2 4.27Å; F301-L584 HydrophobicContact CD1-CD2 4.36Å; F301-L584 HydrophobicContact CE1-CD2 3.94Å; F301-L584 HydrophobicContact CZ-CD2 4.46Å; A580-L584 WeakPolarHBondContact O-CB 3.28Å; A580-L584 WeakPolarHBondContact O-CG 3.36Å; A580-L584 PolarHBondContact O-N 3.19Å; V581-L584 PolarHBondContact O-N 2.87Å; L584-L586 PolarHBondContact O-N 3.45Å; L584-K587 WeakPolarHBondContact O-CB 3.42Å; L584-K587 PolarHBondContact O-N 3.3Å; L584-H588 PolarHBondContact O-CD2 3.5Å; L584-H588 PolarHBondContact O-N 3.42Å
585	L	98.6	Very high	97.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.3	-47.6	177.7	-66.3	-179.8	0	0	0	112	F267 V294 L298 L509 L513 V581 K587 H588 F589 M600	F267-L585 HydrophobicContact CE2-CD1 4.45Å; F267-L585 HydrophobicContact CZ-CD1 3.84Å; V294-L585 HydrophobicContact CG1-CD2 4.06Å; L298-L585 HydrophobicContact CD1-CD2 4.19Å; L509-L585 HydrophobicContact CD2-CD2 3.63Å; L513-L585 HydrophobicContact CD1-CD1 4.5Å; V581-L585 HydrophobicContact CG1-CD1 3.96Å; V581-L585 HydrophobicContact CG1-CG 4.44Å; V581-L585 WeakPolarHBondContact O-CG 3.42Å; V581-L585 PolarHBondContact O-N 2.94Å; L585-K587 PolarHBondContact O-N 3.29Å; L585-H588 PolarHBondContact O-N 2.9Å; L585-F589 HydrophobicContact CB-CD2 4.29Å; L585-F589 HydrophobicContact CB-CE2 4.07Å; L585-F589 HydrophobicContact CD2-CE1 4.47Å; L585-F589 HydrophobicContact CD2-CE2 4.11Å; L585-F589 HydrophobicContact CD2-CZ 3.84Å; L585-F589 HydrophobicContact CG-CE2 4.49Å; L585-F589 WeakPolarHBondContact O-CB 3.43Å; L585-F589 WeakPolarHBondContact O-CG 3.24Å; L585-F589 PolarHBondContact O-N 3.31Å; L585-M600 HydrophobicContact CB-CE 3.63Å; L585-M600 HydrophobicContact CB-SD 3.74Å; L585-M600 HydrophobicContact CD1-CE 3.98Å; L585-M600 HydrophobicContact CG-CE 4.47Å
586	L	98.6	Very high	97.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-63.3	-15.5	175.9	-73.4	171.7	0	0	0	113.9	L582 L584 K590 F597 M600 A601 L604 I674 K677	L582-L586 VanDerWaalsContact O-CB 3.32Å; L582-L586 WeakPolarHBondContact O-CB 3.45Å; L582-L586 WeakPolarHBondContact O-CD1 3.41Å; L582-L586 WeakPolarHBondContact O-CG 3.43Å; L582-L586 PolarHBondContact O-N 2.85Å; L584-L586 PolarHBondContact O-N 3.45Å; L586-K590 WeakPolarHBondContact O-CB 3.45Å; L586-F597 HydrophobicContact CB-CD2 4.25Å; L586-F597 HydrophobicContact CB-CE2 4.19Å; L586-F597 HydrophobicContact CD2-CD2 3.78Å; L586-F597 HydrophobicContact CD2-CE2 3.7Å; L586-F597 WeakPolarHBondContact O-CD2 3.16Å; L586-M600 HydrophobicContact CD2-CB 4.47Å; L586-M600 HydrophobicContact CD2-CE 4.31Å; L586-M600 HydrophobicContact CD2-CG 4.18Å; L586-M600 HydrophobicContact CD2-SD 3.66Å; L586-M600 HydrophobicContact CG-CE 4.01Å; L586-M600 HydrophobicContact CG-SD 3.83Å; L586-A601 HydrophobicContact CD2-CB 4.3Å; L586-L604 HydrophobicContact CD1-CD1 3.93Å; L586-L604 HydrophobicContact CD2-CD1 4.07Å; L586-L604 HydrophobicContact CG-CD1 4.28Å; L586-I674 HydrophobicContact CD1-CB 4.49Å; L586-I674 HydrophobicContact CD1-CG1 4.23Å; L586-I674 HydrophobicContact CD1-CG2 3.95Å; L586-K677 HydrophobicContact CB-CD 4.14Å; L586-K677 PolarHBondContact O-NZ 3.3Å
587	K	97.8	Very high	98	Very high	31 Å²	31	9.4 Å²	9.4	14%	0.135	4%	0.044	C	C	.	.	H	α-helix	trans	-93.6	-49.2	176.1	-80.6	-177.1	111.7	-159.1	0	111.2	F301 L304 L583 L584 L585 K590 L591 K677	F301-K587 HydrophobicContact CD1-CD 3.85Å; F301-K587 HydrophobicContact CE1-CD 3.56Å; L304-K587 HydrophobicContact CD2-CB 3.66Å; L304-K587 HydrophobicContact CD2-CD 3.79Å; L304-K587 HydrophobicContact CD2-CG 4.15Å; L583-K587 HydrophobicContact CD1-CD 4.39Å; L583-K587 HydrophobicContact CD1-CG 4.44Å; L583-K587 HydrophobicContact CG-CD 4.4Å; L583-K587 WeakPolarHBondContact O-CB 3.46Å; L583-K587 VanDerWaalsContact O-CG 3.3Å; L583-K587 WeakPolarHBondContact O-CG 3.48Å; L583-K587 PolarHBondContact O-N 3.2Å; L583-K587 VanDerWaalsContact O-N 3.15Å; L584-K587 WeakPolarHBondContact O-CB 3.42Å; L584-K587 PolarHBondContact O-N 3.3Å; L585-K587 PolarHBondContact O-N 3.29Å; K587-K590 PolarHBondContact O-N 3.02Å; K587-L591 PolarHBondContact O-N 3.46Å; K587-L591 VanDerWaalsContact O-N 3.08Å; K587-K677 VanDerWaalsContact CG-NZ 3.3Å
588	H	98.1	Very high	97.9	Very high	6 Å²	6	10.1 Å²	10.1	3%	0.028	5%	0.047	C	C	.	.	H	α-helix	trans	-66.2	-47.7	-179.8	-77.6	-63.9	0	0	0	111.7	L298 G299 L304 M307 L584 L585 K590 L591 N592	L298-H588 WeakPolarHBondContact CB-NE2 3.39Å; L298-H588 HydrophobicContact CD1-CB 3.82Å; L298-H588 PolarHBondContact O-CE1 2.88Å; L298-H588 PolarHBondContact O-NE2 2.64Å; G299-H588 PolarHBondContact O-CE1 3.07Å; G299-H588 PolarHBondContact O-NE2 3.25Å; L304-H588 VanDerWaalsContact CD1-ND1 3.27Å; L304-H588 WeakPolarHBondContact CD1-ND1 3.46Å; M307-H588 VanDerWaalsContact CE-CE1 3.48Å; M307-H588 WeakPolarHBondContact CE-CE1 3.23Å; L584-H588 PolarHBondContact O-CD2 3.5Å; L584-H588 PolarHBondContact O-N 3.42Å; L585-H588 PolarHBondContact O-N 2.9Å; H588-K590 PolarHBondContact O-N 2.91Å; H588-L591 PolarHBondContact O-N 3.35Å; H588-N592 WeakPolarHBondContact O-CB 3.25Å; H588-N592 PolarHBondContact O-N 3.33Å
589	F	98.3	Very high	97.9	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.2	-34.7	174.6	-64.5	-21.8	0	0	0	112.3	A506 L509 Y510 L513 L585 L591 N592 H593 Q596 F597 M600	A506-F589 WeakPolarHBondContact O-CE1 3.37Å; L509-F589 HydrophobicContact CD2-CZ 4.4Å; L509-F589 HydrophobicContact CG-CZ 4.41Å; Y510-F589 HydrophobicContact CD2-CD1 4.34Å; Y510-F589 HydrophobicContact CD2-CD2 4.16Å; Y510-F589 HydrophobicContact CD2-CE1 4.32Å; Y510-F589 HydrophobicContact CD2-CE2 4.11Å; Y510-F589 HydrophobicContact CD2-CG 4.29Å; Y510-F589 HydrophobicContact CD2-CZ 4.21Å; L513-F589 HydrophobicContact CD1-CE2 4.12Å; L513-F589 HydrophobicContact CD1-CZ 3.8Å; L585-F589 HydrophobicContact CB-CD2 4.29Å; L585-F589 HydrophobicContact CB-CE2 4.07Å; L585-F589 HydrophobicContact CD2-CE1 4.47Å; L585-F589 HydrophobicContact CD2-CE2 4.11Å; L585-F589 HydrophobicContact CD2-CZ 3.84Å; L585-F589 HydrophobicContact CG-CE2 4.49Å; L585-F589 WeakPolarHBondContact O-CB 3.43Å; L585-F589 WeakPolarHBondContact O-CG 3.24Å; L585-F589 PolarHBondContact O-N 3.31Å; F589-L591 VanDerWaalsContact C-N 3.32Å; F589-L591 PolarHBondContact O-N 3.45Å; F589-N592 PolarHBondContact O-N 3.08Å; F589-H593 CarbonylContact O-C 3.29Å; F589-H593 VanDerWaalsContact O-C 3.29Å; F589-H593 PolarHBondContact O-N 3.42Å; F589-Q596 HydrophobicContact CB-CB 4Å; F589-Q596 HydrophobicContact CG-CB 4.45Å; F589-F597 HydrophobicContact CB-CB 4.46Å; F589-M600 HydrophobicContact CD2-SD 3.92Å; F589-M600 HydrophobicContact CE2-SD 4.21Å
590	K	97.8	Very high	97.9	Very high	69 Å²	69	12.2 Å²	12.2	30%	0.3	6%	0.056	S	C	.	.	H	α-helix	trans	-67.7	-33.7	176.1	-173.5	173.5	-175.3	104	0	112.8	L586 K587 H588 I594 F597	L586-K590 WeakPolarHBondContact O-CB 3.45Å; K587-K590 PolarHBondContact O-N 3.02Å; H588-K590 PolarHBondContact O-N 2.91Å; K590-I594 HydrophobicContact CG-CD1 4.32Å; K590-F597 HydrophobicContact CB-CB 3.71Å; K590-F597 HydrophobicContact CB-CD2 3.86Å; K590-F597 HydrophobicContact CB-CG 3.78Å; K590-F597 HydrophobicContact CD-CD1 4.39Å; K590-F597 HydrophobicContact CD-CD2 4.33Å; K590-F597 HydrophobicContact CD-CE2 4.45Å; K590-F597 HydrophobicContact CD-CG 4.29Å; K590-F597 HydrophobicContact CG-CB 4.27Å; K590-F597 HydrophobicContact CG-CD1 4.41Å; K590-F597 HydrophobicContact CG-CD2 4.41Å; K590-F597 HydrophobicContact CG-CG 4.09Å
591	L	96.6	Very high	97.9	Very high	23 Å²	23	12.1 Å²	12.1	12%	0.12	5%	0.054	C	C	.	.	H	α-helix	trans	-75	-39.4	175.8	179.6	61.6	0	0	0	110.5	L304 M307 K308 K311 I478 K587 H588 F589	L304-L591 HydrophobicContact CD1-CB 4.19Å; L304-L591 HydrophobicContact CD1-CD2 3.67Å; L304-L591 HydrophobicContact CG-CD2 4.49Å; M307-L591 HydrophobicContact CB-CD2 3.74Å; M307-L591 HydrophobicContact CE-CD2 4.3Å; K308-L591 HydrophobicContact CB-CD1 3.9Å; K308-L591 HydrophobicContact CB-CD2 4.31Å; K308-L591 HydrophobicContact CG-CD1 4.02Å; K311-L591 HydrophobicContact CB-CD1 4.47Å; K311-L591 HydrophobicContact CD-CD1 4.03Å; K311-L591 HydrophobicContact CD-CG 4.47Å; K311-L591 WeakPolarHBondContact CE-O 3.46Å; K311-L591 PolarHBondContact NZ-O 3.34Å; I478-L591 HydrophobicContact CD1-CD1 3.76Å; K587-L591 PolarHBondContact O-N 3.46Å; K587-L591 VanDerWaalsContact O-N 3.08Å; H588-L591 PolarHBondContact O-N 3.35Å; F589-L591 VanDerWaalsContact C-N 3.32Å; F589-L591 PolarHBondContact O-N 3.45Å
592	N	96.3	Very high	97.7	Very high	22 Å²	22	12.3 Å²	12.3	12%	0.118	6%	0.055	C	C	.	.	H	α-helix	trans	-66.3	-62.4	178.5	-165.8	46.7	0	0	0	110.7	K311 Q482 V504 A506 E507 H588 F589 Q596	K311-N592 PolarHBondContact NZ-O 3.2Å; Q482-N592 PolarHBondContact NE2-O 3.32Å; V504-N592 WeakPolarHBondContact CG2-OD1 3.28Å; A506-N592 HydrophobicContact CB-CB 4.05Å; E507-N592 PolarHBondContact OE2-ND2 2.96Å; H588-N592 WeakPolarHBondContact O-CB 3.25Å; H588-N592 PolarHBondContact O-N 3.33Å; F589-N592 PolarHBondContact O-N 3.08Å; N592-Q596 VanDerWaalsContact ND2-CD 3.33Å; N592-Q596 PolarHBondContact ND2-NE2 3.06Å; N592-Q596 PolarHBondContact ND2-OE1 2.94Å
593	H	96.4	Very high	97.6	Very high	11 Å²	11	14 Å²	14	5%	0.051	6%	0.063	C	C	.	.			trans	-151.1	135.2	171.5	-162	-101.7	0	0	0	114.4	E486 F589 Y595 Q596 F597 F778	E486-H593 IonicContact OE1-CE1 2.8Å; E486-H593 PolarHBondContact OE1-CE1 3.23Å; E486-H593 IonicContact OE1-NE2 3.44Å; E486-H593 PolarHBondContact OE1-NE2 3.44Å; F589-H593 CarbonylContact O-C 3.29Å; F589-H593 VanDerWaalsContact O-C 3.29Å; F589-H593 PolarHBondContact O-N 3.42Å; H593-Y595 VanDerWaalsContact C-N 3.27Å; H593-Y595 AromaticContact CE1-CD2 3.74Å; H593-Y595 PolarHBondContact ND1-N 3.48Å; H593-Y595 PolarHBondContact O-N 2.82Å; H593-Q596 HydrophobicContact CB-CB 4.39Å; H593-Q596 HydrophobicContact CB-CG 3.9Å; H593-Q596 WeakPolarHBondContact O-CB 3.32Å; H593-Q596 PolarHBondContact O-N 2.97Å; H593-Q596 VanDerWaalsContact O-N 3.11Å; H593-F597 PolarHBondContact O-N 3.41Å; H593-F778 HydrophobicContact CB-CZ 4.1Å; H593-F778 AromaticContact CE1-CD2 3.59Å; H593-F778 AromaticContact CE1-CE2 3.32Å; H593-F778 WeakPolarHBondContact CE1-CE2 3.43Å; H593-F778 AromaticContact CE1-CZ 3.81Å; H593-F778 AromaticContact CG-CE2 3.78Å; H593-F778 AromaticContact CG-CZ 3.65Å; H593-F778 AromaticContact ND1-CD2 3.79Å; H593-F778 AromaticContact ND1-CE1 3.74Å; H593-F778 AromaticContact ND1-CE2 3.21Å; H593-F778 WeakPolarHBondContact ND1-CE2 3.47Å; H593-F778 AromaticContact ND1-CZ 3.17Å; H593-F778 WeakPolarHBondContact ND1-CZ 3.32Å; H593-F778 AromaticContact NE2-CE2 3.96Å
594	I	97.1	Very high	97.6	Very high	12 Å²	12	14 Å²	14	6%	0.062	6%	0.063	C	C	.	.	H	α-helix	trans	-56.3	-37.7	-178.1	-173.8	56.3	0	0	0	113.6	A479 Q482 A483 K590 F597 E598	A479-I594 HydrophobicContact CB-CB 4.03Å; A479-I594 HydrophobicContact CB-CD1 3.67Å; A479-I594 HydrophobicContact CB-CG1 3.85Å; Q482-I594 HydrophobicContact CB-CB 4.49Å; Q482-I594 HydrophobicContact CB-CG2 3.8Å; A483-I594 HydrophobicContact CB-CG2 4.46Å; K590-I594 HydrophobicContact CG-CD1 4.32Å; I594-F597 HydrophobicContact CD1-CD1 3.81Å; I594-F597 HydrophobicContact CD1-CE1 4.47Å; I594-F597 WeakPolarHBondContact O-CB 3.47Å; I594-F597 PolarHBondContact O-N 3.22Å; I594-E598 HydrophobicContact CD1-CG 4.31Å; I594-E598 HydrophobicContact CG1-CG 4.34Å; I594-E598 WeakPolarHBondContact O-CG 3.32Å; I594-E598 PolarHBondContact O-N 2.93Å
595	Y	97.2	Very high	97.4	Very high	15 Å²	15	14.5 Å²	14.5	6%	0.059	7%	0.066	C	C	.	.	H	α-helix	trans	-76.7	-25	180	-66.6	-34.6	0	0	0	114.1	E486 H593 F597 E598 Y599 L771 N774 I775 F778	E486-Y595 HydrophobicContact CB-CD2 4.41Å; E486-Y595 HydrophobicContact CB-CE2 3.65Å; E486-Y595 HydrophobicContact CG-CD2 3.83Å; E486-Y595 HydrophobicContact CG-CE2 3.55Å; H593-Y595 VanDerWaalsContact C-N 3.27Å; H593-Y595 AromaticContact CE1-CD2 3.74Å; H593-Y595 PolarHBondContact ND1-N 3.48Å; H593-Y595 PolarHBondContact O-N 2.82Å; Y595-F597 VanDerWaalsContact C-N 3.34Å; Y595-E598 PolarHBondContact O-N 2.71Å; Y595-Y599 VanDerWaalsContact O-CB 3.29Å; Y595-Y599 WeakPolarHBondContact O-CB 3.42Å; Y595-Y599 PolarHBondContact O-N 2.8Å; Y595-L771 HydrophobicContact CE1-CD1 4.22Å; Y595-N774 HydrophobicContact CE1-CB 4.2Å; Y595-N774 HydrophobicContact CE2-CB 4.22Å; Y595-I775 HydrophobicContact CD1-CG1 4Å; Y595-I775 HydrophobicContact CG-CG1 4.31Å; Y595-F778 HydrophobicContact CD2-CB 3.67Å; Y595-F778 HydrophobicContact CD2-CD1 4.46Å; Y595-F778 HydrophobicContact CD2-CD2 4.26Å; Y595-F778 AromaticContact CD2-CG 3.87Å; Y595-F778 HydrophobicContact CD2-CG 3.87Å; Y595-F778 HydrophobicContact CE2-CB 4.47Å; Y595-F778 HydrophobicContact CG-CB 4.35Å; Y595-F778 HydrophobicContact CG-CG 4.37Å
596	Q	98.2	Very high	97.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.6	-43.4	167.3	-66.8	175	-17.6	0	0	110.8	E507 Y510 F589 N592 H593 M600 F778 Y783	E507-Q596 PolarHBondContact OE2-NE2 3.07Å; Y510-Q596 HydrophobicContact CD1-CG 3.72Å; Y510-Q596 HydrophobicContact CD2-CB 3.61Å; Y510-Q596 HydrophobicContact CD2-CG 3.7Å; Y510-Q596 HydrophobicContact CE1-CB 4.42Å; Y510-Q596 HydrophobicContact CE1-CG 3.69Å; Y510-Q596 HydrophobicContact CE2-CB 3.44Å; Y510-Q596 VanDerWaalsContact CE2-CB 3.44Å; Y510-Q596 HydrophobicContact CE2-CG 3.64Å; Y510-Q596 HydrophobicContact CG-CB 4.15Å; Y510-Q596 HydrophobicContact CG-CG 3.72Å; F589-Q596 HydrophobicContact CB-CB 4Å; F589-Q596 HydrophobicContact CG-CB 4.45Å; N592-Q596 VanDerWaalsContact ND2-CD 3.33Å; N592-Q596 PolarHBondContact ND2-NE2 3.06Å; N592-Q596 PolarHBondContact ND2-OE1 2.94Å; H593-Q596 HydrophobicContact CB-CB 4.39Å; H593-Q596 HydrophobicContact CB-CG 3.9Å; H593-Q596 WeakPolarHBondContact O-CB 3.32Å; H593-Q596 PolarHBondContact O-N 2.97Å; H593-Q596 VanDerWaalsContact O-N 3.11Å; Q596-M600 PolarHBondContact O-N 3.3Å; Q596-F778 HydrophobicContact CG-CE1 3.92Å; Q596-F778 HydrophobicContact CG-CZ 4.14Å; Q596-Y783 PolarHBondContact NE2-OH 3.13Å
597	F	98.4	Very high	97	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.013	10%	0.097	C	C	.	.	H	α-helix	trans	-62.6	-47.2	173.4	160.8	-93.7	0	0	0	112.4	L586 F589 K590 H593 I594 Y595 Y599 M600 A601 K677	L586-F597 HydrophobicContact CB-CD2 4.25Å; L586-F597 HydrophobicContact CB-CE2 4.19Å; L586-F597 HydrophobicContact CD2-CD2 3.78Å; L586-F597 HydrophobicContact CD2-CE2 3.7Å; L586-F597 WeakPolarHBondContact O-CD2 3.16Å; F589-F597 HydrophobicContact CB-CB 4.46Å; K590-F597 HydrophobicContact CB-CB 3.71Å; K590-F597 HydrophobicContact CB-CD2 3.86Å; K590-F597 HydrophobicContact CB-CG 3.78Å; K590-F597 HydrophobicContact CD-CD1 4.39Å; K590-F597 HydrophobicContact CD-CD2 4.33Å; K590-F597 HydrophobicContact CD-CE2 4.45Å; K590-F597 HydrophobicContact CD-CG 4.29Å; K590-F597 HydrophobicContact CG-CB 4.27Å; K590-F597 HydrophobicContact CG-CD1 4.41Å; K590-F597 HydrophobicContact CG-CD2 4.41Å; K590-F597 HydrophobicContact CG-CG 4.09Å; H593-F597 PolarHBondContact O-N 3.41Å; I594-F597 HydrophobicContact CD1-CD1 3.81Å; I594-F597 HydrophobicContact CD1-CE1 4.47Å; I594-F597 WeakPolarHBondContact O-CB 3.47Å; I594-F597 PolarHBondContact O-N 3.22Å; Y595-F597 VanDerWaalsContact C-N 3.34Å; F597-Y599 VanDerWaalsContact C-N 3.33Å; F597-Y599 PolarHBondContact O-N 3.28Å; F597-M600 PolarHBondContact O-N 3.49Å; F597-A601 HydrophobicContact CE1-CB 4.45Å; F597-A601 HydrophobicContact CE2-CB 4.49Å; F597-A601 HydrophobicContact CZ-CB 4.27Å; F597-A601 VanDerWaalsContact O-CB 3.22Å; F597-A601 WeakPolarHBondContact O-CB 3.35Å; F597-A601 PolarHBondContact O-N 3.15Å; F597-K677 HydrophobicContact CE2-CB 4.32Å; F597-K677 HydrophobicContact CZ-CB 4.39Å
598	E	97.7	Very high	96.9	Very high	14 Å²	14	23.7 Å²	23.7	7%	0.065	12%	0.116	C	C	.	.	H	α-helix	trans	-67.4	-34.4	-177.9	-68.7	-70.8	-179.2	0	0	111.8	I594 Y595 A601 Q602 K682 R685 L771 I775	I594-E598 HydrophobicContact CD1-CG 4.31Å; I594-E598 HydrophobicContact CG1-CG 4.34Å; I594-E598 WeakPolarHBondContact O-CG 3.32Å; I594-E598 PolarHBondContact O-N 2.93Å; Y595-E598 PolarHBondContact O-N 2.71Å; E598-A601 PolarHBondContact O-N 3.34Å; E598-Q602 WeakPolarHBondContact O-CB 3.37Å; E598-Q602 WeakPolarHBondContact O-CG 3.41Å; E598-Q602 PolarHBondContact O-N 2.92Å; E598-K682 VanDerWaalsContact CD-NZ 3.34Å; E598-K682 WeakPolarHBondContact OE1-CE 3.35Å; E598-K682 IonicContact OE1-NZ 3.07Å; E598-K682 PolarHBondContact OE1-NZ 2.83Å; E598-K682 WeakPolarHBondContact OE2-CE 2.91Å; E598-K682 IonicContact OE2-NZ 2.77Å; E598-K682 PolarHBondContact OE2-NZ 2.86Å; E598-R685 IonicContact OE2-NH1 3.88Å; E598-R685 IonicContact OE2-NH2 2.51Å; E598-L771 HydrophobicContact CB-CD1 4.23Å; E598-L771 HydrophobicContact CG-CD1 4.11Å; E598-I775 HydrophobicContact CB-CD1 3.67Å; E598-I775 HydrophobicContact CB-CG1 4.17Å
599	Y	97.9	Very high	96.9	Very high	45 Å²	45	23.5 Å²	23.5	18%	0.176	12%	0.115	C	C	.	.	H	α-helix	trans	-59.8	-52.9	173.6	-168.7	-121.7	0	0	0	111.3	Y510 L514 L517 Y595 F597 A601 Q602 H603 I775	Y510-Y599 HydrophobicContact CE2-CD1 4.35Å; Y510-Y599 WeakPolarHBondContact OH-CD1 3.42Å; L514-Y599 HydrophobicContact CD1-CD1 4Å; L514-Y599 HydrophobicContact CD1-CE1 3.52Å; L517-Y599 HydrophobicContact CB-CE1 4.12Å; L517-Y599 HydrophobicContact CD2-CD1 3.25Å; L517-Y599 HydrophobicContact CD2-CE1 3.53Å; L517-Y599 HydrophobicContact CD2-CG 4.28Å; L517-Y599 HydrophobicContact CG-CE1 4.45Å; Y595-Y599 VanDerWaalsContact O-CB 3.29Å; Y595-Y599 WeakPolarHBondContact O-CB 3.42Å; Y595-Y599 PolarHBondContact O-N 2.8Å; F597-Y599 VanDerWaalsContact C-N 3.33Å; F597-Y599 PolarHBondContact O-N 3.28Å; Y599-A601 VanDerWaalsContact C-N 3.34Å; Y599-A601 PolarHBondContact O-N 3.28Å; Y599-Q602 PolarHBondContact O-N 3.31Å; Y599-H603 AromaticContact CD2-NE2 3.65Å; Y599-H603 AromaticContact CE1-CD2 3.93Å; Y599-H603 AromaticContact CE1-NE2 3.73Å; Y599-H603 AromaticContact CE2-CD2 3.94Å; Y599-H603 AromaticContact CE2-NE2 3.15Å; Y599-H603 WeakPolarHBondContact CE2-NE2 3.01Å; Y599-H603 AromaticContact CZ-CD2 3.86Å; Y599-H603 AromaticContact CZ-NE2 3.17Å; Y599-H603 PolarHBondContact O-CD2 2.95Å; Y599-H603 PolarHBondContact O-N 3.38Å; Y599-H603 PolarHBondContact OH-NE2 3.45Å; Y599-I775 HydrophobicContact CD2-CG2 3.39Å; Y599-I775 HydrophobicContact CE2-CG2 4.36Å; Y599-I775 HydrophobicContact CG-CG2 3.81Å
600	M	98.1	Very high	96.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.8	-43.6	175.4	-173.7	-165.9	175.7	0	0	111.8	L517 M521 L582 L585 L586 F589 Q596 F597 H603 L604	L517-M600 HydrophobicContact CD2-CB 4.12Å; M521-M600 HydrophobicContact CE-CE 3.99Å; M521-M600 HydrophobicContact CG-CG 4.42Å; M521-M600 HydrophobicContact SD-CE 3.42Å; M521-M600 WeakPolarHBondContact SD-CE 3.15Å; M521-M600 HydrophobicContact SD-CG 3.76Å; M521-M600 HydrophobicContact SD-SD 4.44Å; L582-M600 HydrophobicContact CD2-CE 3.85Å; L585-M600 HydrophobicContact CB-CE 3.63Å; L585-M600 HydrophobicContact CB-SD 3.74Å; L585-M600 HydrophobicContact CD1-CE 3.98Å; L585-M600 HydrophobicContact CG-CE 4.47Å; L586-M600 HydrophobicContact CD2-CB 4.47Å; L586-M600 HydrophobicContact CD2-CE 4.31Å; L586-M600 HydrophobicContact CD2-CG 4.18Å; L586-M600 HydrophobicContact CD2-SD 3.66Å; L586-M600 HydrophobicContact CG-CE 4.01Å; L586-M600 HydrophobicContact CG-SD 3.83Å; F589-M600 HydrophobicContact CD2-SD 3.92Å; F589-M600 HydrophobicContact CE2-SD 4.21Å; Q596-M600 PolarHBondContact O-N 3.3Å; F597-M600 PolarHBondContact O-N 3.49Å; M600-H603 PolarHBondContact O-N 2.94Å; M600-L604 HydrophobicContact CE-CD1 4.23Å; M600-L604 HydrophobicContact CG-CD1 4.49Å; M600-L604 WeakPolarHBondContact O-CG 3.42Å; M600-L604 PolarHBondContact O-N 3Å
601	A	98.1	Very high	96.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.2	-39.6	-178.7	0	0	0	0	0	112.7	L586 F597 E598 Y599 L604 V605 L678	L586-A601 HydrophobicContact CD2-CB 4.3Å; F597-A601 HydrophobicContact CE1-CB 4.45Å; F597-A601 HydrophobicContact CE2-CB 4.49Å; F597-A601 HydrophobicContact CZ-CB 4.27Å; F597-A601 VanDerWaalsContact O-CB 3.22Å; F597-A601 WeakPolarHBondContact O-CB 3.35Å; F597-A601 PolarHBondContact O-N 3.15Å; E598-A601 PolarHBondContact O-N 3.34Å; Y599-A601 VanDerWaalsContact C-N 3.34Å; Y599-A601 PolarHBondContact O-N 3.28Å; A601-L604 PolarHBondContact O-N 3.45Å; A601-V605 VanDerWaalsContact O-CG2 3.29Å; A601-V605 WeakPolarHBondContact O-CG2 3.39Å; A601-V605 PolarHBondContact O-N 2.73Å; A601-L678 HydrophobicContact CB-CD2 3.7Å
602	Q	95.3	Very high	96.7	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.019	11%	0.109	C	C	.	.	H	α-helix	trans	-62.2	-46.6	175.4	-83.1	-170.7	-26.1	0	0	111.2	E598 Y599 L604 V605 F606 E768 I775	E598-Q602 WeakPolarHBondContact O-CB 3.37Å; E598-Q602 WeakPolarHBondContact O-CG 3.41Å; E598-Q602 PolarHBondContact O-N 2.92Å; Y599-Q602 PolarHBondContact O-N 3.31Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 2.92Å; Q602-V605 PolarHBondContact O-N 2.83Å; Q602-V605 VanDerWaalsContact O-N 3.1Å; Q602-F606 HydrophobicContact CB-CD2 4.45Å; Q602-F606 HydrophobicContact CB-CE2 3.86Å; Q602-F606 HydrophobicContact CB-CZ 4.24Å; Q602-F606 HydrophobicContact CG-CE2 4.48Å; Q602-F606 HydrophobicContact CG-CZ 4.44Å; Q602-F606 VanDerWaalsContact O-CD2 3.28Å; Q602-F606 WeakPolarHBondContact O-CD2 3.31Å; Q602-F606 VanDerWaalsContact O-CG 3.31Å; Q602-F606 WeakPolarHBondContact O-CG 3.46Å; Q602-F606 PolarHBondContact O-N 2.78Å; Q602-E768 PolarHBondContact NE2-O 3.41Å; Q602-E768 PolarHBondContact NE2-OE2 3.25Å; Q602-I775 HydrophobicContact CG-CD1 4.45Å; Q602-I775 VanDerWaalsContact OE1-CD1 3.31Å
603	H	96.8	Very high	96.7	Very high	38 Å²	38	20.4 Å²	20.4	18%	0.176	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-37.8	177.6	-71.6	-51.8	0	0	0	113	M521 Y599 M600 V605 F606 A607	M521-H603 HydrophobicContact CB-CB 4.5Å; M521-H603 HydrophobicContact CG-CB 4.34Å; Y599-H603 AromaticContact CD2-NE2 3.65Å; Y599-H603 AromaticContact CE1-CD2 3.93Å; Y599-H603 AromaticContact CE1-NE2 3.73Å; Y599-H603 AromaticContact CE2-CD2 3.94Å; Y599-H603 AromaticContact CE2-NE2 3.15Å; Y599-H603 WeakPolarHBondContact CE2-NE2 3.01Å; Y599-H603 AromaticContact CZ-CD2 3.86Å; Y599-H603 AromaticContact CZ-NE2 3.17Å; Y599-H603 PolarHBondContact O-CD2 2.95Å; Y599-H603 PolarHBondContact O-N 3.38Å; Y599-H603 PolarHBondContact OH-NE2 3.45Å; M600-H603 PolarHBondContact O-N 2.94Å; H603-V605 PolarHBondContact O-N 3.08Å; H603-F606 PolarHBondContact O-N 3.01Å; H603-A607 WeakPolarHBondContact O-CB 3.38Å; H603-A607 PolarHBondContact O-N 3.25Å
604	L	98.1	Very high	96.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-42.8	171.6	-73.9	173.3	0	0	0	112.2	M521 L525 L582 L586 M600 A601 Q602 A607 N608 C609 L678	M521-L604 HydrophobicContact CB-CD2 4.07Å; M521-L604 HydrophobicContact CG-CD2 4.2Å; M521-L604 HydrophobicContact CG-CG 4.32Å; M521-L604 HydrophobicContact SD-CD2 3.76Å; M521-L604 HydrophobicContact SD-CG 4.02Å; L525-L604 HydrophobicContact CD1-CD2 3.91Å; L525-L604 HydrophobicContact CD2-CD2 4.24Å; L525-L604 HydrophobicContact CG-CD2 4.2Å; L582-L604 HydrophobicContact CD1-CD2 4.49Å; L582-L604 HydrophobicContact CD2-CD2 3.93Å; L586-L604 HydrophobicContact CD1-CD1 3.93Å; L586-L604 HydrophobicContact CD2-CD1 4.07Å; L586-L604 HydrophobicContact CG-CD1 4.28Å; M600-L604 HydrophobicContact CE-CD1 4.23Å; M600-L604 HydrophobicContact CG-CD1 4.49Å; M600-L604 WeakPolarHBondContact O-CG 3.42Å; M600-L604 PolarHBondContact O-N 3Å; A601-L604 PolarHBondContact O-N 3.45Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 2.92Å; L604-A607 PolarHBondContact O-N 3.48Å; L604-N608 PolarHBondContact O-N 3.41Å; L604-C609 HydrophobicContact CB-CB 4Å; L604-C609 WeakPolarHBondContact O-CB 3.2Å; L604-C609 PolarHBondContact O-N 2.85Å; L604-L678 HydrophobicContact CB-CD1 4.47Å; L604-L678 HydrophobicContact CB-CD2 4.31Å; L604-L678 HydrophobicContact CD1-CD2 4.23Å
605	V	95.3	Very high	96.6	Very high	11 Å²	11	23.9 Å²	23.9	7%	0.067	12%	0.118	C	C	.	.	H	α-helix	trans	-67.1	-45	179.5	173.8	0	0	0	0	110.9	A601 Q602 H603 A607 N608 I610 L678 M688	A601-V605 VanDerWaalsContact O-CG2 3.29Å; A601-V605 WeakPolarHBondContact O-CG2 3.39Å; A601-V605 PolarHBondContact O-N 2.73Å; Q602-V605 PolarHBondContact O-N 2.83Å; Q602-V605 VanDerWaalsContact O-N 3.1Å; H603-V605 PolarHBondContact O-N 3.08Å; V605-A607 VanDerWaalsContact C-N 3.3Å; V605-A607 PolarHBondContact O-N 3.39Å; V605-N608 PolarHBondContact O-N 3.05Å; V605-I610 HydrophobicContact CG1-CD1 4.35Å; V605-I610 HydrophobicContact CG2-CD1 4.13Å; V605-L678 HydrophobicContact CG2-CB 4.34Å; V605-L678 HydrophobicContact CG2-CD1 4.28Å; V605-L678 HydrophobicContact CG2-CD2 4.28Å; V605-M688 HydrophobicContact CG1-CE 4.13Å; V605-M688 HydrophobicContact CG1-SD 4.07Å
606	F	93.4	Very high	96.5	Very high	98 Å²	98	23.4 Å²	23.4	43%	0.43	12%	0.116	S	C	.	.	H	α-helix	trans	-64.2	-34.8	176.6	-60.8	-32.6	0	0	0	112.6	Q602 H603 N608	Q602-F606 HydrophobicContact CB-CD2 4.45Å; Q602-F606 HydrophobicContact CB-CE2 3.86Å; Q602-F606 HydrophobicContact CB-CZ 4.24Å; Q602-F606 HydrophobicContact CG-CE2 4.48Å; Q602-F606 HydrophobicContact CG-CZ 4.44Å; Q602-F606 VanDerWaalsContact O-CD2 3.28Å; Q602-F606 WeakPolarHBondContact O-CD2 3.31Å; Q602-F606 VanDerWaalsContact O-CG 3.31Å; Q602-F606 WeakPolarHBondContact O-CG 3.46Å; Q602-F606 PolarHBondContact O-N 2.78Å; H603-F606 PolarHBondContact O-N 3.01Å; F606-N608 PolarHBondContact O-N 3.49Å; F606-N608 VanDerWaalsContact O-N 3.13Å
607	A	95.4	Very high	96.4	Very high	26 Å²	26	23.4 Å²	23.4	22%	0.215	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	15.9	173.4	0	0	0	0	0	113.8	I522 L525 H603 L604 V605 C609	I522-A607 HydrophobicContact CG1-CB 3.68Å; L525-A607 HydrophobicContact CD1-CB 3.56Å; H603-A607 WeakPolarHBondContact O-CB 3.38Å; H603-A607 PolarHBondContact O-N 3.25Å; L604-A607 PolarHBondContact O-N 3.48Å; V605-A607 VanDerWaalsContact C-N 3.3Å; V605-A607 PolarHBondContact O-N 3.39Å; A607-C609 PolarHBondContact O-N 2.9Å
608	N	95.5	Very high	96.1	Very high	101 Å²	101	27.4 Å²	27.4	54%	0.54	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	32.1	175.4	-65.5	-54.5	0	0	0	114.9	L604 V605 F606 I610 P611 L612	L604-N608 PolarHBondContact O-N 3.41Å; V605-N608 PolarHBondContact O-N 3.05Å; F606-N608 PolarHBondContact O-N 3.49Å; F606-N608 VanDerWaalsContact O-N 3.13Å; N608-I610 PolarHBondContact O-N 3.44Å; N608-P611 HydrophobicContact CB-CG 3.8Å; N608-P611 VanDerWaalsContact O-CD 3.29Å; N608-P611 WeakPolarHBondContact O-CD 3.47Å; N608-P611 VanDerWaalsContact O-CG 3.31Å; N608-P611 WeakPolarHBondContact O-CG 3.32Å; N608-L612 VanDerWaalsContact O-CB 3.3Å; N608-L612 WeakPolarHBondContact O-CB 3.39Å; N608-L612 PolarHBondContact O-N 2.8Å; N608-L612 VanDerWaalsContact O-N 3.09Å
609	C	97.5	Very high	95.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-60.4	-41.8	176.7	-175.8	0	0	0	0	113	L525 L604 A607 L612 I613 L678	L525-C609 HydrophobicContact CD1-CB 3.83Å; L525-C609 HydrophobicContact CD2-CB 3.98Å; L604-C609 HydrophobicContact CB-CB 4Å; L604-C609 WeakPolarHBondContact O-CB 3.2Å; L604-C609 PolarHBondContact O-N 2.85Å; A607-C609 PolarHBondContact O-N 2.9Å; C609-L612 PolarHBondContact O-N 3.49Å; C609-I613 WeakPolarHBondContact O-CG1 3.43Å; C609-I613 PolarHBondContact O-N 3.23Å; C609-L678 HydrophobicContact CB-CD1 4.24Å
610	I	96.4	Very high	95.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.6	-59.7	179	-67.2	177.6	0	0	0	111.6	V605 N608 L612 I613 L614 L675 L678 T679 R685 M688 L689 F692	V605-I610 HydrophobicContact CG1-CD1 4.35Å; V605-I610 HydrophobicContact CG2-CD1 4.13Å; N608-I610 PolarHBondContact O-N 3.44Å; I610-L612 VanDerWaalsContact C-N 3.26Å; I610-L612 PolarHBondContact O-N 2.87Å; I610-I613 PolarHBondContact O-N 3.47Å; I610-L614 HydrophobicContact CG2-CD1 4.24Å; I610-L614 WeakPolarHBondContact O-CG 3.34Å; I610-L614 PolarHBondContact O-N 2.96Å; I610-L675 HydrophobicContact CB-CD1 4.24Å; I610-L675 HydrophobicContact CG1-CD1 3.91Å; I610-L675 HydrophobicContact CG2-CD1 4.06Å; I610-L678 HydrophobicContact CG1-CD1 4.24Å; I610-T679 HydrophobicContact CD1-CG2 4.05Å; I610-R685 HydrophobicContact CD1-CB 4.21Å; I610-M688 HydrophobicContact CD1-CE 4.44Å; I610-M688 HydrophobicContact CD1-SD 4.38Å; I610-L689 HydrophobicContact CG2-CD2 3.8Å; I610-F692 HydrophobicContact CG2-CD2 4.44Å
611	P	95.7	Very high	95.3	Very high	28 Å²	28	31.5 Å²	31.5	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-30.6	179.1	24.7	-34.6	0	0	0	112.7	N608 L614 K615 F692	N608-P611 HydrophobicContact CB-CG 3.8Å; N608-P611 VanDerWaalsContact O-CD 3.29Å; N608-P611 WeakPolarHBondContact O-CD 3.47Å; N608-P611 VanDerWaalsContact O-CG 3.31Å; N608-P611 WeakPolarHBondContact O-CG 3.32Å; P611-L614 PolarHBondContact O-N 3.14Å; P611-K615 WeakPolarHBondContact O-CB 3.33Å; P611-K615 PolarHBondContact O-N 3.01Å; P611-F692 HydrophobicContact CB-CD1 4.29Å; P611-F692 HydrophobicContact CB-CD2 4.34Å; P611-F692 HydrophobicContact CB-CE1 3.99Å; P611-F692 HydrophobicContact CB-CE2 4.05Å; P611-F692 HydrophobicContact CB-CG 4.48Å; P611-F692 HydrophobicContact CB-CZ 3.87Å; P611-F692 HydrophobicContact CG-CE2 4.14Å; P611-F692 HydrophobicContact CG-CZ 4.01Å
612	L	95.8	Very high	95	Very high	20 Å²	20	34.1 Å²	34.1	11%	0.105	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-49.3	174	177.2	60.6	0	0	0	112	L525 L528 L529 N608 C609 I610 L614 K615 F616	L525-L612 HydrophobicContact CB-CD2 4.08Å; L525-L612 HydrophobicContact CD2-CD2 3.95Å; L525-L612 WeakPolarHBondContact O-CD2 3.46Å; L528-L612 HydrophobicContact CB-CD2 4.26Å; L528-L612 HydrophobicContact CD2-CD2 3.9Å; L528-L612 HydrophobicContact CG-CD2 4.16Å; L529-L612 HydrophobicContact CB-CD1 3.74Å; L529-L612 HydrophobicContact CB-CD2 4.41Å; L529-L612 HydrophobicContact CD1-CD1 3.56Å; L529-L612 HydrophobicContact CG-CD1 4.18Å; N608-L612 VanDerWaalsContact O-CB 3.3Å; N608-L612 WeakPolarHBondContact O-CB 3.39Å; N608-L612 PolarHBondContact O-N 2.8Å; N608-L612 VanDerWaalsContact O-N 3.09Å; C609-L612 PolarHBondContact O-N 3.49Å; I610-L612 VanDerWaalsContact C-N 3.26Å; I610-L612 PolarHBondContact O-N 2.87Å; L612-L614 VanDerWaalsContact C-N 3.31Å; L612-L614 PolarHBondContact O-N 3.33Å; L612-K615 WeakPolarHBondContact O-CB 3.39Å; L612-K615 PolarHBondContact O-N 3.47Å; L612-F616 PolarHBondContact O-N 2.94Å
613	I	97.6	Very high	94.8	Very high	2 Å²	2	37 Å²	37	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-42.2	176.5	-67.8	172	0	0	0	110.2	C609 I610 K615 F616 F617 L671 I674 L675	C609-I613 WeakPolarHBondContact O-CG1 3.43Å; C609-I613 PolarHBondContact O-N 3.23Å; I610-I613 PolarHBondContact O-N 3.47Å; I613-K615 PolarHBondContact O-N 2.76Å; I613-F616 WeakPolarHBondContact O-CB 3.48Å; I613-F616 PolarHBondContact O-N 2.9Å; I613-F617 HydrophobicContact CG2-CD2 3.78Å; I613-F617 HydrophobicContact CG2-CE2 3.87Å; I613-F617 VanDerWaalsContact O-CD2 3.31Å; I613-F617 WeakPolarHBondContact O-CD2 3.33Å; I613-F617 PolarHBondContact O-N 3.49Å; I613-L671 HydrophobicContact CD1-CD2 4.44Å; I613-L671 HydrophobicContact CG1-CB 4.45Å; I613-L671 HydrophobicContact CG1-CD2 4.19Å; I613-L671 HydrophobicContact CG2-CB 4.13Å; I613-I674 HydrophobicContact CD1-CB 4.37Å; I613-I674 HydrophobicContact CD1-CG2 4.02Å; I613-L675 HydrophobicContact CD1-CB 4.29Å; I613-L675 HydrophobicContact CG2-CB 4.35Å; I613-L675 HydrophobicContact CG2-CD2 4Å
614	L	95.8	Very high	94.7	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-40.3	177	-65.5	179.7	0	0	0	112.4	I610 P611 L612 F616 F617 N618 L675 L689 F692 I697	I610-L614 HydrophobicContact CG2-CD1 4.24Å; I610-L614 WeakPolarHBondContact O-CG 3.34Å; I610-L614 PolarHBondContact O-N 2.96Å; P611-L614 PolarHBondContact O-N 3.14Å; L612-L614 VanDerWaalsContact C-N 3.31Å; L612-L614 PolarHBondContact O-N 3.33Å; L614-F616 VanDerWaalsContact C-N 3.32Å; L614-F617 CarbonylContact O-C 3.58Å; L614-F617 PolarHBondContact O-N 3.47Å; L614-N618 WeakPolarHBondContact O-CB 3.5Å; L614-N618 PolarHBondContact O-N 3.07Å; L614-L675 HydrophobicContact CD2-CD2 4.03Å; L614-L689 HydrophobicContact CD1-CD2 4.11Å; L614-L689 HydrophobicContact CD2-CD2 4.34Å; L614-F692 HydrophobicContact CD1-CB 3.6Å; L614-F692 HydrophobicContact CD1-CG 4.34Å; L614-I697 HydrophobicContact CB-CD1 4.37Å
615	K	94.1	Very high	94.4	Very high	89 Å²	89	36.1 Å²	36.1	39%	0.387	19%	0.191	S	C	.	.	H	α-helix	trans	-62.2	-40.4	173.6	-175.3	-176.4	176.8	-171.8	0	111.3	L529 P611 L612 I613 F617 N618	L529-K615 HydrophobicContact CD1-CD 4.41Å; P611-K615 WeakPolarHBondContact O-CB 3.33Å; P611-K615 PolarHBondContact O-N 3.01Å; L612-K615 WeakPolarHBondContact O-CB 3.39Å; L612-K615 PolarHBondContact O-N 3.47Å; I613-K615 PolarHBondContact O-N 2.76Å; K615-F617 VanDerWaalsContact C-N 3.33Å; K615-F617 PolarHBondContact O-N 2.98Å; K615-N618 PolarHBondContact O-N 3.38Å
616	F	95.2	Very high	94.2	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-41.6	173.8	-177.4	-83.6	0	0	0	111.8	A532 P533 V575 L612 I613 L614 N618 Q619 Y624 L671	A532-F616 HydrophobicContact CB-CD2 4.22Å; P533-F616 HydrophobicContact CG-CE2 4.35Å; V575-F616 HydrophobicContact CG1-CE2 3.77Å; V575-F616 HydrophobicContact CG1-CZ 3.96Å; V575-F616 HydrophobicContact CG2-CE2 4.26Å; L612-F616 PolarHBondContact O-N 2.94Å; I613-F616 WeakPolarHBondContact O-CB 3.48Å; I613-F616 PolarHBondContact O-N 2.9Å; L614-F616 VanDerWaalsContact C-N 3.32Å; F616-N618 VanDerWaalsContact C-N 3.31Å; F616-N618 PolarHBondContact O-N 3.25Å; F616-Q619 WeakPolarHBondContact O-CG 3.45Å; F616-Q619 PolarHBondContact O-NE2 3.46Å; F616-Y624 HydrophobicContact CE1-CD1 4.5Å; F616-Y624 AromaticContact CE1-CE1 3.97Å; F616-Y624 HydrophobicContact CE1-CE1 3.97Å; F616-Y624 HydrophobicContact CZ-CD1 4.34Å; F616-Y624 AromaticContact CZ-CE1 3.5Å; F616-Y624 HydrophobicContact CZ-CE1 3.5Å; F616-Y624 VanDerWaalsContact CZ-CE1 3.5Å; F616-Y624 AromaticContact CZ-CZ 3.67Å; F616-L671 HydrophobicContact CD1-CD1 3.64Å; F616-L671 HydrophobicContact CD2-CD1 4.24Å; F616-L671 HydrophobicContact CE1-CD1 3.7Å; F616-L671 HydrophobicContact CE2-CD1 4.28Å; F616-L671 HydrophobicContact CG-CD1 3.92Å; F616-L671 HydrophobicContact CZ-CD1 4.01Å
617	F	95.8	Very high	94.1	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-77.9	-12.8	177	-81.7	-77.5	0	0	0	114.3	I613 L614 K615 Q619 I621 C668 L671 L672 I697 A701 M709	I613-F617 HydrophobicContact CG2-CD2 3.78Å; I613-F617 HydrophobicContact CG2-CE2 3.87Å; I613-F617 VanDerWaalsContact O-CD2 3.31Å; I613-F617 WeakPolarHBondContact O-CD2 3.33Å; I613-F617 PolarHBondContact O-N 3.49Å; L614-F617 CarbonylContact O-C 3.58Å; L614-F617 PolarHBondContact O-N 3.47Å; K615-F617 VanDerWaalsContact C-N 3.33Å; K615-F617 PolarHBondContact O-N 2.98Å; F617-Q619 PolarHBondContact O-N 3.24Å; F617-I621 HydrophobicContact CB-CD1 4.4Å; F617-I621 HydrophobicContact CD1-CD1 3.65Å; F617-I621 HydrophobicContact CD1-CG1 3.99Å; F617-I621 HydrophobicContact CE1-CD1 4.28Å; F617-I621 HydrophobicContact CG-CD1 4.36Å; F617-C668 HydrophobicContact CE1-CB 4.05Å; F617-C668 HydrophobicContact CZ-CB 3.91Å; F617-C668 WeakPolarHBondContact CZ-O 3.32Å; F617-L671 HydrophobicContact CE2-CB 3.99Å; F617-L672 HydrophobicContact CE1-CD1 4.17Å; F617-L672 HydrophobicContact CE1-CD2 4.46Å; F617-L672 HydrophobicContact CE1-CG 4.22Å; F617-L672 HydrophobicContact CE2-CD2 4.01Å; F617-L672 HydrophobicContact CE2-CG 3.86Å; F617-L672 HydrophobicContact CZ-CD1 3.86Å; F617-L672 HydrophobicContact CZ-CD2 3.99Å; F617-L672 HydrophobicContact CZ-CG 3.53Å; F617-I697 HydrophobicContact CB-CG2 3.59Å; F617-A701 HydrophobicContact CD1-CB 4.26Å; F617-M709 HydrophobicContact CE1-CE 3.84Å
618	N	93.6	Very high	93.8	Very high	87 Å²	87	38.8 Å²	38.8	47%	0.465	21%	0.207	S	C	.	.	S	Bend	trans	-81.1	51.3	-178.6	-167.6	22.6	0	0	0	112.5	L614 K615 F616 I697 R700	L614-N618 WeakPolarHBondContact O-CB 3.5Å; L614-N618 PolarHBondContact O-N 3.07Å; K615-N618 PolarHBondContact O-N 3.38Å; F616-N618 VanDerWaalsContact C-N 3.31Å; F616-N618 PolarHBondContact O-N 3.25Å; N618-I697 HydrophobicContact CB-CD1 4.16Å; N618-I697 HydrophobicContact CB-CG1 4.46Å; N618-I697 HydrophobicContact CB-CG2 4.43Å; N618-R700 PolarHBondContact OD1-NH2 2.95Å
619	Q	91.4	Very high	93.6	Very high	37 Å²	37	35.1 Å²	35.1	17%	0.173	19%	0.188	C	C	.	.	S	Bend	trans	-145.5	-178.7	178.5	62.2	-178.4	-23.7	0	0	110.3	T534 F616 F617 I621	T534-Q619 HydrophobicContact CG2-CB 3.82Å; T534-Q619 HydrophobicContact CG2-CG 4.36Å; F616-Q619 WeakPolarHBondContact O-CG 3.45Å; F616-Q619 PolarHBondContact O-NE2 3.46Å; F617-Q619 PolarHBondContact O-N 3.24Å; Q619-I621 HydrophobicContact CG-CD1 3.64Å; Q619-I621 PolarHBondContact O-N 2.98Å
620	N	92.3	Very high	93.2	Very high	101 Å²	101	36.1 Å²	36.1	54%	0.54	20%	0.195	S	C	.	.			trans	-74.9	92.7	170.1	-169.3	-18.9	0	0	0	110	M622 S623 Y624	N620-M622 VanDerWaalsContact C-N 3.29Å; N620-M622 PolarHBondContact O-N 2.88Å; N620-M622 PolarHBondContact OD1-N 3.41Å; N620-S623 PolarHBondContact ND2-OG 2.8Å; N620-S623 VanDerWaalsContact ND2-OG 3.12Å; N620-S623 PolarHBondContact O-N 3.4Å; N620-S623 PolarHBondContact OD1-N 3.34Å; N620-Y624 PolarHBondContact O-N 2.88Å
621	I	93.3	Very high	93	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-33.5	-177.2	-58.7	-61.6	0	0	0	112.5	F617 Q619 Y624 I625 V704 M709	F617-I621 HydrophobicContact CB-CD1 4.4Å; F617-I621 HydrophobicContact CD1-CD1 3.65Å; F617-I621 HydrophobicContact CD1-CG1 3.99Å; F617-I621 HydrophobicContact CE1-CD1 4.28Å; F617-I621 HydrophobicContact CG-CD1 4.36Å; Q619-I621 HydrophobicContact CG-CD1 3.64Å; Q619-I621 PolarHBondContact O-N 2.98Å; I621-Y624 PolarHBondContact O-N 3.1Å; I621-I625 HydrophobicContact CG2-CG2 4.32Å; I621-I625 WeakPolarHBondContact O-CG1 3.5Å; I621-I625 WeakPolarHBondContact O-CG2 3.44Å; I621-I625 PolarHBondContact O-N 3.49Å; I621-V704 HydrophobicContact CG2-CG2 3.82Å; I621-M709 HydrophobicContact CG2-CE 3.73Å
622	M	90.9	Very high	92.6	Very high	54 Å²	54	37.9 Å²	37.9	27%	0.266	21%	0.207	S	C	.	.	H	α-helix	trans	-61.1	-48.9	174.9	-69.9	-59.3	-56.4	0	0	110.5	N620 Y624 I625 T626 K703 V704	N620-M622 VanDerWaalsContact C-N 3.29Å; N620-M622 PolarHBondContact O-N 2.88Å; N620-M622 PolarHBondContact OD1-N 3.41Å; M622-Y624 VanDerWaalsContact C-N 3.28Å; M622-Y624 PolarHBondContact O-N 3.05Å; M622-I625 HydrophobicContact CE-CD1 4.13Å; M622-I625 WeakPolarHBondContact O-CG1 3.27Å; M622-I625 PolarHBondContact O-N 3.46Å; M622-I625 HydrophobicContact SD-CD1 4.03Å; M622-T626 WeakPolarHBondContact O-CG2 3.13Å; M622-T626 PolarHBondContact O-N 2.94Å; M622-T626 PolarHBondContact O-OG1 2.9Å; M622-T626 VanDerWaalsContact O-OG1 3.07Å; M622-K703 HydrophobicContact CG-CB 4.33Å; M622-K703 HydrophobicContact SD-CB 4.47Å; M622-V704 HydrophobicContact SD-CB 4.11Å; M622-V704 HydrophobicContact SD-CG2 3.52Å; M622-V704 VanDerWaalsContact SD-CG2 3.52Å
623	S	91.7	Very high	92.3	Very high	65 Å²	65	38.9 Å²	38.9	46%	0.455	21%	0.214	S	C	.	.	H	α-helix	trans	-61.5	-36.4	177.2	-58	0	0	0	0	112.9	N620 A627	N620-S623 PolarHBondContact ND2-OG 2.8Å; N620-S623 VanDerWaalsContact ND2-OG 3.12Å; N620-S623 PolarHBondContact O-N 3.4Å; N620-S623 PolarHBondContact OD1-N 3.34Å; S623-A627 PolarHBondContact O-N 2.94Å; S623-A627 VanDerWaalsContact O-N 3.12Å
624	Y	93.4	Very high	92	Very high	19 Å²	19	40 Å²	40	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-66.3	-46	176.2	177.9	-112.4	0	0	0	111.8	P533 F616 N620 I621 M622 T626 A627 N664	P533-Y624 HydrophobicContact CB-CD2 4.4Å; P533-Y624 HydrophobicContact CB-CE2 4.5Å; P533-Y624 HydrophobicContact CG-CD2 3.64Å; P533-Y624 HydrophobicContact CG-CE2 3.4Å; F616-Y624 HydrophobicContact CE1-CD1 4.5Å; F616-Y624 AromaticContact CE1-CE1 3.97Å; F616-Y624 HydrophobicContact CE1-CE1 3.97Å; F616-Y624 HydrophobicContact CZ-CD1 4.34Å; F616-Y624 AromaticContact CZ-CE1 3.5Å; F616-Y624 HydrophobicContact CZ-CE1 3.5Å; F616-Y624 VanDerWaalsContact CZ-CE1 3.5Å; F616-Y624 AromaticContact CZ-CZ 3.67Å; N620-Y624 PolarHBondContact O-N 2.88Å; I621-Y624 PolarHBondContact O-N 3.1Å; M622-Y624 VanDerWaalsContact C-N 3.28Å; M622-Y624 PolarHBondContact O-N 3.05Å; Y624-T626 VanDerWaalsContact C-N 3.3Å; Y624-T626 PolarHBondContact O-N 3.42Å; Y624-A627 WeakPolarHBondContact O-CB 3.4Å; Y624-A627 PolarHBondContact O-N 3.49Å; Y624-N664 HydrophobicContact CD1-CB 3.96Å; Y624-N664 HydrophobicContact CE1-CB 3.53Å; Y624-N664 HydrophobicContact CE2-CB 4.37Å; Y624-N664 VanDerWaalsContact CZ-OD1 3.3Å; Y624-N664 PolarHBondContact O-ND2 3.34Å; Y624-N664 PolarHBondContact OH-OD1 3.28Å
625	I	92.8	Very high	91.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-71.8	-23	179.2	65.9	166.8	0	0	0	113	L68 I621 M622 F660 C661 L665 V704	L68-I625 HydrophobicContact CD1-CD1 3.95Å; I621-I625 HydrophobicContact CG2-CG2 4.32Å; I621-I625 WeakPolarHBondContact O-CG1 3.5Å; I621-I625 WeakPolarHBondContact O-CG2 3.44Å; I621-I625 PolarHBondContact O-N 3.49Å; M622-I625 HydrophobicContact CE-CD1 4.13Å; M622-I625 WeakPolarHBondContact O-CG1 3.27Å; M622-I625 PolarHBondContact O-N 3.46Å; M622-I625 HydrophobicContact SD-CD1 4.03Å; I625-F660 CarbonylContact O-C 3.49Å; I625-F660 WeakPolarHBondContact O-CA 3.26Å; I625-C661 PolarHBondContact O-N 3.18Å; I625-L665 HydrophobicContact CG2-CD1 4.49Å; I625-V704 HydrophobicContact CD1-CB 4.26Å; I625-V704 HydrophobicContact CD1-CG1 3.58Å; I625-V704 HydrophobicContact CD1-CG2 3.75Å
626	T	91.4	Very high	91.9	Very high	64 Å²	64	37 Å²	37	39%	0.393	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	10.3	176.1	65.6	0	0	0	0	112.8	M622 Y624 K628	M622-T626 WeakPolarHBondContact O-CG2 3.13Å; M622-T626 PolarHBondContact O-N 2.94Å; M622-T626 PolarHBondContact O-OG1 2.9Å; M622-T626 VanDerWaalsContact O-OG1 3.07Å; Y624-T626 VanDerWaalsContact C-N 3.3Å; Y624-T626 PolarHBondContact O-N 3.42Å; T626-K628 PolarHBondContact O-N 3.33Å
627	A	90.6	Very high	91.9	Very high	28 Å²	28	36.9 Å²	36.9	23%	0.231	21%	0.207	C	C	.	.			trans	-64.4	133.9	179.9	0	0	0	0	0	110.6	S623 Y624	S623-A627 PolarHBondContact O-N 2.94Å; S623-A627 VanDerWaalsContact O-N 3.12Å; Y624-A627 WeakPolarHBondContact O-CB 3.4Å; Y624-A627 PolarHBondContact O-N 3.49Å
628	K	89.6	Confident	91.7	Very high	99 Å²	99	39.6 Å²	39.6	43%	0.43	22%	0.22	S	C	.	.			trans	-103.1	87	178.7	-59.6	-162.4	-174	-164	0	109.6	T626 A654 D656	T626-K628 PolarHBondContact O-N 3.33Å; K628-A654 PolarHBondContact NZ-O 3.43Å; K628-D656 WeakPolarHBondContact CE-O 3.27Å; K628-D656 PolarHBondContact NZ-O 3.09Å
629	N	91	Very high	91.6	Very high	23 Å²	23	36.5 Å²	36.5	12%	0.123	20%	0.204	C	C	.	.			trans	-115	45.5	178.4	-64.3	-52.2	0	0	0	111	N568 R569 E572	N568-N629 HydrophobicContact CB-CB 4.19Å; N568-N629 VanDerWaalsContact CB-CG 3.47Å; N568-N629 WeakPolarHBondContact CB-OD1 2.98Å; R569-N629 HydrophobicContact CB-CB 4.22Å; R569-N629 VanDerWaalsContact CB-O 3.26Å; R569-N629 WeakPolarHBondContact CB-O 3.32Å; R569-N629 VanDerWaalsContact CD-O 3.28Å; R569-N629 WeakPolarHBondContact CD-O 3.49Å; R569-N629 VanDerWaalsContact CG-O 3.26Å; R569-N629 WeakPolarHBondContact CG-O 3.47Å; E572-N629 PolarHBondContact OE1-ND2 3Å
630	S	89.8	Confident	91.7	Very high	22 Å²	22	36.2 Å²	36.2	15%	0.154	21%	0.205	C	C	.	.			trans	-144.4	139.5	179.7	-60	0	0	0	0	109.8	R663	S630-R663 PolarHBondContact OG-NH2 3.26Å
631	I	90.6	Very high	91.7	Very high	14 Å²	14	32.9 Å²	32.9	7%	0.072	19%	0.188	C	C	.	.			trans	-120.7	88.3	-179.3	-53	168.8	0	0	0	105.8	Y88 K562 V565 V633 L634 D635 L647 L652	Y88-I631 HydrophobicContact CD2-CD1 3.84Å; Y88-I631 HydrophobicContact CD2-CG1 4.39Å; Y88-I631 HydrophobicContact CE2-CB 3.93Å; Y88-I631 HydrophobicContact CE2-CD1 3.81Å; Y88-I631 HydrophobicContact CE2-CG1 3.84Å; Y88-I631 PolarHBondContact OH-N 3.28Å; K562-I631 HydrophobicContact CG-CD1 4.18Å; V565-I631 HydrophobicContact CB-CD1 4.46Å; V565-I631 HydrophobicContact CG1-CD1 4.05Å; V565-I631 HydrophobicContact CG1-CG1 3.96Å; I631-V633 HydrophobicContact CG2-CG2 3.79Å; I631-V633 PolarHBondContact O-N 3.05Å; I631-V633 VanDerWaalsContact O-N 3.16Å; I631-L634 HydrophobicContact CB-CB 4.32Å; I631-L634 HydrophobicContact CB-CD1 4.24Å; I631-L634 HydrophobicContact CB-CG 4.33Å; I631-L634 HydrophobicContact CD1-CD1 4.05Å; I631-L634 HydrophobicContact CG2-CB 4.16Å; I631-L634 HydrophobicContact CG2-CD1 3.86Å; I631-L634 HydrophobicContact CG2-CG 3.73Å; I631-L634 WeakPolarHBondContact O-CA 3.47Å; I631-L634 PolarHBondContact O-N 2.96Å; I631-D635 PolarHBondContact O-N 3.32Å; I631-L647 HydrophobicContact CG2-CD2 4.23Å; I631-L652 HydrophobicContact CD1-CD2 3.39Å; I631-L652 HydrophobicContact CG1-CD2 3.99Å
632	S	88.3	Confident	91.4	Very high	52 Å²	52	35.8 Å²	35.8	36%	0.364	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-56.2	-34	-170.4	25.1	0	0	0	0	113.5	L634 D635 D656	S632-L634 PolarHBondContact O-N 3.25Å; S632-D635 PolarHBondContact O-N 2.99Å; S632-D656 WeakPolarHBondContact CB-OD1 3.46Å; S632-D656 PolarHBondContact OG-OD1 3.4Å
633	V	89.2	Confident	91	Very high	41 Å²	41	42.3 Å²	42.3	25%	0.248	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-65.1	-24.8	175.5	-62.1	0	0	0	0	113.8	I631 H638 C639 L644 P645 L647	I631-V633 HydrophobicContact CG2-CG2 3.79Å; I631-V633 PolarHBondContact O-N 3.05Å; I631-V633 VanDerWaalsContact O-N 3.16Å; V633-H638 PolarHBondContact O-ND1 2.98Å; V633-C639 WeakPolarHBondContact O-CB 2.96Å; V633-L644 WeakPolarHBondContact O-CD2 3.47Å; V633-P645 HydrophobicContact CB-CG 4.33Å; V633-P645 HydrophobicContact CG1-CG 4Å; V633-P645 HydrophobicContact CG2-CG 4.5Å; V633-L647 HydrophobicContact CG2-CD2 4.17Å
634	L	91.8	Very high	90.6	Very high	25 Å²	25	43.6 Å²	43.6	13%	0.131	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-95.9	-6.3	178.8	-62.5	-175.1	0	0	0	113.3	Y88 K562 I631 S632 C639 L644 L647	Y88-L634 HydrophobicContact CD1-CB 3.57Å; Y88-L634 HydrophobicContact CD1-CD1 4.26Å; Y88-L634 HydrophobicContact CE1-CB 3.71Å; Y88-L634 HydrophobicContact CG-CB 4.28Å; Y88-L634 HydrophobicContact CG-CD1 4.14Å; K562-L634 HydrophobicContact CD-CD1 4.2Å; I631-L634 HydrophobicContact CB-CB 4.32Å; I631-L634 HydrophobicContact CB-CD1 4.24Å; I631-L634 HydrophobicContact CB-CG 4.33Å; I631-L634 HydrophobicContact CD1-CD1 4.05Å; I631-L634 HydrophobicContact CG2-CB 4.16Å; I631-L634 HydrophobicContact CG2-CD1 3.86Å; I631-L634 HydrophobicContact CG2-CG 3.73Å; I631-L634 WeakPolarHBondContact O-CA 3.47Å; I631-L634 PolarHBondContact O-N 2.96Å; S632-L634 PolarHBondContact O-N 3.25Å; L634-C639 PolarHBondContact O-SG 3.4Å; L634-C639 VanDerWaalsContact O-SG 3.32Å; L634-L644 HydrophobicContact CD2-CD1 4.48Å; L634-L644 HydrophobicContact CD2-CD2 4.18Å; L634-L647 HydrophobicContact CD1-CD1 4.18Å; L634-L647 HydrophobicContact CD2-CD1 4.33Å
635	D	93.4	Very high	89.9	Confident	28 Å²	28	46.2 Å²	46.2	15%	0.15	25%	0.254	C	S	.	.	S	Bend	trans	-70.9	137.9	178.9	-73.5	-25.1	0	0	0	110.1	A83 Y88 R569 I631 S632 H638 C639	A83-D635 HydrophobicContact CB-CB 3.68Å; Y88-D635 VanDerWaalsContact CE1-OD1 3.23Å; Y88-D635 WeakPolarHBondContact CE1-OD1 3.19Å; Y88-D635 PolarHBondContact OH-OD1 3.06Å; R569-D635 IonicContact CZ-OD1 3.32Å; R569-D635 IonicContact NH2-OD1 2.88Å; R569-D635 PolarHBondContact NH2-OD1 3.47Å; I631-D635 PolarHBondContact O-N 3.32Å; S632-D635 PolarHBondContact O-N 2.99Å; D635-H638 WeakPolarHBondContact O-CA 3.29Å; D635-H638 VanDerWaalsContact O-CB 3.32Å; D635-H638 WeakPolarHBondContact O-CB 3.28Å; D635-H638 PolarHBondContact O-N 2.85Å; D635-C639 PolarHBondContact O-N 3.13Å; D635-C639 PolarHBondContact O-SG 2.94Å
636	Y	94	Very high	89.2	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.016	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	136.6	172.7	175.2	-84.5	0	0	0	109.2	L82 A83 Y86 F94 Q153 F156 M169 V640	L82-Y636 HydrophobicContact CB-CD1 4.14Å; L82-Y636 HydrophobicContact CD1-CD1 4.44Å; L82-Y636 HydrophobicContact CD1-CE1 4.08Å; A83-Y636 PolarHBondContact N-O 3.43Å; Y86-Y636 HydrophobicContact CD2-CD1 4.2Å; Y86-Y636 HydrophobicContact CD2-CG 4.11Å; Y86-Y636 AromaticContact CE2-CD1 3.91Å; Y86-Y636 HydrophobicContact CE2-CD1 3.91Å; Y86-Y636 HydrophobicContact CE2-CE1 4.35Å; Y86-Y636 HydrophobicContact CE2-CG 4.1Å; F94-Y636 HydrophobicContact CD1-CD2 4.2Å; F94-Y636 HydrophobicContact CD1-CE2 4.45Å; F94-Y636 AromaticContact CE1-CD2 3.62Å; F94-Y636 HydrophobicContact CE1-CD2 3.62Å; F94-Y636 HydrophobicContact CE1-CE2 4.14Å; F94-Y636 HydrophobicContact CE1-CG 4.2Å; F94-Y636 AromaticContact CZ-CD2 3.84Å; F94-Y636 HydrophobicContact CZ-CD2 3.84Å; F94-Y636 HydrophobicContact CZ-CG 4.14Å; Q153-Y636 VanDerWaalsContact C-OH 3.25Å; Q153-Y636 WeakPolarHBondContact CA-OH 3.38Å; Q153-Y636 HydrophobicContact CB-CE2 4.49Å; Q153-Y636 WeakPolarHBondContact CB-OH 3.39Å; Q153-Y636 PolarHBondContact O-OH 3.38Å; F156-Y636 HydrophobicContact CD1-CE2 4.17Å; M169-Y636 HydrophobicContact CE-CE1 3.92Å; M169-Y636 WeakPolarHBondContact CE-OH 3.33Å; Y636-V640 HydrophobicContact CD2-CG1 4.02Å; Y636-V640 HydrophobicContact CD2-CG2 3.77Å; Y636-V640 HydrophobicContact CE2-CG1 4.33Å; Y636-V640 HydrophobicContact CE2-CG2 3.63Å
637	P	94.3	Very high	88.8	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.013	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	cis	-90	-4.2	10.1	35.6	-37	0	0	0	115.9	W78 E162 V165 C639 V640 V641	W78-P637 HydrophobicContact CH2-CG 3.99Å; W78-P637 HydrophobicContact CZ3-CG 3.91Å; E162-P637 HydrophobicContact CB-CG 4.08Å; E162-P637 HydrophobicContact CG-CG 3.97Å; V165-P637 HydrophobicContact CB-CB 4.44Å; V165-P637 HydrophobicContact CG1-CB 4.02Å; P637-C639 VanDerWaalsContact C-N 3.27Å; P637-C639 PolarHBondContact O-N 3.3Å; P637-V640 HydrophobicContact CB-CG2 4.4Å; P637-V640 WeakPolarHBondContact O-CG2 3.3Å; P637-V640 PolarHBondContact O-N 2.76Å; P637-V640 VanDerWaalsContact O-N 3.13Å; P637-V641 PolarHBondContact O-N 2.99Å
638	H	92.5	Very high	88.5	Confident	59 Å²	59	56.1 Å²	56.1	27%	0.273	30%	0.297	S	S	.	.	H	α-helix	trans	-52.4	-44.2	-176.3	-178.2	-76.4	0	0	0	112.8	E162 V633 D635 V640 V641 N642	E162-H638 WeakPolarHBondContact OE1-CA 3.48Å; E162-H638 WeakPolarHBondContact OE1-CB 3.31Å; E162-H638 IonicContact OE1-CD2 3.49Å; E162-H638 PolarHBondContact OE1-CD2 3.44Å; E162-H638 IonicContact OE1-CG 3.12Å; V633-H638 PolarHBondContact O-ND1 2.98Å; D635-H638 WeakPolarHBondContact O-CA 3.29Å; D635-H638 VanDerWaalsContact O-CB 3.32Å; D635-H638 WeakPolarHBondContact O-CB 3.28Å; D635-H638 PolarHBondContact O-N 2.85Å; H638-V640 PolarHBondContact O-N 3.42Å; H638-V641 PolarHBondContact O-N 3.39Å; H638-N642 PolarHBondContact CD2-ND2 3.1Å; H638-N642 PolarHBondContact NE2-ND2 3.24Å; H638-N642 VanDerWaalsContact NE2-ND2 3.2Å; H638-N642 PolarHBondContact O-N 3.19Å; H638-N642 PolarHBondContact O-ND2 2.75Å
639	C	92.5	Very high	88	Confident	21 Å²	21	53.5 Å²	53.5	14%	0.142	29%	0.294	C	S	.	.	H	α-helix	trans	-69.4	-13	-175.4	66.9	0	0	0	0	115.8	V633 L634 D635 P637 L644	V633-C639 WeakPolarHBondContact O-CB 2.96Å; L634-C639 PolarHBondContact O-SG 3.4Å; L634-C639 VanDerWaalsContact O-SG 3.32Å; D635-C639 PolarHBondContact O-N 3.13Å; D635-C639 PolarHBondContact O-SG 2.94Å; P637-C639 VanDerWaalsContact C-N 3.27Å; P637-C639 PolarHBondContact O-N 3.3Å; C639-L644 HydrophobicContact CB-CD2 3.98Å
640	V	92.7	Very high	87.4	Confident	32 Å²	32	60 Å²	60	19%	0.194	32%	0.324	C	S	.	.	H	α-helix	trans	-106.4	-16	178.7	-62.2	0	0	0	0	113.3	F94 F156 Y636 P637 H638	F94-V640 HydrophobicContact CB-CG1 4.03Å; F94-V640 HydrophobicContact CD1-CG1 4.35Å; F94-V640 HydrophobicContact CD2-CG1 3.99Å; F94-V640 HydrophobicContact CG-CG1 3.89Å; F156-V640 HydrophobicContact CB-CB 4.44Å; F156-V640 HydrophobicContact CB-CG2 3.74Å; F156-V640 HydrophobicContact CD1-CB 4.5Å; F156-V640 HydrophobicContact CD1-CG2 4.14Å; F156-V640 HydrophobicContact CD2-CB 3.54Å; F156-V640 HydrophobicContact CD2-CG1 4.21Å; F156-V640 HydrophobicContact CD2-CG2 3.8Å; F156-V640 HydrophobicContact CE2-CB 3.85Å; F156-V640 HydrophobicContact CE2-CG1 4.05Å; F156-V640 HydrophobicContact CE2-CG2 4.47Å; F156-V640 HydrophobicContact CG-CB 3.91Å; F156-V640 HydrophobicContact CG-CG2 3.62Å; F156-V640 HydrophobicContact CZ-CB 4.44Å; F156-V640 HydrophobicContact CZ-CG1 4.23Å; Y636-V640 HydrophobicContact CD2-CG1 4.02Å; Y636-V640 HydrophobicContact CD2-CG2 3.77Å; Y636-V640 HydrophobicContact CE2-CG1 4.33Å; Y636-V640 HydrophobicContact CE2-CG2 3.63Å; P637-V640 HydrophobicContact CB-CG2 4.4Å; P637-V640 WeakPolarHBondContact O-CG2 3.3Å; P637-V640 PolarHBondContact O-N 2.76Å; P637-V640 VanDerWaalsContact O-N 3.13Å; H638-V640 PolarHBondContact O-N 3.42Å
641	V	91.1	Very high	86.7	Confident	31 Å²	31	61.4 Å²	61.4	19%	0.188	33%	0.334	C	S	.	.	H	α-helix	trans	-96.2	-41.6	178.8	178	0	0	0	0	111.1	E162 V165 P637 H638	E162-V641 HydrophobicContact CG-CG2 4.48Å; V165-V641 HydrophobicContact CG2-CG2 3.62Å; P637-V641 PolarHBondContact O-N 2.99Å; H638-V641 PolarHBondContact O-N 3.39Å
642	N	88.4	Confident	86.1	Confident	67 Å²	67	61.7 Å²	61.7	36%	0.358	34%	0.336	S	S	.	.	S	Bend	trans	-99.3	151.4	-173.4	-60.3	-55.6	0	0	0	111.9	H638 L644	H638-N642 PolarHBondContact CD2-ND2 3.1Å; H638-N642 PolarHBondContact NE2-ND2 3.24Å; H638-N642 VanDerWaalsContact NE2-ND2 3.2Å; H638-N642 PolarHBondContact O-N 3.19Å; H638-N642 PolarHBondContact O-ND2 2.75Å; N642-L644 PolarHBondContact O-N 3.17Å
643	E	82.1	Confident	85.3	Confident	192 Å²	192	66 Å²	66	90%	0.897	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-64.1	126.5	169.4	-69.9	-172.4	168.2	0	0	110.1
644	L	82.7	Confident	84.2	Confident	92 Å²	92	67 Å²	67	48%	0.482	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-76.1	124.7	-177.8	-69.5	174	0	0	0	110.1	V633 L634 C639 N642	V633-L644 WeakPolarHBondContact O-CD2 3.47Å; L634-L644 HydrophobicContact CD2-CD1 4.48Å; L634-L644 HydrophobicContact CD2-CD2 4.18Å; C639-L644 HydrophobicContact CB-CD2 3.98Å; N642-L644 PolarHBondContact O-N 3.17Å
645	P	79.9	Confident	82.8	Confident	74 Å²	74	66.9 Å²	66.9	48%	0.481	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-68	156.8	173.4	29.2	-33.2	0	0	0	110.7	V633 L647	V633-P645 HydrophobicContact CB-CG 4.33Å; V633-P645 HydrophobicContact CG1-CG 4Å; V633-P645 HydrophobicContact CG2-CG 4.5Å; P645-L647 PolarHBondContact O-N 3.18Å
646	E	78.4	Confident	81.5	Confident	183 Å²	183	67.8 Å²	67.8	86%	0.855	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-60.8	121.1	170.8	-72.7	-172.6	172.2	0	0	110	T648	E646-T648 PolarHBondContact O-N 2.83Å
647	L	82.1	Confident	80.2	Confident	50 Å²	50	75.3 Å²	75.3	26%	0.262	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-71.3	121.7	177.4	-74	163.5	0	0	0	109.7	L558 I631 V633 L634 P645	L558-L647 HydrophobicContact CD2-CB 4.44Å; L558-L647 VanDerWaalsContact CD2-O 3.31Å; L558-L647 WeakPolarHBondContact CD2-O 3.33Å; I631-L647 HydrophobicContact CG2-CD2 4.23Å; V633-L647 HydrophobicContact CG2-CD2 4.17Å; L634-L647 HydrophobicContact CD1-CD1 4.18Å; L634-L647 HydrophobicContact CD2-CD1 4.33Å; P645-L647 PolarHBondContact O-N 3.18Å
648	T	83.5	Confident	79.4	Confident	67 Å²	67	80.6 Å²	80.6	41%	0.411	44%	0.441	S	S	.	.			trans	-110.4	157.6	171.8	67	0	0	0	0	110.5	E646 E650 S651 L652	E646-T648 PolarHBondContact O-N 2.83Å; T648-E650 PolarHBondContact O-N 2.92Å; T648-S651 PolarHBondContact N-OG 3.46Å; T648-S651 PolarHBondContact O-N 2.51Å; T648-S651 VanDerWaalsContact O-N 3.12Å; T648-S651 PolarHBondContact O-OG 3.03Å; T648-S651 WeakPolarHBondContact OG1-CB 3.47Å; T648-S651 PolarHBondContact OG1-N 2.86Å; T648-S651 VanDerWaalsContact OG1-N 3.12Å; T648-S651 PolarHBondContact OG1-OG 3.02Å; T648-L652 PolarHBondContact O-N 3.36Å
649	A	80.3	Confident	78.9	Confident	44 Å²	44	83.2 Å²	83.2	36%	0.364	45%	0.453	S	S	.	.	H	α-helix	trans	-57.8	-38.2	175	0	0	0	0	0	111.7	L558 S651 L652 E653	L558-A649 HydrophobicContact CD1-CB 4.45Å; A649-S651 PolarHBondContact O-N 3.38Å; A649-L652 PolarHBondContact O-N 2.95Å; A649-E653 WeakPolarHBondContact O-CG 3.41Å; A649-E653 PolarHBondContact O-N 3.23Å
650	E	76.9	Confident	78.7	Confident	159 Å²	159	83.9 Å²	83.9	74%	0.743	45%	0.454	S	S	*	.	H	α-helix	trans	-63.5	-39.4	176.2	-63	177.7	-179.8	0	0	112.1	T648 L652 E653 A654	T648-E650 PolarHBondContact O-N 2.92Å; E650-L652 VanDerWaalsContact C-N 3.33Å; E650-L652 PolarHBondContact O-N 3.5Å; E650-E653 PolarHBondContact O-N 3Å; E650-A654 WeakPolarHBondContact O-CB 3.31Å; E650-A654 PolarHBondContact O-N 3.29Å
651	S	77.1	Confident	78.7	Confident	53 Å²	53	83 Å²	83	37%	0.371	45%	0.448	S	S	.	.	H	α-helix	trans	-66.2	-33.5	176.7	71.9	0	0	0	0	113	T648 A649	T648-S651 PolarHBondContact N-OG 3.46Å; T648-S651 PolarHBondContact O-N 2.51Å; T648-S651 VanDerWaalsContact O-N 3.12Å; T648-S651 PolarHBondContact O-OG 3.03Å; T648-S651 WeakPolarHBondContact OG1-CB 3.47Å; T648-S651 PolarHBondContact OG1-N 2.86Å; T648-S651 VanDerWaalsContact OG1-N 3.12Å; T648-S651 PolarHBondContact OG1-OG 3.02Å; A649-S651 PolarHBondContact O-N 3.38Å
652	L	77.6	Confident	78.8	Confident	20 Å²	20	83.1 Å²	83.1	11%	0.105	45%	0.446	C	S	.	.	H	α-helix	trans	-71.9	-35.9	175.4	-78.9	149.2	0	0	0	112.1	L558 K562 I631 T648 A649 E650	L558-L652 HydrophobicContact CD1-CD1 3.3Å; L558-L652 HydrophobicContact CG-CD1 4.18Å; K562-L652 HydrophobicContact CB-CD2 4.45Å; I631-L652 HydrophobicContact CD1-CD2 3.39Å; I631-L652 HydrophobicContact CG1-CD2 3.99Å; T648-L652 PolarHBondContact O-N 3.36Å; A649-L652 PolarHBondContact O-N 2.95Å; E650-L652 VanDerWaalsContact C-N 3.33Å; E650-L652 PolarHBondContact O-N 3.5Å
653	E	71.3	Confident	79.1	Confident	142 Å²	142	81 Å²	81	66%	0.664	43%	0.432	S	S	*	.	H	α-helix	trans	-80.2	-32.1	-180	-71.7	-178	-176.4	0	0	113.1	M561 A649 E650 G655	M561-E653 HydrophobicContact CE-CG 4.18Å; A649-E653 WeakPolarHBondContact O-CG 3.41Å; A649-E653 PolarHBondContact O-N 3.23Å; E650-E653 PolarHBondContact O-N 3Å; E653-G655 VanDerWaalsContact C-N 3.29Å; E653-G655 PolarHBondContact O-N 3.15Å
654	A	65.9	Low	79.7	Confident	63 Å²	63	71.8 Å²	71.8	52%	0.521	39%	0.39	S	S	.	.	H	α-helix	trans	-58.7	-42.6	178.6	0	0	0	0	0	111.4	K628 E650	K628-A654 PolarHBondContact NZ-O 3.43Å; E650-A654 WeakPolarHBondContact O-CB 3.31Å; E650-A654 PolarHBondContact O-N 3.29Å
655	G	62.3	Low	80.3	Confident	22 Å²	22	67.4 Å²	67.4	23%	0.227	37%	0.367	C	S	.	.			trans	52.1	-174	-178	0	0	0	0	0	113.8	E653	E653-G655 VanDerWaalsContact C-N 3.29Å; E653-G655 PolarHBondContact O-N 3.15Å
656	D	66.3	Low	81.1	Confident	47 Å²	47	64 Å²	64	25%	0.251	35%	0.345	S	S	.	.			trans	-68.5	149.7	177.6	-68.2	-29.5	0	0	0	112	K628 S632 N658	K628-D656 WeakPolarHBondContact CE-O 3.27Å; K628-D656 PolarHBondContact NZ-O 3.09Å; S632-D656 WeakPolarHBondContact CB-OD1 3.46Å; S632-D656 PolarHBondContact OG-OD1 3.4Å; D656-N658 HydrophobicContact CB-CB 4.35Å; D656-N658 PolarHBondContact O-N 3.22Å; D656-N658 VanDerWaalsContact O-N 3.07Å
657	N	66.9	Low	82	Confident	162 Å²	162	55.3 Å²	55.3	87%	0.866	30%	0.304	S	S	*	.			trans	-73	11.7	173.6	-79.4	-27.4	0	0	0	113.6
658	N	77.1	Confident	82.7	Confident	113 Å²	113	53 Å²	53	60%	0.604	29%	0.291	S	S	*	.			trans	-68.9	136	179.5	-70.7	-22.5	0	0	0	111.1	D656 F660	D656-N658 HydrophobicContact CB-CB 4.35Å; D656-N658 PolarHBondContact O-N 3.22Å; D656-N658 VanDerWaalsContact O-N 3.07Å; N658-F660 PolarHBondContact O-N 2.97Å
659	Q	81.8	Confident	83.4	Confident	113 Å²	113	49.8 Å²	49.8	53%	0.528	27%	0.272	S	S	.	.	S	Bend	trans	-68.2	-22.4	178.7	-64.1	-179.1	24.4	0	0	112.5	L68	L68-Q659 HydrophobicContact CD2-CB 4.44Å
660	F	88.5	Confident	84.2	Confident	36 Å²	36	47.7 Å²	47.7	16%	0.158	26%	0.255	C	S	.	.	S	Bend	trans	-153.1	158.5	-178.2	60.5	-92.5	0	0	0	111.2	L68 E69 F70 I625 N658 L665	L68-F660 HydrophobicContact CB-CD1 4.19Å; L68-F660 HydrophobicContact CB-CE1 4.33Å; L68-F660 HydrophobicContact CD2-CD1 3.95Å; L68-F660 HydrophobicContact CG-CD1 4.44Å; E69-F660 WeakPolarHBondContact O-CZ 3.42Å; F70-F660 HydrophobicContact CB-CE1 4.31Å; F70-F660 HydrophobicContact CB-CE2 4.2Å; F70-F660 HydrophobicContact CB-CZ 3.8Å; F70-F660 HydrophobicContact CD2-CD2 4.31Å; F70-F660 AromaticContact CD2-CE2 3.54Å; F70-F660 HydrophobicContact CD2-CE2 3.54Å; F70-F660 AromaticContact CD2-CZ 3.96Å; F70-F660 HydrophobicContact CD2-CZ 3.96Å; F70-F660 HydrophobicContact CE2-CE2 4.42Å; F70-F660 HydrophobicContact CG-CE2 4.32Å; F70-F660 HydrophobicContact CG-CZ 4.39Å; I625-F660 CarbonylContact O-C 3.49Å; I625-F660 WeakPolarHBondContact O-CA 3.26Å; N658-F660 PolarHBondContact O-N 2.97Å; F660-L665 HydrophobicContact CD2-CD2 3.93Å; F660-L665 HydrophobicContact CE2-CD2 4.28Å; F660-L665 HydrophobicContact CG-CD2 4.22Å
661	C	91.8	Very high	85.2	Confident	12 Å²	12	40.2 Å²	40.2	8%	0.081	22%	0.22	C	C	.	.			trans	-86.7	116	168.3	174.1	0	0	0	0	109.4	I625 R663 N664 L665	I625-C661 PolarHBondContact O-N 3.18Å; C661-R663 PolarHBondContact O-N 2.96Å; C661-N664 HydrophobicContact CB-CB 4.14Å; C661-N664 PolarHBondContact O-N 3.38Å; C661-L665 PolarHBondContact O-N 3.07Å; C661-L665 VanDerWaalsContact O-N 3.15Å
662	W	93.6	Very high	86.3	Confident	35 Å²	35	37.7 Å²	37.7	13%	0.133	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-46.2	-177.9	-171.2	102.6	0	0	0	111.8	F70 D76 K576 N664 L665 F666	F70-W662 AromaticContact CD2-CD1 3.79Å; F70-W662 HydrophobicContact CD2-CG 4.48Å; F70-W662 AromaticContact CE2-CD1 3.38Å; F70-W662 HydrophobicContact CE2-CD2 4.16Å; F70-W662 AromaticContact CE2-CE2 3.93Å; F70-W662 AromaticContact CE2-CG 3.83Å; F70-W662 HydrophobicContact CE2-CG 3.83Å; F70-W662 AromaticContact CE2-NE1 3.4Å; D76-W662 HydrophobicContact CB-CD2 4.1Å; D76-W662 HydrophobicContact CB-CE3 4.01Å; D76-W662 HydrophobicContact CB-CH2 4.1Å; D76-W662 HydrophobicContact CB-CZ2 4.14Å; D76-W662 HydrophobicContact CB-CZ3 4.05Å; D76-W662 VanDerWaalsContact OD2-CD2 3.26Å; D76-W662 VanDerWaalsContact OD2-CG 3.3Å; K576-W662 HydrophobicContact CD-CE3 4.46Å; K576-W662 HydrophobicContact CD-CZ3 3.99Å; W662-N664 VanDerWaalsContact C-N 3.31Å; W662-N664 PolarHBondContact O-N 2.97Å; W662-L665 PolarHBondContact O-N 2.83Å; W662-F666 HydrophobicContact CD2-CB 4.37Å; W662-F666 HydrophobicContact CE3-CB 3.93Å; W662-F666 HydrophobicContact CE3-CG 4.35Å; W662-F666 HydrophobicContact CH2-CB 4.07Å; W662-F666 HydrophobicContact CH2-CD1 4.26Å; W662-F666 AromaticContact CH2-CD2 3.55Å; W662-F666 HydrophobicContact CH2-CD2 3.55Å; W662-F666 AromaticContact CH2-CE2 3.97Å; W662-F666 HydrophobicContact CH2-CE2 3.97Å; W662-F666 AromaticContact CH2-CG 3.71Å; W662-F666 HydrophobicContact CH2-CG 3.71Å; W662-F666 HydrophobicContact CH2-CZ 4.44Å; W662-F666 HydrophobicContact CZ2-CD2 4.05Å; W662-F666 HydrophobicContact CZ2-CG 4.42Å; W662-F666 HydrophobicContact CZ3-CB 3.74Å; W662-F666 AromaticContact CZ3-CD1 3.96Å; W662-F666 HydrophobicContact CZ3-CD1 3.96Å; W662-F666 HydrophobicContact CZ3-CD2 4.01Å; W662-F666 AromaticContact CZ3-CG 3.64Å; W662-F666 HydrophobicContact CZ3-CG 3.64Å; W662-F666 VanDerWaalsContact O-CB 3.23Å; W662-F666 WeakPolarHBondContact O-CB 3.39Å; W662-F666 PolarHBondContact O-N 3.48Å
663	R	94.3	Very high	87.2	Confident	21 Å²	21	37.1 Å²	37.1	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-53.5	-46.2	178.1	-63	-178.1	-73.4	-78.1	0	112.7	E84 E572 K576 S630 C661 S667	E84-R663 WeakPolarHBondContact OE1-CD 3.47Å; E84-R663 WeakPolarHBondContact OE1-CG 3.39Å; E84-R663 IonicContact OE1-NE 3.69Å; E84-R663 IonicContact OE1-NH1 3.6Å; E84-R663 PolarHBondContact OE1-NH1 3.41Å; E572-R663 IonicContact OE2-CZ 3.96Å; E572-R663 IonicContact OE2-NE 2.85Å; E572-R663 PolarHBondContact OE2-NE 2.99Å; E572-R663 VanDerWaalsContact OE2-NE 3.12Å; E572-R663 IonicContact OE2-NH2 3.46Å; E572-R663 PolarHBondContact OE2-NH2 3.43Å; K576-R663 HydrophobicContact CB-CB 4.47Å; K576-R663 HydrophobicContact CD-CB 4.11Å; K576-R663 HydrophobicContact CD-CG 3.75Å; S630-R663 PolarHBondContact OG-NH2 3.26Å; C661-R663 PolarHBondContact O-N 2.96Å; R663-S667 VanDerWaalsContact O-CB 3.22Å; R663-S667 WeakPolarHBondContact O-CB 3.4Å; R663-S667 PolarHBondContact O-N 3.41Å; R663-S667 PolarHBondContact O-OG 3.22Å
664	N	95.4	Very high	88.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-72	-41.6	-174.4	-69.3	-7.6	0	0	0	111	E572 Y624 C661 W662 C668	E572-N664 WeakPolarHBondContact CB-OD1 3.43Å; E572-N664 VanDerWaalsContact CD-ND2 3.35Å; E572-N664 WeakPolarHBondContact CG-OD1 3.45Å; E572-N664 PolarHBondContact OE1-ND2 3.31Å; Y624-N664 HydrophobicContact CD1-CB 3.96Å; Y624-N664 HydrophobicContact CE1-CB 3.53Å; Y624-N664 HydrophobicContact CE2-CB 4.37Å; Y624-N664 VanDerWaalsContact CZ-OD1 3.3Å; Y624-N664 PolarHBondContact O-ND2 3.34Å; Y624-N664 PolarHBondContact OH-OD1 3.28Å; C661-N664 HydrophobicContact CB-CB 4.14Å; C661-N664 PolarHBondContact O-N 3.38Å; W662-N664 VanDerWaalsContact C-N 3.31Å; W662-N664 PolarHBondContact O-N 2.97Å; N664-C668 WeakPolarHBondContact O-CB 3.33Å; N664-C668 PolarHBondContact O-N 3.49Å; N664-C668 PolarHBondContact O-SG 2.95Å
665	L	95.3	Very high	90.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.7	-45.1	176.5	-174.6	53.4	0	0	0	111.8	L68 F70 I625 F660 C661 W662 S667 C668 I669 V704 Q706 M709	L68-L665 HydrophobicContact CD1-CD2 4.2Å; F70-L665 HydrophobicContact CB-CD2 3.68Å; F70-L665 HydrophobicContact CD1-CD2 3.93Å; F70-L665 HydrophobicContact CD1-CG 4.2Å; F70-L665 HydrophobicContact CD2-CB 4.49Å; F70-L665 HydrophobicContact CD2-CD2 3.57Å; F70-L665 HydrophobicContact CD2-CG 4.13Å; F70-L665 HydrophobicContact CE1-CD2 4.44Å; F70-L665 HydrophobicContact CE1-CG 4.25Å; F70-L665 HydrophobicContact CE2-CB 4.27Å; F70-L665 HydrophobicContact CE2-CD2 4.11Å; F70-L665 HydrophobicContact CE2-CG 4.16Å; F70-L665 HydrophobicContact CG-CD2 3.44Å; F70-L665 VanDerWaalsContact CG-CD2 3.44Å; F70-L665 HydrophobicContact CG-CG 4.13Å; F70-L665 HydrophobicContact CZ-CG 4.24Å; I625-L665 HydrophobicContact CG2-CD1 4.49Å; F660-L665 HydrophobicContact CD2-CD2 3.93Å; F660-L665 HydrophobicContact CE2-CD2 4.28Å; F660-L665 HydrophobicContact CG-CD2 4.22Å; C661-L665 PolarHBondContact O-N 3.07Å; C661-L665 VanDerWaalsContact O-N 3.15Å; W662-L665 PolarHBondContact O-N 2.83Å; L665-S667 PolarHBondContact O-N 3.07Å; L665-C668 PolarHBondContact O-N 3.12Å; L665-I669 HydrophobicContact CD1-CD1 4.29Å; L665-I669 HydrophobicContact CG-CD1 4.24Å; L665-I669 WeakPolarHBondContact O-CG1 3.07Å; L665-I669 PolarHBondContact O-N 3.05Å; L665-V704 HydrophobicContact CD1-CG1 4.24Å; L665-Q706 HydrophobicContact CD1-CB 4.45Å; L665-Q706 HydrophobicContact CD1-CG 4.46Å; L665-Q706 HydrophobicContact CD2-CG 4.27Å; L665-M709 HydrophobicContact CD1-SD 3.94Å
666	F	96.4	Very high	91.8	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.013	14%	0.137	C	C	.	.	H	α-helix	trans	-56.7	-48.6	173.3	174.8	-99.6	0	0	0	111.7	F70 Y72 A73 W291 K576 A580 W662 C668 I669 N670	F70-F666 HydrophobicContact CZ-CB 4.23Å; Y72-F666 AromaticContact CD2-CD2 3.95Å; Y72-F666 HydrophobicContact CD2-CD2 3.95Å; Y72-F666 HydrophobicContact CD2-CE2 4.45Å; Y72-F666 AromaticContact CE2-CD2 3.51Å; Y72-F666 HydrophobicContact CE2-CD2 3.51Å; Y72-F666 AromaticContact CE2-CE2 3.74Å; Y72-F666 HydrophobicContact CE2-CE2 3.74Å; Y72-F666 HydrophobicContact CE2-CG 4.49Å; A73-F666 VanDerWaalsContact O-CE2 3.27Å; A73-F666 WeakPolarHBondContact O-CE2 3.42Å; W291-F666 HydrophobicContact CH2-CE1 4.41Å; W291-F666 HydrophobicContact CZ2-CE1 4.19Å; W291-F666 HydrophobicContact CZ2-CZ 4.02Å; K576-F666 HydrophobicContact CD-CD1 4.42Å; K576-F666 HydrophobicContact CG-CD1 3.82Å; K576-F666 HydrophobicContact CG-CE1 3.92Å; A580-F666 HydrophobicContact CB-CE1 3.97Å; A580-F666 HydrophobicContact CB-CZ 4.07Å; W662-F666 HydrophobicContact CD2-CB 4.37Å; W662-F666 HydrophobicContact CE3-CB 3.93Å; W662-F666 HydrophobicContact CE3-CG 4.35Å; W662-F666 HydrophobicContact CH2-CB 4.07Å; W662-F666 HydrophobicContact CH2-CD1 4.26Å; W662-F666 AromaticContact CH2-CD2 3.55Å; W662-F666 HydrophobicContact CH2-CD2 3.55Å; W662-F666 AromaticContact CH2-CE2 3.97Å; W662-F666 HydrophobicContact CH2-CE2 3.97Å; W662-F666 AromaticContact CH2-CG 3.71Å; W662-F666 HydrophobicContact CH2-CG 3.71Å; W662-F666 HydrophobicContact CH2-CZ 4.44Å; W662-F666 HydrophobicContact CZ2-CD2 4.05Å; W662-F666 HydrophobicContact CZ2-CG 4.42Å; W662-F666 HydrophobicContact CZ3-CB 3.74Å; W662-F666 AromaticContact CZ3-CD1 3.96Å; W662-F666 HydrophobicContact CZ3-CD1 3.96Å; W662-F666 HydrophobicContact CZ3-CD2 4.01Å; W662-F666 AromaticContact CZ3-CG 3.64Å; W662-F666 HydrophobicContact CZ3-CG 3.64Å; W662-F666 VanDerWaalsContact O-CB 3.23Å; W662-F666 WeakPolarHBondContact O-CB 3.39Å; W662-F666 PolarHBondContact O-N 3.48Å; F666-C668 PolarHBondContact O-N 3.3Å; F666-I669 PolarHBondContact O-N 3.22Å; F666-N670 WeakPolarHBondContact CD1-ND2 3.11Å; F666-N670 WeakPolarHBondContact CE1-ND2 3.29Å; F666-N670 WeakPolarHBondContact CZ-ND2 3.36Å; F666-N670 VanDerWaalsContact O-CG 3.29Å; F666-N670 PolarHBondContact O-N 2.74Å; F666-N670 PolarHBondContact O-OD1 3.39Å
667	S	97.5	Very high	93.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-46.1	176.6	-64.4	0	0	0	0	112.3	K576 R663 L665 I669 N670 L671	K576-S667 WeakPolarHBondContact CA-OG 3.17Å; K576-S667 PolarHBondContact N-OG 2.96Å; R663-S667 VanDerWaalsContact O-CB 3.22Å; R663-S667 WeakPolarHBondContact O-CB 3.4Å; R663-S667 PolarHBondContact O-N 3.41Å; R663-S667 PolarHBondContact O-OG 3.22Å; L665-S667 PolarHBondContact O-N 3.07Å; S667-I669 VanDerWaalsContact C-N 3.35Å; S667-I669 PolarHBondContact O-N 3.2Å; S667-N670 PolarHBondContact O-N 3.48Å; S667-L671 VanDerWaalsContact O-CG 3.27Å; S667-L671 WeakPolarHBondContact O-CG 3.18Å; S667-L671 PolarHBondContact O-N 3.47Å
668	C	97.6	Very high	94.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.7	-45.2	178.3	-73.2	0	0	0	0	111.5	F617 N664 L665 F666 N670 L671 L672 M709	F617-C668 HydrophobicContact CE1-CB 4.05Å; F617-C668 HydrophobicContact CZ-CB 3.91Å; F617-C668 WeakPolarHBondContact CZ-O 3.32Å; N664-C668 WeakPolarHBondContact O-CB 3.33Å; N664-C668 PolarHBondContact O-N 3.49Å; N664-C668 PolarHBondContact O-SG 2.95Å; L665-C668 PolarHBondContact O-N 3.12Å; F666-C668 PolarHBondContact O-N 3.3Å; C668-N670 VanDerWaalsContact C-N 3.35Å; C668-N670 PolarHBondContact O-N 3.47Å; C668-L671 PolarHBondContact O-N 3.35Å; C668-L672 WeakPolarHBondContact O-CB 3.15Å; C668-L672 WeakPolarHBondContact O-CD1 3.41Å; C668-L672 WeakPolarHBondContact O-CG 3.42Å; C668-L672 PolarHBondContact O-N 3.31Å; C668-M709 HydrophobicContact CB-CE 3.98Å; C668-M709 HydrophobicContact CB-SD 4.27Å
669	I	97.1	Very high	95.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-46.4	176.4	-70.1	165.6	0	0	0	110.1	F70 Y72 L665 F666 S667 L672 R673 M708 M709	F70-I669 HydrophobicContact CD1-CD1 4.06Å; F70-I669 HydrophobicContact CE1-CD1 3.44Å; F70-I669 VanDerWaalsContact CE1-CD1 3.44Å; F70-I669 HydrophobicContact CZ-CD1 4.2Å; Y72-I669 HydrophobicContact CD2-CB 4.31Å; Y72-I669 HydrophobicContact CD2-CD1 4.02Å; Y72-I669 HydrophobicContact CD2-CG2 3.81Å; Y72-I669 HydrophobicContact CE2-CB 4.07Å; Y72-I669 HydrophobicContact CE2-CG2 3.51Å; L665-I669 HydrophobicContact CD1-CD1 4.29Å; L665-I669 HydrophobicContact CG-CD1 4.24Å; L665-I669 WeakPolarHBondContact O-CG1 3.07Å; L665-I669 PolarHBondContact O-N 3.05Å; F666-I669 PolarHBondContact O-N 3.22Å; S667-I669 VanDerWaalsContact C-N 3.35Å; S667-I669 PolarHBondContact O-N 3.2Å; I669-L672 PolarHBondContact O-N 3.46Å; I669-R673 HydrophobicContact CG2-CG 4.34Å; I669-R673 WeakPolarHBondContact O-CG 3.45Å; I669-R673 PolarHBondContact O-N 2.89Å; I669-M708 HydrophobicContact CD1-CB 4.45Å; I669-M708 HydrophobicContact CG2-CG 3.92Å; I669-M708 HydrophobicContact CG2-SD 3.65Å; I669-M709 HydrophobicContact CG1-CB 3.95Å
670	N	98.3	Very high	96	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-60.7	-48.6	179.5	-71.8	-8.3	0	0	0	112.6	Y72 S579 L583 F666 S667 C668 L672 R673 I674	Y72-N670 WeakPolarHBondContact CE2-OD1 3.49Å; Y72-N670 PolarHBondContact OH-OD1 3.1Å; S579-N670 WeakPolarHBondContact OG-CB 3.33Å; S579-N670 PolarHBondContact OG-ND2 3.38Å; S579-N670 VanDerWaalsContact OG-ND2 3.13Å; L583-N670 HydrophobicContact CD2-CB 4.14Å; L583-N670 WeakPolarHBondContact CD2-OD1 3.45Å; F666-N670 WeakPolarHBondContact CD1-ND2 3.11Å; F666-N670 WeakPolarHBondContact CE1-ND2 3.29Å; F666-N670 WeakPolarHBondContact CZ-ND2 3.36Å; F666-N670 VanDerWaalsContact O-CG 3.29Å; F666-N670 PolarHBondContact O-N 2.74Å; F666-N670 PolarHBondContact O-OD1 3.39Å; S667-N670 PolarHBondContact O-N 3.48Å; C668-N670 VanDerWaalsContact C-N 3.35Å; C668-N670 PolarHBondContact O-N 3.47Å; N670-L672 VanDerWaalsContact C-N 3.32Å; N670-L672 PolarHBondContact O-N 3.28Å; N670-R673 WeakPolarHBondContact O-CA 3.5Å; N670-R673 WeakPolarHBondContact O-CB 2.96Å; N670-R673 PolarHBondContact O-N 3.33Å; N670-R673 VanDerWaalsContact O-N 3.08Å; N670-I674 WeakPolarHBondContact O-CG1 3.35Å; N670-I674 PolarHBondContact O-N 3.36Å
671	L	98.4	Very high	95.9	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-61.7	-39.6	179	-65.7	175.8	0	0	0	111.6	L528 V575 I613 F616 F617 S667 C668 I674 L675	L528-L671 HydrophobicContact CD2-CD2 4.09Å; V575-L671 HydrophobicContact CG1-CD1 4.46Å; I613-L671 HydrophobicContact CD1-CD2 4.44Å; I613-L671 HydrophobicContact CG1-CB 4.45Å; I613-L671 HydrophobicContact CG1-CD2 4.19Å; I613-L671 HydrophobicContact CG2-CB 4.13Å; F616-L671 HydrophobicContact CD1-CD1 3.64Å; F616-L671 HydrophobicContact CD2-CD1 4.24Å; F616-L671 HydrophobicContact CE1-CD1 3.7Å; F616-L671 HydrophobicContact CE2-CD1 4.28Å; F616-L671 HydrophobicContact CG-CD1 3.92Å; F616-L671 HydrophobicContact CZ-CD1 4.01Å; F617-L671 HydrophobicContact CE2-CB 3.99Å; S667-L671 VanDerWaalsContact O-CG 3.27Å; S667-L671 WeakPolarHBondContact O-CG 3.18Å; S667-L671 PolarHBondContact O-N 3.47Å; C668-L671 PolarHBondContact O-N 3.35Å; L671-I674 HydrophobicContact CD2-CD1 4.42Å; L671-I674 PolarHBondContact O-N 3.06Å; L671-L675 WeakPolarHBondContact O-CB 3.47Å; L671-L675 PolarHBondContact O-N 3.43Å
672	L	98.3	Very high	95.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.7	-36.9	173.5	-72	164.6	0	0	0	112.4	F617 C668 I669 N670 L675 N676 L698 M709 V713 L716	F617-L672 HydrophobicContact CE1-CD1 4.17Å; F617-L672 HydrophobicContact CE1-CD2 4.46Å; F617-L672 HydrophobicContact CE1-CG 4.22Å; F617-L672 HydrophobicContact CE2-CD2 4.01Å; F617-L672 HydrophobicContact CE2-CG 3.86Å; F617-L672 HydrophobicContact CZ-CD1 3.86Å; F617-L672 HydrophobicContact CZ-CD2 3.99Å; F617-L672 HydrophobicContact CZ-CG 3.53Å; C668-L672 WeakPolarHBondContact O-CB 3.15Å; C668-L672 WeakPolarHBondContact O-CD1 3.41Å; C668-L672 WeakPolarHBondContact O-CG 3.42Å; C668-L672 PolarHBondContact O-N 3.31Å; I669-L672 PolarHBondContact O-N 3.46Å; N670-L672 VanDerWaalsContact C-N 3.32Å; N670-L672 PolarHBondContact O-N 3.28Å; L672-L675 PolarHBondContact O-N 3.2Å; L672-N676 WeakPolarHBondContact O-CB 3.33Å; L672-N676 PolarHBondContact O-N 3.49Å; L672-N676 PolarHBondContact O-ND2 3.36Å; L672-L698 HydrophobicContact CD2-CD2 3.95Å; L672-M709 HydrophobicContact CD1-CE 4.22Å; L672-M709 HydrophobicContact CD1-CG 3.65Å; L672-V713 HydrophobicContact CD1-CG2 3.65Å; L672-V713 HydrophobicContact CD2-CG2 3.83Å; L672-V713 HydrophobicContact CG-CG2 4.39Å; L672-L716 HydrophobicContact CD2-CD1 3.88Å
673	R	98	Very high	95.6	Very high	9 Å²	9	20.7 Å²	20.7	3%	0.034	9%	0.088	C	C	.	.	H	α-helix	trans	-66.5	-41.9	175.6	-71.6	176.1	88.8	-161.5	9.5	111.8	Y72 F301 L583 I669 N670 N676 K677 Y712	Y72-R673 VanDerWaalsContact CZ-NH1 3.32Å; Y72-R673 PolarHBondContact OH-NH1 2.83Å; F301-R673 VanDerWaalsContact CZ-NH1 3.32Å; L583-R673 HydrophobicContact CD1-CB 3.84Å; L583-R673 HydrophobicContact CD2-CB 4.01Å; I669-R673 HydrophobicContact CG2-CG 4.34Å; I669-R673 WeakPolarHBondContact O-CG 3.45Å; I669-R673 PolarHBondContact O-N 2.89Å; N670-R673 WeakPolarHBondContact O-CA 3.5Å; N670-R673 WeakPolarHBondContact O-CB 2.96Å; N670-R673 PolarHBondContact O-N 3.33Å; N670-R673 VanDerWaalsContact O-N 3.08Å; R673-N676 PolarHBondContact O-N 3.09Å; R673-K677 WeakPolarHBondContact O-CG 3.42Å; R673-K677 PolarHBondContact O-N 2.98Å; R673-Y712 HydrophobicContact CG-CD1 4.07Å; R673-Y712 HydrophobicContact CG-CD2 3.63Å; R673-Y712 HydrophobicContact CG-CE1 3.82Å; R673-Y712 HydrophobicContact CG-CE2 3.37Å; R673-Y712 HydrophobicContact CG-CG 3.98Å; R673-Y712 VanDerWaalsContact CG-CZ 3.46Å; R673-Y712 PolarHBondContact NE-OH 2.84Å; R673-Y712 VanDerWaalsContact NE-OH 3.13Å
674	I	98.6	Very high	95.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.4	-51.7	173.2	-67.7	164	0	0	0	109.2	L582 L583 L586 I613 N670 L671 N676 K677 L678	L582-I674 HydrophobicContact CB-CD1 3.7Å; L582-I674 HydrophobicContact CD1-CD1 4.41Å; L583-I674 HydrophobicContact CB-CD1 4.28Å; L583-I674 HydrophobicContact CB-CG1 4.07Å; L583-I674 HydrophobicContact CD1-CG1 4.18Å; L586-I674 HydrophobicContact CD1-CB 4.49Å; L586-I674 HydrophobicContact CD1-CG1 4.23Å; L586-I674 HydrophobicContact CD1-CG2 3.95Å; I613-I674 HydrophobicContact CD1-CB 4.37Å; I613-I674 HydrophobicContact CD1-CG2 4.02Å; N670-I674 WeakPolarHBondContact O-CG1 3.35Å; N670-I674 PolarHBondContact O-N 3.36Å; L671-I674 HydrophobicContact CD2-CD1 4.42Å; L671-I674 PolarHBondContact O-N 3.06Å; I674-N676 VanDerWaalsContact C-N 3.28Å; I674-N676 PolarHBondContact O-N 2.9Å; I674-K677 WeakPolarHBondContact O-CA 3.48Å; I674-K677 WeakPolarHBondContact O-CB 3.36Å; I674-K677 PolarHBondContact O-N 3.12Å; I674-L678 HydrophobicContact CG2-CD1 4.08Å; I674-L678 HydrophobicContact CG2-CG 4.29Å; I674-L678 WeakPolarHBondContact O-CG 3.31Å; I674-L678 PolarHBondContact O-N 3.23Å
675	L	98.3	Very high	95.2	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.7	-38.9	-179.9	-170.1	59	0	0	0	112.7	I610 I613 L614 L671 L672 L678 T679 L689 L716	I610-L675 HydrophobicContact CB-CD1 4.24Å; I610-L675 HydrophobicContact CG1-CD1 3.91Å; I610-L675 HydrophobicContact CG2-CD1 4.06Å; I613-L675 HydrophobicContact CD1-CB 4.29Å; I613-L675 HydrophobicContact CG2-CB 4.35Å; I613-L675 HydrophobicContact CG2-CD2 4Å; L614-L675 HydrophobicContact CD2-CD2 4.03Å; L671-L675 WeakPolarHBondContact O-CB 3.47Å; L671-L675 PolarHBondContact O-N 3.43Å; L672-L675 PolarHBondContact O-N 3.2Å; L675-L678 PolarHBondContact O-N 2.99Å; L675-T679 HydrophobicContact CD1-CG2 4.42Å; L675-T679 WeakPolarHBondContact O-CG2 3.38Å; L675-T679 PolarHBondContact O-N 3.45Å; L675-T679 PolarHBondContact O-OG1 3.28Å; L675-L689 HydrophobicContact CD1-CD2 3.99Å; L675-L689 HydrophobicContact CD2-CD2 4.17Å; L675-L689 HydrophobicContact CG-CD2 4.31Å; L675-L716 HydrophobicContact CB-CD1 4.29Å; L675-L716 HydrophobicContact CB-CD2 4.46Å; L675-L716 HydrophobicContact CD2-CD1 3.78Å; L675-L716 HydrophobicContact CD2-CD2 4.32Å; L675-L716 HydrophobicContact CG-CD1 4.09Å; L675-L716 HydrophobicContact CG-CD2 3.92Å
676	N	97.8	Very high	95	Very high	21 Å²	21	21.3 Å²	21.3	11%	0.112	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-43.5	172.2	-90.6	-93.3	0	0	0	112	L672 R673 I674 L678 T679 K680 Y712 K715 L716	L672-N676 WeakPolarHBondContact O-CB 3.33Å; L672-N676 PolarHBondContact O-N 3.49Å; L672-N676 PolarHBondContact O-ND2 3.36Å; R673-N676 PolarHBondContact O-N 3.09Å; I674-N676 VanDerWaalsContact C-N 3.28Å; I674-N676 PolarHBondContact O-N 2.9Å; N676-L678 VanDerWaalsContact C-N 3.35Å; N676-T679 PolarHBondContact O-N 2.73Å; N676-K680 WeakPolarHBondContact O-CB 3.43Å; N676-K680 PolarHBondContact O-N 3.44Å; N676-Y712 HydrophobicContact CB-CD1 4.25Å; N676-Y712 PolarHBondContact ND2-O 2.91Å; N676-K715 WeakPolarHBondContact OD1-CB 3.38Å; N676-L716 WeakPolarHBondContact ND2-CD1 3.35Å; N676-L716 VanDerWaalsContact ND2-CG 3.33Å; N676-L716 WeakPolarHBondContact ND2-CG 3.29Å
677	K	97.4	Very high	94.7	Very high	44 Å²	44	22 Å²	22	19%	0.191	10%	0.099	C	C	.	.	H	α-helix	trans	-64.1	-39.6	179.1	-81.4	168.4	160.7	-80.9	0	112.2	L583 L586 K587 F597 R673 I674	L583-K677 HydrophobicContact CD1-CD 3.87Å; L586-K677 HydrophobicContact CB-CD 4.14Å; L586-K677 PolarHBondContact O-NZ 3.3Å; K587-K677 VanDerWaalsContact CG-NZ 3.3Å; F597-K677 HydrophobicContact CE2-CB 4.32Å; F597-K677 HydrophobicContact CZ-CB 4.39Å; R673-K677 WeakPolarHBondContact O-CG 3.42Å; R673-K677 PolarHBondContact O-N 2.98Å; I674-K677 WeakPolarHBondContact O-CA 3.48Å; I674-K677 WeakPolarHBondContact O-CB 3.36Å; I674-K677 PolarHBondContact O-N 3.12Å
678	L	97.1	Very high	94.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.4	-35.3	-179.8	-64	-179.2	0	0	0	112.6	A601 L604 V605 C609 I610 I674 L675 N676 R685	A601-L678 HydrophobicContact CB-CD2 3.7Å; L604-L678 HydrophobicContact CB-CD1 4.47Å; L604-L678 HydrophobicContact CB-CD2 4.31Å; L604-L678 HydrophobicContact CD1-CD2 4.23Å; V605-L678 HydrophobicContact CG2-CB 4.34Å; V605-L678 HydrophobicContact CG2-CD1 4.28Å; V605-L678 HydrophobicContact CG2-CD2 4.28Å; C609-L678 HydrophobicContact CB-CD1 4.24Å; I610-L678 HydrophobicContact CG1-CD1 4.24Å; I674-L678 HydrophobicContact CG2-CD1 4.08Å; I674-L678 HydrophobicContact CG2-CG 4.29Å; I674-L678 WeakPolarHBondContact O-CG 3.31Å; I674-L678 PolarHBondContact O-N 3.23Å; L675-L678 PolarHBondContact O-N 2.99Å; N676-L678 VanDerWaalsContact C-N 3.35Å; L678-R685 WeakPolarHBondContact O-CD 3.18Å; L678-R685 PolarHBondContact O-NH1 3.17Å
679	T	94.9	Very high	94.2	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-100.5	-19.2	-171.2	55.8	0	0	0	0	114.3	I610 L675 N676 W681 K682 R685 T686 L689	I610-T679 HydrophobicContact CD1-CG2 4.05Å; L675-T679 HydrophobicContact CD1-CG2 4.42Å; L675-T679 WeakPolarHBondContact O-CG2 3.38Å; L675-T679 PolarHBondContact O-N 3.45Å; L675-T679 PolarHBondContact O-OG1 3.28Å; N676-T679 PolarHBondContact O-N 2.73Å; T679-W681 PolarHBondContact O-N 3.29Å; T679-K682 PolarHBondContact O-N 2.91Å; T679-R685 HydrophobicContact CG2-CB 4.17Å; T679-T686 PolarHBondContact O-OG1 3.43Å; T679-L689 HydrophobicContact CG2-CD1 3.81Å; T679-L689 HydrophobicContact CG2-CD2 4.46Å; T679-L689 HydrophobicContact CG2-CG 4.01Å
680	K	92.3	Very high	93.9	Very high	126 Å²	126	25.9 Å²	25.9	55%	0.548	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	120.2	-178.3	174.2	178.7	179.9	-171.2	0	111.5	N676 K682	N676-K680 WeakPolarHBondContact O-CB 3.43Å; N676-K680 PolarHBondContact O-N 3.44Å; K680-K682 PolarHBondContact O-N 3.33Å
681	W	85.3	Confident	93.5	Very high	116 Å²	116	30.2 Å²	30.2	44%	0.439	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	23	-178.2	-56	115.1	0	0	0	114.6	T679	T679-W681 PolarHBondContact O-N 3.29Å
682	K	90.6	Very high	93.3	Very high	35 Å²	35	34.5 Å²	34.5	15%	0.152	16%	0.164	C	C	.	.			trans	-120.4	103.1	175.2	-58.2	-66.8	-178.9	177.6	0	108.3	E598 T679 K680 R685 T686	E598-K682 VanDerWaalsContact CD-NZ 3.34Å; E598-K682 WeakPolarHBondContact OE1-CE 3.35Å; E598-K682 IonicContact OE1-NZ 3.07Å; E598-K682 PolarHBondContact OE1-NZ 2.83Å; E598-K682 WeakPolarHBondContact OE2-CE 2.91Å; E598-K682 IonicContact OE2-NZ 2.77Å; E598-K682 PolarHBondContact OE2-NZ 2.86Å; T679-K682 PolarHBondContact O-N 2.91Å; K680-K682 PolarHBondContact O-N 3.33Å; K682-R685 HydrophobicContact CB-CB 3.92Å; K682-R685 HydrophobicContact CB-CG 3.94Å; K682-R685 PolarHBondContact O-N 3.18Å; K682-T686 WeakPolarHBondContact O-CB 3.44Å; K682-T686 PolarHBondContact O-N 2.7Å; K682-T686 PolarHBondContact O-OG1 3.36Å
683	H	88.9	Confident	93.1	Very high	56 Å²	56	42.3 Å²	42.3	26%	0.259	20%	0.198	S	C	.	.	H	α-helix	trans	-62.2	-49.2	-177.8	-67.4	118.4	0	0	0	111.5	R685 T686 M687 K722 Y723 F764 E767	H683-R685 VanDerWaalsContact C-N 3.34Å; H683-R685 PolarHBondContact O-N 2.7Å; H683-T686 PolarHBondContact O-N 2.93Å; H683-T686 VanDerWaalsContact O-N 3.11Å; H683-M687 WeakPolarHBondContact O-CG 3.42Å; H683-M687 PolarHBondContact O-N 3.24Å; H683-K722 PolarHBondContact CD2-NZ 2.86Å; H683-K722 PolarHBondContact NE2-NZ 2.75Å; H683-Y723 PolarHBondContact CD2-OH 2.78Å; H683-Y723 VanDerWaalsContact CD2-OH 3.28Å; H683-F764 HydrophobicContact CB-CB 4.47Å; H683-F764 HydrophobicContact CB-CD1 3.37Å; H683-F764 HydrophobicContact CB-CD2 4.02Å; H683-F764 HydrophobicContact CB-CE1 3.45Å; H683-F764 VanDerWaalsContact CB-CE1 3.45Å; H683-F764 HydrophobicContact CB-CE2 4.09Å; H683-F764 HydrophobicContact CB-CG 3.67Å; H683-F764 HydrophobicContact CB-CZ 3.82Å; H683-F764 AromaticContact CG-CE1 3.86Å; H683-E767 IonicContact ND1-OE2 3.42Å
684	S	88.4	Confident	93	Very high	25 Å²	25	41.9 Å²	41.9	18%	0.175	20%	0.197	C	C	.	.	H	α-helix	trans	-49.7	-52.3	174.7	-177	0	0	0	0	112.3	T686 M687 M688	S684-T686 PolarHBondContact O-N 3.29Å; S684-M687 WeakPolarHBondContact O-CB 3.41Å; S684-M687 PolarHBondContact O-N 3Å; S684-M688 WeakPolarHBondContact O-CG 3.46Å; S684-M688 PolarHBondContact O-N 2.9Å
685	R	92.6	Very high	92.8	Very high	2 Å²	2	42 Å²	42	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-71.2	-29.2	-177.9	-55.6	175	-165.9	-179.4	0.9	113	E598 I610 L678 T679 K682 H683 M688 L689 E768	E598-R685 IonicContact OE2-NH1 3.88Å; E598-R685 IonicContact OE2-NH2 2.51Å; I610-R685 HydrophobicContact CD1-CB 4.21Å; L678-R685 WeakPolarHBondContact O-CD 3.18Å; L678-R685 PolarHBondContact O-NH1 3.17Å; T679-R685 HydrophobicContact CG2-CB 4.17Å; K682-R685 HydrophobicContact CB-CB 3.92Å; K682-R685 HydrophobicContact CB-CG 3.94Å; K682-R685 PolarHBondContact O-N 3.18Å; H683-R685 VanDerWaalsContact C-N 3.34Å; H683-R685 PolarHBondContact O-N 2.7Å; R685-M688 WeakPolarHBondContact O-CB 3.44Å; R685-M688 PolarHBondContact O-N 2.95Å; R685-L689 PolarHBondContact O-N 2.9Å; R685-E768 IonicContact CZ-OE1 3.91Å; R685-E768 IonicContact CZ-OE2 3.15Å; R685-E768 IonicContact NE-OE1 3.97Å; R685-E768 PolarHBondContact NE-OE1 2.66Å; R685-E768 IonicContact NE-OE2 3.92Å; R685-E768 IonicContact NH2-OE1 3.83Å; R685-E768 PolarHBondContact NH2-OE1 2.83Å; R685-E768 IonicContact NH2-OE2 3.29Å; R685-E768 PolarHBondContact NH2-OE2 3.16Å
686	T	92.3	Very high	92.7	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-70.2	-39.3	171.6	-55.8	0	0	0	0	110.8	T679 K682 H683 S684 M688 L689 V690 V719 Q720 Y723	T679-T686 PolarHBondContact O-OG1 3.43Å; K682-T686 WeakPolarHBondContact O-CB 3.44Å; K682-T686 PolarHBondContact O-N 2.7Å; K682-T686 PolarHBondContact O-OG1 3.36Å; H683-T686 PolarHBondContact O-N 2.93Å; H683-T686 VanDerWaalsContact O-N 3.11Å; S684-T686 PolarHBondContact O-N 3.29Å; T686-M688 VanDerWaalsContact C-N 3.3Å; T686-M688 PolarHBondContact O-N 3.27Å; T686-L689 VanDerWaalsContact O-CB 3.28Å; T686-L689 WeakPolarHBondContact O-CB 3.3Å; T686-L689 PolarHBondContact O-N 2.89Å; T686-L689 VanDerWaalsContact O-N 3.09Å; T686-V690 PolarHBondContact O-N 3.21Å; T686-V719 HydrophobicContact CG2-CB 4.03Å; T686-V719 HydrophobicContact CG2-CG2 3.89Å; T686-V719 WeakPolarHBondContact CG2-O 3.38Å; T686-Q720 HydrophobicContact CG2-CG 4.26Å; T686-Y723 HydrophobicContact CG2-CD2 4.04Å; T686-Y723 HydrophobicContact CG2-CE2 3.69Å
687	M	88.9	Confident	92.6	Very high	19 Å²	19	45.8 Å²	45.8	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-36.6	173.2	-73.6	-61.3	-96.8	0	0	111.9	H683 S684 L689 V690 V691 Y723 A759 F764	H683-M687 WeakPolarHBondContact O-CG 3.42Å; H683-M687 PolarHBondContact O-N 3.24Å; S684-M687 WeakPolarHBondContact O-CB 3.41Å; S684-M687 PolarHBondContact O-N 3Å; M687-L689 VanDerWaalsContact C-N 3.28Å; M687-L689 PolarHBondContact O-N 2.99Å; M687-V690 WeakPolarHBondContact O-CB 3.41Å; M687-V690 PolarHBondContact O-N 3.41Å; M687-V691 WeakPolarHBondContact O-CG2 3.39Å; M687-V691 PolarHBondContact O-N 3.38Å; M687-Y723 HydrophobicContact CE-CD1 3.96Å; M687-Y723 HydrophobicContact CE-CE1 4.2Å; M687-Y723 HydrophobicContact CE-CG 4.48Å; M687-Y723 HydrophobicContact CG-CE1 4.16Å; M687-Y723 HydrophobicContact CG-CE2 4.22Å; M687-Y723 HydrophobicContact SD-CD1 3.25Å; M687-Y723 WeakPolarHBondContact SD-CD1 3.31Å; M687-Y723 HydrophobicContact SD-CD2 3.66Å; M687-Y723 HydrophobicContact SD-CE1 3.44Å; M687-Y723 WeakPolarHBondContact SD-CE1 3.43Å; M687-Y723 HydrophobicContact SD-CE2 3.82Å; M687-Y723 HydrophobicContact SD-CG 3.35Å; M687-A759 HydrophobicContact CE-CB 4.03Å; M687-A759 WeakPolarHBondContact CE-O 3.41Å; M687-F764 HydrophobicContact CG-CD2 4.46Å; M687-F764 HydrophobicContact CG-CE2 4.19Å
688	M	90.8	Very high	92.6	Very high	48 Å²	48	43.7 Å²	43.7	24%	0.236	21%	0.213	C	C	.	.	H	α-helix	trans	-55.5	-41.8	170.5	-65.6	173.7	70.1	0	0	112.1	V605 I610 S684 R685 T686 V690 V691 F692	V605-M688 HydrophobicContact CG1-CE 4.13Å; V605-M688 HydrophobicContact CG1-SD 4.07Å; I610-M688 HydrophobicContact CD1-CE 4.44Å; I610-M688 HydrophobicContact CD1-SD 4.38Å; S684-M688 WeakPolarHBondContact O-CG 3.46Å; S684-M688 PolarHBondContact O-N 2.9Å; R685-M688 WeakPolarHBondContact O-CB 3.44Å; R685-M688 PolarHBondContact O-N 2.95Å; T686-M688 VanDerWaalsContact C-N 3.3Å; T686-M688 PolarHBondContact O-N 3.27Å; M688-V690 VanDerWaalsContact C-N 3.28Å; M688-V690 PolarHBondContact O-N 3.31Å; M688-V691 PolarHBondContact O-N 3.37Å; M688-F692 HydrophobicContact CB-CD2 4.37Å; M688-F692 HydrophobicContact CB-CE2 4.38Å; M688-F692 HydrophobicContact CE-CE2 4.19Å; M688-F692 WeakPolarHBondContact O-CB 3.39Å; M688-F692 WeakPolarHBondContact O-CD2 3.29Å; M688-F692 PolarHBondContact O-N 3.4Å
689	L	93.6	Very high	92.4	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-38.6	175.8	-69.1	177.7	0	0	0	112.6	I610 L614 L675 T679 R685 T686 M687 K693 S694 L716 Q720	I610-L689 HydrophobicContact CG2-CD2 3.8Å; L614-L689 HydrophobicContact CD1-CD2 4.11Å; L614-L689 HydrophobicContact CD2-CD2 4.34Å; L675-L689 HydrophobicContact CD1-CD2 3.99Å; L675-L689 HydrophobicContact CD2-CD2 4.17Å; L675-L689 HydrophobicContact CG-CD2 4.31Å; T679-L689 HydrophobicContact CG2-CD1 3.81Å; T679-L689 HydrophobicContact CG2-CD2 4.46Å; T679-L689 HydrophobicContact CG2-CG 4.01Å; R685-L689 PolarHBondContact O-N 2.9Å; T686-L689 VanDerWaalsContact O-CB 3.28Å; T686-L689 WeakPolarHBondContact O-CB 3.3Å; T686-L689 PolarHBondContact O-N 2.89Å; T686-L689 VanDerWaalsContact O-N 3.09Å; M687-L689 VanDerWaalsContact C-N 3.28Å; M687-L689 PolarHBondContact O-N 2.99Å; L689-K693 PolarHBondContact O-N 3.39Å; L689-S694 WeakPolarHBondContact O-CB 3.23Å; L689-S694 PolarHBondContact O-N 2.96Å; L689-S694 PolarHBondContact O-OG 3.28Å; L689-L716 HydrophobicContact CD1-CD2 4.04Å; L689-Q720 HydrophobicContact CB-CG 4.22Å; L689-Q720 HydrophobicContact CD1-CG 4.33Å
690	V	91.4	Very high	92.3	Very high	32 Å²	32	51.4 Å²	51.4	19%	0.194	24%	0.243	C	C	.	.	H	α-helix	trans	-69.7	-46.7	179.1	179.6	0	0	0	0	110	T686 M687 M688 F692 K693 Q720 Y723 L724	T686-V690 PolarHBondContact O-N 3.21Å; M687-V690 WeakPolarHBondContact O-CB 3.41Å; M687-V690 PolarHBondContact O-N 3.41Å; M688-V690 VanDerWaalsContact C-N 3.28Å; M688-V690 PolarHBondContact O-N 3.31Å; V690-F692 VanDerWaalsContact C-N 3.31Å; V690-F692 PolarHBondContact O-N 3.33Å; V690-K693 WeakPolarHBondContact O-CA 3.25Å; V690-K693 PolarHBondContact O-N 3.24Å; V690-Q720 HydrophobicContact CG2-CB 4.23Å; V690-Q720 HydrophobicContact CG2-CG 4.01Å; V690-Y723 HydrophobicContact CG2-CD2 4.09Å; V690-Y723 HydrophobicContact CG2-CG 4.31Å; V690-L724 HydrophobicContact CG1-CD2 4.34Å
691	V	89.9	Confident	92.4	Very high	93 Å²	93	45.4 Å²	45.4	56%	0.564	22%	0.217	S	C	*	.	H	α-helix	trans	-58.3	-42.1	176.3	171.7	0	0	0	0	111.2	M687 M688 K693	M687-V691 WeakPolarHBondContact O-CG2 3.39Å; M687-V691 PolarHBondContact O-N 3.38Å; M688-V691 PolarHBondContact O-N 3.37Å; V691-K693 PolarHBondContact O-N 2.99Å; V691-K693 VanDerWaalsContact O-N 3.16Å
692	F	93.1	Very high	92.8	Very high	91 Å²	91	40.2 Å²	40.2	40%	0.399	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	9.3	174.9	-71.6	-59.1	0	0	0	114.3	I610 P611 L614 M688 V690 S694	I610-F692 HydrophobicContact CG2-CD2 4.44Å; P611-F692 HydrophobicContact CB-CD1 4.29Å; P611-F692 HydrophobicContact CB-CD2 4.34Å; P611-F692 HydrophobicContact CB-CE1 3.99Å; P611-F692 HydrophobicContact CB-CE2 4.05Å; P611-F692 HydrophobicContact CB-CG 4.48Å; P611-F692 HydrophobicContact CB-CZ 3.87Å; P611-F692 HydrophobicContact CG-CE2 4.14Å; P611-F692 HydrophobicContact CG-CZ 4.01Å; L614-F692 HydrophobicContact CD1-CB 3.6Å; L614-F692 HydrophobicContact CD1-CG 4.34Å; M688-F692 HydrophobicContact CB-CD2 4.37Å; M688-F692 HydrophobicContact CB-CE2 4.38Å; M688-F692 HydrophobicContact CE-CE2 4.19Å; M688-F692 WeakPolarHBondContact O-CB 3.39Å; M688-F692 WeakPolarHBondContact O-CD2 3.29Å; M688-F692 PolarHBondContact O-N 3.4Å; V690-F692 VanDerWaalsContact C-N 3.31Å; V690-F692 PolarHBondContact O-N 3.33Å; F692-S694 VanDerWaalsContact C-N 3.26Å; F692-S694 PolarHBondContact O-N 3.48Å
693	K	94.4	Very high	92.7	Very high	164 Å²	164	42.8 Å²	42.8	71%	0.713	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	46.2	179.6	-59	-178	179.7	177.5	0	111.8	L689 V690 V691 A695 P696	L689-K693 PolarHBondContact O-N 3.39Å; V690-K693 WeakPolarHBondContact O-CA 3.25Å; V690-K693 PolarHBondContact O-N 3.24Å; V691-K693 PolarHBondContact O-N 2.99Å; V691-K693 VanDerWaalsContact O-N 3.16Å; K693-A695 VanDerWaalsContact C-N 3.33Å; K693-A695 PolarHBondContact O-N 2.96Å; K693-P696 WeakPolarHBondContact O-CD 3.3Å
694	S	96.2	Very high	92.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.9	-26.7	-174.4	81.4	0	0	0	0	113.8	L689 F692 I697 L698 Q720	L689-S694 WeakPolarHBondContact O-CB 3.23Å; L689-S694 PolarHBondContact O-N 2.96Å; L689-S694 PolarHBondContact O-OG 3.28Å; F692-S694 VanDerWaalsContact C-N 3.26Å; F692-S694 PolarHBondContact O-N 3.48Å; S694-I697 WeakPolarHBondContact O-CB 3.38Å; S694-I697 PolarHBondContact O-N 2.96Å; S694-L698 WeakPolarHBondContact O-CB 3.42Å; S694-L698 WeakPolarHBondContact O-CG 3.2Å; S694-L698 PolarHBondContact O-N 3.14Å; S694-Q720 PolarHBondContact OG-NE2 2.75Å; S694-Q720 PolarHBondContact OG-OE1 3.4Å
695	A	95.4	Very high	92.7	Very high	3 Å²	3	40.1 Å²	40.1	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-58.1	-46.4	-173.3	0	0	0	0	0	114.1	K693 I697 L698 K699 L717 L724 W728	K693-A695 VanDerWaalsContact C-N 3.33Å; K693-A695 PolarHBondContact O-N 2.96Å; A695-I697 VanDerWaalsContact C-N 3.35Å; A695-I697 PolarHBondContact O-N 3.42Å; A695-L698 PolarHBondContact O-N 2.8Å; A695-K699 VanDerWaalsContact O-CB 3.29Å; A695-K699 WeakPolarHBondContact O-CB 3.22Å; A695-K699 PolarHBondContact O-N 3.25Å; A695-L717 HydrophobicContact CB-CD2 4Å; A695-L724 HydrophobicContact CB-CD1 3.88Å; A695-L724 HydrophobicContact CB-CD2 4.33Å; A695-W728 HydrophobicContact CB-CZ2 4.15Å
696	P	95.2	Very high	92.6	Very high	81 Å²	81	40.8 Å²	40.8	53%	0.526	20%	0.197	S	C	.	.	H	α-helix	trans	-59.3	-39.5	171.4	-26.2	33.8	0	0	0	114.3	K693 K699 R700	K693-P696 WeakPolarHBondContact O-CD 3.3Å; P696-K699 PolarHBondContact O-N 3.27Å; P696-R700 WeakPolarHBondContact O-CG 3.44Å; P696-R700 PolarHBondContact O-N 3.17Å; P696-R700 VanDerWaalsContact O-N 3.15Å
697	I	95.8	Very high	92.5	Very high	18 Å²	18	41.3 Å²	41.3	9%	0.092	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-51.3	179.6	-59.1	171.6	0	0	0	109.5	L614 F617 N618 S694 A695 K699 R700 A701	L614-I697 HydrophobicContact CB-CD1 4.37Å; F617-I697 HydrophobicContact CB-CG2 3.59Å; N618-I697 HydrophobicContact CB-CD1 4.16Å; N618-I697 HydrophobicContact CB-CG1 4.46Å; N618-I697 HydrophobicContact CB-CG2 4.43Å; S694-I697 WeakPolarHBondContact O-CB 3.38Å; S694-I697 PolarHBondContact O-N 2.96Å; A695-I697 VanDerWaalsContact C-N 3.35Å; A695-I697 PolarHBondContact O-N 3.42Å; I697-K699 PolarHBondContact O-N 2.92Å; I697-R700 PolarHBondContact O-N 3.37Å; I697-A701 PolarHBondContact O-N 2.93Å
698	L	96.8	Very high	92.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-41.5	178	-70.2	174.5	0	0	0	112	L672 S694 A695 R700 A701 L702 V713 L716 L717	L672-L698 HydrophobicContact CD2-CD2 3.95Å; S694-L698 WeakPolarHBondContact O-CB 3.42Å; S694-L698 WeakPolarHBondContact O-CG 3.2Å; S694-L698 PolarHBondContact O-N 3.14Å; A695-L698 PolarHBondContact O-N 2.8Å; L698-R700 VanDerWaalsContact C-N 3.28Å; L698-R700 PolarHBondContact O-N 3.12Å; L698-A701 WeakPolarHBondContact O-CB 3.4Å; L698-A701 PolarHBondContact O-N 3.16Å; L698-L702 PolarHBondContact O-N 3.24Å; L698-V713 HydrophobicContact CB-CG1 3.98Å; L698-V713 HydrophobicContact CD2-CG1 4.47Å; L698-V713 WeakPolarHBondContact O-CG1 3.47Å; L698-L716 HydrophobicContact CD1-CB 3.7Å; L698-L716 HydrophobicContact CD1-CD1 4.39Å; L698-L716 HydrophobicContact CD2-CD1 3.96Å; L698-L717 HydrophobicContact CB-CD1 4.48Å; L698-L717 HydrophobicContact CB-CD2 3.89Å; L698-L717 HydrophobicContact CB-CG 4.13Å; L698-L717 HydrophobicContact CD1-CD2 4.28Å; L698-L717 HydrophobicContact CD1-CG 4.49Å
699	K	94.2	Very high	92.7	Very high	49 Å²	49	38.4 Å²	38.4	21%	0.213	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-36.9	176.5	-173.1	-178.1	173.5	-177.3	0	112.1	P337 A695 P696 I697 L702 N732	P337-K699 HydrophobicContact CB-CG 4.48Å; P337-K699 HydrophobicContact CG-CG 3.78Å; A695-K699 VanDerWaalsContact O-CB 3.29Å; A695-K699 WeakPolarHBondContact O-CB 3.22Å; A695-K699 PolarHBondContact O-N 3.25Å; P696-K699 PolarHBondContact O-N 3.27Å; I697-K699 PolarHBondContact O-N 2.92Å; K699-L702 WeakPolarHBondContact O-CB 3.16Å; K699-L702 PolarHBondContact O-N 3.05Å; K699-N732 WeakPolarHBondContact CE-OD1 3.05Å; K699-N732 PolarHBondContact NZ-OD1 3.17Å
700	R	93.1	Very high	92.7	Very high	116 Å²	116	38.6 Å²	38.6	44%	0.438	19%	0.189	S	C	.	.	H	α-helix	trans	-66.7	-36.2	174	-71.3	-172.5	-58	-177.6	1.9	112.3	N618 P696 I697 L698 L702 K703	N618-R700 PolarHBondContact OD1-NH2 2.95Å; P696-R700 WeakPolarHBondContact O-CG 3.44Å; P696-R700 PolarHBondContact O-N 3.17Å; P696-R700 VanDerWaalsContact O-N 3.15Å; I697-R700 PolarHBondContact O-N 3.37Å; L698-R700 VanDerWaalsContact C-N 3.28Å; L698-R700 PolarHBondContact O-N 3.12Å; R700-L702 PolarHBondContact O-N 3.26Å; R700-K703 WeakPolarHBondContact O-CB 3.46Å; R700-K703 WeakPolarHBondContact O-CG 3.49Å; R700-K703 PolarHBondContact O-N 3.29Å; R700-K703 VanDerWaalsContact O-N 3.15Å
701	A	93.8	Very high	92.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-23.7	177.1	0	0	0	0	0	113.1	F617 I697 L698 K703 V704 M709 V713	F617-A701 HydrophobicContact CD1-CB 4.26Å; I697-A701 PolarHBondContact O-N 2.93Å; L698-A701 WeakPolarHBondContact O-CB 3.4Å; L698-A701 PolarHBondContact O-N 3.16Å; A701-K703 PolarHBondContact O-N 3.4Å; A701-K703 VanDerWaalsContact O-N 3.12Å; A701-V704 PolarHBondContact O-N 3.23Å; A701-M709 HydrophobicContact CB-CE 4.25Å; A701-V713 HydrophobicContact CB-CG2 4.08Å
702	L	92.8	Very high	93.2	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.031	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-13.8	173.7	-66.9	175	0	0	0	114.2	P337 L698 K699 R700 V704 Q710 V713 L714 L717 T735	P337-L702 HydrophobicContact CG-CB 4.22Å; P337-L702 HydrophobicContact CG-CD1 3.89Å; L698-L702 PolarHBondContact O-N 3.24Å; K699-L702 WeakPolarHBondContact O-CB 3.16Å; K699-L702 PolarHBondContact O-N 3.05Å; R700-L702 PolarHBondContact O-N 3.26Å; L702-V704 PolarHBondContact O-N 3.25Å; L702-Q710 HydrophobicContact CD2-CB 4.15Å; L702-Q710 HydrophobicContact CD2-CG 4.14Å; L702-Q710 PolarHBondContact O-NE2 2.93Å; L702-V713 HydrophobicContact CD1-CG1 4.43Å; L702-V713 HydrophobicContact CD2-CB 3.75Å; L702-V713 HydrophobicContact CD2-CG1 3.45Å; L702-V713 VanDerWaalsContact CD2-CG1 3.45Å; L702-V713 HydrophobicContact CG-CB 4.45Å; L702-V713 HydrophobicContact CG-CG1 3.64Å; L702-L714 HydrophobicContact CD1-CD2 4Å; L702-L714 HydrophobicContact CD2-CD2 3.93Å; L702-L714 HydrophobicContact CD2-CG 3.91Å; L702-L717 HydrophobicContact CD1-CD1 3.88Å; L702-T735 HydrophobicContact CD1-CG2 4.4Å
703	K	89.6	Confident	93.4	Very high	90 Å²	90	30 Å²	30	39%	0.391	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.6	173.7	-69.7	-174	174.4	-166.1	0	112.7	P336 M622 R700 A701 K705	P336-K703 HydrophobicContact CB-CG 4.5Å; M622-K703 HydrophobicContact CG-CB 4.33Å; M622-K703 HydrophobicContact SD-CB 4.47Å; R700-K703 WeakPolarHBondContact O-CB 3.46Å; R700-K703 WeakPolarHBondContact O-CG 3.49Å; R700-K703 PolarHBondContact O-N 3.29Å; R700-K703 VanDerWaalsContact O-N 3.15Å; A701-K703 PolarHBondContact O-N 3.4Å; A701-K703 VanDerWaalsContact O-N 3.12Å; K703-K705 PolarHBondContact O-N 3.38Å
704	V	90.1	Very high	93.5	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	11%	0.107	C	C	.	.	S	Bend	trans	-70.7	112.1	173.3	-177.8	0	0	0	0	108.5	L68 I621 M622 I625 L665 A701 L702 Q706 M709 Q710	L68-V704 HydrophobicContact CD1-CG1 4Å; I621-V704 HydrophobicContact CG2-CG2 3.82Å; M622-V704 HydrophobicContact SD-CB 4.11Å; M622-V704 HydrophobicContact SD-CG2 3.52Å; M622-V704 VanDerWaalsContact SD-CG2 3.52Å; I625-V704 HydrophobicContact CD1-CB 4.26Å; I625-V704 HydrophobicContact CD1-CG1 3.58Å; I625-V704 HydrophobicContact CD1-CG2 3.75Å; L665-V704 HydrophobicContact CD1-CG1 4.24Å; A701-V704 PolarHBondContact O-N 3.23Å; L702-V704 PolarHBondContact O-N 3.25Å; V704-Q706 HydrophobicContact CG1-CB 4.1Å; V704-Q706 PolarHBondContact O-N 3.06Å; V704-M709 HydrophobicContact CB-CE 4.23Å; V704-M709 HydrophobicContact CB-SD 3.77Å; V704-M709 HydrophobicContact CG1-SD 3.63Å; V704-M709 HydrophobicContact CG2-CE 3.91Å; V704-M709 HydrophobicContact CG2-SD 4Å; V704-Q710 VanDerWaalsContact O-CG 3.25Å; V704-Q710 WeakPolarHBondContact O-CG 3.47Å; V704-Q710 PolarHBondContact O-NE2 3.43Å
705	K	86.9	Confident	93.4	Very high	23 Å²	23	24.7 Å²	24.7	10%	0.1	12%	0.118	C	C	.	.			trans	-80.8	68.1	178.1	-68.5	-171.7	-179.6	-175.6	0	111.3	S65 L68 A333 P336 K703	S65-K705 VanDerWaalsContact O-CD 3.25Å; S65-K705 WeakPolarHBondContact O-CD 3.38Å; S65-K705 WeakPolarHBondContact O-CE 3.28Å; S65-K705 PolarHBondContact O-NZ 3.12Å; L68-K705 PolarHBondContact N-O 3.21Å; A333-K705 HydrophobicContact CB-CB 4.06Å; P336-K705 HydrophobicContact CG-CG 4.45Å; K703-K705 PolarHBondContact O-N 3.38Å
706	Q	90.3	Very high	93.5	Very high	16 Å²	16	24.6 Å²	24.6	8%	0.075	12%	0.116	C	C	.	.			trans	-132.3	124.2	172.3	-163.3	-79	-20.8	0	0	109	F70 L665 V704 M708 M709 Q710	F70-Q706 HydrophobicContact CB-CG 4.3Å; F70-Q706 HydrophobicContact CD1-CG 4.24Å; L665-Q706 HydrophobicContact CD1-CB 4.45Å; L665-Q706 HydrophobicContact CD1-CG 4.46Å; L665-Q706 HydrophobicContact CD2-CG 4.27Å; V704-Q706 HydrophobicContact CG1-CB 4.1Å; V704-Q706 PolarHBondContact O-N 3.06Å; Q706-M708 PolarHBondContact O-N 3.45Å; Q706-M709 HydrophobicContact CB-CB 4.36Å; Q706-M709 PolarHBondContact O-N 3.28Å; Q706-Q710 WeakPolarHBondContact O-CG 3.45Å; Q706-Q710 PolarHBondContact O-N 3.04Å
707	A	89.5	Confident	93.6	Very high	18 Å²	18	20.7 Å²	20.7	15%	0.149	9%	0.091	C	C	.	.	H	α-helix	trans	-62.5	-40.5	-165.6	0	0	0	0	0	113.6	M331 L711	M331-A707 HydrophobicContact CB-CB 4.28Å; M331-A707 WeakPolarHBondContact O-CB 3.43Å; A707-L711 VanDerWaalsContact O-CB 3.29Å; A707-L711 WeakPolarHBondContact O-CB 3.4Å; A707-L711 PolarHBondContact O-N 2.82Å
708	M	91.6	Very high	93.5	Very high	6 Å²	6	20.7 Å²	20.7	3%	0.03	9%	0.09	C	C	.	.	H	α-helix	trans	-67	-47.7	-179.6	-171.8	170.9	-71.9	0	0	111.6	Y72 I325 I328 I669 Q706 L711 Y712	Y72-M708 HydrophobicContact CD1-CE 3.99Å; Y72-M708 HydrophobicContact CD1-SD 3.72Å; Y72-M708 HydrophobicContact CD2-SD 4.1Å; Y72-M708 HydrophobicContact CE1-SD 4.19Å; Y72-M708 HydrophobicContact CG-CE 4.19Å; Y72-M708 HydrophobicContact CG-SD 3.65Å; I325-M708 HydrophobicContact CG2-CE 4.3Å; I328-M708 HydrophobicContact CB-CE 4.23Å; I328-M708 HydrophobicContact CD1-CE 4.43Å; I328-M708 HydrophobicContact CG2-CB 3.59Å; I328-M708 HydrophobicContact CG2-CE 3.78Å; I328-M708 HydrophobicContact CG2-CG 3.93Å; I669-M708 HydrophobicContact CD1-CB 4.45Å; I669-M708 HydrophobicContact CG2-CG 3.92Å; I669-M708 HydrophobicContact CG2-SD 3.65Å; Q706-M708 PolarHBondContact O-N 3.45Å; M708-L711 PolarHBondContact O-N 3.43Å; M708-Y712 HydrophobicContact CG-CD2 3.83Å; M708-Y712 HydrophobicContact CG-CE2 3.64Å; M708-Y712 WeakPolarHBondContact O-CD2 3.44Å; M708-Y712 PolarHBondContact O-N 2.99Å; M708-Y712 VanDerWaalsContact O-N 3.09Å; M708-Y712 HydrophobicContact SD-CE2 4.28Å
709	M	93.4	Very high	93.2	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.3	-53.2	177.6	-176.4	168.1	-179.3	0	0	110.2	F617 I621 L665 C668 I669 L672 A701 V704 Q706 L711 Y712 V713	F617-M709 HydrophobicContact CE1-CE 3.84Å; I621-M709 HydrophobicContact CG2-CE 3.73Å; L665-M709 HydrophobicContact CD1-SD 3.94Å; C668-M709 HydrophobicContact CB-CE 3.98Å; C668-M709 HydrophobicContact CB-SD 4.27Å; I669-M709 HydrophobicContact CG1-CB 3.95Å; L672-M709 HydrophobicContact CD1-CE 4.22Å; L672-M709 HydrophobicContact CD1-CG 3.65Å; A701-M709 HydrophobicContact CB-CE 4.25Å; V704-M709 HydrophobicContact CB-CE 4.23Å; V704-M709 HydrophobicContact CB-SD 3.77Å; V704-M709 HydrophobicContact CG1-SD 3.63Å; V704-M709 HydrophobicContact CG2-CE 3.91Å; V704-M709 HydrophobicContact CG2-SD 4Å; Q706-M709 HydrophobicContact CB-CB 4.36Å; Q706-M709 PolarHBondContact O-N 3.28Å; M709-L711 VanDerWaalsContact C-N 3.33Å; M709-L711 PolarHBondContact O-N 2.7Å; M709-Y712 PolarHBondContact O-N 3.16Å; M709-V713 VanDerWaalsContact O-CG2 3.32Å; M709-V713 WeakPolarHBondContact O-CG2 3.21Å; M709-V713 PolarHBondContact O-N 3.31Å
710	Q	93.9	Very high	93.1	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.019	10%	0.095	C	C	.	.	H	α-helix	trans	-60	-41.4	178.2	-72.6	-176.8	-26.4	0	0	112.1	A333 A334 L702 V704 Q706 Y712 V713 L714	A333-Q710 VanDerWaalsContact CA-OE1 3.32Å; A334-Q710 PolarHBondContact O-NE2 3.09Å; A334-Q710 PolarHBondContact O-OE1 3.11Å; L702-Q710 HydrophobicContact CD2-CB 4.15Å; L702-Q710 HydrophobicContact CD2-CG 4.14Å; L702-Q710 PolarHBondContact O-NE2 2.93Å; V704-Q710 VanDerWaalsContact O-CG 3.25Å; V704-Q710 WeakPolarHBondContact O-CG 3.47Å; V704-Q710 PolarHBondContact O-NE2 3.43Å; Q706-Q710 WeakPolarHBondContact O-CG 3.45Å; Q706-Q710 PolarHBondContact O-N 3.04Å; Q710-Y712 VanDerWaalsContact C-N 3.34Å; Q710-Y712 PolarHBondContact O-N 3Å; Q710-V713 PolarHBondContact O-N 3.48Å; Q710-L714 WeakPolarHBondContact O-CB 3.37Å; Q710-L714 WeakPolarHBondContact O-CG 3.4Å; Q710-L714 PolarHBondContact O-N 2.97Å
711	L	94.3	Very high	93	Very high	4 Å²	4	15.2 Å²	15.2	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-60.3	-43.7	178.1	-180	65.5	0	0	0	112.1	I328 W424 A707 M708 M709 L714 K715 K742 V743	I328-L711 HydrophobicContact CD1-CD2 3.53Å; I328-L711 HydrophobicContact CG1-CD2 3.46Å; I328-L711 VanDerWaalsContact CG1-CD2 3.46Å; W424-L711 HydrophobicContact CH2-CD2 3.84Å; W424-L711 HydrophobicContact CZ2-CD1 4.17Å; W424-L711 HydrophobicContact CZ2-CD2 3.72Å; A707-L711 VanDerWaalsContact O-CB 3.29Å; A707-L711 WeakPolarHBondContact O-CB 3.4Å; A707-L711 PolarHBondContact O-N 2.82Å; M708-L711 PolarHBondContact O-N 3.43Å; M709-L711 VanDerWaalsContact C-N 3.33Å; M709-L711 PolarHBondContact O-N 2.7Å; L711-L714 PolarHBondContact O-N 3.18Å; L711-K715 HydrophobicContact CG-CD 4.37Å; L711-K715 VanDerWaalsContact O-CG 3.3Å; L711-K715 WeakPolarHBondContact O-CG 3.3Å; L711-K715 PolarHBondContact O-N 2.91Å; L711-K742 VanDerWaalsContact CD1-O 3.29Å; L711-K742 WeakPolarHBondContact CD1-O 3.48Å; L711-V743 HydrophobicContact CD1-CG2 4.11Å
712	Y	96.4	Very high	92.7	Very high	30 Å²	30	17.4 Å²	17.4	12%	0.118	8%	0.083	C	C	.	.	H	α-helix	trans	-71	-32.2	178.6	-76.6	-67.6	0	0	0	112.6	R673 N676 M708 M709 Q710 K715 L716	R673-Y712 HydrophobicContact CG-CD1 4.07Å; R673-Y712 HydrophobicContact CG-CD2 3.63Å; R673-Y712 HydrophobicContact CG-CE1 3.82Å; R673-Y712 HydrophobicContact CG-CE2 3.37Å; R673-Y712 HydrophobicContact CG-CG 3.98Å; R673-Y712 VanDerWaalsContact CG-CZ 3.46Å; R673-Y712 PolarHBondContact NE-OH 2.84Å; R673-Y712 VanDerWaalsContact NE-OH 3.13Å; N676-Y712 HydrophobicContact CB-CD1 4.25Å; N676-Y712 PolarHBondContact ND2-O 2.91Å; M708-Y712 HydrophobicContact CG-CD2 3.83Å; M708-Y712 HydrophobicContact CG-CE2 3.64Å; M708-Y712 WeakPolarHBondContact O-CD2 3.44Å; M708-Y712 PolarHBondContact O-N 2.99Å; M708-Y712 VanDerWaalsContact O-N 3.09Å; M708-Y712 HydrophobicContact SD-CE2 4.28Å; M709-Y712 PolarHBondContact O-N 3.16Å; Q710-Y712 VanDerWaalsContact C-N 3.34Å; Q710-Y712 PolarHBondContact O-N 3Å; Y712-K715 HydrophobicContact CD1-CD 4.14Å; Y712-K715 HydrophobicContact CE1-CD 4.48Å; Y712-L716 WeakPolarHBondContact O-CG 3.43Å; Y712-L716 PolarHBondContact O-N 3.12Å
713	V	97.3	Very high	92.4	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.7	-47.5	169.7	175	0	0	0	0	111.1	L672 L698 A701 L702 M709 Q710 K715 L716 L717	L672-V713 HydrophobicContact CD1-CG2 3.65Å; L672-V713 HydrophobicContact CD2-CG2 3.83Å; L672-V713 HydrophobicContact CG-CG2 4.39Å; L698-V713 HydrophobicContact CB-CG1 3.98Å; L698-V713 HydrophobicContact CD2-CG1 4.47Å; L698-V713 WeakPolarHBondContact O-CG1 3.47Å; A701-V713 HydrophobicContact CB-CG2 4.08Å; L702-V713 HydrophobicContact CD1-CG1 4.43Å; L702-V713 HydrophobicContact CD2-CB 3.75Å; L702-V713 HydrophobicContact CD2-CG1 3.45Å; L702-V713 VanDerWaalsContact CD2-CG1 3.45Å; L702-V713 HydrophobicContact CG-CB 4.45Å; L702-V713 HydrophobicContact CG-CG1 3.64Å; M709-V713 VanDerWaalsContact O-CG2 3.32Å; M709-V713 WeakPolarHBondContact O-CG2 3.21Å; M709-V713 PolarHBondContact O-N 3.31Å; Q710-V713 PolarHBondContact O-N 3.48Å; V713-K715 VanDerWaalsContact C-N 3.31Å; V713-K715 PolarHBondContact O-N 3.34Å; V713-L716 PolarHBondContact O-N 3.11Å; V713-L716 VanDerWaalsContact O-N 3.16Å; V713-L717 HydrophobicContact CG1-CD1 3.96Å; V713-L717 HydrophobicContact CG1-CG 4.49Å; V713-L717 WeakPolarHBondContact O-CG 3.07Å; V713-L717 PolarHBondContact O-N 3.05Å
714	L	96.4	Very high	92.4	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-63.9	-35.8	179.9	-69.1	171	0	0	0	111.9	L702 Q710 L711 L717 K718 T735 A738 I739 K742 V743	L702-L714 HydrophobicContact CD1-CD2 4Å; L702-L714 HydrophobicContact CD2-CD2 3.93Å; L702-L714 HydrophobicContact CD2-CG 3.91Å; Q710-L714 WeakPolarHBondContact O-CB 3.37Å; Q710-L714 WeakPolarHBondContact O-CG 3.4Å; Q710-L714 PolarHBondContact O-N 2.97Å; L711-L714 PolarHBondContact O-N 3.18Å; L714-L717 PolarHBondContact O-N 3.38Å; L714-K718 WeakPolarHBondContact O-CB 3.45Å; L714-K718 PolarHBondContact O-N 3.31Å; L714-T735 HydrophobicContact CD2-CG2 4.45Å; L714-A738 HydrophobicContact CD1-CB 4.19Å; L714-A738 HydrophobicContact CD2-CB 3.88Å; L714-I739 HydrophobicContact CB-CG1 4.23Å; L714-I739 HydrophobicContact CD2-CG1 3.9Å; L714-K742 HydrophobicContact CD1-CB 3.97Å; L714-K742 HydrophobicContact CD1-CG 4.27Å; L714-V743 HydrophobicContact CB-CG2 3.6Å
715	K	95.8	Very high	92.2	Very high	52 Å²	52	16 Å²	16	23%	0.226	8%	0.08	C	C	.	.	H	α-helix	trans	-61.4	-43	172.5	-77	170.2	178.4	167.6	0	112.3	N676 L711 Y712 V713 K718 V719 V743	N676-K715 WeakPolarHBondContact OD1-CB 3.38Å; L711-K715 HydrophobicContact CG-CD 4.37Å; L711-K715 VanDerWaalsContact O-CG 3.3Å; L711-K715 WeakPolarHBondContact O-CG 3.3Å; L711-K715 PolarHBondContact O-N 2.91Å; Y712-K715 HydrophobicContact CD1-CD 4.14Å; Y712-K715 HydrophobicContact CE1-CD 4.48Å; V713-K715 VanDerWaalsContact C-N 3.31Å; V713-K715 PolarHBondContact O-N 3.34Å; K715-K718 PolarHBondContact O-N 3.36Å; K715-V719 PolarHBondContact O-N 2.94Å; K715-V743 HydrophobicContact CG-CG1 3.88Å; K715-V743 HydrophobicContact CG-CG2 4.35Å
716	L	96.9	Very high	92.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.1	-36	176.8	-71	163.7	0	0	0	112.3	L672 L675 N676 L689 L698 Y712 V713 V719 Q720	L672-L716 HydrophobicContact CD2-CD1 3.88Å; L675-L716 HydrophobicContact CB-CD1 4.29Å; L675-L716 HydrophobicContact CB-CD2 4.46Å; L675-L716 HydrophobicContact CD2-CD1 3.78Å; L675-L716 HydrophobicContact CD2-CD2 4.32Å; L675-L716 HydrophobicContact CG-CD1 4.09Å; L675-L716 HydrophobicContact CG-CD2 3.92Å; N676-L716 WeakPolarHBondContact ND2-CD1 3.35Å; N676-L716 VanDerWaalsContact ND2-CG 3.33Å; N676-L716 WeakPolarHBondContact ND2-CG 3.29Å; L689-L716 HydrophobicContact CD1-CD2 4.04Å; L698-L716 HydrophobicContact CD1-CB 3.7Å; L698-L716 HydrophobicContact CD1-CD1 4.39Å; L698-L716 HydrophobicContact CD2-CD1 3.96Å; Y712-L716 WeakPolarHBondContact O-CG 3.43Å; Y712-L716 PolarHBondContact O-N 3.12Å; V713-L716 PolarHBondContact O-N 3.11Å; V713-L716 VanDerWaalsContact O-N 3.16Å; L716-V719 VanDerWaalsContact O-CG2 3.22Å; L716-V719 WeakPolarHBondContact O-CG2 3.22Å; L716-Q720 WeakPolarHBondContact O-CG 3.49Å; L716-Q720 PolarHBondContact O-NE2 3.02Å
717	L	95.9	Very high	92.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.6	-42.1	174.2	-70.2	169.7	0	0	0	110.9	A695 L698 L702 V713 L714 V719 Q720 T721 T735 I739	A695-L717 HydrophobicContact CB-CD2 4Å; L698-L717 HydrophobicContact CB-CD1 4.48Å; L698-L717 HydrophobicContact CB-CD2 3.89Å; L698-L717 HydrophobicContact CB-CG 4.13Å; L698-L717 HydrophobicContact CD1-CD2 4.28Å; L698-L717 HydrophobicContact CD1-CG 4.49Å; L702-L717 HydrophobicContact CD1-CD1 3.88Å; V713-L717 HydrophobicContact CG1-CD1 3.96Å; V713-L717 HydrophobicContact CG1-CG 4.49Å; V713-L717 WeakPolarHBondContact O-CG 3.07Å; V713-L717 PolarHBondContact O-N 3.05Å; L714-L717 PolarHBondContact O-N 3.38Å; L717-V719 PolarHBondContact O-N 3.4Å; L717-Q720 PolarHBondContact O-N 2.83Å; L717-Q720 VanDerWaalsContact O-N 3.1Å; L717-T721 WeakPolarHBondContact O-CG2 3.46Å; L717-T721 PolarHBondContact O-N 3.47Å; L717-T735 HydrophobicContact CD1-CG2 3.77Å; L717-I739 HydrophobicContact CB-CD1 4.16Å
718	K	94	Very high	92.1	Very high	17 Å²	17	31.9 Å²	31.9	7%	0.074	14%	0.142	C	C	.	.	H	α-helix	trans	-56	-44.9	177.5	-179.8	175.2	175.2	165.8	0	112.6	L714 K715 Q720 T721 I739 V743 R744 H745 D749 W751	L714-K718 WeakPolarHBondContact O-CB 3.45Å; L714-K718 PolarHBondContact O-N 3.31Å; K715-K718 PolarHBondContact O-N 3.36Å; K718-Q720 PolarHBondContact O-N 3.47Å; K718-T721 PolarHBondContact O-N 3.34Å; K718-T721 PolarHBondContact O-OG1 3.14Å; K718-I739 HydrophobicContact CB-CD1 4.26Å; K718-I739 HydrophobicContact CB-CG2 3.77Å; K718-I739 HydrophobicContact CD-CG2 3.8Å; K718-I739 HydrophobicContact CG-CG2 3.87Å; K718-V743 HydrophobicContact CD-CB 4.33Å; K718-V743 HydrophobicContact CD-CG1 3.67Å; K718-R744 PolarHBondContact NZ-O 3.33Å; K718-H745 PolarHBondContact NZ-ND1 3.15Å; K718-D749 WeakPolarHBondContact CE-OD2 3.31Å; K718-D749 IonicContact NZ-OD2 3.45Å; K718-D749 PolarHBondContact NZ-OD2 3.38Å; K718-W751 HydrophobicContact CD-CD2 4.26Å; K718-W751 HydrophobicContact CD-CG 4.35Å; K718-W751 HydrophobicContact CG-CB 4.3Å; K718-W751 HydrophobicContact CG-CD2 3.87Å; K718-W751 HydrophobicContact CG-CE3 3.93Å; K718-W751 HydrophobicContact CG-CG 4.02Å
719	V	91.7	Very high	92.1	Very high	50 Å²	50	32.6 Å²	32.6	30%	0.303	14%	0.144	S	C	.	.	H	α-helix	trans	-70	-20.8	-179.1	-63.2	0	0	0	0	113.2	T686 K715 L716 L717	T686-V719 HydrophobicContact CG2-CB 4.03Å; T686-V719 HydrophobicContact CG2-CG2 3.89Å; T686-V719 WeakPolarHBondContact CG2-O 3.38Å; K715-V719 PolarHBondContact O-N 2.94Å; L716-V719 VanDerWaalsContact O-CG2 3.22Å; L716-V719 WeakPolarHBondContact O-CG2 3.22Å; L717-V719 PolarHBondContact O-N 3.4Å
720	Q	92.4	Very high	91.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-88.2	-19.8	178.9	-69.5	177	81.6	0	0	113.5	T686 L689 V690 S694 L716 L717 K718 K722 Y723 L724	T686-Q720 HydrophobicContact CG2-CG 4.26Å; L689-Q720 HydrophobicContact CB-CG 4.22Å; L689-Q720 HydrophobicContact CD1-CG 4.33Å; V690-Q720 HydrophobicContact CG2-CB 4.23Å; V690-Q720 HydrophobicContact CG2-CG 4.01Å; S694-Q720 PolarHBondContact OG-NE2 2.75Å; S694-Q720 PolarHBondContact OG-OE1 3.4Å; L716-Q720 WeakPolarHBondContact O-CG 3.49Å; L716-Q720 PolarHBondContact O-NE2 3.02Å; L717-Q720 PolarHBondContact O-N 2.83Å; L717-Q720 VanDerWaalsContact O-N 3.1Å; K718-Q720 PolarHBondContact O-N 3.47Å; Q720-K722 PolarHBondContact O-N 3.37Å; Q720-K722 VanDerWaalsContact O-N 3.11Å; Q720-Y723 PolarHBondContact O-N 3.47Å; Q720-L724 HydrophobicContact CB-CD1 3.96Å; Q720-L724 HydrophobicContact CB-CG 4.37Å; Q720-L724 WeakPolarHBondContact O-CG 3.5Å; Q720-L724 PolarHBondContact O-N 2.92Å
721	T	90.9	Very high	91.8	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33	-171.7	53.1	0	0	0	0	113.2	L717 K718 Y723 L724 W728 M736 I739 W751	L717-T721 WeakPolarHBondContact O-CG2 3.46Å; L717-T721 PolarHBondContact O-N 3.47Å; K718-T721 PolarHBondContact O-N 3.34Å; K718-T721 PolarHBondContact O-OG1 3.14Å; T721-Y723 PolarHBondContact O-N 3.1Å; T721-L724 PolarHBondContact O-N 3.48Å; T721-W728 HydrophobicContact CG2-CZ3 3.96Å; T721-M736 HydrophobicContact CG2-CE 4.46Å; T721-M736 HydrophobicContact CG2-SD 3.83Å; T721-I739 HydrophobicContact CG2-CD1 4.28Å; T721-W751 WeakPolarHBondContact CB-O 3.32Å; T721-W751 HydrophobicContact CG2-CE3 4.02Å; T721-W751 HydrophobicContact CG2-CZ3 4.18Å; T721-W751 PolarHBondContact OG1-O 3.32Å
722	K	86.6	Confident	91.7	Very high	45 Å²	45	44.4 Å²	44.4	20%	0.196	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.6	177.1	61.6	170.2	172.9	159.7	0	114.6	H683 Q720 D756	H683-K722 PolarHBondContact CD2-NZ 2.86Å; H683-K722 PolarHBondContact NE2-NZ 2.75Å; Q720-K722 PolarHBondContact O-N 3.37Å; Q720-K722 VanDerWaalsContact O-N 3.11Å; K722-D756 PolarHBondContact O-N 3.49Å; K722-D756 VanDerWaalsContact O-N 3.12Å
723	Y	87.3	Confident	91.4	Very high	18 Å²	18	48.2 Å²	48.2	7%	0.071	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-13.9	-178	-56.6	-59.8	0	0	0	113.5	H683 T686 M687 V690 Q720 T721 D756 A759	H683-Y723 PolarHBondContact CD2-OH 2.78Å; H683-Y723 VanDerWaalsContact CD2-OH 3.28Å; T686-Y723 HydrophobicContact CG2-CD2 4.04Å; T686-Y723 HydrophobicContact CG2-CE2 3.69Å; M687-Y723 HydrophobicContact CE-CD1 3.96Å; M687-Y723 HydrophobicContact CE-CE1 4.2Å; M687-Y723 HydrophobicContact CE-CG 4.48Å; M687-Y723 HydrophobicContact CG-CE1 4.16Å; M687-Y723 HydrophobicContact CG-CE2 4.22Å; M687-Y723 HydrophobicContact SD-CD1 3.25Å; M687-Y723 WeakPolarHBondContact SD-CD1 3.31Å; M687-Y723 HydrophobicContact SD-CD2 3.66Å; M687-Y723 HydrophobicContact SD-CE1 3.44Å; M687-Y723 WeakPolarHBondContact SD-CE1 3.43Å; M687-Y723 HydrophobicContact SD-CE2 3.82Å; M687-Y723 HydrophobicContact SD-CG 3.35Å; V690-Y723 HydrophobicContact CG2-CD2 4.09Å; V690-Y723 HydrophobicContact CG2-CG 4.31Å; Q720-Y723 PolarHBondContact O-N 3.47Å; T721-Y723 PolarHBondContact O-N 3.1Å; Y723-D756 HydrophobicContact CD1-CB 4.17Å; Y723-D756 HydrophobicContact CE1-CB 3.99Å; Y723-A759 HydrophobicContact CD1-CB 4.43Å; Y723-A759 HydrophobicContact CE1-CB 3.95Å
724	L	88.6	Confident	91.1	Very high	42 Å²	42	54.4 Å²	54.4	22%	0.22	25%	0.253	C	S	.	.	S	Bend	trans	-86	-8.4	-177.9	-65.7	169.7	0	0	0	113.2	V690 A695 Q720 T721 W728	V690-L724 HydrophobicContact CG1-CD2 4.34Å; A695-L724 HydrophobicContact CB-CD1 3.88Å; A695-L724 HydrophobicContact CB-CD2 4.33Å; Q720-L724 HydrophobicContact CB-CD1 3.96Å; Q720-L724 HydrophobicContact CB-CG 4.37Å; Q720-L724 WeakPolarHBondContact O-CG 3.5Å; Q720-L724 PolarHBondContact O-N 2.92Å; T721-L724 PolarHBondContact O-N 3.48Å; L724-W728 HydrophobicContact CB-CB 3.89Å; L724-W728 HydrophobicContact CB-CD2 3.89Å; L724-W728 HydrophobicContact CB-CE3 4.08Å; L724-W728 HydrophobicContact CB-CG 3.8Å; L724-W728 HydrophobicContact CD1-CD2 3.66Å; L724-W728 HydrophobicContact CD1-CE3 3.84Å; L724-W728 HydrophobicContact CD1-CG 4.25Å; L724-W728 HydrophobicContact CD1-CH2 3.98Å; L724-W728 HydrophobicContact CD1-CZ2 3.81Å; L724-W728 HydrophobicContact CD1-CZ3 4Å; L724-W728 HydrophobicContact CG-CD2 4.34Å; L724-W728 HydrophobicContact CG-CG 4.48Å; L724-W728 VanDerWaalsContact O-CB 3.25Å; L724-W728 WeakPolarHBondContact O-CB 3.44Å
725	G	86.4	Confident	90.9	Very high	7 Å²	7	54.4 Å²	54.4	7%	0.072	25%	0.253	C	S	.	.	H	α-helix	trans	75.7	179.6	176.6	0	0	0	0	0	115.2	R729	G725-R729 PolarHBondContact O-NE 3.16Å; G725-R729 VanDerWaalsContact O-NE 3.16Å
726	R	87.3	Confident	90.8	Very high	199 Å²	199	52.7 Å²	52.7	75%	0.751	25%	0.246	S	C	*	.	H	α-helix	trans	-71.2	-40.7	-173.9	-169.9	178.2	-178.9	-171.3	0.5	113.4	W728 R729 K730	R726-W728 VanDerWaalsContact C-N 3.33Å; R726-W728 PolarHBondContact O-N 2.89Å; R726-R729 PolarHBondContact O-N 3.39Å; R726-K730 PolarHBondContact O-N 2.94Å
727	Q	87.2	Confident	90.5	Very high	150 Å²	150	55.2 Å²	55.2	70%	0.701	26%	0.264	S	S	*	.	H	α-helix	trans	-62.1	-39.9	-178.7	-72	-66.7	-5.5	0	0	112.3	K730 S731	Q727-K730 PolarHBondContact O-N 2.88Å; Q727-S731 PolarHBondContact O-N 2.96Å; Q727-S731 VanDerWaalsContact O-N 3.12Å; Q727-S731 PolarHBondContact O-OG 3.22Å
728	W	90.3	Very high	90.3	Very high	42 Å²	42	55.8 Å²	55.8	16%	0.159	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-43.2	176.4	-172.9	93.9	0	0	0	111.6	A695 T721 L724 R726 K730 S731 N732 T735 M736	A695-W728 HydrophobicContact CB-CZ2 4.15Å; T721-W728 HydrophobicContact CG2-CZ3 3.96Å; L724-W728 HydrophobicContact CB-CB 3.89Å; L724-W728 HydrophobicContact CB-CD2 3.89Å; L724-W728 HydrophobicContact CB-CE3 4.08Å; L724-W728 HydrophobicContact CB-CG 3.8Å; L724-W728 HydrophobicContact CD1-CD2 3.66Å; L724-W728 HydrophobicContact CD1-CE3 3.84Å; L724-W728 HydrophobicContact CD1-CG 4.25Å; L724-W728 HydrophobicContact CD1-CH2 3.98Å; L724-W728 HydrophobicContact CD1-CZ2 3.81Å; L724-W728 HydrophobicContact CD1-CZ3 4Å; L724-W728 HydrophobicContact CG-CD2 4.34Å; L724-W728 HydrophobicContact CG-CG 4.48Å; L724-W728 VanDerWaalsContact O-CB 3.25Å; L724-W728 WeakPolarHBondContact O-CB 3.44Å; R726-W728 VanDerWaalsContact C-N 3.33Å; R726-W728 PolarHBondContact O-N 2.89Å; W728-K730 PolarHBondContact O-N 3.44Å; W728-S731 PolarHBondContact O-N 3.03Å; W728-S731 PolarHBondContact O-OG 3.37Å; W728-N732 HydrophobicContact CD2-CB 4.3Å; W728-N732 HydrophobicContact CE3-CB 4.24Å; W728-N732 HydrophobicContact CH2-CB 4.07Å; W728-N732 HydrophobicContact CZ2-CB 4.12Å; W728-N732 HydrophobicContact CZ3-CB 4.11Å; W728-N732 PolarHBondContact NE1-ND2 3.37Å; W728-N732 VanDerWaalsContact O-CB 3.31Å; W728-N732 WeakPolarHBondContact O-CB 3.45Å; W728-N732 PolarHBondContact O-N 2.89Å; W728-N732 PolarHBondContact O-ND2 2.81Å; W728-T735 HydrophobicContact CH2-CG2 4.45Å; W728-M736 HydrophobicContact CZ3-SD 4.2Å
729	R	90.6	Very high	90.3	Very high	22 Å²	22	55 Å²	55	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-45.8	177	-71.2	178.1	-83.3	164	-10.6	111.9	G725 R726 S731 N732 M733 M736 A752 Y753 N755	G725-R729 PolarHBondContact O-NE 3.16Å; G725-R729 VanDerWaalsContact O-NE 3.16Å; R726-R729 PolarHBondContact O-N 3.39Å; R729-S731 VanDerWaalsContact C-N 3.34Å; R729-S731 PolarHBondContact O-N 3Å; R729-N732 CarbonylContact O-C 3.46Å; R729-N732 PolarHBondContact O-N 3.28Å; R729-N732 VanDerWaalsContact O-N 3.14Å; R729-M733 PolarHBondContact O-N 2.74Å; R729-M736 HydrophobicContact CB-SD 4.48Å; R729-M736 HydrophobicContact CG-CE 4.02Å; R729-M736 HydrophobicContact CG-SD 3.99Å; R729-A752 WeakPolarHBondContact CD-O 3.33Å; R729-A752 PolarHBondContact NH1-O 3.23Å; R729-Y753 VanDerWaalsContact NH1-C 3.3Å; R729-Y753 PolarHBondContact NH1-O 3.15Å; R729-Y753 PolarHBondContact NH2-O 3.49Å; R729-N755 VanDerWaalsContact NH2-CG 3.26Å; R729-N755 PolarHBondContact NH2-ND2 3.45Å; R729-N755 PolarHBondContact NH2-OD1 2.99Å
730	K	89.8	Confident	90.2	Very high	162 Å²	162	60.1 Å²	60.1	70%	0.704	28%	0.28	S	S	*	.	H	α-helix	trans	-57.5	-45.4	177.7	-174	178.5	178.7	179.8	0	111.7	R726 Q727 W728 N732	R726-K730 PolarHBondContact O-N 2.94Å; Q727-K730 PolarHBondContact O-N 2.88Å; W728-K730 PolarHBondContact O-N 3.44Å; K730-N732 VanDerWaalsContact C-N 3.32Å; K730-N732 PolarHBondContact O-N 3.35Å
731	S	91.3	Very high	90.1	Very high	82 Å²	82	66 Å²	66	57%	0.573	31%	0.308	S	S	*	.	H	α-helix	trans	-76.7	-13.6	179.5	55.8	0	0	0	0	114.4	Q727 W728 R729	Q727-S731 PolarHBondContact O-N 2.96Å; Q727-S731 VanDerWaalsContact O-N 3.12Å; Q727-S731 PolarHBondContact O-OG 3.22Å; W728-S731 PolarHBondContact O-N 3.03Å; W728-S731 PolarHBondContact O-OG 3.37Å; R729-S731 VanDerWaalsContact C-N 3.34Å; R729-S731 PolarHBondContact O-N 3Å
732	N	92.8	Very high	90	Very high	12 Å²	12	68 Å²	68	6%	0.064	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	31.4	-177.1	-66.7	-82.8	0	0	0	113.1	K699 W728 R729 K730 K734 T735 M736	K699-N732 WeakPolarHBondContact CE-OD1 3.05Å; K699-N732 PolarHBondContact NZ-OD1 3.17Å; W728-N732 HydrophobicContact CD2-CB 4.3Å; W728-N732 HydrophobicContact CE3-CB 4.24Å; W728-N732 HydrophobicContact CH2-CB 4.07Å; W728-N732 HydrophobicContact CZ2-CB 4.12Å; W728-N732 HydrophobicContact CZ3-CB 4.11Å; W728-N732 PolarHBondContact NE1-ND2 3.37Å; W728-N732 VanDerWaalsContact O-CB 3.31Å; W728-N732 WeakPolarHBondContact O-CB 3.45Å; W728-N732 PolarHBondContact O-N 2.89Å; W728-N732 PolarHBondContact O-ND2 2.81Å; R729-N732 CarbonylContact O-C 3.46Å; R729-N732 PolarHBondContact O-N 3.28Å; R729-N732 VanDerWaalsContact O-N 3.14Å; K730-N732 VanDerWaalsContact C-N 3.32Å; K730-N732 PolarHBondContact O-N 3.35Å; N732-K734 VanDerWaalsContact C-N 3.27Å; N732-K734 PolarHBondContact O-N 2.99Å; N732-K734 VanDerWaalsContact O-N 3.17Å; N732-T735 WeakPolarHBondContact O-CA 3.43Å; N732-T735 VanDerWaalsContact O-CB 3.31Å; N732-T735 WeakPolarHBondContact O-CB 3.27Å; N732-T735 PolarHBondContact O-N 3.46Å; N732-M736 PolarHBondContact O-N 2.67Å
733	M	90.9	Very high	90.2	Very high	110 Å²	110	66.1 Å²	66.1	54%	0.542	31%	0.309	S	S	.	.	H	α-helix	trans	-54.7	-38.9	-176.3	-165.8	58.8	67	0	0	113.4	R729 T735 M736 S737	R729-M733 PolarHBondContact O-N 2.74Å; M733-T735 VanDerWaalsContact C-N 3.3Å; M733-T735 PolarHBondContact O-N 3.42Å; M733-M736 WeakPolarHBondContact O-CB 3.19Å; M733-M736 PolarHBondContact O-N 3.31Å; M733-M736 VanDerWaalsContact O-N 3.12Å; M733-M736 HydrophobicContact SD-CB 4.23Å; M733-S737 PolarHBondContact O-N 3.33Å; M733-S737 PolarHBondContact O-OG 3.19Å; M733-S737 VanDerWaalsContact O-OG 3.04Å
734	K	90.3	Very high	90.3	Very high	129 Å²	129	67.9 Å²	67.9	56%	0.561	32%	0.316	S	S	*	.	H	α-helix	trans	-57.6	-41.9	174.4	-70.2	-175.1	176.4	-177.5	0	112.7	P337 N732 S737 A738	P337-K734 HydrophobicContact CB-CB 4.49Å; N732-K734 VanDerWaalsContact C-N 3.27Å; N732-K734 PolarHBondContact O-N 2.99Å; N732-K734 VanDerWaalsContact O-N 3.17Å; K734-S737 PolarHBondContact O-N 3.29Å; K734-A738 WeakPolarHBondContact O-CB 3.28Å; K734-A738 PolarHBondContact O-N 3.49Å
735	T	92.5	Very high	90.2	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-66.7	-43.3	175.7	-53.8	0	0	0	0	110.6	L702 L714 L717 W728 N732 M733 S737 A738 I739	L702-T735 HydrophobicContact CD1-CG2 4.4Å; L714-T735 HydrophobicContact CD2-CG2 4.45Å; L717-T735 HydrophobicContact CD1-CG2 3.77Å; W728-T735 HydrophobicContact CH2-CG2 4.45Å; N732-T735 WeakPolarHBondContact O-CA 3.43Å; N732-T735 VanDerWaalsContact O-CB 3.31Å; N732-T735 WeakPolarHBondContact O-CB 3.27Å; N732-T735 PolarHBondContact O-N 3.46Å; M733-T735 VanDerWaalsContact C-N 3.3Å; M733-T735 PolarHBondContact O-N 3.42Å; T735-S737 VanDerWaalsContact C-N 3.33Å; T735-S737 PolarHBondContact O-N 2.9Å; T735-A738 PolarHBondContact O-N 2.9Å; T735-I739 HydrophobicContact CG2-CD1 4.26Å; T735-I739 WeakPolarHBondContact O-CG1 3.15Å; T735-I739 PolarHBondContact O-N 3.3Å
736	M	92.4	Very high	90	Very high	17 Å²	17	70 Å²	70	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-45.8	175.3	-63.2	-63	-68.7	0	0	111.2	T721 W728 R729 N732 M733 I739 Y740 W751 A752	T721-M736 HydrophobicContact CG2-CE 4.46Å; T721-M736 HydrophobicContact CG2-SD 3.83Å; W728-M736 HydrophobicContact CZ3-SD 4.2Å; R729-M736 HydrophobicContact CB-SD 4.48Å; R729-M736 HydrophobicContact CG-CE 4.02Å; R729-M736 HydrophobicContact CG-SD 3.99Å; N732-M736 PolarHBondContact O-N 2.67Å; M733-M736 WeakPolarHBondContact O-CB 3.19Å; M733-M736 PolarHBondContact O-N 3.31Å; M733-M736 VanDerWaalsContact O-N 3.12Å; M733-M736 HydrophobicContact SD-CB 4.23Å; M736-I739 PolarHBondContact O-N 2.87Å; M736-Y740 PolarHBondContact O-N 2.92Å; M736-W751 HydrophobicContact CE-CE3 4.01Å; M736-W751 HydrophobicContact CE-CH2 3.87Å; M736-W751 HydrophobicContact CE-CZ3 3.31Å; M736-W751 HydrophobicContact SD-CZ3 3.83Å; M736-A752 HydrophobicContact CE-CB 4.05Å
737	S	91.2	Very high	89.7	Confident	52 Å²	52	64.5 Å²	64.5	36%	0.364	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-40.7	175.9	-55.5	0	0	0	0	112.2	M733 K734 T735 Y740 Q741	M733-S737 PolarHBondContact O-N 3.33Å; M733-S737 PolarHBondContact O-OG 3.19Å; M733-S737 VanDerWaalsContact O-OG 3.04Å; K734-S737 PolarHBondContact O-N 3.29Å; T735-S737 VanDerWaalsContact C-N 3.33Å; T735-S737 PolarHBondContact O-N 2.9Å; S737-Y740 WeakPolarHBondContact O-CB 3.25Å; S737-Y740 PolarHBondContact O-N 3.29Å; S737-Q741 WeakPolarHBondContact O-CB 3.43Å; S737-Q741 VanDerWaalsContact O-CG 3.28Å; S737-Q741 WeakPolarHBondContact O-CG 3.47Å; S737-Q741 PolarHBondContact O-N 3.4Å
738	A	91.8	Very high	89.2	Confident	13 Å²	13	60.7 Å²	60.7	11%	0.107	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-40.5	175.5	0	0	0	0	0	112.2	A334 L714 K734 T735 Y740 Q741 K742	A334-A738 HydrophobicContact CB-CB 4.45Å; L714-A738 HydrophobicContact CD1-CB 4.19Å; L714-A738 HydrophobicContact CD2-CB 3.88Å; K734-A738 WeakPolarHBondContact O-CB 3.28Å; K734-A738 PolarHBondContact O-N 3.49Å; T735-A738 PolarHBondContact O-N 2.9Å; A738-Y740 VanDerWaalsContact C-N 3.31Å; A738-Y740 PolarHBondContact O-N 2.75Å; A738-Q741 PolarHBondContact O-N 3.41Å; A738-K742 WeakPolarHBondContact O-CB 3.35Å; A738-K742 WeakPolarHBondContact O-CG 3.35Å; A738-K742 PolarHBondContact O-N 3.26Å
739	I	93	Very high	88.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-46.8	171.6	-66	165.9	0	0	0	109.4	L714 L717 K718 T721 T735 M736 Q741 K742 V743 W751	L714-I739 HydrophobicContact CB-CG1 4.23Å; L714-I739 HydrophobicContact CD2-CG1 3.9Å; L717-I739 HydrophobicContact CB-CD1 4.16Å; K718-I739 HydrophobicContact CB-CD1 4.26Å; K718-I739 HydrophobicContact CB-CG2 3.77Å; K718-I739 HydrophobicContact CD-CG2 3.8Å; K718-I739 HydrophobicContact CG-CG2 3.87Å; T721-I739 HydrophobicContact CG2-CD1 4.28Å; T735-I739 HydrophobicContact CG2-CD1 4.26Å; T735-I739 WeakPolarHBondContact O-CG1 3.15Å; T735-I739 PolarHBondContact O-N 3.3Å; M736-I739 PolarHBondContact O-N 2.87Å; I739-Q741 VanDerWaalsContact C-N 3.32Å; I739-Q741 PolarHBondContact O-N 2.78Å; I739-K742 PolarHBondContact O-N 2.98Å; I739-V743 HydrophobicContact CG2-CB 4.13Å; I739-V743 HydrophobicContact CG2-CG2 4.15Å; I739-V743 WeakPolarHBondContact O-CB 3.25Å; I739-V743 PolarHBondContact O-N 2.78Å; I739-W751 HydrophobicContact CB-CH2 3.68Å; I739-W751 HydrophobicContact CB-CZ2 4.44Å; I739-W751 HydrophobicContact CB-CZ3 3.95Å; I739-W751 HydrophobicContact CD1-CH2 4.5Å; I739-W751 HydrophobicContact CD1-CZ3 3.91Å; I739-W751 HydrophobicContact CG2-CD2 4.48Å; I739-W751 HydrophobicContact CG2-CE3 4.11Å; I739-W751 HydrophobicContact CG2-CH2 3.31Å; I739-W751 HydrophobicContact CG2-CZ2 3.71Å; I739-W751 HydrophobicContact CG2-CZ3 3.53Å
740	Y	90.4	Very high	88.1	Confident	157 Å²	157	64.7 Å²	64.7	62%	0.616	32%	0.316	S	S	*	.	H	α-helix	trans	-59.5	-39.9	179.1	-171.9	-97.4	0	0	0	113.1	M736 S737 A738 H745	M736-Y740 PolarHBondContact O-N 2.92Å; S737-Y740 WeakPolarHBondContact O-CB 3.25Å; S737-Y740 PolarHBondContact O-N 3.29Å; A738-Y740 VanDerWaalsContact C-N 3.31Å; A738-Y740 PolarHBondContact O-N 2.75Å; Y740-H745 WeakPolarHBondContact CA-NE2 3.36Å; Y740-H745 AromaticContact CD2-NE2 3.58Å; Y740-H745 AromaticContact CG-NE2 3.95Å; Y740-H745 PolarHBondContact O-NE2 2.86Å
741	Q	89.8	Confident	87.9	Confident	125 Å²	125	58 Å²	58	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-86	-15.6	-175.7	-70.9	173.1	0.5	0	0	115	L422 S737 A738 I739	L422-Q741 WeakPolarHBondContact CD2-O 3.4Å; S737-Q741 WeakPolarHBondContact O-CB 3.43Å; S737-Q741 VanDerWaalsContact O-CG 3.28Å; S737-Q741 WeakPolarHBondContact O-CG 3.47Å; S737-Q741 PolarHBondContact O-N 3.4Å; A738-Q741 PolarHBondContact O-N 3.41Å; I739-Q741 VanDerWaalsContact C-N 3.32Å; I739-Q741 PolarHBondContact O-N 2.78Å
742	K	89.2	Confident	87.6	Confident	41 Å²	41	55.1 Å²	55.1	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-126.8	-27.9	-171.5	-59.2	-68.9	-178.9	173.3	0	114.3	M331 R332 A334 W424 L711 L714 A738 I739	M331-K742 HydrophobicContact CE-CB 4.46Å; M331-K742 HydrophobicContact CE-CD 3.98Å; R332-K742 PolarHBondContact O-NZ 3.06Å; A334-K742 HydrophobicContact CB-CG 4.48Å; W424-K742 PolarHBondContact NE1-O 3.21Å; L711-K742 VanDerWaalsContact CD1-O 3.29Å; L711-K742 WeakPolarHBondContact CD1-O 3.48Å; L714-K742 HydrophobicContact CD1-CB 3.97Å; L714-K742 HydrophobicContact CD1-CG 4.27Å; A738-K742 WeakPolarHBondContact O-CB 3.35Å; A738-K742 WeakPolarHBondContact O-CG 3.35Å; A738-K742 PolarHBondContact O-N 3.26Å; I739-K742 PolarHBondContact O-N 2.98Å
743	V	91.6	Very high	86.9	Confident	7 Å²	7	63.9 Å²	63.9	4%	0.042	30%	0.301	C	S	.	.	S	Bend	trans	-97.5	138.2	-175.8	-174.9	0	0	0	0	109.8	L422 L711 L714 K715 K718 I739 H745	L422-V743 WeakPolarHBondContact CD1-O 3.39Å; L711-V743 HydrophobicContact CD1-CG2 4.11Å; L714-V743 HydrophobicContact CB-CG2 3.6Å; K715-V743 HydrophobicContact CG-CG1 3.88Å; K715-V743 HydrophobicContact CG-CG2 4.35Å; K718-V743 HydrophobicContact CD-CB 4.33Å; K718-V743 HydrophobicContact CD-CG1 3.67Å; I739-V743 HydrophobicContact CG2-CB 4.13Å; I739-V743 HydrophobicContact CG2-CG2 4.15Å; I739-V743 WeakPolarHBondContact O-CB 3.25Å; I739-V743 PolarHBondContact O-N 2.78Å; V743-H745 PolarHBondContact O-CE1 3.41Å; V743-H745 PolarHBondContact O-N 3.37Å
744	R	89.3	Confident	86	Confident	55 Å²	55	59.3 Å²	59.3	21%	0.208	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-55.1	131.8	174.2	-176.8	-172.1	-79	121.8	-9.2	110.9	E322 W424 A425 K718	E322-R744 IonicContact OE1-CZ 2.66Å; E322-R744 IonicContact OE1-NE 3.34Å; E322-R744 IonicContact OE1-NH2 3.42Å; E322-R744 PolarHBondContact OE1-NH2 2.85Å; W424-R744 HydrophobicContact CB-CB 3.79Å; W424-R744 HydrophobicContact CB-CG 3.75Å; W424-R744 HydrophobicContact CD2-CB 4.44Å; W424-R744 HydrophobicContact CG-CB 3.77Å; W424-R744 HydrophobicContact CG-CG 4.31Å; A425-R744 WeakPolarHBondContact O-CD 3.34Å; A425-R744 PolarHBondContact O-NE 3.4Å; K718-R744 PolarHBondContact NZ-O 3.33Å
745	H	86.8	Confident	85.1	Confident	42 Å²	42	57.1 Å²	57.1	19%	0.194	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-95.7	153.8	170.2	-58.1	-44.8	0	0	0	111.6	L422 K718 Y740 V743 W751	L422-H745 VanDerWaalsContact CD1-CD2 3.44Å; L422-H745 WeakPolarHBondContact CD1-CD2 3.3Å; K718-H745 PolarHBondContact NZ-ND1 3.15Å; Y740-H745 WeakPolarHBondContact CA-NE2 3.36Å; Y740-H745 AromaticContact CD2-NE2 3.58Å; Y740-H745 AromaticContact CG-NE2 3.95Å; Y740-H745 PolarHBondContact O-NE2 2.86Å; V743-H745 PolarHBondContact O-CE1 3.41Å; V743-H745 PolarHBondContact O-N 3.37Å; H745-W751 AromaticContact CE1-CZ2 3.96Å; H745-W751 AromaticContact ND1-NE1 3.72Å
746	R	82	Confident	84.2	Confident	52 Å²	52	60 Å²	60	20%	0.196	29%	0.292	C	S	.	.			trans	-108.2	159.1	167.7	-51.1	178.4	160.5	-153	-8.9	109.1	D432 N748 D749	D432-R746 IonicContact OD2-NH1 3.37Å; D432-R746 PolarHBondContact OD2-NH1 3.16Å; R746-N748 VanDerWaalsContact C-N 3.32Å; R746-N748 PolarHBondContact O-N 3.2Å; R746-D749 HydrophobicContact CB-CB 3.88Å; R746-D749 PolarHBondContact N-OD2 2.85Å; R746-D749 VanDerWaalsContact O-CB 3.25Å; R746-D749 WeakPolarHBondContact O-CB 3.22Å; R746-D749 PolarHBondContact O-N 3.1Å
747	L	80.8	Confident	82.8	Confident	83 Å²	83	64.7 Å²	64.7	44%	0.435	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-35.9	-176.9	-65.2	177.2	0	0	0	112.2	V428 T469 L470	V428-L747 HydrophobicContact CG2-CB 4.4Å; V428-L747 HydrophobicContact CG2-CD1 3.78Å; V428-L747 HydrophobicContact CG2-CG 4.22Å; T469-L747 HydrophobicContact CG2-CD1 4.18Å; L470-L747 HydrophobicContact CD2-CB 3.92Å; L470-L747 HydrophobicContact CD2-CD1 3.93Å
748	N	77.1	Confident	81.5	Confident	70 Å²	70	69.1 Å²	69.1	37%	0.374	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	25.2	178.4	-58.9	-11.8	0	0	0	112.1	D432 R746 D750	D432-N748 PolarHBondContact O-ND2 3.35Å; R746-N748 VanDerWaalsContact C-N 3.32Å; R746-N748 PolarHBondContact O-N 3.2Å; N748-D750 PolarHBondContact O-N 3.31Å
749	D	76.8	Confident	80.4	Confident	51 Å²	51	69 Å²	69	27%	0.273	34%	0.335	S	S	.	.			trans	-83.2	107.5	-174.3	-151.2	-15.1	0	0	0	111	K718 R746 W751	K718-D749 WeakPolarHBondContact CE-OD2 3.31Å; K718-D749 IonicContact NZ-OD2 3.45Å; K718-D749 PolarHBondContact NZ-OD2 3.38Å; R746-D749 HydrophobicContact CB-CB 3.88Å; R746-D749 PolarHBondContact N-OD2 2.85Å; R746-D749 VanDerWaalsContact O-CB 3.25Å; R746-D749 WeakPolarHBondContact O-CB 3.22Å; R746-D749 PolarHBondContact O-N 3.1Å; D749-W751 VanDerWaalsContact OD1-CD1 3.26Å
750	D	80.7	Confident	79.2	Confident	97 Å²	97	75 Å²	75	52%	0.519	36%	0.358	S	S	.	.			trans	-94.6	7.2	-178.7	72.8	-29.5	0	0	0	113.4	N748 A752 Y753 G754	N748-D750 PolarHBondContact O-N 3.31Å; D750-A752 PolarHBondContact O-N 3.36Å; D750-Y753 PolarHBondContact O-N 3.32Å; D750-G754 PolarHBondContact O-N 3.27Å
751	W	85.9	Confident	77.9	Confident	21 Å²	21	70.7 Å²	70.7	8%	0.08	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-28.8	-173.9	71.7	-79.3	0	0	0	115.7	K718 T721 M736 I739 H745 D749	K718-W751 HydrophobicContact CD-CD2 4.26Å; K718-W751 HydrophobicContact CD-CG 4.35Å; K718-W751 HydrophobicContact CG-CB 4.3Å; K718-W751 HydrophobicContact CG-CD2 3.87Å; K718-W751 HydrophobicContact CG-CE3 3.93Å; K718-W751 HydrophobicContact CG-CG 4.02Å; T721-W751 WeakPolarHBondContact CB-O 3.32Å; T721-W751 HydrophobicContact CG2-CE3 4.02Å; T721-W751 HydrophobicContact CG2-CZ3 4.18Å; T721-W751 PolarHBondContact OG1-O 3.32Å; M736-W751 HydrophobicContact CE-CE3 4.01Å; M736-W751 HydrophobicContact CE-CH2 3.87Å; M736-W751 HydrophobicContact CE-CZ3 3.31Å; M736-W751 HydrophobicContact SD-CZ3 3.83Å; I739-W751 HydrophobicContact CB-CH2 3.68Å; I739-W751 HydrophobicContact CB-CZ2 4.44Å; I739-W751 HydrophobicContact CB-CZ3 3.95Å; I739-W751 HydrophobicContact CD1-CH2 4.5Å; I739-W751 HydrophobicContact CD1-CZ3 3.91Å; I739-W751 HydrophobicContact CG2-CD2 4.48Å; I739-W751 HydrophobicContact CG2-CE3 4.11Å; I739-W751 HydrophobicContact CG2-CH2 3.31Å; I739-W751 HydrophobicContact CG2-CZ2 3.71Å; I739-W751 HydrophobicContact CG2-CZ3 3.53Å; H745-W751 AromaticContact CE1-CZ2 3.96Å; H745-W751 AromaticContact ND1-NE1 3.72Å; D749-W751 VanDerWaalsContact OD1-CD1 3.26Å
752	A	83.6	Confident	76.7	Confident	21 Å²	21	71.8 Å²	71.8	17%	0.174	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-20.4	-178.3	0	0	0	0	0	113.8	R729 M736 D750	R729-A752 WeakPolarHBondContact CD-O 3.33Å; R729-A752 PolarHBondContact NH1-O 3.23Å; M736-A752 HydrophobicContact CE-CB 4.05Å; D750-A752 PolarHBondContact O-N 3.36Å
753	Y	79.2	Confident	75.8	Confident	196 Å²	196	73.1 Å²	73.1	77%	0.769	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	-35.8	-172.8	-61.8	-75.2	0	0	0	113.2	R729 D750	R729-Y753 VanDerWaalsContact NH1-C 3.3Å; R729-Y753 PolarHBondContact NH1-O 3.15Å; R729-Y753 PolarHBondContact NH2-O 3.49Å; D750-Y753 PolarHBondContact O-N 3.32Å
754	G	71.9	Confident	74.8	Confident	14 Å²	14	74 Å²	74	14%	0.144	36%	0.36	C	S	.	.			trans	-53.2	135.3	179.6	0	0	0	0	0	113.1	D750	D750-G754 PolarHBondContact O-N 3.27Å
755	N	72.1	Confident	74.3	Confident	84 Å²	84	77.2 Å²	77.2	45%	0.449	38%	0.378	S	S	.	.			trans	-121.4	112.5	171.8	-84.3	-39.9	0	0	0	107.1	R729 L757	R729-N755 VanDerWaalsContact NH2-CG 3.26Å; R729-N755 PolarHBondContact NH2-ND2 3.45Å; R729-N755 PolarHBondContact NH2-OD1 2.99Å; N755-L757 HydrophobicContact CB-CD1 4.41Å; N755-L757 HydrophobicContact CB-CG 4.22Å
756	D	73.5	Confident	74.1	Confident	63 Å²	63	78.7 Å²	78.7	34%	0.337	40%	0.397	S	S	.	.			trans	-112.5	59.1	174.5	-159.1	6.8	0	0	0	107.5	K722 Y723 D758 A759	K722-D756 PolarHBondContact O-N 3.49Å; K722-D756 VanDerWaalsContact O-N 3.12Å; Y723-D756 HydrophobicContact CD1-CB 4.17Å; Y723-D756 HydrophobicContact CE1-CB 3.99Å; D756-D758 VanDerWaalsContact C-N 3.28Å; D756-A759 HydrophobicContact CB-CB 4.39Å
757	L	62.5	Low	74.1	Confident	114 Å²	114	80.9 Å²	80.9	60%	0.597	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-25.9	-173.2	-66.7	173.2	0	0	0	111.7	N755	N755-L757 HydrophobicContact CB-CD1 4.41Å; N755-L757 HydrophobicContact CB-CG 4.22Å
758	D	64	Low	74.4	Confident	145 Å²	145	78 Å²	78	78%	0.775	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-1	-179.3	-58.5	-40.6	0	0	0	112.9	D756 R760	D756-D758 VanDerWaalsContact C-N 3.28Å; D758-R760 WeakPolarHBondContact O-CG 3.35Å; D758-R760 PolarHBondContact O-N 2.86Å; D758-R760 VanDerWaalsContact O-N 3.16Å
759	A	67.6	Low	75	Confident	12 Å²	12	77.5 Å²	77.5	10%	0.099	40%	0.396	C	S	.	.			trans	-66.4	113.5	174.3	0	0	0	0	0	110.1	M687 Y723 D756 F764	M687-A759 HydrophobicContact CE-CB 4.03Å; M687-A759 WeakPolarHBondContact CE-O 3.41Å; Y723-A759 HydrophobicContact CD1-CB 4.43Å; Y723-A759 HydrophobicContact CE1-CB 3.95Å; D756-A759 HydrophobicContact CB-CB 4.39Å; A759-F764 HydrophobicContact CB-CE2 4.03Å; A759-F764 HydrophobicContact CB-CZ 4.09Å
760	R	68.4	Low	75.6	Confident	126 Å²	126	77.7 Å²	77.7	48%	0.475	40%	0.404	S	S	.	.			trans	-95.6	148.1	-179.6	-53	172.5	-56.1	178.3	-4.8	109.4	D758 W762 D763	D758-R760 WeakPolarHBondContact O-CG 3.35Å; D758-R760 PolarHBondContact O-N 2.86Å; D758-R760 VanDerWaalsContact O-N 3.16Å; R760-W762 HydrophobicContact CB-CD2 3.72Å; R760-W762 HydrophobicContact CB-CE3 4.11Å; R760-W762 HydrophobicContact CB-CG 4.31Å; R760-W762 HydrophobicContact CB-CH2 3.98Å; R760-W762 HydrophobicContact CB-CZ2 3.6Å; R760-W762 HydrophobicContact CB-CZ3 4.21Å; R760-W762 HydrophobicContact CG-CH2 4.32Å; R760-W762 HydrophobicContact CG-CZ2 3.85Å; R760-W762 VanDerWaalsContact CZ-NE1 3.25Å; R760-W762 VanDerWaalsContact NE-NE1 3.14Å; R760-W762 PolarHBondContact O-N 3.24Å; R760-D763 WeakPolarHBondContact CA-OD2 3.36Å; R760-D763 WeakPolarHBondContact CB-OD2 3.36Å; R760-D763 IonicContact CZ-OD1 3.36Å; R760-D763 PolarHBondContact N-OD2 3.42Å; R760-D763 IonicContact NE-OD1 2.73Å; R760-D763 PolarHBondContact NE-OD1 3.48Å; R760-D763 IonicContact NE-OD2 3.12Å; R760-D763 PolarHBondContact NE-OD2 2.9Å; R760-D763 IonicContact NH2-OD1 3.7Å; R760-D763 PolarHBondContact NH2-OD1 3.45Å; R760-D763 VanDerWaalsContact NH2-OD1 3.12Å; R760-D763 WeakPolarHBondContact O-CB 3.36Å; R760-D763 PolarHBondContact O-N 2.93Å
761	P	62.8	Low	76.2	Confident	66 Å²	66	74 Å²	74	43%	0.429	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.5	-178.3	-28.6	35.4	0	0	0	114.8
762	W	65.6	Low	76.5	Confident	147 Å²	147	76.9 Å²	76.9	56%	0.557	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.6	-179.9	51.7	86.5	0	0	0	114.4	R760 F764 Q765	R760-W762 HydrophobicContact CB-CD2 3.72Å; R760-W762 HydrophobicContact CB-CE3 4.11Å; R760-W762 HydrophobicContact CB-CG 4.31Å; R760-W762 HydrophobicContact CB-CH2 3.98Å; R760-W762 HydrophobicContact CB-CZ2 3.6Å; R760-W762 HydrophobicContact CB-CZ3 4.21Å; R760-W762 HydrophobicContact CG-CH2 4.32Å; R760-W762 HydrophobicContact CG-CZ2 3.85Å; R760-W762 VanDerWaalsContact CZ-NE1 3.25Å; R760-W762 VanDerWaalsContact NE-NE1 3.14Å; R760-W762 PolarHBondContact O-N 3.24Å; W762-F764 PolarHBondContact O-N 3.04Å; W762-F764 VanDerWaalsContact O-N 3.12Å; W762-Q765 WeakPolarHBondContact O-CB 3.29Å; W762-Q765 PolarHBondContact O-N 2.69Å; W762-Q765 VanDerWaalsContact O-N 3.11Å
763	D	68.7	Low	76.9	Confident	69 Å²	69	77.5 Å²	77.5	37%	0.369	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.8	-178.5	-61.7	-31.2	0	0	0	111.7	R760	R760-D763 WeakPolarHBondContact CA-OD2 3.36Å; R760-D763 WeakPolarHBondContact CB-OD2 3.36Å; R760-D763 IonicContact CZ-OD1 3.36Å; R760-D763 PolarHBondContact N-OD2 3.42Å; R760-D763 IonicContact NE-OD1 2.73Å; R760-D763 PolarHBondContact NE-OD1 3.48Å; R760-D763 IonicContact NE-OD2 3.12Å; R760-D763 PolarHBondContact NE-OD2 2.9Å; R760-D763 IonicContact NH2-OD1 3.7Å; R760-D763 PolarHBondContact NH2-OD1 3.45Å; R760-D763 VanDerWaalsContact NH2-OD1 3.12Å; R760-D763 WeakPolarHBondContact O-CB 3.36Å; R760-D763 PolarHBondContact O-N 2.93Å
764	F	72.1	Confident	77.6	Confident	26 Å²	26	70.2 Å²	70.2	11%	0.114	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	7.3	179.3	-52.5	-70	0	0	0	114	H683 M687 A759 W762 A766 E767 E768	H683-F764 HydrophobicContact CB-CB 4.47Å; H683-F764 HydrophobicContact CB-CD1 3.37Å; H683-F764 HydrophobicContact CB-CD2 4.02Å; H683-F764 HydrophobicContact CB-CE1 3.45Å; H683-F764 VanDerWaalsContact CB-CE1 3.45Å; H683-F764 HydrophobicContact CB-CE2 4.09Å; H683-F764 HydrophobicContact CB-CG 3.67Å; H683-F764 HydrophobicContact CB-CZ 3.82Å; H683-F764 AromaticContact CG-CE1 3.86Å; M687-F764 HydrophobicContact CG-CD2 4.46Å; M687-F764 HydrophobicContact CG-CE2 4.19Å; A759-F764 HydrophobicContact CB-CE2 4.03Å; A759-F764 HydrophobicContact CB-CZ 4.09Å; W762-F764 PolarHBondContact O-N 3.04Å; W762-F764 VanDerWaalsContact O-N 3.12Å; F764-A766 VanDerWaalsContact C-N 3.31Å; F764-E767 PolarHBondContact O-N 3.05Å; F764-E768 PolarHBondContact O-N 2.91Å
765	Q	77.8	Confident	78.6	Confident	122 Å²	122	69.6 Å²	69.6	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-69.1	-33.1	179.3	-169.4	161.3	-1.1	0	0	111.5	W762 E767 E768 C769	W762-Q765 WeakPolarHBondContact O-CB 3.29Å; W762-Q765 PolarHBondContact O-N 2.69Å; W762-Q765 VanDerWaalsContact O-N 3.11Å; Q765-E767 PolarHBondContact O-N 3.38Å; Q765-E768 PolarHBondContact O-N 2.94Å; Q765-C769 WeakPolarHBondContact O-CB 3.44Å; Q765-C769 PolarHBondContact O-N 3.45Å; Q765-C769 PolarHBondContact O-SG 2.8Å; Q765-C769 VanDerWaalsContact O-SG 3.32Å
766	A	82.6	Confident	79.5	Confident	74 Å²	74	70.9 Å²	70.9	61%	0.612	37%	0.371	S	S	*	.	H	α-helix	trans	-60.3	-41.5	174.1	0	0	0	0	0	112.4	F764 C769 A770	F764-A766 VanDerWaalsContact C-N 3.31Å; A766-C769 PolarHBondContact O-N 2.9Å; A766-A770 WeakPolarHBondContact O-CB 3.25Å; A766-A770 PolarHBondContact O-N 3.12Å
767	E	83.4	Confident	80.3	Confident	98 Å²	98	74.6 Å²	74.6	46%	0.458	38%	0.38	S	S	.	.	H	α-helix	trans	-63.6	-42.4	178.3	-65.5	-174.2	168	0	0	112.2	H683 F764 Q765 L771	H683-E767 IonicContact ND1-OE2 3.42Å; F764-E767 PolarHBondContact O-N 3.05Å; Q765-E767 PolarHBondContact O-N 3.38Å; E767-L771 WeakPolarHBondContact O-CB 3.38Å; E767-L771 PolarHBondContact O-N 3.36Å
768	E	86.9	Confident	81.7	Confident	22 Å²	22	69.2 Å²	69.2	10%	0.103	35%	0.352	C	S	.	.	H	α-helix	trans	-70.9	-34.9	177.5	-71.8	-71.1	163.6	0	0	112	Q602 R685 F764 Q765 R772	Q602-E768 PolarHBondContact NE2-O 3.41Å; Q602-E768 PolarHBondContact NE2-OE2 3.25Å; R685-E768 IonicContact CZ-OE1 3.91Å; R685-E768 IonicContact CZ-OE2 3.15Å; R685-E768 IonicContact NE-OE1 3.97Å; R685-E768 PolarHBondContact NE-OE1 2.66Å; R685-E768 IonicContact NE-OE2 3.92Å; R685-E768 IonicContact NH2-OE1 3.83Å; R685-E768 PolarHBondContact NH2-OE1 2.83Å; R685-E768 IonicContact NH2-OE2 3.29Å; R685-E768 PolarHBondContact NH2-OE2 3.16Å; F764-E768 PolarHBondContact O-N 2.91Å; Q765-E768 PolarHBondContact O-N 2.94Å; E768-R772 WeakPolarHBondContact O-CB 3.37Å; E768-R772 PolarHBondContact O-N 3Å
769	C	88.4	Confident	83	Confident	60 Å²	60	63 Å²	63	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-65.6	-46	173.3	-73.1	0	0	0	0	111.8	Q765 A766 L771 R772 A773	Q765-C769 WeakPolarHBondContact O-CB 3.44Å; Q765-C769 PolarHBondContact O-N 3.45Å; Q765-C769 PolarHBondContact O-SG 2.8Å; Q765-C769 VanDerWaalsContact O-SG 3.32Å; A766-C769 PolarHBondContact O-N 2.9Å; C769-L771 VanDerWaalsContact C-N 3.33Å; C769-L771 PolarHBondContact O-N 3.32Å; C769-R772 PolarHBondContact O-N 3.2Å; C769-A773 PolarHBondContact O-N 3.38Å
770	A	90.6	Very high	84	Confident	54 Å²	54	64.8 Å²	64.8	45%	0.446	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-42.4	176	0	0	0	0	0	111.6	A766 R772 A773 N774	A766-A770 WeakPolarHBondContact O-CB 3.25Å; A766-A770 PolarHBondContact O-N 3.12Å; A770-R772 PolarHBondContact O-N 3.4Å; A770-A773 PolarHBondContact O-N 2.94Å; A770-N774 PolarHBondContact O-N 2.94Å
771	L	91.9	Very high	84.8	Confident	19 Å²	19	63.3 Å²	63.3	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-44.1	175.1	178.7	63.5	0	0	0	112.1	Y595 E598 E767 C769 A773 N774 I775	Y595-L771 HydrophobicContact CE1-CD1 4.22Å; E598-L771 HydrophobicContact CB-CD1 4.23Å; E598-L771 HydrophobicContact CG-CD1 4.11Å; E767-L771 WeakPolarHBondContact O-CB 3.38Å; E767-L771 PolarHBondContact O-N 3.36Å; C769-L771 VanDerWaalsContact C-N 3.33Å; C769-L771 PolarHBondContact O-N 3.32Å; L771-A773 VanDerWaalsContact C-N 3.35Å; L771-A773 PolarHBondContact O-N 2.81Å; L771-N774 PolarHBondContact O-N 3.28Å; L771-I775 HydrophobicContact CD1-CD1 4.14Å; L771-I775 HydrophobicContact CD1-CG1 4.42Å; L771-I775 HydrophobicContact CG-CD1 3.86Å; L771-I775 WeakPolarHBondContact O-CD1 3.37Å; L771-I775 VanDerWaalsContact O-CG1 3.25Å; L771-I775 WeakPolarHBondContact O-CG1 2.97Å; L771-I775 PolarHBondContact O-N 3.21Å
772	R	92.2	Very high	86	Confident	83 Å²	83	62.4 Å²	62.4	31%	0.313	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-47.1	177.1	-175.5	-175.4	-67.7	111	-7.7	111	E768 C769 A770 N774 I775 E776	E768-R772 WeakPolarHBondContact O-CB 3.37Å; E768-R772 PolarHBondContact O-N 3Å; C769-R772 PolarHBondContact O-N 3.2Å; A770-R772 PolarHBondContact O-N 3.4Å; R772-N774 VanDerWaalsContact C-N 3.31Å; R772-N774 PolarHBondContact O-N 2.96Å; R772-I775 PolarHBondContact O-N 3.47Å; R772-I775 VanDerWaalsContact O-N 3.16Å; R772-E776 WeakPolarHBondContact CD-OE1 3.45Å; R772-E776 HydrophobicContact CG-CG 4.46Å; R772-E776 VanDerWaalsContact CG-OE1 3.32Å; R772-E776 WeakPolarHBondContact CG-OE1 3.37Å; R772-E776 WeakPolarHBondContact O-CG 3.5Å; R772-E776 PolarHBondContact O-N 2.82Å
773	A	92.1	Very high	87	Confident	33 Å²	33	57.2 Å²	57.2	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-59.7	-41	178.6	0	0	0	0	0	112.2	C769 A770 L771 E776 R777	C769-A773 PolarHBondContact O-N 3.38Å; A770-A773 PolarHBondContact O-N 2.94Å; L771-A773 VanDerWaalsContact C-N 3.35Å; L771-A773 PolarHBondContact O-N 2.81Å; A773-E776 PolarHBondContact O-N 3.45Å; A773-R777 VanDerWaalsContact O-CG 3.28Å; A773-R777 WeakPolarHBondContact O-CG 3.44Å; A773-R777 PolarHBondContact O-N 3.48Å
774	N	93.4	Very high	87.7	Confident	43 Å²	43	56.4 Å²	56.4	23%	0.23	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-39.6	176.6	-69.8	-10.4	0	0	0	112.3	Y595 A770 L771 R772 F778	Y595-N774 HydrophobicContact CE1-CB 4.2Å; Y595-N774 HydrophobicContact CE2-CB 4.22Å; A770-N774 PolarHBondContact O-N 2.94Å; L771-N774 PolarHBondContact O-N 3.28Å; R772-N774 VanDerWaalsContact C-N 3.31Å; R772-N774 PolarHBondContact O-N 2.96Å; N774-F778 WeakPolarHBondContact O-CB 3.22Å; N774-F778 PolarHBondContact O-N 3.39Å
775	I	94.3	Very high	87.2	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-66	-43.9	177.4	-66	159.2	0	0	0	111.2	Y595 E598 Y599 Q602 L771 R772 F778 N779	Y595-I775 HydrophobicContact CD1-CG1 4Å; Y595-I775 HydrophobicContact CG-CG1 4.31Å; E598-I775 HydrophobicContact CB-CD1 3.67Å; E598-I775 HydrophobicContact CB-CG1 4.17Å; Y599-I775 HydrophobicContact CD2-CG2 3.39Å; Y599-I775 HydrophobicContact CE2-CG2 4.36Å; Y599-I775 HydrophobicContact CG-CG2 3.81Å; Q602-I775 HydrophobicContact CG-CD1 4.45Å; Q602-I775 VanDerWaalsContact OE1-CD1 3.31Å; L771-I775 HydrophobicContact CD1-CD1 4.14Å; L771-I775 HydrophobicContact CD1-CG1 4.42Å; L771-I775 HydrophobicContact CG-CD1 3.86Å; L771-I775 WeakPolarHBondContact O-CD1 3.37Å; L771-I775 VanDerWaalsContact O-CG1 3.25Å; L771-I775 WeakPolarHBondContact O-CG1 2.97Å; L771-I775 PolarHBondContact O-N 3.21Å; R772-I775 PolarHBondContact O-N 3.47Å; R772-I775 VanDerWaalsContact O-N 3.16Å; I775-F778 PolarHBondContact O-N 3.21Å; I775-N779 WeakPolarHBondContact O-CB 3.42Å; I775-N779 PolarHBondContact O-N 2.78Å
776	E	91.5	Very high	86.1	Confident	112 Å²	112	66.7 Å²	66.7	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-45.7	177.7	-74.5	168.6	-176	0	0	111	R772 A773 N779 A780	R772-E776 WeakPolarHBondContact CD-OE1 3.45Å; R772-E776 HydrophobicContact CG-CG 4.46Å; R772-E776 VanDerWaalsContact CG-OE1 3.32Å; R772-E776 WeakPolarHBondContact CG-OE1 3.37Å; R772-E776 WeakPolarHBondContact O-CG 3.5Å; R772-E776 PolarHBondContact O-N 2.82Å; A773-E776 PolarHBondContact O-N 3.45Å; E776-N779 PolarHBondContact O-N 3.43Å; E776-A780 VanDerWaalsContact O-CB 3.27Å; E776-A780 WeakPolarHBondContact O-CB 3.49Å; E776-A780 PolarHBondContact O-N 3.01Å
777	R	89.4	Confident	84.6	Confident	141 Å²	141	69.4 Å²	69.4	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-45.6	175.1	-71.8	172	-177.2	178.7	-1.4	112.5	A773 R781	A773-R777 VanDerWaalsContact O-CG 3.28Å; A773-R777 WeakPolarHBondContact O-CG 3.44Å; A773-R777 PolarHBondContact O-N 3.48Å; R777-R781 VanDerWaalsContact O-CB 3.26Å; R777-R781 WeakPolarHBondContact O-CB 3.28Å; R777-R781 PolarHBondContact O-N 3.46Å
778	F	91.8	Very high	83.2	Confident	1 Å²	1	69.1 Å²	69.1	0%	0.004	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-49.8	176	163.3	-101.9	0	0	0	111.7	E486 H593 Y595 Q596 N774 I775 R781 R782 Y783	E486-F778 VanDerWaalsContact OE1-CD2 3.27Å; E486-F778 WeakPolarHBondContact OE1-CD2 3.41Å; H593-F778 HydrophobicContact CB-CZ 4.1Å; H593-F778 AromaticContact CE1-CD2 3.59Å; H593-F778 AromaticContact CE1-CE2 3.32Å; H593-F778 WeakPolarHBondContact CE1-CE2 3.43Å; H593-F778 AromaticContact CE1-CZ 3.81Å; H593-F778 AromaticContact CG-CE2 3.78Å; H593-F778 AromaticContact CG-CZ 3.65Å; H593-F778 AromaticContact ND1-CD2 3.79Å; H593-F778 AromaticContact ND1-CE1 3.74Å; H593-F778 AromaticContact ND1-CE2 3.21Å; H593-F778 WeakPolarHBondContact ND1-CE2 3.47Å; H593-F778 AromaticContact ND1-CZ 3.17Å; H593-F778 WeakPolarHBondContact ND1-CZ 3.32Å; H593-F778 AromaticContact NE2-CE2 3.96Å; Y595-F778 HydrophobicContact CD2-CB 3.67Å; Y595-F778 HydrophobicContact CD2-CD1 4.46Å; Y595-F778 HydrophobicContact CD2-CD2 4.26Å; Y595-F778 AromaticContact CD2-CG 3.87Å; Y595-F778 HydrophobicContact CD2-CG 3.87Å; Y595-F778 HydrophobicContact CE2-CB 4.47Å; Y595-F778 HydrophobicContact CG-CB 4.35Å; Y595-F778 HydrophobicContact CG-CG 4.37Å; Q596-F778 HydrophobicContact CG-CE1 3.92Å; Q596-F778 HydrophobicContact CG-CZ 4.14Å; N774-F778 WeakPolarHBondContact O-CB 3.22Å; N774-F778 PolarHBondContact O-N 3.39Å; I775-F778 PolarHBondContact O-N 3.21Å; F778-R781 PolarHBondContact O-N 2.98Å; F778-R782 HydrophobicContact CE2-CB 4.49Å; F778-R782 WeakPolarHBondContact O-CB 3.27Å; F778-R782 PolarHBondContact O-N 2.85Å; F778-Y783 AromaticContact CE1-CE2 3.86Å; F778-Y783 HydrophobicContact CE1-CE2 3.86Å; F778-Y783 HydrophobicContact CZ-CE2 4.2Å
779	N	92.3	Very high	81.6	Confident	15 Å²	15	71 Å²	71	8%	0.08	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-41.8	-178	-76.4	-26.7	0	0	0	111.6	Y510 I775 E776 R782 Y783	Y510-N779 PolarHBondContact OH-ND2 2.99Å; Y510-N779 PolarHBondContact OH-OD1 3.37Å; I775-N779 WeakPolarHBondContact O-CB 3.42Å; I775-N779 PolarHBondContact O-N 2.78Å; E776-N779 PolarHBondContact O-N 3.43Å; N779-R782 PolarHBondContact O-N 2.86Å; N779-Y783 HydrophobicContact CB-CD2 4.13Å; N779-Y783 WeakPolarHBondContact O-CB 3.43Å; N779-Y783 WeakPolarHBondContact O-CD2 3.37Å; N779-Y783 PolarHBondContact O-N 3.01Å; N779-Y783 WeakPolarHBondContact OD1-CE2 3.3Å
780	A	87.2	Confident	79.9	Confident	49 Å²	49	72.8 Å²	72.8	41%	0.405	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-50.1	176	0	0	0	0	0	110.7	E776 R782 D784	E776-A780 VanDerWaalsContact O-CB 3.27Å; E776-A780 WeakPolarHBondContact O-CB 3.49Å; E776-A780 PolarHBondContact O-N 3.01Å; A780-R782 VanDerWaalsContact C-N 3.34Å; A780-R782 PolarHBondContact O-N 2.69Å; A780-D784 WeakPolarHBondContact O-CB 3.35Å; A780-D784 PolarHBondContact O-N 3.34Å; A780-D784 VanDerWaalsContact O-N 3.16Å
781	R	85.8	Confident	78.1	Confident	94 Å²	94	76.6 Å²	76.6	36%	0.355	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-41.1	179.8	-175.7	177.8	61.8	71	2.6	112.9	E486 E499 R777 F778	E486-R781 IonicContact OE1-NH2 3.34Å; E486-R781 PolarHBondContact OE1-NH2 3.37Å; E486-R781 IonicContact OE2-CZ 2.68Å; E486-R781 IonicContact OE2-NE 3.27Å; E486-R781 IonicContact OE2-NH2 2.68Å; E486-R781 PolarHBondContact OE2-NH2 2.8Å; E499-R781 IonicContact OE2-CZ 2.82Å; E499-R781 IonicContact OE2-NH1 3.38Å; E499-R781 PolarHBondContact OE2-NH1 3.46Å; E499-R781 IonicContact OE2-NH2 2.71Å; E499-R781 PolarHBondContact OE2-NH2 3.34Å; R777-R781 VanDerWaalsContact O-CB 3.26Å; R777-R781 WeakPolarHBondContact O-CB 3.28Å; R777-R781 PolarHBondContact O-N 3.46Å; F778-R781 PolarHBondContact O-N 2.98Å
782	R	87.2	Confident	76.4	Confident	47 Å²	47	80.4 Å²	80.4	18%	0.177	40%	0.397	C	S	.	.	H	α-helix	trans	-91.5	-32.3	-170	-170.9	175.4	179	112.5	-10.6	114.6	E499 V501 E507 F778 N779 A780	E499-R782 IonicContact OE1-CZ 3.74Å; E499-R782 IonicContact OE1-NH1 3.69Å; E499-R782 PolarHBondContact OE1-NH1 2.99Å; E499-R782 IonicContact OE2-NH1 2.94Å; E499-R782 PolarHBondContact OE2-NH1 3.06Å; E499-R782 VanDerWaalsContact OE2-NH1 3.1Å; V501-R782 HydrophobicContact CG2-CG 4.26Å; E507-R782 IonicContact OE1-CZ 2.76Å; E507-R782 IonicContact OE1-NE 3.5Å; E507-R782 PolarHBondContact OE1-NE 3.09Å; E507-R782 IonicContact OE1-NH2 3.45Å; E507-R782 PolarHBondContact OE1-NH2 3.38Å; E507-R782 IonicContact OE2-NE 3.96Å; E507-R782 IonicContact OE2-NH2 3.82Å; E507-R782 PolarHBondContact OE2-NH2 3.12Å; F778-R782 HydrophobicContact CE2-CB 4.49Å; F778-R782 WeakPolarHBondContact O-CB 3.27Å; F778-R782 PolarHBondContact O-N 2.85Å; N779-R782 PolarHBondContact O-N 2.86Å; A780-R782 VanDerWaalsContact C-N 3.34Å; A780-R782 PolarHBondContact O-N 2.69Å
783	Y	88.2	Confident	74.7	Confident	38 Å²	38	81.1 Å²	81.1	15%	0.149	41%	0.407	C	S	.	.	H	α-helix	trans	-118.7	-18.3	-171.6	-50.1	-70.4	0	0	0	114.2	E507 Y510 Q511 L514 Q596 F778 N779 R785	E507-Y783 VanDerWaalsContact OE1-CE1 3.25Å; E507-Y783 WeakPolarHBondContact OE1-CE1 3.28Å; E507-Y783 PolarHBondContact OE1-OH 3.36Å; Y510-Y783 HydrophobicContact CD1-CE1 4.14Å; Y510-Y783 HydrophobicContact CD1-CE2 4Å; Y510-Y783 AromaticContact CD1-CZ 3.59Å; Y510-Y783 WeakPolarHBondContact CD1-OH 3.3Å; Y510-Y783 HydrophobicContact CE1-CD2 4.22Å; Y510-Y783 HydrophobicContact CE1-CE1 4.42Å; Y510-Y783 AromaticContact CE1-CE2 3.46Å; Y510-Y783 HydrophobicContact CE1-CE2 3.46Å; Y510-Y783 VanDerWaalsContact CE1-CE2 3.46Å; Y510-Y783 AromaticContact CE1-CZ 3.56Å; Q511-Y783 HydrophobicContact CG-CD1 3.66Å; Q511-Y783 HydrophobicContact CG-CE1 3.57Å; L514-Y783 HydrophobicContact CD2-CD1 4.47Å; L514-Y783 HydrophobicContact CD2-CD2 3.48Å; L514-Y783 VanDerWaalsContact CD2-CD2 3.48Å; L514-Y783 HydrophobicContact CD2-CE2 4.28Å; L514-Y783 HydrophobicContact CD2-CG 3.62Å; Q596-Y783 PolarHBondContact NE2-OH 3.13Å; F778-Y783 AromaticContact CE1-CE2 3.86Å; F778-Y783 HydrophobicContact CE1-CE2 3.86Å; F778-Y783 HydrophobicContact CZ-CE2 4.2Å; N779-Y783 HydrophobicContact CB-CD2 4.13Å; N779-Y783 WeakPolarHBondContact O-CB 3.43Å; N779-Y783 WeakPolarHBondContact O-CD2 3.37Å; N779-Y783 PolarHBondContact O-N 3.01Å; N779-Y783 WeakPolarHBondContact OD1-CE2 3.3Å; Y783-R785 PolarHBondContact O-N 3.43Å; Y783-R785 VanDerWaalsContact O-N 3.15Å
784	D	82.3	Confident	73.2	Confident	53 Å²	53	85.3 Å²	85.3	28%	0.283	43%	0.432	S	S	.	.			trans	-83.3	94	-179.3	-160.5	-21.6	0	0	0	110.5	A780 T786 H787	A780-D784 WeakPolarHBondContact O-CB 3.35Å; A780-D784 PolarHBondContact O-N 3.34Å; A780-D784 VanDerWaalsContact O-N 3.16Å; D784-T786 PolarHBondContact O-N 2.91Å; D784-T786 PolarHBondContact OD1-N 2.66Å; D784-T786 VanDerWaalsContact OD1-N 3.09Å; D784-T786 PolarHBondContact OD1-OG1 2.77Å; D784-H787 IonicContact OD2-CD2 2.77Å; D784-H787 PolarHBondContact OD2-CD2 3.48Å; D784-H787 IonicContact OD2-CG 2.93Å; D784-H787 IonicContact OD2-NE2 3.08Å
785	R	61.1	Low	71.7	Confident	243 Å²	243	88.7 Å²	88.7	92%	0.917	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.7	176.5	-70.3	-176.7	171.3	178.6	-2.3	113.2	Y783	Y783-R785 PolarHBondContact O-N 3.43Å; Y783-R785 VanDerWaalsContact O-N 3.15Å
786	T	55.5	Low	70.3	Confident	120 Å²	120	92.2 Å²	92.2	74%	0.736	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-9.2	-176.5	27.3	0	0	0	0	113.8	D784	D784-T786 PolarHBondContact O-N 2.91Å; D784-T786 PolarHBondContact OD1-N 2.66Å; D784-T786 VanDerWaalsContact OD1-N 3.09Å; D784-T786 PolarHBondContact OD1-OG1 2.77Å
787	H	50.1	Low	69.3	Low	132 Å²	132	93.8 Å²	93.8	61%	0.611	48%	0.484	S	S	*	.			trans	-120.7	71	178.7	-67.1	-30.6	0	0	0	110.7	D784 N789	D784-H787 IonicContact OD2-CD2 2.77Å; D784-H787 PolarHBondContact OD2-CD2 3.48Å; D784-H787 IonicContact OD2-CG 2.93Å; D784-H787 IonicContact OD2-NE2 3.08Å; H787-N789 PolarHBondContact O-N 3.41Å
788	S	54.4	Low	68.9	Low	91 Å²	91	90 Å²	90	64%	0.636	48%	0.479	S	S	*	.			trans	-57.8	98.6	140.4	-65.4	0	0	0	0	105	P790	S788-P790 WeakPolarHBondContact O-CD 3.3Å
789	N	53.1	Low	67.9	Low	63 Å²	63	96 Å²	96	34%	0.337	51%	0.51	S	S	.	.			trans	-55.2	121.6	-178.3	166.6	0.3	0	0	0	106.6	H787 D791 F792	H787-N789 PolarHBondContact O-N 3.41Å; N789-D791 PolarHBondContact O-N 3.44Å; N789-D791 WeakPolarHBondContact OD1-CB 3.44Å; N789-D791 PolarHBondContact OD1-N 3.11Å; N789-D791 VanDerWaalsContact OD1-N 3.14Å; N789-F792 HydrophobicContact CB-CD2 3.64Å; N789-F792 HydrophobicContact CB-CE2 4.04Å; N789-F792 WeakPolarHBondContact ND2-CE2 3.31Å; N789-F792 WeakPolarHBondContact O-CA 3.39Å; N789-F792 PolarHBondContact O-N 3.42Å
790	P	54.4	Low	67.1	Low	97 Å²	97	102.9 Å²	102.9	63%	0.63	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-58.6	-23.6	-170.8	20.5	-31.9	0	0	0	112.6	S788 F792 L793	S788-P790 WeakPolarHBondContact O-CD 3.3Å; P790-F792 PolarHBondContact O-N 3.31Å; P790-L793 PolarHBondContact O-N 2.77Å
791	D	51.6	Low	66.6	Low	134 Å²	134	102.9 Å²	102.9	72%	0.717	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-65.6	-12.5	173.4	-61.5	-21.4	0	0	0	113.4	N789	N789-D791 PolarHBondContact O-N 3.44Å; N789-D791 WeakPolarHBondContact OD1-CB 3.44Å; N789-D791 PolarHBondContact OD1-N 3.11Å; N789-D791 VanDerWaalsContact OD1-N 3.14Å
792	F	55.8	Low	65.9	Low	98 Å²	98	102.1 Å²	102.1	43%	0.43	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-119.3	11.2	-177.7	-54.1	-52.2	0	0	0	113.6	P493 L494 N789 P790	P493-F792 HydrophobicContact CB-CE1 4.01Å; P493-F792 HydrophobicContact CB-CE2 4.49Å; P493-F792 HydrophobicContact CB-CZ 3.88Å; P493-F792 HydrophobicContact CG-CE1 4.02Å; P493-F792 HydrophobicContact CG-CZ 4.11Å; L494-F792 HydrophobicContact CD2-CD1 3.67Å; L494-F792 HydrophobicContact CD2-CE1 4.41Å; L494-F792 HydrophobicContact CG-CD1 4.18Å; L494-F792 HydrophobicContact CG-CE1 4.45Å; N789-F792 HydrophobicContact CB-CD2 3.64Å; N789-F792 HydrophobicContact CB-CE2 4.04Å; N789-F792 WeakPolarHBondContact ND2-CE2 3.31Å; N789-F792 WeakPolarHBondContact O-CA 3.39Å; N789-F792 PolarHBondContact O-N 3.42Å; P790-F792 PolarHBondContact O-N 3.31Å
793	L	58.1	Low	65.1	Low	99 Å²	99	106.3 Å²	106.3	52%	0.518	57%	0.57	S	S	.	*	S	Bend	trans	-74.4	148.4	166.3	-69.6	172.2	0	0	0	109.8	P790 V795	P790-L793 PolarHBondContact O-N 2.77Å; L793-V795 PolarHBondContact O-N 3.29Å
794	P	59.3	Low	64.3	Low	121 Å²	121	107.3 Å²	107.3	79%	0.786	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-53.7	128.6	170.9	-20.4	30.4	0	0	0	109.6	D796	P794-D796 PolarHBondContact O-N 2.81Å
795	V	63	Low	63.8	Low	114 Å²	114	110.8 Å²	110.8	69%	0.691	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-59.3	128.4	174.5	-179.1	0	0	0	0	108.2	L793 N797	L793-V795 PolarHBondContact O-N 3.29Å; V795-N797 PolarHBondContact O-N 3.12Å
796	D	63.6	Low	64	Low	74 Å²	74	110.8 Å²	110.8	40%	0.396	61%	0.606	S	S	.	*			trans	-67.3	100.3	173.9	-174.8	2.2	0	0	0	109.4	P794 C798 S801 V802	P794-D796 PolarHBondContact O-N 2.81Å; D796-C798 PolarHBondContact O-N 3.16Å; D796-C798 WeakPolarHBondContact OD1-CB 3.35Å; D796-C798 PolarHBondContact OD1-N 3.45Å; D796-S801 WeakPolarHBondContact OD2-CB 3.31Å; D796-S801 PolarHBondContact OD2-OG 3.03Å; D796-V802 WeakPolarHBondContact O-CG2 3.44Å
797	N	71.9	Confident	64.8	Low	145 Å²	145	109.9 Å²	109.9	78%	0.775	60%	0.6	S	S	*	*			trans	-86.1	6.9	178.9	-64.9	-39.5	0	0	0	112.5	V795 L799	V795-N797 PolarHBondContact O-N 3.12Å; N797-L799 PolarHBondContact O-N 3.04Å
798	C	79.7	Confident	65.8	Low	63 Å²	63	111 Å²	111	43%	0.426	61%	0.611	S	S	.	*			trans	-81.9	104.5	178	-174.9	0	0	0	0	110.6	D796 Q800 S801 V802	D796-C798 PolarHBondContact O-N 3.16Å; D796-C798 WeakPolarHBondContact OD1-CB 3.35Å; D796-C798 PolarHBondContact OD1-N 3.45Å; C798-Q800 PolarHBondContact O-N 3.17Å; C798-Q800 VanDerWaalsContact O-N 3.11Å; C798-S801 WeakPolarHBondContact O-CB 3.4Å; C798-S801 PolarHBondContact O-N 3.19Å; C798-V802 WeakPolarHBondContact O-CG2 3.43Å; C798-V802 PolarHBondContact O-N 2.65Å
799	L	72.4	Confident	67	Low	127 Å²	127	110.6 Å²	110.6	67%	0.665	60%	0.601	S	S	*	*	H	α-helix	trans	-47.8	-39.6	174.9	-96.6	146.2	0	0	0	113.2	N797 S801 L803	N797-L799 PolarHBondContact O-N 3.04Å; L799-S801 VanDerWaalsContact C-N 3.34Å; L799-S801 PolarHBondContact O-N 3.42Å; L799-L803 HydrophobicContact CD2-CD1 3.97Å; L799-L803 VanDerWaalsContact O-CB 3.24Å; L799-L803 WeakPolarHBondContact O-CB 3.4Å; L799-L803 WeakPolarHBondContact O-CG 3.38Å; L799-L803 PolarHBondContact O-N 2.69Å
800	Q	74.8	Confident	68.3	Low	159 Å²	159	111.7 Å²	111.7	74%	0.743	61%	0.612	S	S	*	*	H	α-helix	trans	-68.4	-34	-179.7	-141.1	78	9.3	0	0	112.8	C798 G804	C798-Q800 PolarHBondContact O-N 3.17Å; C798-Q800 VanDerWaalsContact O-N 3.11Å; Q800-G804 PolarHBondContact O-N 3.27Å
801	S	75.4	Confident	69.5	Low	48 Å²	48	115 Å²	115	34%	0.336	62%	0.619	S	S	.	*	H	α-helix	trans	-74.9	-47.2	177.9	-176.6	0	0	0	0	110.6	D796 C798 L799 G804 Q805	D796-S801 WeakPolarHBondContact OD2-CB 3.31Å; D796-S801 PolarHBondContact OD2-OG 3.03Å; C798-S801 WeakPolarHBondContact O-CB 3.4Å; C798-S801 PolarHBondContact O-N 3.19Å; L799-S801 VanDerWaalsContact C-N 3.34Å; L799-S801 PolarHBondContact O-N 3.42Å; S801-G804 PolarHBondContact O-N 3.42Å; S801-G804 VanDerWaalsContact O-N 3.16Å; S801-Q805 PolarHBondContact O-N 3.07Å
802	V	71.4	Confident	70.9	Confident	78 Å²	78	114.1 Å²	114.1	47%	0.473	61%	0.614	S	S	.	*	H	α-helix	trans	-62.7	-45.5	178.8	177.2	0	0	0	0	111.8	D796 C798 G804 Q805	D796-V802 WeakPolarHBondContact O-CG2 3.44Å; C798-V802 WeakPolarHBondContact O-CG2 3.43Å; C798-V802 PolarHBondContact O-N 2.65Å; V802-G804 VanDerWaalsContact C-N 3.26Å; V802-G804 PolarHBondContact O-N 3.16Å; V802-Q805 PolarHBondContact O-N 3.47Å
803	L	70.4	Confident	72.3	Confident	136 Å²	136	114.4 Å²	114.4	71%	0.712	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-17.4	177.3	-65.2	171.9	0	0	0	113.2	L799	L799-L803 HydrophobicContact CD2-CD1 3.97Å; L799-L803 VanDerWaalsContact O-CB 3.24Å; L799-L803 WeakPolarHBondContact O-CB 3.4Å; L799-L803 WeakPolarHBondContact O-CG 3.38Å; L799-L803 PolarHBondContact O-N 2.69Å
804	G	71.6	Confident	73.4	Confident	59 Å²	59	114.4 Å²	114.4	61%	0.608	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-15	175.7	0	0	0	0	0	113.8	Q800 S801 V802 R806	Q800-G804 PolarHBondContact O-N 3.27Å; S801-G804 PolarHBondContact O-N 3.42Å; S801-G804 VanDerWaalsContact O-N 3.16Å; V802-G804 VanDerWaalsContact C-N 3.26Å; V802-G804 PolarHBondContact O-N 3.16Å; G804-R806 PolarHBondContact O-N 3.43Å
805	Q	72	Confident	74.3	Confident	126 Å²	126	113.9 Å²	113.9	59%	0.589	60%	0.601	S	S	*	*	S	Bend	trans	-73.9	124.9	175.8	-76	-172.3	-2	0	0	110.7	S801 V802 V807	S801-Q805 PolarHBondContact O-N 3.07Å; V802-Q805 PolarHBondContact O-N 3.47Å; Q805-V807 PolarHBondContact O-N 3.14Å
806	R	65.8	Low	75.4	Confident	242 Å²	242	112.9 Å²	112.9	91%	0.913	59%	0.592	S	S	*	*			trans	-77.8	105.6	166.6	-76	-170.9	177.8	-164.5	-1	108.6	G804	G804-R806 PolarHBondContact O-N 3.43Å
807	V	71.6	Confident	76.4	Confident	101 Å²	101	114.6 Å²	114.6	61%	0.612	59%	0.593	S	S	*	*			trans	-88.5	117.3	170.6	-177.8	0	0	0	0	107.8	Q805 L809	Q805-V807 PolarHBondContact O-N 3.14Å; V807-L809 HydrophobicContact CG1-CD2 4.23Å; V807-L809 PolarHBondContact O-N 3.41Å; V807-L809 VanDerWaalsContact O-N 3.1Å
808	D	70.8	Confident	76.9	Confident	157 Å²	157	112.5 Å²	112.5	84%	0.84	58%	0.582	S	S	*	*			trans	-73.2	101.7	173.6	-74.5	-33.2	0	0	0	109.1
809	L	79.4	Confident	77.1	Confident	82 Å²	82	114.1 Å²	114.1	43%	0.429	59%	0.586	S	S	.	*			trans	-78.6	138.5	178.3	-64.7	170.1	0	0	0	109.9	V807 F813 Q814	V807-L809 HydrophobicContact CG1-CD2 4.23Å; V807-L809 PolarHBondContact O-N 3.41Å; V807-L809 VanDerWaalsContact O-N 3.1Å; L809-F813 HydrophobicContact CB-CD1 4.18Å; L809-F813 HydrophobicContact CD1-CD1 3.99Å; L809-F813 HydrophobicContact CD1-CE1 4.03Å; L809-F813 HydrophobicContact CD2-CD1 4.18Å; L809-F813 HydrophobicContact CD2-CE1 4.33Å; L809-F813 HydrophobicContact CG-CD1 4.35Å; L809-Q814 HydrophobicContact CB-CG 4.02Å; L809-Q814 PolarHBondContact O-NE2 3.23Å
810	P	82.3	Confident	77.8	Confident	86 Å²	86	114.1 Å²	114.1	56%	0.558	58%	0.578	S	S	*	*			trans	-53.8	142.3	175.4	-24	32.6	0	0	0	111.8	D812 F813 Q814	P810-D812 PolarHBondContact O-N 2.96Å; P810-F813 HydrophobicContact CB-CB 4.4Å; P810-F813 WeakPolarHBondContact O-CA 3.38Å; P810-F813 WeakPolarHBondContact O-CB 3.17Å; P810-F813 PolarHBondContact O-N 3.12Å; P810-Q814 PolarHBondContact O-N 3.41Å; P810-Q814 VanDerWaalsContact O-N 3.13Å
811	E	78.1	Confident	78.2	Confident	167 Å²	167	108.1 Å²	108.1	78%	0.78	55%	0.55	S	S	*	*	H	α-helix	trans	-55.6	-38.4	-178.9	-71.3	-177.3	167	0	0	112.2	F813 Q814 M815	E811-F813 VanDerWaalsContact C-N 3.29Å; E811-F813 PolarHBondContact O-N 2.8Å; E811-Q814 PolarHBondContact O-N 3Å; E811-M815 PolarHBondContact O-N 2.94Å
812	D	82.4	Confident	78.6	Confident	115 Å²	115	111.8 Å²	111.8	62%	0.615	56%	0.562	S	S	*	*	H	α-helix	trans	-62.4	-35.7	175.6	-64.7	-24.1	0	0	0	112.4	P810 N816	P810-D812 PolarHBondContact O-N 2.96Å; D812-N816 VanDerWaalsContact O-CB 3.24Å; D812-N816 WeakPolarHBondContact O-CB 3.48Å; D812-N816 PolarHBondContact O-N 3.39Å; D812-N816 PolarHBondContact O-ND2 2.91Å
813	F	85.1	Confident	79.1	Confident	104 Å²	104	116 Å²	116	46%	0.456	57%	0.57	S	S	.	*	H	α-helix	trans	-69.4	-44.2	177	-176.9	-90.4	0	0	0	110.4	L809 P810 E811 M815 N816 Y817	L809-F813 HydrophobicContact CB-CD1 4.18Å; L809-F813 HydrophobicContact CD1-CD1 3.99Å; L809-F813 HydrophobicContact CD1-CE1 4.03Å; L809-F813 HydrophobicContact CD2-CD1 4.18Å; L809-F813 HydrophobicContact CD2-CE1 4.33Å; L809-F813 HydrophobicContact CG-CD1 4.35Å; P810-F813 HydrophobicContact CB-CB 4.4Å; P810-F813 WeakPolarHBondContact O-CA 3.38Å; P810-F813 WeakPolarHBondContact O-CB 3.17Å; P810-F813 PolarHBondContact O-N 3.12Å; E811-F813 VanDerWaalsContact C-N 3.29Å; E811-F813 PolarHBondContact O-N 2.8Å; F813-M815 PolarHBondContact O-N 3.41Å; F813-N816 PolarHBondContact O-N 3Å; F813-Y817 HydrophobicContact CE1-CD2 4.4Å; F813-Y817 HydrophobicContact CE1-CG 4.35Å; F813-Y817 HydrophobicContact CZ-CD2 4.34Å; F813-Y817 WeakPolarHBondContact O-CB 3.4Å; F813-Y817 PolarHBondContact O-N 3.47Å
814	Q	79.6	Confident	79.5	Confident	99 Å²	99	112 Å²	112	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-60.4	-48.2	178.5	-62	-178.2	22.1	0	0	110.8	L809 P810 E811 N816 Y817 D818	L809-Q814 HydrophobicContact CB-CG 4.02Å; L809-Q814 PolarHBondContact O-NE2 3.23Å; P810-Q814 PolarHBondContact O-N 3.41Å; P810-Q814 VanDerWaalsContact O-N 3.13Å; E811-Q814 PolarHBondContact O-N 3Å; Q814-N816 PolarHBondContact O-N 3.34Å; Q814-Y817 PolarHBondContact O-N 3.38Å; Q814-D818 PolarHBondContact O-N 3.35Å
815	M	78.8	Confident	79.9	Confident	110 Å²	110	111.7 Å²	111.7	54%	0.542	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-44.1	178.4	-172.5	-176.6	69	0	0	112.6	E811 F813 Y817 L819	E811-M815 PolarHBondContact O-N 2.94Å; F813-M815 PolarHBondContact O-N 3.41Å; M815-Y817 VanDerWaalsContact C-N 3.35Å; M815-L819 PolarHBondContact O-N 3.28Å
816	N	85.8	Confident	80.3	Confident	93 Å²	93	113 Å²	113	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-72.4	-30.2	179.3	-72.6	-43	0	0	0	112.6	D812 F813 Q814 W820	D812-N816 VanDerWaalsContact O-CB 3.24Å; D812-N816 WeakPolarHBondContact O-CB 3.48Å; D812-N816 PolarHBondContact O-N 3.39Å; D812-N816 PolarHBondContact O-ND2 2.91Å; F813-N816 PolarHBondContact O-N 3Å; Q814-N816 PolarHBondContact O-N 3.34Å; N816-W820 WeakPolarHBondContact O-CB 3.25Å; N816-W820 PolarHBondContact O-N 2.73Å
817	Y	85.3	Confident	80.8	Confident	109 Å²	109	105.2 Å²	105.2	43%	0.427	52%	0.52	S	S	.	.	H	α-helix	trans	-70.2	-41.2	177.8	-174.6	-107.5	0	0	0	111.4	F813 Q814 M815 W820 L821	F813-Y817 HydrophobicContact CE1-CD2 4.4Å; F813-Y817 HydrophobicContact CE1-CG 4.35Å; F813-Y817 HydrophobicContact CZ-CD2 4.34Å; F813-Y817 WeakPolarHBondContact O-CB 3.4Å; F813-Y817 PolarHBondContact O-N 3.47Å; Q814-Y817 PolarHBondContact O-N 3.38Å; M815-Y817 VanDerWaalsContact C-N 3.35Å; Y817-W820 HydrophobicContact CD2-CE3 4.38Å; Y817-W820 HydrophobicContact CE2-CE3 4.11Å; Y817-W820 HydrophobicContact CE2-CZ3 4.29Å; Y817-W820 PolarHBondContact O-N 3.09Å; Y817-L821 HydrophobicContact CD1-CD1 3.79Å; Y817-L821 HydrophobicContact CD1-CG 4.29Å; Y817-L821 HydrophobicContact CE1-CD1 3.39Å; Y817-L821 HydrophobicContact CE1-CG 3.93Å; Y817-L821 WeakPolarHBondContact O-CB 3.46Å; Y817-L821 WeakPolarHBondContact O-CG 3.38Å; Y817-L821 PolarHBondContact O-N 2.95Å
818	D	82.9	Confident	80.9	Confident	102 Å²	102	105.7 Å²	105.7	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.3	-70.5	-25.2	0	0	0	111.3	Q814 W820 L821 E822	Q814-D818 PolarHBondContact O-N 3.35Å; D818-W820 VanDerWaalsContact C-N 3.32Å; D818-W820 PolarHBondContact O-N 2.88Å; D818-L821 PolarHBondContact O-N 2.88Å; D818-E822 WeakPolarHBondContact O-CB 3.49Å; D818-E822 PolarHBondContact O-N 2.84Å
819	L	83.3	Confident	80.7	Confident	97 Å²	97	104.2 Å²	104.2	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-38.8	174.1	-79.6	163.5	0	0	0	112.5	M815 R823	M815-L819 PolarHBondContact O-N 3.28Å; L819-R823 VanDerWaalsContact O-CB 3.29Å; L819-R823 WeakPolarHBondContact O-CB 3.32Å; L819-R823 PolarHBondContact O-N 3.43Å
820	W	86.7	Confident	80.2	Confident	127 Å²	127	104.1 Å²	104.1	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-68	-44.5	176.6	178.6	88.9	0	0	0	111.7	N816 Y817 D818 E822 R823 E824 V825	N816-W820 WeakPolarHBondContact O-CB 3.25Å; N816-W820 PolarHBondContact O-N 2.73Å; Y817-W820 HydrophobicContact CD2-CE3 4.38Å; Y817-W820 HydrophobicContact CE2-CE3 4.11Å; Y817-W820 HydrophobicContact CE2-CZ3 4.29Å; Y817-W820 PolarHBondContact O-N 3.09Å; D818-W820 VanDerWaalsContact C-N 3.32Å; D818-W820 PolarHBondContact O-N 2.88Å; W820-E822 VanDerWaalsContact C-N 3.3Å; W820-E822 PolarHBondContact O-N 2.88Å; W820-R823 PolarHBondContact O-N 3.37Å; W820-E824 HydrophobicContact CD2-CB 4.29Å; W820-E824 HydrophobicContact CD2-CG 4.45Å; W820-E824 HydrophobicContact CG-CG 4.24Å; W820-E824 HydrophobicContact CZ2-CB 4.17Å; W820-E824 VanDerWaalsContact O-CB 3.32Å; W820-E824 WeakPolarHBondContact O-CB 3.4Å; W820-E824 PolarHBondContact O-N 2.91Å; W820-V825 HydrophobicContact CE3-CG2 4.33Å; W820-V825 HydrophobicContact CH2-CG2 3.82Å; W820-V825 HydrophobicContact CZ3-CG2 3.65Å
821	L	83.6	Confident	79.5	Confident	32 Å²	32	103.1 Å²	103.1	17%	0.168	51%	0.507	C	S	.	.	I	π-helix	trans	-58.6	-46	175.1	-81.6	173.8	0	0	0	110.6	Y817 D818 R823 V825 F826	Y817-L821 HydrophobicContact CD1-CD1 3.79Å; Y817-L821 HydrophobicContact CD1-CG 4.29Å; Y817-L821 HydrophobicContact CE1-CD1 3.39Å; Y817-L821 HydrophobicContact CE1-CG 3.93Å; Y817-L821 WeakPolarHBondContact O-CB 3.46Å; Y817-L821 WeakPolarHBondContact O-CG 3.38Å; Y817-L821 PolarHBondContact O-N 2.95Å; D818-L821 PolarHBondContact O-N 2.88Å; L821-R823 VanDerWaalsContact C-N 3.35Å; L821-R823 PolarHBondContact O-N 3.48Å; L821-V825 HydrophobicContact CD2-CB 4.18Å; L821-V825 HydrophobicContact CD2-CG2 3.89Å; L821-V825 CarbonylContact O-C 3.5Å; L821-V825 WeakPolarHBondContact O-CA 3.49Å; L821-V825 VanDerWaalsContact O-CB 3.31Å; L821-V825 WeakPolarHBondContact O-CB 3.49Å; L821-V825 PolarHBondContact O-N 3.35Å; L821-F826 HydrophobicContact CB-CD2 4.24Å; L821-F826 HydrophobicContact CB-CE2 3.82Å; L821-F826 HydrophobicContact CB-CZ 4.48Å; L821-F826 PolarHBondContact O-N 3.45Å
822	E	83.8	Confident	78.9	Confident	126 Å²	126	103.3 Å²	103.3	59%	0.589	50%	0.501	S	S	*	.	I	π-helix	trans	-62.8	-43	179.3	-155.4	167.8	-155.9	0	0	111.3	D818 W820 S827	D818-E822 WeakPolarHBondContact O-CB 3.49Å; D818-E822 PolarHBondContact O-N 2.84Å; W820-E822 VanDerWaalsContact C-N 3.3Å; W820-E822 PolarHBondContact O-N 2.88Å; E822-S827 WeakPolarHBondContact O-CB 3.37Å; E822-S827 PolarHBondContact O-N 3.37Å; E822-S827 PolarHBondContact O-OG 3.21Å
823	R	81.6	Confident	78.2	Confident	167 Å²	167	106 Å²	106	63%	0.63	51%	0.509	S	S	*	.	I	π-helix	trans	-78.3	-40.9	-177.3	-161	-178.3	83.5	-174.8	3.9	114.9	L819 W820 L821 S827	L819-R823 VanDerWaalsContact O-CB 3.29Å; L819-R823 WeakPolarHBondContact O-CB 3.32Å; L819-R823 PolarHBondContact O-N 3.43Å; W820-R823 PolarHBondContact O-N 3.37Å; L821-R823 VanDerWaalsContact C-N 3.35Å; L821-R823 PolarHBondContact O-N 3.48Å; R823-S827 VanDerWaalsContact CA-OG 3.25Å; R823-S827 WeakPolarHBondContact CA-OG 3.35Å; R823-S827 PolarHBondContact O-OG 3.45Å; R823-S827 VanDerWaalsContact O-OG 3.08Å
824	E	80.1	Confident	77.1	Confident	51 Å²	51	108.6 Å²	108.6	24%	0.238	52%	0.523	C	S	.	.	I	π-helix	trans	-104.8	-22.6	-168.1	-60.3	-65.8	153.4	0	0	112.9	W820 K828	W820-E824 HydrophobicContact CD2-CB 4.29Å; W820-E824 HydrophobicContact CD2-CG 4.45Å; W820-E824 HydrophobicContact CG-CG 4.24Å; W820-E824 HydrophobicContact CZ2-CB 4.17Å; W820-E824 VanDerWaalsContact O-CB 3.32Å; W820-E824 WeakPolarHBondContact O-CB 3.4Å; W820-E824 PolarHBondContact O-N 2.91Å; E824-K828 VanDerWaalsContact OE2-CE 3.28Å; E824-K828 WeakPolarHBondContact OE2-CE 3.45Å; E824-K828 IonicContact OE2-NZ 2.78Å; E824-K828 PolarHBondContact OE2-NZ 2.99Å
825	V	78.5	Confident	76.2	Confident	53 Å²	53	110 Å²	110	32%	0.321	53%	0.533	S	S	.	.	I	π-helix	trans	-111.3	-50.4	-176.8	-175.2	0	0	0	0	111.7	W820 L821	W820-V825 HydrophobicContact CE3-CG2 4.33Å; W820-V825 HydrophobicContact CH2-CG2 3.82Å; W820-V825 HydrophobicContact CZ3-CG2 3.65Å; L821-V825 HydrophobicContact CD2-CB 4.18Å; L821-V825 HydrophobicContact CD2-CG2 3.89Å; L821-V825 CarbonylContact O-C 3.5Å; L821-V825 WeakPolarHBondContact O-CA 3.49Å; L821-V825 VanDerWaalsContact O-CB 3.31Å; L821-V825 WeakPolarHBondContact O-CB 3.49Å; L821-V825 PolarHBondContact O-N 3.35Å
826	F	81.2	Confident	75.2	Confident	152 Å²	152	112.1 Å²	112.1	67%	0.667	55%	0.546	S	S	*	.	I	π-helix	trans	-85.7	-39.3	-174.1	-58.4	-44.5	0	0	0	113.7	L821	L821-F826 HydrophobicContact CB-CD2 4.24Å; L821-F826 HydrophobicContact CB-CE2 3.82Å; L821-F826 HydrophobicContact CB-CZ 4.48Å; L821-F826 PolarHBondContact O-N 3.45Å
827	S	76.2	Confident	73.4	Confident	79 Å²	79	118.9 Å²	118.9	55%	0.552	57%	0.574	S	S	*	*	S	Bend	trans	-91.1	-7	-177.7	57.9	0	0	0	0	114.5	E822 R823	E822-S827 WeakPolarHBondContact O-CB 3.37Å; E822-S827 PolarHBondContact O-N 3.37Å; E822-S827 PolarHBondContact O-OG 3.21Å; R823-S827 VanDerWaalsContact CA-OG 3.25Å; R823-S827 WeakPolarHBondContact CA-OG 3.35Å; R823-S827 PolarHBondContact O-OG 3.45Å; R823-S827 VanDerWaalsContact O-OG 3.08Å
828	K	72.6	Confident	72.8	Confident	111 Å²	111	119.4 Å²	119.4	48%	0.483	58%	0.582	S	S	.	*	S	Bend	trans	-85.6	122.5	166.8	-81	-174.3	173.6	173.1	0	109.9	E824 I830	E824-K828 VanDerWaalsContact OE2-CE 3.28Å; E824-K828 WeakPolarHBondContact OE2-CE 3.45Å; E824-K828 IonicContact OE2-NZ 2.78Å; E824-K828 PolarHBondContact OE2-NZ 2.99Å; K828-I830 PolarHBondContact O-N 3.42Å; K828-I830 VanDerWaalsContact O-N 3.1Å
829	P	68.4	Low	72.3	Confident	127 Å²	127	120.3 Å²	120.3	83%	0.825	58%	0.584	S	S	*	*			trans	-66	114.1	172.8	25.7	-30.3	0	0	0	108.9	S831	P829-S831 PolarHBondContact O-N 3.03Å
830	I	68	Low	71.7	Confident	80 Å²	80	121.6 Å²	121.6	41%	0.41	59%	0.588	S	S	.	*			trans	-69.4	115.4	175.1	-61.1	171.4	0	0	0	107.6	K828 W832	K828-I830 PolarHBondContact O-N 3.42Å; K828-I830 VanDerWaalsContact O-N 3.1Å; I830-W832 VanDerWaalsContact C-N 3.31Å; I830-W832 HydrophobicContact CB-CD2 4.46Å; I830-W832 HydrophobicContact CB-CZ2 4.18Å; I830-W832 HydrophobicContact CD1-CH2 4.29Å; I830-W832 HydrophobicContact CD1-CZ2 3.89Å; I830-W832 HydrophobicContact CG2-CD2 3.73Å; I830-W832 HydrophobicContact CG2-CE3 4.08Å; I830-W832 HydrophobicContact CG2-CG 4.16Å; I830-W832 HydrophobicContact CG2-CH2 4.28Å; I830-W832 HydrophobicContact CG2-CZ2 3.94Å; I830-W832 HydrophobicContact CG2-CZ3 4.34Å; I830-W832 PolarHBondContact O-N 3.17Å
831	S	68	Low	70.8	Confident	64 Å²	64	121.2 Å²	121.2	45%	0.448	59%	0.594	S	S	.	*			trans	-76.5	85.3	171.4	-171.9	0	0	0	0	109	P829 E833 E834	P829-S831 PolarHBondContact O-N 3.03Å; S831-E833 PolarHBondContact O-N 3.15Å; S831-E833 VanDerWaalsContact O-N 3.09Å; S831-E834 PolarHBondContact O-N 3.25Å; S831-E834 VanDerWaalsContact O-N 3.14Å
832	W	65.7	Low	70	Confident	172 Å²	172	126.8 Å²	126.8	65%	0.652	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-20.6	-178.4	-64.2	100.1	0	0	0	113.4	I830	I830-W832 VanDerWaalsContact C-N 3.31Å; I830-W832 HydrophobicContact CB-CD2 4.46Å; I830-W832 HydrophobicContact CB-CZ2 4.18Å; I830-W832 HydrophobicContact CD1-CH2 4.29Å; I830-W832 HydrophobicContact CD1-CZ2 3.89Å; I830-W832 HydrophobicContact CG2-CD2 3.73Å; I830-W832 HydrophobicContact CG2-CE3 4.08Å; I830-W832 HydrophobicContact CG2-CG 4.16Å; I830-W832 HydrophobicContact CG2-CH2 4.28Å; I830-W832 HydrophobicContact CG2-CZ2 3.94Å; I830-W832 HydrophobicContact CG2-CZ3 4.34Å; I830-W832 PolarHBondContact O-N 3.17Å
833	E	68	Low	69.1	Low	170 Å²	170	126.9 Å²	126.9	79%	0.794	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-28.5	177.6	-68.5	-176.1	171.8	0	0	113.3	S831	S831-E833 PolarHBondContact O-N 3.15Å; S831-E833 VanDerWaalsContact O-N 3.09Å
834	E	61.7	Low	68.2	Low	159 Å²	159	124 Å²	124	74%	0.743	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-19.5	177.1	-74.7	-174.6	161.9	0	0	113.2	S831	S831-E834 PolarHBondContact O-N 3.25Å; S831-E834 VanDerWaalsContact O-N 3.14Å
835	L	59.5	Low	67.2	Low	128 Å²	128	129.6 Å²	129.6	67%	0.67	65%	0.652	S	S	*	*	S	Bend	trans	-89.8	-7.7	-175.9	-133.6	134.7	0	0	0	113.2
836	L	57.5	Low	66.3	Low	155 Å²	155	136 Å²	136	81%	0.812	68%	0.679	S	S	*	*			trans	-110.7	7	-179.2	-75.8	168.8	0	0	0	113.9
837	Q	48.8	Very low	64.9	Low	235 Å²	235	134.5 Å²	134.5	100%	1.098	68%	0.681	S	S	*	*			trans	-89.8	0	160.2	-75.2	-173.7	5.6	0	0	109.7

Retrieved 837 of 837 residues in 880.1 ms (Link to these results)

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