A0A096NRA5_PAPAN Loading...

Protein sel-1 homolog 1

Plays a role in the endoplasmic reticulum quality control (ERQC) system also called ER-associated degradation (ERAD) involved in ubiquitin-dependent degradation of misfolded endoplasmic reticulum proteins. Enhances SYVN1 stability. Plays a role in LPL maturation and secretion. Required for normal differentiation of the pancreas epithelium, and for normal exocrine function and survival of pancreatic cells. May play a role in Notch signaling.

AlphaFold DB , UniProt , Accession A0A096NRA5, Species PAPAN (Papio anubis, Olive baboon), Gene SEL1L, Length 794 aa.

						>A0A096NRA5_PAPAN|A0A096NRA5|SEL1L
MRVRIGLTLLLCAVLLSSASASSDEEGSQDESLDSKTTLTSDESVKDHTTAGRVVAGQIFLDSEESELESSIQEEEDSLKSQEGESVTEDLSFLESPNPENKDYEEPKKVRKPALTAIEGTAHGEPCHFPFLFLDKEYDECTSDGREDGRLWCATTYDYKADEKWGFCETEEEAAKRRQMQEAEMMYQTGMKILNGSNKKSQKREAYRYLQKAAGMNHTKALERVSYALLFGDYLPQNIQAAREMFEKLTEEGSPKGQTALGFLYASGLGVNSSQAKALVYYTFGALGGNLIAHMVLGYRYWAGIGVLQSCESALTHYRLVANHVASDISLTGGSVVQRIRLPDEVENPGMNSGMLEEDLIQYYQFLAEKGDVQAQVGLGQLHLHGGRGVEQNHQRAFDYFNLAANAGNSHAMAFLGKMYSEGSDIVPQSNETALHYFKKAADMGNPVGQSGLGMAYLYGRGVQVNYDLALKYFQKAAEQGWVDGQLQLGSMYYNGIGVKRDYKQALKYFNLASQGGHILAFYNLAQMHASGTGVMRSCHTAVELFKNVCERGRWSERLMTAYNSYKDGDYNAAVIQYLLLAEQGYEVAQSNAAFILDQREATIVGENETYPRALLHWNRAASQGYTVARIKLGDYHFYGFGTDVDYETAFIHYRLASEQQHSAQAMFNLGYMHEKGLGIKQDIHLAKRFYDMAAEASPDAQVPVFLALCKLGVVYFLQYIRETNIRDMFTQLDMDQLLGPEWDLYLMTIIALLLGTVIAYRQRQHQDLPAPRPPGPRPAPPQQEAPPEQQPPQ
					

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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	46.3	Very low	38.6	Very low	251 Å²	251	155.7 Å²	155.7	100%	1.236	79%	0.785	S	S	*	*				0	42.3	0	-146.5	168.1	-178.2	0	0	111.8
2	R	33.3	Very low	38.4	Very low	238 Å²	238	150.4 Å²	150.4	90%	0.898	77%	0.771	S	S	*	*			trans	-131.4	120.6	161.6	-78.7	177.7	173.9	174.1	-2.8	101.7
3	V	37.7	Very low	38.1	Very low	136 Å²	136	144.3 Å²	144.3	82%	0.824	76%	0.757	S	S	*	*	S	Bend	trans	159.6	-17.8	170.1	158.5	0	0	0	0	110.5
4	R	43.8	Very low	37.9	Very low	245 Å²	245	142.1 Å²	142.1	93%	0.925	75%	0.752	S	S	*	*	S	Bend	trans	-94.9	10.7	177	-86.5	-173	176.2	177.1	-1	117
5	I	42.5	Very low	37.7	Very low	134 Å²	134	143.1 Å²	143.1	69%	0.687	76%	0.757	S	S	*	*	S	Bend	trans	-113.9	-6.2	176.2	-61.6	168.5	0	0	0	111.5	L9	I5-L9 HydrophobicContact CG2-CD1 4.28Å
6	G	35.9	Very low	37.4	Very low	49 Å²	49	143.9 Å²	143.9	51%	0.505	76%	0.76	S	S	.	*	S	Bend	trans	-86.3	-15.8	-174.7	0	0	0	0	0	116.2
7	L	36.7	Very low	36.9	Very low	149 Å²	149	141.7 Å²	141.7	78%	0.78	76%	0.759	S	S	*	*	S	Bend	trans	-100.8	-18.4	-172	-145.5	75.5	0	0	0	114
8	T	40.8	Very low	36.7	Very low	110 Å²	110	140.3 Å²	140.3	68%	0.675	76%	0.762	S	S	*	*	S	Bend	trans	-88	-17.7	176.3	35	0	0	0	0	113.3
9	L	38.7	Very low	36.3	Very low	121 Å²	121	138.1 Å²	138.1	63%	0.634	77%	0.765	S	S	*	*	S	Bend	trans	-88.2	-13.6	177.2	-93.6	150	0	0	0	114	I5	I5-L9 HydrophobicContact CG2-CD1 4.28Å
10	L	34	Very low	35.7	Very low	132 Å²	132	137.4 Å²	137.4	69%	0.691	77%	0.77	S	S	*	*	S	Bend	trans	-86.6	-20.5	-177.3	-130.2	95.5	0	0	0	114
11	L	35.5	Very low	35.3	Very low	148 Å²	148	135.6 Å²	135.6	78%	0.775	77%	0.773	S	S	*	*	S	Bend	trans	-88.7	-17.5	176.7	-101.9	117.1	0	0	0	113.9
12	C	36.3	Very low	34.3	Very low	92 Å²	92	128.9 Å²	128.9	62%	0.622	75%	0.751	S	S	*	*	S	Bend	trans	-88.7	-11.9	175.5	-75.4	0	0	0	0	114
13	A	34.2	Very low	34	Very low	71 Å²	71	122.6 Å²	122.6	59%	0.587	74%	0.743	S	S	*	*	S	Bend	trans	-88.5	-8.3	-175.1	0	0	0	0	0	114.7
14	V	35.7	Very low	33.5	Very low	114 Å²	114	124 Å²	124	69%	0.691	75%	0.746	S	S	*	*	S	Bend	trans	-97	-8.2	-175	-178.5	0	0	0	0	113.2
15	L	34.6	Very low	32.8	Very low	157 Å²	157	121.3 Å²	121.3	82%	0.822	74%	0.744	S	S	*	*	S	Bend	trans	-106.2	7.4	-178.9	-73.6	169.9	0	0	0	114.9
16	L	33.2	Very low	32.1	Very low	155 Å²	155	124.6 Å²	124.6	81%	0.812	76%	0.756	S	S	*	*	S	Bend	trans	-116.8	14.4	-176.5	-85.3	158.4	0	0	0	114.4
17	S	28.8	Very low	31.5	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	77%	0.77	S	S	*	*			trans	-106.4	38.8	-177.3	69.6	0	0	0	0	114.5
18	S	32.7	Very low	30.9	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	77%	0.768	S	S	*	*	S	Bend	trans	-145.2	62.1	170.4	67.7	0	0	0	0	112.3
19	A	28.5	Very low	30.2	Very low	99 Å²	99	126.9 Å²	126.9	82%	0.818	77%	0.774	S	S	*	*			trans	-162.1	82.3	163	0	0	0	0	0	111
20	S	25.7	Very low	29.5	Very low	123 Å²	123	128.4 Å²	128.4	86%	0.86	78%	0.783	S	S	*	*			trans	-165.1	100.5	156.8	61.7	0	0	0	0	111.9
21	A	26.5	Very low	29.2	Very low	100 Å²	100	130.7 Å²	130.7	83%	0.826	79%	0.79	S	S	*	*			trans	176.7	136.1	152.7	0	0	0	0	0	105.6
22	S	26.1	Very low	28.8	Very low	111 Å²	111	128.9 Å²	128.9	78%	0.776	79%	0.79	S	S	*	*			cis	-161.9	148	10.4	43.6	0	0	0	0	107.6
23	S	26.9	Very low	28.3	Very low	105 Å²	105	132 Å²	132	73%	0.734	80%	0.799	S	S	*	*			trans	-67.3	147.9	163.3	48.6	0	0	0	0	111.2
24	D	26.1	Very low	27.9	Very low	166 Å²	166	135.6 Å²	135.6	89%	0.888	81%	0.809	S	S	*	*			trans	-154.9	133.1	138.5	-88.2	-30.8	0	0	0	110
25	E	29.8	Very low	27.5	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	81%	0.814	S	S	*	*			trans	-81.2	146	172.8	-69.8	178.5	140	0	0	110.6
26	E	26.5	Very low	27	Very low	202 Å²	202	137.3 Å²	137.3	94%	0.944	82%	0.815	S	S	*	*			trans	-158.4	131.4	140.8	-115.4	177.5	-169.1	0	0	109.5
27	G	23.7	Very low	26.6	Very low	76 Å²	76	136.5 Å²	136.5	78%	0.784	82%	0.817	S	S	*	*			trans	-100.3	162	177.9	0	0	0	0	0	112.8
28	S	24.3	Very low	26.4	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	82%	0.816	S	S	*	*			trans	178.8	114.4	153	170.4	0	0	0	0	112.3
29	Q	25.5	Very low	26	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	82%	0.817	S	S	*	*			trans	47.1	127.3	131.7	-63.3	175.8	-6.7	0	0	122.9
30	D	25.8	Very low	25.8	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	82%	0.817	S	S	*	*			trans	29.1	125.8	134	-65.6	-25	0	0	0	120.3
31	E	27.6	Very low	25.7	Very low	180 Å²	180	139.2 Å²	139.2	84%	0.841	81%	0.806	S	S	*	*				-165.5	125.9	117	-109.8	-179	-178.6	0	0	112.2
32	S	26.3	Very low	25.6	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	81%	0.805	S	S	*	*			trans	-72.2	141.3	160.9	53.6	0	0	0	0	110.7
33	L	26.4	Very low	25.5	Very low	157 Å²	157	145.6 Å²	145.6	82%	0.822	81%	0.812	S	S	*	*			trans	-147.2	114.6	156.8	-110.2	136.4	0	0	0	112.5
34	D	25.1	Very low	25.2	Very low	148 Å²	148	146.3 Å²	146.3	79%	0.791	82%	0.816	S	S	*	*			trans	-51.7	143.1	161.5	-75.9	-47.3	0	0	0	111.9
35	S	26.3	Very low	25.1	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	81%	0.812	S	S	*	*			trans	-126.3	96	151	67.8	0	0	0	0	109.8
36	K	24.2	Very low	24.8	Very low	192 Å²	192	145.1 Å²	145.1	84%	0.835	81%	0.811	S	S	*	*			trans	-63.9	131.7	157.3	-81.9	172.6	175.7	167.8	0	108.8
37	T	24.8	Very low	24.6	Very low	139 Å²	139	142.5 Å²	142.5	85%	0.853	80%	0.804	S	S	*	*			trans	-131.5	121.4	152.3	-21.2	0	0	0	0	108.7
38	T	25.2	Very low	24.7	Very low	120 Å²	120	148 Å²	148	74%	0.736	81%	0.809	S	S	*	*			trans	-88.8	129.5	-178.2	35.2	0	0	0	0	111.9
39	L	24.1	Very low	24.6	Very low	157 Å²	157	149 Å²	149	82%	0.822	81%	0.811	S	S	*	*			trans	37.9	128.2	134.6	-77.7	148.5	0	0	0	120.9
40	T	23.9	Very low	24.5	Very low	135 Å²	135	147.6 Å²	147.6	83%	0.828	81%	0.814	S	S	*	*				-150.3	113.4	122	50	0	0	0	0	112.3
41	S	24.7	Very low	24.4	Very low	89 Å²	89	145.2 Å²	145.2	62%	0.622	82%	0.816	S	S	*	*			trans	26.2	134.3	139.3	57.6	0	0	0	0	124.5
42	D	23.3	Very low	24.2	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	81%	0.808	S	S	*	*			trans	78.5	107.6	132	-64.1	-11.4	0	0	0	120.9
43	E	24.1	Very low	24	Very low	194 Å²	194	145.9 Å²	145.9	91%	0.907	81%	0.814	S	S	*	*				-154.8	122	122.9	-114	175	-174.9	0	0	111
44	S	22.1	Very low	23.9	Very low	119 Å²	119	144.5 Å²	144.5	83%	0.832	81%	0.812	S	S	*	*			trans	-86.3	121.2	-179.7	56.7	0	0	0	0	111
45	V	24.1	Very low	24	Very low	133 Å²	133	141.7 Å²	141.7	81%	0.806	80%	0.8	S	S	*	*			trans	-120.4	123.1	161.9	-177.9	0	0	0	0	108.4	D47	V45-D47 PolarHBondContact O-N 3.37Å
46	K	22.6	Very low	24	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.857	78%	0.783	S	S	*	*			trans	-73.7	115.7	-177.7	-73	171.2	174.8	173.7	0	109.9
47	D	23.1	Very low	24.3	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	76%	0.76	S	S	*	*			trans	-85.4	125.5	165.8	-83.5	-27.5	0	0	0	110.7	V45 T49	V45-D47 PolarHBondContact O-N 3.37Å; D47-T49 PolarHBondContact O-N 3.04Å
48	H	24.5	Very low	24.5	Very low	192 Å²	192	131.6 Å²	131.6	89%	0.889	75%	0.752	S	S	*	*			trans	-72.6	104.6	165.8	-88.5	-76.6	0	0	0	109	T50	H48-T50 PolarHBondContact O-N 3.27Å
49	T	23.2	Very low	24.5	Very low	128 Å²	128	132.8 Å²	132.8	79%	0.785	75%	0.752	S	S	*	*			trans	-71.6	115.3	172.5	49.1	0	0	0	0	111.2	D47	D47-T49 PolarHBondContact O-N 3.04Å
50	T	23.2	Very low	24.5	Very low	143 Å²	143	133.7 Å²	133.7	88%	0.877	75%	0.749	S	S	*	*			trans	-104.3	97.8	150.6	44.2	0	0	0	0	107.9	H48 G52	H48-T50 PolarHBondContact O-N 3.27Å; T50-G52 PolarHBondContact O-N 2.9Å; T50-G52 VanDerWaalsContact O-N 3.08Å
51	A	23.2	Very low	24.4	Very low	104 Å²	104	134 Å²	134	86%	0.86	75%	0.746	S	S	*	*			trans	-74	93.9	177.2	0	0	0	0	0	109.9
52	G	22.9	Very low	24.3	Very low	66 Å²	66	137.7 Å²	137.7	68%	0.68	76%	0.758	S	S	*	*			trans	-76.9	115.2	164.6	0	0	0	0	0	110.3	T50 V54	T50-G52 PolarHBondContact O-N 2.9Å; T50-G52 VanDerWaalsContact O-N 3.08Å; G52-V54 PolarHBondContact O-N 3.41Å
53	R	22.6	Very low	24.3	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	75%	0.75	S	S	*	*			trans	-74.1	98.3	177.6	-169.2	177.5	-178.2	170.6	-1.6	109	V55	R53-V55 PolarHBondContact O-N 3.08Å
54	V	25.5	Very low	24.3	Very low	127 Å²	127	135 Å²	135	77%	0.77	75%	0.751	S	S	*	*			trans	-86.1	110.3	177.2	-178.1	0	0	0	0	109.3	G52	G52-V54 PolarHBondContact O-N 3.41Å
55	V	26.3	Very low	24.5	Very low	90 Å²	90	138 Å²	138	55%	0.545	75%	0.752	S	S	.	*			trans	-102.8	114.9	168.2	177.9	0	0	0	0	106.8	R53 G57	R53-V55 PolarHBondContact O-N 3.08Å; V55-G57 PolarHBondContact O-N 3.22Å
56	A	27.4	Very low	24.4	Very low	53 Å²	53	136.6 Å²	136.6	44%	0.438	75%	0.748	S	S	.	*			trans	-88.9	106.5	174.9	0	0	0	0	0	109.8
57	G	30.1	Very low	24.6	Very low	34 Å²	34	135.6 Å²	135.6	35%	0.351	75%	0.746	S	S	.	*	S	Bend	trans	153.5	87.7	175.4	0	0	0	0	0	109.3	V55	V55-G57 PolarHBondContact O-N 3.22Å
58	Q	29.2	Very low	24.8	Very low	146 Å²	146	136.4 Å²	136.4	68%	0.682	75%	0.75	S	S	*	*			trans	67.4	104.9	-168.7	-64.6	175.9	-42.4	0	0	114	F60	Q58-F60 PolarHBondContact O-N 2.74Å
59	I	24.7	Very low	24.9	Very low	144 Å²	144	136.5 Å²	136.5	74%	0.738	75%	0.75	S	S	*	*			trans	-79.7	102.5	160.3	-62.2	171.5	0	0	0	105.8	L61	I59-L61 HydrophobicContact CG2-CD2 4.11Å; I59-L61 HydrophobicContact CG2-CG 3.74Å
60	F	23.1	Very low	25	Very low	176 Å²	176	135.9 Å²	135.9	77%	0.772	75%	0.752	S	S	*	*			trans	-83.2	111.5	145.8	-82.1	-88.5	0	0	0	105.4	Q58 D62	Q58-F60 PolarHBondContact O-N 2.74Å; F60-D62 PolarHBondContact O-N 2.83Å
61	L	23.5	Very low	25.1	Very low	143 Å²	143	134 Å²	134	75%	0.749	74%	0.744	S	S	*	*			trans	-73.9	116.9	157.8	-73	168.8	0	0	0	104.9	I59 S63	I59-L61 HydrophobicContact CG2-CD2 4.11Å; I59-L61 HydrophobicContact CG2-CG 3.74Å; L61-S63 PolarHBondContact O-N 3.04Å
62	D	21	Very low	25.4	Very low	165 Å²	165	136.1 Å²	136.1	88%	0.882	74%	0.739	S	S	*	*			trans	-61.5	99.4	156.4	-80.3	-29.3	0	0	0	105.9	F60 E64	F60-D62 PolarHBondContact O-N 2.83Å; D62-E64 PolarHBondContact O-N 2.95Å
63	S	24.5	Very low	25.6	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	75%	0.745	S	S	*	*			trans	-72.8	101.8	167.5	51.2	0	0	0	0	107.6	L61 E65	L61-S63 PolarHBondContact O-N 3.04Å; S63-E65 PolarHBondContact O-N 3.33Å
64	E	24.7	Very low	25.7	Very low	197 Å²	197	138.9 Å²	138.9	92%	0.921	75%	0.745	S	S	*	*			trans	-71.5	70	144.6	-79.1	-173.1	158.7	0	0	108.1	D62	D62-E64 PolarHBondContact O-N 2.95Å
65	E	24.6	Very low	25.7	Very low	182 Å²	182	141.3 Å²	141.3	85%	0.85	75%	0.748	S	S	*	*			trans	-139.8	67.6	155.1	-90.3	-174.5	168.8	0	0	105.7	S63	S63-E65 PolarHBondContact O-N 3.33Å
66	S	23.5	Very low	25.8	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	76%	0.761	S	S	*	*			trans	-86.2	132.1	159.1	58.5	0	0	0	0	108.4
67	E	26.7	Very low	25.6	Very low	176 Å²	176	151 Å²	151	82%	0.822	78%	0.784	S	S	*	*	S	Bend	trans	107.4	56.7	169.2	-58	-176.1	-177.2	0	0	116.3
68	L	26.9	Very low	25.4	Very low	165 Å²	165	153.9 Å²	153.9	86%	0.864	80%	0.798	S	S	*	*	S	Bend	trans	-160.5	14.6	141.6	-135.5	84.9	0	0	0	116.9
69	E	26.9	Very low	25.3	Very low	193 Å²	193	155.1 Å²	155.1	90%	0.902	81%	0.808	S	S	*	*	S	Bend	trans	-130.2	21.9	179.8	-90.9	-173.8	165.1	0	0	114.3
70	S	23.8	Very low	25.3	Very low	116 Å²	116	158.3 Å²	158.3	81%	0.811	82%	0.817	S	S	*	*	S	Bend	trans	-101.7	22.9	178.2	67.4	0	0	0	0	114.7
71	S	25.3	Very low	25.4	Very low	103 Å²	103	154.9 Å²	154.9	72%	0.72	82%	0.815	S	S	*	*	S	Bend	trans	-126.3	10	-176.7	51.8	0	0	0	0	116
72	I	30.6	Very low	25.4	Very low	148 Å²	148	156.4 Å²	156.4	76%	0.759	82%	0.818	S	S	*	*	S	Bend	trans	-112.9	-0.8	179.2	-56.9	178.6	0	0	0	112.8
73	Q	25.9	Very low	25.6	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.804	82%	0.817	S	S	*	*	S	Bend	trans	-94.5	6.6	-178.4	-144.1	85.8	23.9	0	0	115
74	E	25.6	Very low	25.6	Very low	191 Å²	191	156.3 Å²	156.3	89%	0.893	82%	0.822	S	S	*	*	S	Bend	trans	-106.5	0.8	-178.9	-75.6	-167.8	164	0	0	115.4
75	E	26.3	Very low	25.5	Very low	178 Å²	178	156.2 Å²	156.2	83%	0.832	82%	0.822	S	S	*	*	S	Bend	trans	-108.4	-1.1	177.9	-82.6	-165.5	158.1	0	0	116.1
76	E	27	Very low	25.6	Very low	175 Å²	175	153 Å²	153	82%	0.818	82%	0.82	S	S	*	*	S	Bend	trans	-91.2	-3.8	179.7	-94.4	-169.5	155.8	0	0	115.6
77	D	24	Very low	25.6	Very low	172 Å²	172	154 Å²	154	92%	0.92	82%	0.821	S	S	*	*	S	Bend	trans	-97.9	15.7	-176.8	-112.6	-5.5	0	0	0	114.9
78	S	26	Very low	25.8	Very low	93 Å²	93	152.2 Å²	152.2	65%	0.65	82%	0.822	S	S	*	*	S	Bend	trans	-123.3	32.5	-175.4	72.9	0	0	0	0	116.4
79	L	26.5	Very low	25.8	Very low	172 Å²	172	153 Å²	153	90%	0.901	82%	0.822	S	S	*	*			trans	-156	58.5	163.3	-102.4	131.8	0	0	0	112.8
80	K	25.9	Very low	25.7	Very low	211 Å²	211	151 Å²	151	92%	0.917	82%	0.817	S	S	*	*			trans	-119.2	79.3	156.5	-90.4	-177	179.9	168.3	0	109.9
81	S	23.6	Very low	26.1	Very low	104 Å²	104	154.5 Å²	154.5	73%	0.727	83%	0.826	S	S	*	*			trans	-169.6	92.8	154.1	52.6	0	0	0	0	109.5
82	Q	25.3	Very low	26.2	Very low	175 Å²	175	154.1 Å²	154.1	82%	0.818	82%	0.823	S	S	*	*	S	Bend		175.6	121.8	123.2	-94.8	168.8	-8	0	0	110.8
83	E	25.1	Very low	26	Very low	182 Å²	182	154.9 Å²	154.9	85%	0.85	82%	0.821	S	S	*	*			trans	70.9	110.9	144.8	-63.6	178.5	175.6	0	0	118.9
84	G	22.6	Very low	26.2	Very low	75 Å²	75	155.5 Å²	155.5	77%	0.773	83%	0.829	S	S	*	*			trans	-80.1	145.3	152.6	0	0	0	0	0	110.4
85	E	24.5	Very low	26.4	Very low	195 Å²	195	153.3 Å²	153.3	91%	0.911	82%	0.819	S	S	*	*			trans	-153	133.1	142.9	-115.7	176.3	-175.6	0	0	108.3
86	S	25.9	Very low	26.9	Very low	115 Å²	115	150.6 Å²	150.6	80%	0.804	82%	0.82	S	S	*	*			trans	-75.9	126.3	-178.5	51.7	0	0	0	0	111.3
87	V	24	Very low	27.2	Very low	124 Å²	124	148.3 Å²	148.3	75%	0.752	82%	0.82	S	S	*	*			trans	-141.7	114.2	151.6	-175.2	0	0	0	0	109.2
88	T	30	Very low	27.3	Very low	137 Å²	137	147.7 Å²	147.7	84%	0.84	82%	0.817	S	S	*	*			trans	-64.8	124.9	159.7	43.8	0	0	0	0	109.1
89	E	26.8	Very low	27.9	Very low	182 Å²	182	148.2 Å²	148.2	85%	0.85	82%	0.818	S	S	*	*			trans	-151.3	144.9	160.4	-114.2	174.6	-161.4	0	0	111.4
90	D	25.3	Very low	28.3	Very low	151 Å²	151	149 Å²	149	81%	0.807	82%	0.817	S	S	*	*			trans	-74.1	141.3	-153.9	-69.2	-55.7	0	0	0	115.2	S92	D90-S92 PolarHBondContact O-N 3.09Å; D90-S92 VanDerWaalsContact O-N 3.11Å
91	L	31.7	Very low	28.4	Very low	189 Å²	189	146.7 Å²	146.7	99%	0.99	82%	0.815	S	S	*	*			trans	-78.3	85.8	167.5	-102.1	146.6	0	0	0	109.9
92	S	27	Very low	29.1	Very low	96 Å²	96	149.8 Å²	149.8	67%	0.671	82%	0.815	S	S	*	*			trans	-153.5	108.2	159.6	62.4	0	0	0	0	110.3	D90	D90-S92 PolarHBondContact O-N 3.09Å; D90-S92 VanDerWaalsContact O-N 3.11Å
93	F	26.4	Very low	29.3	Very low	163 Å²	163	149 Å²	149	72%	0.715	82%	0.816	S	S	*	*			trans	171	111	131.2	-138.6	-106.6	0	0	0	110.4	E95	F93-E95 HydrophobicContact CD1-CB 4.44Å; F93-E95 HydrophobicContact CE1-CB 3.81Å; F93-E95 HydrophobicContact CZ-CB 3.95Å
94	L	30.3	Very low	29.8	Very low	185 Å²	185	150.4 Å²	150.4	97%	0.969	82%	0.815	S	S	*	*			trans	-142.1	74.3	148.1	-85.1	-177.3	0	0	0	107.8
95	E	29.8	Very low	30.3	Very low	146 Å²	146	155.8 Å²	155.8	68%	0.682	82%	0.82	S	S	*	*			trans	-95	130.4	156.9	-132.3	162.5	-167.8	0	0	107.4	F93	F93-E95 HydrophobicContact CD1-CB 4.44Å; F93-E95 HydrophobicContact CE1-CB 3.81Å; F93-E95 HydrophobicContact CZ-CB 3.95Å
96	S	37.6	Very low	30.6	Very low	121 Å²	121	155 Å²	155	85%	0.846	82%	0.817	S	S	*	*			trans	-64.3	151.5	178.2	-46.7	0	0	0	0	111.3
97	P	32.6	Very low	30.9	Very low	126 Å²	126	155.4 Å²	155.4	82%	0.818	82%	0.816	S	S	*	*			trans	-138.7	157.4	135.5	30	-12.1	0	0	0	115.9
98	N	26.1	Very low	31.3	Very low	160 Å²	160	159 Å²	159	86%	0.856	82%	0.822	S	S	*	*			trans	-54.8	168.9	178.2	-122.1	1.6	0	0	0	114.9
99	P	39.3	Very low	31.3	Very low	104 Å²	104	162.1 Å²	162.1	68%	0.675	82%	0.824	S	S	*	*			trans	-88.5	123.9	-165.7	35	-31.1	0	0	0	112
100	E	33.9	Very low	31.5	Very low	187 Å²	187	159.7 Å²	159.7	87%	0.874	82%	0.821	S	S	*	*			trans	-176.7	95.5	151.9	-108.8	169.6	-167.2	0	0	109.6
101	N	29.2	Very low	31.9	Very low	164 Å²	164	163.9 Å²	163.9	88%	0.877	83%	0.825	S	S	*	*			trans	-178.6	127.7	132.8	-100.6	-28.7	0	0	0	110.5
102	K	38.5	Very low	32.3	Very low	169 Å²	169	163.2 Å²	163.2	74%	0.735	82%	0.815	S	S	*	*			trans	-81.4	118.7	170.6	-76.9	177.7	174	178.8	0	108.1
103	D	28.6	Very low	33.3	Very low	157 Å²	157	162.2 Å²	162.2	84%	0.84	81%	0.806	S	S	*	*			trans	-133.6	129	148.6	-81.6	-43.2	0	0	0	108.2	E105	D103-E105 PolarHBondContact O-N 2.88Å
104	Y	35.8	Very low	34.6	Very low	213 Å²	213	158.1 Å²	158.1	84%	0.835	80%	0.802	S	S	*	*			trans	-76.1	102.2	-174.8	-74.6	-97.1	0	0	0	109.6
105	E	33.5	Very low	36.2	Very low	188 Å²	188	152 Å²	152	88%	0.879	77%	0.77	S	S	*	*			trans	-91	127.9	156.9	-88.4	-172.1	153.1	0	0	109.6	D103	D103-E105 PolarHBondContact O-N 2.88Å
106	E	31.1	Very low	37.9	Very low	179 Å²	179	147.3 Å²	147.3	84%	0.836	75%	0.751	S	S	*	*			trans	-55.8	140.1	173.9	-72.9	-179	150.5	0	0	111	K108	E106-K108 PolarHBondContact O-N 3.45Å
107	P	32.2	Very low	39.2	Very low	122 Å²	122	141.6 Å²	141.6	79%	0.792	71%	0.712	S	S	*	*			trans	-65.9	113.9	179	26.3	-31.1	0	0	0	109.2	K109	P107-K109 PolarHBondContact O-N 3.41Å
108	K	32.8	Very low	40.8	Very low	200 Å²	200	138.7 Å²	138.7	87%	0.87	69%	0.689	S	S	*	*			trans	-48.2	112	162.5	-77.4	178.8	179.3	172.3	0	107.4	E106 V110	E106-K108 PolarHBondContact O-N 3.45Å; K108-V110 PolarHBondContact O-N 2.87Å
109	K	29.7	Very low	42.6	Very low	202 Å²	202	137.6 Å²	137.6	88%	0.878	68%	0.678	S	S	*	*			trans	-51	108.6	170.4	-93.3	179.9	174.5	177.6	0	107.6	P107 R111	P107-K109 PolarHBondContact O-N 3.41Å; K109-R111 PolarHBondContact O-N 3.49Å
110	V	30.2	Very low	44.2	Very low	131 Å²	131	134.2 Å²	134.2	79%	0.794	66%	0.662	S	S	*	*			trans	-56	108.3	166.8	179.3	0	0	0	0	105.9	K108 K112	K108-V110 PolarHBondContact O-N 2.87Å; V110-K112 PolarHBondContact O-N 2.94Å
111	R	33.9	Very low	46.3	Very low	239 Å²	239	128.6 Å²	128.6	90%	0.902	64%	0.641	S	S	*	*			trans	-59.6	113.8	168.6	-87.4	-176.9	172	-178.9	-2.4	106	K109	K109-R111 PolarHBondContact O-N 3.49Å
112	K	40.1	Very low	48.3	Very low	175 Å²	175	120.9 Å²	120.9	76%	0.761	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-54.7	128	169.8	-68	-175.5	178.9	-175.9	0	106.8	V110	V110-K112 PolarHBondContact O-N 2.94Å
113	P	48	Very low	49.8	Very low	76 Å²	76	121.4 Å²	121.4	49%	0.494	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-61.8	142.7	-177.5	21.9	-28.5	0	0	0	109.9	L115	P113-L115 PolarHBondContact O-N 3.42Å
114	A	54.2	Low	51.7	Low	77 Å²	77	116 Å²	116	64%	0.636	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-59.1	119.9	174.7	0	0	0	0	0	108.7	T116	A114-T116 PolarHBondContact O-N 3.29Å
115	L	62.8	Low	53.7	Low	57 Å²	57	109.3 Å²	109.3	30%	0.298	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-65.6	129.9	175.3	-70.1	156.6	0	0	0	107.4	P113 C127 F129	P113-L115 PolarHBondContact O-N 3.42Å; L115-C127 HydrophobicContact CB-CB 4.28Å; L115-C127 WeakPolarHBondContact O-CB 3.05Å; L115-C127 PolarHBondContact O-N 2.94Å; L115-C127 PolarHBondContact O-SG 3.22Å; L115-F129 HydrophobicContact CB-CE2 4.4Å; L115-F129 HydrophobicContact CD1-CE2 4.08Å; L115-F129 HydrophobicContact CD1-CZ 4.22Å
116	T	65.2	Low	55.9	Low	46 Å²	46	103.9 Å²	103.9	28%	0.282	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-98.5	136	175.8	44.1	0	0	0	0	109.7	A114 I118	A114-T116 PolarHBondContact O-N 3.29Å; T116-I118 PolarHBondContact O-N 3.25Å
117	A	66.6	Low	58.3	Low	2 Å²	2	96 Å²	96	2%	0.017	51%	0.508	C	S	.	.			trans	-75.8	112.2	-178.3	0	0	0	0	0	109.6	G124 E125 T155 G166 F167	A117-G124 VanDerWaalsContact O-CA 3.26Å; A117-G124 WeakPolarHBondContact O-CA 3.34Å; A117-G124 PolarHBondContact O-N 3.42Å; A117-E125 WeakPolarHBondContact CB-O 3.37Å; A117-E125 PolarHBondContact N-O 3.04Å; A117-T155 HydrophobicContact CB-CG2 3.91Å; A117-G166 VanDerWaalsContact CB-CA 3.41Å; A117-F167 WeakPolarHBondContact CA-O 3.46Å
118	I	65.7	Low	60.6	Low	65 Å²	65	94.1 Å²	94.1	33%	0.333	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.1	178.8	-51.6	172.2	0	0	0	108.4	T116 F167 E169	T116-I118 PolarHBondContact O-N 3.25Å; I118-F167 PolarHBondContact N-O 3.28Å; I118-F167 WeakPolarHBondContact O-CB 3.39Å; I118-F167 WeakPolarHBondContact O-CD2 3.36Å; I118-F167 PolarHBondContact O-N 3.12Å; I118-E169 HydrophobicContact CD1-CB 4.08Å; I118-E169 HydrophobicContact CD1-CG 4.09Å
119	E	63.4	Low	63.1	Low	136 Å²	136	87.8 Å²	87.8	64%	0.636	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.4	153.4	-175.6	-65.3	171.8	-179.8	0	0	113.2	G166 F167	E119-G166 WeakPolarHBondContact O-CA 3.4Å; E119-F167 HydrophobicContact CB-CD2 3.96Å; E119-F167 HydrophobicContact CB-CE2 4.29Å; E119-F167 PolarHBondContact O-N 3.19Å
120	G	73.2	Confident	65.7	Low	33 Å²	33	80.2 Å²	80.2	34%	0.34	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	111.7	-159.3	-171.5	0	0	0	0	0	112.1
121	T	77.8	Confident	68.4	Low	70 Å²	70	74 Å²	74	43%	0.429	40%	0.395	S	S	.	.	S	Bend	trans	-88	-10.3	-174	49.4	0	0	0	0	113.3	E163 K164 W165	T121-E163 WeakPolarHBondContact CB-O 3.39Å; T121-E163 PolarHBondContact OG1-O 2.84Å; T121-K164 WeakPolarHBondContact OG1-CA 3.29Å; T121-W165 PolarHBondContact N-O 2.88Å; T121-W165 PolarHBondContact OG1-N 2.68Å
122	A	70.4	Confident	70.9	Confident	2 Å²	2	64.5 Å²	64.5	2%	0.017	36%	0.362	C	S	.	.	S	Bend	trans	-97.5	5.7	-173.4	0	0	0	0	0	115.7	G124 E125 T155 K164 W165	A122-G124 PolarHBondContact O-N 3.39Å; A122-E125 HydrophobicContact CB-CB 4.36Å; A122-E125 WeakPolarHBondContact O-CB 3.17Å; A122-E125 WeakPolarHBondContact O-CG 3.2Å; A122-E125 PolarHBondContact O-N 3.42Å; A122-T155 HydrophobicContact CB-CG2 3.45Å; A122-T155 VanDerWaalsContact CB-CG2 3.45Å; A122-K164 HydrophobicContact CB-CB 4.17Å; A122-W165 WeakPolarHBondContact CB-O 3.4Å; A122-W165 PolarHBondContact N-O 3.36Å; A122-W165 VanDerWaalsContact N-O 3.12Å
123	H	70.3	Confident	73	Confident	180 Å²	180	57.4 Å²	57.4	83%	0.833	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.5	39	171.2	-63.2	-66.9	0	0	0	116.7
124	G	69.6	Low	74.7	Confident	44 Å²	44	59.6 Å²	59.6	45%	0.454	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	4.8	176.8	0	0	0	0	0	116.1	A117 A122	A117-G124 VanDerWaalsContact O-CA 3.26Å; A117-G124 WeakPolarHBondContact O-CA 3.34Å; A117-G124 PolarHBondContact O-N 3.42Å; A122-G124 PolarHBondContact O-N 3.39Å
125	E	77.6	Confident	76.1	Confident	71 Å²	71	63.1 Å²	63.1	33%	0.332	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-62	149.2	174.2	-75.6	176.3	-174.5	0	0	112.1	A117 A122 T155 K164	A117-E125 WeakPolarHBondContact CB-O 3.37Å; A117-E125 PolarHBondContact N-O 3.04Å; A122-E125 HydrophobicContact CB-CB 4.36Å; A122-E125 WeakPolarHBondContact O-CB 3.17Å; A122-E125 WeakPolarHBondContact O-CG 3.2Å; A122-E125 PolarHBondContact O-N 3.42Å; E125-T155 HydrophobicContact CB-CG2 3.73Å; E125-T155 WeakPolarHBondContact OE2-CB 3.38Å; E125-T155 PolarHBondContact OE2-OG1 3.5Å; E125-K164 IonicContact OE1-NZ 2.78Å; E125-K164 PolarHBondContact OE1-NZ 2.94Å; E125-K164 IonicContact OE2-NZ 3.51Å
126	P	79.4	Confident	77.1	Confident	75 Å²	75	66.2 Å²	66.2	49%	0.487	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-67.2	141.1	177.6	27.8	-33.5	0	0	0	112	H128 T155	P126-H128 PolarHBondContact O-N 3.12Å; P126-T155 WeakPolarHBondContact O-CB 3.37Å; P126-T155 WeakPolarHBondContact O-CG2 3.19Å
127	C	80.3	Confident	78.1	Confident	12 Å²	12	69.7 Å²	69.7	8%	0.081	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-60.1	134.2	171.9	-60.6	0	0	0	0	110.5	L115 F129 C153	L115-C127 HydrophobicContact CB-CB 4.28Å; L115-C127 WeakPolarHBondContact O-CB 3.05Å; L115-C127 PolarHBondContact O-N 2.94Å; L115-C127 PolarHBondContact O-SG 3.22Å; C127-F129 HydrophobicContact CB-CD2 4.24Å; C127-F129 HydrophobicContact CB-CE2 3.5Å; C127-F129 VanDerWaalsContact CB-CE2 3.5Å; C127-F129 HydrophobicContact CB-CZ 3.72Å; C127-C153 HydrophobicContact CB-CB 3.51Å; C127-C153 WeakPolarHBondContact CB-SG 3.42Å; C127-C153 WeakPolarHBondContact SG-CB 3.41Å; C127-C153 CovalentContact SG-SG 2.01Å; C127-C153 PolarHBondContact SG-SG 3.03Å
128	H	82.2	Confident	78.9	Confident	84 Å²	84	71 Å²	71	39%	0.389	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-97.1	122.3	174.6	-174.2	-76.5	0	0	0	109.6	P126 P130 F131 A154 T155	P126-H128 PolarHBondContact O-N 3.12Å; H128-P130 PolarHBondContact CE1-O 3.47Å; H128-P130 PolarHBondContact ND1-O 3.32Å; H128-F131 WeakPolarHBondContact O-CB 3.25Å; H128-F131 WeakPolarHBondContact O-CD1 3.49Å; H128-A154 PolarHBondContact N-O 3.48Å; H128-T155 WeakPolarHBondContact CB-O 3.41Å
129	F	83.6	Confident	79.7	Confident	67 Å²	67	73.6 Å²	73.6	29%	0.294	39%	0.39	S	S	.	.	S	Bend	trans	-121.2	133.5	175.5	-62.5	-68.7	0	0	0	110.9	L115 C127 F131 D139 E140 C153	L115-F129 HydrophobicContact CB-CE2 4.4Å; L115-F129 HydrophobicContact CD1-CE2 4.08Å; L115-F129 HydrophobicContact CD1-CZ 4.22Å; C127-F129 HydrophobicContact CB-CD2 4.24Å; C127-F129 HydrophobicContact CB-CE2 3.5Å; C127-F129 VanDerWaalsContact CB-CE2 3.5Å; C127-F129 HydrophobicContact CB-CZ 3.72Å; F129-F131 HydrophobicContact CD1-CD1 4.04Å; F129-F131 HydrophobicContact CD1-CE1 4.21Å; F129-F131 HydrophobicContact CE1-CD1 4.11Å; F129-F131 AromaticContact CE1-CE1 3.87Å; F129-F131 HydrophobicContact CE1-CE1 3.87Å; F129-D139 VanDerWaalsContact CD1-O 3.23Å; F129-D139 WeakPolarHBondContact CD1-O 3.3Å; F129-D139 WeakPolarHBondContact CG-O 3.45Å; F129-E140 VanDerWaalsContact CE1-CA 3.5Å; F129-C153 HydrophobicContact CE1-CB 4.33Å; F129-C153 HydrophobicContact CZ-CB 4.09Å
130	P	85	Confident	80.6	Confident	43 Å²	43	73.6 Å²	73.6	28%	0.279	39%	0.39	S	S	.	.	S	Bend	cis	-69.6	156.3	-9.1	25.5	-31.2	0	0	0	112.9	H128 Y138 D139 Y157	H128-P130 PolarHBondContact CE1-O 3.47Å; H128-P130 PolarHBondContact ND1-O 3.32Å; P130-Y138 VanDerWaalsContact CA-O 3.24Å; P130-Y138 WeakPolarHBondContact CA-O 3.44Å; P130-D139 WeakPolarHBondContact CB-OD1 3.46Å; P130-Y157 HydrophobicContact CG-CE2 4.4Å; P130-Y157 WeakPolarHBondContact O-CD2 3.46Å
131	F	87.3	Confident	81.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.7	165.6	71.1	-84.9	0	0	0	111.6	H128 F129 F133 E137 Y138 T142 W152 C153 A154 T156 Y157	H128-F131 WeakPolarHBondContact O-CB 3.25Å; H128-F131 WeakPolarHBondContact O-CD1 3.49Å; F129-F131 HydrophobicContact CD1-CD1 4.04Å; F129-F131 HydrophobicContact CD1-CE1 4.21Å; F129-F131 HydrophobicContact CE1-CD1 4.11Å; F129-F131 AromaticContact CE1-CE1 3.87Å; F129-F131 HydrophobicContact CE1-CE1 3.87Å; F131-F133 HydrophobicContact CD2-CB 4.26Å; F131-F133 HydrophobicContact CE2-CB 3.99Å; F131-E137 WeakPolarHBondContact O-CA 3.26Å; F131-Y138 HydrophobicContact CE2-CD2 4.11Å; F131-Y138 HydrophobicContact CZ-CD2 4.27Å; F131-Y138 HydrophobicContact CZ-CG 4.26Å; F131-Y138 PolarHBondContact N-O 3.28Å; F131-Y138 PolarHBondContact O-N 2.87Å; F131-T142 HydrophobicContact CE2-CG2 4.49Å; F131-T142 HydrophobicContact CZ-CG2 3.95Å; F131-W152 AromaticContact CE2-CH2 3.81Å; F131-W152 HydrophobicContact CE2-CH2 3.81Å; F131-W152 HydrophobicContact CE2-CZ2 4.44Å; F131-W152 AromaticContact CE2-CZ3 3.86Å; F131-W152 HydrophobicContact CE2-CZ3 3.86Å; F131-W152 HydrophobicContact CZ-CZ3 4.39Å; F131-C153 HydrophobicContact CE1-CB 4.17Å; F131-A154 HydrophobicContact CB-CB 3.85Å; F131-A154 HydrophobicContact CD1-CB 4.45Å; F131-A154 HydrophobicContact CD2-CB 3.44Å; F131-A154 VanDerWaalsContact CD2-CB 3.44Å; F131-A154 HydrophobicContact CE2-CB 4.07Å; F131-A154 HydrophobicContact CG-CB 3.66Å; F131-T156 WeakPolarHBondContact CB-O 3.26Å; F131-Y157 CarbonylContact C-O 3.51Å; F131-Y157 WeakPolarHBondContact CA-O 3.42Å
132	L	85.9	Confident	81.3	Confident	40 Å²	40	70.5 Å²	70.5	21%	0.209	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.1	-176.5	-172.4	73.1	0	0	0	110.1	K136 E137 Y157 Y159	L132-K136 WeakPolarHBondContact CA-O 3.47Å; L132-E137 HydrophobicContact CD1-CG 3.93Å; L132-Y157 HydrophobicContact CB-CE1 4.45Å; L132-Y157 WeakPolarHBondContact CB-O 3.34Å; L132-Y157 PolarHBondContact N-O 2.92Å; L132-Y159 WeakPolarHBondContact O-CB 3.4Å; L132-Y159 PolarHBondContact O-N 2.96Å
133	F	84.9	Confident	82	Confident	25 Å²	25	72.8 Å²	72.8	11%	0.11	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	128.5	173.8	175.8	-107	0	0	0	110.4	F131 D135 K136 Y138 D144 W152 Y159	F131-F133 HydrophobicContact CD2-CB 4.26Å; F131-F133 HydrophobicContact CE2-CB 3.99Å; F133-D135 VanDerWaalsContact C-N 3.3Å; F133-D135 PolarHBondContact O-N 3.21Å; F133-K136 PolarHBondContact N-O 2.83Å; F133-K136 PolarHBondContact O-N 3.04Å; F133-K136 VanDerWaalsContact O-N 3.09Å; F133-K136 VanDerWaalsContact O-O 3.14Å; F133-Y138 HydrophobicContact CB-CD2 4.13Å; F133-Y138 HydrophobicContact CB-CE2 3.82Å; F133-Y138 HydrophobicContact CD1-CE2 4.12Å; F133-Y138 HydrophobicContact CG-CE2 4.49Å; F133-Y138 WeakPolarHBondContact O-CE2 3.47Å; F133-D144 HydrophobicContact CE1-CB 4.37Å; F133-D144 VanDerWaalsContact CE1-O 3.32Å; F133-D144 WeakPolarHBondContact CE1-O 3.22Å; F133-W152 HydrophobicContact CB-CH2 4.09Å; F133-W152 HydrophobicContact CB-CZ2 4.38Å; F133-W152 HydrophobicContact CD1-CH2 4.15Å; F133-W152 AromaticContact CD1-CZ2 3.63Å; F133-W152 HydrophobicContact CD1-CZ2 3.63Å; F133-W152 AromaticContact CD2-CH2 3.52Å; F133-W152 HydrophobicContact CD2-CH2 3.52Å; F133-W152 AromaticContact CD2-CZ2 3.72Å; F133-W152 HydrophobicContact CD2-CZ2 3.72Å; F133-W152 HydrophobicContact CE1-CH2 4.47Å; F133-W152 AromaticContact CE1-CZ2 3.68Å; F133-W152 HydrophobicContact CE1-CZ2 3.68Å; F133-W152 AromaticContact CE2-CH2 3.88Å; F133-W152 HydrophobicContact CE2-CH2 3.88Å; F133-W152 AromaticContact CE2-CZ2 3.77Å; F133-W152 HydrophobicContact CE2-CZ2 3.77Å; F133-W152 AromaticContact CG-CH2 3.66Å; F133-W152 HydrophobicContact CG-CH2 3.66Å; F133-W152 AromaticContact CG-CZ2 3.64Å; F133-W152 HydrophobicContact CG-CZ2 3.64Å; F133-W152 HydrophobicContact CZ-CH2 4.34Å; F133-W152 AromaticContact CZ-CZ2 3.75Å; F133-W152 HydrophobicContact CZ-CZ2 3.75Å; F133-Y159 AromaticContact CD2-CD1 3.48Å; F133-Y159 HydrophobicContact CD2-CD1 3.48Å; F133-Y159 VanDerWaalsContact CD2-CD1 3.48Å; F133-Y159 AromaticContact CD2-CE1 3.91Å; F133-Y159 HydrophobicContact CD2-CE1 3.91Å; F133-Y159 AromaticContact CD2-CG 3.86Å; F133-Y159 HydrophobicContact CD2-CG 3.86Å; F133-Y159 AromaticContact CE2-CD1 3.81Å; F133-Y159 HydrophobicContact CE2-CD1 3.81Å; F133-Y159 AromaticContact CE2-CE1 3.74Å; F133-Y159 HydrophobicContact CE2-CE1 3.74Å; F133-Y159 HydrophobicContact CE2-CG 4.49Å
134	L	83.6	Confident	82.5	Confident	123 Å²	123	67.1 Å²	67.1	64%	0.644	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	45.5	-175.8	-62.4	172.8	0	0	0	113.5	K136	L134-K136 PolarHBondContact O-N 3.1Å; L134-K136 VanDerWaalsContact O-N 3.14Å
135	D	82.3	Confident	82.9	Confident	151 Å²	151	68.2 Å²	68.2	81%	0.807	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	21.9	-178.8	-55.7	-36.7	0	0	0	114.6	F133	F133-D135 VanDerWaalsContact C-N 3.3Å; F133-D135 PolarHBondContact O-N 3.21Å
136	K	84.5	Confident	82.9	Confident	122 Å²	122	68.4 Å²	68.4	53%	0.53	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.2	171.4	-65.7	-179.9	-176.7	175.1	0	110.1	L132 F133 L134 Y138	L132-K136 WeakPolarHBondContact CA-O 3.47Å; F133-K136 PolarHBondContact N-O 2.83Å; F133-K136 PolarHBondContact O-N 3.04Å; F133-K136 VanDerWaalsContact O-N 3.09Å; F133-K136 VanDerWaalsContact O-O 3.14Å; L134-K136 PolarHBondContact O-N 3.1Å; L134-K136 VanDerWaalsContact O-N 3.14Å; K136-Y138 HydrophobicContact CB-CE2 3.87Å; K136-Y138 WeakPolarHBondContact O-CD2 3.27Å; K136-Y138 WeakPolarHBondContact O-CE2 3.22Å
137	E	86.4	Confident	82.8	Confident	119 Å²	119	74.3 Å²	74.3	56%	0.556	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.8	172.4	-71.8	175.1	-168.6	0	0	110	F131 L132 Y157	F131-E137 WeakPolarHBondContact O-CA 3.26Å; L132-E137 HydrophobicContact CD1-CG 3.93Å; E137-Y157 PolarHBondContact OE1-OH 2.93Å
138	Y	82.9	Confident	82.6	Confident	30 Å²	30	79.2 Å²	79.2	12%	0.118	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.8	176.1	-61.6	-89.2	0	0	0	109.9	P130 F131 F133 K136 T142 D144	P130-Y138 VanDerWaalsContact CA-O 3.24Å; P130-Y138 WeakPolarHBondContact CA-O 3.44Å; F131-Y138 HydrophobicContact CE2-CD2 4.11Å; F131-Y138 HydrophobicContact CZ-CD2 4.27Å; F131-Y138 HydrophobicContact CZ-CG 4.26Å; F131-Y138 PolarHBondContact N-O 3.28Å; F131-Y138 PolarHBondContact O-N 2.87Å; F133-Y138 HydrophobicContact CB-CD2 4.13Å; F133-Y138 HydrophobicContact CB-CE2 3.82Å; F133-Y138 HydrophobicContact CD1-CE2 4.12Å; F133-Y138 HydrophobicContact CG-CE2 4.49Å; F133-Y138 WeakPolarHBondContact O-CE2 3.47Å; K136-Y138 HydrophobicContact CB-CE2 3.87Å; K136-Y138 WeakPolarHBondContact O-CD2 3.27Å; K136-Y138 WeakPolarHBondContact O-CE2 3.22Å; Y138-T142 HydrophobicContact CD1-CG2 4.01Å; Y138-T142 HydrophobicContact CD2-CG2 4.38Å; Y138-T142 HydrophobicContact CE1-CG2 4.1Å; Y138-T142 VanDerWaalsContact CE1-OG1 3.26Å; Y138-T142 WeakPolarHBondContact CE1-OG1 3.26Å; Y138-T142 HydrophobicContact CE2-CG2 4.48Å; Y138-T142 HydrophobicContact CG-CG2 4.16Å; Y138-D144 HydrophobicContact CE1-CB 4.46Å; Y138-D144 PolarHBondContact OH-OD2 2.9Å
139	D	82.4	Confident	82.2	Confident	119 Å²	119	77.7 Å²	77.7	64%	0.636	42%	0.418	S	S	*	.	S	Bend	trans	-88	-9.1	174.2	-68.8	-48.8	0	0	0	113	F129 P130	F129-D139 VanDerWaalsContact CD1-O 3.23Å; F129-D139 WeakPolarHBondContact CD1-O 3.3Å; F129-D139 WeakPolarHBondContact CG-O 3.45Å; P130-D139 WeakPolarHBondContact CB-OD1 3.46Å
140	E	82.1	Confident	81.9	Confident	136 Å²	136	81.6 Å²	81.6	64%	0.636	43%	0.431	S	S	*	.	S	Bend	trans	-140.5	169	-179.5	-63.6	-172.3	163.2	0	0	109.9	F129	F129-E140 VanDerWaalsContact CE1-CA 3.5Å
141	C	84.5	Confident	81.9	Confident	26 Å²	26	83.9 Å²	83.9	18%	0.176	44%	0.44	C	S	.	.			trans	-62.3	138.9	178.4	-58.5	0	0	0	0	111.8	L151 W152 C168	C141-L151 HydrophobicContact CB-CB 3.98Å; C141-W152 WeakPolarHBondContact CA-O 3.45Å; C141-C168 HydrophobicContact CB-CB 3.43Å; C141-C168 VanDerWaalsContact CB-CB 3.43Å; C141-C168 WeakPolarHBondContact CB-SG 3.48Å; C141-C168 WeakPolarHBondContact SG-CB 3.47Å; C141-C168 CovalentContact SG-SG 1.99Å; C141-C168 PolarHBondContact SG-SG 3.39Å
142	T	82.8	Confident	81.7	Confident	12 Å²	12	84.2 Å²	84.2	7%	0.074	44%	0.442	C	S	.	.	B	Isolated β-bridge	trans	-119.9	152.7	-174.9	-170.2	0	0	0	0	111.7	F131 Y138 D144 L151 W152	F131-T142 HydrophobicContact CE2-CG2 4.49Å; F131-T142 HydrophobicContact CZ-CG2 3.95Å; Y138-T142 HydrophobicContact CD1-CG2 4.01Å; Y138-T142 HydrophobicContact CD2-CG2 4.38Å; Y138-T142 HydrophobicContact CE1-CG2 4.1Å; Y138-T142 VanDerWaalsContact CE1-OG1 3.26Å; Y138-T142 WeakPolarHBondContact CE1-OG1 3.26Å; Y138-T142 HydrophobicContact CE2-CG2 4.48Å; Y138-T142 HydrophobicContact CG-CG2 4.16Å; T142-D144 HydrophobicContact CG2-CB 4.35Å; T142-D144 WeakPolarHBondContact OG1-CB 3.44Å; T142-D144 PolarHBondContact OG1-N 3.45Å; T142-D144 VanDerWaalsContact OG1-N 3.14Å; T142-L151 CarbonylContact O-C 3.39Å; T142-L151 WeakPolarHBondContact O-CA 3.44Å; T142-W152 HydrophobicContact CG2-CZ2 4.18Å; T142-W152 PolarHBondContact N-O 2.91Å; T142-W152 PolarHBondContact O-N 3.36Å
143	S	84.4	Confident	81.7	Confident	50 Å²	50	82.3 Å²	82.3	35%	0.35	43%	0.432	S	S	.	.			trans	-95.3	-2.9	167.4	55.1	0	0	0	0	112.3	G145 R146	S143-G145 PolarHBondContact O-N 3.46Å; S143-R146 PolarHBondContact O-N 2.87Å
144	D	81.6	Confident	81.8	Confident	61 Å²	61	81.1 Å²	81.1	33%	0.326	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	135	-173.5	-77.4	6.2	0	0	0	110.9	F133 Y138 T142 W152	F133-D144 HydrophobicContact CE1-CB 4.37Å; F133-D144 VanDerWaalsContact CE1-O 3.32Å; F133-D144 WeakPolarHBondContact CE1-O 3.22Å; Y138-D144 HydrophobicContact CE1-CB 4.46Å; Y138-D144 PolarHBondContact OH-OD2 2.9Å; T142-D144 HydrophobicContact CG2-CB 4.35Å; T142-D144 WeakPolarHBondContact OG1-CB 3.44Å; T142-D144 PolarHBondContact OG1-N 3.45Å; T142-D144 VanDerWaalsContact OG1-N 3.14Å; D144-W152 PolarHBondContact O-NE1 3.48Å
145	G	77.4	Confident	81.7	Confident	66 Å²	66	76 Å²	76	68%	0.68	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	1.2	-179.1	0	0	0	0	0	116	S143	S143-G145 PolarHBondContact O-N 3.46Å
146	R	77.6	Confident	81.8	Confident	75 Å²	75	70.2 Å²	70.2	28%	0.283	37%	0.371	S	S	.	.			trans	-120.5	136.9	176.3	-74.4	-176	144.7	-95.9	-6.5	112.5	S143 D148 F167	S143-R146 PolarHBondContact O-N 2.87Å; R146-D148 IonicContact NH1-OD2 3.39Å; R146-D148 PolarHBondContact NH1-OD2 3.5Å; R146-F167 VanDerWaalsContact NH1-CE1 3.26Å
147	E	76.4	Confident	81.8	Confident	199 Å²	199	69.4 Å²	69.4	93%	0.93	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-23.9	174.9	-62.4	-171.6	170.4	0	0	112.5	G149	E147-G149 VanDerWaalsContact C-N 3.31Å; E147-G149 PolarHBondContact O-N 3.22Å
148	D	75.9	Confident	81.7	Confident	116 Å²	116	66.8 Å²	66.8	62%	0.62	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-5.9	-175.3	-53	-32.8	0	0	0	114.5	R146 R150	R146-D148 IonicContact NH1-OD2 3.39Å; R146-D148 PolarHBondContact NH1-OD2 3.5Å; D148-R150 PolarHBondContact O-N 2.93Å; D148-R150 VanDerWaalsContact O-N 3.08Å
149	G	73.7	Confident	81.6	Confident	51 Å²	51	68 Å²	68	53%	0.526	36%	0.36	S	S	.	.			trans	67	4.5	179.4	0	0	0	0	0	116.5	E147	E147-G149 VanDerWaalsContact C-N 3.31Å; E147-G149 PolarHBondContact O-N 3.22Å
150	R	78.8	Confident	81.5	Confident	150 Å²	150	70.8 Å²	70.8	57%	0.566	37%	0.366	S	S	*	.			trans	-74	137	176.5	-65.4	-175.3	-177.1	-171.6	0.1	111.5	D148 F167	D148-R150 PolarHBondContact O-N 2.93Å; D148-R150 VanDerWaalsContact O-N 3.08Å; R150-F167 HydrophobicContact CB-CD1 3.86Å; R150-F167 HydrophobicContact CB-CE1 3.81Å
151	L	83.8	Confident	81.4	Confident	90 Å²	90	67.7 Å²	67.7	47%	0.471	36%	0.363	S	S	.	.			trans	-72.8	137.6	177.5	-62.9	174.8	0	0	0	111	C141 T142 F167 C168	C141-L151 HydrophobicContact CB-CB 3.98Å; T142-L151 CarbonylContact O-C 3.39Å; T142-L151 WeakPolarHBondContact O-CA 3.44Å; L151-F167 WeakPolarHBondContact O-CA 3.26Å; L151-C168 HydrophobicContact CB-CB 4.18Å; L151-C168 PolarHBondContact O-N 3.44Å
152	W	84.1	Confident	81.2	Confident	7 Å²	7	70.5 Å²	70.5	3%	0.027	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	161.6	-179.7	73.2	-85.6	0	0	0	111.7	F131 F133 C141 T142 D144 A154 Y159 W165 G166 F167 C168	F131-W152 AromaticContact CE2-CH2 3.81Å; F131-W152 HydrophobicContact CE2-CH2 3.81Å; F131-W152 HydrophobicContact CE2-CZ2 4.44Å; F131-W152 AromaticContact CE2-CZ3 3.86Å; F131-W152 HydrophobicContact CE2-CZ3 3.86Å; F131-W152 HydrophobicContact CZ-CZ3 4.39Å; F133-W152 HydrophobicContact CB-CH2 4.09Å; F133-W152 HydrophobicContact CB-CZ2 4.38Å; F133-W152 HydrophobicContact CD1-CH2 4.15Å; F133-W152 AromaticContact CD1-CZ2 3.63Å; F133-W152 HydrophobicContact CD1-CZ2 3.63Å; F133-W152 AromaticContact CD2-CH2 3.52Å; F133-W152 HydrophobicContact CD2-CH2 3.52Å; F133-W152 AromaticContact CD2-CZ2 3.72Å; F133-W152 HydrophobicContact CD2-CZ2 3.72Å; F133-W152 HydrophobicContact CE1-CH2 4.47Å; F133-W152 AromaticContact CE1-CZ2 3.68Å; F133-W152 HydrophobicContact CE1-CZ2 3.68Å; F133-W152 AromaticContact CE2-CH2 3.88Å; F133-W152 HydrophobicContact CE2-CH2 3.88Å; F133-W152 AromaticContact CE2-CZ2 3.77Å; F133-W152 HydrophobicContact CE2-CZ2 3.77Å; F133-W152 AromaticContact CG-CH2 3.66Å; F133-W152 HydrophobicContact CG-CH2 3.66Å; F133-W152 AromaticContact CG-CZ2 3.64Å; F133-W152 HydrophobicContact CG-CZ2 3.64Å; F133-W152 HydrophobicContact CZ-CH2 4.34Å; F133-W152 AromaticContact CZ-CZ2 3.75Å; F133-W152 HydrophobicContact CZ-CZ2 3.75Å; C141-W152 WeakPolarHBondContact CA-O 3.45Å; T142-W152 HydrophobicContact CG2-CZ2 4.18Å; T142-W152 PolarHBondContact N-O 2.91Å; T142-W152 PolarHBondContact O-N 3.36Å; D144-W152 PolarHBondContact O-NE1 3.48Å; W152-A154 HydrophobicContact CZ3-CB 4.3Å; W152-Y159 AromaticContact CH2-CD2 3.68Å; W152-Y159 HydrophobicContact CH2-CD2 3.68Å; W152-Y159 AromaticContact CH2-CE2 3.81Å; W152-Y159 HydrophobicContact CH2-CE2 3.81Å; W152-Y159 HydrophobicContact CH2-CG 4.1Å; W152-Y159 AromaticContact CZ3-CD2 3.56Å; W152-Y159 HydrophobicContact CZ3-CD2 3.56Å; W152-Y159 AromaticContact CZ3-CE2 3.68Å; W152-Y159 HydrophobicContact CZ3-CE2 3.68Å; W152-Y159 HydrophobicContact CZ3-CG 4.39Å; W152-W165 HydrophobicContact CB-CE3 4.19Å; W152-W165 HydrophobicContact CE3-CB 3.7Å; W152-W165 HydrophobicContact CE3-CE3 4.45Å; W152-W165 HydrophobicContact CE3-CG 4.32Å; W152-W165 HydrophobicContact CZ3-CB 3.78Å; W152-W165 HydrophobicContact CZ3-CG 4.49Å; W152-G166 WeakPolarHBondContact CA-O 3.45Å; W152-G166 WeakPolarHBondContact CB-O 3.47Å; W152-F167 HydrophobicContact CB-CD1 4.35Å; W152-C168 VanDerWaalsContact C-SG 3.58Å
153	C	85.8	Confident	81.1	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	154	175.2	67.2	0	0	0	0	111.1	C127 F129 F131 W165 G166 C168	C127-C153 HydrophobicContact CB-CB 3.51Å; C127-C153 WeakPolarHBondContact CB-SG 3.42Å; C127-C153 WeakPolarHBondContact SG-CB 3.41Å; C127-C153 CovalentContact SG-SG 2.01Å; C127-C153 PolarHBondContact SG-SG 3.03Å; F129-C153 HydrophobicContact CE1-CB 4.33Å; F129-C153 HydrophobicContact CZ-CB 4.09Å; F131-C153 HydrophobicContact CE1-CB 4.17Å; C153-W165 VanDerWaalsContact O-CA 3.28Å; C153-W165 WeakPolarHBondContact O-CA 3.39Å; C153-W165 WeakPolarHBondContact O-CB 3.48Å; C153-G166 PolarHBondContact N-O 3.41Å; C153-G166 PolarHBondContact O-N 2.9Å; C153-C168 VanDerWaalsContact CB-SG 3.51Å
154	A	86.6	Confident	81.1	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	150.9	164.7	0	0	0	0	0	110.5	H128 F131 W152 T156 Y159 K164	H128-A154 PolarHBondContact N-O 3.48Å; F131-A154 HydrophobicContact CB-CB 3.85Å; F131-A154 HydrophobicContact CD1-CB 4.45Å; F131-A154 HydrophobicContact CD2-CB 3.44Å; F131-A154 VanDerWaalsContact CD2-CB 3.44Å; F131-A154 HydrophobicContact CE2-CB 4.07Å; F131-A154 HydrophobicContact CG-CB 3.66Å; W152-A154 HydrophobicContact CZ3-CB 4.3Å; A154-T156 WeakPolarHBondContact CB-O 3.36Å; A154-Y159 HydrophobicContact CB-CD2 4.18Å; A154-K164 WeakPolarHBondContact CA-O 3.32Å
155	T	82.8	Confident	81.2	Confident	15 Å²	15	76 Å²	76	9%	0.092	39%	0.392	C	S	.	.	S	Bend	trans	-94	-4.2	175.6	65	0	0	0	0	112.9	A117 A122 E125 P126 H128 K164	A117-T155 HydrophobicContact CB-CG2 3.91Å; A122-T155 HydrophobicContact CB-CG2 3.45Å; A122-T155 VanDerWaalsContact CB-CG2 3.45Å; E125-T155 HydrophobicContact CB-CG2 3.73Å; E125-T155 WeakPolarHBondContact OE2-CB 3.38Å; E125-T155 PolarHBondContact OE2-OG1 3.5Å; P126-T155 WeakPolarHBondContact O-CB 3.37Å; P126-T155 WeakPolarHBondContact O-CG2 3.19Å; H128-T155 WeakPolarHBondContact CB-O 3.41Å; T155-K164 PolarHBondContact N-O 3.39Å; T155-K164 WeakPolarHBondContact OG1-CB 3.37Å
156	T	83	Confident	81.5	Confident	31 Å²	31	72.9 Å²	72.9	19%	0.19	36%	0.359	C	S	.	.	S	Bend	trans	-129.2	165.7	173	64.4	0	0	0	0	110.9	F131 A154 D162	F131-T156 WeakPolarHBondContact CB-O 3.26Å; A154-T156 WeakPolarHBondContact CB-O 3.36Å; T156-D162 WeakPolarHBondContact CB-OD2 3.44Å; T156-D162 HydrophobicContact CG2-CB 4.26Å; T156-D162 VanDerWaalsContact CG2-OD2 3.3Å; T156-D162 WeakPolarHBondContact CG2-OD2 3.35Å; T156-D162 WeakPolarHBondContact OG1-CB 3.34Å; T156-D162 PolarHBondContact OG1-OD2 2.97Å
157	Y	85.2	Confident	81.7	Confident	105 Å²	105	70.6 Å²	70.6	41%	0.412	35%	0.352	S	S	.	.	S	Bend	trans	-65.3	-41.6	-177.8	179.6	-96.2	0	0	0	112.9	P130 F131 L132 E137	P130-Y157 HydrophobicContact CG-CE2 4.4Å; P130-Y157 WeakPolarHBondContact O-CD2 3.46Å; F131-Y157 CarbonylContact C-O 3.51Å; F131-Y157 WeakPolarHBondContact CA-O 3.42Å; L132-Y157 HydrophobicContact CB-CE1 4.45Å; L132-Y157 WeakPolarHBondContact CB-O 3.34Å; L132-Y157 PolarHBondContact N-O 2.92Å; E137-Y157 PolarHBondContact OE1-OH 2.93Å
158	D	85	Confident	81.7	Confident	64 Å²	64	61.8 Å²	61.8	34%	0.342	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-109	100.9	-179.8	-172.1	-10	0	0	0	110.6	K160 A161 D162	D158-K160 PolarHBondContact O-N 3.31Å; D158-K160 WeakPolarHBondContact OD1-CB 3.47Å; D158-K160 PolarHBondContact OD1-N 3.49Å; D158-A161 HydrophobicContact CB-CB 4.2Å; D158-A161 PolarHBondContact O-N 2.89Å; D158-D162 PolarHBondContact O-N 3.32Å
159	Y	80.2	Confident	81.5	Confident	56 Å²	56	57.3 Å²	57.3	22%	0.22	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-35	179.2	173.3	-91.3	0	0	0	112.5	L132 F133 W152 A154 A161 E163 W165	L132-Y159 WeakPolarHBondContact O-CB 3.4Å; L132-Y159 PolarHBondContact O-N 2.96Å; F133-Y159 AromaticContact CD2-CD1 3.48Å; F133-Y159 HydrophobicContact CD2-CD1 3.48Å; F133-Y159 VanDerWaalsContact CD2-CD1 3.48Å; F133-Y159 AromaticContact CD2-CE1 3.91Å; F133-Y159 HydrophobicContact CD2-CE1 3.91Å; F133-Y159 AromaticContact CD2-CG 3.86Å; F133-Y159 HydrophobicContact CD2-CG 3.86Å; F133-Y159 AromaticContact CE2-CD1 3.81Å; F133-Y159 HydrophobicContact CE2-CD1 3.81Å; F133-Y159 AromaticContact CE2-CE1 3.74Å; F133-Y159 HydrophobicContact CE2-CE1 3.74Å; F133-Y159 HydrophobicContact CE2-CG 4.49Å; W152-Y159 AromaticContact CH2-CD2 3.68Å; W152-Y159 HydrophobicContact CH2-CD2 3.68Å; W152-Y159 AromaticContact CH2-CE2 3.81Å; W152-Y159 HydrophobicContact CH2-CE2 3.81Å; W152-Y159 HydrophobicContact CH2-CG 4.1Å; W152-Y159 AromaticContact CZ3-CD2 3.56Å; W152-Y159 HydrophobicContact CZ3-CD2 3.56Å; W152-Y159 AromaticContact CZ3-CE2 3.68Å; W152-Y159 HydrophobicContact CZ3-CE2 3.68Å; W152-Y159 HydrophobicContact CZ3-CG 4.39Å; A154-Y159 HydrophobicContact CB-CD2 4.18Å; Y159-A161 VanDerWaalsContact C-N 3.28Å; Y159-A161 PolarHBondContact O-N 2.86Å; Y159-E163 VanDerWaalsContact O-CA 3.3Å; Y159-E163 WeakPolarHBondContact O-CA 3.44Å; Y159-E163 PolarHBondContact O-N 3.33Å; Y159-W165 HydrophobicContact CD2-CB 4.21Å; Y159-W165 HydrophobicContact CE2-CB 3.75Å; Y159-W165 AromaticContact CE2-CD1 3.55Å; Y159-W165 AromaticContact CE2-CG 3.8Å; Y159-W165 HydrophobicContact CE2-CG 3.8Å
160	K	80.2	Confident	81.5	Confident	177 Å²	177	58.2 Å²	58.2	77%	0.77	28%	0.283	S	S	*	.	H	α-helix	trans	-73.3	-23.2	-173.1	-165.2	-179.6	-178.6	179.9	0	112.4	D158	D158-K160 PolarHBondContact O-N 3.31Å; D158-K160 WeakPolarHBondContact OD1-CB 3.47Å; D158-K160 PolarHBondContact OD1-N 3.49Å
161	A	80.4	Confident	81.3	Confident	70 Å²	70	59.6 Å²	59.6	58%	0.579	30%	0.295	S	S	*	.	H	α-helix	trans	-82.2	-43.5	179.4	0	0	0	0	0	111.9	D158 Y159	D158-A161 HydrophobicContact CB-CB 4.2Å; D158-A161 PolarHBondContact O-N 2.89Å; Y159-A161 VanDerWaalsContact C-N 3.28Å; Y159-A161 PolarHBondContact O-N 2.86Å
162	D	79.1	Confident	81	Confident	86 Å²	86	62.2 Å²	62.2	46%	0.46	31%	0.305	S	S	.	.	H	α-helix	trans	-105.7	-20.6	-169.3	-58.8	-44.8	0	0	0	113.7	T156 D158 K164	T156-D162 WeakPolarHBondContact CB-OD2 3.44Å; T156-D162 HydrophobicContact CG2-CB 4.26Å; T156-D162 VanDerWaalsContact CG2-OD2 3.3Å; T156-D162 WeakPolarHBondContact CG2-OD2 3.35Å; T156-D162 WeakPolarHBondContact OG1-CB 3.34Å; T156-D162 PolarHBondContact OG1-OD2 2.97Å; D158-D162 PolarHBondContact O-N 3.32Å; D162-K164 HydrophobicContact CB-CG 4.43Å; D162-K164 PolarHBondContact O-N 2.9Å
163	E	82.1	Confident	80.6	Confident	128 Å²	128	66.3 Å²	66.3	60%	0.598	32%	0.324	S	S	*	.			trans	50.2	21.6	-175.9	-60.6	-174.1	169	0	0	114.1	T121 Y159	T121-E163 WeakPolarHBondContact CB-O 3.39Å; T121-E163 PolarHBondContact OG1-O 2.84Å; Y159-E163 VanDerWaalsContact O-CA 3.3Å; Y159-E163 WeakPolarHBondContact O-CA 3.44Å; Y159-E163 PolarHBondContact O-N 3.33Å
164	K	84.3	Confident	80	Confident	74 Å²	74	66.5 Å²	66.5	32%	0.322	33%	0.326	S	S	.	.			trans	-89.8	114.8	177.4	-72.6	-170.4	173.8	-169.1	0	111	T121 A122 E125 A154 T155 D162	T121-K164 WeakPolarHBondContact OG1-CA 3.29Å; A122-K164 HydrophobicContact CB-CB 4.17Å; E125-K164 IonicContact OE1-NZ 2.78Å; E125-K164 PolarHBondContact OE1-NZ 2.94Å; E125-K164 IonicContact OE2-NZ 3.51Å; A154-K164 WeakPolarHBondContact CA-O 3.32Å; T155-K164 PolarHBondContact N-O 3.39Å; T155-K164 WeakPolarHBondContact OG1-CB 3.37Å; D162-K164 HydrophobicContact CB-CG 4.43Å; D162-K164 PolarHBondContact O-N 2.9Å
165	W	83.6	Confident	79.8	Confident	36 Å²	36	68.8 Å²	68.8	14%	0.136	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	165.4	177.4	66.4	-81.4	0	0	0	111.6	T121 A122 W152 C153 Y159 F167	T121-W165 PolarHBondContact N-O 2.88Å; T121-W165 PolarHBondContact OG1-N 2.68Å; A122-W165 WeakPolarHBondContact CB-O 3.4Å; A122-W165 PolarHBondContact N-O 3.36Å; A122-W165 VanDerWaalsContact N-O 3.12Å; W152-W165 HydrophobicContact CB-CE3 4.19Å; W152-W165 HydrophobicContact CE3-CB 3.7Å; W152-W165 HydrophobicContact CE3-CE3 4.45Å; W152-W165 HydrophobicContact CE3-CG 4.32Å; W152-W165 HydrophobicContact CZ3-CB 3.78Å; W152-W165 HydrophobicContact CZ3-CG 4.49Å; C153-W165 VanDerWaalsContact O-CA 3.28Å; C153-W165 WeakPolarHBondContact O-CA 3.39Å; C153-W165 WeakPolarHBondContact O-CB 3.48Å; Y159-W165 HydrophobicContact CD2-CB 4.21Å; Y159-W165 HydrophobicContact CE2-CB 3.75Å; Y159-W165 AromaticContact CE2-CD1 3.55Å; Y159-W165 AromaticContact CE2-CG 3.8Å; Y159-W165 HydrophobicContact CE2-CG 3.8Å; W165-F167 HydrophobicContact CH2-CE1 4.46Å; W165-F167 AromaticContact CH2-CE2 3.92Å; W165-F167 HydrophobicContact CH2-CE2 3.92Å; W165-F167 AromaticContact CH2-CZ 3.88Å; W165-F167 HydrophobicContact CH2-CZ 3.88Å; W165-F167 HydrophobicContact CZ3-CD1 4.19Å; W165-F167 HydrophobicContact CZ3-CD2 4.06Å; W165-F167 AromaticContact CZ3-CE1 3.94Å; W165-F167 HydrophobicContact CZ3-CE1 3.94Å; W165-F167 AromaticContact CZ3-CE2 3.8Å; W165-F167 HydrophobicContact CZ3-CE2 3.8Å; W165-F167 HydrophobicContact CZ3-CG 4.27Å; W165-F167 AromaticContact CZ3-CZ 3.76Å; W165-F167 HydrophobicContact CZ3-CZ 3.76Å
166	G	82.2	Confident	79.8	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	174.6	164	0	0	0	0	0	112.7	A117 E119 W152 C153	A117-G166 VanDerWaalsContact CB-CA 3.41Å; E119-G166 WeakPolarHBondContact O-CA 3.4Å; W152-G166 WeakPolarHBondContact CA-O 3.45Å; W152-G166 WeakPolarHBondContact CB-O 3.47Å; C153-G166 PolarHBondContact N-O 3.41Å; C153-G166 PolarHBondContact O-N 2.9Å
167	F	83.7	Confident	79.8	Confident	28 Å²	28	75.5 Å²	75.5	12%	0.123	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	141.8	-179.9	-62.6	-75.6	0	0	0	111	A117 I118 E119 R146 R150 L151 W152 W165	A117-F167 WeakPolarHBondContact CA-O 3.46Å; I118-F167 PolarHBondContact N-O 3.28Å; I118-F167 WeakPolarHBondContact O-CB 3.39Å; I118-F167 WeakPolarHBondContact O-CD2 3.36Å; I118-F167 PolarHBondContact O-N 3.12Å; E119-F167 HydrophobicContact CB-CD2 3.96Å; E119-F167 HydrophobicContact CB-CE2 4.29Å; E119-F167 PolarHBondContact O-N 3.19Å; R146-F167 VanDerWaalsContact NH1-CE1 3.26Å; R150-F167 HydrophobicContact CB-CD1 3.86Å; R150-F167 HydrophobicContact CB-CE1 3.81Å; L151-F167 WeakPolarHBondContact O-CA 3.26Å; W152-F167 HydrophobicContact CB-CD1 4.35Å; W165-F167 HydrophobicContact CH2-CE1 4.46Å; W165-F167 AromaticContact CH2-CE2 3.92Å; W165-F167 HydrophobicContact CH2-CE2 3.92Å; W165-F167 AromaticContact CH2-CZ 3.88Å; W165-F167 HydrophobicContact CH2-CZ 3.88Å; W165-F167 HydrophobicContact CZ3-CD1 4.19Å; W165-F167 HydrophobicContact CZ3-CD2 4.06Å; W165-F167 AromaticContact CZ3-CE1 3.94Å; W165-F167 HydrophobicContact CZ3-CE1 3.94Å; W165-F167 AromaticContact CZ3-CE2 3.8Å; W165-F167 HydrophobicContact CZ3-CE2 3.8Å; W165-F167 HydrophobicContact CZ3-CG 4.27Å; W165-F167 AromaticContact CZ3-CZ 3.76Å; W165-F167 HydrophobicContact CZ3-CZ 3.76Å
168	C	75.3	Confident	79.8	Confident	13 Å²	13	76.5 Å²	76.5	9%	0.088	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-80.3	133.3	171.3	-71.9	0	0	0	0	110.4	C141 L151 W152 C153	C141-C168 HydrophobicContact CB-CB 3.43Å; C141-C168 VanDerWaalsContact CB-CB 3.43Å; C141-C168 WeakPolarHBondContact CB-SG 3.48Å; C141-C168 WeakPolarHBondContact SG-CB 3.47Å; C141-C168 CovalentContact SG-SG 1.99Å; C141-C168 PolarHBondContact SG-SG 3.39Å; L151-C168 HydrophobicContact CB-CB 4.18Å; L151-C168 PolarHBondContact O-N 3.44Å; W152-C168 VanDerWaalsContact C-SG 3.58Å; C153-C168 VanDerWaalsContact CB-SG 3.51Å
169	E	71.1	Confident	79.9	Confident	22 Å²	22	77.9 Å²	77.9	10%	0.103	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-66.3	138.9	176.1	-167.3	177.5	-146.3	0	0	111.5	I118 E173 A174 R177	I118-E169 HydrophobicContact CD1-CB 4.08Å; I118-E169 HydrophobicContact CD1-CG 4.09Å; E169-E173 VanDerWaalsContact CD-C 3.48Å; E169-E173 HydrophobicContact CG-CB 3.35Å; E169-E173 VanDerWaalsContact OE1-O 3.12Å; E169-A174 HydrophobicContact CG-CB 4.08Å; E169-A174 VanDerWaalsContact OE1-CA 3.31Å; E169-A174 WeakPolarHBondContact OE1-CA 3.47Å; E169-A174 PolarHBondContact OE1-N 2.96Å; E169-A174 VanDerWaalsContact OE1-N 3.11Å; E169-A174 VanDerWaalsContact OE2-CA 3.25Å; E169-A174 WeakPolarHBondContact OE2-CA 3.49Å; E169-A174 VanDerWaalsContact OE2-CB 3.25Å; E169-A174 WeakPolarHBondContact OE2-CB 3.43Å; E169-R177 IonicContact OE1-CZ 3.95Å; E169-R177 IonicContact OE1-NE 3.71Å; E169-R177 IonicContact OE1-NH1 2.68Å; E169-R177 PolarHBondContact OE1-NH1 2.89Å; E169-R177 IonicContact OE1-NH2 2.76Å; E169-R177 PolarHBondContact OE1-NH2 3.29Å; E169-R177 IonicContact OE2-CZ 3.72Å; E169-R177 IonicContact OE2-NH1 3.23Å; E169-R177 PolarHBondContact OE2-NH1 3.49Å; E169-R177 IonicContact OE2-NH2 3.05Å; E169-R177 PolarHBondContact OE2-NH2 2.89Å
170	T	75.1	Confident	80.3	Confident	71 Å²	71	81.2 Å²	81.2	44%	0.436	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-68.7	153.6	169.9	60	0	0	0	0	110.9	E172 E173 A174	T170-E172 PolarHBondContact O-N 3.11Å; T170-E172 VanDerWaalsContact O-N 3.1Å; T170-E173 PolarHBondContact N-OE2 3.26Å; T170-E173 PolarHBondContact O-N 3.47Å; T170-E173 VanDerWaalsContact O-N 3.14Å; T170-E173 WeakPolarHBondContact OG1-CB 3.15Å; T170-E173 WeakPolarHBondContact OG1-CG 3.46Å; T170-E173 PolarHBondContact OG1-N 2.91Å; T170-E173 PolarHBondContact OG1-OE2 3.42Å; T170-A174 WeakPolarHBondContact O-CB 3.49Å; T170-A174 PolarHBondContact O-N 3.46Å
171	E	74.5	Confident	80.8	Confident	179 Å²	179	78.5 Å²	78.5	84%	0.836	39%	0.385	S	S	*	.	H	α-helix	trans	-56.5	-30.6	176.6	-71.6	-168.1	159.1	0	0	112.5	A175	E171-A175 WeakPolarHBondContact O-CB 3.47Å; E171-A175 PolarHBondContact O-N 3.38Å
172	E	77.3	Confident	81.4	Confident	145 Å²	145	79.8 Å²	79.8	68%	0.678	38%	0.379	S	S	*	.	H	α-helix	trans	-69.8	-44.7	176.5	-66.4	-170.8	173.1	0	0	113.2	T170 A174 A175 K176	T170-E172 PolarHBondContact O-N 3.11Å; T170-E172 VanDerWaalsContact O-N 3.1Å; E172-A174 VanDerWaalsContact C-N 3.34Å; E172-A175 PolarHBondContact O-N 3.41Å; E172-K176 WeakPolarHBondContact O-CG 3.44Å; E172-K176 PolarHBondContact O-N 2.84Å
173	E	75.7	Confident	82.1	Confident	92 Å²	92	75.8 Å²	75.8	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-41.1	175.5	-73.2	161.6	160.3	0	0	110.5	E169 T170 A175 K176 R177	E169-E173 VanDerWaalsContact CD-C 3.48Å; E169-E173 HydrophobicContact CG-CB 3.35Å; E169-E173 VanDerWaalsContact OE1-O 3.12Å; T170-E173 PolarHBondContact N-OE2 3.26Å; T170-E173 PolarHBondContact O-N 3.47Å; T170-E173 VanDerWaalsContact O-N 3.14Å; T170-E173 WeakPolarHBondContact OG1-CB 3.15Å; T170-E173 WeakPolarHBondContact OG1-CG 3.46Å; T170-E173 PolarHBondContact OG1-N 2.91Å; T170-E173 PolarHBondContact OG1-OE2 3.42Å; E173-A175 VanDerWaalsContact C-N 3.31Å; E173-A175 PolarHBondContact O-N 2.98Å; E173-K176 WeakPolarHBondContact O-CB 3.24Å; E173-K176 PolarHBondContact O-N 2.9Å; E173-K176 VanDerWaalsContact O-N 3.13Å; E173-R177 PolarHBondContact O-N 3.3Å
174	A	73.7	Confident	82.6	Confident	4 Å²	4	72.7 Å²	72.7	3%	0.033	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-39.5	177.3	0	0	0	0	0	111.7	E169 T170 E172 R178	E169-A174 HydrophobicContact CG-CB 4.08Å; E169-A174 VanDerWaalsContact OE1-CA 3.31Å; E169-A174 WeakPolarHBondContact OE1-CA 3.47Å; E169-A174 PolarHBondContact OE1-N 2.96Å; E169-A174 VanDerWaalsContact OE1-N 3.11Å; E169-A174 VanDerWaalsContact OE2-CA 3.25Å; E169-A174 WeakPolarHBondContact OE2-CA 3.49Å; E169-A174 VanDerWaalsContact OE2-CB 3.25Å; E169-A174 WeakPolarHBondContact OE2-CB 3.43Å; T170-A174 WeakPolarHBondContact O-CB 3.49Å; T170-A174 PolarHBondContact O-N 3.46Å; E172-A174 VanDerWaalsContact C-N 3.34Å; A174-R178 VanDerWaalsContact O-CG 3.3Å; A174-R178 WeakPolarHBondContact O-CG 3.39Å; A174-R178 PolarHBondContact O-N 3.3Å; A174-R178 VanDerWaalsContact O-N 3.11Å
175	A	82.1	Confident	83.1	Confident	48 Å²	48	74.8 Å²	74.8	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-64.8	-44.3	173.4	0	0	0	0	0	111.8	E171 E172 E173 R177 R178 Q179	E171-A175 WeakPolarHBondContact O-CB 3.47Å; E171-A175 PolarHBondContact O-N 3.38Å; E172-A175 PolarHBondContact O-N 3.41Å; E173-A175 VanDerWaalsContact C-N 3.31Å; E173-A175 PolarHBondContact O-N 2.98Å; A175-R177 PolarHBondContact O-N 2.93Å; A175-R178 PolarHBondContact O-N 3.48Å; A175-Q179 WeakPolarHBondContact O-CB 3.28Å; A175-Q179 PolarHBondContact O-N 3.36Å
176	K	83.1	Confident	83.7	Confident	112 Å²	112	74.9 Å²	74.9	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-43.2	176.3	-74.5	172.1	-175.4	167.8	0	111.9	E172 E173 Q179 M180	E172-K176 WeakPolarHBondContact O-CG 3.44Å; E172-K176 PolarHBondContact O-N 2.84Å; E173-K176 WeakPolarHBondContact O-CB 3.24Å; E173-K176 PolarHBondContact O-N 2.9Å; E173-K176 VanDerWaalsContact O-N 3.13Å; K176-Q179 WeakPolarHBondContact O-CB 3.48Å; K176-Q179 PolarHBondContact O-N 3.48Å; K176-M180 HydrophobicContact CB-CE 4.06Å; K176-M180 WeakPolarHBondContact O-CG 3.46Å; K176-M180 PolarHBondContact O-N 3.47Å
177	R	82.6	Confident	84.4	Confident	76 Å²	76	76.2 Å²	76.2	29%	0.287	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-46.1	177.1	-168.3	-164.9	-58.3	129.1	-1.6	111.7	E169 E173 A175 Q179 M180 Q181	E169-R177 IonicContact OE1-CZ 3.95Å; E169-R177 IonicContact OE1-NE 3.71Å; E169-R177 IonicContact OE1-NH1 2.68Å; E169-R177 PolarHBondContact OE1-NH1 2.89Å; E169-R177 IonicContact OE1-NH2 2.76Å; E169-R177 PolarHBondContact OE1-NH2 3.29Å; E169-R177 IonicContact OE2-CZ 3.72Å; E169-R177 IonicContact OE2-NH1 3.23Å; E169-R177 PolarHBondContact OE2-NH1 3.49Å; E169-R177 IonicContact OE2-NH2 3.05Å; E169-R177 PolarHBondContact OE2-NH2 2.89Å; E173-R177 PolarHBondContact O-N 3.3Å; A175-R177 PolarHBondContact O-N 2.93Å; R177-Q179 VanDerWaalsContact C-N 3.27Å; R177-Q179 PolarHBondContact O-N 2.93Å; R177-M180 PolarHBondContact O-N 3.19Å; R177-M180 VanDerWaalsContact O-N 3.15Å; R177-Q181 WeakPolarHBondContact O-CG 3.48Å; R177-Q181 PolarHBondContact O-N 2.94Å
178	R	84.6	Confident	85	Confident	126 Å²	126	80.1 Å²	80.1	48%	0.475	38%	0.382	S	S	.	.	H	α-helix	trans	-59.1	-42	176.5	-71.3	176.6	-155.5	131.1	9.9	111.2	A174 A175 Q181 E182	A174-R178 VanDerWaalsContact O-CG 3.3Å; A174-R178 WeakPolarHBondContact O-CG 3.39Å; A174-R178 PolarHBondContact O-N 3.3Å; A174-R178 VanDerWaalsContact O-N 3.11Å; A175-R178 PolarHBondContact O-N 3.48Å; R178-Q181 PolarHBondContact O-N 2.91Å; R178-E182 WeakPolarHBondContact O-CB 3.36Å; R178-E182 PolarHBondContact O-N 3.42Å
179	Q	88.3	Confident	85.9	Confident	93 Å²	93	82.1 Å²	82.1	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-41.4	175.9	-170.5	179	13.3	0	0	112	A175 K176 R177 E182 A183 M216	A175-Q179 WeakPolarHBondContact O-CB 3.28Å; A175-Q179 PolarHBondContact O-N 3.36Å; K176-Q179 WeakPolarHBondContact O-CB 3.48Å; K176-Q179 PolarHBondContact O-N 3.48Å; R177-Q179 VanDerWaalsContact C-N 3.27Å; R177-Q179 PolarHBondContact O-N 2.93Å; Q179-E182 PolarHBondContact O-N 3.24Å; Q179-A183 VanDerWaalsContact O-CB 3.3Å; Q179-A183 WeakPolarHBondContact O-CB 3.4Å; Q179-A183 PolarHBondContact O-N 3.45Å; Q179-M216 HydrophobicContact CG-CB 4.2Å; Q179-M216 HydrophobicContact CG-CG 4.12Å; Q179-M216 HydrophobicContact CG-SD 4.07Å
180	M	87.8	Confident	87	Confident	126 Å²	126	81 Å²	81	62%	0.621	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-41.5	175.4	-69.7	-178.4	-134.2	0	0	112.3	K176 R177 A183 E184	K176-M180 HydrophobicContact CB-CE 4.06Å; K176-M180 WeakPolarHBondContact O-CG 3.46Å; K176-M180 PolarHBondContact O-N 3.47Å; R177-M180 PolarHBondContact O-N 3.19Å; R177-M180 VanDerWaalsContact O-N 3.15Å; M180-A183 PolarHBondContact O-N 3.28Å; M180-E184 PolarHBondContact O-N 2.89Å
181	Q	89.6	Confident	87.9	Confident	119 Å²	119	78.8 Å²	78.8	56%	0.556	37%	0.373	S	S	*	.	H	α-helix	trans	-65	-42.7	176.5	-72.9	175.5	-14.4	0	0	111.8	R177 R178 A183 E184 M185	R177-Q181 WeakPolarHBondContact O-CG 3.48Å; R177-Q181 PolarHBondContact O-N 2.94Å; R178-Q181 PolarHBondContact O-N 2.91Å; Q181-A183 VanDerWaalsContact C-N 3.32Å; Q181-E184 PolarHBondContact O-N 3.39Å; Q181-M185 WeakPolarHBondContact O-CB 3.21Å; Q181-M185 PolarHBondContact O-N 2.91Å
182	E	93.3	Very high	88.8	Confident	97 Å²	97	78.3 Å²	78.3	45%	0.453	37%	0.369	S	S	.	.	H	α-helix	trans	-61.9	-42.4	173.7	-171.7	-179.7	177.4	0	0	110.9	R178 Q179 M185 M186 M216	R178-E182 WeakPolarHBondContact O-CB 3.36Å; R178-E182 PolarHBondContact O-N 3.42Å; Q179-E182 PolarHBondContact O-N 3.24Å; E182-M185 PolarHBondContact O-N 2.9Å; E182-M186 HydrophobicContact CG-CE 4.32Å; E182-M186 WeakPolarHBondContact O-CB 3.28Å; E182-M186 WeakPolarHBondContact O-CG 3.11Å; E182-M186 PolarHBondContact O-N 2.76Å; E182-M216 HydrophobicContact CB-SD 4.32Å; E182-M216 HydrophobicContact CG-CE 4.21Å; E182-M216 HydrophobicContact CG-SD 4.24Å
183	A	93.9	Very high	89.5	Confident	2 Å²	2	73.4 Å²	73.4	2%	0.017	35%	0.347	C	S	.	.	H	α-helix	trans	-63.7	-42.6	177.5	0	0	0	0	0	112.7	Q179 M180 Q181 M186 Y187 A213 M216 H218	Q179-A183 VanDerWaalsContact O-CB 3.3Å; Q179-A183 WeakPolarHBondContact O-CB 3.4Å; Q179-A183 PolarHBondContact O-N 3.45Å; M180-A183 PolarHBondContact O-N 3.28Å; Q181-A183 VanDerWaalsContact C-N 3.32Å; A183-M186 PolarHBondContact O-N 2.78Å; A183-Y187 WeakPolarHBondContact O-CB 3.48Å; A183-Y187 PolarHBondContact O-N 2.81Å; A183-A213 WeakPolarHBondContact O-CB 3.37Å; A183-M216 HydrophobicContact CB-CB 3.66Å; A183-M216 HydrophobicContact CB-CE 4.11Å; A183-M216 HydrophobicContact CB-CG 4.48Å; A183-M216 HydrophobicContact CB-SD 4.1Å; A183-H218 HydrophobicContact CB-CB 4.11Å
184	E	93.9	Very high	90.1	Very high	64 Å²	64	70.2 Å²	70.2	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-44	174.9	-179.9	62.2	-143.5	0	0	110.9	M180 Q181 M186 Y187 Q188 H218	M180-E184 PolarHBondContact O-N 2.89Å; Q181-E184 PolarHBondContact O-N 3.39Å; E184-M186 PolarHBondContact O-N 3.07Å; E184-Y187 WeakPolarHBondContact O-CB 3.29Å; E184-Y187 PolarHBondContact O-N 3.43Å; E184-Q188 HydrophobicContact CG-CG 4.46Å; E184-Q188 WeakPolarHBondContact O-CG 3.25Å; E184-Q188 PolarHBondContact O-N 3.36Å; E184-Q188 WeakPolarHBondContact OE1-CG 3.38Å; E184-Q188 PolarHBondContact OE1-NE2 3.45Å; E184-H218 IonicContact OE2-CD2 3.51Å; E184-H218 IonicContact OE2-CE1 2.71Å; E184-H218 IonicContact OE2-NE2 3.62Å; E184-H218 PolarHBondContact OE2-NE2 3.19Å
185	M	94.9	Very high	90.7	Very high	118 Å²	118	76 Å²	76	58%	0.581	36%	0.363	S	S	*	.	H	α-helix	trans	-59.5	-45.2	176.3	-174.6	-158.2	-60.4	0	0	111.8	Q181 E182 Y187 Q188 T189	Q181-M185 WeakPolarHBondContact O-CB 3.21Å; Q181-M185 PolarHBondContact O-N 2.91Å; E182-M185 PolarHBondContact O-N 2.9Å; M185-Y187 VanDerWaalsContact C-N 3.33Å; M185-Q188 PolarHBondContact O-N 2.73Å; M185-T189 WeakPolarHBondContact O-CB 3.44Å; M185-T189 PolarHBondContact O-N 3.31Å; M185-T189 PolarHBondContact O-OG1 3.36Å
186	M	95.8	Very high	90.6	Very high	37 Å²	37	77.1 Å²	77.1	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-63.7	-40.6	176.7	-67.7	-73.2	176.2	0	0	111.1	E182 A183 E184 T189 G190 Y209 A213 M216	E182-M186 HydrophobicContact CG-CE 4.32Å; E182-M186 WeakPolarHBondContact O-CB 3.28Å; E182-M186 WeakPolarHBondContact O-CG 3.11Å; E182-M186 PolarHBondContact O-N 2.76Å; A183-M186 PolarHBondContact O-N 2.78Å; E184-M186 PolarHBondContact O-N 3.07Å; M186-T189 PolarHBondContact O-N 3.48Å; M186-G190 PolarHBondContact O-N 3.5Å; M186-Y209 HydrophobicContact SD-CD1 3.76Å; M186-Y209 HydrophobicContact SD-CE1 4.23Å; M186-A213 HydrophobicContact CB-CB 4.08Å; M186-M216 HydrophobicContact CG-CE 4.02Å
187	Y	96.1	Very high	90.3	Very high	28 Å²	28	72.7 Å²	72.7	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-61.5	-50.1	175.6	175.3	-101.6	0	0	0	111.5	A183 E184 M185 T189 G190 M191 L210 H218 K220 A221	A183-Y187 WeakPolarHBondContact O-CB 3.48Å; A183-Y187 PolarHBondContact O-N 2.81Å; E184-Y187 WeakPolarHBondContact O-CB 3.29Å; E184-Y187 PolarHBondContact O-N 3.43Å; M185-Y187 VanDerWaalsContact C-N 3.33Å; Y187-T189 VanDerWaalsContact C-N 3.34Å; Y187-T189 PolarHBondContact O-N 3.04Å; Y187-G190 PolarHBondContact O-N 3.4Å; Y187-M191 HydrophobicContact CD1-CG 4.25Å; Y187-M191 HydrophobicContact CD2-CG 4.36Å; Y187-M191 HydrophobicContact CE1-CG 3.82Å; Y187-M191 HydrophobicContact CE2-CG 3.97Å; Y187-M191 HydrophobicContact CE2-SD 4.28Å; Y187-M191 HydrophobicContact CG-CG 4.49Å; Y187-M191 WeakPolarHBondContact O-CB 3.19Å; Y187-M191 VanDerWaalsContact O-CG 3.3Å; Y187-M191 WeakPolarHBondContact O-CG 3.27Å; Y187-M191 PolarHBondContact O-N 2.95Å; Y187-L210 HydrophobicContact CD2-CD2 3.54Å; Y187-L210 HydrophobicContact CE2-CD2 4.04Å; Y187-L210 HydrophobicContact CG-CD2 4.42Å; Y187-H218 AromaticContact CD1-CE1 3.78Å; Y187-H218 AromaticContact CD2-CE1 3.88Å; Y187-H218 AromaticContact CD2-ND1 4Å; Y187-H218 AromaticContact CG-CE1 3.57Å; Y187-K220 HydrophobicContact CE1-CD 4.35Å; Y187-K220 HydrophobicContact CE2-CB 3.89Å; Y187-A221 HydrophobicContact CD2-CB 3.79Å; Y187-A221 HydrophobicContact CE2-CB 4.43Å
188	Q	95.6	Very high	89.8	Confident	111 Å²	111	73.6 Å²	73.6	52%	0.519	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-41.1	178.2	-70.6	-179	5.7	0	0	112.2	E184 M185 M191 K192	E184-Q188 HydrophobicContact CG-CG 4.46Å; E184-Q188 WeakPolarHBondContact O-CG 3.25Å; E184-Q188 PolarHBondContact O-N 3.36Å; E184-Q188 WeakPolarHBondContact OE1-CG 3.38Å; E184-Q188 PolarHBondContact OE1-NE2 3.45Å; M185-Q188 PolarHBondContact O-N 2.73Å; Q188-M191 PolarHBondContact O-N 3.09Å; Q188-K192 WeakPolarHBondContact O-CB 3.33Å; Q188-K192 PolarHBondContact O-N 3.24Å
189	T	94.6	Very high	89.7	Confident	54 Å²	54	74.1 Å²	74.1	33%	0.331	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-47.7	176.4	-57.6	0	0	0	0	111	M185 M186 Y187 M191 K192 I193 Y209	M185-T189 WeakPolarHBondContact O-CB 3.44Å; M185-T189 PolarHBondContact O-N 3.31Å; M185-T189 PolarHBondContact O-OG1 3.36Å; M186-T189 PolarHBondContact O-N 3.48Å; Y187-T189 VanDerWaalsContact C-N 3.34Å; Y187-T189 PolarHBondContact O-N 3.04Å; T189-M191 VanDerWaalsContact C-N 3.34Å; T189-M191 PolarHBondContact O-N 3.43Å; T189-K192 PolarHBondContact O-N 2.88Å; T189-I193 HydrophobicContact CG2-CD1 4.49Å; T189-I193 WeakPolarHBondContact O-CG1 3.43Å; T189-I193 PolarHBondContact O-N 2.82Å; T189-Y209 HydrophobicContact CG2-CD1 4.4Å; T189-Y209 HydrophobicContact CG2-CE1 4.36Å
190	G	94.3	Very high	89.5	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-43.2	174.7	0	0	0	0	0	112.3	M186 Y187 K192 I193 L194 A206	M186-G190 PolarHBondContact O-N 3.5Å; Y187-G190 PolarHBondContact O-N 3.4Å; G190-K192 PolarHBondContact O-N 2.83Å; G190-I193 PolarHBondContact O-N 3.39Å; G190-L194 WeakPolarHBondContact O-CG 3.45Å; G190-L194 PolarHBondContact O-N 3.03Å; G190-A206 WeakPolarHBondContact O-CB 3.49Å
191	M	94.2	Very high	89.5	Confident	23 Å²	23	73 Å²	73	11%	0.113	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-39.6	178.2	-76.4	-54.9	-50.7	0	0	113.3	Y187 Q188 T189 I193 L194 N195 R224	Y187-M191 HydrophobicContact CD1-CG 4.25Å; Y187-M191 HydrophobicContact CD2-CG 4.36Å; Y187-M191 HydrophobicContact CE1-CG 3.82Å; Y187-M191 HydrophobicContact CE2-CG 3.97Å; Y187-M191 HydrophobicContact CE2-SD 4.28Å; Y187-M191 HydrophobicContact CG-CG 4.49Å; Y187-M191 WeakPolarHBondContact O-CB 3.19Å; Y187-M191 VanDerWaalsContact O-CG 3.3Å; Y187-M191 WeakPolarHBondContact O-CG 3.27Å; Y187-M191 PolarHBondContact O-N 2.95Å; Q188-M191 PolarHBondContact O-N 3.09Å; T189-M191 VanDerWaalsContact C-N 3.34Å; T189-M191 PolarHBondContact O-N 3.43Å; M191-I193 VanDerWaalsContact C-N 3.32Å; M191-I193 PolarHBondContact O-N 2.98Å; M191-L194 PolarHBondContact O-N 3.05Å; M191-L194 HydrophobicContact SD-CD1 4.17Å; M191-N195 WeakPolarHBondContact O-CB 2.98Å; M191-N195 PolarHBondContact O-N 2.9Å; M191-R224 VanDerWaalsContact CE-CZ 3.45Å; M191-R224 VanDerWaalsContact CE-NH2 3.34Å; M191-R224 PolarHBondContact SD-NH1 3.19Å
192	K	93.6	Very high	89.4	Confident	170 Å²	170	70.8 Å²	70.8	74%	0.739	37%	0.368	S	S	*	.	H	α-helix	trans	-61.3	-41.8	176.3	-173.2	176.6	-178.7	176.9	0	111.4	Q188 T189 G190 G196	Q188-K192 WeakPolarHBondContact O-CB 3.33Å; Q188-K192 PolarHBondContact O-N 3.24Å; T189-K192 PolarHBondContact O-N 2.88Å; G190-K192 PolarHBondContact O-N 2.83Å; K192-G196 PolarHBondContact O-N 3.28Å
193	I	91.9	Very high	89.2	Confident	42 Å²	42	67.9 Å²	67.9	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-42.9	177	-60.9	167.2	0	0	0	110.8	T189 G190 M191 N195 G196 S197 Q202 A206 Y209	T189-I193 HydrophobicContact CG2-CD1 4.49Å; T189-I193 WeakPolarHBondContact O-CG1 3.43Å; T189-I193 PolarHBondContact O-N 2.82Å; G190-I193 PolarHBondContact O-N 3.39Å; M191-I193 VanDerWaalsContact C-N 3.32Å; M191-I193 PolarHBondContact O-N 2.98Å; I193-N195 VanDerWaalsContact C-N 3.33Å; I193-N195 PolarHBondContact O-N 3.49Å; I193-G196 PolarHBondContact O-N 3.43Å; I193-S197 PolarHBondContact O-N 2.98Å; I193-S197 VanDerWaalsContact O-N 3.11Å; I193-Q202 HydrophobicContact CG2-CB 4.22Å; I193-Q202 WeakPolarHBondContact CG2-O 3.31Å; I193-A206 HydrophobicContact CB-CB 3.88Å; I193-A206 HydrophobicContact CG2-CB 3.83Å; I193-Y209 HydrophobicContact CD1-CD2 4.19Å; I193-Y209 HydrophobicContact CD1-CE2 4.11Å
194	L	88.9	Confident	89.1	Confident	24 Å²	24	73.9 Å²	73.9	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-61.9	-39.4	178	-75.3	179.3	0	0	0	112.9	G190 M191 K203 A206 Y207 L210	G190-L194 WeakPolarHBondContact O-CG 3.45Å; G190-L194 PolarHBondContact O-N 3.03Å; M191-L194 PolarHBondContact O-N 3.05Å; M191-L194 HydrophobicContact SD-CD1 4.17Å; L194-K203 HydrophobicContact CD2-CB 4.13Å; L194-K203 HydrophobicContact CD2-CG 4.03Å; L194-A206 HydrophobicContact CD2-CB 3.76Å; L194-A206 HydrophobicContact CG-CB 3.7Å; L194-Y207 HydrophobicContact CD1-CE2 4.49Å; L194-Y207 HydrophobicContact CD2-CD2 4.27Å; L194-Y207 HydrophobicContact CD2-CE2 3.99Å; L194-L210 HydrophobicContact CD1-CD1 3.8Å
195	N	86.6	Confident	88.9	Confident	127 Å²	127	74.8 Å²	74.8	68%	0.679	38%	0.38	S	S	*	.	H	α-helix	trans	-79.2	-31	179.5	-67.9	-6.8	0	0	0	112.2	M191 I193	M191-N195 WeakPolarHBondContact O-CB 2.98Å; M191-N195 PolarHBondContact O-N 2.9Å; I193-N195 VanDerWaalsContact C-N 3.33Å; I193-N195 PolarHBondContact O-N 3.49Å
196	G	79.1	Confident	88.9	Confident	70 Å²	70	69.1 Å²	69.1	72%	0.722	35%	0.353	S	S	*	.	H	α-helix	trans	-86.9	-16.7	-175.1	0	0	0	0	0	115.4	K192 I193	K192-G196 PolarHBondContact O-N 3.28Å; I193-G196 PolarHBondContact O-N 3.43Å
197	S	77.9	Confident	88.8	Confident	20 Å²	20	68.5 Å²	68.5	14%	0.14	35%	0.349	C	S	.	.			trans	-140.4	138.9	-177.9	-178.6	0	0	0	0	115.1	I193 K199 Q202 K203	I193-S197 PolarHBondContact O-N 2.98Å; I193-S197 VanDerWaalsContact O-N 3.11Å; S197-K199 PolarHBondContact OG-N 2.94Å; S197-K199 VanDerWaalsContact OG-N 3.08Å; S197-Q202 PolarHBondContact OG-OE1 2.93Å; S197-K203 WeakPolarHBondContact O-CE 3.22Å
198	N	72.1	Confident	88.7	Confident	94 Å²	94	74.6 Å²	74.6	50%	0.503	37%	0.371	S	S	.	.			trans	-89.2	-9.9	173.2	-69.9	-11.2	0	0	0	113.9	K200 E391	N198-K200 PolarHBondContact O-N 3.41Å; N198-E391 PolarHBondContact ND2-OE2 3.35Å
199	K	82.1	Confident	88.7	Confident	138 Å²	138	72.6 Å²	72.6	60%	0.6	36%	0.359	S	S	*	.			trans	-68.2	127.2	-175.4	-69.2	-179	179.2	176.9	0	111.7	S197 S201 Q202 K203	S197-K199 PolarHBondContact OG-N 2.94Å; S197-K199 VanDerWaalsContact OG-N 3.08Å; K199-S201 PolarHBondContact O-N 3.2Å; K199-S201 VanDerWaalsContact O-N 3.17Å; K199-Q202 HydrophobicContact CB-CB 4.35Å; K199-Q202 HydrophobicContact CB-CG 4.42Å; K199-Q202 PolarHBondContact O-N 3.18Å; K199-Q202 VanDerWaalsContact O-N 3.08Å; K199-K203 PolarHBondContact O-N 2.95Å
200	K	83.4	Confident	88.7	Confident	113 Å²	113	70 Å²	70	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-53.9	-37	179.1	-167.7	172.1	-173.8	170.8	0	112.8	N198 R204 Y234	N198-K200 PolarHBondContact O-N 3.41Å; K200-R204 WeakPolarHBondContact O-CG 3.39Å; K200-R204 PolarHBondContact O-N 3.17Å; K200-Y234 HydrophobicContact CG-CD1 4.01Å; K200-Y234 HydrophobicContact CG-CE1 4.06Å
201	S	86.8	Confident	88.8	Confident	82 Å²	82	73.6 Å²	73.6	57%	0.573	36%	0.36	S	S	*	.	H	α-helix	trans	-65.4	-44.8	177.1	54.9	0	0	0	0	113.1	K199 R204 E205	K199-S201 PolarHBondContact O-N 3.2Å; K199-S201 VanDerWaalsContact O-N 3.17Å; S201-R204 WeakPolarHBondContact O-CB 3.31Å; S201-R204 PolarHBondContact O-N 3.37Å; S201-E205 PolarHBondContact O-N 2.87Å; S201-E205 VanDerWaalsContact O-N 3.11Å
202	Q	88.2	Confident	88.8	Confident	72 Å²	72	78.5 Å²	78.5	34%	0.336	38%	0.381	S	S	.	.	H	α-helix	trans	-70.8	-35.7	178.6	-71.8	176.6	-35.8	0	0	111.2	I193 S197 K199 R204 E205 A206	I193-Q202 HydrophobicContact CG2-CB 4.22Å; I193-Q202 WeakPolarHBondContact CG2-O 3.31Å; S197-Q202 PolarHBondContact OG-OE1 2.93Å; K199-Q202 HydrophobicContact CB-CB 4.35Å; K199-Q202 HydrophobicContact CB-CG 4.42Å; K199-Q202 PolarHBondContact O-N 3.18Å; K199-Q202 VanDerWaalsContact O-N 3.08Å; Q202-R204 PolarHBondContact O-N 3.4Å; Q202-E205 WeakPolarHBondContact O-CB 3.27Å; Q202-E205 PolarHBondContact O-N 3.11Å; Q202-A206 PolarHBondContact O-N 3.19Å
203	K	89	Confident	88.9	Confident	37 Å²	37	70.4 Å²	70.4	16%	0.161	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-42.5	171.1	-68.5	-174.5	176.3	171.2	0	111.8	L194 S197 K199 E205 A206 Y207 Y234	L194-K203 HydrophobicContact CD2-CB 4.13Å; L194-K203 HydrophobicContact CD2-CG 4.03Å; S197-K203 WeakPolarHBondContact O-CE 3.22Å; K199-K203 PolarHBondContact O-N 2.95Å; K203-E205 VanDerWaalsContact C-N 3.3Å; K203-E205 PolarHBondContact O-N 2.99Å; K203-A206 WeakPolarHBondContact O-CB 3.23Å; K203-A206 PolarHBondContact O-N 3.48Å; K203-Y207 VanDerWaalsContact O-CD2 3.32Å; K203-Y207 WeakPolarHBondContact O-CD2 3.38Å; K203-Y207 PolarHBondContact O-N 2.9Å; K203-Y234 HydrophobicContact CB-CD1 3.56Å; K203-Y234 HydrophobicContact CB-CD2 4.47Å; K203-Y234 HydrophobicContact CB-CE1 3.57Å; K203-Y234 HydrophobicContact CB-CE2 4.48Å; K203-Y234 HydrophobicContact CB-CG 4.05Å; K203-Y234 HydrophobicContact CD-CD1 4.37Å; K203-Y234 HydrophobicContact CD-CE1 3.5Å; K203-Y234 VanDerWaalsContact CD-CE1 3.5Å; K203-Y234 HydrophobicContact CD-CE2 4.14Å; K203-Y234 VanDerWaalsContact CD-OH 3.23Å; K203-Y234 WeakPolarHBondContact CD-OH 3.49Å; K203-Y234 HydrophobicContact CG-CE1 4.14Å
204	R	91.4	Very high	89	Confident	128 Å²	128	68.9 Å²	68.9	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-58.1	-41.8	172.9	-75.2	178.9	173.6	169.2	-0.4	112.3	K200 S201 Q202 Y207 R208 Y234	K200-R204 WeakPolarHBondContact O-CG 3.39Å; K200-R204 PolarHBondContact O-N 3.17Å; S201-R204 WeakPolarHBondContact O-CB 3.31Å; S201-R204 PolarHBondContact O-N 3.37Å; Q202-R204 PolarHBondContact O-N 3.4Å; R204-Y207 PolarHBondContact O-N 2.84Å; R204-R208 PolarHBondContact O-N 3.05Å; R204-Y234 WeakPolarHBondContact CG-O 3.4Å
205	E	91.5	Very high	89.2	Confident	82 Å²	82	70.7 Å²	70.7	38%	0.383	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-43.3	176.2	-174.1	176.7	-172.5	0	0	112	S201 Q202 K203 Y207 R208 Y209	S201-E205 PolarHBondContact O-N 2.87Å; S201-E205 VanDerWaalsContact O-N 3.11Å; Q202-E205 WeakPolarHBondContact O-CB 3.27Å; Q202-E205 PolarHBondContact O-N 3.11Å; K203-E205 VanDerWaalsContact C-N 3.3Å; K203-E205 PolarHBondContact O-N 2.99Å; E205-Y207 VanDerWaalsContact C-N 3.29Å; E205-Y207 PolarHBondContact O-N 3.18Å; E205-R208 VanDerWaalsContact O-CB 3.3Å; E205-R208 WeakPolarHBondContact O-CB 3.44Å; E205-R208 PolarHBondContact O-N 3.28Å; E205-Y209 HydrophobicContact CG-CE2 4.16Å; E205-Y209 WeakPolarHBondContact O-CD2 3.46Å; E205-Y209 PolarHBondContact O-N 3.21Å
206	A	94.2	Very high	89.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-57.4	-41.5	175.1	0	0	0	0	0	112.5	G190 I193 L194 Q202 K203 R208 Y209 L210	G190-A206 WeakPolarHBondContact O-CB 3.49Å; I193-A206 HydrophobicContact CB-CB 3.88Å; I193-A206 HydrophobicContact CG2-CB 3.83Å; L194-A206 HydrophobicContact CD2-CB 3.76Å; L194-A206 HydrophobicContact CG-CB 3.7Å; Q202-A206 PolarHBondContact O-N 3.19Å; K203-A206 WeakPolarHBondContact O-CB 3.23Å; K203-A206 PolarHBondContact O-N 3.48Å; A206-R208 PolarHBondContact O-N 3.12Å; A206-Y209 WeakPolarHBondContact O-CB 3.16Å; A206-Y209 PolarHBondContact O-N 3.33Å; A206-Y209 VanDerWaalsContact O-N 3.14Å; A206-L210 WeakPolarHBondContact O-CG 3.45Å; A206-L210 PolarHBondContact O-N 2.97Å
207	Y	93.9	Very high	89.9	Confident	24 Å²	24	67.3 Å²	67.3	9%	0.094	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-23.8	175.8	-87.6	-82.7	0	0	0	113.7	L194 K203 R204 E205 L210 Q211 A228 Y234 L235	L194-Y207 HydrophobicContact CD1-CE2 4.49Å; L194-Y207 HydrophobicContact CD2-CD2 4.27Å; L194-Y207 HydrophobicContact CD2-CE2 3.99Å; K203-Y207 VanDerWaalsContact O-CD2 3.32Å; K203-Y207 WeakPolarHBondContact O-CD2 3.38Å; K203-Y207 PolarHBondContact O-N 2.9Å; R204-Y207 PolarHBondContact O-N 2.84Å; E205-Y207 VanDerWaalsContact C-N 3.29Å; E205-Y207 PolarHBondContact O-N 3.18Å; Y207-L210 HydrophobicContact CD1-CD1 4.12Å; Y207-L210 HydrophobicContact CE1-CD1 4.22Å; Y207-L210 PolarHBondContact O-N 2.96Å; Y207-Q211 WeakPolarHBondContact O-CB 3.47Å; Y207-Q211 VanDerWaalsContact O-CG 3.31Å; Y207-Q211 WeakPolarHBondContact O-CG 3.29Å; Y207-Q211 PolarHBondContact O-N 2.73Å; Y207-A228 HydrophobicContact CD1-CB 3.92Å; Y207-A228 HydrophobicContact CE1-CB 3.29Å; Y207-Y234 AromaticContact CD2-CD2 3.96Å; Y207-Y234 HydrophobicContact CD2-CD2 3.96Å; Y207-Y234 HydrophobicContact CD2-CG 4.13Å; Y207-Y234 AromaticContact CE2-CD2 3.43Å; Y207-Y234 HydrophobicContact CE2-CD2 3.43Å; Y207-Y234 VanDerWaalsContact CE2-CD2 3.43Å; Y207-Y234 HydrophobicContact CE2-CE2 4.21Å; Y207-Y234 HydrophobicContact CE2-CG 4.09Å; Y207-L235 HydrophobicContact CD1-CD1 3.86Å; Y207-L235 HydrophobicContact CD1-CG 4.2Å; Y207-L235 HydrophobicContact CG-CD1 4.39Å; Y207-L235 HydrophobicContact CG-CG 4.28Å
208	R	93.8	Very high	90.7	Very high	155 Å²	155	67.5 Å²	67.5	59%	0.585	33%	0.328	S	S	*	.	H	α-helix	trans	-68	-40.6	171.3	-63	179.4	-176.7	140.4	-3	111.7	R204 E205 A206 Q211 K212	R204-R208 PolarHBondContact O-N 3.05Å; E205-R208 VanDerWaalsContact O-CB 3.3Å; E205-R208 WeakPolarHBondContact O-CB 3.44Å; E205-R208 PolarHBondContact O-N 3.28Å; A206-R208 PolarHBondContact O-N 3.12Å; R208-Q211 PolarHBondContact O-N 2.87Å; R208-K212 WeakPolarHBondContact O-CG 3.27Å; R208-K212 PolarHBondContact O-N 3.35Å; R208-K212 VanDerWaalsContact O-N 3.12Å
209	Y	95.3	Very high	91.6	Very high	69 Å²	69	66.3 Å²	66.3	27%	0.271	32%	0.323	S	S	.	.	H	α-helix	trans	-64.1	-42.6	173.4	-72.6	-78.4	0	0	0	111.3	M186 T189 I193 E205 A206 Q211 K212 A213	M186-Y209 HydrophobicContact SD-CD1 3.76Å; M186-Y209 HydrophobicContact SD-CE1 4.23Å; T189-Y209 HydrophobicContact CG2-CD1 4.4Å; T189-Y209 HydrophobicContact CG2-CE1 4.36Å; I193-Y209 HydrophobicContact CD1-CD2 4.19Å; I193-Y209 HydrophobicContact CD1-CE2 4.11Å; E205-Y209 HydrophobicContact CG-CE2 4.16Å; E205-Y209 WeakPolarHBondContact O-CD2 3.46Å; E205-Y209 PolarHBondContact O-N 3.21Å; A206-Y209 WeakPolarHBondContact O-CB 3.16Å; A206-Y209 PolarHBondContact O-N 3.33Å; A206-Y209 VanDerWaalsContact O-N 3.14Å; Y209-Q211 VanDerWaalsContact C-N 3.35Å; Y209-Q211 PolarHBondContact O-N 3.34Å; Y209-K212 PolarHBondContact O-N 3.43Å; Y209-A213 PolarHBondContact O-N 3.3Å
210	L	95.6	Very high	92.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-37.2	175.9	-64.2	178.2	0	0	0	112.7	Y187 L194 A206 Y207 A213 A214 R224 V225	Y187-L210 HydrophobicContact CD2-CD2 3.54Å; Y187-L210 HydrophobicContact CE2-CD2 4.04Å; Y187-L210 HydrophobicContact CG-CD2 4.42Å; L194-L210 HydrophobicContact CD1-CD1 3.8Å; A206-L210 WeakPolarHBondContact O-CG 3.45Å; A206-L210 PolarHBondContact O-N 2.97Å; Y207-L210 HydrophobicContact CD1-CD1 4.12Å; Y207-L210 HydrophobicContact CE1-CD1 4.22Å; Y207-L210 PolarHBondContact O-N 2.96Å; L210-A213 PolarHBondContact O-N 3Å; L210-A214 WeakPolarHBondContact O-CB 3.49Å; L210-A214 PolarHBondContact O-N 2.71Å; L210-R224 HydrophobicContact CD1-CB 4.5Å; L210-V225 HydrophobicContact CB-CG2 3.75Å
211	Q	95.1	Very high	92.7	Very high	76 Å²	76	59.5 Å²	59.5	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-40.8	173.7	-80.7	-179.9	-33.8	0	0	112.1	Y207 R208 Y209 A214 G215 V225 L235	Y207-Q211 WeakPolarHBondContact O-CB 3.47Å; Y207-Q211 VanDerWaalsContact O-CG 3.31Å; Y207-Q211 WeakPolarHBondContact O-CG 3.29Å; Y207-Q211 PolarHBondContact O-N 2.73Å; R208-Q211 PolarHBondContact O-N 2.87Å; Y209-Q211 VanDerWaalsContact C-N 3.35Å; Y209-Q211 PolarHBondContact O-N 3.34Å; Q211-A214 PolarHBondContact O-N 3.18Å; Q211-G215 PolarHBondContact O-N 3.49Å; Q211-V225 HydrophobicContact CG-CG1 3.89Å; Q211-V225 HydrophobicContact CG-CG2 4.19Å; Q211-L235 HydrophobicContact CG-CD1 4.25Å
212	K	94.7	Very high	93.1	Very high	126 Å²	126	55.9 Å²	55.9	55%	0.548	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-45.3	173.9	-69.8	178.6	-178.9	-177.3	0	111.5	R208 Y209 A214 G215 M216	R208-K212 WeakPolarHBondContact O-CG 3.27Å; R208-K212 PolarHBondContact O-N 3.35Å; R208-K212 VanDerWaalsContact O-N 3.12Å; Y209-K212 PolarHBondContact O-N 3.43Å; K212-A214 VanDerWaalsContact C-N 3.35Å; K212-A214 PolarHBondContact O-N 3.41Å; K212-G215 PolarHBondContact O-N 2.99Å; K212-M216 WeakPolarHBondContact O-CE 3.33Å; K212-M216 PolarHBondContact O-N 2.53Å
213	A	95.6	Very high	93.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-40.7	175.2	0	0	0	0	0	112.4	A183 M186 Y209 L210 G215 M216 H218 A221	A183-A213 WeakPolarHBondContact O-CB 3.37Å; M186-A213 HydrophobicContact CB-CB 4.08Å; Y209-A213 PolarHBondContact O-N 3.3Å; L210-A213 PolarHBondContact O-N 3Å; A213-G215 VanDerWaalsContact C-N 3.34Å; A213-G215 PolarHBondContact O-N 3.24Å; A213-M216 CarbonylContact O-C 3.57Å; A213-M216 PolarHBondContact O-N 3.49Å; A213-M216 VanDerWaalsContact O-N 3.08Å; A213-H218 HydrophobicContact CB-CB 4.29Å; A213-H218 VanDerWaalsContact O-CB 3.26Å; A213-H218 WeakPolarHBondContact O-CB 3.18Å; A213-H218 PolarHBondContact O-N 3.02Å; A213-A221 HydrophobicContact CB-CB 3.76Å
214	A	94.4	Very high	93.6	Very high	9 Å²	9	56.2 Å²	56.2	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-36.9	176	0	0	0	0	0	112.3	L210 Q211 K212 M216 N217 A221 L222 V225	L210-A214 WeakPolarHBondContact O-CB 3.49Å; L210-A214 PolarHBondContact O-N 2.71Å; Q211-A214 PolarHBondContact O-N 3.18Å; K212-A214 VanDerWaalsContact C-N 3.35Å; K212-A214 PolarHBondContact O-N 3.41Å; A214-M216 PolarHBondContact O-N 2.95Å; A214-N217 PolarHBondContact O-N 3.32Å; A214-A221 HydrophobicContact CB-CB 4.36Å; A214-L222 HydrophobicContact CB-CD1 4.21Å; A214-V225 HydrophobicContact CB-CB 4.4Å; A214-V225 HydrophobicContact CB-CG2 4.21Å
215	G	92.1	Very high	93.8	Very high	63 Å²	63	50.3 Å²	50.3	65%	0.649	24%	0.244	S	C	*	.	H	α-helix	trans	-62.4	-22.3	172.3	0	0	0	0	0	113.8	Q211 K212 A213 N217	Q211-G215 PolarHBondContact O-N 3.49Å; K212-G215 PolarHBondContact O-N 2.99Å; A213-G215 VanDerWaalsContact C-N 3.34Å; A213-G215 PolarHBondContact O-N 3.24Å; G215-N217 VanDerWaalsContact C-N 3.34Å
216	M	91.4	Very high	94	Very high	32 Å²	32	46.4 Å²	46.4	16%	0.158	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	17.9	173.6	-64.3	-174.8	-90.6	0	0	113.2	Q179 E182 A183 M186 K212 A213 A214 H218	Q179-M216 HydrophobicContact CG-CB 4.2Å; Q179-M216 HydrophobicContact CG-CG 4.12Å; Q179-M216 HydrophobicContact CG-SD 4.07Å; E182-M216 HydrophobicContact CB-SD 4.32Å; E182-M216 HydrophobicContact CG-CE 4.21Å; E182-M216 HydrophobicContact CG-SD 4.24Å; A183-M216 HydrophobicContact CB-CB 3.66Å; A183-M216 HydrophobicContact CB-CE 4.11Å; A183-M216 HydrophobicContact CB-CG 4.48Å; A183-M216 HydrophobicContact CB-SD 4.1Å; M186-M216 HydrophobicContact CG-CE 4.02Å; K212-M216 WeakPolarHBondContact O-CE 3.33Å; K212-M216 PolarHBondContact O-N 2.53Å; A213-M216 CarbonylContact O-C 3.57Å; A213-M216 PolarHBondContact O-N 3.49Å; A213-M216 VanDerWaalsContact O-N 3.08Å; A214-M216 PolarHBondContact O-N 2.95Å; M216-H218 VanDerWaalsContact C-N 3.33Å; M216-H218 PolarHBondContact O-N 3.02Å
217	N	89.8	Confident	94	Very high	94 Å²	94	47.9 Å²	47.9	50%	0.503	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	29	179.4	-58.3	-19.2	0	0	0	115.3	A214 G215 T219 K248	A214-N217 PolarHBondContact O-N 3.32Å; G215-N217 VanDerWaalsContact C-N 3.34Å; N217-T219 PolarHBondContact O-N 3.32Å; N217-K248 VanDerWaalsContact CG-NZ 3.32Å; N217-K248 PolarHBondContact OD1-NZ 3.37Å
218	H	93.3	Very high	94	Very high	24 Å²	24	46.8 Å²	46.8	11%	0.111	23%	0.228	C	C	.	.			trans	-75.5	110.3	174.5	-170.5	-79.7	0	0	0	111.7	A183 E184 Y187 A213 M216 K220 A221 L222	A183-H218 HydrophobicContact CB-CB 4.11Å; E184-H218 IonicContact OE2-CD2 3.51Å; E184-H218 IonicContact OE2-CE1 2.71Å; E184-H218 IonicContact OE2-NE2 3.62Å; E184-H218 PolarHBondContact OE2-NE2 3.19Å; Y187-H218 AromaticContact CD1-CE1 3.78Å; Y187-H218 AromaticContact CD2-CE1 3.88Å; Y187-H218 AromaticContact CD2-ND1 4Å; Y187-H218 AromaticContact CG-CE1 3.57Å; A213-H218 HydrophobicContact CB-CB 4.29Å; A213-H218 VanDerWaalsContact O-CB 3.26Å; A213-H218 WeakPolarHBondContact O-CB 3.18Å; A213-H218 PolarHBondContact O-N 3.02Å; M216-H218 VanDerWaalsContact C-N 3.33Å; M216-H218 PolarHBondContact O-N 3.02Å; H218-K220 PolarHBondContact O-N 2.87Å; H218-A221 HydrophobicContact CB-CB 3.95Å; H218-A221 PolarHBondContact ND1-N 2.96Å; H218-A221 WeakPolarHBondContact O-CB 3.35Å; H218-A221 PolarHBondContact O-N 3.25Å; H218-L222 WeakPolarHBondContact O-CB 3.34Å; H218-L222 PolarHBondContact O-N 3.48Å
219	T	92.3	Very high	94.1	Very high	68 Å²	68	40.3 Å²	40.3	42%	0.417	21%	0.205	S	C	.	.	H	α-helix	trans	-50.4	-55.3	-173.4	57.5	0	0	0	0	113.8	N217 A221 L222 E223 E252	N217-T219 PolarHBondContact O-N 3.32Å; T219-A221 PolarHBondContact O-N 3.42Å; T219-L222 WeakPolarHBondContact O-CB 3.21Å; T219-L222 PolarHBondContact O-N 3.25Å; T219-E223 WeakPolarHBondContact O-CG 3.47Å; T219-E223 PolarHBondContact O-N 3.34Å; T219-E252 WeakPolarHBondContact CG2-OE2 3.26Å
220	K	93.4	Very high	94.1	Very high	109 Å²	109	37 Å²	37	47%	0.474	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-28.6	-178.7	-57.9	174.2	-177.7	166.3	0	112.8	Y187 H218 R224	Y187-K220 HydrophobicContact CE1-CD 4.35Å; Y187-K220 HydrophobicContact CE2-CB 3.89Å; H218-K220 PolarHBondContact O-N 2.87Å; K220-R224 PolarHBondContact O-N 2.93Å
221	A	94.8	Very high	93.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-76.6	-44.3	178.3	0	0	0	0	0	109.5	Y187 A213 A214 H218 T219 E223 R224 V225	Y187-A221 HydrophobicContact CD2-CB 3.79Å; Y187-A221 HydrophobicContact CE2-CB 4.43Å; A213-A221 HydrophobicContact CB-CB 3.76Å; A214-A221 HydrophobicContact CB-CB 4.36Å; H218-A221 HydrophobicContact CB-CB 3.95Å; H218-A221 PolarHBondContact ND1-N 2.96Å; H218-A221 WeakPolarHBondContact O-CB 3.35Å; H218-A221 PolarHBondContact O-N 3.25Å; T219-A221 PolarHBondContact O-N 3.42Å; A221-E223 VanDerWaalsContact C-N 3.32Å; A221-E223 PolarHBondContact O-N 3.22Å; A221-R224 PolarHBondContact O-N 2.92Å; A221-V225 WeakPolarHBondContact O-CB 3.21Å; A221-V225 VanDerWaalsContact O-CG2 3.28Å; A221-V225 WeakPolarHBondContact O-CG2 3.45Å; A221-V225 PolarHBondContact O-N 3.29Å
222	L	95.2	Very high	93.6	Very high	6 Å²	6	34.5 Å²	34.5	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-56	-44.6	173.6	-166.6	75.1	0	0	0	111	A214 H218 T219 S226 M245 K248 L249	A214-L222 HydrophobicContact CB-CD1 4.21Å; H218-L222 WeakPolarHBondContact O-CB 3.34Å; H218-L222 PolarHBondContact O-N 3.48Å; T219-L222 WeakPolarHBondContact O-CB 3.21Å; T219-L222 PolarHBondContact O-N 3.25Å; L222-S226 WeakPolarHBondContact O-CB 3.39Å; L222-S226 PolarHBondContact O-N 3.42Å; L222-S226 PolarHBondContact O-OG 2.87Å; L222-M245 HydrophobicContact CD1-CB 4.04Å; L222-M245 HydrophobicContact CD1-CG 3.81Å; L222-M245 HydrophobicContact CD1-SD 3.82Å; L222-M245 HydrophobicContact CG-CB 4.3Å; L222-K248 HydrophobicContact CD2-CD 4.11Å; L222-K248 HydrophobicContact CD2-CG 4.3Å; L222-L249 HydrophobicContact CB-CD2 4.11Å; L222-L249 HydrophobicContact CB-CG 4.45Å; L222-L249 HydrophobicContact CD2-CD1 4.31Å; L222-L249 HydrophobicContact CD2-CD2 3.64Å; L222-L249 HydrophobicContact CD2-CG 3.53Å; L222-L249 HydrophobicContact CG-CD1 4.18Å; L222-L249 HydrophobicContact CG-CD2 4.1Å; L222-L249 HydrophobicContact CG-CG 3.94Å
223	E	94.8	Very high	93.2	Very high	20 Å²	20	30.2 Å²	30.2	9%	0.093	17%	0.169	C	C	.	.	H	α-helix	trans	-56	-53.3	172.5	-71.2	-179.4	173.2	0	0	112	T219 A221 V225 S226 Y227 L249 S254 K256	T219-E223 WeakPolarHBondContact O-CG 3.47Å; T219-E223 PolarHBondContact O-N 3.34Å; A221-E223 VanDerWaalsContact C-N 3.32Å; A221-E223 PolarHBondContact O-N 3.22Å; E223-V225 PolarHBondContact O-N 2.85Å; E223-S226 PolarHBondContact O-OG 3.27Å; E223-Y227 VanDerWaalsContact O-CD2 3.25Å; E223-Y227 WeakPolarHBondContact O-CD2 3.41Å; E223-Y227 PolarHBondContact O-N 3.2Å; E223-L249 HydrophobicContact CB-CD1 4.44Å; E223-L249 HydrophobicContact CG-CD1 3.96Å; E223-L249 HydrophobicContact CG-CD2 3.75Å; E223-S254 PolarHBondContact OE1-OG 2.88Å; E223-K256 HydrophobicContact CG-CB 4.39Å; E223-K256 WeakPolarHBondContact OE2-CD 3.5Å; E223-K256 IonicContact OE2-NZ 3.84Å; E223-K256 PolarHBondContact OE2-NZ 3.26Å
224	R	93.7	Very high	92.7	Very high	96 Å²	96	33.9 Å²	33.9	36%	0.362	18%	0.183	S	C	.	.	H	α-helix	trans	-65.8	-41.5	-177.1	-72.4	-172.7	177.8	-124.1	-0.2	112.8	M191 L210 K220 A221 A228	M191-R224 VanDerWaalsContact CE-CZ 3.45Å; M191-R224 VanDerWaalsContact CE-NH2 3.34Å; M191-R224 PolarHBondContact SD-NH1 3.19Å; L210-R224 HydrophobicContact CD1-CB 4.5Å; K220-R224 PolarHBondContact O-N 2.93Å; A221-R224 PolarHBondContact O-N 2.92Å; R224-A228 WeakPolarHBondContact O-CB 3.4Å; R224-A228 PolarHBondContact O-N 3.47Å
225	V	95.4	Very high	92.5	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.024	18%	0.184	C	C	.	.	H	α-helix	trans	-68.7	-41.5	-179.2	171.2	0	0	0	0	111	L210 Q211 A214 A221 E223 A228 L229 L235 M245	L210-V225 HydrophobicContact CB-CG2 3.75Å; Q211-V225 HydrophobicContact CG-CG1 3.89Å; Q211-V225 HydrophobicContact CG-CG2 4.19Å; A214-V225 HydrophobicContact CB-CB 4.4Å; A214-V225 HydrophobicContact CB-CG2 4.21Å; A221-V225 WeakPolarHBondContact O-CB 3.21Å; A221-V225 VanDerWaalsContact O-CG2 3.28Å; A221-V225 WeakPolarHBondContact O-CG2 3.45Å; A221-V225 PolarHBondContact O-N 3.29Å; E223-V225 PolarHBondContact O-N 2.85Å; V225-A228 PolarHBondContact O-N 3.36Å; V225-L229 HydrophobicContact CG1-CD1 4.06Å; V225-L229 WeakPolarHBondContact O-CB 3.33Å; V225-L229 WeakPolarHBondContact O-CG 3.35Å; V225-L229 PolarHBondContact O-N 3.1Å; V225-L235 HydrophobicContact CG1-CD1 4.27Å; V225-M245 HydrophobicContact CG1-CE 4.48Å; V225-M245 HydrophobicContact CG1-SD 4.31Å
226	S	95.3	Very high	92.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-43.7	177.6	53.6	0	0	0	0	112.5	L222 E223 L229 L230 F246	L222-S226 WeakPolarHBondContact O-CB 3.39Å; L222-S226 PolarHBondContact O-N 3.42Å; L222-S226 PolarHBondContact O-OG 2.87Å; E223-S226 PolarHBondContact O-OG 3.27Å; S226-L229 PolarHBondContact O-N 2.84Å; S226-L230 WeakPolarHBondContact O-CB 3.12Å; S226-L230 PolarHBondContact O-N 3.42Å; S226-F246 VanDerWaalsContact CB-CE1 3.41Å; S226-F246 WeakPolarHBondContact OG-CE1 3.41Å
227	Y	94.6	Very high	92.4	Very high	31 Å²	31	37.4 Å²	37.4	12%	0.122	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-39.6	172.6	-84.2	-72.1	0	0	0	112.8	E223 L229 L230 F231 F246 K256 A260	E223-Y227 VanDerWaalsContact O-CD2 3.25Å; E223-Y227 WeakPolarHBondContact O-CD2 3.41Å; E223-Y227 PolarHBondContact O-N 3.2Å; Y227-L229 VanDerWaalsContact C-N 3.35Å; Y227-L229 PolarHBondContact O-N 2.9Å; Y227-L230 WeakPolarHBondContact O-CB 3.37Å; Y227-L230 PolarHBondContact O-N 3.46Å; Y227-F231 HydrophobicContact CD1-CD2 4.35Å; Y227-F231 AromaticContact CD1-CE2 3.42Å; Y227-F231 HydrophobicContact CD1-CE2 3.42Å; Y227-F231 VanDerWaalsContact CD1-CE2 3.42Å; Y227-F231 AromaticContact CD1-CZ 3.9Å; Y227-F231 HydrophobicContact CD1-CZ 3.9Å; Y227-F231 HydrophobicContact CE1-CE2 4.21Å; Y227-F231 HydrophobicContact CE1-CZ 4.33Å; Y227-F231 HydrophobicContact CG-CE2 4.28Å; Y227-F231 WeakPolarHBondContact O-CD2 3.32Å; Y227-F231 PolarHBondContact O-N 3.39Å; Y227-F246 HydrophobicContact CD1-CZ 4.15Å; Y227-F246 HydrophobicContact CD2-CE1 4Å; Y227-F246 HydrophobicContact CD2-CZ 4.35Å; Y227-F246 HydrophobicContact CE1-CZ 4.41Å; Y227-F246 AromaticContact CE2-CE1 3.95Å; Y227-F246 HydrophobicContact CE2-CE1 3.95Å; Y227-F246 HydrophobicContact CE2-CZ 4.48Å; Y227-F246 HydrophobicContact CG-CE1 4.3Å; Y227-F246 HydrophobicContact CG-CZ 4.18Å; Y227-K256 HydrophobicContact CE2-CB 4.09Å; Y227-K256 PolarHBondContact OH-O 3.17Å; Y227-A260 HydrophobicContact CE1-CB 4.07Å; Y227-A260 HydrophobicContact CE2-CB 4.43Å
228	A	93.8	Very high	92.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-64.2	-39.6	176.7	0	0	0	0	0	112.5	Y207 R224 V225 L230 G232 D233 L235	Y207-A228 HydrophobicContact CD1-CB 3.92Å; Y207-A228 HydrophobicContact CE1-CB 3.29Å; R224-A228 WeakPolarHBondContact O-CB 3.4Å; R224-A228 PolarHBondContact O-N 3.47Å; V225-A228 PolarHBondContact O-N 3.36Å; A228-L230 VanDerWaalsContact C-N 3.33Å; A228-G232 CarbonylContact O-C 3.55Å; A228-G232 WeakPolarHBondContact O-CA 3.45Å; A228-G232 PolarHBondContact O-N 3.35Å; A228-D233 HydrophobicContact CB-CB 4.27Å; A228-D233 WeakPolarHBondContact CB-O 3.49Å; A228-D233 PolarHBondContact O-N 3.01Å; A228-L235 HydrophobicContact CB-CD1 4.01Å
229	L	94.9	Very high	92.6	Very high	19 Å²	19	36.8 Å²	36.8	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-68.1	-31.6	173.9	-76.3	173.9	0	0	0	112.9	V225 S226 Y227 L235 P236 Q237 N238 A242 M245	V225-L229 HydrophobicContact CG1-CD1 4.06Å; V225-L229 WeakPolarHBondContact O-CB 3.33Å; V225-L229 WeakPolarHBondContact O-CG 3.35Å; V225-L229 PolarHBondContact O-N 3.1Å; S226-L229 PolarHBondContact O-N 2.84Å; Y227-L229 VanDerWaalsContact C-N 3.35Å; Y227-L229 PolarHBondContact O-N 2.9Å; L229-L235 HydrophobicContact CD2-CB 3.99Å; L229-L235 HydrophobicContact CD2-CD1 4.25Å; L229-L235 HydrophobicContact CG-CD1 4.16Å; L229-P236 VanDerWaalsContact CD2-O 3.24Å; L229-P236 WeakPolarHBondContact CD2-O 3.37Å; L229-Q237 WeakPolarHBondContact O-CA 3.35Å; L229-N238 HydrophobicContact CD2-CB 4.5Å; L229-N238 PolarHBondContact O-N 3.21Å; L229-A242 HydrophobicContact CB-CB 4.19Å; L229-M245 HydrophobicContact CD1-CE 3.23Å; L229-M245 HydrophobicContact CG-CE 4.4Å
230	L	94.8	Very high	92.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-47.1	174.8	179	61.7	0	0	0	111.8	S226 Y227 A228 Q237 I239 A242 F246 F263 L264 I576	S226-L230 WeakPolarHBondContact O-CB 3.12Å; S226-L230 PolarHBondContact O-N 3.42Å; Y227-L230 WeakPolarHBondContact O-CB 3.37Å; Y227-L230 PolarHBondContact O-N 3.46Å; A228-L230 VanDerWaalsContact C-N 3.33Å; L230-Q237 PolarHBondContact O-NE2 3.17Å; L230-Q237 VanDerWaalsContact O-NE2 3.08Å; L230-I239 HydrophobicContact CD1-CG2 4.46Å; L230-A242 HydrophobicContact CB-CB 4.11Å; L230-F246 HydrophobicContact CB-CE2 4.31Å; L230-F246 HydrophobicContact CB-CZ 4.47Å; L230-F246 HydrophobicContact CD2-CE2 4.01Å; L230-F246 HydrophobicContact CD2-CZ 4.24Å; L230-F263 HydrophobicContact CD2-CD1 4.07Å; L230-F263 HydrophobicContact CD2-CE1 4.08Å; L230-L264 HydrophobicContact CD1-CD2 3.78Å; L230-I576 HydrophobicContact CD1-CG2 4.11Å; L230-I576 HydrophobicContact CG-CG2 4.11Å
231	F	92.9	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-91.6	-12.5	-174	-59.2	-51	0	0	0	114.8	Y227 R558 A573 I576 Q577 L580	Y227-F231 HydrophobicContact CD1-CD2 4.35Å; Y227-F231 AromaticContact CD1-CE2 3.42Å; Y227-F231 HydrophobicContact CD1-CE2 3.42Å; Y227-F231 VanDerWaalsContact CD1-CE2 3.42Å; Y227-F231 AromaticContact CD1-CZ 3.9Å; Y227-F231 HydrophobicContact CD1-CZ 3.9Å; Y227-F231 HydrophobicContact CE1-CE2 4.21Å; Y227-F231 HydrophobicContact CE1-CZ 4.33Å; Y227-F231 HydrophobicContact CG-CE2 4.28Å; Y227-F231 WeakPolarHBondContact O-CD2 3.32Å; Y227-F231 PolarHBondContact O-N 3.39Å; F231-R558 VanDerWaalsContact CE2-NH1 3.31Å; F231-A573 VanDerWaalsContact O-CB 3.31Å; F231-A573 WeakPolarHBondContact O-CB 3.26Å; F231-I576 HydrophobicContact CD1-CG2 3.81Å; F231-I576 HydrophobicContact CE1-CG2 3.89Å; F231-Q577 HydrophobicContact CB-CG 3.95Å; F231-Q577 HydrophobicContact CD1-CG 3.71Å; F231-Q577 HydrophobicContact CG-CG 3.99Å; F231-Q577 PolarHBondContact O-NE2 3.5Å; F231-L580 HydrophobicContact CE1-CB 4.33Å; F231-L580 HydrophobicContact CE1-CD2 4.18Å; F231-L580 HydrophobicContact CE2-CD2 4.43Å; F231-L580 HydrophobicContact CZ-CD2 3.63Å; F231-L580 HydrophobicContact CZ-CG 4.45Å
232	G	89.1	Confident	92.7	Very high	22 Å²	22	33.1 Å²	33.1	23%	0.227	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	21	-172.3	0	0	0	0	0	113.4	A228 Y234 L235	A228-G232 CarbonylContact O-C 3.55Å; A228-G232 WeakPolarHBondContact O-CA 3.45Å; A228-G232 PolarHBondContact O-N 3.35Å; G232-Y234 PolarHBondContact O-N 3.24Å; G232-Y234 VanDerWaalsContact O-N 3.09Å; G232-L235 CarbonylContact C-O 3.09Å; G232-L235 VanDerWaalsContact C-O 3.24Å; G232-L235 VanDerWaalsContact CA-O 3.28Å; G232-L235 WeakPolarHBondContact CA-O 3.5Å
233	D	85.3	Confident	92.7	Very high	36 Å²	36	35.5 Å²	35.5	19%	0.193	18%	0.181	C	C	.	.	S	Bend	trans	-75.2	102.2	-176.7	-66.6	-22.9	0	0	0	109.7	A228 L235	A228-D233 HydrophobicContact CB-CB 4.27Å; A228-D233 WeakPolarHBondContact CB-O 3.49Å; A228-D233 PolarHBondContact O-N 3.01Å; D233-L235 PolarHBondContact O-N 3.42Å
234	Y	86.3	Confident	92.7	Very high	78 Å²	78	39.5 Å²	39.5	31%	0.306	20%	0.2	S	C	.	.	S	Bend	trans	62.3	-10.3	179.8	-45.1	-82.5	0	0	0	115.3	K200 K203 R204 Y207 G232	K200-Y234 HydrophobicContact CG-CD1 4.01Å; K200-Y234 HydrophobicContact CG-CE1 4.06Å; K203-Y234 HydrophobicContact CB-CD1 3.56Å; K203-Y234 HydrophobicContact CB-CD2 4.47Å; K203-Y234 HydrophobicContact CB-CE1 3.57Å; K203-Y234 HydrophobicContact CB-CE2 4.48Å; K203-Y234 HydrophobicContact CB-CG 4.05Å; K203-Y234 HydrophobicContact CD-CD1 4.37Å; K203-Y234 HydrophobicContact CD-CE1 3.5Å; K203-Y234 VanDerWaalsContact CD-CE1 3.5Å; K203-Y234 HydrophobicContact CD-CE2 4.14Å; K203-Y234 VanDerWaalsContact CD-OH 3.23Å; K203-Y234 WeakPolarHBondContact CD-OH 3.49Å; K203-Y234 HydrophobicContact CG-CE1 4.14Å; R204-Y234 WeakPolarHBondContact CG-O 3.4Å; Y207-Y234 AromaticContact CD2-CD2 3.96Å; Y207-Y234 HydrophobicContact CD2-CD2 3.96Å; Y207-Y234 HydrophobicContact CD2-CG 4.13Å; Y207-Y234 AromaticContact CE2-CD2 3.43Å; Y207-Y234 HydrophobicContact CE2-CD2 3.43Å; Y207-Y234 VanDerWaalsContact CE2-CD2 3.43Å; Y207-Y234 HydrophobicContact CE2-CE2 4.21Å; Y207-Y234 HydrophobicContact CE2-CG 4.09Å; G232-Y234 PolarHBondContact O-N 3.24Å; G232-Y234 VanDerWaalsContact O-N 3.09Å
235	L	89.4	Confident	92.8	Very high	16 Å²	16	36.6 Å²	36.6	8%	0.084	19%	0.19	C	C	.	.	S	Bend	trans	-116.1	150.8	173.1	-68	178.2	0	0	0	109.7	Y207 Q211 V225 A228 L229 G232 D233 Q237	Y207-L235 HydrophobicContact CD1-CD1 3.86Å; Y207-L235 HydrophobicContact CD1-CG 4.2Å; Y207-L235 HydrophobicContact CG-CD1 4.39Å; Y207-L235 HydrophobicContact CG-CG 4.28Å; Q211-L235 HydrophobicContact CG-CD1 4.25Å; V225-L235 HydrophobicContact CG1-CD1 4.27Å; A228-L235 HydrophobicContact CB-CD1 4.01Å; L229-L235 HydrophobicContact CD2-CB 3.99Å; L229-L235 HydrophobicContact CD2-CD1 4.25Å; L229-L235 HydrophobicContact CG-CD1 4.16Å; G232-L235 CarbonylContact C-O 3.09Å; G232-L235 VanDerWaalsContact C-O 3.24Å; G232-L235 VanDerWaalsContact CA-O 3.28Å; G232-L235 WeakPolarHBondContact CA-O 3.5Å; D233-L235 PolarHBondContact O-N 3.42Å; L235-Q237 PolarHBondContact O-N 3.04Å
236	P	89.9	Confident	92.8	Very high	106 Å²	106	36.4 Å²	36.4	69%	0.688	19%	0.189	S	C	*	.			trans	-63.5	136	174.3	28	-34.1	0	0	0	110.1	L229 N238	L229-P236 VanDerWaalsContact CD2-O 3.24Å; L229-P236 WeakPolarHBondContact CD2-O 3.37Å; P236-N238 PolarHBondContact O-N 3.25Å
237	Q	91.3	Very high	92.8	Very high	56 Å²	56	39.6 Å²	39.6	26%	0.262	20%	0.204	S	C	.	.			trans	-63.6	130.1	-177.6	-173.8	176.7	63.5	0	0	111.4	L229 L230 L235	L229-Q237 WeakPolarHBondContact O-CA 3.35Å; L230-Q237 PolarHBondContact O-NE2 3.17Å; L230-Q237 VanDerWaalsContact O-NE2 3.08Å; L235-Q237 PolarHBondContact O-N 3.04Å
238	N	93.7	Very high	92.9	Very high	76 Å²	76	41.3 Å²	41.3	41%	0.406	21%	0.212	S	C	.	.			trans	-149.1	97.4	173.4	-172.7	-22	0	0	0	110.4	L229 P236 Q240 A241 A242	L229-N238 HydrophobicContact CD2-CB 4.5Å; L229-N238 PolarHBondContact O-N 3.21Å; P236-N238 PolarHBondContact O-N 3.25Å; N238-Q240 VanDerWaalsContact C-N 3.33Å; N238-Q240 PolarHBondContact O-N 3.11Å; N238-Q240 PolarHBondContact OD1-N 2.95Å; N238-A241 HydrophobicContact CB-CB 4.14Å; N238-A241 PolarHBondContact OD1-N 3.09Å; N238-A242 WeakPolarHBondContact O-CB 3.25Å; N238-A242 PolarHBondContact O-N 3.21Å
239	I	93	Very high	92.9	Very high	29 Å²	29	41.3 Å²	41.3	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-37.5	-175.9	-55.5	173.2	0	0	0	111.3	L230 A242 R243 L264 L269 I576 I604	L230-I239 HydrophobicContact CD1-CG2 4.46Å; I239-A242 PolarHBondContact O-N 3.35Å; I239-R243 WeakPolarHBondContact O-CB 3.02Å; I239-R243 PolarHBondContact O-N 3.03Å; I239-L264 HydrophobicContact CG2-CD2 4.29Å; I239-L269 HydrophobicContact CG2-CB 4.31Å; I239-I576 HydrophobicContact CD1-CD1 3.68Å; I239-I576 HydrophobicContact CG1-CD1 4.03Å; I239-I604 HydrophobicContact CD1-CG2 3.77Å
240	Q	93.4	Very high	92.9	Very high	73 Å²	73	41.7 Å²	41.7	34%	0.341	22%	0.215	S	C	.	.	H	α-helix	trans	-69.4	-47.4	-177.2	-179.5	56.8	32.2	0	0	111.4	N238 A242 R243 E244	N238-Q240 VanDerWaalsContact C-N 3.33Å; N238-Q240 PolarHBondContact O-N 3.11Å; N238-Q240 PolarHBondContact OD1-N 2.95Å; Q240-A242 VanDerWaalsContact C-N 3.31Å; Q240-A242 PolarHBondContact O-N 3.42Å; Q240-R243 VanDerWaalsContact NE2-CZ 3.33Å; Q240-R243 WeakPolarHBondContact O-CB 3.26Å; Q240-R243 PolarHBondContact O-N 3.39Å; Q240-R243 VanDerWaalsContact OE1-CZ 3.28Å; Q240-R243 VanDerWaalsContact OE1-NH1 3.11Å; Q240-E244 PolarHBondContact NE2-OE1 3.38Å; Q240-E244 PolarHBondContact O-N 3.24Å; Q240-E244 VanDerWaalsContact O-N 3.13Å
241	A	94	Very high	92.9	Very high	27 Å²	27	49.7 Å²	49.7	22%	0.223	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-38.3	175.1	0	0	0	0	0	111.7	N238 R243 E244 M245	N238-A241 HydrophobicContact CB-CB 4.14Å; N238-A241 PolarHBondContact OD1-N 3.09Å; A241-R243 VanDerWaalsContact C-N 3.34Å; A241-R243 PolarHBondContact O-N 3.22Å; A241-E244 PolarHBondContact O-N 3.11Å; A241-M245 VanDerWaalsContact O-CE 3.25Å; A241-M245 WeakPolarHBondContact O-CE 3.4Å; A241-M245 PolarHBondContact O-N 3.48Å
242	A	95.6	Very high	92.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-44.8	173.4	0	0	0	0	0	111.6	L229 L230 N238 I239 Q240 M245 F246	L229-A242 HydrophobicContact CB-CB 4.19Å; L230-A242 HydrophobicContact CB-CB 4.11Å; N238-A242 WeakPolarHBondContact O-CB 3.25Å; N238-A242 PolarHBondContact O-N 3.21Å; I239-A242 PolarHBondContact O-N 3.35Å; Q240-A242 VanDerWaalsContact C-N 3.31Å; Q240-A242 PolarHBondContact O-N 3.42Å; A242-M245 PolarHBondContact O-N 3.05Å; A242-F246 HydrophobicContact CB-CD2 4.37Å; A242-F246 HydrophobicContact CB-CE2 3.93Å; A242-F246 WeakPolarHBondContact O-CD2 3.13Å; A242-F246 VanDerWaalsContact O-CG 3.3Å; A242-F246 WeakPolarHBondContact O-CG 3.44Å; A242-F246 PolarHBondContact O-N 3.28Å
243	R	95.3	Very high	93	Very high	55 Å²	55	54.9 Å²	54.9	21%	0.208	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-49.3	178.3	-169.6	-170.4	79.4	-164.7	2.5	112.2	I239 Q240 A241 M245 F246 E247 L261 L264 G270 V271	I239-R243 WeakPolarHBondContact O-CB 3.02Å; I239-R243 PolarHBondContact O-N 3.03Å; Q240-R243 VanDerWaalsContact NE2-CZ 3.33Å; Q240-R243 WeakPolarHBondContact O-CB 3.26Å; Q240-R243 PolarHBondContact O-N 3.39Å; Q240-R243 VanDerWaalsContact OE1-CZ 3.28Å; Q240-R243 VanDerWaalsContact OE1-NH1 3.11Å; A241-R243 VanDerWaalsContact C-N 3.34Å; A241-R243 PolarHBondContact O-N 3.22Å; R243-M245 VanDerWaalsContact C-N 3.29Å; R243-M245 PolarHBondContact O-N 3.46Å; R243-F246 PolarHBondContact O-N 3.49Å; R243-E247 IonicContact NE-OE1 3.37Å; R243-E247 PolarHBondContact NE-OE1 2.92Å; R243-E247 WeakPolarHBondContact O-CG 3.31Å; R243-E247 PolarHBondContact O-N 3.48Å; R243-L261 HydrophobicContact CG-CD2 4.38Å; R243-L264 HydrophobicContact CB-CD1 4.01Å; R243-L264 HydrophobicContact CG-CD1 3.99Å; R243-G270 PolarHBondContact NH1-O 3.26Å; R243-V271 VanDerWaalsContact CD-CG1 3.43Å; R243-V271 HydrophobicContact CG-CG1 4.45Å
244	E	95.1	Very high	93.4	Very high	105 Å²	105	53.7 Å²	53.7	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-40.1	-179.5	-71.1	166.7	-163.8	0	0	111.7	Q240 A241 E247 K248	Q240-E244 PolarHBondContact NE2-OE1 3.38Å; Q240-E244 PolarHBondContact O-N 3.24Å; Q240-E244 VanDerWaalsContact O-N 3.13Å; A241-E244 PolarHBondContact O-N 3.11Å; E244-E247 PolarHBondContact O-N 2.92Å; E244-K248 PolarHBondContact O-N 2.91Å; E244-K248 VanDerWaalsContact O-N 3.17Å
245	M	95.6	Very high	93.9	Very high	34 Å²	34	51.7 Å²	51.7	17%	0.167	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-35.9	174	-67.8	-176.7	-76.2	0	0	112.8	L222 V225 L229 A241 A242 R243 K248 L249	L222-M245 HydrophobicContact CD1-CB 4.04Å; L222-M245 HydrophobicContact CD1-CG 3.81Å; L222-M245 HydrophobicContact CD1-SD 3.82Å; L222-M245 HydrophobicContact CG-CB 4.3Å; V225-M245 HydrophobicContact CG1-CE 4.48Å; V225-M245 HydrophobicContact CG1-SD 4.31Å; L229-M245 HydrophobicContact CD1-CE 3.23Å; L229-M245 HydrophobicContact CG-CE 4.4Å; A241-M245 VanDerWaalsContact O-CE 3.25Å; A241-M245 WeakPolarHBondContact O-CE 3.4Å; A241-M245 PolarHBondContact O-N 3.48Å; A242-M245 PolarHBondContact O-N 3.05Å; R243-M245 VanDerWaalsContact C-N 3.29Å; R243-M245 PolarHBondContact O-N 3.46Å; M245-K248 PolarHBondContact O-N 3.5Å; M245-L249 WeakPolarHBondContact O-CB 3.45Å; M245-L249 WeakPolarHBondContact O-CG 3.16Å; M245-L249 PolarHBondContact O-N 2.88Å
246	F	96.4	Very high	94.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.9	-34.2	175.6	-67.8	-48.5	0	0	0	112.8	S226 Y227 L230 A242 R243 L249 T250 A260 L261 L264	S226-F246 VanDerWaalsContact CB-CE1 3.41Å; S226-F246 WeakPolarHBondContact OG-CE1 3.41Å; Y227-F246 HydrophobicContact CD1-CZ 4.15Å; Y227-F246 HydrophobicContact CD2-CE1 4Å; Y227-F246 HydrophobicContact CD2-CZ 4.35Å; Y227-F246 HydrophobicContact CE1-CZ 4.41Å; Y227-F246 AromaticContact CE2-CE1 3.95Å; Y227-F246 HydrophobicContact CE2-CE1 3.95Å; Y227-F246 HydrophobicContact CE2-CZ 4.48Å; Y227-F246 HydrophobicContact CG-CE1 4.3Å; Y227-F246 HydrophobicContact CG-CZ 4.18Å; L230-F246 HydrophobicContact CB-CE2 4.31Å; L230-F246 HydrophobicContact CB-CZ 4.47Å; L230-F246 HydrophobicContact CD2-CE2 4.01Å; L230-F246 HydrophobicContact CD2-CZ 4.24Å; A242-F246 HydrophobicContact CB-CD2 4.37Å; A242-F246 HydrophobicContact CB-CE2 3.93Å; A242-F246 WeakPolarHBondContact O-CD2 3.13Å; A242-F246 VanDerWaalsContact O-CG 3.3Å; A242-F246 WeakPolarHBondContact O-CG 3.44Å; A242-F246 PolarHBondContact O-N 3.28Å; R243-F246 PolarHBondContact O-N 3.49Å; F246-L249 HydrophobicContact CD1-CD1 4.05Å; F246-L249 PolarHBondContact O-N 3.1Å; F246-T250 WeakPolarHBondContact O-CB 3.37Å; F246-T250 PolarHBondContact O-N 3.4Å; F246-T250 PolarHBondContact O-OG1 3.19Å; F246-A260 HydrophobicContact CD1-CB 3.47Å; F246-A260 VanDerWaalsContact CD1-CB 3.47Å; F246-A260 HydrophobicContact CD2-CB 3.8Å; F246-A260 HydrophobicContact CE1-CB 3.35Å; F246-A260 HydrophobicContact CE2-CB 3.72Å; F246-A260 HydrophobicContact CG-CB 3.7Å; F246-A260 HydrophobicContact CZ-CB 3.49Å; F246-A260 VanDerWaalsContact CZ-CB 3.49Å; F246-L261 HydrophobicContact CB-CD2 3.61Å; F246-L261 HydrophobicContact CB-CG 3.85Å; F246-L264 HydrophobicContact CD2-CD1 4Å
247	E	95.1	Very high	94.5	Very high	67 Å²	67	50.3 Å²	50.3	31%	0.313	26%	0.257	S	S	.	.	H	α-helix	trans	-60.1	-50.4	171.6	-74.2	169.6	176.8	0	0	110.1	R243 E244 L249 T250 E251 L261	R243-E247 IonicContact NE-OE1 3.37Å; R243-E247 PolarHBondContact NE-OE1 2.92Å; R243-E247 WeakPolarHBondContact O-CG 3.31Å; R243-E247 PolarHBondContact O-N 3.48Å; E244-E247 PolarHBondContact O-N 2.92Å; E247-L249 PolarHBondContact O-N 2.64Å; E247-T250 WeakPolarHBondContact O-CB 3.48Å; E247-T250 PolarHBondContact O-N 3.33Å; E247-E251 PolarHBondContact O-N 3.08Å; E247-L261 HydrophobicContact CG-CD1 4.27Å; E247-L261 HydrophobicContact CG-CD2 4.17Å
248	K	95.1	Very high	94.7	Very high	68 Å²	68	48.9 Å²	48.9	30%	0.296	25%	0.25	S	C	.	.	H	α-helix	trans	-58.3	-46.8	174.8	-175.8	176.6	-179.9	174.2	0	113.3	N217 L222 E244 M245 T250 E251 E252	N217-K248 VanDerWaalsContact CG-NZ 3.32Å; N217-K248 PolarHBondContact OD1-NZ 3.37Å; L222-K248 HydrophobicContact CD2-CD 4.11Å; L222-K248 HydrophobicContact CD2-CG 4.3Å; E244-K248 PolarHBondContact O-N 2.91Å; E244-K248 VanDerWaalsContact O-N 3.17Å; M245-K248 PolarHBondContact O-N 3.5Å; K248-T250 PolarHBondContact O-N 3.29Å; K248-E251 WeakPolarHBondContact O-CB 3.2Å; K248-E251 PolarHBondContact O-N 3.48Å; K248-E252 WeakPolarHBondContact O-CG 3.36Å; K248-E252 PolarHBondContact O-N 3.44Å; K248-E252 VanDerWaalsContact O-N 3.09Å
249	L	95.7	Very high	94.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-34.3	175.5	-79.9	168.3	0	0	0	112.3	L222 E223 M245 F246 E247 E252 G253 S254	L222-L249 HydrophobicContact CB-CD2 4.11Å; L222-L249 HydrophobicContact CB-CG 4.45Å; L222-L249 HydrophobicContact CD2-CD1 4.31Å; L222-L249 HydrophobicContact CD2-CD2 3.64Å; L222-L249 HydrophobicContact CD2-CG 3.53Å; L222-L249 HydrophobicContact CG-CD1 4.18Å; L222-L249 HydrophobicContact CG-CD2 4.1Å; L222-L249 HydrophobicContact CG-CG 3.94Å; E223-L249 HydrophobicContact CB-CD1 4.44Å; E223-L249 HydrophobicContact CG-CD1 3.96Å; E223-L249 HydrophobicContact CG-CD2 3.75Å; M245-L249 WeakPolarHBondContact O-CB 3.45Å; M245-L249 WeakPolarHBondContact O-CG 3.16Å; M245-L249 PolarHBondContact O-N 2.88Å; F246-L249 HydrophobicContact CD1-CD1 4.05Å; F246-L249 PolarHBondContact O-N 3.1Å; E247-L249 PolarHBondContact O-N 2.64Å; L249-E252 PolarHBondContact O-N 3.47Å; L249-G253 PolarHBondContact O-N 3.27Å; L249-S254 VanDerWaalsContact O-CB 3.3Å; L249-S254 WeakPolarHBondContact O-CB 3.4Å; L249-S254 PolarHBondContact O-N 3.28Å
250	T	95	Very high	95.1	Very high	28 Å²	28	44 Å²	44	17%	0.172	22%	0.224	C	C	.	.	H	α-helix	trans	-74.4	-36.1	-179.7	-61.2	0	0	0	0	111.7	F246 E247 K248 E252 G253 Q258 L261 Y281	F246-T250 WeakPolarHBondContact O-CB 3.37Å; F246-T250 PolarHBondContact O-N 3.4Å; F246-T250 PolarHBondContact O-OG1 3.19Å; E247-T250 WeakPolarHBondContact O-CB 3.48Å; E247-T250 PolarHBondContact O-N 3.33Å; K248-T250 PolarHBondContact O-N 3.29Å; T250-E252 VanDerWaalsContact C-N 3.28Å; T250-E252 PolarHBondContact O-N 2.97Å; T250-G253 PolarHBondContact O-N 3.36Å; T250-Q258 HydrophobicContact CG2-CG 3.75Å; T250-Q258 PolarHBondContact OG1-N 2.85Å; T250-L261 HydrophobicContact CG2-CD1 4.12Å; T250-L261 WeakPolarHBondContact OG1-CD1 3.45Å; T250-Y281 HydrophobicContact CG2-CD1 4.42Å; T250-Y281 HydrophobicContact CG2-CE1 3.88Å
251	E	93.4	Very high	95.2	Very high	168 Å²	168	40.7 Å²	40.7	79%	0.785	21%	0.209	S	C	*	.	H	α-helix	trans	-62	-37.1	170.7	-68.3	174.5	177.9	0	0	111.7	E247 K248 G253	E247-E251 PolarHBondContact O-N 3.08Å; K248-E251 WeakPolarHBondContact O-CB 3.2Å; K248-E251 PolarHBondContact O-N 3.48Å; E251-G253 PolarHBondContact O-N 2.92Å
252	E	91.3	Very high	95.3	Very high	87 Å²	87	39.4 Å²	39.4	41%	0.407	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.3	173.2	-67.2	169.8	-178	0	0	113.4	T219 K248 L249 T250	T219-E252 WeakPolarHBondContact CG2-OE2 3.26Å; K248-E252 WeakPolarHBondContact O-CG 3.36Å; K248-E252 PolarHBondContact O-N 3.44Å; K248-E252 VanDerWaalsContact O-N 3.09Å; L249-E252 PolarHBondContact O-N 3.47Å; T250-E252 VanDerWaalsContact C-N 3.28Å; T250-E252 PolarHBondContact O-N 2.97Å
253	G	92.3	Very high	95.4	Very high	44 Å²	44	39.4 Å²	39.4	45%	0.454	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	17.1	179.2	0	0	0	0	0	115.2	L249 T250 E251	L249-G253 PolarHBondContact O-N 3.27Å; T250-G253 PolarHBondContact O-N 3.36Å; E251-G253 PolarHBondContact O-N 2.92Å
254	S	95.6	Very high	95.4	Very high	11 Å²	11	36.8 Å²	36.8	8%	0.077	19%	0.188	C	C	.	.			trans	-65.5	125	178	167.9	0	0	0	0	111.5	E223 L249 K256 G257 Q258	E223-S254 PolarHBondContact OE1-OG 2.88Å; L249-S254 VanDerWaalsContact O-CB 3.3Å; L249-S254 WeakPolarHBondContact O-CB 3.4Å; L249-S254 PolarHBondContact O-N 3.28Å; S254-K256 VanDerWaalsContact C-N 3.28Å; S254-K256 PolarHBondContact O-N 2.8Å; S254-K256 PolarHBondContact OG-N 3.49Å; S254-G257 PolarHBondContact O-N 3.4Å; S254-G257 PolarHBondContact OG-N 3.14Å; S254-Q258 WeakPolarHBondContact O-CG 3.44Å; S254-Q258 PolarHBondContact O-N 3.09Å
255	P	96.5	Very high	95.5	Very high	36 Å²	36	33.4 Å²	33.4	23%	0.234	17%	0.171	C	C	.	.	H	α-helix	trans	-68.5	-28.7	178.6	27.9	-35.1	0	0	0	112.4	T259 G288 N290	P255-T259 WeakPolarHBondContact O-CB 3.03Å; P255-T259 PolarHBondContact O-N 3.48Å; P255-T259 PolarHBondContact O-OG1 2.94Å; P255-G288 WeakPolarHBondContact CG-O 3.24Å; P255-N290 HydrophobicContact CB-CB 4.28Å
256	K	95.2	Very high	95.4	Very high	93 Å²	93	32 Å²	32	40%	0.404	17%	0.166	S	C	.	.	H	α-helix	trans	-73.5	-37.5	175.4	-68.7	-166.6	-154.6	137.7	0	112	E223 Y227 S254 T259 A260 N290	E223-K256 HydrophobicContact CG-CB 4.39Å; E223-K256 WeakPolarHBondContact OE2-CD 3.5Å; E223-K256 IonicContact OE2-NZ 3.84Å; E223-K256 PolarHBondContact OE2-NZ 3.26Å; Y227-K256 HydrophobicContact CE2-CB 4.09Å; Y227-K256 PolarHBondContact OH-O 3.17Å; S254-K256 VanDerWaalsContact C-N 3.28Å; S254-K256 PolarHBondContact O-N 2.8Å; S254-K256 PolarHBondContact OG-N 3.49Å; K256-T259 PolarHBondContact O-N 2.89Å; K256-A260 PolarHBondContact O-N 2.86Å; K256-A260 VanDerWaalsContact O-N 3.07Å; K256-N290 WeakPolarHBondContact CG-ND2 3.34Å
257	G	96	Very high	95.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.2	-47.6	172.3	0	0	0	0	0	111.7	S254 T259 A260 L261	S254-G257 PolarHBondContact O-N 3.4Å; S254-G257 PolarHBondContact OG-N 3.14Å; G257-T259 PolarHBondContact O-N 2.67Å; G257-A260 WeakPolarHBondContact O-CB 3.4Å; G257-A260 PolarHBondContact O-N 3.2Å; G257-A260 VanDerWaalsContact O-N 3.17Å; G257-L261 PolarHBondContact O-N 2.83Å
258	Q	96.6	Very high	95	Very high	26 Å²	26	30 Å²	30	12%	0.121	16%	0.16	C	C	.	.	H	α-helix	trans	-57.9	-46.8	175.7	-71.3	167.5	-0.4	0	0	111.8	T250 S254 A260 L261 G262 Y281 F284	T250-Q258 HydrophobicContact CG2-CG 3.75Å; T250-Q258 PolarHBondContact OG1-N 2.85Å; S254-Q258 WeakPolarHBondContact O-CG 3.44Å; S254-Q258 PolarHBondContact O-N 3.09Å; Q258-A260 VanDerWaalsContact C-N 3.31Å; Q258-A260 PolarHBondContact O-N 3.46Å; Q258-L261 PolarHBondContact O-N 3.27Å; Q258-G262 PolarHBondContact O-N 2.9Å; Q258-Y281 WeakPolarHBondContact O-CB 3.11Å; Q258-F284 VanDerWaalsContact OE1-CB 3.23Å; Q258-F284 PolarHBondContact OE1-O 3.34Å
259	T	97.3	Very high	94.8	Very high	1 Å²	1	27 Å²	27	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-40.5	177.8	-54.4	0	0	0	0	111.9	P255 K256 G257 G262 F263 Y282 N290 I292 A293	P255-T259 WeakPolarHBondContact O-CB 3.03Å; P255-T259 PolarHBondContact O-N 3.48Å; P255-T259 PolarHBondContact O-OG1 2.94Å; K256-T259 PolarHBondContact O-N 2.89Å; G257-T259 PolarHBondContact O-N 2.67Å; T259-G262 PolarHBondContact O-N 3.39Å; T259-F263 PolarHBondContact O-N 3.44Å; T259-Y282 HydrophobicContact CG2-CD1 4.17Å; T259-Y282 HydrophobicContact CG2-CE1 4.1Å; T259-Y282 WeakPolarHBondContact O-CE1 3.29Å; T259-N290 PolarHBondContact OG1-ND2 3.46Å; T259-I292 HydrophobicContact CG2-CB 4.47Å; T259-I292 HydrophobicContact CG2-CG2 4.31Å; T259-A293 HydrophobicContact CG2-CB 4.06Å
260	A	96.5	Very high	94.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-66.5	-43.9	177.6	0	0	0	0	0	112.5	Y227 F246 K256 G257 Q258 G262 F263 L264	Y227-A260 HydrophobicContact CE1-CB 4.07Å; Y227-A260 HydrophobicContact CE2-CB 4.43Å; F246-A260 HydrophobicContact CD1-CB 3.47Å; F246-A260 VanDerWaalsContact CD1-CB 3.47Å; F246-A260 HydrophobicContact CD2-CB 3.8Å; F246-A260 HydrophobicContact CE1-CB 3.35Å; F246-A260 HydrophobicContact CE2-CB 3.72Å; F246-A260 HydrophobicContact CG-CB 3.7Å; F246-A260 HydrophobicContact CZ-CB 3.49Å; F246-A260 VanDerWaalsContact CZ-CB 3.49Å; K256-A260 PolarHBondContact O-N 2.86Å; K256-A260 VanDerWaalsContact O-N 3.07Å; G257-A260 WeakPolarHBondContact O-CB 3.4Å; G257-A260 PolarHBondContact O-N 3.2Å; G257-A260 VanDerWaalsContact O-N 3.17Å; Q258-A260 VanDerWaalsContact C-N 3.31Å; Q258-A260 PolarHBondContact O-N 3.46Å; A260-G262 VanDerWaalsContact C-N 3.3Å; A260-G262 PolarHBondContact O-N 3.37Å; A260-F263 WeakPolarHBondContact O-CA 3.4Å; A260-F263 WeakPolarHBondContact O-CB 3.38Å; A260-F263 PolarHBondContact O-N 3.11Å; A260-F263 VanDerWaalsContact O-N 3.14Å; A260-L264 WeakPolarHBondContact O-CG 3.22Å; A260-L264 PolarHBondContact O-N 3.03Å
261	L	96.1	Very high	94.1	Very high	3 Å²	3	29 Å²	29	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-40.9	173.2	-72.4	-173.8	0	0	0	111.4	R243 F246 E247 T250 G257 Q258 F263 L264 Y265 Y281	R243-L261 HydrophobicContact CG-CD2 4.38Å; F246-L261 HydrophobicContact CB-CD2 3.61Å; F246-L261 HydrophobicContact CB-CG 3.85Å; E247-L261 HydrophobicContact CG-CD1 4.27Å; E247-L261 HydrophobicContact CG-CD2 4.17Å; T250-L261 HydrophobicContact CG2-CD1 4.12Å; T250-L261 WeakPolarHBondContact OG1-CD1 3.45Å; G257-L261 PolarHBondContact O-N 2.83Å; Q258-L261 PolarHBondContact O-N 3.27Å; L261-F263 PolarHBondContact O-N 3Å; L261-L264 HydrophobicContact CD2-CD1 4.28Å; L261-L264 PolarHBondContact O-N 2.79Å; L261-L264 VanDerWaalsContact O-N 3.16Å; L261-Y265 VanDerWaalsContact O-CD2 3.24Å; L261-Y265 WeakPolarHBondContact O-CD2 3.37Å; L261-Y265 PolarHBondContact O-N 3.34Å; L261-Y281 HydrophobicContact CB-CD1 4.35Å; L261-Y281 HydrophobicContact CB-CD2 4.29Å; L261-Y281 HydrophobicContact CB-CE1 4.48Å; L261-Y281 HydrophobicContact CB-CE2 4.42Å; L261-Y281 HydrophobicContact CB-CG 4.27Å; L261-Y281 HydrophobicContact CD1-CE1 4.08Å
262	G	96.4	Very high	94	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-54	-43.7	172.7	0	0	0	0	0	111.8	Q258 T259 A260 A266 A278 Y282	Q258-G262 PolarHBondContact O-N 2.9Å; T259-G262 PolarHBondContact O-N 3.39Å; A260-G262 VanDerWaalsContact C-N 3.3Å; A260-G262 PolarHBondContact O-N 3.37Å; G262-A266 VanDerWaalsContact O-CB 3.27Å; G262-A266 WeakPolarHBondContact O-CB 3.48Å; G262-A266 PolarHBondContact O-N 3.18Å; G262-A278 VanDerWaalsContact O-CB 3.28Å; G262-A278 WeakPolarHBondContact O-CB 3.46Å; G262-Y282 VanDerWaalsContact C-CZ 3.46Å
263	F	96.8	Very high	94	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-45.9	174.1	170	-110.2	0	0	0	113.4	L230 T259 A260 L261 Y265 A266 S267 L269 Y282 I576 L579 L580 E583	L230-F263 HydrophobicContact CD2-CD1 4.07Å; L230-F263 HydrophobicContact CD2-CE1 4.08Å; T259-F263 PolarHBondContact O-N 3.44Å; A260-F263 WeakPolarHBondContact O-CA 3.4Å; A260-F263 WeakPolarHBondContact O-CB 3.38Å; A260-F263 PolarHBondContact O-N 3.11Å; A260-F263 VanDerWaalsContact O-N 3.14Å; L261-F263 PolarHBondContact O-N 3Å; F263-Y265 PolarHBondContact O-N 3.43Å; F263-A266 PolarHBondContact O-N 3.27Å; F263-S267 WeakPolarHBondContact O-CB 3.32Å; F263-S267 PolarHBondContact O-N 3.33Å; F263-S267 PolarHBondContact O-OG 3.17Å; F263-L269 HydrophobicContact CE1-CD1 4.07Å; F263-L269 HydrophobicContact CZ-CD1 4.02Å; F263-Y282 WeakPolarHBondContact CA-OH 3.39Å; F263-Y282 PolarHBondContact N-OH 3.16Å; F263-I576 HydrophobicContact CE1-CG2 3.92Å; F263-I576 HydrophobicContact CZ-CG2 4.08Å; F263-L579 HydrophobicContact CE2-CB 3.96Å; F263-L579 HydrophobicContact CZ-CB 3.97Å; F263-L580 HydrophobicContact CB-CD1 4.02Å; F263-L580 HydrophobicContact CD1-CD1 4Å; F263-L580 HydrophobicContact CD2-CB 4.31Å; F263-L580 HydrophobicContact CD2-CD1 3.72Å; F263-L580 HydrophobicContact CE1-CD1 4.42Å; F263-L580 VanDerWaalsContact CE2-CA 3.43Å; F263-L580 HydrophobicContact CE2-CB 3.92Å; F263-L580 HydrophobicContact CE2-CD1 4.19Å; F263-L580 HydrophobicContact CG-CD1 3.62Å; F263-L580 HydrophobicContact CZ-CB 4.01Å; F263-E583 HydrophobicContact CD2-CG 4.09Å; F263-E583 HydrophobicContact CE2-CG 4.34Å
264	L	96	Very high	94.1	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-42.8	178.1	-67	-179	0	0	0	111.8	L230 I239 R243 F246 A260 L261 S267 G268 L269 V271	L230-L264 HydrophobicContact CD1-CD2 3.78Å; I239-L264 HydrophobicContact CG2-CD2 4.29Å; R243-L264 HydrophobicContact CB-CD1 4.01Å; R243-L264 HydrophobicContact CG-CD1 3.99Å; F246-L264 HydrophobicContact CD2-CD1 4Å; A260-L264 WeakPolarHBondContact O-CG 3.22Å; A260-L264 PolarHBondContact O-N 3.03Å; L261-L264 HydrophobicContact CD2-CD1 4.28Å; L261-L264 PolarHBondContact O-N 2.79Å; L261-L264 VanDerWaalsContact O-N 3.16Å; L264-S267 PolarHBondContact O-OG 3.26Å; L264-G268 WeakPolarHBondContact O-CA 3.23Å; L264-G268 PolarHBondContact O-N 3.28Å; L264-L269 HydrophobicContact CD2-CB 3.9Å; L264-L269 PolarHBondContact O-N 3.39Å; L264-L269 VanDerWaalsContact O-N 3.16Å; L264-V271 HydrophobicContact CB-CG2 4.21Å; L264-V271 VanDerWaalsContact O-CG2 3.24Å; L264-V271 WeakPolarHBondContact O-CG2 3.49Å
265	Y	95.8	Very high	94	Very high	33 Å²	33	29.2 Å²	29.2	13%	0.129	17%	0.173	C	C	.	.	H	α-helix	trans	-69.7	-34.8	175.5	-79.1	-67.9	0	0	0	113.2	L261 F263 V271 S273 S274 K277 Y281	L261-Y265 VanDerWaalsContact O-CD2 3.24Å; L261-Y265 WeakPolarHBondContact O-CD2 3.37Å; L261-Y265 PolarHBondContact O-N 3.34Å; F263-Y265 PolarHBondContact O-N 3.43Å; Y265-V271 HydrophobicContact CD1-CB 4.18Å; Y265-V271 HydrophobicContact CD1-CG2 3.76Å; Y265-V271 HydrophobicContact CE1-CB 4.04Å; Y265-V271 HydrophobicContact CE1-CG1 4.34Å; Y265-V271 HydrophobicContact CE1-CG2 4.11Å; Y265-V271 HydrophobicContact CG-CG2 4.17Å; Y265-S273 WeakPolarHBondContact O-CA 3.34Å; Y265-S273 PolarHBondContact O-OG 3.32Å; Y265-S274 PolarHBondContact O-N 3.32Å; Y265-K277 HydrophobicContact CD1-CB 4.34Å; Y265-K277 HydrophobicContact CD1-CD 4.04Å; Y265-K277 HydrophobicContact CD2-CB 4.44Å; Y265-K277 HydrophobicContact CE1-CD 3.76Å; Y265-K277 HydrophobicContact CG-CB 4.15Å; Y265-Y281 AromaticContact CD2-CD2 3.8Å; Y265-Y281 HydrophobicContact CD2-CD2 3.8Å; Y265-Y281 AromaticContact CD2-CE2 3.56Å; Y265-Y281 HydrophobicContact CD2-CE2 3.56Å; Y265-Y281 HydrophobicContact CE2-CD2 4.17Å; Y265-Y281 AromaticContact CE2-CE2 3.45Å; Y265-Y281 HydrophobicContact CE2-CE2 3.45Å; Y265-Y281 VanDerWaalsContact CE2-CE2 3.45Å
266	A	94.8	Very high	93.9	Very high	6 Å²	6	30.9 Å²	30.9	5%	0.05	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-46.7	176.5	0	0	0	0	0	111.4	G262 F263 S273 Q275 A278 Y282	G262-A266 VanDerWaalsContact O-CB 3.27Å; G262-A266 WeakPolarHBondContact O-CB 3.48Å; G262-A266 PolarHBondContact O-N 3.18Å; F263-A266 PolarHBondContact O-N 3.27Å; A266-S273 PolarHBondContact O-OG 3.13Å; A266-Q275 PolarHBondContact O-NE2 3.22Å; A266-A278 HydrophobicContact CB-CB 3.79Å; A266-Y282 HydrophobicContact CB-CE2 4.3Å
267	S	92	Very high	93.9	Very high	16 Å²	16	31.5 Å²	31.5	11%	0.112	19%	0.192	C	C	.	.	H	α-helix	trans	-81.6	-18.1	-178	59.6	0	0	0	0	113.4	F263 L264 L269 R613	F263-S267 WeakPolarHBondContact O-CB 3.32Å; F263-S267 PolarHBondContact O-N 3.33Å; F263-S267 PolarHBondContact O-OG 3.17Å; L264-S267 PolarHBondContact O-OG 3.26Å; S267-L269 WeakPolarHBondContact OG-CD1 3.4Å; S267-L269 WeakPolarHBondContact OG-CG 3.25Å; S267-R613 PolarHBondContact O-NH1 2.85Å
268	G	90.9	Very high	93.9	Very high	8 Å²	8	31.5 Å²	31.5	8%	0.082	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	40	-174.9	0	0	0	0	0	112.6	L264 V271 R613	L264-G268 WeakPolarHBondContact O-CA 3.23Å; L264-G268 PolarHBondContact O-N 3.28Å; G268-V271 CarbonylContact C-O 3.11Å; G268-V271 VanDerWaalsContact C-O 3.26Å; G268-V271 VanDerWaalsContact CA-O 3.26Å; G268-V271 WeakPolarHBondContact CA-O 3.47Å; G268-R613 PolarHBondContact O-NH1 3.35Å; G268-R613 PolarHBondContact O-NH2 2.67Å; G268-R613 VanDerWaalsContact O-NH2 3.09Å
269	L	90.1	Very high	93.9	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	20%	0.195	C	C	.	.	S	Bend	trans	-96.2	112	178.6	-70.1	175.4	0	0	0	109.8	I239 F263 L264 S267 V271 I576 L579 I604	I239-L269 HydrophobicContact CG2-CB 4.31Å; F263-L269 HydrophobicContact CE1-CD1 4.07Å; F263-L269 HydrophobicContact CZ-CD1 4.02Å; L264-L269 HydrophobicContact CD2-CB 3.9Å; L264-L269 PolarHBondContact O-N 3.39Å; L264-L269 VanDerWaalsContact O-N 3.16Å; S267-L269 WeakPolarHBondContact OG-CD1 3.4Å; S267-L269 WeakPolarHBondContact OG-CG 3.25Å; L269-V271 PolarHBondContact O-N 3.18Å; L269-V271 VanDerWaalsContact O-N 3.12Å; L269-I576 HydrophobicContact CD1-CD1 4.17Å; L269-I576 HydrophobicContact CD1-CG1 4.07Å; L269-I576 HydrophobicContact CD1-CG2 4.11Å; L269-L579 HydrophobicContact CD1-CD1 4.34Å; L269-I604 HydrophobicContact CD2-CG2 3.42Å; L269-I604 VanDerWaalsContact CD2-CG2 3.42Å
270	G	86.1	Confident	93.9	Very high	44 Å²	44	35.3 Å²	35.3	45%	0.454	22%	0.215	S	C	.	.	S	Bend	trans	67.2	5.3	-176.6	0	0	0	0	0	114.7	R243	R243-G270 PolarHBondContact NH1-O 3.26Å
271	V	90.9	Very high	93.9	Very high	25 Å²	25	38 Å²	38	15%	0.152	23%	0.226	C	C	.	.	S	Bend	trans	-146.6	158.2	177.2	-64.3	0	0	0	0	110.2	R243 L264 Y265 G268 L269 S273	R243-V271 VanDerWaalsContact CD-CG1 3.43Å; R243-V271 HydrophobicContact CG-CG1 4.45Å; L264-V271 HydrophobicContact CB-CG2 4.21Å; L264-V271 VanDerWaalsContact O-CG2 3.24Å; L264-V271 WeakPolarHBondContact O-CG2 3.49Å; Y265-V271 HydrophobicContact CD1-CB 4.18Å; Y265-V271 HydrophobicContact CD1-CG2 3.76Å; Y265-V271 HydrophobicContact CE1-CB 4.04Å; Y265-V271 HydrophobicContact CE1-CG1 4.34Å; Y265-V271 HydrophobicContact CE1-CG2 4.11Å; Y265-V271 HydrophobicContact CG-CG2 4.17Å; G268-V271 CarbonylContact C-O 3.11Å; G268-V271 VanDerWaalsContact C-O 3.26Å; G268-V271 VanDerWaalsContact CA-O 3.26Å; G268-V271 WeakPolarHBondContact CA-O 3.47Å; L269-V271 PolarHBondContact O-N 3.18Å; L269-V271 VanDerWaalsContact O-N 3.12Å; V271-S273 PolarHBondContact O-N 2.97Å
272	N	91.1	Very high	94	Very high	150 Å²	150	37.9 Å²	37.9	80%	0.802	23%	0.225	S	C	*	.			trans	-65.6	130.3	171.3	-67	-16.6	0	0	0	110	S274	N272-S274 PolarHBondContact O-N 3.41Å
273	S	91	Very high	94	Very high	72 Å²	72	40 Å²	40	50%	0.503	24%	0.238	S	C	.	.			trans	-60.8	130	-179.8	-174.3	0	0	0	0	110.9	Y265 A266 V271	Y265-S273 WeakPolarHBondContact O-CA 3.34Å; Y265-S273 PolarHBondContact O-OG 3.32Å; A266-S273 PolarHBondContact O-OG 3.13Å; V271-S273 PolarHBondContact O-N 2.97Å
274	S	94.5	Very high	94	Very high	36 Å²	36	45.2 Å²	45.2	25%	0.252	26%	0.261	S	S	.	.			trans	-148.3	104.3	177.2	-177.7	0	0	0	0	110.2	Y265 N272 A276 K277 A278	Y265-S274 PolarHBondContact O-N 3.32Å; N272-S274 PolarHBondContact O-N 3.41Å; S274-A276 VanDerWaalsContact C-N 3.27Å; S274-A276 PolarHBondContact O-N 3.45Å; S274-K277 PolarHBondContact O-N 3.18Å; S274-K277 PolarHBondContact OG-N 3.48Å; S274-A278 WeakPolarHBondContact O-CB 3.5Å; S274-A278 PolarHBondContact O-N 3.08Å
275	Q	93.9	Very high	94	Very high	58 Å²	58	45.2 Å²	45.2	27%	0.271	26%	0.261	S	S	.	.	H	α-helix	trans	-65.2	-31.5	178.4	-62.8	-56.8	-41.9	0	0	112.5	A266 L279	A266-Q275 PolarHBondContact O-NE2 3.22Å; Q275-L279 WeakPolarHBondContact O-CB 3.32Å; Q275-L279 PolarHBondContact O-N 3.43Å
276	A	94.1	Very high	94.1	Very high	70 Å²	70	43.9 Å²	43.9	58%	0.579	26%	0.257	S	S	*	.	H	α-helix	trans	-67.1	-48.3	177.6	0	0	0	0	0	111.9	S274 A278 L279 V280	S274-A276 VanDerWaalsContact C-N 3.27Å; S274-A276 PolarHBondContact O-N 3.45Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 2.99Å; A276-L279 PolarHBondContact O-N 3.43Å; A276-V280 WeakPolarHBondContact O-CG2 3.41Å; A276-V280 PolarHBondContact O-N 3.31Å
277	K	95.3	Very high	94.1	Very high	107 Å²	107	50.5 Å²	50.5	47%	0.465	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-43.7	174.4	-73.5	-173.3	174.9	-173.6	0	111.2	Y265 S274 L279 V280 Y281	Y265-K277 HydrophobicContact CD1-CB 4.34Å; Y265-K277 HydrophobicContact CD1-CD 4.04Å; Y265-K277 HydrophobicContact CD2-CB 4.44Å; Y265-K277 HydrophobicContact CE1-CD 3.76Å; Y265-K277 HydrophobicContact CG-CB 4.15Å; S274-K277 PolarHBondContact O-N 3.18Å; S274-K277 PolarHBondContact OG-N 3.48Å; K277-L279 VanDerWaalsContact C-N 3.32Å; K277-L279 PolarHBondContact O-N 3.12Å; K277-V280 PolarHBondContact O-N 2.92Å; K277-Y281 HydrophobicContact CB-CE2 4.47Å; K277-Y281 WeakPolarHBondContact O-CD2 3.32Å; K277-Y281 PolarHBondContact O-N 3.48Å
278	A	96.5	Very high	94.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-56.4	-46.8	177.7	0	0	0	0	0	112	G262 A266 S274 A276 V280 Y281 Y282	G262-A278 VanDerWaalsContact O-CB 3.28Å; G262-A278 WeakPolarHBondContact O-CB 3.46Å; A266-A278 HydrophobicContact CB-CB 3.79Å; S274-A278 WeakPolarHBondContact O-CB 3.5Å; S274-A278 PolarHBondContact O-N 3.08Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 2.99Å; A278-V280 PolarHBondContact O-N 3.4Å; A278-Y281 PolarHBondContact O-N 3.45Å; A278-Y282 HydrophobicContact CB-CD2 4.42Å; A278-Y282 HydrophobicContact CB-CE2 4.16Å; A278-Y282 WeakPolarHBondContact O-CD2 3.26Å; A278-Y282 PolarHBondContact O-N 3.18Å
279	L	96.6	Very high	94.4	Very high	34 Å²	34	53.8 Å²	53.8	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-57.2	-48.1	177.5	-178.9	65.4	0	0	0	111.5	Q275 A276 K277 Y281 Y282 T283 L297 V307	Q275-L279 WeakPolarHBondContact O-CB 3.32Å; Q275-L279 PolarHBondContact O-N 3.43Å; A276-L279 PolarHBondContact O-N 3.43Å; K277-L279 VanDerWaalsContact C-N 3.32Å; K277-L279 PolarHBondContact O-N 3.12Å; L279-Y281 PolarHBondContact O-N 3.48Å; L279-Y282 PolarHBondContact O-N 3.33Å; L279-T283 HydrophobicContact CD1-CG2 4.47Å; L279-T283 VanDerWaalsContact O-CG2 3.27Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 3.11Å; L279-L297 HydrophobicContact CD1-CD2 3.72Å; L279-V307 HydrophobicContact CD1-CG1 3.66Å; L279-V307 HydrophobicContact CD2-CG1 3.45Å; L279-V307 VanDerWaalsContact CD2-CG1 3.45Å; L279-V307 HydrophobicContact CG-CG1 4.22Å
280	V	96.1	Very high	94.7	Very high	72 Å²	72	54.4 Å²	54.4	44%	0.436	33%	0.33	S	S	.	.	H	α-helix	trans	-58.5	-49.2	178.9	174	0	0	0	0	111.1	A276 K277 A278 Y282 T283 F284	A276-V280 WeakPolarHBondContact O-CG2 3.41Å; A276-V280 PolarHBondContact O-N 3.31Å; K277-V280 PolarHBondContact O-N 2.92Å; A278-V280 PolarHBondContact O-N 3.4Å; V280-Y282 PolarHBondContact O-N 3.38Å; V280-T283 WeakPolarHBondContact CA-OG1 3.38Å; V280-T283 PolarHBondContact O-N 3.36Å; V280-T283 VanDerWaalsContact O-N 3.12Å; V280-T283 PolarHBondContact O-OG1 3.28Å; V280-F284 HydrophobicContact CG1-CD2 3.74Å; V280-F284 HydrophobicContact CG1-CE2 3.49Å; V280-F284 VanDerWaalsContact CG1-CE2 3.49Å; V280-F284 VanDerWaalsContact O-CD2 3.29Å; V280-F284 WeakPolarHBondContact O-CD2 3.26Å; V280-F284 PolarHBondContact O-N 3.15Å
281	Y	97.4	Very high	95.2	Very high	58 Å²	58	53.9 Å²	53.9	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-40.5	178.2	-78.2	-59	0	0	0	113.1	T250 Q258 L261 Y265 K277 A278 L279 T283 F284 G285	T250-Y281 HydrophobicContact CG2-CD1 4.42Å; T250-Y281 HydrophobicContact CG2-CE1 3.88Å; Q258-Y281 WeakPolarHBondContact O-CB 3.11Å; L261-Y281 HydrophobicContact CB-CD1 4.35Å; L261-Y281 HydrophobicContact CB-CD2 4.29Å; L261-Y281 HydrophobicContact CB-CE1 4.48Å; L261-Y281 HydrophobicContact CB-CE2 4.42Å; L261-Y281 HydrophobicContact CB-CG 4.27Å; L261-Y281 HydrophobicContact CD1-CE1 4.08Å; Y265-Y281 AromaticContact CD2-CD2 3.8Å; Y265-Y281 HydrophobicContact CD2-CD2 3.8Å; Y265-Y281 AromaticContact CD2-CE2 3.56Å; Y265-Y281 HydrophobicContact CD2-CE2 3.56Å; Y265-Y281 HydrophobicContact CE2-CD2 4.17Å; Y265-Y281 AromaticContact CE2-CE2 3.45Å; Y265-Y281 HydrophobicContact CE2-CE2 3.45Å; Y265-Y281 VanDerWaalsContact CE2-CE2 3.45Å; K277-Y281 HydrophobicContact CB-CE2 4.47Å; K277-Y281 WeakPolarHBondContact O-CD2 3.32Å; K277-Y281 PolarHBondContact O-N 3.48Å; A278-Y281 PolarHBondContact O-N 3.45Å; L279-Y281 PolarHBondContact O-N 3.48Å; Y281-T283 VanDerWaalsContact C-N 3.32Å; Y281-T283 PolarHBondContact O-N 3.01Å; Y281-F284 PolarHBondContact O-N 3.39Å; Y281-G285 PolarHBondContact O-N 3.32Å
282	Y	97.6	Very high	95.4	Very high	1 Å²	1	54.3 Å²	54.3	0%	0.004	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-36.3	173.9	-69.5	-49.1	0	0	0	112.3	T259 G262 F263 A266 A278 L279 V280 G285 A286 V296	T259-Y282 HydrophobicContact CG2-CD1 4.17Å; T259-Y282 HydrophobicContact CG2-CE1 4.1Å; T259-Y282 WeakPolarHBondContact O-CE1 3.29Å; G262-Y282 VanDerWaalsContact C-CZ 3.46Å; F263-Y282 WeakPolarHBondContact CA-OH 3.39Å; F263-Y282 PolarHBondContact N-OH 3.16Å; A266-Y282 HydrophobicContact CB-CE2 4.3Å; A278-Y282 HydrophobicContact CB-CD2 4.42Å; A278-Y282 HydrophobicContact CB-CE2 4.16Å; A278-Y282 WeakPolarHBondContact O-CD2 3.26Å; A278-Y282 PolarHBondContact O-N 3.18Å; L279-Y282 PolarHBondContact O-N 3.33Å; V280-Y282 PolarHBondContact O-N 3.38Å; Y282-G285 PolarHBondContact O-N 2.84Å; Y282-A286 VanDerWaalsContact O-CB 3.32Å; Y282-A286 WeakPolarHBondContact O-CB 3.32Å; Y282-A286 PolarHBondContact O-N 3.16Å; Y282-V296 HydrophobicContact CD1-CB 4.43Å; Y282-V296 HydrophobicContact CD1-CG1 4.2Å; Y282-V296 HydrophobicContact CD2-CG1 3.77Å; Y282-V296 HydrophobicContact CE1-CB 4.37Å; Y282-V296 HydrophobicContact CE1-CG1 4.01Å; Y282-V296 HydrophobicContact CE1-CG2 4.32Å; Y282-V296 HydrophobicContact CE2-CG1 3.56Å; Y282-V296 HydrophobicContact CG-CG1 4.08Å
283	T	96.6	Very high	95.7	Very high	45 Å²	45	47.1 Å²	47.1	28%	0.276	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-44.2	175.3	61.4	0	0	0	0	112.3	L279 V280 Y281 A286 L287 L297	L279-T283 HydrophobicContact CD1-CG2 4.47Å; L279-T283 VanDerWaalsContact O-CG2 3.27Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 3.11Å; V280-T283 WeakPolarHBondContact CA-OG1 3.38Å; V280-T283 PolarHBondContact O-N 3.36Å; V280-T283 VanDerWaalsContact O-N 3.12Å; V280-T283 PolarHBondContact O-OG1 3.28Å; Y281-T283 VanDerWaalsContact C-N 3.32Å; Y281-T283 PolarHBondContact O-N 3.01Å; T283-A286 PolarHBondContact O-N 2.8Å; T283-L287 WeakPolarHBondContact O-CB 3.42Å; T283-L287 VanDerWaalsContact O-CG 3.29Å; T283-L287 WeakPolarHBondContact O-CG 3.29Å; T283-L287 PolarHBondContact O-N 3.15Å; T283-L297 HydrophobicContact CG2-CD1 4.34Å; T283-L297 HydrophobicContact CG2-CD2 4.16Å
284	F	96.5	Very high	96	Very high	109 Å²	109	44.8 Å²	44.8	48%	0.478	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-41.1	175.4	-73.2	-65.8	0	0	0	112.1	Q258 V280 Y281 A286 L287 G288	Q258-F284 VanDerWaalsContact OE1-CB 3.23Å; Q258-F284 PolarHBondContact OE1-O 3.34Å; V280-F284 HydrophobicContact CG1-CD2 3.74Å; V280-F284 HydrophobicContact CG1-CE2 3.49Å; V280-F284 VanDerWaalsContact CG1-CE2 3.49Å; V280-F284 VanDerWaalsContact O-CD2 3.29Å; V280-F284 WeakPolarHBondContact O-CD2 3.26Å; V280-F284 PolarHBondContact O-N 3.15Å; Y281-F284 PolarHBondContact O-N 3.39Å; F284-A286 VanDerWaalsContact C-N 3.31Å; F284-A286 PolarHBondContact O-N 2.87Å; F284-L287 HydrophobicContact CD1-CD1 4.43Å; F284-L287 PolarHBondContact O-N 2.75Å; F284-G288 PolarHBondContact O-N 3.47Å
285	G	96.8	Very high	96.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-40.6	175.2	0	0	0	0	0	112.7	Y281 Y282 G288 G289 N290	Y281-G285 PolarHBondContact O-N 3.32Å; Y282-G285 PolarHBondContact O-N 2.84Å; G285-G288 CarbonylContact O-C 3.59Å; G285-G288 PolarHBondContact O-N 3.12Å; G285-G289 PolarHBondContact O-N 2.82Å; G285-N290 WeakPolarHBondContact O-CB 3.37Å; G285-N290 PolarHBondContact O-N 3.5Å
286	A	96.9	Very high	96.3	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-69.1	-42.6	175.4	0	0	0	0	0	112	Y282 T283 F284 G288 G289 A293 H294 L297	Y282-A286 VanDerWaalsContact O-CB 3.32Å; Y282-A286 WeakPolarHBondContact O-CB 3.32Å; Y282-A286 PolarHBondContact O-N 3.16Å; T283-A286 PolarHBondContact O-N 2.8Å; F284-A286 VanDerWaalsContact C-N 3.31Å; F284-A286 PolarHBondContact O-N 2.87Å; A286-G288 PolarHBondContact O-N 3Å; A286-G289 PolarHBondContact O-N 3.27Å; A286-A293 HydrophobicContact CB-CB 4.02Å; A286-H294 PolarHBondContact O-NE2 3.37Å; A286-L297 HydrophobicContact CB-CD1 3.53Å
287	L	96.1	Very high	96.4	Very high	145 Å²	145	37.1 Å²	37.1	76%	0.759	21%	0.209	S	C	*	.	H	α-helix	trans	-59.6	-34.5	174	-73.3	171.4	0	0	0	112.3	T283 F284 G289	T283-L287 WeakPolarHBondContact O-CB 3.42Å; T283-L287 VanDerWaalsContact O-CG 3.29Å; T283-L287 WeakPolarHBondContact O-CG 3.29Å; T283-L287 PolarHBondContact O-N 3.15Å; F284-L287 HydrophobicContact CD1-CD1 4.43Å; F284-L287 PolarHBondContact O-N 2.75Å; L287-G289 PolarHBondContact O-N 3.11Å
288	G	94.4	Very high	96.5	Very high	44 Å²	44	32 Å²	32	45%	0.454	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	13.1	172.2	0	0	0	0	0	114.9	P255 F284 G285 A286	P255-G288 WeakPolarHBondContact CG-O 3.24Å; F284-G288 PolarHBondContact O-N 3.47Å; G285-G288 CarbonylContact O-C 3.59Å; G285-G288 PolarHBondContact O-N 3.12Å; A286-G288 PolarHBondContact O-N 3Å
289	G	94.4	Very high	96.5	Very high	50 Å²	50	32.1 Å²	32.1	52%	0.515	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	13.5	171.4	0	0	0	0	0	115.7	G285 A286 L287 L291	G285-G289 PolarHBondContact O-N 2.82Å; A286-G289 PolarHBondContact O-N 3.27Å; L287-G289 PolarHBondContact O-N 3.11Å; G289-L291 PolarHBondContact O-N 3.39Å
290	N	95.9	Very high	96.5	Very high	17 Å²	17	30.6 Å²	30.6	9%	0.091	18%	0.179	C	C	.	.			trans	-74.2	114.7	177.7	-170.2	-55.7	0	0	0	111.6	P255 K256 T259 G285 I292 A293 H294	P255-N290 HydrophobicContact CB-CB 4.28Å; K256-N290 WeakPolarHBondContact CG-ND2 3.34Å; T259-N290 PolarHBondContact OG1-ND2 3.46Å; G285-N290 WeakPolarHBondContact O-CB 3.37Å; G285-N290 PolarHBondContact O-N 3.5Å; N290-I292 VanDerWaalsContact C-N 3.34Å; N290-I292 PolarHBondContact O-N 3.4Å; N290-I292 WeakPolarHBondContact OD1-CA 3.39Å; N290-I292 VanDerWaalsContact OD1-CB 3.29Å; N290-I292 WeakPolarHBondContact OD1-CB 3.45Å; N290-I292 PolarHBondContact OD1-N 3.4Å; N290-A293 HydrophobicContact CB-CB 3.98Å; N290-A293 WeakPolarHBondContact O-CB 3.4Å; N290-A293 PolarHBondContact O-N 2.87Å; N290-A293 PolarHBondContact OD1-N 2.95Å; N290-A293 VanDerWaalsContact OD1-N 3.11Å; N290-H294 PolarHBondContact O-CD2 3.37Å; N290-H294 PolarHBondContact O-N 2.94Å; N290-H294 VanDerWaalsContact O-N 3.09Å
291	L	95.6	Very high	96.6	Very high	33 Å²	33	29.9 Å²	29.9	17%	0.173	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-37.2	-179.5	-57.4	176.2	0	0	0	113.3	G289 A293 H294 M295 L320 V321 H324 W555	G289-L291 PolarHBondContact O-N 3.39Å; L291-A293 VanDerWaalsContact C-N 3.33Å; L291-H294 WeakPolarHBondContact O-CB 3.46Å; L291-H294 PolarHBondContact O-N 2.81Å; L291-M295 WeakPolarHBondContact O-CG 3.35Å; L291-M295 PolarHBondContact O-N 3.37Å; L291-L320 HydrophobicContact CD2-CD2 3.96Å; L291-V321 HydrophobicContact CD2-CG2 4.46Å; L291-H324 HydrophobicContact CD1-CB 4.32Å; L291-H324 HydrophobicContact CD2-CB 4.33Å; L291-W555 HydrophobicContact CB-CZ3 4.35Å; L291-W555 HydrophobicContact CD1-CH2 4.46Å; L291-W555 HydrophobicContact CD1-CZ3 3.93Å
292	I	95.5	Very high	96.5	Very high	34 Å²	34	29 Å²	29	17%	0.174	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-41.7	178	-59.9	176.1	0	0	0	109.5	T259 N290 H294 M295 V296 Q584	T259-I292 HydrophobicContact CG2-CB 4.47Å; T259-I292 HydrophobicContact CG2-CG2 4.31Å; N290-I292 VanDerWaalsContact C-N 3.34Å; N290-I292 PolarHBondContact O-N 3.4Å; N290-I292 WeakPolarHBondContact OD1-CA 3.39Å; N290-I292 VanDerWaalsContact OD1-CB 3.29Å; N290-I292 WeakPolarHBondContact OD1-CB 3.45Å; N290-I292 PolarHBondContact OD1-N 3.4Å; I292-H294 VanDerWaalsContact C-N 3.35Å; I292-H294 PolarHBondContact O-N 3.32Å; I292-M295 WeakPolarHBondContact O-CB 3.3Å; I292-M295 PolarHBondContact O-N 3.38Å; I292-V296 HydrophobicContact CG2-CG2 4.4Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.11Å; I292-V296 PolarHBondContact O-N 2.91Å; I292-Q584 HydrophobicContact CG2-CG 3.85Å
293	A	97.2	Very high	96.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.8	-42.1	174.9	0	0	0	0	0	111.9	T259 A286 N290 L291 M295 V296 L297	T259-A293 HydrophobicContact CG2-CB 4.06Å; A286-A293 HydrophobicContact CB-CB 4.02Å; N290-A293 HydrophobicContact CB-CB 3.98Å; N290-A293 WeakPolarHBondContact O-CB 3.4Å; N290-A293 PolarHBondContact O-N 2.87Å; N290-A293 PolarHBondContact OD1-N 2.95Å; N290-A293 VanDerWaalsContact OD1-N 3.11Å; L291-A293 VanDerWaalsContact C-N 3.33Å; A293-M295 VanDerWaalsContact C-N 3.34Å; A293-M295 PolarHBondContact O-N 3Å; A293-V296 PolarHBondContact O-N 3.35Å; A293-L297 WeakPolarHBondContact O-CB 3.46Å; A293-L297 WeakPolarHBondContact O-CG 3.4Å; A293-L297 PolarHBondContact O-N 3.43Å
294	H	97.4	Very high	96.3	Very high	22 Å²	22	30.1 Å²	30.1	10%	0.102	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-43.6	172.4	-84.7	-86.9	0	0	0	112.2	A286 N290 L291 I292 L297 G298 H317 V321	A286-H294 PolarHBondContact O-NE2 3.37Å; N290-H294 PolarHBondContact O-CD2 3.37Å; N290-H294 PolarHBondContact O-N 2.94Å; N290-H294 VanDerWaalsContact O-N 3.09Å; L291-H294 WeakPolarHBondContact O-CB 3.46Å; L291-H294 PolarHBondContact O-N 2.81Å; I292-H294 VanDerWaalsContact C-N 3.35Å; I292-H294 PolarHBondContact O-N 3.32Å; H294-L297 PolarHBondContact O-N 3.27Å; H294-G298 PolarHBondContact O-N 3.03Å; H294-H317 AromaticContact CE1-ND1 3.66Å; H294-H317 AromaticContact CG-ND1 3.92Å; H294-H317 AromaticContact ND1-CE1 3.99Å; H294-H317 AromaticContact ND1-CG 3.9Å; H294-H317 AromaticContact ND1-ND1 3Å; H294-H317 PolarHBondContact ND1-ND1 3.11Å; H294-H317 WeakPolarHBondContact O-CB 3.46Å; H294-V321 HydrophobicContact CB-CG2 3.44Å; H294-V321 VanDerWaalsContact CB-CG2 3.44Å
295	M	96.9	Very high	96.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-44.8	176.8	-71.1	-176.2	65.9	0	0	112.6	L291 I292 A293 G298 Y299 V321 C550 W555 Q584 Y586	L291-M295 WeakPolarHBondContact O-CG 3.35Å; L291-M295 PolarHBondContact O-N 3.37Å; I292-M295 WeakPolarHBondContact O-CB 3.3Å; I292-M295 PolarHBondContact O-N 3.38Å; A293-M295 VanDerWaalsContact C-N 3.34Å; A293-M295 PolarHBondContact O-N 3Å; M295-G298 PolarHBondContact O-N 3.44Å; M295-Y299 PolarHBondContact O-N 3.47Å; M295-V321 HydrophobicContact CG-CB 4.29Å; M295-V321 HydrophobicContact CG-CG1 3.74Å; M295-V321 HydrophobicContact CG-CG2 3.99Å; M295-V321 HydrophobicContact SD-CG1 4.02Å; M295-C550 HydrophobicContact CE-CB 3.82Å; M295-C550 HydrophobicContact CG-CB 4.38Å; M295-C550 HydrophobicContact SD-CB 4.21Å; M295-W555 HydrophobicContact CE-CZ2 4.35Å; M295-W555 HydrophobicContact SD-CD2 4.23Å; M295-W555 HydrophobicContact SD-CH2 4.28Å; M295-W555 HydrophobicContact SD-CZ2 3.35Å; M295-W555 WeakPolarHBondContact SD-CZ2 3.3Å; M295-W555 PolarHBondContact SD-NE1 3.41Å; M295-Q584 HydrophobicContact CE-CB 4.4Å; M295-Y586 HydrophobicContact CE-CE2 4.07Å
296	V	97.5	Very high	95.8	Very high	1 Å²	1	29 Å²	29	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-45.4	178.8	174.5	0	0	0	0	110.6	Y282 I292 A293 Y299 R300 E583 Q584	Y282-V296 HydrophobicContact CD1-CB 4.43Å; Y282-V296 HydrophobicContact CD1-CG1 4.2Å; Y282-V296 HydrophobicContact CD2-CG1 3.77Å; Y282-V296 HydrophobicContact CE1-CB 4.37Å; Y282-V296 HydrophobicContact CE1-CG1 4.01Å; Y282-V296 HydrophobicContact CE1-CG2 4.32Å; Y282-V296 HydrophobicContact CE2-CG1 3.56Å; Y282-V296 HydrophobicContact CG-CG1 4.08Å; I292-V296 HydrophobicContact CG2-CG2 4.4Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.11Å; I292-V296 PolarHBondContact O-N 2.91Å; A293-V296 PolarHBondContact O-N 3.35Å; V296-Y299 PolarHBondContact O-N 3.48Å; V296-R300 HydrophobicContact CG1-CG 4.37Å; V296-R300 WeakPolarHBondContact O-CB 3.31Å; V296-R300 VanDerWaalsContact O-CG 3.26Å; V296-R300 WeakPolarHBondContact O-CG 3.28Å; V296-R300 PolarHBondContact O-N 2.71Å; V296-E583 HydrophobicContact CG2-CB 4.4Å; V296-Q584 HydrophobicContact CG2-CG 3.87Å
297	L	97.4	Very high	95.7	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-42.5	175.5	-70.8	175.9	0	0	0	111.9	L279 T283 A286 A293 H294 Y299 R300 Y301	L279-L297 HydrophobicContact CD1-CD2 3.72Å; T283-L297 HydrophobicContact CG2-CD1 4.34Å; T283-L297 HydrophobicContact CG2-CD2 4.16Å; A286-L297 HydrophobicContact CB-CD1 3.53Å; A293-L297 WeakPolarHBondContact O-CB 3.46Å; A293-L297 WeakPolarHBondContact O-CG 3.4Å; A293-L297 PolarHBondContact O-N 3.43Å; H294-L297 PolarHBondContact O-N 3.27Å; L297-Y299 VanDerWaalsContact C-N 3.31Å; L297-Y299 PolarHBondContact O-N 3.1Å; L297-R300 PolarHBondContact O-N 3.1Å; L297-Y301 WeakPolarHBondContact O-CD2 3.37Å; L297-Y301 PolarHBondContact O-N 3.29Å
298	G	97	Very high	95.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.7	-47.6	174.5	0	0	0	0	0	111.7	H294 M295 W302 A314	H294-G298 PolarHBondContact O-N 3.03Å; M295-G298 PolarHBondContact O-N 3.44Å; G298-W302 VanDerWaalsContact O-CB 3.3Å; G298-W302 WeakPolarHBondContact O-CB 3.2Å; G298-W302 PolarHBondContact O-N 2.95Å; G298-A314 WeakPolarHBondContact O-CB 3.24Å
299	Y	96.9	Very high	95.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-41.1	176.8	-178	-118.9	0	0	0	112.5	M295 V296 L297 W302 A303 I305 Y318 G585 Q590 Q624	M295-Y299 PolarHBondContact O-N 3.47Å; V296-Y299 PolarHBondContact O-N 3.48Å; L297-Y299 VanDerWaalsContact C-N 3.31Å; L297-Y299 PolarHBondContact O-N 3.1Å; Y299-W302 PolarHBondContact O-N 3.32Å; Y299-A303 HydrophobicContact CD2-CB 4.48Å; Y299-A303 HydrophobicContact CE2-CB 4.06Å; Y299-A303 WeakPolarHBondContact O-CB 3.35Å; Y299-A303 PolarHBondContact O-N 3.2Å; Y299-I305 HydrophobicContact CD1-CD1 4.13Å; Y299-I305 HydrophobicContact CE1-CD1 3.6Å; Y299-Y318 VanDerWaalsContact CA-OH 3.29Å; Y299-Y318 WeakPolarHBondContact CA-OH 3.44Å; Y299-Y318 WeakPolarHBondContact CB-OH 3.41Å; Y299-Y318 PolarHBondContact N-OH 3.28Å; Y299-G585 VanDerWaalsContact CG-CA 3.43Å; Y299-Q590 VanDerWaalsContact CZ-NE2 3.3Å; Y299-Q590 PolarHBondContact OH-NE2 2.9Å; Y299-Q624 PolarHBondContact OH-NE2 3.02Å
300	R	96.8	Very high	95.8	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-44	178.3	-74.7	174.5	172.6	-91.7	-4.1	112.3	V296 L297 W302 G304 I305 V307 E583	V296-R300 HydrophobicContact CG1-CG 4.37Å; V296-R300 WeakPolarHBondContact O-CB 3.31Å; V296-R300 VanDerWaalsContact O-CG 3.26Å; V296-R300 WeakPolarHBondContact O-CG 3.28Å; V296-R300 PolarHBondContact O-N 2.71Å; L297-R300 PolarHBondContact O-N 3.1Å; R300-W302 VanDerWaalsContact C-N 3.35Å; R300-G304 CarbonylContact O-C 3.6Å; R300-G304 WeakPolarHBondContact O-CA 3.44Å; R300-G304 PolarHBondContact O-N 2.87Å; R300-I305 HydrophobicContact CB-CB 4.47Å; R300-I305 HydrophobicContact CG-CB 4.19Å; R300-I305 PolarHBondContact O-N 3.35Å; R300-V307 HydrophobicContact CB-CG2 4.26Å; R300-V307 WeakPolarHBondContact O-CG2 3.45Å; R300-E583 IonicContact CZ-OE2 3.49Å; R300-E583 IonicContact NE-OE2 3.76Å; R300-E583 IonicContact NH2-OE2 3.3Å; R300-E583 PolarHBondContact NH2-OE2 3.07Å
301	Y	97.2	Very high	95.8	Very high	56 Å²	56	35.2 Å²	35.2	22%	0.22	21%	0.207	C	C	.	.	H	α-helix	trans	-67.9	-34.6	174.3	-77.8	-64.1	0	0	0	112.7	L297 V307 Q309 S310 H317	L297-Y301 WeakPolarHBondContact O-CD2 3.37Å; L297-Y301 PolarHBondContact O-N 3.29Å; Y301-V307 HydrophobicContact CD1-CB 4.06Å; Y301-V307 HydrophobicContact CD1-CG2 3.65Å; Y301-V307 HydrophobicContact CE1-CB 3.91Å; Y301-V307 HydrophobicContact CE1-CG1 4.11Å; Y301-V307 HydrophobicContact CE1-CG2 3.99Å; Y301-V307 HydrophobicContact CG-CG2 4.17Å; Y301-Q309 WeakPolarHBondContact O-CA 3.22Å; Y301-S310 PolarHBondContact O-N 3.25Å; Y301-H317 AromaticContact CD2-CD2 3.94Å; Y301-H317 AromaticContact CE2-NE2 3.73Å
302	W	95.9	Very high	95.8	Very high	39 Å²	39	37.7 Å²	37.7	15%	0.148	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-46.2	176.4	177.4	-109.3	0	0	0	112.8	G298 Y299 R300 Q309 C311 A314 H540 V543 E544	G298-W302 VanDerWaalsContact O-CB 3.3Å; G298-W302 WeakPolarHBondContact O-CB 3.2Å; G298-W302 PolarHBondContact O-N 2.95Å; Y299-W302 PolarHBondContact O-N 3.32Å; R300-W302 VanDerWaalsContact C-N 3.35Å; W302-Q309 WeakPolarHBondContact O-CG 3.38Å; W302-Q309 PolarHBondContact O-NE2 3.38Å; W302-C311 HydrophobicContact CZ3-CB 4.46Å; W302-A314 HydrophobicContact CB-CB 4.04Å; W302-H540 HydrophobicContact CH2-CB 4.18Å; W302-H540 AromaticContact CH2-CE1 3.39Å; W302-H540 WeakPolarHBondContact CH2-CE1 3.34Å; W302-H540 AromaticContact CH2-CG 3.61Å; W302-H540 AromaticContact CH2-ND1 2.94Å; W302-H540 WeakPolarHBondContact CH2-ND1 3.46Å; W302-H540 WeakPolarHBondContact CH2-O 3.25Å; W302-H540 AromaticContact CZ2-CE1 3.48Å; W302-H540 VanDerWaalsContact CZ2-CE1 3.48Å; W302-H540 WeakPolarHBondContact CZ2-CE1 3.46Å; W302-H540 AromaticContact CZ2-ND1 3.55Å; W302-H540 AromaticContact CZ3-ND1 3.74Å; W302-V543 HydrophobicContact CD2-CG1 3.81Å; W302-V543 HydrophobicContact CE3-CB 3.97Å; W302-V543 HydrophobicContact CE3-CG1 3.45Å; W302-V543 VanDerWaalsContact CE3-CG1 3.45Å; W302-V543 HydrophobicContact CE3-CG2 4.38Å; W302-V543 HydrophobicContact CG-CG1 4.35Å; W302-V543 HydrophobicContact CH2-CB 4.11Å; W302-V543 HydrophobicContact CH2-CG1 4.14Å; W302-V543 HydrophobicContact CZ3-CB 3.63Å; W302-V543 HydrophobicContact CZ3-CG1 3.64Å; W302-V543 HydrophobicContact CZ3-CG2 4.17Å; W302-E544 HydrophobicContact CH2-CG 4.05Å; W302-E544 HydrophobicContact CZ2-CG 3.81Å
303	A	94.5	Very high	95.8	Very high	40 Å²	40	38 Å²	38	33%	0.331	22%	0.222	S	C	.	.	H	α-helix	trans	-89.9	-10.3	-176.6	0	0	0	0	0	113.8	Y299 I305	Y299-A303 HydrophobicContact CD2-CB 4.48Å; Y299-A303 HydrophobicContact CE2-CB 4.06Å; Y299-A303 WeakPolarHBondContact O-CB 3.35Å; Y299-A303 PolarHBondContact O-N 3.2Å; A303-I305 HydrophobicContact CB-CD1 3.81Å; A303-I305 HydrophobicContact CB-CG1 3.85Å
304	G	94.4	Very high	95.8	Very high	31 Å²	31	38 Å²	38	32%	0.32	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	34.5	-177.4	0	0	0	0	0	114.2	R300 G306 V307	R300-G304 CarbonylContact O-C 3.6Å; R300-G304 WeakPolarHBondContact O-CA 3.44Å; R300-G304 PolarHBondContact O-N 2.87Å; G304-G306 PolarHBondContact O-N 3.04Å; G304-V307 CarbonylContact C-O 3.54Å; G304-V307 VanDerWaalsContact C-O 3.28Å; G304-V307 WeakPolarHBondContact CA-O 3.44Å
305	I	92.9	Very high	95.8	Very high	30 Å²	30	37.4 Å²	37.4	15%	0.154	22%	0.22	C	C	.	.	S	Bend	trans	-90.7	100.9	-174.4	-57	168	0	0	0	110.4	Y299 R300 A303 V307	Y299-I305 HydrophobicContact CD1-CD1 4.13Å; Y299-I305 HydrophobicContact CE1-CD1 3.6Å; R300-I305 HydrophobicContact CB-CB 4.47Å; R300-I305 HydrophobicContact CG-CB 4.19Å; R300-I305 PolarHBondContact O-N 3.35Å; A303-I305 HydrophobicContact CB-CD1 3.81Å; A303-I305 HydrophobicContact CB-CG1 3.85Å; I305-V307 PolarHBondContact O-N 3.26Å
306	G	89.8	Confident	95.8	Very high	56 Å²	56	40.9 Å²	40.9	58%	0.577	24%	0.241	S	C	*	.	S	Bend	trans	72	6.3	-179.2	0	0	0	0	0	114.1	G304	G304-G306 PolarHBondContact O-N 3.04Å
307	V	95	Very high	95.8	Very high	28 Å²	28	42.4 Å²	42.4	17%	0.17	25%	0.248	C	C	.	.	S	Bend	trans	-142.6	158.4	177.1	-67.2	0	0	0	0	109.4	L279 R300 Y301 G304 I305	L279-V307 HydrophobicContact CD1-CG1 3.66Å; L279-V307 HydrophobicContact CD2-CG1 3.45Å; L279-V307 VanDerWaalsContact CD2-CG1 3.45Å; L279-V307 HydrophobicContact CG-CG1 4.22Å; R300-V307 HydrophobicContact CB-CG2 4.26Å; R300-V307 WeakPolarHBondContact O-CG2 3.45Å; Y301-V307 HydrophobicContact CD1-CB 4.06Å; Y301-V307 HydrophobicContact CD1-CG2 3.65Å; Y301-V307 HydrophobicContact CE1-CB 3.91Å; Y301-V307 HydrophobicContact CE1-CG1 4.11Å; Y301-V307 HydrophobicContact CE1-CG2 3.99Å; Y301-V307 HydrophobicContact CG-CG2 4.17Å; G304-V307 CarbonylContact C-O 3.54Å; G304-V307 VanDerWaalsContact C-O 3.28Å; G304-V307 WeakPolarHBondContact CA-O 3.44Å; I305-V307 PolarHBondContact O-N 3.26Å
308	L	95.4	Very high	95.8	Very high	157 Å²	157	42.3 Å²	42.3	82%	0.822	25%	0.248	S	C	*	.			trans	-65.2	135.2	171.5	-173.6	68.1	0	0	0	109.7	S310	L308-S310 PolarHBondContact O-N 3.38Å
309	Q	95.8	Very high	95.8	Very high	137 Å²	137	47.4 Å²	47.4	64%	0.64	27%	0.267	S	S	*	.			trans	-60.8	121.9	178	-170	177.4	32.7	0	0	110.3	Y301 W302	Y301-Q309 WeakPolarHBondContact O-CA 3.22Å; W302-Q309 WeakPolarHBondContact O-CG 3.38Å; W302-Q309 PolarHBondContact O-NE2 3.38Å
310	S	96.4	Very high	95.8	Very high	35 Å²	35	51 Å²	51	25%	0.245	29%	0.286	C	S	.	.			trans	-144.6	111.9	-178.1	174.8	0	0	0	0	110.2	Y301 L308 S313 A314	Y301-S310 PolarHBondContact O-N 3.25Å; L308-S310 PolarHBondContact O-N 3.38Å; S310-S313 WeakPolarHBondContact OG-CB 3.49Å; S310-S313 PolarHBondContact OG-N 3.46Å; S310-S313 PolarHBondContact OG-OG 3.07Å; S310-A314 PolarHBondContact O-N 3.2Å; S310-A314 VanDerWaalsContact O-N 3.11Å
311	C	96.3	Very high	95.8	Very high	34 Å²	34	50.9 Å²	50.9	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-66.7	-40.8	178.2	-176.9	0	0	0	0	111.9	W302 S313 A314 L315 C539 H540	W302-C311 HydrophobicContact CZ3-CB 4.46Å; C311-S313 PolarHBondContact O-N 3.45Å; C311-A314 PolarHBondContact O-N 2.83Å; C311-L315 VanDerWaalsContact O-CB 3.3Å; C311-L315 WeakPolarHBondContact O-CB 3.37Å; C311-L315 PolarHBondContact O-N 3.37Å; C311-C539 HydrophobicContact CB-CB 4.06Å; C311-C539 WeakPolarHBondContact CB-SG 3.33Å; C311-C539 PolarHBondContact O-SG 3.29Å; C311-C539 WeakPolarHBondContact SG-CB 3.35Å; C311-C539 PolarHBondContact SG-O 2.88Å; C311-C539 VanDerWaalsContact SG-O 3.32Å; C311-C539 CovalentContact SG-SG 2.03Å; C311-C539 PolarHBondContact SG-SG 3Å; C311-H540 PolarHBondContact SG-N 3.36Å
312	E	95.6	Very high	95.7	Very high	85 Å²	85	48.2 Å²	48.2	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-65.1	-41.6	-178.3	-63.8	-68.3	177.3	0	0	111.4	L315 T316 R537	E312-L315 WeakPolarHBondContact O-CB 3.21Å; E312-L315 PolarHBondContact O-N 3.08Å; E312-T316 WeakPolarHBondContact O-CG2 3.46Å; E312-T316 PolarHBondContact O-N 2.9Å; E312-T316 VanDerWaalsContact O-N 3.09Å; E312-R537 IonicContact OE1-CZ 2.72Å; E312-R537 IonicContact OE1-NH1 3.59Å; E312-R537 IonicContact OE1-NH2 3.81Å; E312-R537 PolarHBondContact OE1-NH2 2.96Å; E312-R537 IonicContact OE2-NH2 2.67Å; E312-R537 PolarHBondContact OE2-NH2 2.94Å
313	S	96.3	Very high	95.6	Very high	40 Å²	40	49.6 Å²	49.6	28%	0.28	29%	0.285	S	S	.	.	H	α-helix	trans	-65.2	-40.8	174.9	-53.9	0	0	0	0	111.3	S310 C311 L315 T316 H317	S310-S313 WeakPolarHBondContact OG-CB 3.49Å; S310-S313 PolarHBondContact OG-N 3.46Å; S310-S313 PolarHBondContact OG-OG 3.07Å; C311-S313 PolarHBondContact O-N 3.45Å; S313-L315 VanDerWaalsContact C-N 3.33Å; S313-L315 PolarHBondContact O-N 3.4Å; S313-T316 PolarHBondContact O-OG1 3.49Å; S313-H317 PolarHBondContact O-CD2 2.98Å; S313-H317 PolarHBondContact O-N 3.02Å
314	A	97.4	Very high	95.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-42.3	174.1	0	0	0	0	0	111.7	G298 W302 S310 C311 T316 H317 Y318 V543	G298-A314 WeakPolarHBondContact O-CB 3.24Å; W302-A314 HydrophobicContact CB-CB 4.04Å; S310-A314 PolarHBondContact O-N 3.2Å; S310-A314 VanDerWaalsContact O-N 3.11Å; C311-A314 PolarHBondContact O-N 2.83Å; A314-T316 PolarHBondContact O-N 3.43Å; A314-H317 PolarHBondContact O-N 3.47Å; A314-Y318 HydrophobicContact CB-CD2 4.38Å; A314-Y318 VanDerWaalsContact O-CD2 3.29Å; A314-Y318 WeakPolarHBondContact O-CD2 3.47Å; A314-Y318 PolarHBondContact O-N 3.4Å; A314-V543 HydrophobicContact CB-CG1 4.28Å; A314-V543 HydrophobicContact CB-CG2 4.33Å
315	L	97.3	Very high	95.6	Very high	9 Å²	9	50 Å²	50	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-42.5	-179.7	-177.3	65.1	0	0	0	112.2	C311 E312 S313 R319 A530 A542 V543 F546	C311-L315 VanDerWaalsContact O-CB 3.3Å; C311-L315 WeakPolarHBondContact O-CB 3.37Å; C311-L315 PolarHBondContact O-N 3.37Å; E312-L315 WeakPolarHBondContact O-CB 3.21Å; E312-L315 PolarHBondContact O-N 3.08Å; S313-L315 VanDerWaalsContact C-N 3.33Å; S313-L315 PolarHBondContact O-N 3.4Å; L315-R319 WeakPolarHBondContact O-CB 3.44Å; L315-R319 PolarHBondContact O-N 2.79Å; L315-A530 HydrophobicContact CD1-CB 4.3Å; L315-A530 HydrophobicContact CD2-CB 4.22Å; L315-A542 HydrophobicContact CD1-CB 3.88Å; L315-V543 HydrophobicContact CB-CG2 3.71Å; L315-V543 HydrophobicContact CD1-CG2 3.95Å; L315-V543 HydrophobicContact CG-CG2 4.44Å; L315-F546 HydrophobicContact CD1-CD2 3.54Å; L315-F546 HydrophobicContact CD1-CE2 3.7Å
316	T	96.3	Very high	95.5	Very high	74 Å²	74	49.5 Å²	49.5	45%	0.454	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-44.3	179.7	56.5	0	0	0	0	112	E312 S313 A314 L320	E312-T316 WeakPolarHBondContact O-CG2 3.46Å; E312-T316 PolarHBondContact O-N 2.9Å; E312-T316 VanDerWaalsContact O-N 3.09Å; S313-T316 PolarHBondContact O-OG1 3.49Å; A314-T316 PolarHBondContact O-N 3.43Å; T316-L320 PolarHBondContact O-N 3.46Å
317	H	97.3	Very high	95.4	Very high	33 Å²	33	50.8 Å²	50.8	15%	0.153	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-48.6	177.4	-72.1	-72.1	0	0	0	111.9	H294 Y301 S313 A314 R319 L320 V321	H294-H317 AromaticContact CE1-ND1 3.66Å; H294-H317 AromaticContact CG-ND1 3.92Å; H294-H317 AromaticContact ND1-CE1 3.99Å; H294-H317 AromaticContact ND1-CG 3.9Å; H294-H317 AromaticContact ND1-ND1 3Å; H294-H317 PolarHBondContact ND1-ND1 3.11Å; H294-H317 WeakPolarHBondContact O-CB 3.46Å; Y301-H317 AromaticContact CD2-CD2 3.94Å; Y301-H317 AromaticContact CE2-NE2 3.73Å; S313-H317 PolarHBondContact O-CD2 2.98Å; S313-H317 PolarHBondContact O-N 3.02Å; A314-H317 PolarHBondContact O-N 3.47Å; H317-R319 PolarHBondContact O-N 3.39Å; H317-L320 PolarHBondContact O-N 3.38Å; H317-V321 PolarHBondContact O-N 3.47Å
318	Y	97.8	Very high	95	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-36.2	-179.9	-80.4	-57.2	0	0	0	112.9	Y299 A314 L320 V321 A322 V543 K547 C550	Y299-Y318 VanDerWaalsContact CA-OH 3.29Å; Y299-Y318 WeakPolarHBondContact CA-OH 3.44Å; Y299-Y318 WeakPolarHBondContact CB-OH 3.41Å; Y299-Y318 PolarHBondContact N-OH 3.28Å; A314-Y318 HydrophobicContact CB-CD2 4.38Å; A314-Y318 VanDerWaalsContact O-CD2 3.29Å; A314-Y318 WeakPolarHBondContact O-CD2 3.47Å; A314-Y318 PolarHBondContact O-N 3.4Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 3.18Å; Y318-V321 PolarHBondContact O-N 3.18Å; Y318-A322 WeakPolarHBondContact O-CB 3.41Å; Y318-A322 PolarHBondContact O-N 2.92Å; Y318-V543 HydrophobicContact CD2-CG1 3.8Å; Y318-V543 HydrophobicContact CE2-CG1 3.98Å; Y318-K547 HydrophobicContact CE1-CB 4.22Å; Y318-K547 HydrophobicContact CE1-CG 4.27Å; Y318-K547 HydrophobicContact CE2-CB 4.42Å; Y318-C550 HydrophobicContact CD1-CB 4.24Å; Y318-C550 PolarHBondContact O-SG 3.24Å
319	R	96.6	Very high	94.3	Very high	107 Å²	107	46.9 Å²	46.9	40%	0.404	25%	0.251	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176.3	-175.9	177.3	66.7	178.4	1.6	111.7	L315 H317 A322 N323 F546	L315-R319 WeakPolarHBondContact O-CB 3.44Å; L315-R319 PolarHBondContact O-N 2.79Å; H317-R319 PolarHBondContact O-N 3.39Å; R319-A322 PolarHBondContact O-N 3.36Å; R319-N323 PolarHBondContact O-N 3.04Å; R319-N323 PolarHBondContact O-OD1 2.95Å; R319-N323 VanDerWaalsContact O-OD1 3.08Å; R319-F546 HydrophobicContact CB-CE2 4.3Å; R319-F546 HydrophobicContact CB-CZ 4.41Å; R319-F546 HydrophobicContact CG-CE2 4.38Å; R319-F546 HydrophobicContact CG-CZ 4.09Å
320	L	96.1	Very high	93.1	Very high	77 Å²	77	42.8 Å²	42.8	40%	0.403	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-48.1	177.6	-174.2	153.5	0	0	0	111.2	L291 T316 H317 Y318 N323 H324	L291-L320 HydrophobicContact CD2-CD2 3.96Å; T316-L320 PolarHBondContact O-N 3.46Å; H317-L320 PolarHBondContact O-N 3.38Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 3.18Å; L320-N323 PolarHBondContact O-N 3.44Å; L320-H324 PolarHBondContact O-N 3.31Å
321	V	96.8	Very high	91.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-42.3	179.2	-179.5	0	0	0	0	111	L291 H294 M295 H317 Y318 N323 H324 V325 C550 W555	L291-V321 HydrophobicContact CD2-CG2 4.46Å; H294-V321 HydrophobicContact CB-CG2 3.44Å; H294-V321 VanDerWaalsContact CB-CG2 3.44Å; M295-V321 HydrophobicContact CG-CB 4.29Å; M295-V321 HydrophobicContact CG-CG1 3.74Å; M295-V321 HydrophobicContact CG-CG2 3.99Å; M295-V321 HydrophobicContact SD-CG1 4.02Å; H317-V321 PolarHBondContact O-N 3.47Å; Y318-V321 PolarHBondContact O-N 3.18Å; V321-N323 VanDerWaalsContact C-N 3.3Å; V321-N323 PolarHBondContact O-N 3.44Å; V321-H324 WeakPolarHBondContact O-CB 3.4Å; V321-H324 PolarHBondContact O-N 3.08Å; V321-H324 VanDerWaalsContact O-N 3.15Å; V321-V325 HydrophobicContact CG1-CG2 4.38Å; V321-V325 WeakPolarHBondContact O-CG2 3.43Å; V321-V325 PolarHBondContact O-N 3.24Å; V321-C550 HydrophobicContact CG1-CB 4.03Å; V321-W555 HydrophobicContact CG1-CH2 3.52Å; V321-W555 HydrophobicContact CG1-CZ2 3.68Å
322	A	95.9	Very high	89.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-35.1	179.3	0	0	0	0	0	112.4	Y318 R319 H324 V325 A326 Y523 F546 V549	Y318-A322 WeakPolarHBondContact O-CB 3.41Å; Y318-A322 PolarHBondContact O-N 2.92Å; R319-A322 PolarHBondContact O-N 3.36Å; A322-H324 VanDerWaalsContact C-N 3.34Å; A322-V325 PolarHBondContact O-N 3.45Å; A322-A326 VanDerWaalsContact O-CB 3.22Å; A322-A326 WeakPolarHBondContact O-CB 3.36Å; A322-A326 PolarHBondContact O-N 3.05Å; A322-Y523 HydrophobicContact CB-CD2 4.12Å; A322-Y523 HydrophobicContact CB-CE2 4.38Å; A322-F546 HydrophobicContact CB-CB 4.38Å; A322-F546 HydrophobicContact CB-CD1 3.38Å; A322-F546 HydrophobicContact CB-CE1 3.99Å; A322-F546 HydrophobicContact CB-CG 4.23Å; A322-V549 HydrophobicContact CB-CB 4.33Å; A322-V549 HydrophobicContact CB-CG1 3.92Å
323	N	94.9	Very high	87.9	Confident	68 Å²	68	41.7 Å²	41.7	36%	0.364	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-44.5	173	-69.6	-1.9	0	0	0	111.2	R319 L320 V321 A326 S327 Y523	R319-N323 PolarHBondContact O-N 3.04Å; R319-N323 PolarHBondContact O-OD1 2.95Å; R319-N323 VanDerWaalsContact O-OD1 3.08Å; L320-N323 PolarHBondContact O-N 3.44Å; V321-N323 VanDerWaalsContact C-N 3.3Å; V321-N323 PolarHBondContact O-N 3.44Å; N323-A326 PolarHBondContact O-N 3.39Å; N323-S327 PolarHBondContact O-N 3.29Å; N323-S327 PolarHBondContact O-OG 3.3Å; N323-Y523 VanDerWaalsContact OD1-CE2 3.23Å; N323-Y523 WeakPolarHBondContact OD1-CE2 3.44Å; N323-Y523 PolarHBondContact OD1-OH 3.27Å
324	H	94.1	Very high	86.3	Confident	76 Å²	76	42.1 Å²	42.1	35%	0.352	25%	0.246	S	C	.	.	H	α-helix	trans	-65.3	-42.5	176.6	-173.5	-67.2	0	0	0	111.9	L291 L320 V321 A322 A326 S327 D328	L291-H324 HydrophobicContact CD1-CB 4.32Å; L291-H324 HydrophobicContact CD2-CB 4.33Å; L320-H324 PolarHBondContact O-N 3.31Å; V321-H324 WeakPolarHBondContact O-CB 3.4Å; V321-H324 PolarHBondContact O-N 3.08Å; V321-H324 VanDerWaalsContact O-N 3.15Å; A322-H324 VanDerWaalsContact C-N 3.34Å; H324-A326 VanDerWaalsContact C-N 3.3Å; H324-A326 PolarHBondContact O-N 2.97Å; H324-S327 PolarHBondContact O-N 3.02Å; H324-S327 PolarHBondContact O-OG 2.99Å; H324-D328 IonicContact CE1-OD1 3.45Å; H324-D328 IonicContact CE1-OD2 2.86Å; H324-D328 PolarHBondContact CE1-OD2 3.13Å; H324-D328 IonicContact ND1-OD1 3.25Å; H324-D328 IonicContact ND1-OD2 3.58Å; H324-D328 PolarHBondContact ND1-OD2 3.19Å; H324-D328 WeakPolarHBondContact O-CB 3.15Å; H324-D328 PolarHBondContact O-N 2.92Å; H324-D328 VanDerWaalsContact O-N 3.12Å
325	V	93	Very high	84.9	Confident	4 Å²	4	45 Å²	45	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.2	176.8	0	0	0	0	110.6	V321 A322 S327 D328 I329 I519 V549 W555	V321-V325 HydrophobicContact CG1-CG2 4.38Å; V321-V325 WeakPolarHBondContact O-CG2 3.43Å; V321-V325 PolarHBondContact O-N 3.24Å; A322-V325 PolarHBondContact O-N 3.45Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.08Å; V325-D328 PolarHBondContact O-N 3.03Å; V325-I329 HydrophobicContact CG1-CD1 4.32Å; V325-I329 VanDerWaalsContact O-CD1 3.26Å; V325-I329 WeakPolarHBondContact O-CD1 3.46Å; V325-I329 VanDerWaalsContact O-CG1 3.23Å; V325-I329 WeakPolarHBondContact O-CG1 3.49Å; V325-I329 PolarHBondContact O-N 3.48Å; V325-I519 HydrophobicContact CG1-CG2 4.41Å; V325-V549 HydrophobicContact CB-CG1 4.13Å; V325-V549 HydrophobicContact CG1-CG1 4Å; V325-W555 HydrophobicContact CG2-CH2 3.33Å; V325-W555 HydrophobicContact CG2-CZ2 3.64Å; V325-W555 HydrophobicContact CG2-CZ3 4.34Å
326	A	91.1	Very high	83.8	Confident	18 Å²	18	48.6 Å²	48.6	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-36.5	178.4	0	0	0	0	0	112.8	A322 N323 H324 L520 Y523	A322-A326 VanDerWaalsContact O-CB 3.22Å; A322-A326 WeakPolarHBondContact O-CB 3.36Å; A322-A326 PolarHBondContact O-N 3.05Å; N323-A326 PolarHBondContact O-N 3.39Å; H324-A326 VanDerWaalsContact C-N 3.3Å; H324-A326 PolarHBondContact O-N 2.97Å; A326-L520 HydrophobicContact CB-CD2 3.89Å; A326-Y523 HydrophobicContact CB-CD1 4.12Å; A326-Y523 HydrophobicContact CB-CD2 3.87Å; A326-Y523 HydrophobicContact CB-CE1 4.22Å; A326-Y523 HydrophobicContact CB-CE2 3.98Å; A326-Y523 HydrophobicContact CB-CG 3.94Å
327	S	89.2	Confident	82.9	Confident	84 Å²	84	46.6 Å²	46.6	59%	0.587	28%	0.276	S	S	*	.	H	α-helix	trans	-73.9	-29.9	176	55.9	0	0	0	0	113.6	N323 H324 V325	N323-S327 PolarHBondContact O-N 3.29Å; N323-S327 PolarHBondContact O-OG 3.3Å; H324-S327 PolarHBondContact O-N 3.02Å; H324-S327 PolarHBondContact O-OG 2.99Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.08Å
328	D	85.6	Confident	82.1	Confident	62 Å²	62	46.6 Å²	46.6	33%	0.332	28%	0.276	S	S	.	.	H	α-helix	trans	-79.8	-13.2	-175.4	-76.5	-1.4	0	0	0	114.6	H324 V325 S330	H324-D328 IonicContact CE1-OD1 3.45Å; H324-D328 IonicContact CE1-OD2 2.86Å; H324-D328 PolarHBondContact CE1-OD2 3.13Å; H324-D328 IonicContact ND1-OD1 3.25Å; H324-D328 IonicContact ND1-OD2 3.58Å; H324-D328 PolarHBondContact ND1-OD2 3.19Å; H324-D328 WeakPolarHBondContact O-CB 3.15Å; H324-D328 PolarHBondContact O-N 2.92Å; H324-D328 VanDerWaalsContact O-N 3.12Å; V325-D328 PolarHBondContact O-N 3.03Å; D328-S330 PolarHBondContact O-N 3.49Å
329	I	80.8	Confident	81.6	Confident	41 Å²	41	50.8 Å²	50.8	21%	0.21	29%	0.292	C	S	.	.			trans	-75.4	116.5	-175.9	-67.2	153.3	0	0	0	109.9	V325 I519 L520	V325-I329 HydrophobicContact CG1-CD1 4.32Å; V325-I329 VanDerWaalsContact O-CD1 3.26Å; V325-I329 WeakPolarHBondContact O-CD1 3.46Å; V325-I329 VanDerWaalsContact O-CG1 3.23Å; V325-I329 WeakPolarHBondContact O-CG1 3.49Å; V325-I329 PolarHBondContact O-N 3.48Å; I329-I519 HydrophobicContact CD1-CB 3.72Å; I329-I519 HydrophobicContact CD1-CD1 4.1Å; I329-I519 HydrophobicContact CD1-CG1 4.38Å; I329-I519 HydrophobicContact CD1-CG2 3.72Å; I329-I519 HydrophobicContact CG1-CD1 4.33Å; I329-L520 HydrophobicContact CD1-CD2 3.85Å; I329-L520 HydrophobicContact CD1-CG 4.19Å
330	S	70.6	Confident	81.2	Confident	51 Å²	51	46.5 Å²	46.5	36%	0.357	28%	0.277	S	S	.	.			trans	-71.4	158.5	168.3	65.5	0	0	0	0	111.2	D328 T332 G333	D328-S330 PolarHBondContact O-N 3.49Å; S330-T332 PolarHBondContact O-N 3.09Å; S330-T332 PolarHBondContact OG-OG1 3.4Å; S330-G333 PolarHBondContact O-N 3.44Å; S330-G333 PolarHBondContact OG-N 3.23Å
331	L	61	Low	80.9	Confident	88 Å²	88	46.6 Å²	46.6	46%	0.461	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-35.6	173.2	-97	102	0	0	0	111.2	G333 K418 E422 M455	L331-G333 PolarHBondContact O-N 3.39Å; L331-G333 VanDerWaalsContact O-N 3.17Å; L331-K418 WeakPolarHBondContact O-CE 3.36Å; L331-K418 PolarHBondContact O-NZ 2.92Å; L331-E422 HydrophobicContact CB-CG 4.16Å; L331-E422 WeakPolarHBondContact CB-OE1 3.44Å; L331-M455 HydrophobicContact CD2-CE 4.33Å
332	T	56	Low	80.7	Confident	18 Å²	18	46.6 Å²	46.6	11%	0.11	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-15.7	174.2	34.1	0	0	0	0	113.3	S330 L384 H385 K418 E422	S330-T332 PolarHBondContact O-N 3.09Å; S330-T332 PolarHBondContact OG-OG1 3.4Å; T332-L384 HydrophobicContact CG2-CD1 4.29Å; T332-H385 PolarHBondContact O-CE1 3.24Å; T332-H385 PolarHBondContact O-ND1 3.06Å; T332-K418 VanDerWaalsContact CA-CE 3.46Å; T332-K418 HydrophobicContact CG2-CD 4.34Å; T332-K418 HydrophobicContact CG2-CG 4.36Å; T332-E422 WeakPolarHBondContact CB-OE2 3.24Å; T332-E422 VanDerWaalsContact CG2-CD 3.46Å; T332-E422 WeakPolarHBondContact CG2-OE1 3.45Å; T332-E422 WeakPolarHBondContact CG2-OE2 3.35Å; T332-E422 VanDerWaalsContact N-CD 3.26Å; T332-E422 PolarHBondContact N-OE1 3.12Å; T332-E422 PolarHBondContact N-OE2 3.05Å; T332-E422 PolarHBondContact OG1-OE2 3.49Å
333	G	61.6	Low	80.3	Confident	24 Å²	24	46.8 Å²	46.8	25%	0.247	27%	0.273	C	S	.	.			trans	74.2	140.2	-170.3	0	0	0	0	0	110.5	S330 L331	S330-G333 PolarHBondContact O-N 3.44Å; S330-G333 PolarHBondContact OG-N 3.23Å; L331-G333 PolarHBondContact O-N 3.39Å; L331-G333 VanDerWaalsContact O-N 3.17Å
334	G	64.1	Low	79.9	Confident	49 Å²	49	45.4 Å²	45.4	51%	0.505	27%	0.266	S	S	.	.			trans	-69.5	-177.1	175.6	0	0	0	0	0	112.9	V336	G334-V336 PolarHBondContact O-N 3.48Å
335	S	67.8	Low	79.3	Confident	60 Å²	60	42.9 Å²	42.9	42%	0.42	25%	0.254	S	S	.	.			trans	-56.3	128	174.5	49.3	0	0	0	0	111.4	V337 H385	S335-V337 PolarHBondContact O-N 3.16Å; S335-V337 VanDerWaalsContact O-N 3.13Å; S335-H385 WeakPolarHBondContact CA-O 3.05Å
336	V	72.8	Confident	78.8	Confident	86 Å²	86	46.6 Å²	46.6	52%	0.521	28%	0.276	S	S	.	.			trans	-79.1	104.1	-179.6	179.5	0	0	0	0	108.8	G334 H385 G386	G334-V336 PolarHBondContact O-N 3.48Å; V336-H385 HydrophobicContact CG2-CB 4.06Å; V336-G386 WeakPolarHBondContact CB-O 3.01Å; V336-G386 PolarHBondContact N-O 3.36Å
337	V	79.1	Confident	78.1	Confident	31 Å²	31	50.8 Å²	50.8	19%	0.188	29%	0.293	C	S	.	.			trans	-82.2	126.8	175.3	176.6	0	0	0	0	110.1	S335 S556 L559 M560	S335-V337 PolarHBondContact O-N 3.16Å; S335-V337 VanDerWaalsContact O-N 3.13Å; V337-S556 WeakPolarHBondContact CG1-O 3.45Å; V337-S556 WeakPolarHBondContact CG2-OG 3.09Å; V337-L559 HydrophobicContact CG1-CB 4.14Å; V337-L559 HydrophobicContact CG1-CD1 4.08Å; V337-M560 HydrophobicContact CG1-CG 4.31Å
338	Q	80.4	Confident	77.3	Confident	34 Å²	34	50.2 Å²	50.2	16%	0.159	28%	0.283	C	S	.	.			trans	-90.9	139.8	175.2	-61.6	-176.1	-54.6	0	0	110.8	I340 G354 R388 M560	Q338-I340 HydrophobicContact CB-CD1 4.43Å; Q338-I340 HydrophobicContact CB-CG1 4.1Å; Q338-G354 PolarHBondContact NE2-O 2.84Å; Q338-G354 PolarHBondContact OE1-O 3.27Å; Q338-R388 VanDerWaalsContact OE1-CA 3.28Å; Q338-M560 HydrophobicContact CB-SD 3.9Å
339	R	86.8	Confident	76.2	Confident	89 Å²	89	52.4 Å²	52.4	34%	0.336	30%	0.301	S	S	.	.			trans	-102.3	89.4	177.5	-62.9	-179.3	-179.2	131.7	-0.7	108	E551 L559 V588	R339-E551 PolarHBondContact NH2-O 2.94Å; R339-L559 HydrophobicContact CG-CD1 4.18Å; R339-V588 HydrophobicContact CB-CG1 4.46Å; R339-V588 HydrophobicContact CB-CG2 4.09Å
340	I	87.1	Confident	75	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.082	32%	0.32	C	S	.	.			trans	-93.9	124	-177.1	-52.5	174.6	0	0	0	108.7	Q338 M355 M560 Y563 V588 N592	Q338-I340 HydrophobicContact CB-CD1 4.43Å; Q338-I340 HydrophobicContact CB-CG1 4.1Å; I340-M355 HydrophobicContact CD1-CG 4.21Å; I340-M560 HydrophobicContact CD1-CE 4.33Å; I340-Y563 HydrophobicContact CB-CD2 4.2Å; I340-Y563 HydrophobicContact CB-CE2 4.25Å; I340-Y563 HydrophobicContact CD1-CD1 4.36Å; I340-Y563 HydrophobicContact CD1-CD2 4.12Å; I340-Y563 HydrophobicContact CD1-CE1 4.28Å; I340-Y563 HydrophobicContact CD1-CE2 3.98Å; I340-Y563 HydrophobicContact CD1-CG 4.26Å; I340-Y563 HydrophobicContact CG2-CD2 4.08Å; I340-Y563 HydrophobicContact CG2-CE2 3.67Å; I340-V588 WeakPolarHBondContact O-CG1 3.28Å; I340-N592 PolarHBondContact O-ND2 2.95Å
341	R	91.2	Very high	74.1	Confident	79 Å²	79	58.9 Å²	58.9	30%	0.298	34%	0.343	S	S	.	.			trans	-90.2	120.9	170.6	-67.6	-169.1	-169	86.1	5.4	108.8	D344 E345 E587 V588 N592 Y626	R341-D344 HydrophobicContact CB-CB 4.18Å; R341-D344 WeakPolarHBondContact CB-OD2 3.19Å; R341-D344 WeakPolarHBondContact CD-OD2 3.33Å; R341-D344 IonicContact NH1-OD2 3.62Å; R341-D344 PolarHBondContact O-N 2.71Å; R341-E345 PolarHBondContact O-N 2.89Å; R341-E587 IonicContact CZ-OE2 3.37Å; R341-E587 IonicContact NE-OE1 2.71Å; R341-E587 PolarHBondContact NE-OE1 3.04Å; R341-E587 IonicContact NE-OE2 3.02Å; R341-E587 PolarHBondContact NE-OE2 3.41Å; R341-E587 IonicContact NH2-OE2 2.98Å; R341-E587 PolarHBondContact NH2-OE2 2.81Å; R341-V588 HydrophobicContact CG-CB 4.42Å; R341-V588 HydrophobicContact CG-CG1 3.97Å; R341-V588 HydrophobicContact CG-CG2 3.99Å; R341-N592 WeakPolarHBondContact CA-OD1 3.27Å; R341-Y626 VanDerWaalsContact CD-CE2 3.48Å
342	L	90.9	Very high	73.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-41.9	178.9	-60.1	177.1	0	0	0	112.9	D344 E345 V346 Y563 Y566 Y578 N592 F595 I596	L342-D344 VanDerWaalsContact C-N 3.33Å; L342-D344 PolarHBondContact O-N 2.68Å; L342-E345 PolarHBondContact O-N 3.25Å; L342-V346 PolarHBondContact O-N 3.45Å; L342-Y563 HydrophobicContact CD2-CD2 3.73Å; L342-Y563 HydrophobicContact CD2-CE2 3.93Å; L342-Y566 HydrophobicContact CD1-CD1 4.11Å; L342-Y566 HydrophobicContact CD1-CD2 3.95Å; L342-Y566 HydrophobicContact CD1-CE1 4.25Å; L342-Y566 HydrophobicContact CD1-CE2 4.12Å; L342-Y566 HydrophobicContact CD1-CG 3.97Å; L342-Y566 HydrophobicContact CD2-CD1 3.61Å; L342-Y566 HydrophobicContact CD2-CE1 3.83Å; L342-Y566 HydrophobicContact CD2-CG 4.2Å; L342-Y566 HydrophobicContact CG-CD1 4.48Å; L342-Y578 HydrophobicContact CD1-CE2 4Å; L342-N592 HydrophobicContact CD1-CB 3.95Å; L342-N592 HydrophobicContact CG-CB 4.14Å; L342-N592 PolarHBondContact N-OD1 2.72Å; L342-F595 HydrophobicContact CB-CD1 3.72Å; L342-F595 HydrophobicContact CB-CE1 3.96Å; L342-F595 HydrophobicContact CD1-CD1 4.36Å; L342-I596 HydrophobicContact CD1-CD1 3.76Å; L342-I596 HydrophobicContact CD1-CG1 3.82Å
343	P	88.3	Confident	73.7	Confident	4 Å²	4	60.9 Å²	60.9	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-57.4	-44.8	177.4	-23.3	31.9	0	0	0	113	E345 V346 E347 F595 W618	P343-E345 VanDerWaalsContact C-N 3.28Å; P343-E345 PolarHBondContact O-N 2.92Å; P343-V346 PolarHBondContact O-N 2.91Å; P343-E347 PolarHBondContact O-N 3.16Å; P343-E347 VanDerWaalsContact O-N 3.13Å; P343-F595 HydrophobicContact CB-CD2 4.11Å; P343-F595 HydrophobicContact CB-CE2 4.28Å; P343-F595 HydrophobicContact CG-CB 3.94Å; P343-F595 HydrophobicContact CG-CD2 3.7Å; P343-F595 HydrophobicContact CG-CE2 4.31Å; P343-F595 HydrophobicContact CG-CG 3.85Å; P343-W618 HydrophobicContact CG-CH2 4.05Å
344	D	85.9	Confident	73.5	Confident	40 Å²	40	60.5 Å²	60.5	21%	0.214	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-33.9	-177.4	-62.8	-12.1	0	0	0	111.9	R341 L342 N348 Y626	R341-D344 HydrophobicContact CB-CB 4.18Å; R341-D344 WeakPolarHBondContact CB-OD2 3.19Å; R341-D344 WeakPolarHBondContact CD-OD2 3.33Å; R341-D344 IonicContact NH1-OD2 3.62Å; R341-D344 PolarHBondContact O-N 2.71Å; L342-D344 VanDerWaalsContact C-N 3.33Å; L342-D344 PolarHBondContact O-N 2.68Å; D344-N348 PolarHBondContact O-N 2.91Å; D344-N348 VanDerWaalsContact O-N 3.1Å; D344-Y626 PolarHBondContact OD1-OH 2.95Å
345	E	83.1	Confident	73.5	Confident	23 Å²	23	60.6 Å²	60.6	11%	0.107	34%	0.34	C	S	.	.	H	α-helix	trans	-72.8	-39.3	179.6	-165.4	-171.3	179.4	0	0	112.1	R341 L342 P343 N348 S353 Y563 K567	R341-E345 PolarHBondContact O-N 2.89Å; L342-E345 PolarHBondContact O-N 3.25Å; P343-E345 VanDerWaalsContact C-N 3.28Å; P343-E345 PolarHBondContact O-N 2.92Å; E345-N348 CarbonylContact O-C 3.13Å; E345-N348 PolarHBondContact O-N 3.33Å; E345-S353 PolarHBondContact OE1-OG 3.4Å; E345-Y563 PolarHBondContact OE1-OH 3.37Å; E345-Y563 VanDerWaalsContact OE1-OH 3.09Å; E345-Y563 WeakPolarHBondContact OE2-CE2 3.39Å; E345-Y563 PolarHBondContact OE2-OH 2.84Å; E345-K567 WeakPolarHBondContact OE1-CE 3.35Å; E345-K567 IonicContact OE1-NZ 2.79Å; E345-K567 PolarHBondContact OE1-NZ 3.24Å; E345-K567 IonicContact OE2-NZ 3.03Å; E345-K567 PolarHBondContact OE2-NZ 2.83Å
346	V	82.4	Confident	73.4	Confident	82 Å²	82	59.3 Å²	59.3	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-69.2	-36.2	178.6	174.4	0	0	0	0	111.2	L342 P343 F595	L342-V346 PolarHBondContact O-N 3.45Å; P343-V346 PolarHBondContact O-N 2.91Å; V346-F595 HydrophobicContact CB-CZ 4.27Å; V346-F595 HydrophobicContact CG2-CE1 4.24Å; V346-F595 HydrophobicContact CG2-CZ 3.88Å
347	E	76.3	Confident	73.3	Confident	106 Å²	106	61 Å²	61	50%	0.495	33%	0.331	S	S	.	.	H	α-helix	trans	-72.9	-35.2	176.3	-70.3	-180	-177.1	0	0	112.5	P343	P343-E347 PolarHBondContact O-N 3.16Å; P343-E347 VanDerWaalsContact O-N 3.13Å
348	N	72.4	Confident	73	Confident	72 Å²	72	66.2 Å²	66.2	39%	0.385	35%	0.353	S	S	.	.	S	Bend	trans	-128.3	69.9	-177.2	-67.5	-64	0	0	0	113.2	D344 E345 G350	D344-N348 PolarHBondContact O-N 2.91Å; D344-N348 VanDerWaalsContact O-N 3.1Å; E345-N348 CarbonylContact O-C 3.13Å; E345-N348 PolarHBondContact O-N 3.33Å; N348-G350 PolarHBondContact O-N 2.87Å; N348-G350 VanDerWaalsContact O-N 3.08Å
349	P	61.8	Low	73	Confident	108 Å²	108	70.1 Å²	70.1	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	111.3	177	25.3	-31.1	0	0	0	110.1
350	G	55.5	Low	72.8	Confident	59 Å²	59	69 Å²	69	61%	0.608	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.9	-19.7	169.1	0	0	0	0	0	116.8	N348	N348-G350 PolarHBondContact O-N 2.87Å; N348-G350 VanDerWaalsContact O-N 3.08Å
351	M	52.3	Low	72.7	Confident	169 Å²	169	69.5 Å²	69.5	83%	0.833	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-25.8	179.2	-137.2	153	72.4	0	0	113.2
352	N	53	Low	72.5	Confident	106 Å²	106	70.5 Å²	70.5	57%	0.567	39%	0.386	S	S	*	.	S	Bend	trans	-124.6	15.1	-177.9	-76	-19.5	0	0	0	113.6	G354	N352-G354 PolarHBondContact O-N 3.5Å
353	S	55.9	Low	72.4	Confident	41 Å²	41	76.6 Å²	76.6	29%	0.287	41%	0.41	S	S	.	.			trans	-61.7	119	177.9	-165.8	0	0	0	0	108.9	E345 M355	E345-S353 PolarHBondContact OE1-OG 3.4Å; S353-M355 PolarHBondContact O-N 2.94Å
354	G	57.2	Low	72.5	Confident	17 Å²	17	81.2 Å²	81.2	18%	0.175	43%	0.428	C	S	.	.	S	Bend	trans	-64	-30	-176.7	0	0	0	0	0	111.8	Q338 N352	Q338-G354 PolarHBondContact NE2-O 2.84Å; Q338-G354 PolarHBondContact OE1-O 3.27Å; N352-G354 PolarHBondContact O-N 3.5Å
355	M	64.4	Low	72.7	Confident	50 Å²	50	81.6 Å²	81.6	25%	0.246	43%	0.428	C	S	.	.	S	Bend	trans	-87.8	142.9	178.1	-71.4	-176.7	68.8	0	0	111.7	I340 S353 E357 G389 M560 Y563	I340-M355 HydrophobicContact CD1-CG 4.21Å; S353-M355 PolarHBondContact O-N 2.94Å; M355-E357 PolarHBondContact O-N 3.4Å; M355-G389 VanDerWaalsContact CE-CA 3.47Å; M355-M560 HydrophobicContact CG-CE 4.4Å; M355-M560 HydrophobicContact SD-CE 4.49Å; M355-Y563 HydrophobicContact CG-CE1 4.11Å; M355-Y563 HydrophobicContact SD-CD1 3.77Å; M355-Y563 HydrophobicContact SD-CE1 3.22Å; M355-Y563 WeakPolarHBondContact SD-CE1 3.45Å
356	L	64.3	Low	73.2	Confident	34 Å²	34	85.1 Å²	85.1	18%	0.178	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-68.9	128.7	164.4	-75.3	161.7	0	0	0	106.8	L360 I361 L382 R388	L356-L360 HydrophobicContact CD2-CD2 3.36Å; L356-L360 HydrophobicContact CD2-CG 3.98Å; L356-I361 HydrophobicContact CB-CD1 4.03Å; L356-I361 HydrophobicContact CB-CG1 3.92Å; L356-I361 HydrophobicContact CD1-CG1 4.27Å; L356-L382 HydrophobicContact CD1-CD1 4.31Å; L356-L382 HydrophobicContact CD1-CD2 3.76Å; L356-R388 HydrophobicContact CB-CB 4.07Å; L356-R388 HydrophobicContact CD1-CB 3.6Å; L356-R388 HydrophobicContact CD1-CG 4.04Å; L356-R388 HydrophobicContact CG-CB 3.62Å; L356-R388 VanDerWaalsContact CG-CD 3.49Å; L356-R388 HydrophobicContact CG-CG 4.14Å; L356-R388 PolarHBondContact N-O 2.94Å
357	E	70.3	Confident	73.8	Confident	121 Å²	121	82.9 Å²	82.9	57%	0.565	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-59.1	142.5	167.9	-66.5	177.4	178.3	0	0	109.3	M355 D359 L360 I361	M355-E357 PolarHBondContact O-N 3.4Å; E357-D359 PolarHBondContact O-N 3.37Å; E357-L360 WeakPolarHBondContact O-CB 3.44Å; E357-L360 PolarHBondContact O-N 3.23Å; E357-I361 PolarHBondContact O-N 2.87Å
358	E	74.5	Confident	74.6	Confident	141 Å²	141	78 Å²	78	66%	0.659	41%	0.406	S	S	*	.	H	α-helix	trans	-56.6	-37.7	-178.6	-170.6	172.4	177.3	0	0	111.5	L360 I361 Q362	E358-L360 VanDerWaalsContact C-N 3.27Å; E358-L360 PolarHBondContact O-N 3.21Å; E358-I361 WeakPolarHBondContact O-CB 2.9Å; E358-I361 PolarHBondContact O-N 3.49Å; E358-I361 VanDerWaalsContact O-N 3.14Å; E358-Q362 WeakPolarHBondContact O-CG 3.36Å; E358-Q362 PolarHBondContact O-N 3.42Å
359	D	78.9	Confident	75.4	Confident	116 Å²	116	81.7 Å²	81.7	62%	0.62	42%	0.421	S	S	*	.	H	α-helix	trans	-59.3	-36.9	176.2	-64.5	-7.9	0	0	0	112.3	E357 Q362 Y363	E357-D359 PolarHBondContact O-N 3.37Å; D359-Q362 PolarHBondContact O-N 3.04Å; D359-Y363 WeakPolarHBondContact O-CB 3.49Å; D359-Y363 PolarHBondContact O-N 3.23Å
360	L	83.1	Confident	76.9	Confident	66 Å²	66	83.8 Å²	83.8	35%	0.346	42%	0.419	S	S	.	.	H	α-helix	trans	-71.9	-36.8	178.2	-176.3	55.7	0	0	0	111.4	L356 E357 E358 Y363 Y364	L356-L360 HydrophobicContact CD2-CD2 3.36Å; L356-L360 HydrophobicContact CD2-CG 3.98Å; E357-L360 WeakPolarHBondContact O-CB 3.44Å; E357-L360 PolarHBondContact O-N 3.23Å; E358-L360 VanDerWaalsContact C-N 3.27Å; E358-L360 PolarHBondContact O-N 3.21Å; L360-Y363 HydrophobicContact CD1-CD1 4.32Å; L360-Y363 PolarHBondContact O-N 3.09Å; L360-Y364 HydrophobicContact CD1-CD2 4.01Å; L360-Y364 HydrophobicContact CD1-CE2 3.57Å; L360-Y364 HydrophobicContact CD2-CE2 4.36Å; L360-Y364 HydrophobicContact CG-CD2 4.04Å; L360-Y364 HydrophobicContact CG-CE2 3.75Å; L360-Y364 WeakPolarHBondContact O-CD2 3.39Å; L360-Y364 PolarHBondContact O-N 3.08Å
361	I	85.1	Confident	78.6	Confident	25 Å²	25	83 Å²	83	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-64.3	-45.7	174.2	-63.8	158.7	0	0	0	110	L356 E357 E358 Y363 Y364 Q365 V390	L356-I361 HydrophobicContact CB-CD1 4.03Å; L356-I361 HydrophobicContact CB-CG1 3.92Å; L356-I361 HydrophobicContact CD1-CG1 4.27Å; E357-I361 PolarHBondContact O-N 2.87Å; E358-I361 WeakPolarHBondContact O-CB 2.9Å; E358-I361 PolarHBondContact O-N 3.49Å; E358-I361 VanDerWaalsContact O-N 3.14Å; I361-Y363 VanDerWaalsContact C-N 3.3Å; I361-Y363 PolarHBondContact O-N 3.46Å; I361-Y364 PolarHBondContact O-N 3.41Å; I361-Q365 WeakPolarHBondContact O-CG 3.22Å; I361-Q365 PolarHBondContact O-N 3.01Å; I361-V390 HydrophobicContact CD1-CG2 3.36Å; I361-V390 HydrophobicContact CG1-CG2 3.94Å
362	Q	86.8	Confident	80.7	Confident	100 Å²	100	78 Å²	78	47%	0.467	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-40.5	176.3	-69	179.6	17.1	0	0	111.7	E358 D359 Q365 F366	E358-Q362 WeakPolarHBondContact O-CG 3.36Å; E358-Q362 PolarHBondContact O-N 3.42Å; D359-Q362 PolarHBondContact O-N 3.04Å; Q362-Q365 PolarHBondContact O-N 3.04Å; Q362-F366 PolarHBondContact O-N 3.41Å
363	Y	88.9	Confident	82.6	Confident	129 Å²	129	74.6 Å²	74.6	51%	0.506	37%	0.371	S	S	.	.	H	α-helix	trans	-60.6	-45.7	174.9	177.2	-106	0	0	0	112.4	D359 L360 I361 Q365 F366 L367	D359-Y363 WeakPolarHBondContact O-CB 3.49Å; D359-Y363 PolarHBondContact O-N 3.23Å; L360-Y363 HydrophobicContact CD1-CD1 4.32Å; L360-Y363 PolarHBondContact O-N 3.09Å; I361-Y363 VanDerWaalsContact C-N 3.3Å; I361-Y363 PolarHBondContact O-N 3.46Å; Y363-Q365 VanDerWaalsContact C-N 3.34Å; Y363-Q365 PolarHBondContact O-N 3.15Å; Y363-F366 WeakPolarHBondContact O-CB 3.36Å; Y363-F366 PolarHBondContact O-N 2.98Å; Y363-L367 HydrophobicContact CD1-CD1 4.08Å; Y363-L367 HydrophobicContact CE1-CD1 3.48Å; Y363-L367 VanDerWaalsContact CE1-CD1 3.48Å; Y363-L367 HydrophobicContact CE1-CG 4.2Å; Y363-L367 HydrophobicContact CE2-CG 4.47Å; Y363-L367 WeakPolarHBondContact O-CG 3.39Å; Y363-L367 PolarHBondContact O-N 3.46Å
364	Y	90	Very high	84.4	Confident	101 Å²	101	78.6 Å²	78.6	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-65.1	-36.9	175.6	-80	-63.9	0	0	0	112.7	L360 I361 F366 L367 A368 A375	L360-Y364 HydrophobicContact CD1-CD2 4.01Å; L360-Y364 HydrophobicContact CD1-CE2 3.57Å; L360-Y364 HydrophobicContact CD2-CE2 4.36Å; L360-Y364 HydrophobicContact CG-CD2 4.04Å; L360-Y364 HydrophobicContact CG-CE2 3.75Å; L360-Y364 WeakPolarHBondContact O-CD2 3.39Å; L360-Y364 PolarHBondContact O-N 3.08Å; I361-Y364 PolarHBondContact O-N 3.41Å; Y364-F366 VanDerWaalsContact C-N 3.35Å; Y364-L367 HydrophobicContact CD1-CD1 4.3Å; Y364-L367 PolarHBondContact O-N 2.92Å; Y364-A368 WeakPolarHBondContact O-CB 3.43Å; Y364-A368 PolarHBondContact O-N 3.43Å; Y364-A375 HydrophobicContact CD1-CB 4.33Å
365	Q	91.4	Very high	86.1	Confident	47 Å²	47	78 Å²	78	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-61.3	-46.1	175.3	-74.6	172.2	-6.8	0	0	110.8	I361 Q362 Y363 L367 A368 E369 L379	I361-Q365 WeakPolarHBondContact O-CG 3.22Å; I361-Q365 PolarHBondContact O-N 3.01Å; Q362-Q365 PolarHBondContact O-N 3.04Å; Y363-Q365 VanDerWaalsContact C-N 3.34Å; Y363-Q365 PolarHBondContact O-N 3.15Å; Q365-L367 VanDerWaalsContact C-N 3.33Å; Q365-L367 PolarHBondContact O-N 3.35Å; Q365-A368 PolarHBondContact O-N 3.36Å; Q365-E369 WeakPolarHBondContact O-CG 3.29Å; Q365-E369 PolarHBondContact O-N 3.35Å; Q365-L379 HydrophobicContact CB-CD1 4.42Å; Q365-L379 HydrophobicContact CG-CD1 3.92Å; Q365-L379 HydrophobicContact CG-CD2 4.5Å
366	F	92.8	Very high	87.5	Confident	98 Å²	98	76.2 Å²	76.2	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-40.6	175.2	175	-104.9	0	0	0	113	Q362 Y363 Y364 E369 K370	Q362-F366 PolarHBondContact O-N 3.41Å; Y363-F366 WeakPolarHBondContact O-CB 3.36Å; Y363-F366 PolarHBondContact O-N 2.98Å; Y364-F366 VanDerWaalsContact C-N 3.35Å; F366-E369 PolarHBondContact O-N 3.07Å; F366-K370 HydrophobicContact CD1-CD 4.31Å; F366-K370 HydrophobicContact CE1-CD 3.77Å; F366-K370 VanDerWaalsContact CE1-NZ 3.3Å; F366-K370 HydrophobicContact CE2-CD 4.42Å; F366-K370 HydrophobicContact CZ-CD 3.87Å; F366-K370 PolarHBondContact O-N 3.2Å
367	L	93.9	Very high	88.9	Confident	35 Å²	35	75 Å²	75	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-63.8	-43.9	174.4	-71	179.4	0	0	0	111.9	Y363 Y364 Q365 E369 K370 G371 D372 A375	Y363-L367 HydrophobicContact CD1-CD1 4.08Å; Y363-L367 HydrophobicContact CE1-CD1 3.48Å; Y363-L367 VanDerWaalsContact CE1-CD1 3.48Å; Y363-L367 HydrophobicContact CE1-CG 4.2Å; Y363-L367 HydrophobicContact CE2-CG 4.47Å; Y363-L367 WeakPolarHBondContact O-CG 3.39Å; Y363-L367 PolarHBondContact O-N 3.46Å; Y364-L367 HydrophobicContact CD1-CD1 4.3Å; Y364-L367 PolarHBondContact O-N 2.92Å; Q365-L367 VanDerWaalsContact C-N 3.33Å; Q365-L367 PolarHBondContact O-N 3.35Å; L367-E369 VanDerWaalsContact C-N 3.33Å; L367-E369 PolarHBondContact O-N 3.49Å; L367-K370 PolarHBondContact O-N 2.65Å; L367-G371 PolarHBondContact O-N 2.81Å; L367-D372 HydrophobicContact CB-CB 4.12Å; L367-D372 VanDerWaalsContact O-CB 3.3Å; L367-D372 WeakPolarHBondContact O-CB 3.19Å; L367-D372 PolarHBondContact O-N 2.84Å; L367-A375 HydrophobicContact CB-CB 3.78Å
368	A	93.4	Very high	89.9	Confident	3 Å²	3	70.8 Å²	70.8	3%	0.025	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-39.2	178.3	0	0	0	0	0	112.1	Y364 Q365 K370 G371 A375 Q376 L379 Y400	Y364-A368 WeakPolarHBondContact O-CB 3.43Å; Y364-A368 PolarHBondContact O-N 3.43Å; Q365-A368 PolarHBondContact O-N 3.36Å; A368-K370 VanDerWaalsContact C-N 3.35Å; A368-G371 PolarHBondContact O-N 3.47Å; A368-G371 VanDerWaalsContact O-N 3.11Å; A368-A375 HydrophobicContact CB-CB 4.16Å; A368-Q376 HydrophobicContact CB-CG 3.74Å; A368-Q376 PolarHBondContact O-NE2 3.5Å; A368-L379 HydrophobicContact CB-CD1 3.79Å; A368-Y400 HydrophobicContact CB-CD1 4.45Å; A368-Y400 HydrophobicContact CB-CE1 4.1Å
369	E	90.9	Very high	90.7	Very high	150 Å²	150	64.2 Å²	64.2	70%	0.701	32%	0.322	S	S	*	.	H	α-helix	trans	-65.8	-35.2	174.3	-73.9	176.2	-175	0	0	112.6	Q365 F366 L367 G371	Q365-E369 WeakPolarHBondContact O-CG 3.29Å; Q365-E369 PolarHBondContact O-N 3.35Å; F366-E369 PolarHBondContact O-N 3.07Å; L367-E369 VanDerWaalsContact C-N 3.33Å; L367-E369 PolarHBondContact O-N 3.49Å; E369-G371 PolarHBondContact O-N 2.97Å
370	K	92.8	Very high	91.3	Very high	151 Å²	151	58.7 Å²	58.7	66%	0.657	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.5	172.2	-80.2	-173.8	165.8	179.5	0	114.2	F366 L367 A368	F366-K370 HydrophobicContact CD1-CD 4.31Å; F366-K370 HydrophobicContact CE1-CD 3.77Å; F366-K370 VanDerWaalsContact CE1-NZ 3.3Å; F366-K370 HydrophobicContact CE2-CD 4.42Å; F366-K370 HydrophobicContact CZ-CD 3.87Å; F366-K370 PolarHBondContact O-N 3.2Å; L367-K370 PolarHBondContact O-N 2.65Å; A368-K370 VanDerWaalsContact C-N 3.35Å
371	G	91.4	Very high	91.6	Very high	42 Å²	42	58.8 Å²	58.8	43%	0.433	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	17	179.1	0	0	0	0	0	114.4	L367 A368 E369 V373	L367-G371 PolarHBondContact O-N 2.81Å; A368-G371 PolarHBondContact O-N 3.47Å; A368-G371 VanDerWaalsContact O-N 3.11Å; E369-G371 PolarHBondContact O-N 2.97Å; G371-V373 PolarHBondContact O-N 3.02Å; G371-V373 VanDerWaalsContact O-N 3.09Å
372	D	95.3	Very high	91.8	Very high	64 Å²	64	58.8 Å²	58.8	34%	0.342	29%	0.291	S	S	.	.			trans	-69.4	106.3	169.3	-175.8	-5	0	0	0	110.1	L367 Q374 A375 Q376	L367-D372 HydrophobicContact CB-CB 4.12Å; L367-D372 VanDerWaalsContact O-CB 3.3Å; L367-D372 WeakPolarHBondContact O-CB 3.19Å; L367-D372 PolarHBondContact O-N 2.84Å; D372-Q374 VanDerWaalsContact C-N 3.28Å; D372-Q374 PolarHBondContact O-N 3.27Å; D372-Q374 PolarHBondContact OD1-N 2.86Å; D372-A375 HydrophobicContact CB-CB 3.93Å; D372-A375 PolarHBondContact O-N 3.39Å; D372-A375 PolarHBondContact OD1-N 3.01Å; D372-Q376 WeakPolarHBondContact O-CG 3.18Å; D372-Q376 PolarHBondContact O-N 3.23Å
373	V	94.1	Very high	91.8	Very high	36 Å²	36	54.4 Å²	54.4	22%	0.218	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-33.3	-178.5	-177.7	0	0	0	0	112	G371 Q376 V377 A404 A407 N409	G371-V373 PolarHBondContact O-N 3.02Å; G371-V373 VanDerWaalsContact O-N 3.09Å; V373-Q376 PolarHBondContact O-N 2.98Å; V373-V377 WeakPolarHBondContact O-CG2 3.28Å; V373-V377 PolarHBondContact O-N 3.25Å; V373-A404 HydrophobicContact CG1-CB 3.99Å; V373-A407 HydrophobicContact CG1-CB 4.43Å; V373-A407 HydrophobicContact CG2-CB 3.59Å; V373-N409 HydrophobicContact CG1-CB 3.5Å; V373-N409 WeakPolarHBondContact CG1-ND2 3.38Å
374	Q	93.1	Very high	91.8	Very high	125 Å²	125	48.3 Å²	48.3	58%	0.584	25%	0.247	S	C	*	.	H	α-helix	trans	-72	-40.7	178.8	-64.8	-60.9	-29.5	0	0	111	D372 Q376 V377 G378	D372-Q374 VanDerWaalsContact C-N 3.28Å; D372-Q374 PolarHBondContact O-N 3.27Å; D372-Q374 PolarHBondContact OD1-N 2.86Å; Q374-Q376 VanDerWaalsContact C-N 3.33Å; Q374-Q376 PolarHBondContact O-N 3.49Å; Q374-V377 PolarHBondContact O-N 3.39Å; Q374-G378 PolarHBondContact O-N 3.22Å
375	A	92.9	Very high	91.4	Very high	5 Å²	5	45.6 Å²	45.6	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-41.1	173.4	0	0	0	0	0	111.5	Y364 L367 A368 D372 G378 L379	Y364-A375 HydrophobicContact CD1-CB 4.33Å; L367-A375 HydrophobicContact CB-CB 3.78Å; A368-A375 HydrophobicContact CB-CB 4.16Å; D372-A375 HydrophobicContact CB-CB 3.93Å; D372-A375 PolarHBondContact O-N 3.39Å; D372-A375 PolarHBondContact OD1-N 3.01Å; A375-G378 PolarHBondContact O-N 2.78Å; A375-L379 WeakPolarHBondContact O-CB 3.24Å; A375-L379 WeakPolarHBondContact O-CG 3.49Å; A375-L379 PolarHBondContact O-N 3.23Å
376	Q	94.4	Very high	90.9	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.056	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-48.3	174.2	-70.6	169	-1	0	0	111.9	A368 D372 V373 Q374 G380 Y400 A404	A368-Q376 HydrophobicContact CB-CG 3.74Å; A368-Q376 PolarHBondContact O-NE2 3.5Å; D372-Q376 WeakPolarHBondContact O-CG 3.18Å; D372-Q376 PolarHBondContact O-N 3.23Å; V373-Q376 PolarHBondContact O-N 2.98Å; Q374-Q376 VanDerWaalsContact C-N 3.33Å; Q374-Q376 PolarHBondContact O-N 3.49Å; Q376-G380 PolarHBondContact O-N 2.74Å; Q376-Y400 HydrophobicContact CG-CD1 4.49Å; Q376-Y400 WeakPolarHBondContact O-CB 3.35Å; Q376-A404 HydrophobicContact CB-CB 3.95Å
377	V	93.1	Very high	90	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-64	-43	177.4	174.8	0	0	0	0	111.5	V373 Q374 G380 Q381 A404 N409 H411 A412	V373-V377 WeakPolarHBondContact O-CG2 3.28Å; V373-V377 PolarHBondContact O-N 3.25Å; Q374-V377 PolarHBondContact O-N 3.39Å; V377-G380 PolarHBondContact O-N 3.39Å; V377-Q381 WeakPolarHBondContact O-CG 3.48Å; V377-Q381 PolarHBondContact O-N 2.88Å; V377-A404 HydrophobicContact CG2-CB 3.72Å; V377-N409 HydrophobicContact CG2-CB 4.45Å; V377-H411 HydrophobicContact CG1-CB 4.14Å; V377-A412 HydrophobicContact CG2-CB 3.96Å
378	G	91.3	Very high	89	Confident	33 Å²	33	44.3 Å²	44.3	34%	0.34	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-47	179.5	0	0	0	0	0	112.7	Q374 A375 Q381 L382	Q374-G378 PolarHBondContact O-N 3.22Å; A375-G378 PolarHBondContact O-N 2.78Å; G378-Q381 PolarHBondContact O-N 3.44Å; G378-L382 WeakPolarHBondContact O-CB 3.49Å; G378-L382 PolarHBondContact O-N 3.21Å
379	L	90.7	Very high	87.9	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-37.9	174.8	-73.4	175.8	0	0	0	112.2	Q365 A368 A375 Q381 L382 H383 Y400	Q365-L379 HydrophobicContact CB-CD1 4.42Å; Q365-L379 HydrophobicContact CG-CD1 3.92Å; Q365-L379 HydrophobicContact CG-CD2 4.5Å; A368-L379 HydrophobicContact CB-CD1 3.79Å; A375-L379 WeakPolarHBondContact O-CB 3.24Å; A375-L379 WeakPolarHBondContact O-CG 3.49Å; A375-L379 PolarHBondContact O-N 3.23Å; L379-Q381 VanDerWaalsContact C-N 3.34Å; L379-Q381 PolarHBondContact O-N 3.18Å; L379-L382 HydrophobicContact CD2-CD2 4.38Å; L379-L382 PolarHBondContact O-N 3.27Å; L379-H383 WeakPolarHBondContact O-CB 3.46Å; L379-H383 PolarHBondContact O-CD2 3.48Å; L379-H383 VanDerWaalsContact O-CD2 3.31Å; L379-H383 PolarHBondContact O-N 3.17Å; L379-Y400 HydrophobicContact CB-CD2 3.98Å; L379-Y400 HydrophobicContact CB-CE2 4.03Å; L379-Y400 HydrophobicContact CB-CG 4.42Å; L379-Y400 HydrophobicContact CD1-CE1 4.33Å; L379-Y400 HydrophobicContact CD1-CE2 4.34Å
380	G	91.8	Very high	87.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-47.4	173.5	0	0	0	0	0	111.7	Q376 V377 H383 L384 A397 F401	Q376-G380 PolarHBondContact O-N 2.74Å; V377-G380 PolarHBondContact O-N 3.39Å; G380-H383 PolarHBondContact O-N 3.41Å; G380-L384 VanDerWaalsContact O-CB 3.24Å; G380-L384 WeakPolarHBondContact O-CB 3.25Å; G380-L384 PolarHBondContact O-N 3.22Å; G380-A397 WeakPolarHBondContact O-CB 3.34Å; G380-F401 WeakPolarHBondContact O-CZ 3.34Å
381	Q	89.3	Confident	86.6	Confident	68 Å²	68	38.8 Å²	38.8	32%	0.318	22%	0.221	S	C	.	.	H	α-helix	trans	-63.7	-42.8	175.4	-72.9	174.6	-3.1	0	0	112.3	V377 G378 L379 H383 L384 H385 F401 F415	V377-Q381 WeakPolarHBondContact O-CG 3.48Å; V377-Q381 PolarHBondContact O-N 2.88Å; G378-Q381 PolarHBondContact O-N 3.44Å; L379-Q381 VanDerWaalsContact C-N 3.34Å; L379-Q381 PolarHBondContact O-N 3.18Å; Q381-H383 PolarHBondContact O-N 2.95Å; Q381-L384 PolarHBondContact O-N 3.29Å; Q381-H385 PolarHBondContact O-CD2 3.22Å; Q381-H385 VanDerWaalsContact O-CD2 3.27Å; Q381-H385 PolarHBondContact O-N 3.33Å; Q381-F401 HydrophobicContact CG-CE1 4.23Å; Q381-F401 HydrophobicContact CG-CZ 4.14Å; Q381-F415 HydrophobicContact CG-CD2 4.4Å; Q381-F415 HydrophobicContact CG-CE1 4.34Å; Q381-F415 HydrophobicContact CG-CE2 3.97Å; Q381-F415 HydrophobicContact CG-CZ 3.92Å
382	L	88.5	Confident	86.3	Confident	25 Å²	25	40.9 Å²	40.9	13%	0.131	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-44.3	179.9	-172	62.7	0	0	0	111.3	L356 G378 L379 G386 G387 R388 V390	L356-L382 HydrophobicContact CD1-CD1 4.31Å; L356-L382 HydrophobicContact CD1-CD2 3.76Å; G378-L382 WeakPolarHBondContact O-CB 3.49Å; G378-L382 PolarHBondContact O-N 3.21Å; L379-L382 HydrophobicContact CD2-CD2 4.38Å; L379-L382 PolarHBondContact O-N 3.27Å; L382-G386 VanDerWaalsContact O-CA 3.26Å; L382-G386 WeakPolarHBondContact O-CA 3.42Å; L382-G386 PolarHBondContact O-N 3.37Å; L382-G387 WeakPolarHBondContact CD1-O 3.3Å; L382-R388 HydrophobicContact CD1-CB 4.45Å; L382-R388 HydrophobicContact CD1-CG 4.41Å; L382-V390 HydrophobicContact CD1-CB 4.3Å; L382-V390 HydrophobicContact CD2-CB 4.01Å; L382-V390 HydrophobicContact CD2-CG1 4.29Å; L382-V390 HydrophobicContact CD2-CG2 3.59Å; L382-V390 HydrophobicContact CG-CB 3.83Å; L382-V390 HydrophobicContact CG-CG1 4.05Å; L382-V390 HydrophobicContact CG-CG2 4.01Å
383	H	88.8	Confident	85.9	Confident	7 Å²	7	40.6 Å²	40.6	3%	0.032	22%	0.217	C	C	.	.	H	α-helix	trans	-73.7	-28.4	175	-76.1	-55	0	0	0	113.5	L379 G380 Q381 V390 Q392 N393 A397 Y400	L379-H383 WeakPolarHBondContact O-CB 3.46Å; L379-H383 PolarHBondContact O-CD2 3.48Å; L379-H383 VanDerWaalsContact O-CD2 3.31Å; L379-H383 PolarHBondContact O-N 3.17Å; G380-H383 PolarHBondContact O-N 3.41Å; Q381-H383 PolarHBondContact O-N 2.95Å; H383-V390 VanDerWaalsContact CE1-CG1 3.44Å; H383-V390 WeakPolarHBondContact CE1-CG1 3.37Å; H383-V390 WeakPolarHBondContact ND1-CG1 3.31Å; H383-Q392 CarbonylContact O-C 3.5Å; H383-Q392 WeakPolarHBondContact O-CA 3.49Å; H383-N393 PolarHBondContact O-N 2.99Å; H383-A397 HydrophobicContact CB-CB 4.01Å; H383-Y400 AromaticContact CD2-CE2 3.78Å
384	L	87.2	Confident	85.5	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-69.2	-47.8	177.4	-178.8	66.2	0	0	0	111.6	T332 G380 Q381 Q392 A397 F401 F415 M419	T332-L384 HydrophobicContact CG2-CD1 4.29Å; G380-L384 VanDerWaalsContact O-CB 3.24Å; G380-L384 WeakPolarHBondContact O-CB 3.25Å; G380-L384 PolarHBondContact O-N 3.22Å; Q381-L384 PolarHBondContact O-N 3.29Å; L384-Q392 WeakPolarHBondContact O-CG 3.43Å; L384-Q392 PolarHBondContact O-NE2 3.29Å; L384-A397 HydrophobicContact CB-CB 4.05Å; L384-F401 HydrophobicContact CB-CE2 4.2Å; L384-F401 HydrophobicContact CB-CZ 4.47Å; L384-F401 HydrophobicContact CD2-CE2 4.07Å; L384-F401 HydrophobicContact CD2-CZ 4.32Å; L384-F415 HydrophobicContact CD2-CD1 4.04Å; L384-M419 HydrophobicContact CD1-CE 4.47Å; L384-M419 HydrophobicContact CD1-CG 4.19Å; L384-M419 HydrophobicContact CD1-SD 4.32Å
385	H	83.3	Confident	85.4	Confident	43 Å²	43	39.2 Å²	39.2	20%	0.199	21%	0.209	C	C	.	.	H	α-helix	trans	-90.1	-29.3	-176.6	-61	-62.8	0	0	0	112.6	T332 S335 V336 Q381	T332-H385 PolarHBondContact O-CE1 3.24Å; T332-H385 PolarHBondContact O-ND1 3.06Å; S335-H385 WeakPolarHBondContact CA-O 3.05Å; V336-H385 HydrophobicContact CG2-CB 4.06Å; Q381-H385 PolarHBondContact O-CD2 3.22Å; Q381-H385 VanDerWaalsContact O-CD2 3.27Å; Q381-H385 PolarHBondContact O-N 3.33Å
386	G	79.1	Confident	85.2	Confident	9 Å²	9	45 Å²	45	9%	0.093	23%	0.229	C	C	.	.			trans	69.2	139	-165.8	0	0	0	0	0	111.1	V336 L382 V390	V336-G386 WeakPolarHBondContact CB-O 3.01Å; V336-G386 PolarHBondContact N-O 3.36Å; L382-G386 VanDerWaalsContact O-CA 3.26Å; L382-G386 WeakPolarHBondContact O-CA 3.42Å; L382-G386 PolarHBondContact O-N 3.37Å; G386-V390 WeakPolarHBondContact CA-O 3.41Å
387	G	75.5	Confident	85.1	Confident	12 Å²	12	44.5 Å²	44.5	12%	0.124	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	158.7	166.4	-178.8	0	0	0	0	0	112.8	L382 G389 V390	L382-G387 WeakPolarHBondContact CD1-O 3.3Å; G387-G389 PolarHBondContact O-N 3.13Å; G387-G389 VanDerWaalsContact O-N 3.16Å; G387-V390 PolarHBondContact N-O 2.99Å; G387-V390 WeakPolarHBondContact O-CB 3.22Å; G387-V390 PolarHBondContact O-N 3.14Å
388	R	72.9	Confident	85.1	Confident	133 Å²	133	45.9 Å²	45.9	50%	0.502	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	28.7	-178.2	-47.2	-145.5	163.2	83.7	-8.3	114.7	Q338 L356 L382	Q338-R388 VanDerWaalsContact OE1-CA 3.28Å; L356-R388 HydrophobicContact CB-CB 4.07Å; L356-R388 HydrophobicContact CD1-CB 3.6Å; L356-R388 HydrophobicContact CD1-CG 4.04Å; L356-R388 HydrophobicContact CG-CB 3.62Å; L356-R388 VanDerWaalsContact CG-CD 3.49Å; L356-R388 HydrophobicContact CG-CG 4.14Å; L356-R388 PolarHBondContact N-O 2.94Å; L382-R388 HydrophobicContact CD1-CB 4.45Å; L382-R388 HydrophobicContact CD1-CG 4.41Å
389	G	69.3	Low	85.2	Confident	43 Å²	43	47.7 Å²	47.7	44%	0.443	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	-3.8	-175.2	0	0	0	0	0	115.4	M355 G387	M355-G389 VanDerWaalsContact CE-CA 3.47Å; G387-G389 PolarHBondContact O-N 3.13Å; G387-G389 VanDerWaalsContact O-N 3.16Å
390	V	80.4	Confident	85.4	Confident	17 Å²	17	49.1 Å²	49.1	10%	0.103	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-92.9	125.7	174.5	-179.5	0	0	0	0	110.4	I361 L382 H383 G386 G387	I361-V390 HydrophobicContact CD1-CG2 3.36Å; I361-V390 HydrophobicContact CG1-CG2 3.94Å; L382-V390 HydrophobicContact CD1-CB 4.3Å; L382-V390 HydrophobicContact CD2-CB 4.01Å; L382-V390 HydrophobicContact CD2-CG1 4.29Å; L382-V390 HydrophobicContact CD2-CG2 3.59Å; L382-V390 HydrophobicContact CG-CB 3.83Å; L382-V390 HydrophobicContact CG-CG1 4.05Å; L382-V390 HydrophobicContact CG-CG2 4.01Å; H383-V390 VanDerWaalsContact CE1-CG1 3.44Å; H383-V390 WeakPolarHBondContact CE1-CG1 3.37Å; H383-V390 WeakPolarHBondContact ND1-CG1 3.31Å; G386-V390 WeakPolarHBondContact CA-O 3.41Å; G387-V390 PolarHBondContact N-O 2.99Å; G387-V390 WeakPolarHBondContact O-CB 3.22Å; G387-V390 PolarHBondContact O-N 3.14Å
391	E	77.1	Confident	85.5	Confident	128 Å²	128	49.1 Å²	49.1	60%	0.598	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-69.4	149.4	175.2	-64.3	-173.2	179.6	0	0	112.1	N198 N393	N198-E391 PolarHBondContact ND2-OE2 3.35Å; E391-N393 PolarHBondContact O-N 3.16Å
392	Q	83.8	Confident	85.8	Confident	86 Å²	86	47.3 Å²	47.3	40%	0.402	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-65.9	127.2	174.5	-173	176.1	41.8	0	0	110.3	H383 L384 H394	H383-Q392 CarbonylContact O-C 3.5Å; H383-Q392 WeakPolarHBondContact O-CA 3.49Å; L384-Q392 WeakPolarHBondContact O-CG 3.43Å; L384-Q392 PolarHBondContact O-NE2 3.29Å; Q392-H394 VanDerWaalsContact CD-NE2 3.28Å; Q392-H394 PolarHBondContact NE2-NE2 3.14Å
393	N	86.6	Confident	86	Confident	57 Å²	57	50.6 Å²	50.6	31%	0.305	25%	0.249	S	C	.	.			trans	-144.9	100.2	176.8	-172.8	-36.5	0	0	0	109.9	H383 E391 Q395 R396 A397	H383-N393 PolarHBondContact O-N 2.99Å; E391-N393 PolarHBondContact O-N 3.16Å; N393-Q395 PolarHBondContact O-N 3.31Å; N393-Q395 WeakPolarHBondContact OD1-CB 3.35Å; N393-Q395 PolarHBondContact OD1-N 3.46Å; N393-R396 HydrophobicContact CB-CB 4.37Å; N393-R396 PolarHBondContact OD1-N 3.07Å; N393-R396 VanDerWaalsContact OD1-N 3.08Å; N393-A397 WeakPolarHBondContact O-CB 3.33Å; N393-A397 PolarHBondContact O-N 2.97Å; N393-A397 VanDerWaalsContact O-N 3.08Å
394	H	86.9	Confident	86.3	Confident	55 Å²	55	50.3 Å²	50.3	26%	0.255	25%	0.248	S	C	.	.	H	α-helix	trans	-66.4	-27.3	-176.5	-66.5	-171.2	0	0	0	112.6	Q392 F398 I426	Q392-H394 VanDerWaalsContact CD-NE2 3.28Å; Q392-H394 PolarHBondContact NE2-NE2 3.14Å; H394-F398 WeakPolarHBondContact O-CB 3.47Å; H394-F398 PolarHBondContact O-N 2.73Å; H394-I426 HydrophobicContact CB-CD1 3.65Å
395	Q	89.7	Confident	86.7	Confident	78 Å²	78	50.6 Å²	50.6	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-69.6	-53	-179.4	179.3	64	48.4	0	0	109.9	N393 A397 F398 D399 I426	N393-Q395 PolarHBondContact O-N 3.31Å; N393-Q395 WeakPolarHBondContact OD1-CB 3.35Å; N393-Q395 PolarHBondContact OD1-N 3.46Å; Q395-A397 VanDerWaalsContact C-N 3.26Å; Q395-A397 PolarHBondContact O-N 3.35Å; Q395-F398 WeakPolarHBondContact O-CB 3.34Å; Q395-F398 PolarHBondContact O-N 3.47Å; Q395-F398 VanDerWaalsContact O-N 3.16Å; Q395-D399 PolarHBondContact NE2-OD1 3.48Å; Q395-D399 VanDerWaalsContact NE2-OD1 3.15Å; Q395-D399 PolarHBondContact NE2-OD2 2.92Å; Q395-D399 VanDerWaalsContact O-CG 3.27Å; Q395-D399 PolarHBondContact O-N 3.37Å; Q395-I426 HydrophobicContact CB-CD1 3.69Å; Q395-I426 HydrophobicContact CB-CG1 4.33Å; Q395-I426 VanDerWaalsContact N-CD1 3.27Å
396	R	89.4	Confident	87.2	Confident	127 Å²	127	55.2 Å²	55.2	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-38.5	177.3	-71.5	-174.7	176	176.1	-1.1	111.5	N393 D399 Y400	N393-R396 HydrophobicContact CB-CB 4.37Å; N393-R396 PolarHBondContact OD1-N 3.07Å; N393-R396 VanDerWaalsContact OD1-N 3.08Å; R396-D399 PolarHBondContact O-N 3.17Å; R396-Y400 HydrophobicContact CB-CE2 4.37Å; R396-Y400 WeakPolarHBondContact O-CD2 3.04Å; R396-Y400 PolarHBondContact O-N 3.19Å
397	A	91.8	Very high	87.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-48.7	174.8	0	0	0	0	0	111.5	G380 H383 L384 N393 Q395 D399 Y400 F401	G380-A397 WeakPolarHBondContact O-CB 3.34Å; H383-A397 HydrophobicContact CB-CB 4.01Å; L384-A397 HydrophobicContact CB-CB 4.05Å; N393-A397 WeakPolarHBondContact O-CB 3.33Å; N393-A397 PolarHBondContact O-N 2.97Å; N393-A397 VanDerWaalsContact O-N 3.08Å; Q395-A397 VanDerWaalsContact C-N 3.26Å; Q395-A397 PolarHBondContact O-N 3.35Å; A397-D399 PolarHBondContact O-N 3.41Å; A397-Y400 PolarHBondContact O-N 2.89Å; A397-F401 HydrophobicContact CB-CD2 4.4Å; A397-F401 HydrophobicContact CB-CE2 4.12Å; A397-F401 WeakPolarHBondContact O-CB 3.29Å; A397-F401 WeakPolarHBondContact O-CD2 3.26Å; A397-F401 VanDerWaalsContact O-CG 3.28Å; A397-F401 WeakPolarHBondContact O-CG 3.19Å; A397-F401 PolarHBondContact O-N 3.24Å
398	F	92.8	Very high	88.6	Confident	37 Å²	37	59.1 Å²	59.1	16%	0.162	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-45.9	177	179.8	-109.2	0	0	0	112.2	H394 Q395 F401 N402 L416 M419 Y420 V427	H394-F398 WeakPolarHBondContact O-CB 3.47Å; H394-F398 PolarHBondContact O-N 2.73Å; Q395-F398 WeakPolarHBondContact O-CB 3.34Å; Q395-F398 PolarHBondContact O-N 3.47Å; Q395-F398 VanDerWaalsContact O-N 3.16Å; F398-F401 PolarHBondContact O-N 2.83Å; F398-N402 WeakPolarHBondContact CD1-ND2 3.39Å; F398-N402 WeakPolarHBondContact CE1-ND2 3.38Å; F398-N402 VanDerWaalsContact CE2-ND2 3.29Å; F398-N402 WeakPolarHBondContact CE2-ND2 3.3Å; F398-N402 WeakPolarHBondContact CZ-ND2 3.37Å; F398-N402 WeakPolarHBondContact O-CB 3.4Å; F398-N402 PolarHBondContact O-N 3.33Å; F398-N402 PolarHBondContact O-ND2 2.95Å; F398-N402 VanDerWaalsContact O-ND2 3.13Å; F398-L416 HydrophobicContact CD2-CD2 3.76Å; F398-L416 HydrophobicContact CE2-CD2 3.94Å; F398-M419 HydrophobicContact CB-CE 3.83Å; F398-M419 HydrophobicContact CB-SD 4.5Å; F398-M419 HydrophobicContact CD2-CE 4.37Å; F398-Y420 HydrophobicContact CE2-CE2 4.28Å; F398-V427 HydrophobicContact CB-CG2 4.5Å; F398-V427 HydrophobicContact CD2-CG2 3.55Å; F398-V427 HydrophobicContact CE2-CG2 3.77Å; F398-V427 HydrophobicContact CG-CG2 3.99Å; F398-V427 HydrophobicContact CZ-CG2 4.36Å
399	D	93.6	Very high	89.6	Confident	71 Å²	71	53.5 Å²	53.5	38%	0.38	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-48	-179	-63.5	-27.7	0	0	0	111.4	Q395 R396 A397 F401 N402 L403	Q395-D399 PolarHBondContact NE2-OD1 3.48Å; Q395-D399 VanDerWaalsContact NE2-OD1 3.15Å; Q395-D399 PolarHBondContact NE2-OD2 2.92Å; Q395-D399 VanDerWaalsContact O-CG 3.27Å; Q395-D399 PolarHBondContact O-N 3.37Å; R396-D399 PolarHBondContact O-N 3.17Å; A397-D399 PolarHBondContact O-N 3.41Å; D399-F401 PolarHBondContact O-N 3.44Å; D399-N402 PolarHBondContact O-N 3.17Å; D399-L403 WeakPolarHBondContact O-CG 3.32Å; D399-L403 PolarHBondContact O-N 3.41Å
400	Y	95	Very high	90.8	Very high	33 Å²	33	52.7 Å²	52.7	13%	0.129	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-40.8	176.7	-73	-52.7	0	0	0	112.7	A368 Q376 L379 H383 R396 A397 L403 A404	A368-Y400 HydrophobicContact CB-CD1 4.45Å; A368-Y400 HydrophobicContact CB-CE1 4.1Å; Q376-Y400 HydrophobicContact CG-CD1 4.49Å; Q376-Y400 WeakPolarHBondContact O-CB 3.35Å; L379-Y400 HydrophobicContact CB-CD2 3.98Å; L379-Y400 HydrophobicContact CB-CE2 4.03Å; L379-Y400 HydrophobicContact CB-CG 4.42Å; L379-Y400 HydrophobicContact CD1-CE1 4.33Å; L379-Y400 HydrophobicContact CD1-CE2 4.34Å; H383-Y400 AromaticContact CD2-CE2 3.78Å; R396-Y400 HydrophobicContact CB-CE2 4.37Å; R396-Y400 WeakPolarHBondContact O-CD2 3.04Å; R396-Y400 PolarHBondContact O-N 3.19Å; A397-Y400 PolarHBondContact O-N 2.89Å; Y400-L403 PolarHBondContact O-N 3.27Å; Y400-A404 WeakPolarHBondContact O-CB 3.45Å; Y400-A404 PolarHBondContact O-N 3.47Å
401	F	94.9	Very high	91.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-36	177.1	-68.4	-45.3	0	0	0	112.5	G380 Q381 L384 A397 F398 D399 A404 A405 A412 F415 L416 M419	G380-F401 WeakPolarHBondContact O-CZ 3.34Å; Q381-F401 HydrophobicContact CG-CE1 4.23Å; Q381-F401 HydrophobicContact CG-CZ 4.14Å; L384-F401 HydrophobicContact CB-CE2 4.2Å; L384-F401 HydrophobicContact CB-CZ 4.47Å; L384-F401 HydrophobicContact CD2-CE2 4.07Å; L384-F401 HydrophobicContact CD2-CZ 4.32Å; A397-F401 HydrophobicContact CB-CD2 4.4Å; A397-F401 HydrophobicContact CB-CE2 4.12Å; A397-F401 WeakPolarHBondContact O-CB 3.29Å; A397-F401 WeakPolarHBondContact O-CD2 3.26Å; A397-F401 VanDerWaalsContact O-CG 3.28Å; A397-F401 WeakPolarHBondContact O-CG 3.19Å; A397-F401 PolarHBondContact O-N 3.24Å; F398-F401 PolarHBondContact O-N 2.83Å; D399-F401 PolarHBondContact O-N 3.44Å; F401-A404 PolarHBondContact O-N 2.89Å; F401-A405 WeakPolarHBondContact O-CB 3.42Å; F401-A405 PolarHBondContact O-N 3Å; F401-A412 HydrophobicContact CD1-CB 4.43Å; F401-A412 WeakPolarHBondContact O-CB 3.26Å; F401-F415 HydrophobicContact CD1-CB 4.07Å; F401-F415 HydrophobicContact CD2-CB 4.08Å; F401-F415 HydrophobicContact CE1-CB 3.82Å; F401-F415 AromaticContact CE1-CD2 3.91Å; F401-F415 HydrophobicContact CE1-CD2 3.91Å; F401-F415 AromaticContact CE1-CG 3.94Å; F401-F415 HydrophobicContact CE1-CG 3.94Å; F401-F415 HydrophobicContact CE2-CB 3.83Å; F401-F415 HydrophobicContact CE2-CG 4.38Å; F401-F415 HydrophobicContact CG-CB 4.2Å; F401-F415 HydrophobicContact CZ-CB 3.67Å; F401-F415 HydrophobicContact CZ-CD1 4.3Å; F401-F415 HydrophobicContact CZ-CD2 4.18Å; F401-F415 AromaticContact CZ-CG 3.79Å; F401-F415 HydrophobicContact CZ-CG 3.79Å; F401-L416 HydrophobicContact CB-CD1 4.49Å; F401-L416 HydrophobicContact CB-CD2 3.7Å; F401-L416 HydrophobicContact CB-CG 3.82Å; F401-M419 HydrophobicContact CD2-SD 3.74Å; F401-M419 HydrophobicContact CE2-SD 4.09Å
402	N	94.3	Very high	92.2	Very high	31 Å²	31	49.2 Å²	49.2	17%	0.166	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-43.5	174.1	-79.8	-42.6	0	0	0	112.2	F398 D399 A404 A405 N406 L416	F398-N402 WeakPolarHBondContact CD1-ND2 3.39Å; F398-N402 WeakPolarHBondContact CE1-ND2 3.38Å; F398-N402 VanDerWaalsContact CE2-ND2 3.29Å; F398-N402 WeakPolarHBondContact CE2-ND2 3.3Å; F398-N402 WeakPolarHBondContact CZ-ND2 3.37Å; F398-N402 WeakPolarHBondContact O-CB 3.4Å; F398-N402 PolarHBondContact O-N 3.33Å; F398-N402 PolarHBondContact O-ND2 2.95Å; F398-N402 VanDerWaalsContact O-ND2 3.13Å; D399-N402 PolarHBondContact O-N 3.17Å; N402-A404 VanDerWaalsContact C-N 3.34Å; N402-A404 PolarHBondContact O-N 3.49Å; N402-A405 PolarHBondContact O-N 3.32Å; N402-N406 WeakPolarHBondContact O-CB 3.48Å; N402-N406 PolarHBondContact O-N 3.43Å; N402-N406 PolarHBondContact O-ND2 2.93Å; N402-L416 WeakPolarHBondContact OD1-CD1 3.37Å
403	L	94.4	Very high	92.7	Very high	94 Å²	94	45.9 Å²	45.9	49%	0.492	25%	0.246	S	C	.	.	H	α-helix	trans	-57.6	-48.7	175.3	-70	172	0	0	0	111	D399 Y400 N406 A407	D399-L403 WeakPolarHBondContact O-CG 3.32Å; D399-L403 PolarHBondContact O-N 3.41Å; Y400-L403 PolarHBondContact O-N 3.27Å; L403-N406 PolarHBondContact O-N 2.89Å; L403-A407 PolarHBondContact O-N 3.39Å; L403-A407 VanDerWaalsContact O-N 3.15Å
404	A	95.2	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-36.4	179.8	0	0	0	0	0	112.9	V373 Q376 V377 Y400 F401 N402 A407 G408 N409 A412	V373-A404 HydrophobicContact CG1-CB 3.99Å; Q376-A404 HydrophobicContact CB-CB 3.95Å; V377-A404 HydrophobicContact CG2-CB 3.72Å; Y400-A404 WeakPolarHBondContact O-CB 3.45Å; Y400-A404 PolarHBondContact O-N 3.47Å; F401-A404 PolarHBondContact O-N 2.89Å; N402-A404 VanDerWaalsContact C-N 3.34Å; N402-A404 PolarHBondContact O-N 3.49Å; A404-A407 PolarHBondContact O-N 3.05Å; A404-G408 PolarHBondContact O-N 3Å; A404-N409 HydrophobicContact CB-CB 4.21Å; A404-N409 WeakPolarHBondContact O-CB 3.27Å; A404-N409 PolarHBondContact O-N 2.88Å; A404-A412 HydrophobicContact CB-CB 3.5Å
405	A	94.4	Very high	93.3	Very high	9 Å²	9	41 Å²	41	7%	0.074	22%	0.221	C	C	.	.	H	α-helix	trans	-68.2	-38.7	177	0	0	0	0	0	111.7	F401 N402 A407 G408 A412 M413 L416	F401-A405 WeakPolarHBondContact O-CB 3.42Å; F401-A405 PolarHBondContact O-N 3Å; N402-A405 PolarHBondContact O-N 3.32Å; A405-A407 PolarHBondContact O-N 2.84Å; A405-G408 WeakPolarHBondContact O-CA 3.2Å; A405-G408 PolarHBondContact O-N 2.95Å; A405-A412 HydrophobicContact CB-CB 4.1Å; A405-M413 HydrophobicContact CB-CG 3.88Å; A405-M413 VanDerWaalsContact O-CE 3.23Å; A405-M413 WeakPolarHBondContact O-CE 3.35Å; A405-L416 HydrophobicContact CB-CD1 3.51Å
406	N	93.2	Very high	93.4	Very high	139 Å²	139	37.3 Å²	37.3	74%	0.743	20%	0.204	S	C	*	.	H	α-helix	trans	-64.7	-31.1	174.1	-71.5	-23.5	0	0	0	112.1	N402 L403 G408	N402-N406 WeakPolarHBondContact O-CB 3.48Å; N402-N406 PolarHBondContact O-N 3.43Å; N402-N406 PolarHBondContact O-ND2 2.93Å; L403-N406 PolarHBondContact O-N 2.89Å; N406-G408 PolarHBondContact O-N 2.91Å
407	A	92.5	Very high	93.5	Very high	64 Å²	64	31.3 Å²	31.3	53%	0.529	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-0.2	170.5	0	0	0	0	0	114	V373 L403 A404 A405	V373-A407 HydrophobicContact CG1-CB 4.43Å; V373-A407 HydrophobicContact CG2-CB 3.59Å; L403-A407 PolarHBondContact O-N 3.39Å; L403-A407 VanDerWaalsContact O-N 3.15Å; A404-A407 PolarHBondContact O-N 3.05Å; A405-A407 PolarHBondContact O-N 2.84Å
408	G	91.9	Very high	93.4	Very high	40 Å²	40	32.3 Å²	32.3	41%	0.412	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	15	176.7	0	0	0	0	0	115.2	A404 A405 N406 S410	A404-G408 PolarHBondContact O-N 3Å; A405-G408 WeakPolarHBondContact O-CA 3.2Å; A405-G408 PolarHBondContact O-N 2.95Å; N406-G408 PolarHBondContact O-N 2.91Å; G408-S410 PolarHBondContact O-N 3.05Å
409	N	94.9	Very high	93.2	Very high	15 Å²	15	30.9 Å²	30.9	8%	0.08	18%	0.179	C	C	.	.			trans	-73.8	123.6	179.8	-169.5	-75.4	0	0	0	112.6	V373 V377 A404 H411 A412 M413	V373-N409 HydrophobicContact CG1-CB 3.5Å; V373-N409 WeakPolarHBondContact CG1-ND2 3.38Å; V377-N409 HydrophobicContact CG2-CB 4.45Å; A404-N409 HydrophobicContact CB-CB 4.21Å; A404-N409 WeakPolarHBondContact O-CB 3.27Å; A404-N409 PolarHBondContact O-N 2.88Å; N409-H411 WeakPolarHBondContact OD1-CA 3.49Å; N409-H411 VanDerWaalsContact OD1-CB 3.31Å; N409-H411 WeakPolarHBondContact OD1-CB 3.47Å; N409-H411 PolarHBondContact OD1-N 3.47Å; N409-A412 HydrophobicContact CB-CB 3.96Å; N409-A412 PolarHBondContact OD1-N 2.64Å; N409-M413 WeakPolarHBondContact O-CG 3.29Å; N409-M413 PolarHBondContact O-N 3.12Å
410	S	94.3	Very high	93.1	Very high	26 Å²	26	29.5 Å²	29.5	18%	0.182	17%	0.169	C	C	.	.	H	α-helix	trans	-71.4	-31.1	-177.8	70.3	0	0	0	0	113.9	G408 A414 A441 N446	G408-S410 PolarHBondContact O-N 3.05Å; S410-A414 PolarHBondContact O-N 3.22Å; S410-A414 VanDerWaalsContact O-N 3.1Å; S410-A441 WeakPolarHBondContact O-CB 3.44Å; S410-N446 PolarHBondContact OG-ND2 2.85Å; S410-N446 VanDerWaalsContact OG-ND2 3.11Å
411	H	92.5	Very high	92.8	Very high	72 Å²	72	28.5 Å²	28.5	33%	0.333	17%	0.167	S	C	.	.	H	α-helix	trans	-68.9	-46	175.7	-68.7	-82.8	0	0	0	110.8	V377 N409 M413 A414 F415 N446	V377-H411 HydrophobicContact CG1-CB 4.14Å; N409-H411 WeakPolarHBondContact OD1-CA 3.49Å; N409-H411 VanDerWaalsContact OD1-CB 3.31Å; N409-H411 WeakPolarHBondContact OD1-CB 3.47Å; N409-H411 PolarHBondContact OD1-N 3.47Å; H411-M413 VanDerWaalsContact C-N 3.31Å; H411-M413 PolarHBondContact O-N 3.33Å; H411-A414 WeakPolarHBondContact O-CB 3.47Å; H411-A414 PolarHBondContact O-N 2.71Å; H411-F415 HydrophobicContact CB-CD2 4.47Å; H411-F415 HydrophobicContact CB-CE2 4.31Å; H411-F415 WeakPolarHBondContact O-CD2 3.21Å; H411-F415 PolarHBondContact O-N 3.39Å; H411-N446 WeakPolarHBondContact CA-ND2 3.49Å; H411-N446 PolarHBondContact CE1-ND2 3.44Å; H411-N446 VanDerWaalsContact CE1-ND2 3.35Å; H411-N446 VanDerWaalsContact CG-ND2 3.28Å; H411-N446 PolarHBondContact N-ND2 3.36Å; H411-N446 PolarHBondContact ND1-ND2 3.22Å; H411-N446 VanDerWaalsContact ND1-ND2 3.13Å
412	A	94	Very high	92.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.7	-45.7	176.5	0	0	0	0	0	111.7	V377 F401 A404 A405 N409 A414 F415 L416	V377-A412 HydrophobicContact CG2-CB 3.96Å; F401-A412 HydrophobicContact CD1-CB 4.43Å; F401-A412 WeakPolarHBondContact O-CB 3.26Å; A404-A412 HydrophobicContact CB-CB 3.5Å; A405-A412 HydrophobicContact CB-CB 4.1Å; N409-A412 HydrophobicContact CB-CB 3.96Å; N409-A412 PolarHBondContact OD1-N 2.64Å; A412-A414 VanDerWaalsContact C-N 3.3Å; A412-A414 PolarHBondContact O-N 3.42Å; A412-F415 PolarHBondContact O-N 3.34Å; A412-L416 WeakPolarHBondContact O-CG 3.49Å; A412-L416 PolarHBondContact O-N 2.97Å
413	M	94.8	Very high	91.7	Very high	16 Å²	16	30.4 Å²	30.4	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-41.2	174.3	-68.1	178.4	-163.9	0	0	112	A405 N409 H411 L416 G417 Y437 K440 A441 M444	A405-M413 HydrophobicContact CB-CG 3.88Å; A405-M413 VanDerWaalsContact O-CE 3.23Å; A405-M413 WeakPolarHBondContact O-CE 3.35Å; N409-M413 WeakPolarHBondContact O-CG 3.29Å; N409-M413 PolarHBondContact O-N 3.12Å; H411-M413 VanDerWaalsContact C-N 3.31Å; H411-M413 PolarHBondContact O-N 3.33Å; M413-L416 PolarHBondContact O-N 3.13Å; M413-G417 PolarHBondContact O-N 2.88Å; M413-Y437 HydrophobicContact CB-CD1 4.38Å; M413-Y437 HydrophobicContact CG-CD1 4.45Å; M413-Y437 WeakPolarHBondContact O-CB 3.3Å; M413-K440 HydrophobicContact SD-CB 3.93Å; M413-K440 HydrophobicContact SD-CD 4.47Å; M413-A441 HydrophobicContact CB-CB 4.12Å; M413-M444 HydrophobicContact CE-CE 4.1Å; M413-M444 HydrophobicContact SD-CE 4.24Å; M413-M444 HydrophobicContact SD-SD 4.3Å
414	A	92.8	Very high	91	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.1	-40.3	178	0	0	0	0	0	112.7	S410 H411 A412 G417 K418 F438 A441 V448	S410-A414 PolarHBondContact O-N 3.22Å; S410-A414 VanDerWaalsContact O-N 3.1Å; H411-A414 WeakPolarHBondContact O-CB 3.47Å; H411-A414 PolarHBondContact O-N 2.71Å; A412-A414 VanDerWaalsContact C-N 3.3Å; A412-A414 PolarHBondContact O-N 3.42Å; A414-G417 PolarHBondContact O-N 3.02Å; A414-K418 PolarHBondContact O-N 3.09Å; A414-F438 WeakPolarHBondContact O-CE1 3.31Å; A414-A441 HydrophobicContact CB-CB 3.9Å; A414-V448 HydrophobicContact CB-CB 3.62Å; A414-V448 HydrophobicContact CB-CG1 3.74Å
415	F	92.2	Very high	90.1	Very high	10 Å²	10	35.8 Å²	35.8	4%	0.044	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-38.9	175	-74.3	-69.5	0	0	0	112.2	Q381 L384 F401 H411 A412 G417 K418 M419	Q381-F415 HydrophobicContact CG-CD2 4.4Å; Q381-F415 HydrophobicContact CG-CE1 4.34Å; Q381-F415 HydrophobicContact CG-CE2 3.97Å; Q381-F415 HydrophobicContact CG-CZ 3.92Å; L384-F415 HydrophobicContact CD2-CD1 4.04Å; F401-F415 HydrophobicContact CD1-CB 4.07Å; F401-F415 HydrophobicContact CD2-CB 4.08Å; F401-F415 HydrophobicContact CE1-CB 3.82Å; F401-F415 AromaticContact CE1-CD2 3.91Å; F401-F415 HydrophobicContact CE1-CD2 3.91Å; F401-F415 AromaticContact CE1-CG 3.94Å; F401-F415 HydrophobicContact CE1-CG 3.94Å; F401-F415 HydrophobicContact CE2-CB 3.83Å; F401-F415 HydrophobicContact CE2-CG 4.38Å; F401-F415 HydrophobicContact CG-CB 4.2Å; F401-F415 HydrophobicContact CZ-CB 3.67Å; F401-F415 HydrophobicContact CZ-CD1 4.3Å; F401-F415 HydrophobicContact CZ-CD2 4.18Å; F401-F415 AromaticContact CZ-CG 3.79Å; F401-F415 HydrophobicContact CZ-CG 3.79Å; H411-F415 HydrophobicContact CB-CD2 4.47Å; H411-F415 HydrophobicContact CB-CE2 4.31Å; H411-F415 WeakPolarHBondContact O-CD2 3.21Å; H411-F415 PolarHBondContact O-N 3.39Å; A412-F415 PolarHBondContact O-N 3.34Å; F415-G417 VanDerWaalsContact C-N 3.34Å; F415-G417 PolarHBondContact O-N 2.95Å; F415-K418 WeakPolarHBondContact O-CB 3.43Å; F415-K418 PolarHBondContact O-N 2.98Å; F415-K418 VanDerWaalsContact O-N 3.15Å; F415-M419 WeakPolarHBondContact O-CG 3.32Å; F415-M419 PolarHBondContact O-N 3.25Å
416	L	92.5	Very high	89.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-45.9	170.4	-71.7	173.1	0	0	0	111.1	F398 F401 N402 A405 A412 M413 K418 M419 Y420 Y437	F398-L416 HydrophobicContact CD2-CD2 3.76Å; F398-L416 HydrophobicContact CE2-CD2 3.94Å; F401-L416 HydrophobicContact CB-CD1 4.49Å; F401-L416 HydrophobicContact CB-CD2 3.7Å; F401-L416 HydrophobicContact CB-CG 3.82Å; N402-L416 WeakPolarHBondContact OD1-CD1 3.37Å; A405-L416 HydrophobicContact CB-CD1 3.51Å; A412-L416 WeakPolarHBondContact O-CG 3.49Å; A412-L416 PolarHBondContact O-N 2.97Å; M413-L416 PolarHBondContact O-N 3.13Å; L416-K418 PolarHBondContact O-N 2.88Å; L416-M419 PolarHBondContact O-N 3.44Å; L416-M419 VanDerWaalsContact O-N 3.16Å; L416-Y420 WeakPolarHBondContact O-CD2 3.25Å; L416-Y420 PolarHBondContact O-N 2.9Å; L416-Y437 HydrophobicContact CB-CD2 4.47Å; L416-Y437 HydrophobicContact CB-CG 4.4Å; L416-Y437 HydrophobicContact CD1-CE1 4.21Å
417	G	91.8	Very high	89.2	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-55.6	-40.2	174.8	0	0	0	0	0	112.5	M413 A414 F415 S421 A434 F438	M413-G417 PolarHBondContact O-N 2.88Å; A414-G417 PolarHBondContact O-N 3.02Å; F415-G417 VanDerWaalsContact C-N 3.34Å; F415-G417 PolarHBondContact O-N 2.95Å; G417-S421 WeakPolarHBondContact O-CB 3.28Å; G417-S421 PolarHBondContact O-N 3.21Å; G417-A434 VanDerWaalsContact O-CB 3.28Å; G417-A434 WeakPolarHBondContact O-CB 3.29Å; G417-F438 VanDerWaalsContact C-CE1 3.49Å; G417-F438 WeakPolarHBondContact O-CZ 3.29Å
418	K	88.6	Confident	89	Confident	22 Å²	22	33.7 Å²	33.7	10%	0.096	20%	0.197	C	C	.	.	H	α-helix	trans	-65	-47.4	175.3	-166.3	178.9	-169.5	-177.9	0	112.3	L331 T332 A414 F415 L416 Y420 S421 E422 F438	L331-K418 WeakPolarHBondContact O-CE 3.36Å; L331-K418 PolarHBondContact O-NZ 2.92Å; T332-K418 VanDerWaalsContact CA-CE 3.46Å; T332-K418 HydrophobicContact CG2-CD 4.34Å; T332-K418 HydrophobicContact CG2-CG 4.36Å; A414-K418 PolarHBondContact O-N 3.09Å; F415-K418 WeakPolarHBondContact O-CB 3.43Å; F415-K418 PolarHBondContact O-N 2.98Å; F415-K418 VanDerWaalsContact O-N 3.15Å; L416-K418 PolarHBondContact O-N 2.88Å; K418-Y420 PolarHBondContact O-N 3.27Å; K418-S421 PolarHBondContact O-N 3.02Å; K418-S421 VanDerWaalsContact O-N 3.15Å; K418-E422 WeakPolarHBondContact CE-OE1 3.48Å; K418-E422 WeakPolarHBondContact CG-OE1 3.39Å; K418-E422 PolarHBondContact O-N 3.18Å; K418-E422 VanDerWaalsContact O-N 3.13Å; K418-F438 HydrophobicContact CB-CE1 4.48Å; K418-F438 HydrophobicContact CB-CZ 4.41Å
419	M	89.9	Confident	88.9	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-44.4	177	-68.5	-178.2	74.8	0	0	111.9	L384 F398 F401 F415 L416 G423 V427	L384-M419 HydrophobicContact CD1-CE 4.47Å; L384-M419 HydrophobicContact CD1-CG 4.19Å; L384-M419 HydrophobicContact CD1-SD 4.32Å; F398-M419 HydrophobicContact CB-CE 3.83Å; F398-M419 HydrophobicContact CB-SD 4.5Å; F398-M419 HydrophobicContact CD2-CE 4.37Å; F401-M419 HydrophobicContact CD2-SD 3.74Å; F401-M419 HydrophobicContact CE2-SD 4.09Å; F415-M419 WeakPolarHBondContact O-CG 3.32Å; F415-M419 PolarHBondContact O-N 3.25Å; L416-M419 PolarHBondContact O-N 3.44Å; L416-M419 VanDerWaalsContact O-N 3.16Å; M419-G423 PolarHBondContact O-N 2.87Å; M419-V427 HydrophobicContact CE-CG2 4.29Å
420	Y	91.5	Very high	88.7	Confident	42 Å²	42	38.4 Å²	38.4	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-68.5	-31.8	175.7	-77.4	-68.4	0	0	0	113.2	F398 L416 K418 V427 Q429 S430 T433 Y437	F398-Y420 HydrophobicContact CE2-CE2 4.28Å; L416-Y420 WeakPolarHBondContact O-CD2 3.25Å; L416-Y420 PolarHBondContact O-N 2.9Å; K418-Y420 PolarHBondContact O-N 3.27Å; Y420-V427 HydrophobicContact CD1-CG1 3.24Å; Y420-V427 HydrophobicContact CE1-CG1 3.21Å; Y420-V427 HydrophobicContact CE2-CG1 4.47Å; Y420-V427 HydrophobicContact CG-CG1 3.93Å; Y420-Q429 CarbonylContact O-C 3.28Å; Y420-Q429 WeakPolarHBondContact O-CA 3.28Å; Y420-S430 PolarHBondContact O-N 3.33Å; Y420-T433 WeakPolarHBondContact CD1-OG1 3.39Å; Y420-Y437 AromaticContact CD2-CD2 3.9Å; Y420-Y437 HydrophobicContact CD2-CD2 3.9Å; Y420-Y437 AromaticContact CD2-CE2 3.94Å; Y420-Y437 HydrophobicContact CD2-CE2 3.94Å; Y420-Y437 HydrophobicContact CE2-CD2 4.05Å; Y420-Y437 AromaticContact CE2-CE2 3.59Å; Y420-Y437 HydrophobicContact CE2-CE2 3.59Å
421	S	88.3	Confident	88.5	Confident	12 Å²	12	40 Å²	40	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-71	-32.9	179.3	-178.6	0	0	0	0	112.9	G417 K418 Q429	G417-S421 WeakPolarHBondContact O-CB 3.28Å; G417-S421 PolarHBondContact O-N 3.21Å; K418-S421 PolarHBondContact O-N 3.02Å; K418-S421 VanDerWaalsContact O-N 3.15Å; S421-Q429 WeakPolarHBondContact O-CG 3.39Å; S421-Q429 PolarHBondContact O-NE2 3.03Å
422	E	82.9	Confident	88.4	Confident	45 Å²	45	44 Å²	44	21%	0.21	24%	0.237	C	C	.	.	H	α-helix	trans	-89.8	-38.3	-179.8	-71.3	174.6	-139.2	0	0	111.5	L331 T332 K418	L331-E422 HydrophobicContact CB-CG 4.16Å; L331-E422 WeakPolarHBondContact CB-OE1 3.44Å; T332-E422 WeakPolarHBondContact CB-OE2 3.24Å; T332-E422 VanDerWaalsContact CG2-CD 3.46Å; T332-E422 WeakPolarHBondContact CG2-OE1 3.45Å; T332-E422 WeakPolarHBondContact CG2-OE2 3.35Å; T332-E422 VanDerWaalsContact N-CD 3.26Å; T332-E422 PolarHBondContact N-OE1 3.12Å; T332-E422 PolarHBondContact N-OE2 3.05Å; T332-E422 PolarHBondContact OG1-OE2 3.49Å; K418-E422 WeakPolarHBondContact CE-OE1 3.48Å; K418-E422 WeakPolarHBondContact CG-OE1 3.39Å; K418-E422 PolarHBondContact O-N 3.18Å; K418-E422 VanDerWaalsContact O-N 3.13Å
423	G	83.3	Confident	88.3	Confident	26 Å²	26	46.4 Å²	46.4	27%	0.268	25%	0.252	S	S	.	.			trans	77.2	153.7	-166.8	0	0	0	0	0	111.8	M419 V427	M419-G423 PolarHBondContact O-N 2.87Å; G423-V427 CarbonylContact C-O 3.6Å; G423-V427 VanDerWaalsContact CA-O 3.26Å; G423-V427 WeakPolarHBondContact CA-O 3.43Å
424	S	79.3	Confident	88.2	Confident	30 Å²	30	45.8 Å²	45.8	21%	0.21	25%	0.249	C	C	.	.			trans	-150.7	172.4	172.5	57.7	0	0	0	0	108.4	I426 V427	S424-I426 PolarHBondContact O-N 3.47Å; S424-V427 PolarHBondContact N-O 2.95Å; S424-V427 CarbonylContact O-C 3.21Å; S424-V427 PolarHBondContact O-N 3.26Å; S424-V427 PolarHBondContact OG-N 3.26Å; S424-V427 VanDerWaalsContact OG-N 3.12Å
425	D	76.3	Confident	88.2	Confident	177 Å²	177	47.4 Å²	47.4	95%	0.947	26%	0.258	S	S	*	.	S	Bend	trans	-56.7	-24.7	177.3	-59.7	-33	0	0	0	113.1
426	I	84.2	Confident	88.3	Confident	66 Å²	66	51.4 Å²	51.4	34%	0.338	28%	0.276	S	S	.	.	S	Bend	trans	-94.5	-40.9	-179.8	-66.8	139.7	0	0	0	111.8	H394 Q395 S424	H394-I426 HydrophobicContact CB-CD1 3.65Å; Q395-I426 HydrophobicContact CB-CD1 3.69Å; Q395-I426 HydrophobicContact CB-CG1 4.33Å; Q395-I426 VanDerWaalsContact N-CD1 3.27Å; S424-I426 PolarHBondContact O-N 3.47Å
427	V	85.2	Confident	88.4	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.018	29%	0.286	C	S	.	.	S	Bend	trans	-114.3	108.7	-174.2	-176	0	0	0	0	109	F398 M419 Y420 G423 S424	F398-V427 HydrophobicContact CB-CG2 4.5Å; F398-V427 HydrophobicContact CD2-CG2 3.55Å; F398-V427 HydrophobicContact CE2-CG2 3.77Å; F398-V427 HydrophobicContact CG-CG2 3.99Å; F398-V427 HydrophobicContact CZ-CG2 4.36Å; M419-V427 HydrophobicContact CE-CG2 4.29Å; Y420-V427 HydrophobicContact CD1-CG1 3.24Å; Y420-V427 HydrophobicContact CE1-CG1 3.21Å; Y420-V427 HydrophobicContact CE2-CG1 4.47Å; Y420-V427 HydrophobicContact CG-CG1 3.93Å; G423-V427 CarbonylContact C-O 3.6Å; G423-V427 VanDerWaalsContact CA-O 3.26Å; G423-V427 WeakPolarHBondContact CA-O 3.43Å; S424-V427 PolarHBondContact N-O 2.95Å; S424-V427 CarbonylContact O-C 3.21Å; S424-V427 PolarHBondContact O-N 3.26Å; S424-V427 PolarHBondContact OG-N 3.26Å; S424-V427 VanDerWaalsContact OG-N 3.12Å
428	P	87.7	Confident	88.5	Confident	99 Å²	99	54.6 Å²	54.6	64%	0.643	29%	0.29	S	S	*	.			trans	-65	144.3	179.1	27.3	-33.9	0	0	0	110.8	S430	P428-S430 PolarHBondContact O-N 3.24Å
429	Q	89.2	Confident	88.8	Confident	118 Å²	118	59.1 Å²	59.1	55%	0.551	31%	0.309	S	S	*	.			trans	-62.7	125.4	179	-167.5	-178.5	19.5	0	0	110.4	Y420 S421	Y420-Q429 CarbonylContact O-C 3.28Å; Y420-Q429 WeakPolarHBondContact O-CA 3.28Å; S421-Q429 WeakPolarHBondContact O-CG 3.39Å; S421-Q429 PolarHBondContact O-NE2 3.03Å
430	S	91.6	Very high	89	Confident	36 Å²	36	63.2 Å²	63.2	25%	0.252	33%	0.327	S	S	.	.			trans	-146.9	105.3	178.5	173	0	0	0	0	110.4	Y420 P428 E432 T433 A434	Y420-S430 PolarHBondContact O-N 3.33Å; P428-S430 PolarHBondContact O-N 3.24Å; S430-E432 VanDerWaalsContact C-N 3.31Å; S430-E432 PolarHBondContact O-N 3.15Å; S430-T433 WeakPolarHBondContact CB-OG1 3.5Å; S430-T433 PolarHBondContact O-OG1 2.66Å; S430-T433 VanDerWaalsContact O-OG1 3.08Å; S430-T433 WeakPolarHBondContact OG-CG2 3.33Å; S430-T433 PolarHBondContact OG-N 2.88Å; S430-T433 PolarHBondContact OG-OG1 2.92Å; S430-A434 VanDerWaalsContact O-CB 3.26Å; S430-A434 WeakPolarHBondContact O-CB 3.42Å; S430-A434 PolarHBondContact O-N 2.62Å
431	N	90.2	Very high	89.2	Confident	59 Å²	59	61.2 Å²	61.2	32%	0.316	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-33.4	-178.8	-67.7	-38.3	0	0	0	112.6	L435	N431-L435 VanDerWaalsContact O-CB 3.27Å; N431-L435 WeakPolarHBondContact O-CB 3.45Å; N431-L435 PolarHBondContact O-N 2.77Å
432	E	90.6	Very high	89.5	Confident	156 Å²	156	61.1 Å²	61.1	73%	0.729	32%	0.319	S	S	*	.	H	α-helix	trans	-69.7	-45.8	-179.3	-63	-178.5	174.9	0	0	112.1	S430 L435 H436	S430-E432 VanDerWaalsContact C-N 3.31Å; S430-E432 PolarHBondContact O-N 3.15Å; E432-L435 PolarHBondContact O-N 3.5Å; E432-H436 PolarHBondContact O-N 3.36Å
433	T	91.3	Very high	90	Very high	52 Å²	52	64.7 Å²	64.7	32%	0.319	34%	0.339	S	S	.	.	H	α-helix	trans	-68.5	-40.1	177.3	57.6	0	0	0	0	111	Y420 S430 L435 H436 Y437	Y420-T433 WeakPolarHBondContact CD1-OG1 3.39Å; S430-T433 WeakPolarHBondContact CB-OG1 3.5Å; S430-T433 PolarHBondContact O-OG1 2.66Å; S430-T433 VanDerWaalsContact O-OG1 3.08Å; S430-T433 WeakPolarHBondContact OG-CG2 3.33Å; S430-T433 PolarHBondContact OG-N 2.88Å; S430-T433 PolarHBondContact OG-OG1 2.92Å; T433-L435 VanDerWaalsContact C-N 3.32Å; T433-L435 PolarHBondContact O-N 3.34Å; T433-H436 PolarHBondContact O-N 3.21Å; T433-Y437 VanDerWaalsContact O-CD2 3.26Å; T433-Y437 WeakPolarHBondContact O-CD2 3.48Å; T433-Y437 PolarHBondContact O-N 3.27Å
434	A	92.1	Very high	90.5	Very high	2 Å²	2	68.6 Å²	68.6	2%	0.017	35%	0.352	C	S	.	.	H	α-helix	trans	-55.4	-48.4	172	0	0	0	0	0	111.4	G417 S430 H436 Y437 F438	G417-A434 VanDerWaalsContact O-CB 3.28Å; G417-A434 WeakPolarHBondContact O-CB 3.29Å; S430-A434 VanDerWaalsContact O-CB 3.26Å; S430-A434 WeakPolarHBondContact O-CB 3.42Å; S430-A434 PolarHBondContact O-N 2.62Å; A434-H436 PolarHBondContact O-N 2.68Å; A434-Y437 PolarHBondContact O-N 3.44Å; A434-F438 HydrophobicContact CB-CD2 4.37Å; A434-F438 HydrophobicContact CB-CE2 4.1Å; A434-F438 WeakPolarHBondContact O-CB 3.49Å; A434-F438 WeakPolarHBondContact O-CD2 3.2Å; A434-F438 VanDerWaalsContact O-CG 3.32Å; A434-F438 WeakPolarHBondContact O-CG 3.47Å; A434-F438 PolarHBondContact O-N 3.23Å
435	L	93.3	Very high	91.1	Very high	35 Å²	35	68.6 Å²	68.6	18%	0.183	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-40.7	179.2	-171.9	138.4	0	0	0	112.5	N431 E432 T433 Y437 F438 K439 L453 A456 V463	N431-L435 VanDerWaalsContact O-CB 3.27Å; N431-L435 WeakPolarHBondContact O-CB 3.45Å; N431-L435 PolarHBondContact O-N 2.77Å; E432-L435 PolarHBondContact O-N 3.5Å; T433-L435 VanDerWaalsContact C-N 3.32Å; T433-L435 PolarHBondContact O-N 3.34Å; L435-Y437 PolarHBondContact O-N 3.09Å; L435-F438 PolarHBondContact O-N 3.47Å; L435-K439 VanDerWaalsContact O-CB 3.28Å; L435-K439 WeakPolarHBondContact O-CB 3.45Å; L435-K439 PolarHBondContact O-N 3.09Å; L435-L453 HydrophobicContact CG-CD2 4.48Å; L435-A456 HydrophobicContact CD1-CB 4.21Å; L435-V463 HydrophobicContact CD1-CB 4.15Å; L435-V463 HydrophobicContact CD1-CG1 3.4Å; L435-V463 HydrophobicContact CD1-CG2 3.85Å
436	H	94	Very high	92	Very high	93 Å²	93	60.3 Å²	60.3	43%	0.431	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-44.7	175.5	168.3	-100.6	0	0	0	112	E432 T433 A434 K440	E432-H436 PolarHBondContact O-N 3.36Å; T433-H436 PolarHBondContact O-N 3.21Å; A434-H436 PolarHBondContact O-N 2.68Å; H436-K440 WeakPolarHBondContact CE1-CE 3.49Å; H436-K440 PolarHBondContact CE1-NZ 3.4Å; H436-K440 WeakPolarHBondContact NE2-CE 3.44Å; H436-K440 PolarHBondContact NE2-NZ 2.94Å; H436-K440 WeakPolarHBondContact O-CG 3.37Å; H436-K440 PolarHBondContact O-N 3.21Å; H436-K440 VanDerWaalsContact O-N 3.12Å
437	Y	94.6	Very high	92.4	Very high	51 Å²	51	58 Å²	58	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-69.1	-42.3	176.4	-79.6	-64.4	0	0	0	113	M413 L416 Y420 T433 A434 L435 K439 K440 A441	M413-Y437 HydrophobicContact CB-CD1 4.38Å; M413-Y437 HydrophobicContact CG-CD1 4.45Å; M413-Y437 WeakPolarHBondContact O-CB 3.3Å; L416-Y437 HydrophobicContact CB-CD2 4.47Å; L416-Y437 HydrophobicContact CB-CG 4.4Å; L416-Y437 HydrophobicContact CD1-CE1 4.21Å; Y420-Y437 AromaticContact CD2-CD2 3.9Å; Y420-Y437 HydrophobicContact CD2-CD2 3.9Å; Y420-Y437 AromaticContact CD2-CE2 3.94Å; Y420-Y437 HydrophobicContact CD2-CE2 3.94Å; Y420-Y437 HydrophobicContact CE2-CD2 4.05Å; Y420-Y437 AromaticContact CE2-CE2 3.59Å; Y420-Y437 HydrophobicContact CE2-CE2 3.59Å; T433-Y437 VanDerWaalsContact O-CD2 3.26Å; T433-Y437 WeakPolarHBondContact O-CD2 3.48Å; T433-Y437 PolarHBondContact O-N 3.27Å; A434-Y437 PolarHBondContact O-N 3.44Å; L435-Y437 PolarHBondContact O-N 3.09Å; Y437-K439 VanDerWaalsContact C-N 3.29Å; Y437-K439 PolarHBondContact O-N 3.26Å; Y437-K440 PolarHBondContact O-N 3.22Å; Y437-A441 WeakPolarHBondContact O-CB 3.47Å; Y437-A441 PolarHBondContact O-N 3.47Å
438	F	94.6	Very high	92.7	Very high	17 Å²	17	58.2 Å²	58.2	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-39.7	175	-71	-43.2	0	0	0	112.1	A414 G417 K418 A434 L435 A441 A442 L453	A414-F438 WeakPolarHBondContact O-CE1 3.31Å; G417-F438 VanDerWaalsContact C-CE1 3.49Å; G417-F438 WeakPolarHBondContact O-CZ 3.29Å; K418-F438 HydrophobicContact CB-CE1 4.48Å; K418-F438 HydrophobicContact CB-CZ 4.41Å; A434-F438 HydrophobicContact CB-CD2 4.37Å; A434-F438 HydrophobicContact CB-CE2 4.1Å; A434-F438 WeakPolarHBondContact O-CB 3.49Å; A434-F438 WeakPolarHBondContact O-CD2 3.2Å; A434-F438 VanDerWaalsContact O-CG 3.32Å; A434-F438 WeakPolarHBondContact O-CG 3.47Å; A434-F438 PolarHBondContact O-N 3.23Å; L435-F438 PolarHBondContact O-N 3.47Å; F438-A441 PolarHBondContact O-N 2.92Å; F438-A442 WeakPolarHBondContact O-CB 3.38Å; F438-A442 PolarHBondContact O-N 2.93Å; F438-L453 HydrophobicContact CB-CD2 3.91Å; F438-L453 HydrophobicContact CB-CG 4.06Å
439	K	94.6	Very high	93	Very high	116 Å²	116	53.5 Å²	53.5	50%	0.504	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-50	175.7	-171.6	176.5	179.7	-178.9	0	111.5	L435 Y437 A441 A442 D443 L453	L435-K439 VanDerWaalsContact O-CB 3.28Å; L435-K439 WeakPolarHBondContact O-CB 3.45Å; L435-K439 PolarHBondContact O-N 3.09Å; Y437-K439 VanDerWaalsContact C-N 3.29Å; Y437-K439 PolarHBondContact O-N 3.26Å; K439-A441 VanDerWaalsContact C-N 3.32Å; K439-A441 PolarHBondContact O-N 3.34Å; K439-A442 PolarHBondContact O-N 3.32Å; K439-D443 WeakPolarHBondContact O-CB 2.94Å; K439-D443 PolarHBondContact O-N 3.46Å; K439-L453 HydrophobicContact CB-CD2 4.35Å
440	K	94.9	Very high	93.3	Very high	92 Å²	92	48.5 Å²	48.5	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-55.9	-46.3	175.6	-75.6	-177.4	173	-179.5	0	112.3	M413 H436 Y437 M444	M413-K440 HydrophobicContact SD-CB 3.93Å; M413-K440 HydrophobicContact SD-CD 4.47Å; H436-K440 WeakPolarHBondContact CE1-CE 3.49Å; H436-K440 PolarHBondContact CE1-NZ 3.4Å; H436-K440 WeakPolarHBondContact NE2-CE 3.44Å; H436-K440 PolarHBondContact NE2-NZ 2.94Å; H436-K440 WeakPolarHBondContact O-CG 3.37Å; H436-K440 PolarHBondContact O-N 3.21Å; H436-K440 VanDerWaalsContact O-N 3.12Å; Y437-K440 PolarHBondContact O-N 3.22Å; K440-M444 WeakPolarHBondContact O-CG 3.46Å; K440-M444 PolarHBondContact O-N 2.95Å
441	A	94.9	Very high	93.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-43.6	179.1	0	0	0	0	0	112.1	S410 M413 A414 Y437 F438 K439 M444 G445 N446	S410-A441 WeakPolarHBondContact O-CB 3.44Å; M413-A441 HydrophobicContact CB-CB 4.12Å; A414-A441 HydrophobicContact CB-CB 3.9Å; Y437-A441 WeakPolarHBondContact O-CB 3.47Å; Y437-A441 PolarHBondContact O-N 3.47Å; F438-A441 PolarHBondContact O-N 2.92Å; K439-A441 VanDerWaalsContact C-N 3.32Å; K439-A441 PolarHBondContact O-N 3.34Å; A441-M444 CarbonylContact O-C 3.57Å; A441-M444 PolarHBondContact O-N 2.86Å; A441-G445 PolarHBondContact O-N 3.26Å; A441-N446 HydrophobicContact CB-CB 4.12Å; A441-N446 WeakPolarHBondContact O-CB 3.35Å; A441-N446 PolarHBondContact O-N 3.28Å
442	A	94.6	Very high	93.4	Very high	11 Å²	11	44.8 Å²	44.8	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-68	-35.9	179.7	0	0	0	0	0	113.1	F438 K439 M444 G445 Q450 L453	F438-A442 WeakPolarHBondContact O-CB 3.38Å; F438-A442 PolarHBondContact O-N 2.93Å; K439-A442 PolarHBondContact O-N 3.32Å; A442-M444 PolarHBondContact O-N 3.48Å; A442-G445 WeakPolarHBondContact O-CA 3.41Å; A442-G445 PolarHBondContact O-N 3.2Å; A442-Q450 HydrophobicContact CB-CG 3.96Å; A442-L453 HydrophobicContact CB-CD1 3.4Å; A442-L453 VanDerWaalsContact CB-CD1 3.4Å; A442-L453 HydrophobicContact CB-CG 4.18Å
443	D	94.4	Very high	93.5	Very high	119 Å²	119	37.6 Å²	37.6	64%	0.636	20%	0.196	S	C	*	.	H	α-helix	trans	-63.4	-31.4	174.6	-71.1	-20.2	0	0	0	111.1	K439 G445	K439-D443 WeakPolarHBondContact O-CB 2.94Å; K439-D443 PolarHBondContact O-N 3.46Å; D443-G445 PolarHBondContact O-N 3.19Å
444	M	93.3	Very high	93.6	Very high	108 Å²	108	35.1 Å²	35.1	53%	0.532	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	6.8	170.2	-63.3	179.3	-178.6	0	0	113.7	M413 K440 A441 A442 N446	M413-M444 HydrophobicContact CE-CE 4.1Å; M413-M444 HydrophobicContact SD-CE 4.24Å; M413-M444 HydrophobicContact SD-SD 4.3Å; K440-M444 WeakPolarHBondContact O-CG 3.46Å; K440-M444 PolarHBondContact O-N 2.95Å; A441-M444 CarbonylContact O-C 3.57Å; A441-M444 PolarHBondContact O-N 2.86Å; A442-M444 PolarHBondContact O-N 3.48Å; M444-N446 PolarHBondContact O-N 3.09Å
445	G	92.4	Very high	93.6	Very high	31 Å²	31	35.9 Å²	35.9	32%	0.32	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	5.3	177.8	0	0	0	0	0	115.4	A441 A442 D443 Q450 Q480	A441-G445 PolarHBondContact O-N 3.26Å; A442-G445 WeakPolarHBondContact O-CA 3.41Å; A442-G445 PolarHBondContact O-N 3.2Å; D443-G445 PolarHBondContact O-N 3.19Å; G445-Q450 PolarHBondContact O-NE2 2.72Å; G445-Q480 PolarHBondContact O-NE2 3.04Å; G445-Q480 VanDerWaalsContact O-NE2 3.09Å; G445-Q480 PolarHBondContact O-OE1 3.4Å
446	N	94.3	Very high	93.5	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	18%	0.178	C	C	.	.			trans	-67.3	129.2	-175.2	-170.2	-76.3	0	0	0	112.1	S410 H411 A441 M444 V448 G449 Q450	S410-N446 PolarHBondContact OG-ND2 2.85Å; S410-N446 VanDerWaalsContact OG-ND2 3.11Å; H411-N446 WeakPolarHBondContact CA-ND2 3.49Å; H411-N446 PolarHBondContact CE1-ND2 3.44Å; H411-N446 VanDerWaalsContact CE1-ND2 3.35Å; H411-N446 VanDerWaalsContact CG-ND2 3.28Å; H411-N446 PolarHBondContact N-ND2 3.36Å; H411-N446 PolarHBondContact ND1-ND2 3.22Å; H411-N446 VanDerWaalsContact ND1-ND2 3.13Å; A441-N446 HydrophobicContact CB-CB 4.12Å; A441-N446 WeakPolarHBondContact O-CB 3.35Å; A441-N446 PolarHBondContact O-N 3.28Å; M444-N446 PolarHBondContact O-N 3.09Å; N446-V448 PolarHBondContact O-N 3.21Å; N446-V448 WeakPolarHBondContact OD1-CA 3.29Å; N446-V448 VanDerWaalsContact OD1-CB 3.23Å; N446-V448 WeakPolarHBondContact OD1-CB 3.04Å; N446-V448 PolarHBondContact OD1-N 3.5Å; N446-G449 PolarHBondContact O-N 3.43Å; N446-G449 PolarHBondContact OD1-N 3.49Å; N446-Q450 VanDerWaalsContact O-CG 3.29Å; N446-Q450 WeakPolarHBondContact O-CG 3.32Å; N446-Q450 PolarHBondContact O-N 3.04Å
447	P	93.8	Very high	93.6	Very high	17 Å²	17	32.4 Å²	32.4	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-74	-27.8	-174.8	30.3	-35.2	0	0	0	113.3	Q450 S451 A477 Q480 W482	P447-Q450 PolarHBondContact O-N 3.05Å; P447-S451 WeakPolarHBondContact O-CB 3.3Å; P447-S451 PolarHBondContact O-N 3.46Å; P447-A477 HydrophobicContact CB-CB 4.41Å; P447-Q480 HydrophobicContact CB-CB 3.97Å; P447-Q480 HydrophobicContact CG-CB 4.41Å; P447-W482 HydrophobicContact CB-CB 3.74Å; P447-W482 HydrophobicContact CB-CG 4.24Å; P447-W482 HydrophobicContact CG-CB 4.33Å
448	V	91.3	Very high	93.5	Very high	8 Å²	8	30.5 Å²	30.5	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-44.8	173.7	-170.9	0	0	0	0	109.6	A414 N446 S451 G452 W482	A414-V448 HydrophobicContact CB-CB 3.62Å; A414-V448 HydrophobicContact CB-CG1 3.74Å; N446-V448 PolarHBondContact O-N 3.21Å; N446-V448 WeakPolarHBondContact OD1-CA 3.29Å; N446-V448 VanDerWaalsContact OD1-CB 3.23Å; N446-V448 WeakPolarHBondContact OD1-CB 3.04Å; N446-V448 PolarHBondContact OD1-N 3.5Å; V448-S451 PolarHBondContact O-N 2.96Å; V448-G452 PolarHBondContact O-N 3.37Å; V448-W482 HydrophobicContact CB-CZ2 4.34Å; V448-W482 HydrophobicContact CG1-CZ2 4.11Å; V448-W482 HydrophobicContact CG2-CD2 4.02Å; V448-W482 HydrophobicContact CG2-CE3 4.01Å; V448-W482 HydrophobicContact CG2-CH2 3.65Å; V448-W482 HydrophobicContact CG2-CZ2 3.65Å; V448-W482 HydrophobicContact CG2-CZ3 3.82Å
449	G	92.9	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-43	174.3	0	0	0	0	0	112.8	N446 G452 L453	N446-G449 PolarHBondContact O-N 3.43Å; N446-G449 PolarHBondContact OD1-N 3.49Å; G449-G452 PolarHBondContact O-N 3.44Å; G449-L453 PolarHBondContact O-N 3.46Å
450	Q	95.3	Very high	93	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-45	174.8	-70.8	168.5	5	0	0	111.7	A442 G445 N446 P447 G452 L453 G454 Y473 K476 A477	A442-Q450 HydrophobicContact CB-CG 3.96Å; G445-Q450 PolarHBondContact O-NE2 2.72Å; N446-Q450 VanDerWaalsContact O-CG 3.29Å; N446-Q450 WeakPolarHBondContact O-CG 3.32Å; N446-Q450 PolarHBondContact O-N 3.04Å; P447-Q450 PolarHBondContact O-N 3.05Å; Q450-G452 VanDerWaalsContact C-N 3.33Å; Q450-G452 PolarHBondContact O-N 3Å; Q450-L453 PolarHBondContact O-N 3.38Å; Q450-G454 PolarHBondContact O-N 3.27Å; Q450-Y473 HydrophobicContact CG-CD1 4.48Å; Q450-Y473 WeakPolarHBondContact O-CB 3.01Å; Q450-K476 VanDerWaalsContact OE1-CB 3.27Å; Q450-A477 HydrophobicContact CB-CB 4.16Å
451	S	93.2	Very high	92.6	Very high	7 Å²	7	28.4 Å²	28.4	5%	0.049	16%	0.155	C	C	.	.	H	α-helix	trans	-62.4	-40.3	175	-169.9	0	0	0	0	111.9	P447 V448 G454 M455 F474	P447-S451 WeakPolarHBondContact O-CB 3.3Å; P447-S451 PolarHBondContact O-N 3.46Å; V448-S451 PolarHBondContact O-N 2.96Å; S451-G454 PolarHBondContact O-N 3.38Å; S451-M455 WeakPolarHBondContact O-CB 3.17Å; S451-M455 PolarHBondContact O-N 2.91Å; S451-F474 WeakPolarHBondContact O-CE1 3.3Å
452	G	91.6	Very high	92	Very high	10 Å²	10	30.8 Å²	30.8	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-43.5	175	0	0	0	0	0	113	V448 G449 Q450 M455 A456	V448-G452 PolarHBondContact O-N 3.37Å; G449-G452 PolarHBondContact O-N 3.44Å; Q450-G452 VanDerWaalsContact C-N 3.33Å; Q450-G452 PolarHBondContact O-N 3Å; G452-M455 WeakPolarHBondContact O-CB 3.43Å; G452-M455 PolarHBondContact O-N 3.17Å; G452-A456 PolarHBondContact O-N 2.88Å
453	L	93.1	Very high	91.9	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-42.7	172.2	-74.3	-175.9	0	0	0	112.2	L435 F438 K439 A442 G449 Q450 M455 A456 Y457 Y473	L435-L453 HydrophobicContact CG-CD2 4.48Å; F438-L453 HydrophobicContact CB-CD2 3.91Å; F438-L453 HydrophobicContact CB-CG 4.06Å; K439-L453 HydrophobicContact CB-CD2 4.35Å; A442-L453 HydrophobicContact CB-CD1 3.4Å; A442-L453 VanDerWaalsContact CB-CD1 3.4Å; A442-L453 HydrophobicContact CB-CG 4.18Å; G449-L453 PolarHBondContact O-N 3.46Å; Q450-L453 PolarHBondContact O-N 3.38Å; L453-M455 PolarHBondContact O-N 3.23Å; L453-A456 PolarHBondContact O-N 3.24Å; L453-A456 VanDerWaalsContact O-N 3.16Å; L453-Y457 WeakPolarHBondContact O-CD2 3.45Å; L453-Y457 PolarHBondContact O-N 3.47Å; L453-Y473 HydrophobicContact CB-CD2 4.3Å; L453-Y473 HydrophobicContact CB-CG 4.31Å; L453-Y473 HydrophobicContact CD1-CD1 4.37Å; L453-Y473 HydrophobicContact CD1-CE1 3.93Å; L453-Y473 HydrophobicContact CD1-CE2 4.49Å
454	G	93.3	Very high	91.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-55.1	-42.9	175	0	0	0	0	0	111.2	Q450 S451 Y457 L458 A470	Q450-G454 PolarHBondContact O-N 3.27Å; S451-G454 PolarHBondContact O-N 3.38Å; G454-Y457 PolarHBondContact O-N 3.4Å; G454-L458 VanDerWaalsContact O-CB 3.31Å; G454-L458 WeakPolarHBondContact O-CB 3.43Å; G454-L458 PolarHBondContact O-N 3.42Å; G454-A470 WeakPolarHBondContact O-CB 3.44Å
455	M	91.4	Very high	91.8	Very high	17 Å²	17	33.2 Å²	33.2	8%	0.084	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-43.2	176.3	-161.8	65.5	78.4	0	0	113.1	L331 S451 G452 L453 Y457 L458 Y459 F474 Q488	L331-M455 HydrophobicContact CD2-CE 4.33Å; S451-M455 WeakPolarHBondContact O-CB 3.17Å; S451-M455 PolarHBondContact O-N 2.91Å; G452-M455 WeakPolarHBondContact O-CB 3.43Å; G452-M455 PolarHBondContact O-N 3.17Å; L453-M455 PolarHBondContact O-N 3.23Å; M455-Y457 VanDerWaalsContact C-N 3.32Å; M455-Y457 PolarHBondContact O-N 2.93Å; M455-L458 PolarHBondContact O-N 2.03Å; M455-L458 HydrophobicContact SD-CD2 4.27Å; M455-Y459 HydrophobicContact CE-CE2 4.48Å; M455-Y459 HydrophobicContact CG-CD2 3.78Å; M455-Y459 HydrophobicContact CG-CE2 3.96Å; M455-Y459 PolarHBondContact O-N 3.31Å; M455-Y459 HydrophobicContact SD-CD2 3.49Å; M455-Y459 WeakPolarHBondContact SD-CD2 3.4Å; M455-Y459 HydrophobicContact SD-CE2 3.1Å; M455-Y459 WeakPolarHBondContact SD-CE2 3.48Å; M455-F474 HydrophobicContact SD-CZ 4.48Å; M455-Q488 HydrophobicContact CE-CG 3.63Å
456	A	92.2	Very high	91.9	Very high	6 Å²	6	34.5 Å²	34.5	5%	0.05	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-42.9	177.3	0	0	0	0	0	111.4	L435 G452 L453 G460 R461 V463	L435-A456 HydrophobicContact CD1-CB 4.21Å; G452-A456 PolarHBondContact O-N 2.88Å; L453-A456 PolarHBondContact O-N 3.24Å; L453-A456 VanDerWaalsContact O-N 3.16Å; A456-G460 CarbonylContact O-C 3.11Å; A456-G460 VanDerWaalsContact O-CA 3.23Å; A456-G460 WeakPolarHBondContact O-CA 3.42Å; A456-G460 PolarHBondContact O-N 3.11Å; A456-R461 PolarHBondContact O-N 2.89Å; A456-V463 HydrophobicContact CB-CG2 3.99Å; A456-V463 WeakPolarHBondContact O-CG2 3.23Å
457	Y	94.4	Very high	91.9	Very high	49 Å²	49	39.4 Å²	39.4	19%	0.192	21%	0.21	C	C	.	.	H	α-helix	trans	-73.2	-30.1	175.4	-76.1	-63.6	0	0	0	114.1	L453 G454 M455 V463 V465 N466 L469 Y473	L453-Y457 WeakPolarHBondContact O-CD2 3.45Å; L453-Y457 PolarHBondContact O-N 3.47Å; G454-Y457 PolarHBondContact O-N 3.4Å; M455-Y457 VanDerWaalsContact C-N 3.32Å; M455-Y457 PolarHBondContact O-N 2.93Å; Y457-V463 HydrophobicContact CD1-CB 4.28Å; Y457-V463 HydrophobicContact CD1-CG2 3.85Å; Y457-V463 HydrophobicContact CE1-CB 4.06Å; Y457-V463 HydrophobicContact CE1-CG1 4.28Å; Y457-V463 HydrophobicContact CE1-CG2 4.01Å; Y457-V463 HydrophobicContact CG-CG2 4.32Å; Y457-V465 CarbonylContact O-C 3.57Å; Y457-V465 VanDerWaalsContact O-CA 3.3Å; Y457-V465 WeakPolarHBondContact O-CA 3.33Å; Y457-N466 HydrophobicContact CD1-CB 4.01Å; Y457-N466 PolarHBondContact O-N 3.38Å; Y457-L469 HydrophobicContact CD1-CB 4.42Å; Y457-L469 HydrophobicContact CD1-CD1 4.29Å; Y457-L469 HydrophobicContact CD2-CB 4.17Å; Y457-L469 HydrophobicContact CE1-CD1 3.85Å; Y457-L469 HydrophobicContact CE2-CB 4.44Å; Y457-L469 HydrophobicContact CE2-CD1 4.44Å; Y457-L469 HydrophobicContact CG-CB 4.17Å; Y457-Y473 AromaticContact CD2-CD2 3.99Å; Y457-Y473 HydrophobicContact CD2-CD2 3.99Å; Y457-Y473 AromaticContact CD2-CE2 3.97Å; Y457-Y473 HydrophobicContact CD2-CE2 3.97Å; Y457-Y473 HydrophobicContact CE2-CD2 4.12Å; Y457-Y473 AromaticContact CE2-CE2 3.61Å; Y457-Y473 HydrophobicContact CE2-CE2 3.61Å
458	L	92.3	Very high	91.9	Very high	12 Å²	12	44.3 Å²	44.3	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-44.6	178.3	-177.6	65.8	0	0	0	111.6	G454 M455 Y467 A470 F474 I497	G454-L458 VanDerWaalsContact O-CB 3.31Å; G454-L458 WeakPolarHBondContact O-CB 3.43Å; G454-L458 PolarHBondContact O-N 3.42Å; M455-L458 PolarHBondContact O-N 2.03Å; M455-L458 HydrophobicContact SD-CD2 4.27Å; L458-Y467 HydrophobicContact CD1-CD1 3.83Å; L458-Y467 HydrophobicContact CD1-CE1 3.97Å; L458-A470 HydrophobicContact CB-CB 4.21Å; L458-F474 HydrophobicContact CB-CE2 4.31Å; L458-F474 HydrophobicContact CD2-CE2 4.11Å; L458-F474 HydrophobicContact CD2-CZ 4.3Å; L458-I497 HydrophobicContact CD1-CG2 3.91Å
459	Y	89.8	Confident	92.1	Very high	93 Å²	93	46.6 Å²	46.6	37%	0.365	25%	0.246	S	C	.	.	H	α-helix	trans	-101.5	-6.5	-176.6	-63.5	-48.9	0	0	0	114.6	M455	M455-Y459 HydrophobicContact CE-CE2 4.48Å; M455-Y459 HydrophobicContact CG-CD2 3.78Å; M455-Y459 HydrophobicContact CG-CE2 3.96Å; M455-Y459 PolarHBondContact O-N 3.31Å; M455-Y459 HydrophobicContact SD-CD2 3.49Å; M455-Y459 WeakPolarHBondContact SD-CD2 3.4Å; M455-Y459 HydrophobicContact SD-CE2 3.1Å; M455-Y459 WeakPolarHBondContact SD-CE2 3.48Å
460	G	89.4	Confident	92.2	Very high	27 Å²	27	46.6 Å²	46.6	28%	0.278	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	32.6	-179	0	0	0	0	0	114.1	A456 G462 V463	A456-G460 CarbonylContact O-C 3.11Å; A456-G460 VanDerWaalsContact O-CA 3.23Å; A456-G460 WeakPolarHBondContact O-CA 3.42Å; A456-G460 PolarHBondContact O-N 3.11Å; G460-G462 PolarHBondContact O-N 3.3Å; G460-V463 CarbonylContact C-O 3.6Å; G460-V463 WeakPolarHBondContact CA-O 3.34Å; G460-V463 VanDerWaalsContact O-O 3.1Å
461	R	86.1	Confident	92.2	Very high	61 Å²	61	47.4 Å²	47.4	23%	0.23	25%	0.251	C	S	.	.	S	Bend	trans	-82.5	102.6	-180	-65	-176.3	-176.4	175.5	-0.5	110.4	A456 V463	A456-R461 PolarHBondContact O-N 2.89Å; R461-V463 PolarHBondContact O-N 2.88Å
462	G	83.4	Confident	92.3	Very high	50 Å²	50	52.6 Å²	52.6	52%	0.515	27%	0.273	S	S	.	.	S	Bend	trans	74.6	-1.8	-179.2	0	0	0	0	0	114.8	G460	G460-G462 PolarHBondContact O-N 3.3Å
463	V	91.8	Very high	92.5	Very high	38 Å²	38	54.5 Å²	54.5	23%	0.23	28%	0.277	C	S	.	.	S	Bend	trans	-141.1	160.9	174.2	-82.5	0	0	0	0	110	L435 A456 Y457 G460 R461	L435-V463 HydrophobicContact CD1-CB 4.15Å; L435-V463 HydrophobicContact CD1-CG1 3.4Å; L435-V463 HydrophobicContact CD1-CG2 3.85Å; A456-V463 HydrophobicContact CB-CG2 3.99Å; A456-V463 WeakPolarHBondContact O-CG2 3.23Å; Y457-V463 HydrophobicContact CD1-CB 4.28Å; Y457-V463 HydrophobicContact CD1-CG2 3.85Å; Y457-V463 HydrophobicContact CE1-CB 4.06Å; Y457-V463 HydrophobicContact CE1-CG1 4.28Å; Y457-V463 HydrophobicContact CE1-CG2 4.01Å; Y457-V463 HydrophobicContact CG-CG2 4.32Å; G460-V463 CarbonylContact C-O 3.6Å; G460-V463 WeakPolarHBondContact CA-O 3.34Å; G460-V463 VanDerWaalsContact O-O 3.1Å; R461-V463 PolarHBondContact O-N 2.88Å
464	Q	92.1	Very high	92.6	Very high	177 Å²	177	54.2 Å²	54.2	83%	0.827	28%	0.276	S	S	*	.			trans	-68.1	143.7	171.5	-66.3	-178.3	3.5	0	0	111	N466	Q464-N466 PolarHBondContact O-N 2.95Å
465	V	93.8	Very high	92.7	Very high	73 Å²	73	57 Å²	57	44%	0.442	29%	0.289	S	S	.	.			trans	-59.6	125.7	178.5	178.9	0	0	0	0	109.8	Y457 Y467	Y457-V465 CarbonylContact O-C 3.57Å; Y457-V465 VanDerWaalsContact O-CA 3.3Å; Y457-V465 WeakPolarHBondContact O-CA 3.33Å; V465-Y467 HydrophobicContact CG1-CD1 4.28Å; V465-Y467 HydrophobicContact CG1-CD2 4.46Å; V465-Y467 HydrophobicContact CG1-CE1 3.74Å; V465-Y467 HydrophobicContact CG1-CE2 3.95Å
466	N	95	Very high	92.9	Very high	58 Å²	58	60.2 Å²	60.2	31%	0.31	30%	0.302	S	S	.	.			trans	-145.7	101.5	176.1	-172.3	-36.4	0	0	0	110.2	Y457 Q464 D468 L469 A470	Y457-N466 HydrophobicContact CD1-CB 4.01Å; Y457-N466 PolarHBondContact O-N 3.38Å; Q464-N466 PolarHBondContact O-N 2.95Å; N466-D468 PolarHBondContact O-N 3.42Å; N466-D468 PolarHBondContact OD1-N 3.48Å; N466-D468 VanDerWaalsContact OD1-N 3.15Å; N466-L469 HydrophobicContact CB-CB 4.25Å; N466-L469 HydrophobicContact CB-CD1 4.2Å; N466-L469 HydrophobicContact CB-CG 4.45Å; N466-L469 PolarHBondContact OD1-N 3.04Å; N466-L469 VanDerWaalsContact OD1-N 3.08Å; N466-A470 WeakPolarHBondContact O-CB 3.2Å; N466-A470 PolarHBondContact O-N 2.97Å
467	Y	94.3	Very high	93	Very high	107 Å²	107	59.9 Å²	59.9	42%	0.42	30%	0.3	S	S	.	.	H	α-helix	trans	-69.2	-30.7	-175.6	-57.5	-64.1	0	0	0	113.9	L458 V465 A470 L471 I497	L458-Y467 HydrophobicContact CD1-CD1 3.83Å; L458-Y467 HydrophobicContact CD1-CE1 3.97Å; V465-Y467 HydrophobicContact CG1-CD1 4.28Å; V465-Y467 HydrophobicContact CG1-CD2 4.46Å; V465-Y467 HydrophobicContact CG1-CE1 3.74Å; V465-Y467 HydrophobicContact CG1-CE2 3.95Å; Y467-A470 PolarHBondContact O-N 3.14Å; Y467-L471 WeakPolarHBondContact O-CB 3.48Å; Y467-L471 PolarHBondContact O-N 3.38Å; Y467-I497 HydrophobicContact CD1-CG2 3.58Å; Y467-I497 HydrophobicContact CE1-CG2 3.46Å; Y467-I497 VanDerWaalsContact CE1-CG2 3.46Å; Y467-I497 HydrophobicContact CG-CG2 4.4Å
468	D	94.1	Very high	93	Very high	119 Å²	119	58 Å²	58	64%	0.636	30%	0.295	S	S	*	.	H	α-helix	trans	-69.4	-42.4	179.6	-63.6	-35.8	0	0	0	111.1	N466 K472	N466-D468 PolarHBondContact O-N 3.42Å; N466-D468 PolarHBondContact OD1-N 3.48Å; N466-D468 VanDerWaalsContact OD1-N 3.15Å; D468-K472 PolarHBondContact O-N 3.17Å
469	L	93.9	Very high	93.1	Very high	56 Å²	56	65 Å²	65	29%	0.293	33%	0.327	S	S	.	.	H	α-helix	trans	-66.6	-42.5	173.3	-72.1	177.7	0	0	0	111.1	Y457 N466 L471 K472 Y473	Y457-L469 HydrophobicContact CD1-CB 4.42Å; Y457-L469 HydrophobicContact CD1-CD1 4.29Å; Y457-L469 HydrophobicContact CD2-CB 4.17Å; Y457-L469 HydrophobicContact CE1-CD1 3.85Å; Y457-L469 HydrophobicContact CE2-CB 4.44Å; Y457-L469 HydrophobicContact CE2-CD1 4.44Å; Y457-L469 HydrophobicContact CG-CB 4.17Å; N466-L469 HydrophobicContact CB-CB 4.25Å; N466-L469 HydrophobicContact CB-CD1 4.2Å; N466-L469 HydrophobicContact CB-CG 4.45Å; N466-L469 PolarHBondContact OD1-N 3.04Å; N466-L469 VanDerWaalsContact OD1-N 3.08Å; L469-L471 VanDerWaalsContact C-N 3.34Å; L469-L471 PolarHBondContact O-N 3.32Å; L469-K472 PolarHBondContact O-N 2.97Å; L469-Y473 HydrophobicContact CB-CE2 4.47Å; L469-Y473 WeakPolarHBondContact O-CD2 3.32Å; L469-Y473 PolarHBondContact O-N 3.01Å
470	A	94.9	Very high	93.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-56.4	-49.5	176.3	0	0	0	0	0	111.3	G454 L458 N466 Y467 K472 Y473 F474	G454-A470 WeakPolarHBondContact O-CB 3.44Å; L458-A470 HydrophobicContact CB-CB 4.21Å; N466-A470 WeakPolarHBondContact O-CB 3.2Å; N466-A470 PolarHBondContact O-N 2.97Å; Y467-A470 PolarHBondContact O-N 3.14Å; A470-K472 VanDerWaalsContact C-N 3.34Å; A470-K472 PolarHBondContact O-N 3.26Å; A470-Y473 PolarHBondContact O-N 2.96Å; A470-F474 HydrophobicContact CB-CD2 4.34Å; A470-F474 HydrophobicContact CB-CE2 4.11Å; A470-F474 WeakPolarHBondContact O-CD2 3.41Å; A470-F474 WeakPolarHBondContact O-CG 3.45Å; A470-F474 PolarHBondContact O-N 3.11Å
471	L	95.2	Very high	93.3	Very high	30 Å²	30	66.2 Å²	66.2	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-56.6	-46.5	175.5	174.9	140.7	0	0	0	112.1	Y467 L469 Y473 F474 Q475 M492 V499	Y467-L471 WeakPolarHBondContact O-CB 3.48Å; Y467-L471 PolarHBondContact O-N 3.38Å; L469-L471 VanDerWaalsContact C-N 3.34Å; L469-L471 PolarHBondContact O-N 3.32Å; L471-Y473 VanDerWaalsContact C-N 3.31Å; L471-Y473 PolarHBondContact O-N 3.08Å; L471-F474 PolarHBondContact O-N 3.32Å; L471-Q475 VanDerWaalsContact CD2-CD 3.44Å; L471-Q475 HydrophobicContact CD2-CG 4.32Å; L471-Q475 HydrophobicContact CG-CG 4.35Å; L471-Q475 WeakPolarHBondContact O-CB 3.44Å; L471-Q475 VanDerWaalsContact O-CG 3.3Å; L471-Q475 WeakPolarHBondContact O-CG 3.5Å; L471-Q475 PolarHBondContact O-N 2.93Å; L471-M492 HydrophobicContact CB-CE 3.93Å; L471-V499 HydrophobicContact CD1-CB 4.48Å; L471-V499 HydrophobicContact CD1-CG1 2.99Å; L471-V499 HydrophobicContact CG-CG1 4.47Å
472	K	95.5	Very high	93.6	Very high	115 Å²	115	66.5 Å²	66.5	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-41.2	-179.8	-174.1	178	-176.9	176.9	0	111.9	D468 L469 A470 K476	D468-K472 PolarHBondContact O-N 3.17Å; L469-K472 PolarHBondContact O-N 2.97Å; A470-K472 VanDerWaalsContact C-N 3.34Å; A470-K472 PolarHBondContact O-N 3.26Å; K472-K476 WeakPolarHBondContact O-CG 3.47Å; K472-K476 PolarHBondContact O-N 3.16Å
473	Y	95.9	Very high	94	Very high	51 Å²	51	65.6 Å²	65.6	20%	0.2	33%	0.325	C	S	.	.	H	α-helix	trans	-73	-39.9	177.9	-74.4	-64.4	0	0	0	112.5	Q450 L453 Y457 L469 A470 L471 K476 A477	Q450-Y473 HydrophobicContact CG-CD1 4.48Å; Q450-Y473 WeakPolarHBondContact O-CB 3.01Å; L453-Y473 HydrophobicContact CB-CD2 4.3Å; L453-Y473 HydrophobicContact CB-CG 4.31Å; L453-Y473 HydrophobicContact CD1-CD1 4.37Å; L453-Y473 HydrophobicContact CD1-CE1 3.93Å; L453-Y473 HydrophobicContact CD1-CE2 4.49Å; Y457-Y473 AromaticContact CD2-CD2 3.99Å; Y457-Y473 HydrophobicContact CD2-CD2 3.99Å; Y457-Y473 AromaticContact CD2-CE2 3.97Å; Y457-Y473 HydrophobicContact CD2-CE2 3.97Å; Y457-Y473 HydrophobicContact CE2-CD2 4.12Å; Y457-Y473 AromaticContact CE2-CE2 3.61Å; Y457-Y473 HydrophobicContact CE2-CE2 3.61Å; L469-Y473 HydrophobicContact CB-CE2 4.47Å; L469-Y473 WeakPolarHBondContact O-CD2 3.32Å; L469-Y473 PolarHBondContact O-N 3.01Å; A470-Y473 PolarHBondContact O-N 2.96Å; L471-Y473 VanDerWaalsContact C-N 3.31Å; L471-Y473 PolarHBondContact O-N 3.08Å; Y473-K476 PolarHBondContact O-N 3.06Å; Y473-A477 PolarHBondContact O-N 3.33Å
474	F	95.7	Very high	93.9	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-37.9	175.5	-69.9	-48.1	0	0	0	112.7	S451 M455 L458 A470 L471 A477 A478 Q488 L489 M492	S451-F474 WeakPolarHBondContact O-CE1 3.3Å; M455-F474 HydrophobicContact SD-CZ 4.48Å; L458-F474 HydrophobicContact CB-CE2 4.31Å; L458-F474 HydrophobicContact CD2-CE2 4.11Å; L458-F474 HydrophobicContact CD2-CZ 4.3Å; A470-F474 HydrophobicContact CB-CD2 4.34Å; A470-F474 HydrophobicContact CB-CE2 4.11Å; A470-F474 WeakPolarHBondContact O-CD2 3.41Å; A470-F474 WeakPolarHBondContact O-CG 3.45Å; A470-F474 PolarHBondContact O-N 3.11Å; L471-F474 PolarHBondContact O-N 3.32Å; F474-A477 PolarHBondContact O-N 3.21Å; F474-A478 VanDerWaalsContact O-CB 3.22Å; F474-A478 WeakPolarHBondContact O-CB 3.35Å; F474-A478 PolarHBondContact O-N 3.39Å; F474-Q488 HydrophobicContact CD1-CB 3.91Å; F474-Q488 HydrophobicContact CD2-CB 4.29Å; F474-Q488 HydrophobicContact CE1-CB 3.65Å; F474-Q488 HydrophobicContact CE1-CG 3.9Å; F474-Q488 HydrophobicContact CE2-CB 4.05Å; F474-Q488 HydrophobicContact CG-CB 4.22Å; F474-Q488 HydrophobicContact CZ-CB 3.71Å; F474-Q488 HydrophobicContact CZ-CG 4.01Å; F474-L489 HydrophobicContact CB-CB 4.37Å; F474-L489 HydrophobicContact CB-CD1 4.48Å; F474-M492 HydrophobicContact CD2-SD 3.57Å; F474-M492 VanDerWaalsContact CD2-SD 3.57Å; F474-M492 HydrophobicContact CE2-SD 3.95Å
475	Q	95.1	Very high	93.9	Very high	59 Å²	59	57.2 Å²	57.2	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-60	-48.2	173.1	-77.3	177.4	-16.9	0	0	111.5	L471 A477 A478 E479 L489	L471-Q475 VanDerWaalsContact CD2-CD 3.44Å; L471-Q475 HydrophobicContact CD2-CG 4.32Å; L471-Q475 HydrophobicContact CG-CG 4.35Å; L471-Q475 WeakPolarHBondContact O-CB 3.44Å; L471-Q475 VanDerWaalsContact O-CG 3.3Å; L471-Q475 WeakPolarHBondContact O-CG 3.5Å; L471-Q475 PolarHBondContact O-N 2.93Å; Q475-A477 VanDerWaalsContact C-N 3.32Å; Q475-A477 PolarHBondContact O-N 2.92Å; Q475-A478 PolarHBondContact O-N 3.22Å; Q475-E479 WeakPolarHBondContact O-CB 3.27Å; Q475-E479 VanDerWaalsContact O-CG 3.29Å; Q475-E479 WeakPolarHBondContact O-CG 3.44Å; Q475-E479 PolarHBondContact O-N 3.5Å; Q475-L489 HydrophobicContact CG-CD1 4.09Å; Q475-L489 HydrophobicContact CG-CD2 3.98Å
476	K	95.5	Very high	94	Very high	83 Å²	83	54.5 Å²	54.5	36%	0.361	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-41.6	176.2	-71.9	176.7	173.5	-168.4	0	112.7	Q450 K472 Y473 Q480	Q450-K476 VanDerWaalsContact OE1-CB 3.27Å; K472-K476 WeakPolarHBondContact O-CG 3.47Å; K472-K476 PolarHBondContact O-N 3.16Å; Y473-K476 PolarHBondContact O-N 3.06Å; K476-Q480 WeakPolarHBondContact O-CG 3.26Å; K476-Q480 PolarHBondContact O-N 3.3Å
477	A	94.9	Very high	93.9	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-41.8	177.1	0	0	0	0	0	111.6	P447 Q450 Y473 F474 Q475 Q480 G481 W482	P447-A477 HydrophobicContact CB-CB 4.41Å; Q450-A477 HydrophobicContact CB-CB 4.16Å; Y473-A477 PolarHBondContact O-N 3.33Å; F474-A477 PolarHBondContact O-N 3.21Å; Q475-A477 VanDerWaalsContact C-N 3.32Å; Q475-A477 PolarHBondContact O-N 2.92Å; A477-Q480 PolarHBondContact O-N 3.41Å; A477-G481 PolarHBondContact O-N 3.06Å; A477-W482 HydrophobicContact CB-CB 4.39Å; A477-W482 WeakPolarHBondContact O-CB 3.48Å; A477-W482 PolarHBondContact O-N 3.14Å
478	A	94.3	Very high	93.9	Very high	10 Å²	10	48.1 Å²	48.1	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-37.2	-179.9	0	0	0	0	0	113	F474 Q475 Q480 G481 Q486 L489 Y509	F474-A478 VanDerWaalsContact O-CB 3.22Å; F474-A478 WeakPolarHBondContact O-CB 3.35Å; F474-A478 PolarHBondContact O-N 3.39Å; Q475-A478 PolarHBondContact O-N 3.22Å; A478-Q480 VanDerWaalsContact C-N 3.25Å; A478-Q480 PolarHBondContact O-N 3.45Å; A478-G481 WeakPolarHBondContact O-CA 3.47Å; A478-G481 PolarHBondContact O-N 3.01Å; A478-Q486 HydrophobicContact CB-CG 3.76Å; A478-L489 HydrophobicContact CB-CD2 3.97Å; A478-Y509 HydrophobicContact CB-CE1 4.47Å
479	E	93.9	Very high	93.9	Very high	159 Å²	159	42.4 Å²	42.4	74%	0.743	21%	0.209	S	C	*	.	H	α-helix	trans	-62.5	-32.3	173.7	-76.2	170.5	-176.1	0	0	112.3	Q475 G481	Q475-E479 WeakPolarHBondContact O-CB 3.27Å; Q475-E479 VanDerWaalsContact O-CG 3.29Å; Q475-E479 WeakPolarHBondContact O-CG 3.44Å; Q475-E479 PolarHBondContact O-N 3.5Å; E479-G481 PolarHBondContact O-N 2.98Å
480	Q	93.4	Very high	93.9	Very high	102 Å²	102	39.8 Å²	39.8	48%	0.477	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	3	172.5	-65.7	-176.3	50.8	0	0	113.4	G445 P447 K476 A477 A478	G445-Q480 PolarHBondContact O-NE2 3.04Å; G445-Q480 VanDerWaalsContact O-NE2 3.09Å; G445-Q480 PolarHBondContact O-OE1 3.4Å; P447-Q480 HydrophobicContact CB-CB 3.97Å; P447-Q480 HydrophobicContact CG-CB 4.41Å; K476-Q480 WeakPolarHBondContact O-CG 3.26Å; K476-Q480 PolarHBondContact O-N 3.3Å; A477-Q480 PolarHBondContact O-N 3.41Å; A478-Q480 VanDerWaalsContact C-N 3.25Å; A478-Q480 PolarHBondContact O-N 3.45Å
481	G	90.8	Very high	93.8	Very high	42 Å²	42	40.7 Å²	40.7	43%	0.433	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	13.7	179.2	0	0	0	0	0	114.7	A477 A478 E479 V483	A477-G481 PolarHBondContact O-N 3.06Å; A478-G481 WeakPolarHBondContact O-CA 3.47Å; A478-G481 PolarHBondContact O-N 3.01Å; E479-G481 PolarHBondContact O-N 2.98Å; G481-V483 PolarHBondContact O-N 3.23Å
482	W	92.2	Very high	93.8	Very high	68 Å²	68	39.3 Å²	39.3	26%	0.258	20%	0.195	S	C	.	.			trans	-75.3	123.1	179.8	-175.6	-109.4	0	0	0	112.1	P447 V448 A477 D484 G485 Q486	P447-W482 HydrophobicContact CB-CB 3.74Å; P447-W482 HydrophobicContact CB-CG 4.24Å; P447-W482 HydrophobicContact CG-CB 4.33Å; V448-W482 HydrophobicContact CB-CZ2 4.34Å; V448-W482 HydrophobicContact CG1-CZ2 4.11Å; V448-W482 HydrophobicContact CG2-CD2 4.02Å; V448-W482 HydrophobicContact CG2-CE3 4.01Å; V448-W482 HydrophobicContact CG2-CH2 3.65Å; V448-W482 HydrophobicContact CG2-CZ2 3.65Å; V448-W482 HydrophobicContact CG2-CZ3 3.82Å; A477-W482 HydrophobicContact CB-CB 4.39Å; A477-W482 WeakPolarHBondContact O-CB 3.48Å; A477-W482 PolarHBondContact O-N 3.14Å; W482-D484 WeakPolarHBondContact CZ2-OD2 3.48Å; W482-D484 PolarHBondContact NE1-OD2 3.12Å; W482-D484 PolarHBondContact O-N 3.13Å; W482-G485 PolarHBondContact O-N 3.11Å; W482-Q486 WeakPolarHBondContact O-CG 3.33Å; W482-Q486 PolarHBondContact O-N 2.85Å
483	V	91.8	Very high	93.8	Very high	31 Å²	31	35.4 Å²	35.4	19%	0.188	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-43.2	-167.3	-174.4	0	0	0	0	112.4	G481 G485 Q486 L487 A513 H518	G481-V483 PolarHBondContact O-N 3.23Å; V483-G485 VanDerWaalsContact C-N 3.29Å; V483-G485 PolarHBondContact O-N 3.17Å; V483-Q486 PolarHBondContact O-N 3.36Å; V483-L487 PolarHBondContact O-N 2.64Å; V483-A513 HydrophobicContact CG1-CB 4.07Å; V483-A513 WeakPolarHBondContact CG1-O 3.44Å; V483-H518 HydrophobicContact CG1-CB 3.45Å; V483-H518 VanDerWaalsContact CG1-CB 3.45Å
484	D	89.6	Confident	93.8	Very high	39 Å²	39	35.3 Å²	35.3	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-36.3	178.1	-54.1	-29.1	0	0	0	111.2	W482 L487 Q488 H518	W482-D484 WeakPolarHBondContact CZ2-OD2 3.48Å; W482-D484 PolarHBondContact NE1-OD2 3.12Å; W482-D484 PolarHBondContact O-N 3.13Å; D484-L487 PolarHBondContact O-N 3.06Å; D484-Q488 WeakPolarHBondContact O-CG 3.49Å; D484-Q488 PolarHBondContact O-N 3.27Å; D484-H518 IonicContact OD1-CD2 2.78Å; D484-H518 PolarHBondContact OD1-CD2 3.2Å; D484-H518 VanDerWaalsContact OD1-CD2 3.3Å; D484-H518 IonicContact OD1-NE2 3.27Å; D484-H518 PolarHBondContact OD1-NE2 2.9Å
485	G	92.4	Very high	93.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-43.3	176.9	0	0	0	0	0	111.6	W482 V483 L489	W482-G485 PolarHBondContact O-N 3.11Å; V483-G485 VanDerWaalsContact C-N 3.29Å; V483-G485 PolarHBondContact O-N 3.17Å; G485-L489 VanDerWaalsContact O-CB 3.26Å; G485-L489 WeakPolarHBondContact O-CB 3.25Å; G485-L489 PolarHBondContact O-N 3.42Å
486	Q	94.9	Very high	93.5	Very high	15 Å²	15	36 Å²	36	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-44.9	173.7	-67.7	170.4	-6.3	0	0	111.7	A478 W482 V483 L489 G490 Y509 L512 A513	A478-Q486 HydrophobicContact CB-CG 3.76Å; W482-Q486 WeakPolarHBondContact O-CG 3.33Å; W482-Q486 PolarHBondContact O-N 2.85Å; V483-Q486 PolarHBondContact O-N 3.36Å; Q486-L489 PolarHBondContact O-N 3.08Å; Q486-G490 PolarHBondContact O-N 2.89Å; Q486-Y509 WeakPolarHBondContact O-CB 3.33Å; Q486-L512 VanDerWaalsContact OE1-C 3.24Å; Q486-L512 PolarHBondContact OE1-O 3.31Å; Q486-A513 HydrophobicContact CB-CB 4.03Å
487	L	93.8	Very high	93.3	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-50.1	177.7	175.8	73.8	0	0	0	111.6	V483 D484 L489 G490 S491 F510 A513 H518 L520 A521	V483-L487 PolarHBondContact O-N 2.64Å; D484-L487 PolarHBondContact O-N 3.06Å; L487-L489 VanDerWaalsContact C-N 3.35Å; L487-G490 PolarHBondContact O-N 2.59Å; L487-S491 PolarHBondContact O-N 3.48Å; L487-F510 HydrophobicContact CD1-CD1 4.07Å; L487-F510 HydrophobicContact CD1-CE1 3.99Å; L487-A513 HydrophobicContact CB-CB 4.33Å; L487-H518 WeakPolarHBondContact CD2-CE1 3.38Å; L487-L520 HydrophobicContact CD1-CB 4.05Å; L487-L520 HydrophobicContact CD2-CB 3.87Å; L487-L520 HydrophobicContact CD2-CD1 4.14Å; L487-A521 HydrophobicContact CD1-CB 3.99Å
488	Q	93.5	Very high	92.9	Very high	26 Å²	26	35.9 Å²	35.9	12%	0.121	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-39.4	-178.2	-66.3	-53.9	-28.1	0	0	111.7	M455 F474 D484 G490 S491 M492	M455-Q488 HydrophobicContact CE-CG 3.63Å; F474-Q488 HydrophobicContact CD1-CB 3.91Å; F474-Q488 HydrophobicContact CD2-CB 4.29Å; F474-Q488 HydrophobicContact CE1-CB 3.65Å; F474-Q488 HydrophobicContact CE1-CG 3.9Å; F474-Q488 HydrophobicContact CE2-CB 4.05Å; F474-Q488 HydrophobicContact CG-CB 4.22Å; F474-Q488 HydrophobicContact CZ-CB 3.71Å; F474-Q488 HydrophobicContact CZ-CG 4.01Å; D484-Q488 WeakPolarHBondContact O-CG 3.49Å; D484-Q488 PolarHBondContact O-N 3.27Å; Q488-G490 VanDerWaalsContact C-N 3.32Å; Q488-G490 PolarHBondContact O-N 3.02Å; Q488-S491 WeakPolarHBondContact O-CB 3.47Å; Q488-S491 PolarHBondContact O-N 3.22Å; Q488-M492 WeakPolarHBondContact O-CG 3.32Å; Q488-M492 PolarHBondContact O-N 3.47Å
489	L	94	Very high	92.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-42.1	173.7	-170	58.9	0	0	0	111.5	F474 Q475 A478 G485 Q486 L487 S491 M492 Y493 Y509	F474-L489 HydrophobicContact CB-CB 4.37Å; F474-L489 HydrophobicContact CB-CD1 4.48Å; Q475-L489 HydrophobicContact CG-CD1 4.09Å; Q475-L489 HydrophobicContact CG-CD2 3.98Å; A478-L489 HydrophobicContact CB-CD2 3.97Å; G485-L489 VanDerWaalsContact O-CB 3.26Å; G485-L489 WeakPolarHBondContact O-CB 3.25Å; G485-L489 PolarHBondContact O-N 3.42Å; Q486-L489 PolarHBondContact O-N 3.08Å; L487-L489 VanDerWaalsContact C-N 3.35Å; L489-S491 PolarHBondContact O-N 3.17Å; L489-M492 PolarHBondContact O-N 3.32Å; L489-Y493 HydrophobicContact CD1-CD2 4.21Å; L489-Y493 HydrophobicContact CD1-CE2 3.66Å; L489-Y493 HydrophobicContact CD2-CE2 4.49Å; L489-Y493 HydrophobicContact CG-CD2 4.11Å; L489-Y493 HydrophobicContact CG-CE2 3.79Å; L489-Y493 WeakPolarHBondContact O-CD2 3.36Å; L489-Y493 PolarHBondContact O-N 3.28Å; L489-Y493 VanDerWaalsContact O-N 3.1Å; L489-Y509 HydrophobicContact CD2-CD1 4.1Å; L489-Y509 HydrophobicContact CD2-CD2 4.06Å; L489-Y509 HydrophobicContact CD2-CE1 3.63Å; L489-Y509 HydrophobicContact CD2-CE2 3.56Å; L489-Y509 HydrophobicContact CD2-CG 4.31Å; L489-Y509 HydrophobicContact CG-CD2 3.95Å; L489-Y509 HydrophobicContact CG-CE2 3.78Å; L489-Y509 HydrophobicContact CG-CG 4.39Å
490	G	94.6	Very high	92.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-43.7	172.1	0	0	0	0	0	112.7	Q486 L487 Q488 Y493 Y494 A506 F510	Q486-G490 PolarHBondContact O-N 2.89Å; L487-G490 PolarHBondContact O-N 2.59Å; Q488-G490 VanDerWaalsContact C-N 3.32Å; Q488-G490 PolarHBondContact O-N 3.02Å; G490-Y493 PolarHBondContact O-N 2.93Å; G490-Y494 VanDerWaalsContact O-CB 3.28Å; G490-Y494 WeakPolarHBondContact O-CB 3.39Å; G490-Y494 PolarHBondContact O-N 3.12Å; G490-A506 WeakPolarHBondContact O-CB 3.15Å; G490-F510 VanDerWaalsContact C-CZ 3.41Å
491	S	93.6	Very high	92.9	Very high	19 Å²	19	40.5 Å²	40.5	13%	0.133	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-41.5	176.3	-173.4	0	0	0	0	112.4	L487 Q488 L489 Y494 N495	L487-S491 PolarHBondContact O-N 3.48Å; Q488-S491 WeakPolarHBondContact O-CB 3.47Å; Q488-S491 PolarHBondContact O-N 3.22Å; L489-S491 PolarHBondContact O-N 3.17Å; S491-Y494 PolarHBondContact O-N 2.99Å; S491-N495 WeakPolarHBondContact O-CB 3.09Å; S491-N495 PolarHBondContact O-N 3.05Å; S491-N495 PolarHBondContact O-ND2 3.22Å; S491-N495 PolarHBondContact OG-ND2 2.88Å
492	M	94.4	Very high	93.1	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-46.3	175.3	-71.7	-179	74.9	0	0	111.5	L471 F474 Q488 L489 G496 I497 V499	L471-M492 HydrophobicContact CB-CE 3.93Å; F474-M492 HydrophobicContact CD2-SD 3.57Å; F474-M492 VanDerWaalsContact CD2-SD 3.57Å; F474-M492 HydrophobicContact CE2-SD 3.95Å; Q488-M492 WeakPolarHBondContact O-CG 3.32Å; Q488-M492 PolarHBondContact O-N 3.47Å; L489-M492 PolarHBondContact O-N 3.32Å; M492-G496 CarbonylContact O-C 3.56Å; M492-G496 VanDerWaalsContact O-CA 3.27Å; M492-G496 WeakPolarHBondContact O-CA 3.35Å; M492-G496 PolarHBondContact O-N 2.91Å; M492-I497 WeakPolarHBondContact CE-O 3.5Å; M492-I497 PolarHBondContact O-N 2.76Å; M492-V499 HydrophobicContact CB-CG2 4.23Å; M492-V499 WeakPolarHBondContact O-CG2 3.45Å
493	Y	95.8	Very high	93.2	Very high	33 Å²	33	41 Å²	41	13%	0.129	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-34.8	176.9	-77.3	-64.9	0	0	0	113.5	L489 G490 V499 R501 D502 Q505 Y509	L489-Y493 HydrophobicContact CD1-CD2 4.21Å; L489-Y493 HydrophobicContact CD1-CE2 3.66Å; L489-Y493 HydrophobicContact CD2-CE2 4.49Å; L489-Y493 HydrophobicContact CG-CD2 4.11Å; L489-Y493 HydrophobicContact CG-CE2 3.79Å; L489-Y493 WeakPolarHBondContact O-CD2 3.36Å; L489-Y493 PolarHBondContact O-N 3.28Å; L489-Y493 VanDerWaalsContact O-N 3.1Å; G490-Y493 PolarHBondContact O-N 2.93Å; Y493-V499 HydrophobicContact CD1-CB 4.2Å; Y493-V499 HydrophobicContact CD1-CG2 3.7Å; Y493-V499 HydrophobicContact CE1-CB 4.06Å; Y493-V499 HydrophobicContact CE1-CG1 4.17Å; Y493-V499 HydrophobicContact CE1-CG2 4.02Å; Y493-V499 HydrophobicContact CG-CG2 4.22Å; Y493-R501 WeakPolarHBondContact O-CA 3.44Å; Y493-D502 HydrophobicContact CD1-CB 4.2Å; Y493-D502 PolarHBondContact O-N 3.37Å; Y493-Q505 HydrophobicContact CD1-CB 4.09Å; Y493-Q505 HydrophobicContact CD1-CG 4.28Å; Y493-Q505 HydrophobicContact CD2-CB 4.11Å; Y493-Q505 HydrophobicContact CD2-CG 3.88Å; Y493-Q505 HydrophobicContact CE1-CB 4.44Å; Y493-Q505 HydrophobicContact CE1-CG 4.18Å; Y493-Q505 HydrophobicContact CE2-CB 4.46Å; Y493-Q505 HydrophobicContact CE2-CG 3.78Å; Y493-Q505 HydrophobicContact CG-CB 3.93Å; Y493-Q505 HydrophobicContact CG-CG 4.16Å; Y493-Y509 AromaticContact CD2-CD2 3.96Å; Y493-Y509 HydrophobicContact CD2-CD2 3.96Å; Y493-Y509 AromaticContact CD2-CE2 3.92Å; Y493-Y509 HydrophobicContact CD2-CE2 3.92Å; Y493-Y509 HydrophobicContact CE2-CD2 4.15Å; Y493-Y509 AromaticContact CE2-CE2 3.63Å; Y493-Y509 HydrophobicContact CE2-CE2 3.63Å
494	Y	94.9	Very high	93.3	Very high	49 Å²	49	47.3 Å²	47.3	19%	0.192	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-47.2	178.6	-177.8	-97	0	0	0	111.8	G490 S491 R501 Y503 F510 M528	G490-Y494 VanDerWaalsContact O-CB 3.28Å; G490-Y494 WeakPolarHBondContact O-CB 3.39Å; G490-Y494 PolarHBondContact O-N 3.12Å; S491-Y494 PolarHBondContact O-N 2.99Å; Y494-R501 WeakPolarHBondContact O-CD 3.18Å; Y494-R501 WeakPolarHBondContact O-CG 3.43Å; Y494-Y503 AromaticContact CD2-CD1 3.84Å; Y494-Y503 HydrophobicContact CD2-CD1 3.84Å; Y494-Y503 AromaticContact CD2-CE1 3.97Å; Y494-Y503 HydrophobicContact CD2-CE1 3.97Å; Y494-Y503 HydrophobicContact CE2-CD1 4.16Å; Y494-Y503 HydrophobicContact CE2-CE1 4.04Å; Y494-F510 HydrophobicContact CD2-CE2 4.25Å; Y494-F510 HydrophobicContact CG-CE2 4.26Å; Y494-M528 HydrophobicContact CD2-CG 4.17Å; Y494-M528 HydrophobicContact CD2-SD 4.05Å; Y494-M528 HydrophobicContact CE2-CG 3.69Å; Y494-M528 HydrophobicContact CE2-SD 4.19Å
495	N	92.8	Very high	93.5	Very high	42 Å²	42	48.5 Å²	48.5	23%	0.225	24%	0.236	C	C	.	.	H	α-helix	trans	-84.5	-21.2	-178.8	-66.5	-42.4	0	0	0	113.2	S491 I497	S491-N495 WeakPolarHBondContact O-CB 3.09Å; S491-N495 PolarHBondContact O-N 3.05Å; S491-N495 PolarHBondContact O-ND2 3.22Å; S491-N495 PolarHBondContact OG-ND2 2.88Å; N495-I497 HydrophobicContact CB-CD1 3.8Å; N495-I497 HydrophobicContact CB-CG1 3.82Å
496	G	92.3	Very high	93.7	Very high	30 Å²	30	48.5 Å²	48.5	31%	0.309	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	34.8	-173.4	0	0	0	0	0	113.6	M492 V499	M492-G496 CarbonylContact O-C 3.56Å; M492-G496 VanDerWaalsContact O-CA 3.27Å; M492-G496 WeakPolarHBondContact O-CA 3.35Å; M492-G496 PolarHBondContact O-N 2.91Å; G496-V499 CarbonylContact C-O 3.24Å; G496-V499 VanDerWaalsContact CA-O 3.25Å; G496-V499 WeakPolarHBondContact CA-O 3.46Å
497	I	90.6	Very high	93.7	Very high	47 Å²	47	49.3 Å²	49.3	24%	0.241	24%	0.24	C	C	.	.	S	Bend	trans	-88.9	115.5	179.9	-60.1	168.2	0	0	0	108.6	L458 Y467 M492 N495 V499	L458-I497 HydrophobicContact CD1-CG2 3.91Å; Y467-I497 HydrophobicContact CD1-CG2 3.58Å; Y467-I497 HydrophobicContact CE1-CG2 3.46Å; Y467-I497 VanDerWaalsContact CE1-CG2 3.46Å; Y467-I497 HydrophobicContact CG-CG2 4.4Å; M492-I497 WeakPolarHBondContact CE-O 3.5Å; M492-I497 PolarHBondContact O-N 2.76Å; N495-I497 HydrophobicContact CB-CD1 3.8Å; N495-I497 HydrophobicContact CB-CG1 3.82Å; I497-V499 PolarHBondContact O-N 3.25Å
498	G	87.3	Confident	93.7	Very high	35 Å²	35	54.7 Å²	54.7	36%	0.361	26%	0.264	S	S	.	.	S	Bend	trans	70.6	-7.7	-177.7	0	0	0	0	0	115.5
499	V	93.4	Very high	93.8	Very high	28 Å²	28	55.1 Å²	55.1	17%	0.17	26%	0.264	C	S	.	.	S	Bend	trans	-137.8	157.7	179.6	-69.7	0	0	0	0	111	L471 M492 Y493 G496 I497 R501	L471-V499 HydrophobicContact CD1-CB 4.48Å; L471-V499 HydrophobicContact CD1-CG1 2.99Å; L471-V499 HydrophobicContact CG-CG1 4.47Å; M492-V499 HydrophobicContact CB-CG2 4.23Å; M492-V499 WeakPolarHBondContact O-CG2 3.45Å; Y493-V499 HydrophobicContact CD1-CB 4.2Å; Y493-V499 HydrophobicContact CD1-CG2 3.7Å; Y493-V499 HydrophobicContact CE1-CB 4.06Å; Y493-V499 HydrophobicContact CE1-CG1 4.17Å; Y493-V499 HydrophobicContact CE1-CG2 4.02Å; Y493-V499 HydrophobicContact CG-CG2 4.22Å; G496-V499 CarbonylContact C-O 3.24Å; G496-V499 VanDerWaalsContact CA-O 3.25Å; G496-V499 WeakPolarHBondContact CA-O 3.46Å; I497-V499 PolarHBondContact O-N 3.25Å; V499-R501 PolarHBondContact O-N 3.27Å
500	K	93.4	Very high	93.9	Very high	192 Å²	192	55.1 Å²	55.1	84%	0.835	26%	0.264	S	S	*	.			trans	-62.9	131.5	166.7	-171.9	176.2	179.8	-179.8	0	109.1	D502	K500-D502 PolarHBondContact O-N 3.06Å
501	R	94.5	Very high	93.9	Very high	148 Å²	148	58.1 Å²	58.1	56%	0.558	28%	0.28	S	S	*	.			trans	-56.4	123.2	177.6	-170.4	174.5	68.7	173	0.4	110.8	Y493 Y494 V499 Y503	Y493-R501 WeakPolarHBondContact O-CA 3.44Å; Y494-R501 WeakPolarHBondContact O-CD 3.18Å; Y494-R501 WeakPolarHBondContact O-CG 3.43Å; V499-R501 PolarHBondContact O-N 3.27Å; R501-Y503 WeakPolarHBondContact CD-OH 3.19Å; R501-Y503 HydrophobicContact CG-CE1 4.09Å; R501-Y503 PolarHBondContact NE-OH 3.25Å; R501-Y503 PolarHBondContact NH1-OH 3.42Å
502	D	95.1	Very high	94	Very high	61 Å²	61	60.2 Å²	60.2	33%	0.326	29%	0.29	S	S	.	.			trans	-142.6	102.1	178.6	-170.1	-24	0	0	0	110.4	Y493 K500 K504 Q505 A506	Y493-D502 HydrophobicContact CD1-CB 4.2Å; Y493-D502 PolarHBondContact O-N 3.37Å; K500-D502 PolarHBondContact O-N 3.06Å; D502-K504 VanDerWaalsContact C-N 3.3Å; D502-K504 PolarHBondContact O-N 3.32Å; D502-K504 WeakPolarHBondContact OD1-CB 3.45Å; D502-K504 PolarHBondContact OD1-N 3.18Å; D502-Q505 HydrophobicContact CB-CB 4.04Å; D502-Q505 PolarHBondContact O-N 3.11Å; D502-Q505 PolarHBondContact OD1-N 3.44Å; D502-A506 PolarHBondContact O-N 3.31Å
503	Y	95.1	Very high	93.9	Very high	58 Å²	58	60.1 Å²	60.1	23%	0.227	29%	0.289	C	S	.	.	H	α-helix	trans	-69.9	-25.2	-178.7	-58.9	-58.9	0	0	0	113.7	Y494 R501 L507	Y494-Y503 AromaticContact CD2-CD1 3.84Å; Y494-Y503 HydrophobicContact CD2-CD1 3.84Å; Y494-Y503 AromaticContact CD2-CE1 3.97Å; Y494-Y503 HydrophobicContact CD2-CE1 3.97Å; Y494-Y503 HydrophobicContact CE2-CD1 4.16Å; Y494-Y503 HydrophobicContact CE2-CE1 4.04Å; R501-Y503 WeakPolarHBondContact CD-OH 3.19Å; R501-Y503 HydrophobicContact CG-CE1 4.09Å; R501-Y503 PolarHBondContact NE-OH 3.25Å; R501-Y503 PolarHBondContact NH1-OH 3.42Å; Y503-L507 VanDerWaalsContact O-CB 3.31Å; Y503-L507 WeakPolarHBondContact O-CB 3.45Å; Y503-L507 PolarHBondContact O-N 2.99Å
504	K	94.1	Very high	93.7	Very high	164 Å²	164	59.3 Å²	59.3	71%	0.713	29%	0.288	S	S	*	.	H	α-helix	trans	-70.5	-43.1	177.8	-66.5	-178.6	177.9	-179.1	0	109.9	D502 L507 K508	D502-K504 VanDerWaalsContact C-N 3.3Å; D502-K504 PolarHBondContact O-N 3.32Å; D502-K504 WeakPolarHBondContact OD1-CB 3.45Å; D502-K504 PolarHBondContact OD1-N 3.18Å; K504-L507 PolarHBondContact O-N 2.87Å; K504-K508 PolarHBondContact O-N 3.16Å; K504-K508 VanDerWaalsContact O-N 3.09Å
505	Q	93.4	Very high	93.6	Very high	65 Å²	65	64.5 Å²	64.5	30%	0.304	31%	0.314	S	S	.	.	H	α-helix	trans	-64.9	-42.7	175.1	-146.3	87.8	12.9	0	0	111.1	Y493 D502 K508 Y509	Y493-Q505 HydrophobicContact CD1-CB 4.09Å; Y493-Q505 HydrophobicContact CD1-CG 4.28Å; Y493-Q505 HydrophobicContact CD2-CB 4.11Å; Y493-Q505 HydrophobicContact CD2-CG 3.88Å; Y493-Q505 HydrophobicContact CE1-CB 4.44Å; Y493-Q505 HydrophobicContact CE1-CG 4.18Å; Y493-Q505 HydrophobicContact CE2-CB 4.46Å; Y493-Q505 HydrophobicContact CE2-CG 3.78Å; Y493-Q505 HydrophobicContact CG-CB 3.93Å; Y493-Q505 HydrophobicContact CG-CG 4.16Å; D502-Q505 HydrophobicContact CB-CB 4.04Å; D502-Q505 PolarHBondContact O-N 3.11Å; D502-Q505 PolarHBondContact OD1-N 3.44Å; Q505-K508 WeakPolarHBondContact O-CB 3.2Å; Q505-K508 PolarHBondContact O-N 3.28Å; Q505-Y509 HydrophobicContact CG-CD2 4.21Å; Q505-Y509 HydrophobicContact CG-CE2 3.72Å; Q505-Y509 WeakPolarHBondContact O-CD2 3.19Å; Q505-Y509 PolarHBondContact O-N 3.38Å; Q505-Y509 VanDerWaalsContact O-N 3.13Å
506	A	95.4	Very high	93.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.7	-48.4	175.5	0	0	0	0	0	112	G490 D502 K508 Y509 F510	G490-A506 WeakPolarHBondContact O-CB 3.15Å; D502-A506 PolarHBondContact O-N 3.31Å; A506-K508 VanDerWaalsContact C-N 3.31Å; A506-K508 PolarHBondContact O-N 2.89Å; A506-Y509 PolarHBondContact O-N 3.11Å; A506-F510 HydrophobicContact CB-CD2 4.38Å; A506-F510 HydrophobicContact CB-CE2 4.13Å; A506-F510 WeakPolarHBondContact O-CB 3.12Å; A506-F510 VanDerWaalsContact O-CD2 3.31Å; A506-F510 WeakPolarHBondContact O-CD2 3.46Å; A506-F510 WeakPolarHBondContact O-CG 3.45Å; A506-F510 PolarHBondContact O-N 2.6Å
507	L	95.3	Very high	92.9	Very high	32 Å²	32	64.6 Å²	64.6	17%	0.168	33%	0.326	C	S	.	.	H	α-helix	trans	-57.3	-44	177.3	-173.4	75.7	0	0	0	111.7	Y503 K504 Y509 F510 N511 L525 M528 V535	Y503-L507 VanDerWaalsContact O-CB 3.31Å; Y503-L507 WeakPolarHBondContact O-CB 3.45Å; Y503-L507 PolarHBondContact O-N 2.99Å; K504-L507 PolarHBondContact O-N 2.87Å; L507-Y509 PolarHBondContact O-N 3.33Å; L507-F510 PolarHBondContact O-N 3.05Å; L507-N511 WeakPolarHBondContact O-CB 3.47Å; L507-N511 PolarHBondContact O-N 3.42Å; L507-N511 PolarHBondContact O-ND2 2.78Å; L507-L525 HydrophobicContact CD1-CD2 3.71Å; L507-M528 HydrophobicContact CB-CE 3.94Å; L507-M528 HydrophobicContact CD1-CE 4.01Å; L507-M528 HydrophobicContact CD1-SD 4.32Å; L507-V535 HydrophobicContact CD1-CG1 3.55Å; L507-V535 HydrophobicContact CD2-CG1 3.25Å; L507-V535 HydrophobicContact CG-CG1 4Å
508	K	94.9	Very high	92.8	Very high	118 Å²	118	64.2 Å²	64.2	51%	0.513	32%	0.323	S	S	.	.	H	α-helix	trans	-57.1	-51.3	177.2	-178.6	-174.3	177.1	-175.2	0	111.2	K504 Q505 A506 N511 L512	K504-K508 PolarHBondContact O-N 3.16Å; K504-K508 VanDerWaalsContact O-N 3.09Å; Q505-K508 WeakPolarHBondContact O-CB 3.2Å; Q505-K508 PolarHBondContact O-N 3.28Å; A506-K508 VanDerWaalsContact C-N 3.31Å; A506-K508 PolarHBondContact O-N 2.89Å; K508-N511 PolarHBondContact O-N 2.88Å; K508-L512 HydrophobicContact CG-CD1 4.43Å; K508-L512 WeakPolarHBondContact O-CG 3.49Å; K508-L512 PolarHBondContact O-N 3.12Å; K508-L512 VanDerWaalsContact O-N 3.08Å
509	Y	95.6	Very high	93	Very high	35 Å²	35	64.2 Å²	64.2	14%	0.137	31%	0.314	C	S	.	.	H	α-helix	trans	-71.1	-36.1	-177.6	-71.3	-60.5	0	0	0	113	A478 Q486 L489 Y493 Q505 A506 L507 N511 L512 A513	A478-Y509 HydrophobicContact CB-CE1 4.47Å; Q486-Y509 WeakPolarHBondContact O-CB 3.33Å; L489-Y509 HydrophobicContact CD2-CD1 4.1Å; L489-Y509 HydrophobicContact CD2-CD2 4.06Å; L489-Y509 HydrophobicContact CD2-CE1 3.63Å; L489-Y509 HydrophobicContact CD2-CE2 3.56Å; L489-Y509 HydrophobicContact CD2-CG 4.31Å; L489-Y509 HydrophobicContact CG-CD2 3.95Å; L489-Y509 HydrophobicContact CG-CE2 3.78Å; L489-Y509 HydrophobicContact CG-CG 4.39Å; Y493-Y509 AromaticContact CD2-CD2 3.96Å; Y493-Y509 HydrophobicContact CD2-CD2 3.96Å; Y493-Y509 AromaticContact CD2-CE2 3.92Å; Y493-Y509 HydrophobicContact CD2-CE2 3.92Å; Y493-Y509 HydrophobicContact CE2-CD2 4.15Å; Y493-Y509 AromaticContact CE2-CE2 3.63Å; Y493-Y509 HydrophobicContact CE2-CE2 3.63Å; Q505-Y509 HydrophobicContact CG-CD2 4.21Å; Q505-Y509 HydrophobicContact CG-CE2 3.72Å; Q505-Y509 WeakPolarHBondContact O-CD2 3.19Å; Q505-Y509 PolarHBondContact O-N 3.38Å; Q505-Y509 VanDerWaalsContact O-N 3.13Å; A506-Y509 PolarHBondContact O-N 3.11Å; L507-Y509 PolarHBondContact O-N 3.33Å; Y509-N511 VanDerWaalsContact C-N 3.34Å; Y509-L512 HydrophobicContact CD1-CD1 4.2Å; Y509-L512 PolarHBondContact O-N 3.36Å; Y509-A513 WeakPolarHBondContact O-CB 3.36Å; Y509-A513 PolarHBondContact O-N 3.43Å
510	F	95.5	Very high	92.9	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.2	-36.2	173.7	-67.3	-37.1	0	0	0	112.4	L487 G490 Y494 A506 L507 A513 S514 N524 L525 M528	L487-F510 HydrophobicContact CD1-CD1 4.07Å; L487-F510 HydrophobicContact CD1-CE1 3.99Å; G490-F510 VanDerWaalsContact C-CZ 3.41Å; Y494-F510 HydrophobicContact CD2-CE2 4.25Å; Y494-F510 HydrophobicContact CG-CE2 4.26Å; A506-F510 HydrophobicContact CB-CD2 4.38Å; A506-F510 HydrophobicContact CB-CE2 4.13Å; A506-F510 WeakPolarHBondContact O-CB 3.12Å; A506-F510 VanDerWaalsContact O-CD2 3.31Å; A506-F510 WeakPolarHBondContact O-CD2 3.46Å; A506-F510 WeakPolarHBondContact O-CG 3.45Å; A506-F510 PolarHBondContact O-N 2.6Å; L507-F510 PolarHBondContact O-N 3.05Å; F510-A513 PolarHBondContact O-N 2.81Å; F510-S514 WeakPolarHBondContact O-CB 3.44Å; F510-S514 PolarHBondContact O-N 3.45Å; F510-S514 PolarHBondContact O-OG 3.35Å; F510-N524 HydrophobicContact CD1-CB 4.25Å; F510-N524 HydrophobicContact CD2-CB 4.02Å; F510-N524 HydrophobicContact CE1-CB 3.98Å; F510-N524 WeakPolarHBondContact CE1-ND2 3.3Å; F510-N524 HydrophobicContact CE2-CB 3.73Å; F510-N524 HydrophobicContact CG-CB 4.27Å; F510-N524 HydrophobicContact CZ-CB 3.71Å; F510-L525 HydrophobicContact CB-CD1 4.34Å; F510-L525 HydrophobicContact CB-CD2 3.48Å; F510-L525 VanDerWaalsContact CB-CD2 3.48Å; F510-L525 HydrophobicContact CB-CG 3.69Å; F510-M528 HydrophobicContact CD2-SD 3.68Å; F510-M528 HydrophobicContact CE2-SD 3.92Å
511	N	94.8	Very high	92.9	Very high	63 Å²	63	55.8 Å²	55.8	34%	0.337	28%	0.277	S	S	.	.	H	α-helix	trans	-65	-39.3	172.8	-79.3	-24.6	0	0	0	112.5	L507 K508 Y509 S514 Q515 L525	L507-N511 WeakPolarHBondContact O-CB 3.47Å; L507-N511 PolarHBondContact O-N 3.42Å; L507-N511 PolarHBondContact O-ND2 2.78Å; K508-N511 PolarHBondContact O-N 2.88Å; Y509-N511 VanDerWaalsContact C-N 3.34Å; N511-S514 WeakPolarHBondContact CA-OG 3.39Å; N511-S514 PolarHBondContact O-N 3.46Å; N511-S514 PolarHBondContact O-OG 3.46Å; N511-Q515 VanDerWaalsContact O-CG 3.29Å; N511-Q515 WeakPolarHBondContact O-CG 3.34Å; N511-Q515 PolarHBondContact O-N 3.37Å; N511-Q515 VanDerWaalsContact O-N 3.09Å; N511-L525 WeakPolarHBondContact OD1-CD1 3.16Å; N511-L525 WeakPolarHBondContact OD1-CD2 3.43Å
512	L	94.8	Very high	92.9	Very high	62 Å²	62	50 Å²	50	33%	0.325	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-43.6	173.5	-68.2	169.8	0	0	0	111	Q486 K508 Y509 S514 Q515 G516	Q486-L512 VanDerWaalsContact OE1-C 3.24Å; Q486-L512 PolarHBondContact OE1-O 3.31Å; K508-L512 HydrophobicContact CG-CD1 4.43Å; K508-L512 WeakPolarHBondContact O-CG 3.49Å; K508-L512 PolarHBondContact O-N 3.12Å; K508-L512 VanDerWaalsContact O-N 3.08Å; Y509-L512 HydrophobicContact CD1-CD1 4.2Å; Y509-L512 PolarHBondContact O-N 3.36Å; L512-S514 VanDerWaalsContact C-N 3.34Å; L512-S514 PolarHBondContact O-N 2.88Å; L512-Q515 WeakPolarHBondContact O-CB 3.49Å; L512-Q515 PolarHBondContact O-N 3.27Å; L512-G516 PolarHBondContact O-N 2.98Å
513	A	92.9	Very high	92.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-32.1	179.4	0	0	0	0	0	112.9	V483 Q486 L487 Y509 F510 G516 G517 H518 A521	V483-A513 HydrophobicContact CG1-CB 4.07Å; V483-A513 WeakPolarHBondContact CG1-O 3.44Å; Q486-A513 HydrophobicContact CB-CB 4.03Å; L487-A513 HydrophobicContact CB-CB 4.33Å; Y509-A513 WeakPolarHBondContact O-CB 3.36Å; Y509-A513 PolarHBondContact O-N 3.43Å; F510-A513 PolarHBondContact O-N 2.81Å; A513-G516 CarbonylContact O-C 3.57Å; A513-G516 WeakPolarHBondContact O-CA 3.47Å; A513-G516 PolarHBondContact O-N 3.45Å; A513-G517 PolarHBondContact O-N 2.91Å; A513-H518 PolarHBondContact O-N 2.95Å; A513-A521 HydrophobicContact CB-CB 3.58Å
514	S	91.9	Very high	92.9	Very high	16 Å²	16	47.8 Å²	47.8	11%	0.112	25%	0.245	C	C	.	.	H	α-helix	trans	-72.8	-33.9	175.9	71.1	0	0	0	0	112.3	F510 N511 L512 G516 G517 F522 L525	F510-S514 WeakPolarHBondContact O-CB 3.44Å; F510-S514 PolarHBondContact O-N 3.45Å; F510-S514 PolarHBondContact O-OG 3.35Å; N511-S514 WeakPolarHBondContact CA-OG 3.39Å; N511-S514 PolarHBondContact O-N 3.46Å; N511-S514 PolarHBondContact O-OG 3.46Å; L512-S514 VanDerWaalsContact C-N 3.34Å; L512-S514 PolarHBondContact O-N 2.88Å; S514-G516 PolarHBondContact O-N 3.33Å; S514-G517 WeakPolarHBondContact O-CA 3.5Å; S514-G517 PolarHBondContact O-N 3.43Å; S514-F522 WeakPolarHBondContact O-CZ 3.26Å; S514-L525 WeakPolarHBondContact OG-CD1 3.42Å
515	Q	92.1	Very high	92.9	Very high	158 Å²	158	40.1 Å²	40.1	74%	0.738	21%	0.211	S	C	*	.	H	α-helix	trans	-61	-34.2	167.8	-71.5	170.9	4.2	0	0	111.6	N511 L512 G517	N511-Q515 VanDerWaalsContact O-CG 3.29Å; N511-Q515 WeakPolarHBondContact O-CG 3.34Å; N511-Q515 PolarHBondContact O-N 3.37Å; N511-Q515 VanDerWaalsContact O-N 3.09Å; L512-Q515 WeakPolarHBondContact O-CB 3.49Å; L512-Q515 PolarHBondContact O-N 3.27Å; Q515-G517 PolarHBondContact O-N 3.43Å
516	G	86.1	Confident	93.1	Very high	45 Å²	45	37 Å²	37	46%	0.464	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-2.2	169.5	0	0	0	0	0	115.1	L512 A513 S514	L512-G516 PolarHBondContact O-N 2.98Å; A513-G516 CarbonylContact O-C 3.57Å; A513-G516 WeakPolarHBondContact O-CA 3.47Å; A513-G516 PolarHBondContact O-N 3.45Å; S514-G516 PolarHBondContact O-N 3.33Å
517	G	85.6	Confident	93	Very high	30 Å²	30	39.5 Å²	39.5	31%	0.309	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	8.2	175.1	0	0	0	0	0	115.6	A513 S514 Q515 I519	A513-G517 PolarHBondContact O-N 2.91Å; S514-G517 WeakPolarHBondContact O-CA 3.5Å; S514-G517 PolarHBondContact O-N 3.43Å; Q515-G517 PolarHBondContact O-N 3.43Å; G517-I519 PolarHBondContact O-N 2.87Å
518	H	88.1	Confident	93.1	Very high	38 Å²	38	38 Å²	38	18%	0.176	20%	0.201	C	C	.	.			trans	-72.6	127.4	-174.5	-167.4	-60.5	0	0	0	112.9	V483 D484 L487 A513 L520 A521 F522	V483-H518 HydrophobicContact CG1-CB 3.45Å; V483-H518 VanDerWaalsContact CG1-CB 3.45Å; D484-H518 IonicContact OD1-CD2 2.78Å; D484-H518 PolarHBondContact OD1-CD2 3.2Å; D484-H518 VanDerWaalsContact OD1-CD2 3.3Å; D484-H518 IonicContact OD1-NE2 3.27Å; D484-H518 PolarHBondContact OD1-NE2 2.9Å; L487-H518 WeakPolarHBondContact CD2-CE1 3.38Å; A513-H518 PolarHBondContact O-N 2.95Å; H518-L520 PolarHBondContact ND1-N 3.32Å; H518-L520 VanDerWaalsContact ND1-N 3.1Å; H518-L520 PolarHBondContact O-N 3.34Å; H518-A521 HydrophobicContact CB-CB 4.18Å; H518-A521 WeakPolarHBondContact O-CB 3.43Å; H518-A521 PolarHBondContact O-N 3.24Å; H518-A521 VanDerWaalsContact O-N 3.09Å; H518-F522 VanDerWaalsContact O-CD2 3.25Å; H518-F522 WeakPolarHBondContact O-CD2 3.49Å; H518-F522 PolarHBondContact O-N 2.82Å
519	I	90.8	Very high	93.1	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.185	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-48.9	-172.5	-38.8	-171.5	0	0	0	112.1	V325 I329 G517 A521 F522 Y523 V549 R552	V325-I519 HydrophobicContact CG1-CG2 4.41Å; I329-I519 HydrophobicContact CD1-CB 3.72Å; I329-I519 HydrophobicContact CD1-CD1 4.1Å; I329-I519 HydrophobicContact CD1-CG1 4.38Å; I329-I519 HydrophobicContact CD1-CG2 3.72Å; I329-I519 HydrophobicContact CG1-CD1 4.33Å; G517-I519 PolarHBondContact O-N 2.87Å; I519-A521 PolarHBondContact O-N 3.48Å; I519-F522 WeakPolarHBondContact O-CB 3.18Å; I519-F522 PolarHBondContact O-N 3.36Å; I519-F522 VanDerWaalsContact O-N 3.16Å; I519-Y523 PolarHBondContact O-N 3.49Å; I519-V549 HydrophobicContact CG2-CB 4.3Å; I519-V549 HydrophobicContact CG2-CG1 3.85Å; I519-V549 HydrophobicContact CG2-CG2 4.21Å; I519-R552 HydrophobicContact CD1-CB 3.76Å; I519-R552 HydrophobicContact CD1-CG 4.39Å; I519-R552 HydrophobicContact CG1-CB 4.48Å; I519-R552 HydrophobicContact CG2-CB 4.41Å
520	L	91.4	Very high	93.1	Very high	43 Å²	43	33 Å²	33	23%	0.225	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-24.6	177.9	-60.9	177.8	0	0	0	113.4	A326 I329 L487 H518 Y523 N524	A326-L520 HydrophobicContact CB-CD2 3.89Å; I329-L520 HydrophobicContact CD1-CD2 3.85Å; I329-L520 HydrophobicContact CD1-CG 4.19Å; L487-L520 HydrophobicContact CD1-CB 4.05Å; L487-L520 HydrophobicContact CD2-CB 3.87Å; L487-L520 HydrophobicContact CD2-CD1 4.14Å; H518-L520 PolarHBondContact ND1-N 3.32Å; H518-L520 VanDerWaalsContact ND1-N 3.1Å; H518-L520 PolarHBondContact O-N 3.34Å; L520-Y523 PolarHBondContact O-N 3.31Å; L520-N524 WeakPolarHBondContact O-CB 3.3Å; L520-N524 VanDerWaalsContact O-CG 3.32Å; L520-N524 PolarHBondContact O-N 3.29Å; L520-N524 PolarHBondContact O-ND2 3.49Å
521	A	93	Very high	93	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.3	-46.6	174.8	0	0	0	0	0	110.2	L487 A513 H518 I519 Y523 N524 L525	L487-A521 HydrophobicContact CD1-CB 3.99Å; A513-A521 HydrophobicContact CB-CB 3.58Å; H518-A521 HydrophobicContact CB-CB 4.18Å; H518-A521 WeakPolarHBondContact O-CB 3.43Å; H518-A521 PolarHBondContact O-N 3.24Å; H518-A521 VanDerWaalsContact O-N 3.09Å; I519-A521 PolarHBondContact O-N 3.48Å; A521-Y523 VanDerWaalsContact C-N 3.29Å; A521-Y523 PolarHBondContact O-N 3.3Å; A521-N524 PolarHBondContact O-N 3.05Å; A521-L525 WeakPolarHBondContact O-CB 3.36Å; A521-L525 VanDerWaalsContact O-CG 3.31Å; A521-L525 WeakPolarHBondContact O-CG 3.47Å; A521-L525 PolarHBondContact O-N 3.35Å
522	F	94.6	Very high	93	Very high	25 Å²	25	34 Å²	34	11%	0.11	20%	0.199	C	C	.	.	H	α-helix	trans	-57.1	-43.1	171.8	-70	-69.9	0	0	0	111.9	S514 H518 I519 L525 A526 L545 V549	S514-F522 WeakPolarHBondContact O-CZ 3.26Å; H518-F522 VanDerWaalsContact O-CD2 3.25Å; H518-F522 WeakPolarHBondContact O-CD2 3.49Å; H518-F522 PolarHBondContact O-N 2.82Å; I519-F522 WeakPolarHBondContact O-CB 3.18Å; I519-F522 PolarHBondContact O-N 3.36Å; I519-F522 VanDerWaalsContact O-N 3.16Å; F522-L525 PolarHBondContact O-N 3.03Å; F522-A526 VanDerWaalsContact O-CB 3.26Å; F522-A526 WeakPolarHBondContact O-CB 3.36Å; F522-A526 PolarHBondContact O-N 3.04Å; F522-L545 HydrophobicContact CD1-CD2 3.66Å; F522-L545 HydrophobicContact CE1-CD2 4.28Å; F522-V549 HydrophobicContact CB-CG2 3.56Å
523	Y	95.4	Very high	92.8	Very high	47 Å²	47	32.6 Å²	32.6	18%	0.184	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-49.3	177.4	174.4	-98.2	0	0	0	112.5	A322 N323 A326 I519 L520 A521 A526 Q527 F546	A322-Y523 HydrophobicContact CB-CD2 4.12Å; A322-Y523 HydrophobicContact CB-CE2 4.38Å; N323-Y523 VanDerWaalsContact OD1-CE2 3.23Å; N323-Y523 WeakPolarHBondContact OD1-CE2 3.44Å; N323-Y523 PolarHBondContact OD1-OH 3.27Å; A326-Y523 HydrophobicContact CB-CD1 4.12Å; A326-Y523 HydrophobicContact CB-CD2 3.87Å; A326-Y523 HydrophobicContact CB-CE1 4.22Å; A326-Y523 HydrophobicContact CB-CE2 3.98Å; A326-Y523 HydrophobicContact CB-CG 3.94Å; I519-Y523 PolarHBondContact O-N 3.49Å; L520-Y523 PolarHBondContact O-N 3.31Å; A521-Y523 VanDerWaalsContact C-N 3.29Å; A521-Y523 PolarHBondContact O-N 3.3Å; Y523-A526 WeakPolarHBondContact O-CB 3.4Å; Y523-A526 PolarHBondContact O-N 3.48Å; Y523-Q527 PolarHBondContact O-N 3.02Å; Y523-F546 HydrophobicContact CD2-CD1 4.35Å; Y523-F546 AromaticContact CD2-CE1 3.83Å; Y523-F546 HydrophobicContact CD2-CE1 3.83Å; Y523-F546 AromaticContact CE2-CE1 3.99Å; Y523-F546 HydrophobicContact CE2-CE1 3.99Å
524	N	95.1	Very high	92.6	Very high	27 Å²	27	34.5 Å²	34.5	14%	0.144	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-39.7	179.3	-71.4	-28.8	0	0	0	112	F510 L520 A521 Q527 M528	F510-N524 HydrophobicContact CD1-CB 4.25Å; F510-N524 HydrophobicContact CD2-CB 4.02Å; F510-N524 HydrophobicContact CE1-CB 3.98Å; F510-N524 WeakPolarHBondContact CE1-ND2 3.3Å; F510-N524 HydrophobicContact CE2-CB 3.73Å; F510-N524 HydrophobicContact CG-CB 4.27Å; F510-N524 HydrophobicContact CZ-CB 3.71Å; L520-N524 WeakPolarHBondContact O-CB 3.3Å; L520-N524 VanDerWaalsContact O-CG 3.32Å; L520-N524 PolarHBondContact O-N 3.29Å; L520-N524 PolarHBondContact O-ND2 3.49Å; A521-N524 PolarHBondContact O-N 3.05Å; N524-Q527 PolarHBondContact O-N 3.09Å; N524-M528 WeakPolarHBondContact O-CG 3.37Å; N524-M528 PolarHBondContact O-N 2.67Å
525	L	95.4	Very high	92.7	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-44	172.9	-72.1	173.5	0	0	0	111.7	L507 F510 N511 S514 A521 F522 Q527 M528 H529 L545	L507-L525 HydrophobicContact CD1-CD2 3.71Å; F510-L525 HydrophobicContact CB-CD1 4.34Å; F510-L525 HydrophobicContact CB-CD2 3.48Å; F510-L525 VanDerWaalsContact CB-CD2 3.48Å; F510-L525 HydrophobicContact CB-CG 3.69Å; N511-L525 WeakPolarHBondContact OD1-CD1 3.16Å; N511-L525 WeakPolarHBondContact OD1-CD2 3.43Å; S514-L525 WeakPolarHBondContact OG-CD1 3.42Å; A521-L525 WeakPolarHBondContact O-CB 3.36Å; A521-L525 VanDerWaalsContact O-CG 3.31Å; A521-L525 WeakPolarHBondContact O-CG 3.47Å; A521-L525 PolarHBondContact O-N 3.35Å; F522-L525 PolarHBondContact O-N 3.03Å; L525-Q527 VanDerWaalsContact C-N 3.3Å; L525-Q527 PolarHBondContact O-N 3.11Å; L525-M528 WeakPolarHBondContact O-CB 3.47Å; L525-M528 PolarHBondContact O-N 2.96Å; L525-M528 VanDerWaalsContact O-N 3.17Å; L525-H529 PolarHBondContact O-CD2 2.87Å; L525-H529 VanDerWaalsContact O-CD2 3.24Å; L525-H529 PolarHBondContact O-N 2.5Å; L525-L545 HydrophobicContact CB-CD1 3.9Å
526	A	96.1	Very high	92.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-43.6	178.1	0	0	0	0	0	110.8	F522 Y523 M528 H529 A530 L545 F546	F522-A526 VanDerWaalsContact O-CB 3.26Å; F522-A526 WeakPolarHBondContact O-CB 3.36Å; F522-A526 PolarHBondContact O-N 3.04Å; Y523-A526 WeakPolarHBondContact O-CB 3.4Å; Y523-A526 PolarHBondContact O-N 3.48Å; A526-M528 VanDerWaalsContact C-N 3.34Å; A526-M528 PolarHBondContact O-N 3.28Å; A526-H529 PolarHBondContact O-N 3.08Å; A526-A530 VanDerWaalsContact O-CB 3.25Å; A526-A530 WeakPolarHBondContact O-CB 3.49Å; A526-A530 PolarHBondContact O-N 3.41Å; A526-L545 HydrophobicContact CB-CB 3.59Å; A526-L545 HydrophobicContact CB-CD1 4.43Å; A526-F546 HydrophobicContact CB-CB 4.47Å; A526-F546 HydrophobicContact CB-CD1 3.47Å; A526-F546 VanDerWaalsContact CB-CD1 3.47Å; A526-F546 HydrophobicContact CB-CD2 3.68Å; A526-F546 HydrophobicContact CB-CE1 3.48Å; A526-F546 VanDerWaalsContact CB-CE1 3.48Å; A526-F546 HydrophobicContact CB-CE2 3.67Å; A526-F546 HydrophobicContact CB-CG 3.58Å; A526-F546 HydrophobicContact CB-CZ 3.58Å
527	Q	94.9	Very high	93.2	Very high	53 Å²	53	40.5 Å²	40.5	25%	0.248	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-39.5	175.6	-172.6	60.4	28.8	0	0	111.9	Y523 N524 L525 A530 S531	Y523-Q527 PolarHBondContact O-N 3.02Å; N524-Q527 PolarHBondContact O-N 3.09Å; L525-Q527 VanDerWaalsContact C-N 3.3Å; L525-Q527 PolarHBondContact O-N 3.11Å; Q527-A530 PolarHBondContact O-N 2.94Å; Q527-S531 WeakPolarHBondContact O-CB 3.45Å; Q527-S531 PolarHBondContact O-N 3.24Å; Q527-S531 PolarHBondContact O-OG 3.24Å
528	M	95.3	Very high	93.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-45.6	174.7	-72.2	179.4	75.8	0	0	112.2	Y494 L507 F510 N524 L525 A526 S531 G532 T533 V535	Y494-M528 HydrophobicContact CD2-CG 4.17Å; Y494-M528 HydrophobicContact CD2-SD 4.05Å; Y494-M528 HydrophobicContact CE2-CG 3.69Å; Y494-M528 HydrophobicContact CE2-SD 4.19Å; L507-M528 HydrophobicContact CB-CE 3.94Å; L507-M528 HydrophobicContact CD1-CE 4.01Å; L507-M528 HydrophobicContact CD1-SD 4.32Å; F510-M528 HydrophobicContact CD2-SD 3.68Å; F510-M528 HydrophobicContact CE2-SD 3.92Å; N524-M528 WeakPolarHBondContact O-CG 3.37Å; N524-M528 PolarHBondContact O-N 2.67Å; L525-M528 WeakPolarHBondContact O-CB 3.47Å; L525-M528 PolarHBondContact O-N 2.96Å; L525-M528 VanDerWaalsContact O-N 3.17Å; A526-M528 VanDerWaalsContact C-N 3.34Å; A526-M528 PolarHBondContact O-N 3.28Å; M528-S531 PolarHBondContact O-OG 2.94Å; M528-G532 CarbonylContact O-C 3.34Å; M528-G532 VanDerWaalsContact O-CA 3.31Å; M528-G532 WeakPolarHBondContact O-CA 3.31Å; M528-G532 PolarHBondContact O-N 3.37Å; M528-T533 WeakPolarHBondContact CA-OG1 3.33Å; M528-T533 WeakPolarHBondContact CE-O 3.25Å; M528-T533 PolarHBondContact O-N 3.47Å; M528-V535 HydrophobicContact CB-CG2 4.3Å
529	H	95.9	Very high	94.1	Very high	36 Å²	36	40.1 Å²	40.1	17%	0.167	22%	0.221	C	C	.	.	H	α-helix	trans	-69.5	-34.9	177.2	-78.9	-71.3	0	0	0	113.5	L525 A526 R537 S538 T541 A542	L525-H529 PolarHBondContact O-CD2 2.87Å; L525-H529 VanDerWaalsContact O-CD2 3.24Å; L525-H529 PolarHBondContact O-N 2.5Å; A526-H529 PolarHBondContact O-N 3.08Å; H529-R537 WeakPolarHBondContact O-CA 3.4Å; H529-S538 PolarHBondContact O-N 3.25Å; H529-T541 PolarHBondContact ND1-OG1 2.94Å; H529-A542 HydrophobicContact CB-CB 3.96Å
530	A	95.9	Very high	94.3	Very high	12 Å²	12	43.3 Å²	43.3	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-41.2	177.5	0	0	0	0	0	112.1	L315 A526 Q527 R537 A542 F546	L315-A530 HydrophobicContact CD1-CB 4.3Å; L315-A530 HydrophobicContact CD2-CB 4.22Å; A526-A530 VanDerWaalsContact O-CB 3.25Å; A526-A530 WeakPolarHBondContact O-CB 3.49Å; A526-A530 PolarHBondContact O-N 3.41Å; Q527-A530 PolarHBondContact O-N 2.94Å; A530-R537 PolarHBondContact O-NE 3.11Å; A530-A542 HydrophobicContact CB-CB 3.94Å; A530-F546 HydrophobicContact CB-CE2 4.15Å
531	S	93.9	Very high	94.5	Very high	55 Å²	55	43.2 Å²	43.2	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-85.8	-21.9	179.8	59.8	0	0	0	0	113.9	Q527 M528 T533	Q527-S531 WeakPolarHBondContact O-CB 3.45Å; Q527-S531 PolarHBondContact O-N 3.24Å; Q527-S531 PolarHBondContact O-OG 3.24Å; M528-S531 PolarHBondContact O-OG 2.94Å; S531-T533 WeakPolarHBondContact OG-CG2 3.29Å; S531-T533 PolarHBondContact OG-N 3.44Å; S531-T533 PolarHBondContact OG-OG1 3.29Å
532	G	93.7	Very high	94.7	Very high	28 Å²	28	43.2 Å²	43.2	29%	0.289	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	28.7	-170.1	0	0	0	0	0	113.4	M528 G534 V535	M528-G532 CarbonylContact O-C 3.34Å; M528-G532 VanDerWaalsContact O-CA 3.31Å; M528-G532 WeakPolarHBondContact O-CA 3.31Å; M528-G532 PolarHBondContact O-N 3.37Å; G532-G534 PolarHBondContact O-N 3.01Å; G532-V535 CarbonylContact C-O 3.26Å; G532-V535 WeakPolarHBondContact CA-O 3.45Å
533	T	91.8	Very high	94.8	Very high	34 Å²	34	42 Å²	42	21%	0.209	23%	0.231	C	C	.	.	S	Bend	trans	-85.7	111.4	178.7	48.1	0	0	0	0	110.7	M528 S531 V535	M528-T533 WeakPolarHBondContact CA-OG1 3.33Å; M528-T533 WeakPolarHBondContact CE-O 3.25Å; M528-T533 PolarHBondContact O-N 3.47Å; S531-T533 WeakPolarHBondContact OG-CG2 3.29Å; S531-T533 PolarHBondContact OG-N 3.44Å; S531-T533 PolarHBondContact OG-OG1 3.29Å; T533-V535 PolarHBondContact O-N 3.31Å
534	G	87.6	Confident	94.8	Very high	39 Å²	39	44.2 Å²	44.2	40%	0.402	24%	0.243	S	C	.	.	S	Bend	trans	77.2	-10.6	-178.8	0	0	0	0	0	115.8	G532	G532-G534 PolarHBondContact O-N 3.01Å
535	V	94.3	Very high	94.8	Very high	31 Å²	31	44.5 Å²	44.5	19%	0.188	24%	0.244	C	C	.	.	S	Bend	trans	-137.9	160.1	176.2	-69.7	0	0	0	0	110.2	L507 M528 G532 T533 R537	L507-V535 HydrophobicContact CD1-CG1 3.55Å; L507-V535 HydrophobicContact CD2-CG1 3.25Å; L507-V535 HydrophobicContact CG-CG1 4Å; M528-V535 HydrophobicContact CB-CG2 4.3Å; G532-V535 CarbonylContact C-O 3.26Å; G532-V535 WeakPolarHBondContact CA-O 3.45Å; T533-V535 PolarHBondContact O-N 3.31Å; V535-R537 PolarHBondContact O-N 3.32Å
536	M	93.1	Very high	94.9	Very high	170 Å²	170	44.4 Å²	44.4	84%	0.837	24%	0.244	S	C	*	.			trans	-63.1	134	170.6	-68.1	-62.9	-72.3	0	0	109.9	S538	M536-S538 PolarHBondContact O-N 3.46Å
537	R	95.2	Very high	94.9	Very high	144 Å²	144	45.4 Å²	45.4	54%	0.543	25%	0.248	S	C	.	.			trans	-59	126.2	177.1	-178.2	177.3	177.2	-122.7	-6.8	109.4	E312 H529 A530 V535	E312-R537 IonicContact OE1-CZ 2.72Å; E312-R537 IonicContact OE1-NH1 3.59Å; E312-R537 IonicContact OE1-NH2 3.81Å; E312-R537 PolarHBondContact OE1-NH2 2.96Å; E312-R537 IonicContact OE2-NH2 2.67Å; E312-R537 PolarHBondContact OE2-NH2 2.94Å; H529-R537 WeakPolarHBondContact O-CA 3.4Å; A530-R537 PolarHBondContact O-NE 3.11Å; V535-R537 PolarHBondContact O-N 3.32Å
538	S	96.1	Very high	94.8	Very high	39 Å²	39	45 Å²	45	27%	0.273	25%	0.248	S	C	.	.			trans	-140.5	109.4	177.9	171.2	0	0	0	0	108.4	H529 M536 H540 T541 A542	H529-S538 PolarHBondContact O-N 3.25Å; M536-S538 PolarHBondContact O-N 3.46Å; S538-H540 VanDerWaalsContact C-N 3.34Å; S538-T541 WeakPolarHBondContact CB-OG1 3.43Å; S538-T541 PolarHBondContact O-OG1 3.23Å; S538-T541 PolarHBondContact OG-N 3.42Å; S538-T541 PolarHBondContact OG-OG1 2.84Å; S538-A542 WeakPolarHBondContact O-CB 3.45Å; S538-A542 PolarHBondContact O-N 3.18Å
539	C	96	Very high	94.7	Very high	21 Å²	21	45 Å²	45	14%	0.142	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-41.4	179.4	178.9	0	0	0	0	110.9	C311 T541 A542 V543	C311-C539 HydrophobicContact CB-CB 4.06Å; C311-C539 WeakPolarHBondContact CB-SG 3.33Å; C311-C539 PolarHBondContact O-SG 3.29Å; C311-C539 WeakPolarHBondContact SG-CB 3.35Å; C311-C539 PolarHBondContact SG-O 2.88Å; C311-C539 VanDerWaalsContact SG-O 3.32Å; C311-C539 CovalentContact SG-SG 2.03Å; C311-C539 PolarHBondContact SG-SG 3Å; C539-T541 PolarHBondContact O-N 3.43Å; C539-A542 PolarHBondContact O-N 2.91Å; C539-V543 WeakPolarHBondContact O-CG2 3.47Å; C539-V543 PolarHBondContact O-N 3.49Å
540	H	95.2	Very high	94.6	Very high	103 Å²	103	43.3 Å²	43.3	48%	0.477	24%	0.24	S	C	.	.	H	α-helix	trans	-58.4	-53.9	-176.8	-177.5	81.8	0	0	0	111.5	W302 C311 S538 A542 V543 E544	W302-H540 HydrophobicContact CH2-CB 4.18Å; W302-H540 AromaticContact CH2-CE1 3.39Å; W302-H540 WeakPolarHBondContact CH2-CE1 3.34Å; W302-H540 AromaticContact CH2-CG 3.61Å; W302-H540 AromaticContact CH2-ND1 2.94Å; W302-H540 WeakPolarHBondContact CH2-ND1 3.46Å; W302-H540 WeakPolarHBondContact CH2-O 3.25Å; W302-H540 AromaticContact CZ2-CE1 3.48Å; W302-H540 VanDerWaalsContact CZ2-CE1 3.48Å; W302-H540 WeakPolarHBondContact CZ2-CE1 3.46Å; W302-H540 AromaticContact CZ2-ND1 3.55Å; W302-H540 AromaticContact CZ3-ND1 3.74Å; C311-H540 PolarHBondContact SG-N 3.36Å; S538-H540 VanDerWaalsContact C-N 3.34Å; H540-A542 VanDerWaalsContact C-N 3.31Å; H540-A542 PolarHBondContact O-N 3.43Å; H540-V543 PolarHBondContact O-N 3.47Å; H540-E544 IonicContact CD2-OE1 3.01Å; H540-E544 IonicContact CE1-OE1 3.01Å; H540-E544 IonicContact NE2-OE1 2.64Å; H540-E544 PolarHBondContact NE2-OE1 2.91Å; H540-E544 WeakPolarHBondContact O-CG 3.2Å; H540-E544 PolarHBondContact O-N 3.41Å; H540-E544 VanDerWaalsContact O-N 3.09Å
541	T	95.7	Very high	94.4	Very high	42 Å²	42	43.8 Å²	43.8	26%	0.258	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-35	179.2	57.9	0	0	0	0	111.8	H529 S538 C539 E544 L545	H529-T541 PolarHBondContact ND1-OG1 2.94Å; S538-T541 WeakPolarHBondContact CB-OG1 3.43Å; S538-T541 PolarHBondContact O-OG1 3.23Å; S538-T541 PolarHBondContact OG-N 3.42Å; S538-T541 PolarHBondContact OG-OG1 2.84Å; C539-T541 PolarHBondContact O-N 3.43Å; T541-E544 PolarHBondContact O-N 2.91Å; T541-L545 WeakPolarHBondContact O-CB 3.42Å; T541-L545 WeakPolarHBondContact O-CD1 3.39Å; T541-L545 WeakPolarHBondContact O-CG 3.35Å; T541-L545 PolarHBondContact O-N 3.3Å
542	A	96.7	Very high	94.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-44.1	175.7	0	0	0	0	0	112.3	L315 H529 A530 S538 C539 H540 L545 F546	L315-A542 HydrophobicContact CD1-CB 3.88Å; H529-A542 HydrophobicContact CB-CB 3.96Å; A530-A542 HydrophobicContact CB-CB 3.94Å; S538-A542 WeakPolarHBondContact O-CB 3.45Å; S538-A542 PolarHBondContact O-N 3.18Å; C539-A542 PolarHBondContact O-N 2.91Å; H540-A542 VanDerWaalsContact C-N 3.31Å; H540-A542 PolarHBondContact O-N 3.43Å; A542-L545 PolarHBondContact O-N 3.5Å; A542-F546 WeakPolarHBondContact O-CB 3.38Å; A542-F546 WeakPolarHBondContact O-CD2 3.45Å; A542-F546 PolarHBondContact O-N 3.34Å
543	V	97.1	Very high	93.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-43.4	177.3	170.9	0	0	0	0	111.1	W302 A314 L315 Y318 C539 H540 L545 F546 K547	W302-V543 HydrophobicContact CD2-CG1 3.81Å; W302-V543 HydrophobicContact CE3-CB 3.97Å; W302-V543 HydrophobicContact CE3-CG1 3.45Å; W302-V543 VanDerWaalsContact CE3-CG1 3.45Å; W302-V543 HydrophobicContact CE3-CG2 4.38Å; W302-V543 HydrophobicContact CG-CG1 4.35Å; W302-V543 HydrophobicContact CH2-CB 4.11Å; W302-V543 HydrophobicContact CH2-CG1 4.14Å; W302-V543 HydrophobicContact CZ3-CB 3.63Å; W302-V543 HydrophobicContact CZ3-CG1 3.64Å; W302-V543 HydrophobicContact CZ3-CG2 4.17Å; A314-V543 HydrophobicContact CB-CG1 4.28Å; A314-V543 HydrophobicContact CB-CG2 4.33Å; L315-V543 HydrophobicContact CB-CG2 3.71Å; L315-V543 HydrophobicContact CD1-CG2 3.95Å; L315-V543 HydrophobicContact CG-CG2 4.44Å; Y318-V543 HydrophobicContact CD2-CG1 3.8Å; Y318-V543 HydrophobicContact CE2-CG1 3.98Å; C539-V543 WeakPolarHBondContact O-CG2 3.47Å; C539-V543 PolarHBondContact O-N 3.49Å; H540-V543 PolarHBondContact O-N 3.47Å; V543-L545 PolarHBondContact O-N 2.87Å; V543-F546 PolarHBondContact O-N 3.3Å; V543-K547 WeakPolarHBondContact O-CB 3.31Å; V543-K547 PolarHBondContact O-N 3.39Å
544	E	95	Very high	93.6	Very high	93 Å²	93	50.2 Å²	50.2	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-44.9	177	-70.4	-178.3	151.9	0	0	112.2	W302 H540 T541 K547 N548	W302-E544 HydrophobicContact CH2-CG 4.05Å; W302-E544 HydrophobicContact CZ2-CG 3.81Å; H540-E544 IonicContact CD2-OE1 3.01Å; H540-E544 IonicContact CE1-OE1 3.01Å; H540-E544 IonicContact NE2-OE1 2.64Å; H540-E544 PolarHBondContact NE2-OE1 2.91Å; H540-E544 WeakPolarHBondContact O-CG 3.2Å; H540-E544 PolarHBondContact O-N 3.41Å; H540-E544 VanDerWaalsContact O-N 3.09Å; T541-E544 PolarHBondContact O-N 2.91Å; E544-K547 PolarHBondContact O-N 3.35Å; E544-N548 VanDerWaalsContact O-CB 3.32Å; E544-N548 WeakPolarHBondContact O-CB 3.26Å; E544-N548 PolarHBondContact O-N 3.35Å
545	L	96.2	Very high	93.7	Very high	32 Å²	32	50.4 Å²	50.4	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-43.5	177.5	-66.1	167.3	0	0	0	111.5	F522 L525 A526 T541 A542 V543 N548 V549	F522-L545 HydrophobicContact CD1-CD2 3.66Å; F522-L545 HydrophobicContact CE1-CD2 4.28Å; L525-L545 HydrophobicContact CB-CD1 3.9Å; A526-L545 HydrophobicContact CB-CB 3.59Å; A526-L545 HydrophobicContact CB-CD1 4.43Å; T541-L545 WeakPolarHBondContact O-CB 3.42Å; T541-L545 WeakPolarHBondContact O-CD1 3.39Å; T541-L545 WeakPolarHBondContact O-CG 3.35Å; T541-L545 PolarHBondContact O-N 3.3Å; A542-L545 PolarHBondContact O-N 3.5Å; V543-L545 PolarHBondContact O-N 2.87Å; L545-N548 WeakPolarHBondContact O-CB 3.47Å; L545-N548 PolarHBondContact O-N 3.39Å; L545-V549 WeakPolarHBondContact O-CG2 3.25Å; L545-V549 PolarHBondContact O-N 3.18Å; L545-V549 VanDerWaalsContact O-N 3.11Å
546	F	97.1	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-38.8	175.8	-78.6	-52.4	0	0	0	112.5	L315 R319 A322 Y523 A526 A530 A542 V543 N548 V549 C550	L315-F546 HydrophobicContact CD1-CD2 3.54Å; L315-F546 HydrophobicContact CD1-CE2 3.7Å; R319-F546 HydrophobicContact CB-CE2 4.3Å; R319-F546 HydrophobicContact CB-CZ 4.41Å; R319-F546 HydrophobicContact CG-CE2 4.38Å; R319-F546 HydrophobicContact CG-CZ 4.09Å; A322-F546 HydrophobicContact CB-CB 4.38Å; A322-F546 HydrophobicContact CB-CD1 3.38Å; A322-F546 HydrophobicContact CB-CE1 3.99Å; A322-F546 HydrophobicContact CB-CG 4.23Å; Y523-F546 HydrophobicContact CD2-CD1 4.35Å; Y523-F546 AromaticContact CD2-CE1 3.83Å; Y523-F546 HydrophobicContact CD2-CE1 3.83Å; Y523-F546 AromaticContact CE2-CE1 3.99Å; Y523-F546 HydrophobicContact CE2-CE1 3.99Å; A526-F546 HydrophobicContact CB-CB 4.47Å; A526-F546 HydrophobicContact CB-CD1 3.47Å; A526-F546 VanDerWaalsContact CB-CD1 3.47Å; A526-F546 HydrophobicContact CB-CD2 3.68Å; A526-F546 HydrophobicContact CB-CE1 3.48Å; A526-F546 VanDerWaalsContact CB-CE1 3.48Å; A526-F546 HydrophobicContact CB-CE2 3.67Å; A526-F546 HydrophobicContact CB-CG 3.58Å; A526-F546 HydrophobicContact CB-CZ 3.58Å; A530-F546 HydrophobicContact CB-CE2 4.15Å; A542-F546 WeakPolarHBondContact O-CB 3.38Å; A542-F546 WeakPolarHBondContact O-CD2 3.45Å; A542-F546 PolarHBondContact O-N 3.34Å; V543-F546 PolarHBondContact O-N 3.3Å; F546-N548 VanDerWaalsContact C-N 3.3Å; F546-N548 PolarHBondContact O-N 3.24Å; F546-V549 WeakPolarHBondContact O-CB 3.47Å; F546-V549 PolarHBondContact O-N 3.33Å; F546-C550 PolarHBondContact O-N 3.47Å; F546-C550 PolarHBondContact O-SG 2.96Å
547	K	95.5	Very high	93.1	Very high	21 Å²	21	46.4 Å²	46.4	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-46.4	172.8	177.8	176.8	-173.1	-83	0	110.4	Y318 V543 E544 V549 C550 E551 G585	Y318-K547 HydrophobicContact CE1-CB 4.22Å; Y318-K547 HydrophobicContact CE1-CG 4.27Å; Y318-K547 HydrophobicContact CE2-CB 4.42Å; V543-K547 WeakPolarHBondContact O-CB 3.31Å; V543-K547 PolarHBondContact O-N 3.39Å; E544-K547 PolarHBondContact O-N 3.35Å; K547-V549 VanDerWaalsContact C-N 3.28Å; K547-V549 PolarHBondContact O-N 3.09Å; K547-C550 PolarHBondContact O-N 3.3Å; K547-C550 VanDerWaalsContact O-N 3.16Å; K547-E551 WeakPolarHBondContact CE-OE1 3.31Å; K547-E551 HydrophobicContact CG-CG 4.45Å; K547-E551 IonicContact NZ-OE1 3.47Å; K547-E551 PolarHBondContact NZ-OE1 2.89Å; K547-E551 WeakPolarHBondContact O-CB 3.35Å; K547-E551 WeakPolarHBondContact O-CG 3.2Å; K547-E551 PolarHBondContact O-N 2.9Å; K547-G585 WeakPolarHBondContact CE-O 3.33Å; K547-G585 PolarHBondContact NZ-O 2.99Å
548	N	93.1	Very high	92.9	Very high	45 Å²	45	42.3 Å²	42.3	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-34.8	177.8	-172.1	-64.3	0	0	0	113	E544 L545 F546 R552	E544-N548 VanDerWaalsContact O-CB 3.32Å; E544-N548 WeakPolarHBondContact O-CB 3.26Å; E544-N548 PolarHBondContact O-N 3.35Å; L545-N548 WeakPolarHBondContact O-CB 3.47Å; L545-N548 PolarHBondContact O-N 3.39Å; F546-N548 VanDerWaalsContact C-N 3.3Å; F546-N548 PolarHBondContact O-N 3.24Å; N548-R552 VanDerWaalsContact CG-NH1 3.32Å; N548-R552 PolarHBondContact O-NH1 3.35Å; N548-R552 PolarHBondContact OD1-NH1 3.11Å; N548-R552 PolarHBondContact OD1-NH2 3.48Å
549	V	93.6	Very high	92.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-50.7	171.3	171.8	0	0	0	0	111.2	A322 V325 I519 F522 L545 F546 K547 E551 R552	A322-V549 HydrophobicContact CB-CB 4.33Å; A322-V549 HydrophobicContact CB-CG1 3.92Å; V325-V549 HydrophobicContact CB-CG1 4.13Å; V325-V549 HydrophobicContact CG1-CG1 4Å; I519-V549 HydrophobicContact CG2-CB 4.3Å; I519-V549 HydrophobicContact CG2-CG1 3.85Å; I519-V549 HydrophobicContact CG2-CG2 4.21Å; F522-V549 HydrophobicContact CB-CG2 3.56Å; L545-V549 WeakPolarHBondContact O-CG2 3.25Å; L545-V549 PolarHBondContact O-N 3.18Å; L545-V549 VanDerWaalsContact O-N 3.11Å; F546-V549 WeakPolarHBondContact O-CB 3.47Å; F546-V549 PolarHBondContact O-N 3.33Å; K547-V549 VanDerWaalsContact C-N 3.28Å; K547-V549 PolarHBondContact O-N 3.09Å; V549-E551 PolarHBondContact O-N 2.93Å; V549-R552 PolarHBondContact O-N 3.15Å
550	C	93.9	Very high	92.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-35.8	-179.6	-62	0	0	0	0	111.7	M295 Y318 V321 F546 K547 R552 G553 W555	M295-C550 HydrophobicContact CE-CB 3.82Å; M295-C550 HydrophobicContact CG-CB 4.38Å; M295-C550 HydrophobicContact SD-CB 4.21Å; Y318-C550 HydrophobicContact CD1-CB 4.24Å; Y318-C550 PolarHBondContact O-SG 3.24Å; V321-C550 HydrophobicContact CG1-CB 4.03Å; F546-C550 PolarHBondContact O-N 3.47Å; F546-C550 PolarHBondContact O-SG 2.96Å; K547-C550 PolarHBondContact O-N 3.3Å; K547-C550 VanDerWaalsContact O-N 3.16Å; C550-R552 PolarHBondContact O-N 2.92Å; C550-G553 PolarHBondContact O-N 2.86Å; C550-W555 VanDerWaalsContact O-CE2 3.23Å; C550-W555 WeakPolarHBondContact O-CZ2 3.47Å; C550-W555 PolarHBondContact O-NE1 3.39Å
551	E	91.8	Very high	92	Very high	22 Å²	22	38.4 Å²	38.4	10%	0.103	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-2.3	176.3	-74.6	179.9	-177.6	0	0	114.9	R339 K547 V549 Y586	R339-E551 PolarHBondContact NH2-O 2.94Å; K547-E551 WeakPolarHBondContact CE-OE1 3.31Å; K547-E551 HydrophobicContact CG-CG 4.45Å; K547-E551 IonicContact NZ-OE1 3.47Å; K547-E551 PolarHBondContact NZ-OE1 2.89Å; K547-E551 WeakPolarHBondContact O-CB 3.35Å; K547-E551 WeakPolarHBondContact O-CG 3.2Å; K547-E551 PolarHBondContact O-N 2.9Å; V549-E551 PolarHBondContact O-N 2.93Å; E551-Y586 VanDerWaalsContact CA-OH 3.28Å; E551-Y586 WeakPolarHBondContact CA-OH 3.39Å; E551-Y586 HydrophobicContact CB-CD1 4.26Å; E551-Y586 HydrophobicContact CB-CE1 3.64Å; E551-Y586 HydrophobicContact CG-CD1 3.97Å; E551-Y586 HydrophobicContact CG-CD2 4.49Å; E551-Y586 HydrophobicContact CG-CE1 3.74Å; E551-Y586 HydrophobicContact CG-CE2 4.29Å; E551-Y586 HydrophobicContact CG-CG 4.36Å; E551-Y586 WeakPolarHBondContact O-CE1 3.49Å; E551-Y586 PolarHBondContact O-OH 3.48Å
552	R	88.6	Confident	91.9	Very high	64 Å²	64	36.4 Å²	36.4	24%	0.242	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	6.2	176.6	-64	171.7	162.1	65.1	-9.6	113.1	I519 N548 V549 C550	I519-R552 HydrophobicContact CD1-CB 3.76Å; I519-R552 HydrophobicContact CD1-CG 4.39Å; I519-R552 HydrophobicContact CG1-CB 4.48Å; I519-R552 HydrophobicContact CG2-CB 4.41Å; N548-R552 VanDerWaalsContact CG-NH1 3.32Å; N548-R552 PolarHBondContact O-NH1 3.35Å; N548-R552 PolarHBondContact OD1-NH1 3.11Å; N548-R552 PolarHBondContact OD1-NH2 3.48Å; V549-R552 PolarHBondContact O-N 3.15Å; C550-R552 PolarHBondContact O-N 2.92Å
553	G	89.1	Confident	91.6	Very high	6 Å²	6	36.7 Å²	36.7	6%	0.062	16%	0.164	C	C	.	.	S	Bend	trans	-65.4	167.4	172.1	0	0	0	0	0	112.2	C550 W555 S556	C550-G553 PolarHBondContact O-N 2.86Å; G553-W555 PolarHBondContact O-N 3.13Å; G553-W555 VanDerWaalsContact O-N 3.12Å; G553-S556 VanDerWaalsContact O-CB 3.25Å; G553-S556 WeakPolarHBondContact O-CB 3.38Å; G553-S556 PolarHBondContact O-N 2.98Å; G553-S556 PolarHBondContact O-OG 3.31Å
554	R	85.8	Confident	91.2	Very high	182 Å²	182	40.1 Å²	40.1	69%	0.687	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-58	-30	-174.9	-59.4	-173.3	-166.9	-149	2	114	S556 E557	R554-S556 PolarHBondContact O-N 2.97Å; R554-S556 VanDerWaalsContact O-N 3.11Å; R554-E557 VanDerWaalsContact O-CB 3.27Å; R554-E557 WeakPolarHBondContact O-CB 3.42Å; R554-E557 PolarHBondContact O-N 2.83Å
555	W	89.1	Confident	91	Very high	44 Å²	44	36.7 Å²	36.7	17%	0.167	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-59.7	-20.1	175	50.5	79.4	0	0	0	113.7	L291 M295 V321 V325 C550 G553 E557 R558 Y586	L291-W555 HydrophobicContact CB-CZ3 4.35Å; L291-W555 HydrophobicContact CD1-CH2 4.46Å; L291-W555 HydrophobicContact CD1-CZ3 3.93Å; M295-W555 HydrophobicContact CE-CZ2 4.35Å; M295-W555 HydrophobicContact SD-CD2 4.23Å; M295-W555 HydrophobicContact SD-CH2 4.28Å; M295-W555 HydrophobicContact SD-CZ2 3.35Å; M295-W555 WeakPolarHBondContact SD-CZ2 3.3Å; M295-W555 PolarHBondContact SD-NE1 3.41Å; V321-W555 HydrophobicContact CG1-CH2 3.52Å; V321-W555 HydrophobicContact CG1-CZ2 3.68Å; V325-W555 HydrophobicContact CG2-CH2 3.33Å; V325-W555 HydrophobicContact CG2-CZ2 3.64Å; V325-W555 HydrophobicContact CG2-CZ3 4.34Å; C550-W555 VanDerWaalsContact O-CE2 3.23Å; C550-W555 WeakPolarHBondContact O-CZ2 3.47Å; C550-W555 PolarHBondContact O-NE1 3.39Å; G553-W555 PolarHBondContact O-N 3.13Å; G553-W555 VanDerWaalsContact O-N 3.12Å; W555-E557 PolarHBondContact O-N 3.28Å; W555-R558 WeakPolarHBondContact O-CB 3.4Å; W555-R558 PolarHBondContact O-N 3.09Å; W555-Y586 PolarHBondContact NE1-OH 3.49Å; W555-Y586 VanDerWaalsContact NE1-OH 3.15Å
556	S	88.3	Confident	90.8	Very high	5 Å²	5	36.3 Å²	36.3	4%	0.035	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-63.8	-20.6	174.8	65.4	0	0	0	0	112.6	V337 G553 R554 R558 L559 Y586	V337-S556 WeakPolarHBondContact CG1-O 3.45Å; V337-S556 WeakPolarHBondContact CG2-OG 3.09Å; G553-S556 VanDerWaalsContact O-CB 3.25Å; G553-S556 WeakPolarHBondContact O-CB 3.38Å; G553-S556 PolarHBondContact O-N 2.98Å; G553-S556 PolarHBondContact O-OG 3.31Å; R554-S556 PolarHBondContact O-N 2.97Å; R554-S556 VanDerWaalsContact O-N 3.11Å; S556-R558 PolarHBondContact O-N 2.95Å; S556-L559 WeakPolarHBondContact O-CB 3.37Å; S556-L559 PolarHBondContact O-N 3.5Å; S556-Y586 WeakPolarHBondContact CB-OH 3.31Å
557	E	86.7	Confident	90.4	Very high	111 Å²	111	41.2 Å²	41.2	52%	0.519	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-52.2	-29.5	172.7	-173.6	-177.4	167.7	0	0	112	R554 W555 L559 M560 T561	R554-E557 VanDerWaalsContact O-CB 3.27Å; R554-E557 WeakPolarHBondContact O-CB 3.42Å; R554-E557 PolarHBondContact O-N 2.83Å; W555-E557 PolarHBondContact O-N 3.28Å; E557-L559 PolarHBondContact O-N 3.16Å; E557-L559 VanDerWaalsContact O-N 3.13Å; E557-M560 WeakPolarHBondContact O-CB 3.41Å; E557-M560 PolarHBondContact O-N 3.46Å; E557-T561 PolarHBondContact O-N 2.99Å
558	R	91.3	Very high	90	Very high	58 Å²	58	45.9 Å²	45.9	22%	0.219	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-22	176.6	-173.2	165.5	-73.3	159	0.4	114	F231 W555 S556 M560 T561 A562 Q577 L581	F231-R558 VanDerWaalsContact CE2-NH1 3.31Å; W555-R558 WeakPolarHBondContact O-CB 3.4Å; W555-R558 PolarHBondContact O-N 3.09Å; S556-R558 PolarHBondContact O-N 2.95Å; R558-M560 VanDerWaalsContact C-N 3.3Å; R558-T561 VanDerWaalsContact CA-OG1 3.26Å; R558-T561 WeakPolarHBondContact CA-OG1 3.48Å; R558-T561 PolarHBondContact O-OG1 3.37Å; R558-A562 VanDerWaalsContact O-CB 3.29Å; R558-A562 WeakPolarHBondContact O-CB 3.42Å; R558-A562 PolarHBondContact O-N 2.92Å; R558-Q577 HydrophobicContact CG-CB 4.12Å; R558-Q577 HydrophobicContact CG-CG 4.38Å; R558-L581 HydrophobicContact CB-CD1 4.1Å; R558-L581 HydrophobicContact CB-CD2 4.43Å; R558-L581 HydrophobicContact CG-CD1 3.99Å; R558-L581 HydrophobicContact CG-CG 4.45Å
559	L	91.6	Very high	89.9	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-40.2	171.9	-77.2	166.1	0	0	0	111.3	V337 R339 S556 E557 Y563 Y578 L581 Y586 A589	V337-L559 HydrophobicContact CG1-CB 4.14Å; V337-L559 HydrophobicContact CG1-CD1 4.08Å; R339-L559 HydrophobicContact CG-CD1 4.18Å; S556-L559 WeakPolarHBondContact O-CB 3.37Å; S556-L559 PolarHBondContact O-N 3.5Å; E557-L559 PolarHBondContact O-N 3.16Å; E557-L559 VanDerWaalsContact O-N 3.13Å; L559-Y563 WeakPolarHBondContact O-CB 3.42Å; L559-Y563 PolarHBondContact O-N 3.11Å; L559-Y563 VanDerWaalsContact O-N 3.07Å; L559-Y578 HydrophobicContact CD2-CD1 4.33Å; L559-Y578 HydrophobicContact CD2-CE1 4.05Å; L559-L581 HydrophobicContact CB-CD1 4.44Å; L559-L581 HydrophobicContact CD2-CD1 3.72Å; L559-L581 HydrophobicContact CG-CD1 3.78Å; L559-Y586 HydrophobicContact CD1-CD1 3.96Å; L559-Y586 HydrophobicContact CD1-CE1 3.99Å; L559-A589 HydrophobicContact CD2-CB 4.22Å
560	M	87.8	Confident	89.8	Confident	31 Å²	31	48.8 Å²	48.8	15%	0.153	24%	0.237	C	C	.	.	H	α-helix	trans	-74.4	-38.7	179.3	-62.7	-55	-58.4	0	0	111.1	V337 Q338 I340 M355 E557 R558 A562 Y563 N564	V337-M560 HydrophobicContact CG1-CG 4.31Å; Q338-M560 HydrophobicContact CB-SD 3.9Å; I340-M560 HydrophobicContact CD1-CE 4.33Å; M355-M560 HydrophobicContact CG-CE 4.4Å; M355-M560 HydrophobicContact SD-CE 4.49Å; E557-M560 WeakPolarHBondContact O-CB 3.41Å; E557-M560 PolarHBondContact O-N 3.46Å; R558-M560 VanDerWaalsContact C-N 3.3Å; M560-A562 VanDerWaalsContact C-N 3.33Å; M560-A562 PolarHBondContact O-N 2.96Å; M560-Y563 PolarHBondContact O-N 3.26Å; M560-N564 WeakPolarHBondContact O-CB 3.41Å; M560-N564 PolarHBondContact O-N 3.27Å; M560-N564 PolarHBondContact O-ND2 3.4Å
561	T	88.9	Confident	89.7	Confident	46 Å²	46	52.2 Å²	52.2	28%	0.282	25%	0.25	S	S	.	.	H	α-helix	trans	-63.6	-41.1	174.8	62.4	0	0	0	0	111.4	E557 R558 Y563 N564 S565 Q577	E557-T561 PolarHBondContact O-N 2.99Å; R558-T561 VanDerWaalsContact CA-OG1 3.26Å; R558-T561 WeakPolarHBondContact CA-OG1 3.48Å; R558-T561 PolarHBondContact O-OG1 3.37Å; T561-Y563 PolarHBondContact O-N 3.14Å; T561-N564 PolarHBondContact O-N 3.43Å; T561-S565 PolarHBondContact O-N 2.94Å; T561-S565 PolarHBondContact O-OG 3.23Å; T561-Q577 PolarHBondContact OG1-OE1 3.34Å
562	A	93.1	Very high	89.8	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-41.8	176.6	0	0	0	0	0	112.1	R558 M560 S565 Y566 A574 Q577 Y578	R558-A562 VanDerWaalsContact O-CB 3.29Å; R558-A562 WeakPolarHBondContact O-CB 3.42Å; R558-A562 PolarHBondContact O-N 2.92Å; M560-A562 VanDerWaalsContact C-N 3.33Å; M560-A562 PolarHBondContact O-N 2.96Å; A562-S565 PolarHBondContact O-N 3.39Å; A562-Y566 PolarHBondContact O-N 3.4Å; A562-A574 WeakPolarHBondContact O-CB 3.46Å; A562-Q577 HydrophobicContact CB-CB 3.66Å; A562-Q577 VanDerWaalsContact N-OE1 3.09Å; A562-Y578 HydrophobicContact CB-CD1 4.01Å; A562-Y578 HydrophobicContact CB-CD2 4.01Å; A562-Y578 HydrophobicContact CB-CE1 3.78Å; A562-Y578 HydrophobicContact CB-CE2 3.78Å; A562-Y578 HydrophobicContact CB-CG 4.12Å
563	Y	90.7	Very high	90	Very high	6 Å²	6	50 Å²	50	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-44.2	175.9	178	-90.3	0	0	0	112	I340 L342 E345 M355 L559 M560 T561 S565 Y566 K567 Y578	I340-Y563 HydrophobicContact CB-CD2 4.2Å; I340-Y563 HydrophobicContact CB-CE2 4.25Å; I340-Y563 HydrophobicContact CD1-CD1 4.36Å; I340-Y563 HydrophobicContact CD1-CD2 4.12Å; I340-Y563 HydrophobicContact CD1-CE1 4.28Å; I340-Y563 HydrophobicContact CD1-CE2 3.98Å; I340-Y563 HydrophobicContact CD1-CG 4.26Å; I340-Y563 HydrophobicContact CG2-CD2 4.08Å; I340-Y563 HydrophobicContact CG2-CE2 3.67Å; L342-Y563 HydrophobicContact CD2-CD2 3.73Å; L342-Y563 HydrophobicContact CD2-CE2 3.93Å; E345-Y563 PolarHBondContact OE1-OH 3.37Å; E345-Y563 VanDerWaalsContact OE1-OH 3.09Å; E345-Y563 WeakPolarHBondContact OE2-CE2 3.39Å; E345-Y563 PolarHBondContact OE2-OH 2.84Å; M355-Y563 HydrophobicContact CG-CE1 4.11Å; M355-Y563 HydrophobicContact SD-CD1 3.77Å; M355-Y563 HydrophobicContact SD-CE1 3.22Å; M355-Y563 WeakPolarHBondContact SD-CE1 3.45Å; L559-Y563 WeakPolarHBondContact O-CB 3.42Å; L559-Y563 PolarHBondContact O-N 3.11Å; L559-Y563 VanDerWaalsContact O-N 3.07Å; M560-Y563 PolarHBondContact O-N 3.26Å; T561-Y563 PolarHBondContact O-N 3.14Å; Y563-S565 VanDerWaalsContact C-N 3.34Å; Y563-S565 PolarHBondContact O-N 3.1Å; Y563-Y566 WeakPolarHBondContact O-CB 3.36Å; Y563-Y566 PolarHBondContact O-N 2.8Å; Y563-Y566 VanDerWaalsContact O-N 3.15Å; Y563-K567 HydrophobicContact CD1-CG 4.13Å; Y563-K567 HydrophobicContact CE1-CD 4.4Å; Y563-K567 HydrophobicContact CE1-CG 3.61Å; Y563-K567 HydrophobicContact CE2-CG 4.48Å; Y563-K567 PolarHBondContact O-N 3.15Å; Y563-K567 WeakPolarHBondContact OH-CE 3.24Å; Y563-Y578 WeakPolarHBondContact CA-OH 3.47Å; Y563-Y578 PolarHBondContact N-OH 2.88Å
564	N	87.9	Confident	90.3	Very high	71 Å²	71	49.8 Å²	49.8	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-42.5	176.9	-69	-15.5	0	0	0	111.1	M560 T561 Y566 K567 D568	M560-N564 WeakPolarHBondContact O-CB 3.41Å; M560-N564 PolarHBondContact O-N 3.27Å; M560-N564 PolarHBondContact O-ND2 3.4Å; T561-N564 PolarHBondContact O-N 3.43Å; N564-Y566 VanDerWaalsContact C-N 3.31Å; N564-Y566 PolarHBondContact O-N 3.08Å; N564-K567 PolarHBondContact O-N 3.32Å; N564-D568 WeakPolarHBondContact O-CB 3.47Å; N564-D568 VanDerWaalsContact O-CG 3.31Å; N564-D568 PolarHBondContact O-N 3.49Å
565	S	90.8	Very high	90.7	Very high	22 Å²	22	41.2 Å²	41.2	15%	0.154	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-38.5	173.7	-62.6	0	0	0	0	112.5	T561 A562 Y563 D568 G569 D570	T561-S565 PolarHBondContact O-N 2.94Å; T561-S565 PolarHBondContact O-OG 3.23Å; A562-S565 PolarHBondContact O-N 3.39Å; Y563-S565 VanDerWaalsContact C-N 3.34Å; Y563-S565 PolarHBondContact O-N 3.1Å; S565-D568 PolarHBondContact O-N 3.32Å; S565-G569 PolarHBondContact O-N 3.43Å; S565-D570 CarbonylContact O-C 3.54Å; S565-D570 WeakPolarHBondContact O-CA 3.42Å; S565-D570 PolarHBondContact O-N 3.42Å
566	Y	91.6	Very high	91	Very high	24 Å²	24	39.1 Å²	39.1	9%	0.094	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-45.6	174.9	177.7	-99.3	0	0	0	111.7	L342 A562 Y563 N564 D568 G569 Y571 I596 E601	L342-Y566 HydrophobicContact CD1-CD1 4.11Å; L342-Y566 HydrophobicContact CD1-CD2 3.95Å; L342-Y566 HydrophobicContact CD1-CE1 4.25Å; L342-Y566 HydrophobicContact CD1-CE2 4.12Å; L342-Y566 HydrophobicContact CD1-CG 3.97Å; L342-Y566 HydrophobicContact CD2-CD1 3.61Å; L342-Y566 HydrophobicContact CD2-CE1 3.83Å; L342-Y566 HydrophobicContact CD2-CG 4.2Å; L342-Y566 HydrophobicContact CG-CD1 4.48Å; A562-Y566 PolarHBondContact O-N 3.4Å; Y563-Y566 WeakPolarHBondContact O-CB 3.36Å; Y563-Y566 PolarHBondContact O-N 2.8Å; Y563-Y566 VanDerWaalsContact O-N 3.15Å; N564-Y566 VanDerWaalsContact C-N 3.31Å; N564-Y566 PolarHBondContact O-N 3.08Å; Y566-D568 VanDerWaalsContact C-N 3.34Å; Y566-D568 PolarHBondContact O-N 2.92Å; Y566-G569 PolarHBondContact O-N 3.46Å; Y566-G569 VanDerWaalsContact O-N 3.1Å; Y566-Y571 AromaticContact CD2-CD1 3.59Å; Y566-Y571 HydrophobicContact CD2-CD1 3.59Å; Y566-Y571 AromaticContact CD2-CE1 3.76Å; Y566-Y571 HydrophobicContact CD2-CE1 3.76Å; Y566-Y571 AromaticContact CE2-CD1 3.67Å; Y566-Y571 HydrophobicContact CE2-CD1 3.67Å; Y566-Y571 AromaticContact CE2-CE1 3.53Å; Y566-Y571 HydrophobicContact CE2-CE1 3.53Å; Y566-I596 HydrophobicContact CD2-CD1 3.84Å; Y566-I596 HydrophobicContact CD2-CG1 3.89Å; Y566-I596 HydrophobicContact CE2-CD1 4.35Å; Y566-I596 HydrophobicContact CE2-CG1 3.87Å; Y566-E601 WeakPolarHBondContact CE2-OE2 3.07Å
567	K	88.6	Confident	91.4	Very high	102 Å²	102	38.9 Å²	38.9	44%	0.443	20%	0.2	S	C	.	.	H	α-helix	trans	-66.3	-34.2	176.7	-70.1	-61.3	-170.8	-176.4	0	113.3	E345 Y563 N564 G569	E345-K567 WeakPolarHBondContact OE1-CE 3.35Å; E345-K567 IonicContact OE1-NZ 2.79Å; E345-K567 PolarHBondContact OE1-NZ 3.24Å; E345-K567 IonicContact OE2-NZ 3.03Å; E345-K567 PolarHBondContact OE2-NZ 2.83Å; Y563-K567 HydrophobicContact CD1-CG 4.13Å; Y563-K567 HydrophobicContact CE1-CD 4.4Å; Y563-K567 HydrophobicContact CE1-CG 3.61Å; Y563-K567 HydrophobicContact CE2-CG 4.48Å; Y563-K567 PolarHBondContact O-N 3.15Å; Y563-K567 WeakPolarHBondContact OH-CE 3.24Å; N564-K567 PolarHBondContact O-N 3.32Å; K567-G569 PolarHBondContact O-N 3.34Å
568	D	88.6	Confident	91.8	Very high	119 Å²	119	33.8 Å²	33.8	64%	0.636	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-9	174	-75.6	-4.9	0	0	0	112.5	N564 S565 Y566	N564-D568 WeakPolarHBondContact O-CB 3.47Å; N564-D568 VanDerWaalsContact O-CG 3.31Å; N564-D568 PolarHBondContact O-N 3.49Å; S565-D568 PolarHBondContact O-N 3.32Å; Y566-D568 VanDerWaalsContact C-N 3.34Å; Y566-D568 PolarHBondContact O-N 2.92Å
569	G	89.9	Confident	92.1	Very high	37 Å²	37	31.4 Å²	31.4	38%	0.381	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	7.7	-177	0	0	0	0	0	114.3	S565 Y566 K567 Y571	S565-G569 PolarHBondContact O-N 3.43Å; Y566-G569 PolarHBondContact O-N 3.46Å; Y566-G569 VanDerWaalsContact O-N 3.1Å; K567-G569 PolarHBondContact O-N 3.34Å; G569-Y571 VanDerWaalsContact C-N 3.31Å; G569-Y571 WeakPolarHBondContact O-CD2 3.3Å; G569-Y571 PolarHBondContact O-N 3.17Å; G569-Y571 VanDerWaalsContact O-N 3.17Å
570	D	91.9	Very high	92.3	Very high	70 Å²	70	31.5 Å²	31.5	37%	0.374	17%	0.168	S	C	.	.			trans	-87.8	71.7	172.6	-167.4	-10.5	0	0	0	110.4	S565 N572 A573 A574	S565-D570 CarbonylContact O-C 3.54Å; S565-D570 WeakPolarHBondContact O-CA 3.42Å; S565-D570 PolarHBondContact O-N 3.42Å; D570-N572 PolarHBondContact O-N 3.39Å; D570-A573 HydrophobicContact CB-CB 4.29Å; D570-A573 VanDerWaalsContact CG-CB 3.44Å; D570-A573 PolarHBondContact O-N 3.2Å; D570-A573 WeakPolarHBondContact OD1-CB 3.44Å; D570-A573 PolarHBondContact OD1-N 3.44Å; D570-A573 WeakPolarHBondContact OD2-CB 3.45Å; D570-A574 WeakPolarHBondContact O-CB 3.25Å; D570-A574 PolarHBondContact O-N 2.91Å
571	Y	92.8	Very high	92.7	Very high	71 Å²	71	30 Å²	30	28%	0.278	16%	0.161	S	C	.	.	H	α-helix	trans	-59.9	-31.2	179.7	-54.7	-63	0	0	0	112.5	Y566 G569 A574 V575 I596 E601	Y566-Y571 AromaticContact CD2-CD1 3.59Å; Y566-Y571 HydrophobicContact CD2-CD1 3.59Å; Y566-Y571 AromaticContact CD2-CE1 3.76Å; Y566-Y571 HydrophobicContact CD2-CE1 3.76Å; Y566-Y571 AromaticContact CE2-CD1 3.67Å; Y566-Y571 HydrophobicContact CE2-CD1 3.67Å; Y566-Y571 AromaticContact CE2-CE1 3.53Å; Y566-Y571 HydrophobicContact CE2-CE1 3.53Å; G569-Y571 VanDerWaalsContact C-N 3.31Å; G569-Y571 WeakPolarHBondContact O-CD2 3.3Å; G569-Y571 PolarHBondContact O-N 3.17Å; G569-Y571 VanDerWaalsContact O-N 3.17Å; Y571-A574 PolarHBondContact O-N 2.81Å; Y571-V575 WeakPolarHBondContact O-CB 3.33Å; Y571-V575 VanDerWaalsContact O-CG2 3.3Å; Y571-V575 WeakPolarHBondContact O-CG2 3.34Å; Y571-V575 PolarHBondContact O-N 3.22Å; Y571-I596 HydrophobicContact CD1-CG2 4.48Å; Y571-E601 HydrophobicContact CD1-CB 4.01Å; Y571-E601 VanDerWaalsContact CD1-OE2 3.29Å; Y571-E601 WeakPolarHBondContact CD1-OE2 3.4Å; Y571-E601 HydrophobicContact CD2-CB 3.74Å; Y571-E601 HydrophobicContact CE1-CB 4.32Å; Y571-E601 WeakPolarHBondContact CE1-OE2 3.15Å; Y571-E601 HydrophobicContact CE2-CB 4.06Å; Y571-E601 HydrophobicContact CE2-CG 4.45Å; Y571-E601 HydrophobicContact CG-CB 3.7Å
572	N	92.7	Very high	93.1	Very high	40 Å²	40	27.8 Å²	27.8	21%	0.214	15%	0.147	C	C	.	.	H	α-helix	trans	-68.6	-49.8	-178.7	-76.2	-22.7	0	0	0	111.2	D570 A574 I576 A602 T603 I604	D570-N572 PolarHBondContact O-N 3.39Å; N572-A574 VanDerWaalsContact C-N 3.34Å; N572-A574 PolarHBondContact O-N 2.93Å; N572-I576 PolarHBondContact O-N 3.07Å; N572-A602 WeakPolarHBondContact OD1-CA 3.5Å; N572-T603 PolarHBondContact ND2-OG1 3.46Å; N572-T603 PolarHBondContact OD1-N 2.91Å; N572-I604 HydrophobicContact CB-CD1 3.47Å; N572-I604 VanDerWaalsContact CB-CD1 3.47Å; N572-I604 HydrophobicContact CB-CG1 3.85Å; N572-I604 WeakPolarHBondContact O-CD1 3.37Å; N572-I604 WeakPolarHBondContact OD1-CG1 3.35Å
573	A	93.1	Very high	93.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-44.9	172.6	0	0	0	0	0	111.7	F231 D570 V575 I576 Q577	F231-A573 VanDerWaalsContact O-CB 3.31Å; F231-A573 WeakPolarHBondContact O-CB 3.26Å; D570-A573 HydrophobicContact CB-CB 4.29Å; D570-A573 VanDerWaalsContact CG-CB 3.44Å; D570-A573 PolarHBondContact O-N 3.2Å; D570-A573 WeakPolarHBondContact OD1-CB 3.44Å; D570-A573 PolarHBondContact OD1-N 3.44Å; D570-A573 WeakPolarHBondContact OD2-CB 3.45Å; A573-V575 PolarHBondContact O-N 3.05Å; A573-I576 PolarHBondContact O-N 3.45Å; A573-Q577 WeakPolarHBondContact O-CG 3.23Å; A573-Q577 PolarHBondContact O-N 3.48Å
574	A	94.8	Very high	93.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-48.4	-178.7	0	0	0	0	0	112.4	A562 D570 Y571 N572 I576 Q577 Y578 I596	A562-A574 WeakPolarHBondContact O-CB 3.46Å; D570-A574 WeakPolarHBondContact O-CB 3.25Å; D570-A574 PolarHBondContact O-N 2.91Å; Y571-A574 PolarHBondContact O-N 2.81Å; N572-A574 VanDerWaalsContact C-N 3.34Å; N572-A574 PolarHBondContact O-N 2.93Å; A574-I576 PolarHBondContact O-N 3.18Å; A574-Q577 PolarHBondContact O-N 3.32Å; A574-Y578 WeakPolarHBondContact O-CD2 3.39Å; A574-Y578 PolarHBondContact O-N 2.98Å; A574-I596 HydrophobicContact CB-CD1 4.24Å
575	V	95.1	Very high	93.8	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.018	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-45	-179.1	168.6	0	0	0	0	111.8	Y571 A573 Q577 Y578 L579 I596 L597 A602	Y571-V575 WeakPolarHBondContact O-CB 3.33Å; Y571-V575 VanDerWaalsContact O-CG2 3.3Å; Y571-V575 WeakPolarHBondContact O-CG2 3.34Å; Y571-V575 PolarHBondContact O-N 3.22Å; A573-V575 PolarHBondContact O-N 3.05Å; V575-Q577 VanDerWaalsContact C-N 3.31Å; V575-Q577 PolarHBondContact O-N 3.29Å; V575-Y578 PolarHBondContact O-N 3.4Å; V575-L579 HydrophobicContact CG1-CD1 3.72Å; V575-L579 HydrophobicContact CG1-CG 4Å; V575-L579 WeakPolarHBondContact O-CB 3.48Å; V575-L579 WeakPolarHBondContact O-CG 3.38Å; V575-L579 PolarHBondContact O-N 3.49Å; V575-I596 HydrophobicContact CG2-CB 3.51Å; V575-I596 HydrophobicContact CG2-CD1 3.78Å; V575-I596 HydrophobicContact CG2-CG1 4.26Å; V575-I596 HydrophobicContact CG2-CG2 3.25Å; V575-L597 HydrophobicContact CG1-CD2 4.14Å; V575-L597 HydrophobicContact CG1-CG 4.38Å; V575-A602 HydrophobicContact CB-CB 4.39Å; V575-A602 HydrophobicContact CG2-CB 3.79Å
576	I	94.9	Very high	94	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.6	-40.4	-179.4	-60.3	-170.6	0	0	0	111	L230 F231 I239 F263 L269 N572 A573 A574 L579 L580 I604	L230-I576 HydrophobicContact CD1-CG2 4.11Å; L230-I576 HydrophobicContact CG-CG2 4.11Å; F231-I576 HydrophobicContact CD1-CG2 3.81Å; F231-I576 HydrophobicContact CE1-CG2 3.89Å; I239-I576 HydrophobicContact CD1-CD1 3.68Å; I239-I576 HydrophobicContact CG1-CD1 4.03Å; F263-I576 HydrophobicContact CE1-CG2 3.92Å; F263-I576 HydrophobicContact CZ-CG2 4.08Å; L269-I576 HydrophobicContact CD1-CD1 4.17Å; L269-I576 HydrophobicContact CD1-CG1 4.07Å; L269-I576 HydrophobicContact CD1-CG2 4.11Å; N572-I576 PolarHBondContact O-N 3.07Å; A573-I576 PolarHBondContact O-N 3.45Å; A574-I576 PolarHBondContact O-N 3.18Å; I576-L579 PolarHBondContact O-N 3.28Å; I576-L580 PolarHBondContact O-N 2.93Å; I576-L580 VanDerWaalsContact O-N 3.08Å; I576-I604 HydrophobicContact CD1-CD1 3.75Å; I576-I604 HydrophobicContact CG1-CD1 3.66Å
577	Q	95.8	Very high	94.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.4	-44.4	177	-67.3	-177.1	41.2	0	0	111.6	F231 R558 T561 A562 A573 A574 V575 L580 L581	F231-Q577 HydrophobicContact CB-CG 3.95Å; F231-Q577 HydrophobicContact CD1-CG 3.71Å; F231-Q577 HydrophobicContact CG-CG 3.99Å; F231-Q577 PolarHBondContact O-NE2 3.5Å; R558-Q577 HydrophobicContact CG-CB 4.12Å; R558-Q577 HydrophobicContact CG-CG 4.38Å; T561-Q577 PolarHBondContact OG1-OE1 3.34Å; A562-Q577 HydrophobicContact CB-CB 3.66Å; A562-Q577 VanDerWaalsContact N-OE1 3.09Å; A573-Q577 WeakPolarHBondContact O-CG 3.23Å; A573-Q577 PolarHBondContact O-N 3.48Å; A574-Q577 PolarHBondContact O-N 3.32Å; V575-Q577 VanDerWaalsContact C-N 3.31Å; V575-Q577 PolarHBondContact O-N 3.29Å; Q577-L580 PolarHBondContact O-N 3Å; Q577-L581 PolarHBondContact O-N 3.47Å
578	Y	96.8	Very high	94.5	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-65	-38.2	174.3	-75.7	-54.7	0	0	0	112.5	L342 L559 A562 Y563 A574 V575 L580 L581 A582 A589 N592 I596	L342-Y578 HydrophobicContact CD1-CE2 4Å; L559-Y578 HydrophobicContact CD2-CD1 4.33Å; L559-Y578 HydrophobicContact CD2-CE1 4.05Å; A562-Y578 HydrophobicContact CB-CD1 4.01Å; A562-Y578 HydrophobicContact CB-CD2 4.01Å; A562-Y578 HydrophobicContact CB-CE1 3.78Å; A562-Y578 HydrophobicContact CB-CE2 3.78Å; A562-Y578 HydrophobicContact CB-CG 4.12Å; Y563-Y578 WeakPolarHBondContact CA-OH 3.47Å; Y563-Y578 PolarHBondContact N-OH 2.88Å; A574-Y578 WeakPolarHBondContact O-CD2 3.39Å; A574-Y578 PolarHBondContact O-N 2.98Å; V575-Y578 PolarHBondContact O-N 3.4Å; Y578-L580 VanDerWaalsContact C-N 3.32Å; Y578-L580 PolarHBondContact O-N 3.35Å; Y578-L581 CarbonylContact O-C 3.47Å; Y578-L581 PolarHBondContact O-N 2.9Å; Y578-A582 WeakPolarHBondContact O-CB 3.34Å; Y578-A582 PolarHBondContact O-N 3.31Å; Y578-A589 HydrophobicContact CD1-CB 4.04Å; Y578-N592 HydrophobicContact CD1-CB 3.93Å; Y578-N592 HydrophobicContact CD2-CB 3.99Å; Y578-N592 HydrophobicContact CE1-CB 3.92Å; Y578-N592 WeakPolarHBondContact CE1-ND2 3.43Å; Y578-N592 HydrophobicContact CE2-CB 3.97Å; Y578-N592 HydrophobicContact CG-CB 3.98Å; Y578-N592 PolarHBondContact OH-ND2 2.88Å; Y578-I596 HydrophobicContact CD2-CD1 3.81Å; Y578-I596 HydrophobicContact CE2-CD1 4.01Å
579	L	96.2	Very high	94.9	Very high	9 Å²	9	13.6 Å²	13.6	5%	0.047	8%	0.076	C	C	.	.	H	α-helix	trans	-60.8	-40.7	176.4	-75.2	174.3	0	0	0	111.8	F263 L269 V575 I576 A582 E583 A593 H617	F263-L579 HydrophobicContact CE2-CB 3.96Å; F263-L579 HydrophobicContact CZ-CB 3.97Å; L269-L579 HydrophobicContact CD1-CD1 4.34Å; V575-L579 HydrophobicContact CG1-CD1 3.72Å; V575-L579 HydrophobicContact CG1-CG 4Å; V575-L579 WeakPolarHBondContact O-CB 3.48Å; V575-L579 WeakPolarHBondContact O-CG 3.38Å; V575-L579 PolarHBondContact O-N 3.49Å; I576-L579 PolarHBondContact O-N 3.28Å; L579-A582 WeakPolarHBondContact O-CB 3.47Å; L579-A582 PolarHBondContact O-N 2.95Å; L579-E583 WeakPolarHBondContact O-CG 3.22Å; L579-E583 PolarHBondContact O-N 3.37Å; L579-A593 HydrophobicContact CD2-CB 3.99Å; L579-A593 HydrophobicContact CG-CB 4.36Å; L579-H617 WeakPolarHBondContact CD2-NE2 3.19Å
580	L	96.3	Very high	95.3	Very high	6 Å²	6	11.9 Å²	11.9	3%	0.031	6%	0.057	C	C	.	.	H	α-helix	trans	-64	-43.5	175.9	-177.3	82.9	0	0	0	111.7	F231 F263 I576 Q577 Y578 A582 E583 Q584	F231-L580 HydrophobicContact CE1-CB 4.33Å; F231-L580 HydrophobicContact CE1-CD2 4.18Å; F231-L580 HydrophobicContact CE2-CD2 4.43Å; F231-L580 HydrophobicContact CZ-CD2 3.63Å; F231-L580 HydrophobicContact CZ-CG 4.45Å; F263-L580 HydrophobicContact CB-CD1 4.02Å; F263-L580 HydrophobicContact CD1-CD1 4Å; F263-L580 HydrophobicContact CD2-CB 4.31Å; F263-L580 HydrophobicContact CD2-CD1 3.72Å; F263-L580 HydrophobicContact CE1-CD1 4.42Å; F263-L580 VanDerWaalsContact CE2-CA 3.43Å; F263-L580 HydrophobicContact CE2-CB 3.92Å; F263-L580 HydrophobicContact CE2-CD1 4.19Å; F263-L580 HydrophobicContact CG-CD1 3.62Å; F263-L580 HydrophobicContact CZ-CB 4.01Å; I576-L580 PolarHBondContact O-N 2.93Å; I576-L580 VanDerWaalsContact O-N 3.08Å; Q577-L580 PolarHBondContact O-N 3Å; Y578-L580 VanDerWaalsContact C-N 3.32Å; Y578-L580 PolarHBondContact O-N 3.35Å; L580-A582 VanDerWaalsContact C-N 3.3Å; L580-E583 PolarHBondContact O-N 2.92Å; L580-Q584 PolarHBondContact O-N 3.34Å; L580-Q584 PolarHBondContact O-NE2 2.88Å
581	L	96.8	Very high	95.5	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-68.4	-33.3	177	-70.2	162.8	0	0	0	111.2	R558 L559 Q577 Y578 E583 Q584 G585 Y586 A589	R558-L581 HydrophobicContact CB-CD1 4.1Å; R558-L581 HydrophobicContact CB-CD2 4.43Å; R558-L581 HydrophobicContact CG-CD1 3.99Å; R558-L581 HydrophobicContact CG-CG 4.45Å; L559-L581 HydrophobicContact CB-CD1 4.44Å; L559-L581 HydrophobicContact CD2-CD1 3.72Å; L559-L581 HydrophobicContact CG-CD1 3.78Å; Q577-L581 PolarHBondContact O-N 3.47Å; Y578-L581 CarbonylContact O-C 3.47Å; Y578-L581 PolarHBondContact O-N 2.9Å; L581-E583 VanDerWaalsContact C-N 3.33Å; L581-E583 PolarHBondContact O-N 3.27Å; L581-Q584 WeakPolarHBondContact O-CB 3.47Å; L581-Q584 PolarHBondContact O-N 3.49Å; L581-Q584 VanDerWaalsContact O-N 3.17Å; L581-G585 PolarHBondContact O-N 3.31Å; L581-Y586 HydrophobicContact CB-CD2 4.25Å; L581-Y586 HydrophobicContact CD2-CD2 4.06Å; L581-Y586 HydrophobicContact CD2-CE2 3.9Å; L581-Y586 WeakPolarHBondContact O-CD2 3.31Å; L581-Y586 PolarHBondContact O-N 3.08Å; L581-A589 HydrophobicContact CB-CB 3.42Å; L581-A589 VanDerWaalsContact CB-CB 3.42Å
582	A	96.7	Very high	95.7	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-64.4	-37.7	174.8	0	0	0	0	0	111.9	Y578 L579 L580 Q584 G585 A589 Q590	Y578-A582 WeakPolarHBondContact O-CB 3.34Å; Y578-A582 PolarHBondContact O-N 3.31Å; L579-A582 WeakPolarHBondContact O-CB 3.47Å; L579-A582 PolarHBondContact O-N 2.95Å; L580-A582 VanDerWaalsContact C-N 3.3Å; A582-Q584 VanDerWaalsContact C-N 3.34Å; A582-G585 PolarHBondContact O-N 3.08Å; A582-G585 VanDerWaalsContact O-N 3.16Å; A582-A589 HydrophobicContact CB-CB 4.39Å; A582-Q590 HydrophobicContact CB-CB 4.31Å; A582-Q590 HydrophobicContact CB-CG 3.53Å; A582-Q590 PolarHBondContact O-NE2 2.94Å
583	E	95.4	Very high	95.8	Very high	8 Å²	8	3.2 Å²	3.2	4%	0.037	2%	0.016	C	C	.	.	H	α-helix	trans	-67.2	-31.4	172.7	-74.8	-67.4	123.9	0	0	112.7	F263 V296 R300 L579 L580 L581 G585 R620	F263-E583 HydrophobicContact CD2-CG 4.09Å; F263-E583 HydrophobicContact CE2-CG 4.34Å; V296-E583 HydrophobicContact CG2-CB 4.4Å; R300-E583 IonicContact CZ-OE2 3.49Å; R300-E583 IonicContact NE-OE2 3.76Å; R300-E583 IonicContact NH2-OE2 3.3Å; R300-E583 PolarHBondContact NH2-OE2 3.07Å; L579-E583 WeakPolarHBondContact O-CG 3.22Å; L579-E583 PolarHBondContact O-N 3.37Å; L580-E583 PolarHBondContact O-N 2.92Å; L581-E583 VanDerWaalsContact C-N 3.33Å; L581-E583 PolarHBondContact O-N 3.27Å; E583-G585 PolarHBondContact O-N 3.03Å; E583-R620 IonicContact OE1-CZ 3.98Å; E583-R620 IonicContact OE1-NH1 3.69Å; E583-R620 PolarHBondContact OE1-NH1 3.47Å; E583-R620 IonicContact OE1-NH2 2.92Å
584	Q	95.4	Very high	96	Very high	3 Å²	3	3.2 Å²	3.2	1%	0.014	2%	0.016	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.7	172.1	-69.8	168.3	63.1	0	0	113.3	I292 M295 V296 L580 L581 A582 Y586	I292-Q584 HydrophobicContact CG2-CG 3.85Å; M295-Q584 HydrophobicContact CE-CB 4.4Å; V296-Q584 HydrophobicContact CG2-CG 3.87Å; L580-Q584 PolarHBondContact O-N 3.34Å; L580-Q584 PolarHBondContact O-NE2 2.88Å; L581-Q584 WeakPolarHBondContact O-CB 3.47Å; L581-Q584 PolarHBondContact O-N 3.49Å; L581-Q584 VanDerWaalsContact O-N 3.17Å; A582-Q584 VanDerWaalsContact C-N 3.34Å; Q584-Y586 HydrophobicContact CB-CD2 3.91Å; Q584-Y586 HydrophobicContact CB-CE2 4.02Å
585	G	94.7	Very high	96	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	9.6	176.2	0	0	0	0	0	115.6	Y299 K547 L581 A582 E583 E587 Q624	Y299-G585 VanDerWaalsContact CG-CA 3.43Å; K547-G585 WeakPolarHBondContact CE-O 3.33Å; K547-G585 PolarHBondContact NZ-O 2.99Å; L581-G585 PolarHBondContact O-N 3.31Å; A582-G585 PolarHBondContact O-N 3.08Å; A582-G585 VanDerWaalsContact O-N 3.16Å; E583-G585 PolarHBondContact O-N 3.03Å; G585-E587 PolarHBondContact O-N 3.27Å; G585-Q624 PolarHBondContact O-NE2 3.36Å; G585-Q624 VanDerWaalsContact O-NE2 3.14Å; G585-Q624 PolarHBondContact O-OE1 3.45Å; G585-Q624 VanDerWaalsContact O-OE1 3.13Å
586	Y	96.1	Very high	96	Very high	3 Å²	3	3.9 Å²	3.9	1%	0.012	2%	0.019	C	C	.	.			trans	-67.6	114.6	174.6	-73.5	-101.2	0	0	0	110.1	M295 E551 W555 S556 L559 L581 Q584 V588 A589 Q590	M295-Y586 HydrophobicContact CE-CE2 4.07Å; E551-Y586 VanDerWaalsContact CA-OH 3.28Å; E551-Y586 WeakPolarHBondContact CA-OH 3.39Å; E551-Y586 HydrophobicContact CB-CD1 4.26Å; E551-Y586 HydrophobicContact CB-CE1 3.64Å; E551-Y586 HydrophobicContact CG-CD1 3.97Å; E551-Y586 HydrophobicContact CG-CD2 4.49Å; E551-Y586 HydrophobicContact CG-CE1 3.74Å; E551-Y586 HydrophobicContact CG-CE2 4.29Å; E551-Y586 HydrophobicContact CG-CG 4.36Å; E551-Y586 WeakPolarHBondContact O-CE1 3.49Å; E551-Y586 PolarHBondContact O-OH 3.48Å; W555-Y586 PolarHBondContact NE1-OH 3.49Å; W555-Y586 VanDerWaalsContact NE1-OH 3.15Å; S556-Y586 WeakPolarHBondContact CB-OH 3.31Å; L559-Y586 HydrophobicContact CD1-CD1 3.96Å; L559-Y586 HydrophobicContact CD1-CE1 3.99Å; L581-Y586 HydrophobicContact CB-CD2 4.25Å; L581-Y586 HydrophobicContact CD2-CD2 4.06Å; L581-Y586 HydrophobicContact CD2-CE2 3.9Å; L581-Y586 WeakPolarHBondContact O-CD2 3.31Å; L581-Y586 PolarHBondContact O-N 3.08Å; Q584-Y586 HydrophobicContact CB-CD2 3.91Å; Q584-Y586 HydrophobicContact CB-CE2 4.02Å; Y586-V588 VanDerWaalsContact C-N 3.35Å; Y586-V588 PolarHBondContact O-N 2.93Å; Y586-A589 PolarHBondContact O-N 3.32Å; Y586-Q590 WeakPolarHBondContact O-CG 3.23Å; Y586-Q590 PolarHBondContact O-N 3.25Å; Y586-Q590 VanDerWaalsContact O-N 3.08Å
587	E	95.5	Very high	95.9	Very high	25 Å²	25	4 Å²	4	12%	0.117	2%	0.019	C	C	.	.	H	α-helix	trans	-57.2	-47.3	177.2	172	-82	128	0	0	111.6	R341 G585 A589 Q590 S591 A621 Q624 Y626	R341-E587 IonicContact CZ-OE2 3.37Å; R341-E587 IonicContact NE-OE1 2.71Å; R341-E587 PolarHBondContact NE-OE1 3.04Å; R341-E587 IonicContact NE-OE2 3.02Å; R341-E587 PolarHBondContact NE-OE2 3.41Å; R341-E587 IonicContact NH2-OE2 2.98Å; R341-E587 PolarHBondContact NH2-OE2 2.81Å; G585-E587 PolarHBondContact O-N 3.27Å; E587-A589 VanDerWaalsContact C-N 3.26Å; E587-A589 PolarHBondContact O-N 3.22Å; E587-Q590 WeakPolarHBondContact O-CA 3.11Å; E587-Q590 WeakPolarHBondContact O-CB 3.44Å; E587-Q590 PolarHBondContact O-N 2.87Å; E587-S591 PolarHBondContact O-N 2.88Å; E587-S591 PolarHBondContact O-OG 2.92Å; E587-S591 PolarHBondContact OE1-OG 2.78Å; E587-A621 HydrophobicContact CG-CB 4.44Å; E587-Q624 HydrophobicContact CB-CB 4.11Å; E587-Q624 HydrophobicContact CG-CB 4.12Å; E587-Y626 WeakPolarHBondContact OE1-CB 2.85Å; E587-Y626 WeakPolarHBondContact OE1-CD1 3.41Å; E587-Y626 VanDerWaalsContact OE1-CG 3.3Å
588	V	95.2	Very high	95.8	Very high	7 Å²	7	5.5 Å²	5.5	4%	0.042	3%	0.027	C	C	.	.	H	α-helix	trans	-60.3	-36.6	179.8	174.5	0	0	0	0	112.2	R339 I340 R341 Y586 S591 N592	R339-V588 HydrophobicContact CB-CG1 4.46Å; R339-V588 HydrophobicContact CB-CG2 4.09Å; I340-V588 WeakPolarHBondContact O-CG1 3.28Å; R341-V588 HydrophobicContact CG-CB 4.42Å; R341-V588 HydrophobicContact CG-CG1 3.97Å; R341-V588 HydrophobicContact CG-CG2 3.99Å; Y586-V588 VanDerWaalsContact C-N 3.35Å; Y586-V588 PolarHBondContact O-N 2.93Å; V588-S591 WeakPolarHBondContact CA-OG 3.33Å; V588-S591 PolarHBondContact O-OG 3.03Å; V588-S591 VanDerWaalsContact O-OG 3.11Å; V588-N592 VanDerWaalsContact O-CB 3.28Å; V588-N592 WeakPolarHBondContact O-CB 3.39Å; V588-N592 PolarHBondContact O-N 2.85Å; V588-N592 PolarHBondContact O-ND2 3.45Å; V588-N592 PolarHBondContact O-OD1 2.92Å
589	A	97.1	Very high	95.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-72.3	-33.4	176.4	0	0	0	0	0	112.1	L559 Y578 L581 A582 Y586 E587 A593	L559-A589 HydrophobicContact CD2-CB 4.22Å; Y578-A589 HydrophobicContact CD1-CB 4.04Å; L581-A589 HydrophobicContact CB-CB 3.42Å; L581-A589 VanDerWaalsContact CB-CB 3.42Å; A582-A589 HydrophobicContact CB-CB 4.39Å; Y586-A589 PolarHBondContact O-N 3.32Å; E587-A589 VanDerWaalsContact C-N 3.26Å; E587-A589 PolarHBondContact O-N 3.22Å; A589-A593 VanDerWaalsContact O-CB 3.24Å; A589-A593 WeakPolarHBondContact O-CB 3.34Å; A589-A593 PolarHBondContact O-N 2.77Å
590	Q	97.3	Very high	95	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.2	-47.5	174.9	-68	164.9	3.1	0	0	111	Y299 A582 Y586 E587 A594 R620 A621 Q624	Y299-Q590 VanDerWaalsContact CZ-NE2 3.3Å; Y299-Q590 PolarHBondContact OH-NE2 2.9Å; A582-Q590 HydrophobicContact CB-CB 4.31Å; A582-Q590 HydrophobicContact CB-CG 3.53Å; A582-Q590 PolarHBondContact O-NE2 2.94Å; Y586-Q590 WeakPolarHBondContact O-CG 3.23Å; Y586-Q590 PolarHBondContact O-N 3.25Å; Y586-Q590 VanDerWaalsContact O-N 3.08Å; E587-Q590 WeakPolarHBondContact O-CA 3.11Å; E587-Q590 WeakPolarHBondContact O-CB 3.44Å; E587-Q590 PolarHBondContact O-N 2.87Å; Q590-A594 WeakPolarHBondContact O-CB 3.28Å; Q590-A594 PolarHBondContact O-N 3.43Å; Q590-R620 HydrophobicContact CG-CB 4.26Å; Q590-R620 VanDerWaalsContact OE1-CB 3.29Å; Q590-R620 PolarHBondContact OE1-O 3.39Å; Q590-A621 HydrophobicContact CB-CB 4.04Å; Q590-Q624 VanDerWaalsContact CD-NE2 3.27Å
591	S	96.8	Very high	94.3	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.1	-40.5	177.6	47.9	0	0	0	0	112.4	E587 V588 A594 F595 Y626	E587-S591 PolarHBondContact O-N 2.88Å; E587-S591 PolarHBondContact O-OG 2.92Å; E587-S591 PolarHBondContact OE1-OG 2.78Å; V588-S591 WeakPolarHBondContact CA-OG 3.33Å; V588-S591 PolarHBondContact O-OG 3.03Å; V588-S591 VanDerWaalsContact O-OG 3.11Å; S591-A594 PolarHBondContact O-N 3.39Å; S591-F595 VanDerWaalsContact O-CB 3.32Å; S591-F595 WeakPolarHBondContact O-CB 3.49Å; S591-F595 PolarHBondContact O-N 3.38Å; S591-Y626 VanDerWaalsContact CB-CE1 3.48Å
592	N	96.6	Very high	93.7	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.4	-43.6	176.4	-69.4	-6.3	0	0	0	112.8	I340 R341 L342 Y578 V588 A594 F595 I596	I340-N592 PolarHBondContact O-ND2 2.95Å; R341-N592 WeakPolarHBondContact CA-OD1 3.27Å; L342-N592 HydrophobicContact CD1-CB 3.95Å; L342-N592 HydrophobicContact CG-CB 4.14Å; L342-N592 PolarHBondContact N-OD1 2.72Å; Y578-N592 HydrophobicContact CD1-CB 3.93Å; Y578-N592 HydrophobicContact CD2-CB 3.99Å; Y578-N592 HydrophobicContact CE1-CB 3.92Å; Y578-N592 WeakPolarHBondContact CE1-ND2 3.43Å; Y578-N592 HydrophobicContact CE2-CB 3.97Å; Y578-N592 HydrophobicContact CG-CB 3.98Å; Y578-N592 PolarHBondContact OH-ND2 2.88Å; V588-N592 VanDerWaalsContact O-CB 3.28Å; V588-N592 WeakPolarHBondContact O-CB 3.39Å; V588-N592 PolarHBondContact O-N 2.85Å; V588-N592 PolarHBondContact O-ND2 3.45Å; V588-N592 PolarHBondContact O-OD1 2.92Å; N592-A594 VanDerWaalsContact C-N 3.33Å; N592-A594 PolarHBondContact O-N 3.17Å; N592-F595 PolarHBondContact O-N 3.01Å; N592-I596 WeakPolarHBondContact O-CG1 3Å; N592-I596 PolarHBondContact O-N 3.44Å; N592-I596 VanDerWaalsContact O-N 3.08Å
593	A	96.3	Very high	93.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-42.9	175.4	0	0	0	0	0	111.3	L579 A589 F595 L597	L579-A593 HydrophobicContact CD2-CB 3.99Å; L579-A593 HydrophobicContact CG-CB 4.36Å; A589-A593 VanDerWaalsContact O-CB 3.24Å; A589-A593 WeakPolarHBondContact O-CB 3.34Å; A589-A593 PolarHBondContact O-N 2.77Å; A593-F595 VanDerWaalsContact C-N 3.33Å; A593-F595 PolarHBondContact O-N 2.82Å; A593-L597 WeakPolarHBondContact O-CB 3.38Å; A593-L597 VanDerWaalsContact O-CG 3.23Å; A593-L597 WeakPolarHBondContact O-CG 3.46Å; A593-L597 PolarHBondContact O-N 3.49Å
594	A	96	Very high	92.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-42.6	176.8	0	0	0	0	0	111.7	Q590 S591 N592 L597 D598 H617 W618	Q590-A594 WeakPolarHBondContact O-CB 3.28Å; Q590-A594 PolarHBondContact O-N 3.43Å; S591-A594 PolarHBondContact O-N 3.39Å; N592-A594 VanDerWaalsContact C-N 3.33Å; N592-A594 PolarHBondContact O-N 3.17Å; A594-L597 PolarHBondContact O-N 3.1Å; A594-D598 VanDerWaalsContact O-CB 3.25Å; A594-D598 WeakPolarHBondContact O-CB 3.38Å; A594-D598 PolarHBondContact O-N 3.3Å; A594-H617 HydrophobicContact CB-CB 3.74Å; A594-W618 HydrophobicContact CB-CD2 3.44Å; A594-W618 VanDerWaalsContact CB-CD2 3.44Å; A594-W618 VanDerWaalsContact CB-CE2 3.43Å; A594-W618 HydrophobicContact CB-CE3 3.93Å; A594-W618 HydrophobicContact CB-CG 3.73Å; A594-W618 HydrophobicContact CB-CH2 4.36Å; A594-W618 HydrophobicContact CB-CZ2 3.92Å; A594-W618 HydrophobicContact CB-CZ3 4.37Å
595	F	95.3	Very high	91.8	Very high	18 Å²	18	26 Å²	26	8%	0.079	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-49.7	179.3	179.8	-104.8	0	0	0	113.2	L342 P343 V346 S591 N592 A593 L597 D598 Q599 W618	L342-F595 HydrophobicContact CB-CD1 3.72Å; L342-F595 HydrophobicContact CB-CE1 3.96Å; L342-F595 HydrophobicContact CD1-CD1 4.36Å; P343-F595 HydrophobicContact CB-CD2 4.11Å; P343-F595 HydrophobicContact CB-CE2 4.28Å; P343-F595 HydrophobicContact CG-CB 3.94Å; P343-F595 HydrophobicContact CG-CD2 3.7Å; P343-F595 HydrophobicContact CG-CE2 4.31Å; P343-F595 HydrophobicContact CG-CG 3.85Å; V346-F595 HydrophobicContact CB-CZ 4.27Å; V346-F595 HydrophobicContact CG2-CE1 4.24Å; V346-F595 HydrophobicContact CG2-CZ 3.88Å; S591-F595 VanDerWaalsContact O-CB 3.32Å; S591-F595 WeakPolarHBondContact O-CB 3.49Å; S591-F595 PolarHBondContact O-N 3.38Å; N592-F595 PolarHBondContact O-N 3.01Å; A593-F595 VanDerWaalsContact C-N 3.33Å; A593-F595 PolarHBondContact O-N 2.82Å; F595-L597 VanDerWaalsContact C-N 3.29Å; F595-L597 PolarHBondContact O-N 2.94Å; F595-D598 WeakPolarHBondContact O-CB 3.46Å; F595-D598 PolarHBondContact O-N 3.43Å; F595-Q599 VanDerWaalsContact CE1-CD 3.49Å; F595-Q599 VanDerWaalsContact CE1-OE1 3.23Å; F595-Q599 HydrophobicContact CE2-CG 4.41Å; F595-Q599 VanDerWaalsContact CZ-CD 3.43Å; F595-Q599 HydrophobicContact CZ-CG 4.34Å; F595-Q599 WeakPolarHBondContact O-CG 3.1Å; F595-Q599 PolarHBondContact O-N 2.92Å; F595-W618 HydrophobicContact CB-CH2 4.19Å; F595-W618 HydrophobicContact CB-CZ2 4.19Å
596	I	94.9	Very high	91.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.8	-36.6	-179.2	-56.9	163.4	0	0	0	110.8	L342 Y566 Y571 A574 V575 Y578 N592 R600 E601 A602	L342-I596 HydrophobicContact CD1-CD1 3.76Å; L342-I596 HydrophobicContact CD1-CG1 3.82Å; Y566-I596 HydrophobicContact CD2-CD1 3.84Å; Y566-I596 HydrophobicContact CD2-CG1 3.89Å; Y566-I596 HydrophobicContact CE2-CD1 4.35Å; Y566-I596 HydrophobicContact CE2-CG1 3.87Å; Y571-I596 HydrophobicContact CD1-CG2 4.48Å; A574-I596 HydrophobicContact CB-CD1 4.24Å; V575-I596 HydrophobicContact CG2-CB 3.51Å; V575-I596 HydrophobicContact CG2-CD1 3.78Å; V575-I596 HydrophobicContact CG2-CG1 4.26Å; V575-I596 HydrophobicContact CG2-CG2 3.25Å; Y578-I596 HydrophobicContact CD2-CD1 3.81Å; Y578-I596 HydrophobicContact CE2-CD1 4.01Å; N592-I596 WeakPolarHBondContact O-CG1 3Å; N592-I596 PolarHBondContact O-N 3.44Å; N592-I596 VanDerWaalsContact O-N 3.08Å; I596-R600 PolarHBondContact O-N 3.47Å; I596-E601 HydrophobicContact CG2-CB 4.34Å; I596-A602 HydrophobicContact CG2-CB 4.15Å
597	L	93.6	Very high	90.3	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-43	173.6	-68.6	173.2	0	0	0	111.4	V575 A593 A594 F595 Q599 R600 V605 T610 R613 A614	V575-L597 HydrophobicContact CG1-CD2 4.14Å; V575-L597 HydrophobicContact CG1-CG 4.38Å; A593-L597 WeakPolarHBondContact O-CB 3.38Å; A593-L597 VanDerWaalsContact O-CG 3.23Å; A593-L597 WeakPolarHBondContact O-CG 3.46Å; A593-L597 PolarHBondContact O-N 3.49Å; A594-L597 PolarHBondContact O-N 3.1Å; F595-L597 VanDerWaalsContact C-N 3.29Å; F595-L597 PolarHBondContact O-N 2.94Å; L597-Q599 VanDerWaalsContact C-N 3.31Å; L597-Q599 PolarHBondContact O-N 2.98Å; L597-R600 PolarHBondContact O-N 2.64Å; L597-V605 HydrophobicContact CD2-CG2 4.19Å; L597-T610 HydrophobicContact CB-CG2 4.03Å; L597-T610 HydrophobicContact CD2-CG2 4.27Å; L597-T610 WeakPolarHBondContact O-CG2 3.42Å; L597-R613 HydrophobicContact CD1-CB 4.29Å; L597-A614 HydrophobicContact CB-CB 3.93Å
598	D	92.1	Very high	89.8	Confident	31 Å²	31	41.8 Å²	41.8	17%	0.166	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-39.5	178.8	-168.1	35.5	0	0	0	112.2	A594 F595 R600 Y636	A594-D598 VanDerWaalsContact O-CB 3.25Å; A594-D598 WeakPolarHBondContact O-CB 3.38Å; A594-D598 PolarHBondContact O-N 3.3Å; F595-D598 WeakPolarHBondContact O-CB 3.46Å; F595-D598 PolarHBondContact O-N 3.43Å; D598-R600 PolarHBondContact O-N 3.08Å; D598-Y636 PolarHBondContact OD1-OH 3.48Å
599	Q	90.5	Very high	89.4	Confident	73 Å²	73	46 Å²	46	34%	0.341	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.2	176.8	-67.1	-175.2	-40	0	0	114	F595 L597 E601	F595-Q599 VanDerWaalsContact CE1-CD 3.49Å; F595-Q599 VanDerWaalsContact CE1-OE1 3.23Å; F595-Q599 HydrophobicContact CE2-CG 4.41Å; F595-Q599 VanDerWaalsContact CZ-CD 3.43Å; F595-Q599 HydrophobicContact CZ-CG 4.34Å; F595-Q599 WeakPolarHBondContact O-CG 3.1Å; F595-Q599 PolarHBondContact O-N 2.92Å; L597-Q599 VanDerWaalsContact C-N 3.31Å; L597-Q599 PolarHBondContact O-N 2.98Å; Q599-E601 HydrophobicContact CB-CG 3.83Å; Q599-E601 PolarHBondContact O-N 3.33Å; Q599-E601 VanDerWaalsContact OE1-CD 3.3Å; Q599-E601 PolarHBondContact OE1-OE1 3.34Å; Q599-E601 PolarHBondContact OE1-OE2 2.89Å
600	R	86.4	Confident	89.1	Confident	146 Å²	146	46.4 Å²	46.4	55%	0.551	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	27.7	-175.8	-48.2	-174.6	-171.2	-177.3	8.7	114.1	I596 L597 D598 Y611	I596-R600 PolarHBondContact O-N 3.47Å; L597-R600 PolarHBondContact O-N 2.64Å; D598-R600 PolarHBondContact O-N 3.08Å; R600-Y611 VanDerWaalsContact CZ-OH 3.32Å; R600-Y611 PolarHBondContact NE-OH 3.32Å; R600-Y611 PolarHBondContact NH2-OH 3.4Å
601	E	82.4	Confident	88.9	Confident	60 Å²	60	48.4 Å²	48.4	28%	0.28	25%	0.248	S	C	.	.			trans	-75.2	-28.3	177.5	-66.7	179.5	159.7	0	0	111.9	Y566 Y571 I596 Q599	Y566-E601 WeakPolarHBondContact CE2-OE2 3.07Å; Y571-E601 HydrophobicContact CD1-CB 4.01Å; Y571-E601 VanDerWaalsContact CD1-OE2 3.29Å; Y571-E601 WeakPolarHBondContact CD1-OE2 3.4Å; Y571-E601 HydrophobicContact CD2-CB 3.74Å; Y571-E601 HydrophobicContact CE1-CB 4.32Å; Y571-E601 WeakPolarHBondContact CE1-OE2 3.15Å; Y571-E601 HydrophobicContact CE2-CB 4.06Å; Y571-E601 HydrophobicContact CE2-CG 4.45Å; Y571-E601 HydrophobicContact CG-CB 3.7Å; I596-E601 HydrophobicContact CG2-CB 4.34Å; Q599-E601 HydrophobicContact CB-CG 3.83Å; Q599-E601 PolarHBondContact O-N 3.33Å; Q599-E601 VanDerWaalsContact OE1-CD 3.3Å; Q599-E601 PolarHBondContact OE1-OE1 3.34Å; Q599-E601 PolarHBondContact OE1-OE2 2.89Å
602	A	83.2	Confident	88.8	Confident	7 Å²	7	51 Å²	51	6%	0.058	27%	0.266	C	S	.	.			trans	-93.5	131	178	0	0	0	0	0	112.2	N572 V575 I596	N572-A602 WeakPolarHBondContact OD1-CA 3.5Å; V575-A602 HydrophobicContact CB-CB 4.39Å; V575-A602 HydrophobicContact CG2-CB 3.79Å; I596-A602 HydrophobicContact CG2-CB 4.15Å
603	T	84.1	Confident	88.5	Confident	115 Å²	115	53.1 Å²	53.1	71%	0.706	27%	0.273	S	S	*	.			trans	-100	5.5	-176.3	60.9	0	0	0	0	113.7	N572 V605	N572-T603 PolarHBondContact ND2-OG1 3.46Å; N572-T603 PolarHBondContact OD1-N 2.91Å; T603-V605 VanDerWaalsContact C-N 3.33Å; T603-V605 PolarHBondContact O-N 2.87Å
604	I	82.4	Confident	88.5	Confident	44 Å²	44	53.1 Å²	53.1	23%	0.226	27%	0.273	C	S	.	.	S	Bend	trans	-69.2	-31.5	-176.3	-68.1	156.6	0	0	0	112.6	I239 L269 N572 I576	I239-I604 HydrophobicContact CD1-CG2 3.77Å; L269-I604 HydrophobicContact CD2-CG2 3.42Å; L269-I604 VanDerWaalsContact CD2-CG2 3.42Å; N572-I604 HydrophobicContact CB-CD1 3.47Å; N572-I604 VanDerWaalsContact CB-CD1 3.47Å; N572-I604 HydrophobicContact CB-CG1 3.85Å; N572-I604 WeakPolarHBondContact O-CD1 3.37Å; N572-I604 WeakPolarHBondContact OD1-CG1 3.35Å; I576-I604 HydrophobicContact CD1-CD1 3.75Å; I576-I604 HydrophobicContact CG1-CD1 3.66Å
605	V	82.1	Confident	88.5	Confident	13 Å²	13	54.4 Å²	54.4	8%	0.079	28%	0.28	C	S	.	.	S	Bend	trans	-102.1	138.6	-177.5	-178.3	0	0	0	0	108.6	L597 T603 E609	L597-V605 HydrophobicContact CD2-CG2 4.19Å; T603-V605 VanDerWaalsContact C-N 3.33Å; T603-V605 PolarHBondContact O-N 2.87Å; V605-E609 HydrophobicContact CG1-CB 3.64Å
606	G	81.2	Confident	88.4	Confident	47 Å²	47	57.3 Å²	57.3	49%	0.485	30%	0.296	S	S	.	.			trans	-61.9	144.4	175.2	0	0	0	0	0	111.6	N608 E609 T610	G606-N608 PolarHBondContact O-N 3.25Å; G606-E609 PolarHBondContact O-N 2.98Å; G606-T610 PolarHBondContact O-N 3.49Å; G606-T610 PolarHBondContact O-OG1 3.46Å
607	E	78.4	Confident	88.5	Confident	160 Å²	160	57.9 Å²	57.9	75%	0.748	30%	0.298	S	S	*	.	H	α-helix	trans	-52.6	-34.8	-170.7	-63.2	-174.9	166.8	0	0	114.4	E609	E607-E609 VanDerWaalsContact C-N 3.33Å; E607-E609 PolarHBondContact O-N 3.03Å
608	N	84.6	Confident	88.6	Confident	153 Å²	153	57.7 Å²	57.7	82%	0.818	30%	0.298	S	S	*	.	H	α-helix	trans	-73	-24.7	180	-65.5	-18.4	0	0	0	113.3	G606 P612	G606-N608 PolarHBondContact O-N 3.25Å; N608-P612 WeakPolarHBondContact O-CD 3.4Å
609	E	86.8	Confident	88.8	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-95.5	-12.3	-177.3	-64.1	-171.9	-178.7	0	0	112.8	V605 G606 E607 P612 R613	V605-E609 HydrophobicContact CG1-CB 3.64Å; G606-E609 PolarHBondContact O-N 2.98Å; E607-E609 VanDerWaalsContact C-N 3.33Å; E607-E609 PolarHBondContact O-N 3.03Å; E609-P612 WeakPolarHBondContact O-CD 2.91Å; E609-R613 WeakPolarHBondContact O-CB 3.47Å; E609-R613 WeakPolarHBondContact O-CG 3.22Å; E609-R613 PolarHBondContact O-N 3.31Å; E609-R613 VanDerWaalsContact O-N 3.14Å; E609-R613 IonicContact OE2-CZ 2.71Å; E609-R613 VanDerWaalsContact OE2-CZ 3.31Å; E609-R613 IonicContact OE2-NE 3.31Å; E609-R613 PolarHBondContact OE2-NE 3.12Å; E609-R613 IonicContact OE2-NH2 3.89Å; E609-R613 PolarHBondContact OE2-NH2 2.86Å
610	T	91	Very high	89.1	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.043	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-52.7	-175.4	-52.8	0	0	0	0	112.3	L597 G606 R613 A614	L597-T610 HydrophobicContact CB-CG2 4.03Å; L597-T610 HydrophobicContact CD2-CG2 4.27Å; L597-T610 WeakPolarHBondContact O-CG2 3.42Å; G606-T610 PolarHBondContact O-N 3.49Å; G606-T610 PolarHBondContact O-OG1 3.46Å; T610-R613 PolarHBondContact O-N 2.81Å; T610-A614 WeakPolarHBondContact O-CB 3.33Å; T610-A614 PolarHBondContact O-N 3.01Å
611	Y	93.1	Very high	89.6	Confident	42 Å²	42	50.9 Å²	50.9	17%	0.165	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-46.8	-180	-71.3	-66.1	0	0	0	114.2	R600 R613 A614 L615 Y636 F641	R600-Y611 VanDerWaalsContact CZ-OH 3.32Å; R600-Y611 PolarHBondContact NE-OH 3.32Å; R600-Y611 PolarHBondContact NH2-OH 3.4Å; Y611-R613 PolarHBondContact O-N 3.37Å; Y611-A614 PolarHBondContact O-N 3.49Å; Y611-L615 VanDerWaalsContact O-CB 3.31Å; Y611-L615 WeakPolarHBondContact O-CB 3.36Å; Y611-L615 PolarHBondContact O-N 3.3Å; Y611-Y636 HydrophobicContact CD1-CE1 4.04Å; Y611-F641 HydrophobicContact CD1-CB 3.95Å; Y611-F641 HydrophobicContact CD1-CG 4.41Å; Y611-F641 HydrophobicContact CE1-CB 4.4Å; Y611-F641 HydrophobicContact CE1-CG 4.37Å; Y611-F641 HydrophobicContact CG-CB 4.21Å
612	P	93	Very high	90.2	Very high	56 Å²	56	48.1 Å²	48.1	36%	0.364	26%	0.261	S	S	.	.	H	α-helix	trans	-56.8	-36.7	175.5	-26.6	34.5	0	0	0	113.1	N608 E609 L616	N608-P612 WeakPolarHBondContact O-CD 3.4Å; E609-P612 WeakPolarHBondContact O-CD 2.91Å; P612-L616 PolarHBondContact O-N 3.47Å; P612-L616 VanDerWaalsContact O-N 3.11Å
613	R	92.3	Very high	90.7	Very high	44 Å²	44	51.7 Å²	51.7	17%	0.166	29%	0.285	C	S	.	.	H	α-helix	trans	-72.2	-42.3	175.8	-69.3	-178.2	-170	-151	-1.6	112	S267 G268 L597 E609 T610 Y611 L615 L616 H617	S267-R613 PolarHBondContact O-NH1 2.85Å; G268-R613 PolarHBondContact O-NH1 3.35Å; G268-R613 PolarHBondContact O-NH2 2.67Å; G268-R613 VanDerWaalsContact O-NH2 3.09Å; L597-R613 HydrophobicContact CD1-CB 4.29Å; E609-R613 WeakPolarHBondContact O-CB 3.47Å; E609-R613 WeakPolarHBondContact O-CG 3.22Å; E609-R613 PolarHBondContact O-N 3.31Å; E609-R613 VanDerWaalsContact O-N 3.14Å; E609-R613 IonicContact OE2-CZ 2.71Å; E609-R613 VanDerWaalsContact OE2-CZ 3.31Å; E609-R613 IonicContact OE2-NE 3.31Å; E609-R613 PolarHBondContact OE2-NE 3.12Å; E609-R613 IonicContact OE2-NH2 3.89Å; E609-R613 PolarHBondContact OE2-NH2 2.86Å; T610-R613 PolarHBondContact O-N 2.81Å; Y611-R613 PolarHBondContact O-N 3.37Å; R613-L615 VanDerWaalsContact C-N 3.34Å; R613-L615 PolarHBondContact O-N 3.09Å; R613-L616 WeakPolarHBondContact O-CB 3.43Å; R613-L616 PolarHBondContact O-N 3.46Å; R613-H617 PolarHBondContact O-CD2 2.96Å; R613-H617 PolarHBondContact O-N 3.31Å; R613-H617 VanDerWaalsContact O-N 3.15Å
614	A	94.9	Very high	91.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.5	-45.7	173.9	0	0	0	0	0	111.3	L597 T610 Y611 L616 H617 W618 Y636	L597-A614 HydrophobicContact CB-CB 3.93Å; T610-A614 WeakPolarHBondContact O-CB 3.33Å; T610-A614 PolarHBondContact O-N 3.01Å; Y611-A614 PolarHBondContact O-N 3.49Å; A614-L616 VanDerWaalsContact C-N 3.31Å; A614-L616 PolarHBondContact O-N 3.13Å; A614-H617 PolarHBondContact O-N 3.22Å; A614-H617 VanDerWaalsContact O-N 3.11Å; A614-W618 VanDerWaalsContact O-CD1 3.25Å; A614-W618 PolarHBondContact O-N 3.35Å; A614-Y636 HydrophobicContact CB-CE1 4.25Å; A614-Y636 WeakPolarHBondContact CB-OH 3.43Å
615	L	95.5	Very high	91.5	Very high	26 Å²	26	48.4 Å²	48.4	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-55.2	-45.3	175.3	179.7	58.6	0	0	0	111.8	Y611 R613 H617 W618 N619 L633 Y636 T643	Y611-L615 VanDerWaalsContact O-CB 3.31Å; Y611-L615 WeakPolarHBondContact O-CB 3.36Å; Y611-L615 PolarHBondContact O-N 3.3Å; R613-L615 VanDerWaalsContact C-N 3.34Å; R613-L615 PolarHBondContact O-N 3.09Å; L615-H617 VanDerWaalsContact C-N 3.34Å; L615-H617 PolarHBondContact O-N 3.36Å; L615-W618 PolarHBondContact O-N 3.33Å; L615-N619 WeakPolarHBondContact O-CB 3.41Å; L615-N619 PolarHBondContact O-N 2.9Å; L615-L633 HydrophobicContact CD1-CD2 3.52Å; L615-Y636 HydrophobicContact CB-CD1 3.65Å; L615-Y636 HydrophobicContact CB-CE1 3.87Å; L615-Y636 HydrophobicContact CD1-CD1 3.68Å; L615-Y636 HydrophobicContact CD1-CG 4.01Å; L615-Y636 HydrophobicContact CG-CD1 4.13Å; L615-T643 HydrophobicContact CD2-CG2 4.07Å
616	L	94.6	Very high	92	Very high	79 Å²	79	48.5 Å²	48.5	41%	0.414	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-43.3	177	174.8	128.6	0	0	0	111.9	P612 R613 A614 N619 R620	P612-L616 PolarHBondContact O-N 3.47Å; P612-L616 VanDerWaalsContact O-N 3.11Å; R613-L616 WeakPolarHBondContact O-CB 3.43Å; R613-L616 PolarHBondContact O-N 3.46Å; A614-L616 VanDerWaalsContact C-N 3.31Å; A614-L616 PolarHBondContact O-N 3.13Å; L616-N619 PolarHBondContact O-N 2.9Å; L616-R620 WeakPolarHBondContact O-CG 3.23Å; L616-R620 PolarHBondContact O-N 3.47Å; L616-R620 VanDerWaalsContact O-N 3.11Å
617	H	96.1	Very high	92.5	Very high	12 Å²	12	48.7 Å²	48.7	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-73.8	-36.9	178.8	-72.8	-67.7	0	0	0	112.8	L579 A594 R613 A614 L615 N619 R620 A621	L579-H617 WeakPolarHBondContact CD2-NE2 3.19Å; A594-H617 HydrophobicContact CB-CB 3.74Å; R613-H617 PolarHBondContact O-CD2 2.96Å; R613-H617 PolarHBondContact O-N 3.31Å; R613-H617 VanDerWaalsContact O-N 3.15Å; A614-H617 PolarHBondContact O-N 3.22Å; A614-H617 VanDerWaalsContact O-N 3.11Å; L615-H617 VanDerWaalsContact C-N 3.34Å; L615-H617 PolarHBondContact O-N 3.36Å; H617-N619 VanDerWaalsContact C-N 3.26Å; H617-N619 PolarHBondContact O-N 2.64Å; H617-R620 PolarHBondContact O-N 2.87Å; H617-A621 PolarHBondContact O-N 2.93Å
618	W	97.1	Very high	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-41.3	169.4	-74.4	130.5	0	0	0	111.5	P343 A594 F595 A614 L615 A621 A622 Y626 A629 K632 L633 Y636	P343-W618 HydrophobicContact CG-CH2 4.05Å; A594-W618 HydrophobicContact CB-CD2 3.44Å; A594-W618 VanDerWaalsContact CB-CD2 3.44Å; A594-W618 VanDerWaalsContact CB-CE2 3.43Å; A594-W618 HydrophobicContact CB-CE3 3.93Å; A594-W618 HydrophobicContact CB-CG 3.73Å; A594-W618 HydrophobicContact CB-CH2 4.36Å; A594-W618 HydrophobicContact CB-CZ2 3.92Å; A594-W618 HydrophobicContact CB-CZ3 4.37Å; F595-W618 HydrophobicContact CB-CH2 4.19Å; F595-W618 HydrophobicContact CB-CZ2 4.19Å; A614-W618 VanDerWaalsContact O-CD1 3.25Å; A614-W618 PolarHBondContact O-N 3.35Å; L615-W618 PolarHBondContact O-N 3.33Å; W618-A621 PolarHBondContact O-N 2.95Å; W618-A622 VanDerWaalsContact O-CB 3.29Å; W618-A622 WeakPolarHBondContact O-CB 2.91Å; W618-A622 PolarHBondContact O-N 2.92Å; W618-Y626 HydrophobicContact CZ3-CE1 4.07Å; W618-A629 HydrophobicContact CE3-CB 3.49Å; W618-A629 VanDerWaalsContact CE3-CB 3.49Å; W618-A629 HydrophobicContact CZ3-CB 3.96Å; W618-K632 HydrophobicContact CD2-CB 3.97Å; W618-K632 HydrophobicContact CD2-CG 4.38Å; W618-K632 HydrophobicContact CE3-CB 4.36Å; W618-K632 HydrophobicContact CG-CB 4.2Å; W618-K632 HydrophobicContact CH2-CG 4.29Å; W618-K632 HydrophobicContact CZ2-CG 4.08Å; W618-L633 HydrophobicContact CB-CD2 3.76Å; W618-L633 HydrophobicContact CB-CG 4.23Å; W618-Y636 AromaticContact CD1-CE2 3.91Å; W618-Y636 AromaticContact CD1-CZ 3.78Å; W618-Y636 AromaticContact NE1-CE2 3.92Å; W618-Y636 AromaticContact NE1-CZ 3.89Å
619	N	96	Very high	93.6	Very high	88 Å²	88	34.6 Å²	34.6	47%	0.471	19%	0.192	S	C	.	.	H	α-helix	trans	-63.4	-44.5	177.8	-171.1	27.8	0	0	0	112.1	L615 L616 H617 A621 A622 S623 L633	L615-N619 WeakPolarHBondContact O-CB 3.41Å; L615-N619 PolarHBondContact O-N 2.9Å; L616-N619 PolarHBondContact O-N 2.9Å; H617-N619 VanDerWaalsContact C-N 3.26Å; H617-N619 PolarHBondContact O-N 2.64Å; N619-A621 PolarHBondContact O-N 2.99Å; N619-A622 PolarHBondContact O-N 3.08Å; N619-S623 WeakPolarHBondContact O-CB 3.45Å; N619-S623 PolarHBondContact O-N 3.18Å; N619-S623 PolarHBondContact O-OG 3.49Å; N619-L633 HydrophobicContact CB-CD1 4.4Å; N619-L633 HydrophobicContact CB-CD2 4.01Å
620	R	96	Very high	94.1	Very high	19 Å²	19	31.6 Å²	31.6	7%	0.072	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-40.3	176.1	-69	175.8	178.6	-173.8	2	112.4	E583 Q590 L616 H617 S623 Q624	E583-R620 IonicContact OE1-CZ 3.98Å; E583-R620 IonicContact OE1-NH1 3.69Å; E583-R620 PolarHBondContact OE1-NH1 3.47Å; E583-R620 IonicContact OE1-NH2 2.92Å; Q590-R620 HydrophobicContact CG-CB 4.26Å; Q590-R620 VanDerWaalsContact OE1-CB 3.29Å; Q590-R620 PolarHBondContact OE1-O 3.39Å; L616-R620 WeakPolarHBondContact O-CG 3.23Å; L616-R620 PolarHBondContact O-N 3.47Å; L616-R620 VanDerWaalsContact O-N 3.11Å; H617-R620 PolarHBondContact O-N 2.87Å; R620-S623 PolarHBondContact O-OG 3.37Å; R620-Q624 WeakPolarHBondContact O-CG 3.21Å; R620-Q624 PolarHBondContact O-N 3.09Å
621	A	96.4	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.9	-41.4	177.2	0	0	0	0	0	111.6	E587 Q590 H617 W618 N619 S623 Q624 G625 Y626 A629	E587-A621 HydrophobicContact CG-CB 4.44Å; Q590-A621 HydrophobicContact CB-CB 4.04Å; H617-A621 PolarHBondContact O-N 2.93Å; W618-A621 PolarHBondContact O-N 2.95Å; N619-A621 PolarHBondContact O-N 2.99Å; A621-S623 PolarHBondContact O-N 3.22Å; A621-Q624 PolarHBondContact O-N 3.11Å; A621-G625 PolarHBondContact O-N 3.03Å; A621-Y626 HydrophobicContact CB-CD1 4.26Å; A621-Y626 WeakPolarHBondContact O-CB 3.04Å; A621-Y626 PolarHBondContact O-N 3.04Å; A621-Y626 VanDerWaalsContact O-N 3.12Å; A621-A629 HydrophobicContact CB-CB 3.8Å
622	A	95.2	Very high	94.4	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-35.6	178.4	0	0	0	0	0	112.8	W618 N619 Q624 G625 A629 R630 L633	W618-A622 VanDerWaalsContact O-CB 3.29Å; W618-A622 WeakPolarHBondContact O-CB 2.91Å; W618-A622 PolarHBondContact O-N 2.92Å; N619-A622 PolarHBondContact O-N 3.08Å; A622-Q624 PolarHBondContact O-N 2.99Å; A622-G625 PolarHBondContact O-N 3.3Å; A622-A629 HydrophobicContact CB-CB 4.06Å; A622-R630 HydrophobicContact CB-CB 4.02Å; A622-R630 PolarHBondContact O-NH2 3.38Å; A622-L633 HydrophobicContact CB-CD1 3.5Å; A622-L633 VanDerWaalsContact CB-CD1 3.5Å; A622-L633 HydrophobicContact CB-CG 4.4Å
623	S	93.3	Very high	94.5	Very high	81 Å²	81	29.4 Å²	29.4	57%	0.566	16%	0.161	S	C	*	.	H	α-helix	trans	-68.4	-25.4	176.3	72.2	0	0	0	0	112.6	N619 R620 A621 G625	N619-S623 WeakPolarHBondContact O-CB 3.45Å; N619-S623 PolarHBondContact O-N 3.18Å; N619-S623 PolarHBondContact O-OG 3.49Å; R620-S623 PolarHBondContact O-OG 3.37Å; A621-S623 PolarHBondContact O-N 3.22Å; S623-G625 VanDerWaalsContact C-N 3.26Å
624	Q	92.8	Very high	94.6	Very high	54 Å²	54	27.3 Å²	27.3	25%	0.252	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4.3	170.8	-63.9	-166.8	78.3	0	0	113.7	Y299 G585 E587 Q590 R620 A621 A622	Y299-Q624 PolarHBondContact OH-NE2 3.02Å; G585-Q624 PolarHBondContact O-NE2 3.36Å; G585-Q624 VanDerWaalsContact O-NE2 3.14Å; G585-Q624 PolarHBondContact O-OE1 3.45Å; G585-Q624 VanDerWaalsContact O-OE1 3.13Å; E587-Q624 HydrophobicContact CB-CB 4.11Å; E587-Q624 HydrophobicContact CG-CB 4.12Å; Q590-Q624 VanDerWaalsContact CD-NE2 3.27Å; R620-Q624 WeakPolarHBondContact O-CG 3.21Å; R620-Q624 PolarHBondContact O-N 3.09Å; A621-Q624 PolarHBondContact O-N 3.11Å; A622-Q624 PolarHBondContact O-N 2.99Å
625	G	91.1	Very high	94.7	Very high	37 Å²	37	28.3 Å²	28.3	38%	0.381	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	7.6	172.4	0	0	0	0	0	115.4	A621 A622 S623 T627 Q661	A621-G625 PolarHBondContact O-N 3.03Å; A622-G625 PolarHBondContact O-N 3.3Å; S623-G625 VanDerWaalsContact C-N 3.26Å; G625-T627 PolarHBondContact O-N 3.34Å; G625-Q661 PolarHBondContact O-NE2 3.23Å; G625-Q661 VanDerWaalsContact O-NE2 3.09Å
626	Y	93.3	Very high	94.7	Very high	15 Å²	15	27.2 Å²	27.2	6%	0.059	15%	0.153	C	C	.	.			trans	-72.2	124.9	175.8	-176.2	-140.1	0	0	0	111.7	R341 D344 E587 S591 W618 A621 V628 A629 R630	R341-Y626 VanDerWaalsContact CD-CE2 3.48Å; D344-Y626 PolarHBondContact OD1-OH 2.95Å; E587-Y626 WeakPolarHBondContact OE1-CB 2.85Å; E587-Y626 WeakPolarHBondContact OE1-CD1 3.41Å; E587-Y626 VanDerWaalsContact OE1-CG 3.3Å; S591-Y626 VanDerWaalsContact CB-CE1 3.48Å; W618-Y626 HydrophobicContact CZ3-CE1 4.07Å; A621-Y626 HydrophobicContact CB-CD1 4.26Å; A621-Y626 WeakPolarHBondContact O-CB 3.04Å; A621-Y626 PolarHBondContact O-N 3.04Å; A621-Y626 VanDerWaalsContact O-N 3.12Å; Y626-V628 HydrophobicContact CE1-CB 3.96Å; Y626-V628 HydrophobicContact CE2-CB 3.99Å; Y626-V628 HydrophobicContact CE2-CG2 4.01Å; Y626-V628 WeakPolarHBondContact OH-CB 3.49Å; Y626-A629 HydrophobicContact CD1-CB 3.38Å; Y626-A629 HydrophobicContact CE1-CB 4.1Å; Y626-A629 HydrophobicContact CG-CB 4.06Å; Y626-R630 PolarHBondContact O-N 2.95Å
627	T	90.7	Very high	94.9	Very high	50 Å²	50	25 Å²	25	31%	0.307	14%	0.14	S	C	.	.	H	α-helix	trans	-75.6	-48.7	-166.3	71.6	0	0	0	0	112.2	G625 A629 R630 I631 Q661	G625-T627 PolarHBondContact O-N 3.34Å; T627-A629 VanDerWaalsContact C-N 3.3Å; T627-A629 PolarHBondContact O-N 3.46Å; T627-R630 WeakPolarHBondContact O-CA 3.47Å; T627-R630 WeakPolarHBondContact O-CB 3.28Å; T627-R630 PolarHBondContact O-N 3.16Å; T627-I631 PolarHBondContact O-N 2.98Å; T627-I631 VanDerWaalsContact O-N 3.12Å; T627-Q661 HydrophobicContact CG2-CB 3.81Å; T627-Q661 HydrophobicContact CG2-CG 3.59Å
628	V	92	Very high	94.9	Very high	18 Å²	18	25.6 Å²	25.6	11%	0.109	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-39.9	178.8	-178.7	0	0	0	0	110.2	Y626 R630 I631 K632	Y626-V628 HydrophobicContact CE1-CB 3.96Å; Y626-V628 HydrophobicContact CE2-CB 3.99Å; Y626-V628 HydrophobicContact CE2-CG2 4.01Å; Y626-V628 WeakPolarHBondContact OH-CB 3.49Å; V628-R630 VanDerWaalsContact C-N 3.27Å; V628-R630 PolarHBondContact O-N 3.35Å; V628-I631 PolarHBondContact O-N 3.35Å; V628-I631 VanDerWaalsContact O-N 3.15Å; V628-K632 HydrophobicContact CG1-CG 4.47Å; V628-K632 WeakPolarHBondContact O-CG 3.33Å; V628-K632 PolarHBondContact O-N 2.97Å
629	A	95.2	Very high	94.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.3	-40.7	172.7	0	0	0	0	0	112.7	W618 A621 A622 Y626 T627 I631 K632 L633	W618-A629 HydrophobicContact CE3-CB 3.49Å; W618-A629 VanDerWaalsContact CE3-CB 3.49Å; W618-A629 HydrophobicContact CZ3-CB 3.96Å; A621-A629 HydrophobicContact CB-CB 3.8Å; A622-A629 HydrophobicContact CB-CB 4.06Å; Y626-A629 HydrophobicContact CD1-CB 3.38Å; Y626-A629 HydrophobicContact CE1-CB 4.1Å; Y626-A629 HydrophobicContact CG-CB 4.06Å; T627-A629 VanDerWaalsContact C-N 3.3Å; T627-A629 PolarHBondContact O-N 3.46Å; A629-I631 VanDerWaalsContact C-N 3.33Å; A629-I631 PolarHBondContact O-N 3.13Å; A629-K632 PolarHBondContact O-N 3.06Å; A629-L633 WeakPolarHBondContact O-CG 3.26Å; A629-L633 PolarHBondContact O-N 3.39Å
630	R	95.6	Very high	94.7	Very high	34 Å²	34	29.2 Å²	29.2	13%	0.128	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-35.1	178.5	-168.1	169.5	-67.3	-137.4	-0.4	112.3	A622 Y626 T627 V628 G634 A657	A622-R630 HydrophobicContact CB-CB 4.02Å; A622-R630 PolarHBondContact O-NH2 3.38Å; Y626-R630 PolarHBondContact O-N 2.95Å; T627-R630 WeakPolarHBondContact O-CA 3.47Å; T627-R630 WeakPolarHBondContact O-CB 3.28Å; T627-R630 PolarHBondContact O-N 3.16Å; V628-R630 VanDerWaalsContact C-N 3.27Å; V628-R630 PolarHBondContact O-N 3.35Å; R630-G634 PolarHBondContact O-N 3.45Å; R630-A657 HydrophobicContact CB-CB 4.44Å; R630-A657 HydrophobicContact CG-CB 4.24Å
631	I	95.1	Very high	94.6	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-44.7	172.9	-61.1	170.6	0	0	0	110	T627 V628 A629 L633 G634 D635 Y654 A657 S663 Q665 A666	T627-I631 PolarHBondContact O-N 2.98Å; T627-I631 VanDerWaalsContact O-N 3.12Å; V628-I631 PolarHBondContact O-N 3.35Å; V628-I631 VanDerWaalsContact O-N 3.15Å; A629-I631 VanDerWaalsContact C-N 3.33Å; A629-I631 PolarHBondContact O-N 3.13Å; I631-L633 VanDerWaalsContact C-N 3.3Å; I631-L633 PolarHBondContact O-N 3.03Å; I631-G634 CarbonylContact O-C 3.53Å; I631-G634 WeakPolarHBondContact O-CA 3.38Å; I631-G634 PolarHBondContact O-N 2.97Å; I631-D635 PolarHBondContact O-N 3.43Å; I631-Y654 HydrophobicContact CG2-CD1 4.34Å; I631-Y654 HydrophobicContact CG2-CE1 3.98Å; I631-Y654 WeakPolarHBondContact O-CE1 3.39Å; I631-A657 HydrophobicContact CG1-CB 3.94Å; I631-S663 WeakPolarHBondContact CD1-OG 3.4Å; I631-Q665 HydrophobicContact CD1-CB 4.33Å; I631-Q665 HydrophobicContact CG2-CG 4.28Å; I631-A666 HydrophobicContact CD1-CB 4.27Å; I631-A666 HydrophobicContact CG1-CB 4.19Å
632	K	95.6	Very high	94.2	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.226	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-37.8	175.7	-69.9	-67.6	-177.5	178.7	0	112.7	W618 V628 A629 G634 D635 Y636	W618-K632 HydrophobicContact CD2-CB 3.97Å; W618-K632 HydrophobicContact CD2-CG 4.38Å; W618-K632 HydrophobicContact CE3-CB 4.36Å; W618-K632 HydrophobicContact CG-CB 4.2Å; W618-K632 HydrophobicContact CH2-CG 4.29Å; W618-K632 HydrophobicContact CZ2-CG 4.08Å; V628-K632 HydrophobicContact CG1-CG 4.47Å; V628-K632 WeakPolarHBondContact O-CG 3.33Å; V628-K632 PolarHBondContact O-N 2.97Å; A629-K632 PolarHBondContact O-N 3.06Å; K632-G634 VanDerWaalsContact C-N 3.32Å; K632-G634 PolarHBondContact O-N 3.28Å; K632-D635 WeakPolarHBondContact O-CB 3.34Å; K632-D635 PolarHBondContact O-N 3.26Å; K632-Y636 WeakPolarHBondContact O-CD2 3.49Å; K632-Y636 PolarHBondContact O-N 3Å
633	L	95.4	Very high	94.1	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-44.5	170.5	-70.7	177.8	0	0	0	112.2	L615 W618 N619 A622 A629 I631 D635 Y636 H637	L615-L633 HydrophobicContact CD1-CD2 3.52Å; W618-L633 HydrophobicContact CB-CD2 3.76Å; W618-L633 HydrophobicContact CB-CG 4.23Å; N619-L633 HydrophobicContact CB-CD1 4.4Å; N619-L633 HydrophobicContact CB-CD2 4.01Å; A622-L633 HydrophobicContact CB-CD1 3.5Å; A622-L633 VanDerWaalsContact CB-CD1 3.5Å; A622-L633 HydrophobicContact CB-CG 4.4Å; A629-L633 WeakPolarHBondContact O-CG 3.26Å; A629-L633 PolarHBondContact O-N 3.39Å; I631-L633 VanDerWaalsContact C-N 3.3Å; I631-L633 PolarHBondContact O-N 3.03Å; L633-D635 VanDerWaalsContact C-N 3.31Å; L633-D635 PolarHBondContact O-N 2.67Å; L633-Y636 PolarHBondContact O-N 3.34Å; L633-H637 PolarHBondContact O-CD2 2.87Å; L633-H637 VanDerWaalsContact O-CD2 3.25Å; L633-H637 PolarHBondContact O-N 2.97Å; L633-H637 VanDerWaalsContact O-N 3.09Å
634	G	95.7	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.9	-46.9	173.4	0	0	0	0	0	111.5	R630 I631 K632 Y636 H637 F638 A650 Y654	R630-G634 PolarHBondContact O-N 3.45Å; I631-G634 CarbonylContact O-C 3.53Å; I631-G634 WeakPolarHBondContact O-CA 3.38Å; I631-G634 PolarHBondContact O-N 2.97Å; K632-G634 VanDerWaalsContact C-N 3.32Å; K632-G634 PolarHBondContact O-N 3.28Å; G634-Y636 VanDerWaalsContact C-N 3.33Å; G634-Y636 PolarHBondContact O-N 2.56Å; G634-H637 PolarHBondContact O-N 3.39Å; G634-F638 WeakPolarHBondContact O-CB 3.5Å; G634-F638 PolarHBondContact O-N 3.29Å; G634-A650 WeakPolarHBondContact O-CB 3.41Å; G634-Y654 VanDerWaalsContact C-OH 3.32Å
635	D	96.1	Very high	94.3	Very high	21 Å²	21	39.7 Å²	39.7	11%	0.112	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-40.9	178.1	-61	-18	0	0	0	111.8	I631 K632 L633 F638 Y639 Y654	I631-D635 PolarHBondContact O-N 3.43Å; K632-D635 WeakPolarHBondContact O-CB 3.34Å; K632-D635 PolarHBondContact O-N 3.26Å; L633-D635 VanDerWaalsContact C-N 3.31Å; L633-D635 PolarHBondContact O-N 2.67Å; D635-F638 PolarHBondContact O-N 3.04Å; D635-Y639 HydrophobicContact CB-CD2 4.24Å; D635-Y639 HydrophobicContact CB-CE2 4.35Å; D635-Y639 WeakPolarHBondContact O-CB 3.36Å; D635-Y639 WeakPolarHBondContact O-CD2 3.36Å; D635-Y639 PolarHBondContact O-N 3.4Å; D635-Y654 WeakPolarHBondContact CA-OH 3.45Å; D635-Y654 PolarHBondContact N-OH 2.97Å; D635-Y654 WeakPolarHBondContact OD1-CE1 3.26Å; D635-Y654 PolarHBondContact OD1-OH 2.78Å
636	Y	96.5	Very high	94.6	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-44.2	179.3	-88.9	-126	0	0	0	112.1	D598 Y611 A614 L615 W618 K632 L633 G634 G640 F641	D598-Y636 PolarHBondContact OD1-OH 3.48Å; Y611-Y636 HydrophobicContact CD1-CE1 4.04Å; A614-Y636 HydrophobicContact CB-CE1 4.25Å; A614-Y636 WeakPolarHBondContact CB-OH 3.43Å; L615-Y636 HydrophobicContact CB-CD1 3.65Å; L615-Y636 HydrophobicContact CB-CE1 3.87Å; L615-Y636 HydrophobicContact CD1-CD1 3.68Å; L615-Y636 HydrophobicContact CD1-CG 4.01Å; L615-Y636 HydrophobicContact CG-CD1 4.13Å; W618-Y636 AromaticContact CD1-CE2 3.91Å; W618-Y636 AromaticContact CD1-CZ 3.78Å; W618-Y636 AromaticContact NE1-CE2 3.92Å; W618-Y636 AromaticContact NE1-CZ 3.89Å; K632-Y636 WeakPolarHBondContact O-CD2 3.49Å; K632-Y636 PolarHBondContact O-N 3Å; L633-Y636 PolarHBondContact O-N 3.34Å; G634-Y636 VanDerWaalsContact C-N 3.33Å; G634-Y636 PolarHBondContact O-N 2.56Å; Y636-G640 CarbonylContact O-C 3.56Å; Y636-G640 VanDerWaalsContact O-CA 3.28Å; Y636-G640 WeakPolarHBondContact O-CA 3.41Å; Y636-G640 PolarHBondContact O-N 3.2Å; Y636-F641 HydrophobicContact CD1-CB 3.7Å; Y636-F641 WeakPolarHBondContact CD1-O 3.4Å; Y636-F641 HydrophobicContact CD2-CB 4.33Å; Y636-F641 HydrophobicContact CD2-CD2 4.08Å; Y636-F641 HydrophobicContact CE1-CB 4.03Å; Y636-F641 HydrophobicContact CE2-CD2 4.3Å; Y636-F641 HydrophobicContact CG-CB 3.89Å; Y636-F641 HydrophobicContact CG-CD2 4.39Å; Y636-F641 PolarHBondContact O-N 2.92Å
637	H	96.9	Very high	94.8	Very high	32 Å²	32	43.9 Å²	43.9	15%	0.148	23%	0.231	C	C	.	.	H	α-helix	trans	-70.3	-33.8	174.8	-74.9	-67.7	0	0	0	112.3	L633 G634 V645 D646 A650 H653	L633-H637 PolarHBondContact O-CD2 2.87Å; L633-H637 VanDerWaalsContact O-CD2 3.25Å; L633-H637 PolarHBondContact O-N 2.97Å; L633-H637 VanDerWaalsContact O-N 3.09Å; G634-H637 PolarHBondContact O-N 3.39Å; H637-V645 WeakPolarHBondContact O-CA 3.32Å; H637-D646 PolarHBondContact O-N 3.35Å; H637-A650 HydrophobicContact CB-CB 4Å; H637-H653 AromaticContact CD2-CD2 3.96Å
638	F	96.6	Very high	95	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-44.1	177.9	-175.7	-86.6	0	0	0	112.4	G634 D635 Y647 A650 Y672 M673 L678	G634-F638 WeakPolarHBondContact O-CB 3.5Å; G634-F638 PolarHBondContact O-N 3.29Å; D635-F638 PolarHBondContact O-N 3.04Å; F638-Y647 AromaticContact CD2-CD1 3.61Å; F638-Y647 HydrophobicContact CD2-CD1 3.61Å; F638-Y647 AromaticContact CD2-CE1 3.74Å; F638-Y647 HydrophobicContact CD2-CE1 3.74Å; F638-Y647 AromaticContact CE2-CD1 3.77Å; F638-Y647 HydrophobicContact CE2-CD1 3.77Å; F638-Y647 AromaticContact CE2-CE1 3.67Å; F638-Y647 HydrophobicContact CE2-CE1 3.67Å; F638-Y647 HydrophobicContact CG-CD1 4.34Å; F638-Y647 HydrophobicContact CG-CE1 4.21Å; F638-Y647 HydrophobicContact CZ-CE1 4.08Å; F638-A650 HydrophobicContact CB-CB 4.04Å; F638-Y672 HydrophobicContact CZ-CE1 4.15Å; F638-M673 HydrophobicContact CE2-CG 4.46Å; F638-L678 HydrophobicContact CE2-CD1 3.7Å; F638-L678 HydrophobicContact CZ-CD1 3.84Å
639	Y	95.6	Very high	95.1	Very high	139 Å²	139	48.9 Å²	48.9	55%	0.545	25%	0.252	S	S	.	.	H	α-helix	trans	-92.7	-13.9	-178.8	-66.5	-64.7	0	0	0	113.9	D635 F641	D635-Y639 HydrophobicContact CB-CD2 4.24Å; D635-Y639 HydrophobicContact CB-CE2 4.35Å; D635-Y639 WeakPolarHBondContact O-CB 3.36Å; D635-Y639 WeakPolarHBondContact O-CD2 3.36Å; D635-Y639 PolarHBondContact O-N 3.4Å; Y639-F641 HydrophobicContact CD2-CD2 4.47Å; Y639-F641 AromaticContact CD2-CE2 3.7Å; Y639-F641 HydrophobicContact CD2-CE2 3.7Å; Y639-F641 HydrophobicContact CD2-CZ 4.11Å; Y639-F641 AromaticContact CG-CE2 3.89Å; Y639-F641 HydrophobicContact CG-CE2 3.89Å; Y639-F641 AromaticContact CG-CZ 3.89Å; Y639-F641 HydrophobicContact CG-CZ 3.89Å
640	G	94.2	Very high	95.2	Very high	24 Å²	24	48.9 Å²	48.9	25%	0.247	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	40.4	-175.7	0	0	0	0	0	113.2	Y636 G642 T643	Y636-G640 CarbonylContact O-C 3.56Å; Y636-G640 VanDerWaalsContact O-CA 3.28Å; Y636-G640 WeakPolarHBondContact O-CA 3.41Å; Y636-G640 PolarHBondContact O-N 3.2Å; G640-G642 PolarHBondContact O-N 3.48Å; G640-T643 CarbonylContact C-O 3.6Å; G640-T643 WeakPolarHBondContact CA-O 3.31Å
641	F	92.5	Very high	95.2	Very high	71 Å²	71	48.9 Å²	48.9	31%	0.311	25%	0.253	S	S	.	.	S	Bend	trans	-81.9	109.6	176.6	-62.6	-37.4	0	0	0	110.8	Y611 Y636 Y639 T643	Y611-F641 HydrophobicContact CD1-CB 3.95Å; Y611-F641 HydrophobicContact CD1-CG 4.41Å; Y611-F641 HydrophobicContact CE1-CB 4.4Å; Y611-F641 HydrophobicContact CE1-CG 4.37Å; Y611-F641 HydrophobicContact CG-CB 4.21Å; Y636-F641 HydrophobicContact CD1-CB 3.7Å; Y636-F641 WeakPolarHBondContact CD1-O 3.4Å; Y636-F641 HydrophobicContact CD2-CB 4.33Å; Y636-F641 HydrophobicContact CD2-CD2 4.08Å; Y636-F641 HydrophobicContact CE1-CB 4.03Å; Y636-F641 HydrophobicContact CE2-CD2 4.3Å; Y636-F641 HydrophobicContact CG-CB 3.89Å; Y636-F641 HydrophobicContact CG-CD2 4.39Å; Y636-F641 PolarHBondContact O-N 2.92Å; Y639-F641 HydrophobicContact CD2-CD2 4.47Å; Y639-F641 AromaticContact CD2-CE2 3.7Å; Y639-F641 HydrophobicContact CD2-CE2 3.7Å; Y639-F641 HydrophobicContact CD2-CZ 4.11Å; Y639-F641 AromaticContact CG-CE2 3.89Å; Y639-F641 HydrophobicContact CG-CE2 3.89Å; Y639-F641 AromaticContact CG-CZ 3.89Å; Y639-F641 HydrophobicContact CG-CZ 3.89Å; F641-T643 PolarHBondContact O-N 2.95Å; F641-T643 VanDerWaalsContact O-N 3.1Å
642	G	88.1	Confident	95.2	Very high	38 Å²	38	53 Å²	53	39%	0.392	27%	0.274	S	S	.	.	S	Bend	trans	66.9	7.7	-179.6	0	0	0	0	0	114.6	G640	G640-G642 PolarHBondContact O-N 3.48Å
643	T	94.3	Very high	95.2	Very high	50 Å²	50	52.3 Å²	52.3	31%	0.307	27%	0.271	S	S	.	.	S	Bend	trans	-151.3	166.1	178	-170	0	0	0	0	108.9	L615 G640 F641	L615-T643 HydrophobicContact CD2-CG2 4.07Å; G640-T643 CarbonylContact C-O 3.6Å; G640-T643 WeakPolarHBondContact CA-O 3.31Å; F641-T643 PolarHBondContact O-N 2.95Å; F641-T643 VanDerWaalsContact O-N 3.1Å
644	D	94.4	Very high	95.2	Very high	141 Å²	141	52.4 Å²	52.4	75%	0.754	27%	0.271	S	S	*	.			trans	-72.4	152.6	175.2	-63.3	-47.7	0	0	0	110.8	D646	D644-D646 PolarHBondContact O-N 3.18Å
645	V	96.4	Very high	95.2	Very high	77 Å²	77	58.1 Å²	58.1	47%	0.467	29%	0.293	S	S	.	.			trans	-65.5	117	178.1	177.8	0	0	0	0	109.6	H637 Y647	H637-V645 WeakPolarHBondContact O-CA 3.32Å; V645-Y647 HydrophobicContact CG1-CD1 4.48Å; V645-Y647 HydrophobicContact CG1-CD2 4.26Å; V645-Y647 HydrophobicContact CG1-CE1 3.94Å; V645-Y647 HydrophobicContact CG1-CE2 3.69Å
646	D	96.4	Very high	95.1	Very high	57 Å²	57	59.5 Å²	59.5	31%	0.305	30%	0.3	S	S	.	.			trans	-137.4	100	179.7	-179	1.7	0	0	0	110.5	H637 D644 E648 T649 A650	H637-D646 PolarHBondContact O-N 3.35Å; D644-D646 PolarHBondContact O-N 3.18Å; D646-E648 VanDerWaalsContact C-N 3.31Å; D646-E648 PolarHBondContact O-N 3.46Å; D646-E648 PolarHBondContact OD1-N 2.98Å; D646-T649 VanDerWaalsContact CB-OG1 3.31Å; D646-T649 WeakPolarHBondContact CB-OG1 3.38Å; D646-T649 PolarHBondContact O-OG1 2.88Å; D646-T649 PolarHBondContact OD1-N 3.24Å; D646-T649 WeakPolarHBondContact OD2-CB 3.48Å; D646-T649 WeakPolarHBondContact OD2-CG2 3.16Å; D646-T649 PolarHBondContact OD2-OG1 3.42Å; D646-A650 WeakPolarHBondContact O-CB 3.15Å; D646-A650 PolarHBondContact O-N 3.45Å
647	Y	96.6	Very high	95	Very high	83 Å²	83	59.3 Å²	59.3	33%	0.325	30%	0.3	S	S	.	.	H	α-helix	trans	-72.3	-24	-180	-60.2	-64.8	0	0	0	112.8	F638 V645 F651 M673 L678	F638-Y647 AromaticContact CD2-CD1 3.61Å; F638-Y647 HydrophobicContact CD2-CD1 3.61Å; F638-Y647 AromaticContact CD2-CE1 3.74Å; F638-Y647 HydrophobicContact CD2-CE1 3.74Å; F638-Y647 AromaticContact CE2-CD1 3.77Å; F638-Y647 HydrophobicContact CE2-CD1 3.77Å; F638-Y647 AromaticContact CE2-CE1 3.67Å; F638-Y647 HydrophobicContact CE2-CE1 3.67Å; F638-Y647 HydrophobicContact CG-CD1 4.34Å; F638-Y647 HydrophobicContact CG-CE1 4.21Å; F638-Y647 HydrophobicContact CZ-CE1 4.08Å; V645-Y647 HydrophobicContact CG1-CD1 4.48Å; V645-Y647 HydrophobicContact CG1-CD2 4.26Å; V645-Y647 HydrophobicContact CG1-CE1 3.94Å; V645-Y647 HydrophobicContact CG1-CE2 3.69Å; Y647-F651 WeakPolarHBondContact O-CB 3.46Å; Y647-F651 PolarHBondContact O-N 2.87Å; Y647-M673 WeakPolarHBondContact O-CE 3.41Å; Y647-L678 HydrophobicContact CD1-CB 4.1Å; Y647-L678 HydrophobicContact CE1-CD1 4.43Å; Y647-L678 HydrophobicContact CE2-CD2 4.46Å; Y647-L678 HydrophobicContact CG-CB 4.14Å
648	E	95.5	Very high	94.8	Very high	133 Å²	133	58 Å²	58	62%	0.621	29%	0.294	S	S	*	.	H	α-helix	trans	-72.3	-45.7	-179.6	-66.9	-175.2	-176.2	0	0	110.6	D646 F651 I652	D646-E648 VanDerWaalsContact C-N 3.31Å; D646-E648 PolarHBondContact O-N 3.46Å; D646-E648 PolarHBondContact OD1-N 2.98Å; E648-F651 WeakPolarHBondContact O-CB 3.29Å; E648-F651 PolarHBondContact O-N 3.5Å; E648-I652 WeakPolarHBondContact O-CG1 3.44Å; E648-I652 PolarHBondContact O-N 2.97Å; E648-I652 VanDerWaalsContact O-N 3.11Å
649	T	95.4	Very high	94.4	Very high	39 Å²	39	61.7 Å²	61.7	24%	0.239	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-39.4	174.8	49.7	0	0	0	0	112.1	D646 F651 I652 H653	D646-T649 VanDerWaalsContact CB-OG1 3.31Å; D646-T649 WeakPolarHBondContact CB-OG1 3.38Å; D646-T649 PolarHBondContact O-OG1 2.88Å; D646-T649 PolarHBondContact OD1-N 3.24Å; D646-T649 WeakPolarHBondContact OD2-CB 3.48Å; D646-T649 WeakPolarHBondContact OD2-CG2 3.16Å; D646-T649 PolarHBondContact OD2-OG1 3.42Å; T649-F651 VanDerWaalsContact C-N 3.31Å; T649-F651 PolarHBondContact O-N 3.34Å; T649-I652 PolarHBondContact O-N 3.3Å; T649-H653 PolarHBondContact O-CD2 3.16Å; T649-H653 PolarHBondContact O-N 2.77Å
650	A	97	Very high	93.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.5	-45.6	173.1	0	0	0	0	0	111.9	G634 H637 F638 D646 I652 H653 Y654 M673	G634-A650 WeakPolarHBondContact O-CB 3.41Å; H637-A650 HydrophobicContact CB-CB 4Å; F638-A650 HydrophobicContact CB-CB 4.04Å; D646-A650 WeakPolarHBondContact O-CB 3.15Å; D646-A650 PolarHBondContact O-N 3.45Å; A650-I652 VanDerWaalsContact C-N 3.35Å; A650-I652 PolarHBondContact O-N 1.99Å; A650-H653 PolarHBondContact O-N 2.01Å; A650-Y654 HydrophobicContact CB-CE2 4.26Å; A650-Y654 WeakPolarHBondContact O-CD2 3.44Å; A650-Y654 PolarHBondContact O-N 3.02Å; A650-M673 HydrophobicContact CB-CE 4.42Å
651	F	95.7	Very high	93.3	Very high	34 Å²	34	61.8 Å²	61.8	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-58.4	-44.8	176.2	177.9	-94.3	0	0	0	111.9	Y647 E648 T649 H653 Y654 R655 L670 M673 H674 I680	Y647-F651 WeakPolarHBondContact O-CB 3.46Å; Y647-F651 PolarHBondContact O-N 2.87Å; E648-F651 WeakPolarHBondContact O-CB 3.29Å; E648-F651 PolarHBondContact O-N 3.5Å; T649-F651 VanDerWaalsContact C-N 3.31Å; T649-F651 PolarHBondContact O-N 3.34Å; F651-H653 VanDerWaalsContact C-N 3.35Å; F651-H653 PolarHBondContact O-N 2.87Å; F651-Y654 PolarHBondContact O-N 3.39Å; F651-R655 WeakPolarHBondContact O-CB 2.95Å; F651-R655 PolarHBondContact O-N 2.96Å; F651-L670 HydrophobicContact CD2-CD2 3.54Å; F651-L670 HydrophobicContact CE2-CD2 3.5Å; F651-L670 HydrophobicContact CG-CD2 4.33Å; F651-L670 HydrophobicContact CZ-CD2 4.28Å; F651-M673 HydrophobicContact CB-CE 3.71Å; F651-M673 HydrophobicContact CB-SD 4.25Å; F651-M673 HydrophobicContact CD2-CE 4.45Å; F651-M673 HydrophobicContact CD2-SD 4.35Å; F651-H674 AromaticContact CE2-NE2 3.57Å; F651-H674 AromaticContact CZ-NE2 3.99Å; F651-I680 HydrophobicContact CD1-CG2 4.26Å; F651-I680 HydrophobicContact CD2-CD1 3.94Å; F651-I680 HydrophobicContact CD2-CG1 4.35Å; F651-I680 HydrophobicContact CD2-CG2 4.15Å; F651-I680 HydrophobicContact CE1-CG2 4.37Å; F651-I680 HydrophobicContact CE2-CD1 3.69Å; F651-I680 HydrophobicContact CE2-CG1 4.49Å; F651-I680 HydrophobicContact CE2-CG2 4.26Å; F651-I680 HydrophobicContact CG-CG2 4.14Å; F651-I680 HydrophobicContact CZ-CG2 4.38Å
652	I	94.4	Very high	93.1	Very high	89 Å²	89	64.8 Å²	64.8	46%	0.456	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-45.2	178.1	-67.7	165.9	0	0	0	110.7	E648 T649 A650 R655 L656	E648-I652 WeakPolarHBondContact O-CG1 3.44Å; E648-I652 PolarHBondContact O-N 2.97Å; E648-I652 VanDerWaalsContact O-N 3.11Å; T649-I652 PolarHBondContact O-N 3.3Å; A650-I652 VanDerWaalsContact C-N 3.35Å; A650-I652 PolarHBondContact O-N 1.99Å; I652-R655 PolarHBondContact O-N 3.14Å; I652-L656 HydrophobicContact CG2-CD1 3.87Å; I652-L656 HydrophobicContact CG2-CG 4.4Å; I652-L656 WeakPolarHBondContact O-CB 3.24Å; I652-L656 VanDerWaalsContact O-CG 3.26Å; I652-L656 WeakPolarHBondContact O-CG 2.99Å; I652-L656 PolarHBondContact O-N 3.41Å
653	H	95.7	Very high	93.4	Very high	38 Å²	38	64.1 Å²	64.1	18%	0.176	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-45.8	179.3	-76	-61.5	0	0	0	112.5	H637 T649 A650 F651 L656 A657	H637-H653 AromaticContact CD2-CD2 3.96Å; T649-H653 PolarHBondContact O-CD2 3.16Å; T649-H653 PolarHBondContact O-N 2.77Å; A650-H653 PolarHBondContact O-N 2.01Å; F651-H653 VanDerWaalsContact C-N 3.35Å; F651-H653 PolarHBondContact O-N 2.87Å; H653-L656 PolarHBondContact O-N 2.9Å; H653-A657 WeakPolarHBondContact O-CB 3.23Å; H653-A657 PolarHBondContact O-N 3.41Å
654	Y	96.2	Very high	93.3	Very high	5 Å²	5	62.4 Å²	62.4	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-39.8	175.7	-62.2	-46.5	0	0	0	112.2	I631 G634 D635 A650 F651 L656 A657 S658 N669 M673	I631-Y654 HydrophobicContact CG2-CD1 4.34Å; I631-Y654 HydrophobicContact CG2-CE1 3.98Å; I631-Y654 WeakPolarHBondContact O-CE1 3.39Å; G634-Y654 VanDerWaalsContact C-OH 3.32Å; D635-Y654 WeakPolarHBondContact CA-OH 3.45Å; D635-Y654 PolarHBondContact N-OH 2.97Å; D635-Y654 WeakPolarHBondContact OD1-CE1 3.26Å; D635-Y654 PolarHBondContact OD1-OH 2.78Å; A650-Y654 HydrophobicContact CB-CE2 4.26Å; A650-Y654 WeakPolarHBondContact O-CD2 3.44Å; A650-Y654 PolarHBondContact O-N 3.02Å; F651-Y654 PolarHBondContact O-N 3.39Å; Y654-L656 PolarHBondContact O-N 3.3Å; Y654-A657 PolarHBondContact O-N 2.95Å; Y654-S658 WeakPolarHBondContact O-CB 3.29Å; Y654-S658 PolarHBondContact O-N 2.83Å; Y654-N669 HydrophobicContact CD1-CB 4.19Å; Y654-N669 HydrophobicContact CD2-CB 4.09Å; Y654-N669 HydrophobicContact CE1-CB 4.17Å; Y654-N669 VanDerWaalsContact CE1-ND2 3.27Å; Y654-N669 WeakPolarHBondContact CE1-ND2 2.94Å; Y654-N669 HydrophobicContact CE2-CB 4.06Å; Y654-N669 HydrophobicContact CG-CB 4.15Å; Y654-M673 HydrophobicContact CD2-SD 3.59Å; Y654-M673 VanDerWaalsContact CD2-SD 3.59Å; Y654-M673 HydrophobicContact CE2-SD 3.84Å
655	R	94.4	Very high	93.3	Very high	121 Å²	121	59.7 Å²	59.7	46%	0.457	29%	0.288	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.8	-178.4	178.5	176.2	-171	-3.2	111.4	F651 I652 A657 S658 E659 L670	F651-R655 WeakPolarHBondContact O-CB 2.95Å; F651-R655 PolarHBondContact O-N 2.96Å; I652-R655 PolarHBondContact O-N 3.14Å; R655-A657 VanDerWaalsContact C-N 3.34Å; R655-A657 PolarHBondContact O-N 3.23Å; R655-S658 PolarHBondContact O-N 3.42Å; R655-E659 HydrophobicContact CG-CG 4.32Å; R655-E659 IonicContact CZ-OE1 2.93Å; R655-E659 IonicContact NE-OE1 3.92Å; R655-E659 PolarHBondContact NE-OE1 3.35Å; R655-E659 IonicContact NE-OE2 3.34Å; R655-E659 IonicContact NH2-OE1 3.83Å; R655-E659 PolarHBondContact NH2-OE1 3.08Å; R655-E659 IonicContact NH2-OE2 2.67Å; R655-E659 PolarHBondContact O-N 2.92Å; R655-L670 HydrophobicContact CB-CD2 4.35Å
656	L	93.6	Very high	93.3	Very high	49 Å²	49	56 Å²	56	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-41	177.7	-70	169.3	0	0	0	111.8	I652 H653 Y654 S658 Q660	I652-L656 HydrophobicContact CG2-CD1 3.87Å; I652-L656 HydrophobicContact CG2-CG 4.4Å; I652-L656 WeakPolarHBondContact O-CB 3.24Å; I652-L656 VanDerWaalsContact O-CG 3.26Å; I652-L656 WeakPolarHBondContact O-CG 2.99Å; I652-L656 PolarHBondContact O-N 3.41Å; H653-L656 PolarHBondContact O-N 2.9Å; Y654-L656 PolarHBondContact O-N 3.3Å; L656-S658 VanDerWaalsContact C-N 3.33Å; L656-Q660 VanDerWaalsContact O-CB 3.26Å; L656-Q660 WeakPolarHBondContact O-CB 3.35Å; L656-Q660 WeakPolarHBondContact O-CG 3.38Å; L656-Q660 PolarHBondContact O-N 3.43Å
657	A	94.3	Very high	93.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-32.7	175.7	0	0	0	0	0	112.7	R630 I631 H653 Y654 R655 Q661 H662 S663 A666	R630-A657 HydrophobicContact CB-CB 4.44Å; R630-A657 HydrophobicContact CG-CB 4.24Å; I631-A657 HydrophobicContact CG1-CB 3.94Å; H653-A657 WeakPolarHBondContact O-CB 3.23Å; H653-A657 PolarHBondContact O-N 3.41Å; Y654-A657 PolarHBondContact O-N 2.95Å; R655-A657 VanDerWaalsContact C-N 3.34Å; R655-A657 PolarHBondContact O-N 3.23Å; A657-Q661 WeakPolarHBondContact O-CB 3.46Å; A657-Q661 PolarHBondContact O-N 3.46Å; A657-H662 PolarHBondContact O-N 2.87Å; A657-S663 PolarHBondContact O-N 3.45Å; A657-A666 HydrophobicContact CB-CB 3.76Å
658	S	92.6	Very high	93.2	Very high	5 Å²	5	52.3 Å²	52.3	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-71.6	-51.3	174.6	178.6	0	0	0	0	111.9	Y654 R655 L656 H662 M667	Y654-S658 WeakPolarHBondContact O-CB 3.29Å; Y654-S658 PolarHBondContact O-N 2.83Å; R655-S658 PolarHBondContact O-N 3.42Å; L656-S658 VanDerWaalsContact C-N 3.33Å; S658-H662 VanDerWaalsContact O-CA 3.25Å; S658-H662 WeakPolarHBondContact O-CA 3.13Å; S658-H662 PolarHBondContact O-N 3.47Å; S658-M667 WeakPolarHBondContact OG-CG 3.26Å
659	E	89.2	Confident	93.3	Very high	102 Å²	102	47.6 Å²	47.6	48%	0.477	23%	0.228	S	C	.	.	H	α-helix	trans	-74.3	-42.1	-173.2	-71.1	178.3	174.8	0	0	112.7	R655	R655-E659 HydrophobicContact CG-CG 4.32Å; R655-E659 IonicContact CZ-OE1 2.93Å; R655-E659 IonicContact NE-OE1 3.92Å; R655-E659 PolarHBondContact NE-OE1 3.35Å; R655-E659 IonicContact NE-OE2 3.34Å; R655-E659 IonicContact NH2-OE1 3.83Å; R655-E659 PolarHBondContact NH2-OE1 3.08Å; R655-E659 IonicContact NH2-OE2 2.67Å; R655-E659 PolarHBondContact O-N 2.92Å
660	Q	85.9	Confident	93.3	Very high	117 Å²	117	45.8 Å²	45.8	55%	0.547	22%	0.217	S	C	.	.	H	α-helix	trans	-83.5	-30.6	-174.8	-61.2	-178.1	-10.9	0	0	112.4	L656	L656-Q660 VanDerWaalsContact O-CB 3.26Å; L656-Q660 WeakPolarHBondContact O-CB 3.35Å; L656-Q660 WeakPolarHBondContact O-CG 3.38Å; L656-Q660 PolarHBondContact O-N 3.43Å
661	Q	81.4	Confident	93.2	Very high	48 Å²	48	45.8 Å²	45.8	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-127.7	-1	-165.4	-63.2	161.2	-11.4	0	0	113.4	G625 T627 A657 S663	G625-Q661 PolarHBondContact O-NE2 3.23Å; G625-Q661 VanDerWaalsContact O-NE2 3.09Å; T627-Q661 HydrophobicContact CG2-CB 3.81Å; T627-Q661 HydrophobicContact CG2-CG 3.59Å; A657-Q661 WeakPolarHBondContact O-CB 3.46Å; A657-Q661 PolarHBondContact O-N 3.46Å; Q661-S663 PolarHBondContact O-N 3.03Å
662	H	88.3	Confident	93.2	Very high	134 Å²	134	48.2 Å²	48.2	62%	0.62	23%	0.226	S	C	*	.			trans	54.2	35.2	175.5	-59.3	74.6	0	0	0	113.6	A657 S658 A664 M667	A657-H662 PolarHBondContact O-N 2.87Å; S658-H662 VanDerWaalsContact O-CA 3.25Å; S658-H662 WeakPolarHBondContact O-CA 3.13Å; S658-H662 PolarHBondContact O-N 3.47Å; H662-A664 PolarHBondContact O-N 3.15Å; H662-M667 HydrophobicContact CB-CE 4.2Å
663	S	93.1	Very high	93.2	Very high	24 Å²	24	44 Å²	44	17%	0.168	20%	0.204	C	C	.	.			trans	-72.9	123.5	-179.9	174.9	0	0	0	0	112.2	I631 A657 Q661 Q665 A666 M667	I631-S663 WeakPolarHBondContact CD1-OG 3.4Å; A657-S663 PolarHBondContact O-N 3.45Å; Q661-S663 PolarHBondContact O-N 3.03Å; S663-Q665 VanDerWaalsContact C-N 3.34Å; S663-Q665 PolarHBondContact O-N 2.91Å; S663-Q665 PolarHBondContact OG-N 3.35Å; S663-A666 PolarHBondContact O-N 3.22Å; S663-M667 WeakPolarHBondContact O-CG 3.4Å; S663-M667 PolarHBondContact O-N 3.04Å; S663-M667 VanDerWaalsContact O-N 3.08Å
664	A	93.3	Very high	93.2	Very high	14 Å²	14	43 Å²	43	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-38.9	177	0	0	0	0	0	112.7	H662 M667 F668 A694 A697 A701	H662-A664 PolarHBondContact O-N 3.15Å; A664-M667 PolarHBondContact O-N 3.41Å; A664-F668 WeakPolarHBondContact O-CB 3.4Å; A664-F668 PolarHBondContact O-N 3.32Å; A664-A694 WeakPolarHBondContact O-CB 3.47Å; A664-A697 HydrophobicContact CB-CB 3.99Å; A664-A701 HydrophobicContact CB-CB 4.05Å
665	Q	93.9	Very high	93.1	Very high	85 Å²	85	43.2 Å²	43.2	40%	0.397	20%	0.201	S	C	.	.	H	α-helix	trans	-65.2	-41.4	177.7	-178.2	179.6	-3.4	0	0	111.5	I631 S663 F668 N669	I631-Q665 HydrophobicContact CD1-CB 4.33Å; I631-Q665 HydrophobicContact CG2-CG 4.28Å; S663-Q665 VanDerWaalsContact C-N 3.34Å; S663-Q665 PolarHBondContact O-N 2.91Å; S663-Q665 PolarHBondContact OG-N 3.35Å; Q665-F668 PolarHBondContact O-N 3.48Å; Q665-N669 WeakPolarHBondContact O-CB 3.42Å; Q665-N669 PolarHBondContact O-N 2.97Å
666	A	95.4	Very high	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-43	176.6	0	0	0	0	0	111.6	I631 A657 S663 F668 N669 L670	I631-A666 HydrophobicContact CD1-CB 4.27Å; I631-A666 HydrophobicContact CG1-CB 4.19Å; A657-A666 HydrophobicContact CB-CB 3.76Å; S663-A666 PolarHBondContact O-N 3.22Å; A666-F668 PolarHBondContact O-N 3.15Å; A666-N669 PolarHBondContact O-N 3.21Å; A666-L670 WeakPolarHBondContact O-CG 3.29Å; A666-L670 PolarHBondContact O-N 2.82Å
667	M	95.9	Very high	93.1	Very high	7 Å²	7	40.8 Å²	40.8	3%	0.034	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-43.7	174.4	-69.1	173.6	-163	0	0	111.8	S658 H662 S663 A664 N669 L670 G671 M693 A694 A697	S658-M667 WeakPolarHBondContact OG-CG 3.26Å; H662-M667 HydrophobicContact CB-CE 4.2Å; S663-M667 WeakPolarHBondContact O-CG 3.4Å; S663-M667 PolarHBondContact O-N 3.04Å; S663-M667 VanDerWaalsContact O-N 3.08Å; A664-M667 PolarHBondContact O-N 3.41Å; M667-N669 PolarHBondContact O-N 2.99Å; M667-L670 PolarHBondContact O-N 3.4Å; M667-G671 PolarHBondContact O-N 3.13Å; M667-M693 HydrophobicContact CE-CE 4.41Å; M667-M693 HydrophobicContact SD-CB 3.85Å; M667-M693 HydrophobicContact SD-CE 4.3Å; M667-A694 HydrophobicContact CB-CB 3.8Å; M667-A697 HydrophobicContact CE-CB 4.42Å; M667-A697 HydrophobicContact SD-CB 4.11Å
668	F	96.3	Very high	93	Very high	55 Å²	55	42.8 Å²	42.8	24%	0.241	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-45.1	176.7	-174.1	-86.4	0	0	0	111.8	A664 Q665 A666 G671 Y672 Y691 A694 P704 V705 A708	A664-F668 WeakPolarHBondContact O-CB 3.4Å; A664-F668 PolarHBondContact O-N 3.32Å; Q665-F668 PolarHBondContact O-N 3.48Å; A666-F668 PolarHBondContact O-N 3.15Å; F668-G671 PolarHBondContact O-N 3.44Å; F668-Y672 PolarHBondContact O-N 2.9Å; F668-Y691 AromaticContact CD2-CD1 3.77Å; F668-Y691 HydrophobicContact CD2-CD1 3.77Å; F668-Y691 AromaticContact CD2-CE1 3.81Å; F668-Y691 HydrophobicContact CD2-CE1 3.81Å; F668-Y691 AromaticContact CE2-CD1 4Å; F668-Y691 HydrophobicContact CE2-CD1 4Å; F668-Y691 AromaticContact CE2-CE1 3.8Å; F668-Y691 HydrophobicContact CE2-CE1 3.8Å; F668-Y691 HydrophobicContact CG-CD1 4.41Å; F668-Y691 HydrophobicContact CG-CE1 4.2Å; F668-Y691 HydrophobicContact CZ-CE1 4.18Å; F668-Y691 WeakPolarHBondContact O-CE1 3.36Å; F668-A694 HydrophobicContact CB-CB 4.32Å; F668-P704 HydrophobicContact CE2-CB 4.18Å; F668-V705 HydrophobicContact CD2-CG2 3.94Å; F668-V705 HydrophobicContact CE2-CG2 4.35Å; F668-A708 HydrophobicContact CE2-CB 3.92Å; F668-A708 HydrophobicContact CZ-CB 4.15Å
669	N	96.3	Very high	92.8	Very high	33 Å²	33	44 Å²	44	18%	0.176	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-42.7	177.2	-73	-3.4	0	0	0	111.7	Y654 Q665 A666 M667 G671 Y672 M673	Y654-N669 HydrophobicContact CD1-CB 4.19Å; Y654-N669 HydrophobicContact CD2-CB 4.09Å; Y654-N669 HydrophobicContact CE1-CB 4.17Å; Y654-N669 VanDerWaalsContact CE1-ND2 3.27Å; Y654-N669 WeakPolarHBondContact CE1-ND2 2.94Å; Y654-N669 HydrophobicContact CE2-CB 4.06Å; Y654-N669 HydrophobicContact CG-CB 4.15Å; Q665-N669 WeakPolarHBondContact O-CB 3.42Å; Q665-N669 PolarHBondContact O-N 2.97Å; A666-N669 PolarHBondContact O-N 3.21Å; M667-N669 PolarHBondContact O-N 2.99Å; N669-G671 PolarHBondContact O-N 3.3Å; N669-Y672 WeakPolarHBondContact O-CB 3.44Å; N669-Y672 PolarHBondContact O-N 3.11Å; N669-M673 WeakPolarHBondContact O-CG 3.26Å; N669-M673 PolarHBondContact O-N 3.26Å
670	L	95.6	Very high	93	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-43.7	173.6	-71.9	167.5	0	0	0	111.9	F651 R655 A666 M667 Y672 M673 H674 F690	F651-L670 HydrophobicContact CD2-CD2 3.54Å; F651-L670 HydrophobicContact CE2-CD2 3.5Å; F651-L670 HydrophobicContact CG-CD2 4.33Å; F651-L670 HydrophobicContact CZ-CD2 4.28Å; R655-L670 HydrophobicContact CB-CD2 4.35Å; A666-L670 WeakPolarHBondContact O-CG 3.29Å; A666-L670 PolarHBondContact O-N 2.82Å; M667-L670 PolarHBondContact O-N 3.4Å; L670-Y672 VanDerWaalsContact C-N 3.27Å; L670-Y672 PolarHBondContact O-N 3.1Å; L670-M673 PolarHBondContact O-N 2.91Å; L670-M673 VanDerWaalsContact O-N 3.17Å; L670-H674 PolarHBondContact O-CD2 2.88Å; L670-H674 VanDerWaalsContact O-CD2 3.25Å; L670-H674 PolarHBondContact O-N 3.04Å; L670-F690 HydrophobicContact CB-CD1 4.33Å; L670-F690 HydrophobicContact CB-CD2 4.28Å; L670-F690 HydrophobicContact CB-CE2 4.44Å; L670-F690 HydrophobicContact CB-CG 4.22Å; L670-F690 HydrophobicContact CD1-CD1 4.44Å; L670-F690 HydrophobicContact CD1-CE1 4.05Å; L670-F690 HydrophobicContact CD1-CZ 4.33Å
671	G	95.3	Very high	93.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-55.8	-44	174.5	0	0	0	0	0	111.7	M667 F668 N669 H674 E675 A687	M667-G671 PolarHBondContact O-N 3.13Å; F668-G671 PolarHBondContact O-N 3.44Å; N669-G671 PolarHBondContact O-N 3.3Å; G671-H674 PolarHBondContact O-N 3.39Å; G671-E675 WeakPolarHBondContact O-CB 3.37Å; G671-E675 PolarHBondContact O-N 3.48Å; G671-A687 VanDerWaalsContact O-CB 3.28Å; G671-A687 WeakPolarHBondContact O-CB 3.17Å
672	Y	95.3	Very high	94	Very high	86 Å²	86	48 Å²	48	34%	0.337	24%	0.24	S	C	.	.	H	α-helix	trans	-64.6	-41.6	175.8	-178.2	-99.9	0	0	0	113.2	F638 F668 N669 L670 E675 K676 L678 Y691	F638-Y672 HydrophobicContact CZ-CE1 4.15Å; F668-Y672 PolarHBondContact O-N 2.9Å; N669-Y672 WeakPolarHBondContact O-CB 3.44Å; N669-Y672 PolarHBondContact O-N 3.11Å; L670-Y672 VanDerWaalsContact C-N 3.27Å; L670-Y672 PolarHBondContact O-N 3.1Å; Y672-E675 WeakPolarHBondContact O-CB 3.43Å; Y672-E675 PolarHBondContact O-N 2.9Å; Y672-K676 HydrophobicContact CD2-CG 4.49Å; Y672-K676 HydrophobicContact CE1-CG 4.16Å; Y672-K676 HydrophobicContact CE2-CG 4.02Å; Y672-K676 PolarHBondContact O-N 3.15Å; Y672-L678 HydrophobicContact CE1-CD1 4.06Å; Y672-Y691 VanDerWaalsContact CA-OH 3.24Å; Y672-Y691 WeakPolarHBondContact CA-OH 3.28Å; Y672-Y691 PolarHBondContact N-OH 3.34Å
673	M	96.1	Very high	94.3	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-40.4	176.8	-66.9	-179.1	80.7	0	0	112.1	F638 Y647 A650 F651 Y654 N669 L670 K676 G677 L678 I680	F638-M673 HydrophobicContact CE2-CG 4.46Å; Y647-M673 WeakPolarHBondContact O-CE 3.41Å; A650-M673 HydrophobicContact CB-CE 4.42Å; F651-M673 HydrophobicContact CB-CE 3.71Å; F651-M673 HydrophobicContact CB-SD 4.25Å; F651-M673 HydrophobicContact CD2-CE 4.45Å; F651-M673 HydrophobicContact CD2-SD 4.35Å; Y654-M673 HydrophobicContact CD2-SD 3.59Å; Y654-M673 VanDerWaalsContact CD2-SD 3.59Å; Y654-M673 HydrophobicContact CE2-SD 3.84Å; N669-M673 WeakPolarHBondContact O-CG 3.26Å; N669-M673 PolarHBondContact O-N 3.26Å; L670-M673 PolarHBondContact O-N 2.91Å; L670-M673 VanDerWaalsContact O-N 3.17Å; M673-K676 PolarHBondContact O-N 3.12Å; M673-G677 WeakPolarHBondContact O-CA 3.38Å; M673-G677 PolarHBondContact O-N 3.23Å; M673-L678 WeakPolarHBondContact CE-O 3.49Å; M673-L678 PolarHBondContact O-N 3.38Å; M673-I680 HydrophobicContact CB-CD1 4.47Å
674	H	95.5	Very high	94.1	Very high	17 Å²	17	46.7 Å²	46.7	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-67.2	-37.1	173.6	-81.9	-72	0	0	0	112.7	F651 L670 G671 K676 I680 Q682 D683 L686 A687 F690	F651-H674 AromaticContact CE2-NE2 3.57Å; F651-H674 AromaticContact CZ-NE2 3.99Å; L670-H674 PolarHBondContact O-CD2 2.88Å; L670-H674 VanDerWaalsContact O-CD2 3.25Å; L670-H674 PolarHBondContact O-N 3.04Å; G671-H674 PolarHBondContact O-N 3.39Å; H674-K676 VanDerWaalsContact C-N 3.32Å; H674-K676 PolarHBondContact O-N 2.89Å; H674-I680 HydrophobicContact CB-CD1 4.38Å; H674-I680 WeakPolarHBondContact CE1-CD1 3.41Å; H674-I680 VanDerWaalsContact ND1-CD1 3.25Å; H674-I680 WeakPolarHBondContact ND1-CD1 3.49Å; H674-Q682 WeakPolarHBondContact O-CA 3.41Å; H674-Q682 WeakPolarHBondContact O-CG 3.1Å; H674-D683 PolarHBondContact O-N 3.46Å; H674-L686 WeakPolarHBondContact CE1-CD2 3.3Å; H674-A687 HydrophobicContact CB-CB 3.78Å; H674-F690 AromaticContact CD2-CD2 3.65Å; H674-F690 AromaticContact CD2-CE2 3.53Å; H674-F690 AromaticContact NE2-CE2 3.52Å
675	E	94.3	Very high	94	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-42.2	175	-171	-152.9	122.9	0	0	111	G671 Y672 Q682 A687 Y691 K711 L712	G671-E675 WeakPolarHBondContact O-CB 3.37Å; G671-E675 PolarHBondContact O-N 3.48Å; Y672-E675 WeakPolarHBondContact O-CB 3.43Å; Y672-E675 PolarHBondContact O-N 2.9Å; E675-Q682 WeakPolarHBondContact O-CG 3.47Å; E675-Q682 PolarHBondContact O-NE2 2.98Å; E675-A687 HydrophobicContact CB-CB 4.23Å; E675-Y691 PolarHBondContact OE2-OH 3.45Å; E675-K711 WeakPolarHBondContact OE1-CE 3.26Å; E675-K711 IonicContact OE1-NZ 2.73Å; E675-K711 PolarHBondContact OE1-NZ 3.06Å; E675-K711 IonicContact OE2-NZ 2.76Å; E675-K711 PolarHBondContact OE2-NZ 3.18Å; E675-L712 HydrophobicContact CG-CD1 3.95Å
676	K	93.2	Very high	94	Very high	93 Å²	93	52 Å²	52	40%	0.404	26%	0.258	S	S	.	.	H	α-helix	trans	-92.9	-18.9	-175.1	-66.4	-51.2	-171.4	-154.5	0	114.8	Y672 M673 H674 L678	Y672-K676 HydrophobicContact CD2-CG 4.49Å; Y672-K676 HydrophobicContact CE1-CG 4.16Å; Y672-K676 HydrophobicContact CE2-CG 4.02Å; Y672-K676 PolarHBondContact O-N 3.15Å; M673-K676 PolarHBondContact O-N 3.12Å; H674-K676 VanDerWaalsContact C-N 3.32Å; H674-K676 PolarHBondContact O-N 2.89Å; K676-L678 HydrophobicContact CB-CD1 3.93Å; K676-L678 HydrophobicContact CB-CD2 4.47Å; K676-L678 HydrophobicContact CB-CG 3.7Å; K676-L678 HydrophobicContact CG-CD1 4.46Å
677	G	93.7	Very high	94	Very high	27 Å²	27	52 Å²	52	28%	0.278	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	40.5	-171.8	0	0	0	0	0	112.8	M673 I680	M673-G677 WeakPolarHBondContact O-CA 3.38Å; M673-G677 PolarHBondContact O-N 3.23Å; G677-I680 CarbonylContact C-O 3.4Å; G677-I680 WeakPolarHBondContact CA-O 3.46Å; G677-I680 VanDerWaalsContact O-O 3.1Å
678	L	93.1	Very high	94	Very high	41 Å²	41	56.5 Å²	56.5	22%	0.215	28%	0.277	C	S	.	.	S	Bend	trans	-87.9	114.4	179	-63.8	172.1	0	0	0	109.9	F638 Y647 Y672 M673 K676 I680	F638-L678 HydrophobicContact CE2-CD1 3.7Å; F638-L678 HydrophobicContact CZ-CD1 3.84Å; Y647-L678 HydrophobicContact CD1-CB 4.1Å; Y647-L678 HydrophobicContact CE1-CD1 4.43Å; Y647-L678 HydrophobicContact CE2-CD2 4.46Å; Y647-L678 HydrophobicContact CG-CB 4.14Å; Y672-L678 HydrophobicContact CE1-CD1 4.06Å; M673-L678 WeakPolarHBondContact CE-O 3.49Å; M673-L678 PolarHBondContact O-N 3.38Å; K676-L678 HydrophobicContact CB-CD1 3.93Å; K676-L678 HydrophobicContact CB-CD2 4.47Å; K676-L678 HydrophobicContact CB-CG 3.7Å; K676-L678 HydrophobicContact CG-CD1 4.46Å; L678-I680 WeakPolarHBondContact O-CG1 3.02Å; L678-I680 PolarHBondContact O-N 3.04Å; L678-I680 VanDerWaalsContact O-N 3.11Å
679	G	87.8	Confident	93.9	Very high	30 Å²	30	61.7 Å²	61.7	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	71.2	-3.9	-177.9	0	0	0	0	0	114.9
680	I	92.9	Very high	93.9	Very high	45 Å²	45	61.6 Å²	61.6	23%	0.231	29%	0.293	C	S	.	.	S	Bend	trans	-148.6	162.4	-177.9	46.8	153.5	0	0	0	109.8	F651 M673 H674 G677 L678 Q682	F651-I680 HydrophobicContact CD1-CG2 4.26Å; F651-I680 HydrophobicContact CD2-CD1 3.94Å; F651-I680 HydrophobicContact CD2-CG1 4.35Å; F651-I680 HydrophobicContact CD2-CG2 4.15Å; F651-I680 HydrophobicContact CE1-CG2 4.37Å; F651-I680 HydrophobicContact CE2-CD1 3.69Å; F651-I680 HydrophobicContact CE2-CG1 4.49Å; F651-I680 HydrophobicContact CE2-CG2 4.26Å; F651-I680 HydrophobicContact CG-CG2 4.14Å; F651-I680 HydrophobicContact CZ-CG2 4.38Å; M673-I680 HydrophobicContact CB-CD1 4.47Å; H674-I680 HydrophobicContact CB-CD1 4.38Å; H674-I680 WeakPolarHBondContact CE1-CD1 3.41Å; H674-I680 VanDerWaalsContact ND1-CD1 3.25Å; H674-I680 WeakPolarHBondContact ND1-CD1 3.49Å; G677-I680 CarbonylContact C-O 3.4Å; G677-I680 WeakPolarHBondContact CA-O 3.46Å; G677-I680 VanDerWaalsContact O-O 3.1Å; L678-I680 WeakPolarHBondContact O-CG1 3.02Å; L678-I680 PolarHBondContact O-N 3.04Å; L678-I680 VanDerWaalsContact O-N 3.11Å; I680-Q682 PolarHBondContact O-N 3.25Å
681	K	93.8	Very high	94	Very high	193 Å²	193	61.7 Å²	61.7	84%	0.839	29%	0.293	S	S	*	.			trans	-64.5	134.7	174.1	-171.5	177.6	177.3	-176.4	0	110.2	D683	K681-D683 PolarHBondContact O-N 3.3Å
682	Q	94.2	Very high	94	Very high	115 Å²	115	64.1 Å²	64.1	54%	0.537	31%	0.306	S	S	.	.			trans	-59.6	127.5	176.1	-168.4	-178.3	26.9	0	0	110.8	H674 E675 I680	H674-Q682 WeakPolarHBondContact O-CA 3.41Å; H674-Q682 WeakPolarHBondContact O-CG 3.1Å; E675-Q682 WeakPolarHBondContact O-CG 3.47Å; E675-Q682 PolarHBondContact O-NE2 2.98Å; I680-Q682 PolarHBondContact O-N 3.25Å
683	D	94.4	Very high	94	Very high	67 Å²	67	62.9 Å²	62.9	36%	0.358	31%	0.305	S	S	.	.			trans	-143.6	102.9	176.1	-172.3	-24.7	0	0	0	109.9	H674 K681 H685 L686 A687	H674-D683 PolarHBondContact O-N 3.46Å; K681-D683 PolarHBondContact O-N 3.3Å; D683-H685 PolarHBondContact OD1-N 3.09Å; D683-L686 HydrophobicContact CB-CB 4.02Å; D683-L686 PolarHBondContact OD1-N 3.34Å; D683-A687 WeakPolarHBondContact O-CB 3.24Å; D683-A687 PolarHBondContact O-N 2.92Å
684	I	90.4	Very high	94	Very high	63 Å²	63	62.9 Å²	62.9	32%	0.323	30%	0.304	S	S	.	.	H	α-helix	trans	-72.5	-32.1	-174.2	-61.3	170.2	0	0	0	111.7	A687 K688 L712	I684-A687 WeakPolarHBondContact O-CB 3.42Å; I684-A687 PolarHBondContact O-N 3.47Å; I684-K688 PolarHBondContact O-N 2.98Å; I684-L712 HydrophobicContact CG2-CD1 3.95Å; I684-L712 HydrophobicContact CG2-CD2 3.95Å; I684-L712 HydrophobicContact CG2-CG 4.23Å
685	H	91.4	Very high	94	Very high	160 Å²	160	63.1 Å²	63.1	74%	0.741	31%	0.309	S	S	*	.	H	α-helix	trans	-70.9	-42.7	-179.8	-66.6	-69.5	0	0	0	110.5	D683 A687 K688 R689	D683-H685 PolarHBondContact OD1-N 3.09Å; H685-A687 VanDerWaalsContact C-N 3.34Å; H685-K688 PolarHBondContact O-N 2.99Å; H685-R689 PolarHBondContact O-N 3.22Å
686	L	94.1	Very high	93.9	Very high	51 Å²	51	70.7 Å²	70.7	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-67	-37.6	174.8	-170.5	55.1	0	0	0	111.4	H674 D683 K688 R689 F690	H674-L686 WeakPolarHBondContact CE1-CD2 3.3Å; D683-L686 HydrophobicContact CB-CB 4.02Å; D683-L686 PolarHBondContact OD1-N 3.34Å; L686-K688 PolarHBondContact O-N 3.15Å; L686-R689 WeakPolarHBondContact O-CB 3.33Å; L686-R689 PolarHBondContact O-N 3.13Å; L686-F690 HydrophobicContact CD1-CD2 4.1Å; L686-F690 HydrophobicContact CD1-CE2 3.73Å; L686-F690 HydrophobicContact CD1-CZ 4.42Å; L686-F690 HydrophobicContact CD2-CE2 4.14Å; L686-F690 HydrophobicContact CG-CD2 3.91Å; L686-F690 HydrophobicContact CG-CE2 3.62Å; L686-F690 VanDerWaalsContact O-CD2 3.29Å; L686-F690 WeakPolarHBondContact O-CD2 3.46Å; L686-F690 PolarHBondContact O-N 2.78Å
687	A	94.9	Very high	93.9	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.9	-49.3	172.3	0	0	0	0	0	112.2	G671 H674 E675 D683 I684 H685 R689 F690 Y691	G671-A687 VanDerWaalsContact O-CB 3.28Å; G671-A687 WeakPolarHBondContact O-CB 3.17Å; H674-A687 HydrophobicContact CB-CB 3.78Å; E675-A687 HydrophobicContact CB-CB 4.23Å; D683-A687 WeakPolarHBondContact O-CB 3.24Å; D683-A687 PolarHBondContact O-N 2.92Å; I684-A687 WeakPolarHBondContact O-CB 3.42Å; I684-A687 PolarHBondContact O-N 3.47Å; H685-A687 VanDerWaalsContact C-N 3.34Å; A687-R689 VanDerWaalsContact C-N 3.32Å; A687-R689 PolarHBondContact O-N 2.91Å; A687-F690 PolarHBondContact O-N 3.01Å; A687-Y691 VanDerWaalsContact O-CD2 3.23Å; A687-Y691 WeakPolarHBondContact O-CD2 2.96Å; A687-Y691 PolarHBondContact O-N 3.37Å
688	K	94.9	Very high	93.7	Very high	100 Å²	100	68.8 Å²	68.8	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-57.4	-45.7	175.2	-179.1	178.5	179.7	-71.9	0	111.5	I684 H685 L686 F690 Y691 D692 L709 L712	I684-K688 PolarHBondContact O-N 2.98Å; H685-K688 PolarHBondContact O-N 2.99Å; L686-K688 PolarHBondContact O-N 3.15Å; K688-F690 VanDerWaalsContact C-N 3.32Å; K688-F690 PolarHBondContact O-N 3.44Å; K688-Y691 WeakPolarHBondContact O-CB 3.27Å; K688-Y691 PolarHBondContact O-N 3.34Å; K688-D692 IonicContact NZ-OD1 2.67Å; K688-D692 IonicContact NZ-OD2 3.5Å; K688-D692 PolarHBondContact NZ-OD2 2.83Å; K688-D692 VanDerWaalsContact O-CG 3.3Å; K688-D692 PolarHBondContact O-N 2.88Å; K688-L709 HydrophobicContact CB-CD2 4.47Å; K688-L709 HydrophobicContact CG-CD2 3.88Å; K688-L712 HydrophobicContact CB-CD2 4.49Å
689	R	95.6	Very high	93.7	Very high	164 Å²	164	71.4 Å²	71.4	62%	0.619	36%	0.361	S	S	*	.	H	α-helix	trans	-58.8	-44.2	178.9	-177.3	-178.5	178.1	178.5	1	111.7	H685 L686 A687 Y691 D692 M693	H685-R689 PolarHBondContact O-N 3.22Å; L686-R689 WeakPolarHBondContact O-CB 3.33Å; L686-R689 PolarHBondContact O-N 3.13Å; A687-R689 VanDerWaalsContact C-N 3.32Å; A687-R689 PolarHBondContact O-N 2.91Å; R689-Y691 VanDerWaalsContact C-N 3.34Å; R689-D692 PolarHBondContact O-N 3.47Å; R689-M693 HydrophobicContact CG-CG 4.49Å; R689-M693 HydrophobicContact CG-SD 4.11Å; R689-M693 WeakPolarHBondContact O-CB 3.44Å; R689-M693 VanDerWaalsContact O-CG 3.26Å; R689-M693 WeakPolarHBondContact O-CG 3.44Å; R689-M693 PolarHBondContact O-N 3.35Å
690	F	95.8	Very high	93.7	Very high	32 Å²	32	76.2 Å²	76.2	14%	0.14	38%	0.38	C	S	.	.	H	α-helix	trans	-65.7	-36.7	177.2	-82.5	-59.6	0	0	0	112.8	L670 H674 L686 A687 K688 M693 A694	L670-F690 HydrophobicContact CB-CD1 4.33Å; L670-F690 HydrophobicContact CB-CD2 4.28Å; L670-F690 HydrophobicContact CB-CE2 4.44Å; L670-F690 HydrophobicContact CB-CG 4.22Å; L670-F690 HydrophobicContact CD1-CD1 4.44Å; L670-F690 HydrophobicContact CD1-CE1 4.05Å; L670-F690 HydrophobicContact CD1-CZ 4.33Å; H674-F690 AromaticContact CD2-CD2 3.65Å; H674-F690 AromaticContact CD2-CE2 3.53Å; H674-F690 AromaticContact NE2-CE2 3.52Å; L686-F690 HydrophobicContact CD1-CD2 4.1Å; L686-F690 HydrophobicContact CD1-CE2 3.73Å; L686-F690 HydrophobicContact CD1-CZ 4.42Å; L686-F690 HydrophobicContact CD2-CE2 4.14Å; L686-F690 HydrophobicContact CG-CD2 3.91Å; L686-F690 HydrophobicContact CG-CE2 3.62Å; L686-F690 VanDerWaalsContact O-CD2 3.29Å; L686-F690 WeakPolarHBondContact O-CD2 3.46Å; L686-F690 PolarHBondContact O-N 2.78Å; A687-F690 PolarHBondContact O-N 3.01Å; K688-F690 VanDerWaalsContact C-N 3.32Å; K688-F690 PolarHBondContact O-N 3.44Å; F690-M693 HydrophobicContact CD1-SD 4.34Å; F690-M693 PolarHBondContact O-N 3.25Å; F690-A694 WeakPolarHBondContact O-CB 3.46Å; F690-A694 PolarHBondContact O-N 2.98Å
691	Y	96.6	Very high	93.7	Very high	2 Å²	2	74.7 Å²	74.7	1%	0.008	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-47.1	171.6	-70.3	-40.8	0	0	0	112.1	F668 Y672 E675 A687 K688 R689 M693 A694 A695 V705 A708 L709	F668-Y691 AromaticContact CD2-CD1 3.77Å; F668-Y691 HydrophobicContact CD2-CD1 3.77Å; F668-Y691 AromaticContact CD2-CE1 3.81Å; F668-Y691 HydrophobicContact CD2-CE1 3.81Å; F668-Y691 AromaticContact CE2-CD1 4Å; F668-Y691 HydrophobicContact CE2-CD1 4Å; F668-Y691 AromaticContact CE2-CE1 3.8Å; F668-Y691 HydrophobicContact CE2-CE1 3.8Å; F668-Y691 HydrophobicContact CG-CD1 4.41Å; F668-Y691 HydrophobicContact CG-CE1 4.2Å; F668-Y691 HydrophobicContact CZ-CE1 4.18Å; F668-Y691 WeakPolarHBondContact O-CE1 3.36Å; Y672-Y691 VanDerWaalsContact CA-OH 3.24Å; Y672-Y691 WeakPolarHBondContact CA-OH 3.28Å; Y672-Y691 PolarHBondContact N-OH 3.34Å; E675-Y691 PolarHBondContact OE2-OH 3.45Å; A687-Y691 VanDerWaalsContact O-CD2 3.23Å; A687-Y691 WeakPolarHBondContact O-CD2 2.96Å; A687-Y691 PolarHBondContact O-N 3.37Å; K688-Y691 WeakPolarHBondContact O-CB 3.27Å; K688-Y691 PolarHBondContact O-N 3.34Å; R689-Y691 VanDerWaalsContact C-N 3.34Å; Y691-M693 VanDerWaalsContact C-N 3.35Å; Y691-M693 PolarHBondContact O-N 2.86Å; Y691-A694 WeakPolarHBondContact O-CB 3.38Å; Y691-A694 PolarHBondContact O-N 2.9Å; Y691-A695 PolarHBondContact O-N 2.87Å; Y691-A695 VanDerWaalsContact O-N 3.11Å; Y691-V705 VanDerWaalsContact O-CG1 3.22Å; Y691-V705 WeakPolarHBondContact O-CG1 3.41Å; Y691-V705 WeakPolarHBondContact O-CG2 3.46Å; Y691-A708 HydrophobicContact CD1-CB 4.43Å; Y691-A708 HydrophobicContact CE1-CB 4.18Å; Y691-A708 HydrophobicContact CE2-CB 4.29Å; Y691-L709 HydrophobicContact CD2-CD2 4.04Å; Y691-L709 HydrophobicContact CG-CD2 4.44Å
692	D	95.8	Very high	93.8	Very high	51 Å²	51	70.9 Å²	70.9	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-59.2	-46.2	176.5	-66.4	-22.7	0	0	0	110.6	K688 R689 A694 A695 E696	K688-D692 IonicContact NZ-OD1 2.67Å; K688-D692 IonicContact NZ-OD2 3.5Å; K688-D692 PolarHBondContact NZ-OD2 2.83Å; K688-D692 VanDerWaalsContact O-CG 3.3Å; K688-D692 PolarHBondContact O-N 2.88Å; R689-D692 PolarHBondContact O-N 3.47Å; D692-A694 VanDerWaalsContact C-N 3.34Å; D692-A694 PolarHBondContact O-N 3.27Å; D692-A695 PolarHBondContact O-N 3.18Å; D692-E696 PolarHBondContact O-N 3.2Å; D692-E696 VanDerWaalsContact O-N 3.1Å
693	M	94.9	Very high	93.8	Very high	61 Å²	61	70.2 Å²	70.2	30%	0.3	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-39.9	175.1	-72.6	174.4	60.3	0	0	112.9	M667 R689 F690 Y691 A695 E696 A697	M667-M693 HydrophobicContact CE-CE 4.41Å; M667-M693 HydrophobicContact SD-CB 3.85Å; M667-M693 HydrophobicContact SD-CE 4.3Å; R689-M693 HydrophobicContact CG-CG 4.49Å; R689-M693 HydrophobicContact CG-SD 4.11Å; R689-M693 WeakPolarHBondContact O-CB 3.44Å; R689-M693 VanDerWaalsContact O-CG 3.26Å; R689-M693 WeakPolarHBondContact O-CG 3.44Å; R689-M693 PolarHBondContact O-N 3.35Å; F690-M693 HydrophobicContact CD1-SD 4.34Å; F690-M693 PolarHBondContact O-N 3.25Å; Y691-M693 VanDerWaalsContact C-N 3.35Å; Y691-M693 PolarHBondContact O-N 2.86Å; M693-A695 VanDerWaalsContact C-N 3.34Å; M693-A695 PolarHBondContact O-N 2.97Å; M693-E696 PolarHBondContact O-N 3.5Å; M693-A697 WeakPolarHBondContact O-CB 3.35Å; M693-A697 PolarHBondContact O-N 2.91Å
694	A	95.9	Very high	93.8	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-40.1	178.1	0	0	0	0	0	111.9	A664 M667 F668 F690 Y691 D692 A697 S698 A701 V705	A664-A694 WeakPolarHBondContact O-CB 3.47Å; M667-A694 HydrophobicContact CB-CB 3.8Å; F668-A694 HydrophobicContact CB-CB 4.32Å; F690-A694 WeakPolarHBondContact O-CB 3.46Å; F690-A694 PolarHBondContact O-N 2.98Å; Y691-A694 WeakPolarHBondContact O-CB 3.38Å; Y691-A694 PolarHBondContact O-N 2.9Å; D692-A694 VanDerWaalsContact C-N 3.34Å; D692-A694 PolarHBondContact O-N 3.27Å; A694-A697 PolarHBondContact O-N 3.05Å; A694-S698 PolarHBondContact O-N 2.86Å; A694-A701 WeakPolarHBondContact O-CB 3.38Å; A694-V705 HydrophobicContact CB-CG2 3.99Å
695	A	95.6	Very high	94.1	Very high	22 Å²	22	67.1 Å²	67.1	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-29.4	177.3	0	0	0	0	0	113.5	Y691 D692 M693 Q702 V705	Y691-A695 PolarHBondContact O-N 2.87Å; Y691-A695 VanDerWaalsContact O-N 3.11Å; D692-A695 PolarHBondContact O-N 3.18Å; M693-A695 VanDerWaalsContact C-N 3.34Å; M693-A695 PolarHBondContact O-N 2.97Å; A695-Q702 HydrophobicContact CB-CG 4.31Å; A695-V705 HydrophobicContact CB-CB 4.03Å; A695-V705 HydrophobicContact CB-CG1 3.81Å; A695-V705 HydrophobicContact CB-CG2 4.07Å
696	E	93.6	Very high	94.3	Very high	168 Å²	168	66 Å²	66	79%	0.785	34%	0.343	S	S	*	.	H	α-helix	trans	-73.1	-34.5	171.6	-70.9	177.2	-178.7	0	0	112	D692 M693	D692-E696 PolarHBondContact O-N 3.2Å; D692-E696 VanDerWaalsContact O-N 3.1Å; M693-E696 PolarHBondContact O-N 3.5Å
697	A	92.1	Very high	94.4	Very high	51 Å²	51	68.7 Å²	68.7	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-72.4	-35.1	-176.7	0	0	0	0	0	113.7	A664 M667 M693 A694	A664-A697 HydrophobicContact CB-CB 3.99Å; M667-A697 HydrophobicContact CE-CB 4.42Å; M667-A697 HydrophobicContact SD-CB 4.11Å; M693-A697 WeakPolarHBondContact O-CB 3.35Å; M693-A697 PolarHBondContact O-N 2.91Å; A694-A697 PolarHBondContact O-N 3.05Å
698	S	90.9	Very high	94.4	Very high	29 Å²	29	69.2 Å²	69.2	20%	0.203	36%	0.362	C	S	.	.			trans	-143.7	137.9	178.7	176.5	0	0	0	0	112.6	A694 D700 A701	A694-S698 PolarHBondContact O-N 2.86Å; S698-D700 PolarHBondContact O-N 2.82Å; S698-D700 PolarHBondContact OG-N 3.34Å; S698-A701 PolarHBondContact O-N 3.22Å
699	P	91.6	Very high	94.3	Very high	95 Å²	95	66.6 Å²	66.6	62%	0.617	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-61.4	-33	173.8	27.2	-34.9	0	0	0	112.2	A701 Q702	P699-A701 PolarHBondContact O-N 3.1Å; P699-Q702 WeakPolarHBondContact O-CB 3.42Å; P699-Q702 WeakPolarHBondContact O-CG 3.39Å; P699-Q702 PolarHBondContact O-N 3.05Å
700	D	88.8	Confident	94.3	Very high	131 Å²	131	61.4 Å²	61.4	70%	0.701	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-67.3	-24.8	-178.7	-58.3	-29.4	0	0	0	111.9	S698 P704	S698-D700 PolarHBondContact O-N 2.82Å; S698-D700 PolarHBondContact OG-N 3.34Å; D700-P704 WeakPolarHBondContact O-CD 3.23Å
701	A	93.1	Very high	94.2	Very high	13 Å²	13	63.7 Å²	63.7	11%	0.107	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-79.9	-14.8	178.8	0	0	0	0	0	113.4	A664 A694 S698 P699 V703 P704 V705	A664-A701 HydrophobicContact CB-CB 4.05Å; A694-A701 WeakPolarHBondContact O-CB 3.38Å; S698-A701 PolarHBondContact O-N 3.22Å; P699-A701 PolarHBondContact O-N 3.1Å; A701-V703 PolarHBondContact O-N 2.92Å; A701-P704 WeakPolarHBondContact O-CD 3.46Å; A701-V705 HydrophobicContact CB-CG2 4.46Å; A701-V705 VanDerWaalsContact O-CB 3.27Å; A701-V705 WeakPolarHBondContact O-CB 3.44Å; A701-V705 WeakPolarHBondContact O-CG2 3.49Å; A701-V705 PolarHBondContact O-N 3.36Å
702	Q	94.4	Very high	93.9	Very high	114 Å²	114	64.6 Å²	64.6	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-44.5	-173.8	-68.5	-178	-1.4	0	0	113.1	A695 P699 F706	A695-Q702 HydrophobicContact CB-CG 4.31Å; P699-Q702 WeakPolarHBondContact O-CB 3.42Å; P699-Q702 WeakPolarHBondContact O-CG 3.39Å; P699-Q702 PolarHBondContact O-N 3.05Å; Q702-F706 VanDerWaalsContact O-CB 3.31Å; Q702-F706 WeakPolarHBondContact O-CB 3.26Å; Q702-F706 PolarHBondContact O-N 3.25Å
703	V	95	Very high	93.7	Very high	101 Å²	101	64.2 Å²	64.2	61%	0.612	36%	0.364	S	S	*	.	H	α-helix	trans	-69.2	-49.9	-179	175.9	0	0	0	0	111.6	A701 V705 F706 L707	A701-V703 PolarHBondContact O-N 2.92Å; V703-V705 PolarHBondContact O-N 3.33Å; V703-F706 PolarHBondContact O-N 3.5Å; V703-L707 HydrophobicContact CG1-CD1 4.5Å; V703-L707 WeakPolarHBondContact O-CG 3.18Å; V703-L707 PolarHBondContact O-N 3.25Å; V703-L707 VanDerWaalsContact O-N 3.12Å
704	P	94.9	Very high	93.5	Very high	60 Å²	60	65.3 Å²	65.3	39%	0.39	37%	0.374	S	S	.	.	H	α-helix	trans	-56.5	-44.2	173.8	-26.6	33.7	0	0	0	113.8	F668 D700 A701 L707 A708	F668-P704 HydrophobicContact CE2-CB 4.18Å; D700-P704 WeakPolarHBondContact O-CD 3.23Å; A701-P704 WeakPolarHBondContact O-CD 3.46Å; P704-L707 PolarHBondContact O-N 2.99Å; P704-A708 WeakPolarHBondContact O-CB 3.49Å; P704-A708 PolarHBondContact O-N 3.49Å
705	V	96.3	Very high	93.1	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.024	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-47.2	177.5	166.6	0	0	0	0	110.5	F668 Y691 A694 A695 A701 V703 L707 A708 L709	F668-V705 HydrophobicContact CD2-CG2 3.94Å; F668-V705 HydrophobicContact CE2-CG2 4.35Å; Y691-V705 VanDerWaalsContact O-CG1 3.22Å; Y691-V705 WeakPolarHBondContact O-CG1 3.41Å; Y691-V705 WeakPolarHBondContact O-CG2 3.46Å; A694-V705 HydrophobicContact CB-CG2 3.99Å; A695-V705 HydrophobicContact CB-CB 4.03Å; A695-V705 HydrophobicContact CB-CG1 3.81Å; A695-V705 HydrophobicContact CB-CG2 4.07Å; A701-V705 HydrophobicContact CB-CG2 4.46Å; A701-V705 VanDerWaalsContact O-CB 3.27Å; A701-V705 WeakPolarHBondContact O-CB 3.44Å; A701-V705 WeakPolarHBondContact O-CG2 3.49Å; A701-V705 PolarHBondContact O-N 3.36Å; V703-V705 PolarHBondContact O-N 3.33Å; V705-L707 VanDerWaalsContact C-N 3.28Å; V705-L707 PolarHBondContact O-N 3.38Å; V705-A708 WeakPolarHBondContact O-CB 3.4Å; V705-A708 PolarHBondContact O-N 3.49Å; V705-A708 VanDerWaalsContact O-N 3.09Å; V705-L709 HydrophobicContact CG1-CD1 3.85Å; V705-L709 HydrophobicContact CG1-CG 4.18Å; V705-L709 WeakPolarHBondContact O-CG 3.32Å; V705-L709 PolarHBondContact O-N 2.94Å
706	F	95.6	Very high	92.7	Very high	136 Å²	136	74.6 Å²	74.6	60%	0.596	41%	0.412	S	S	*	.	H	α-helix	trans	-56.3	-45.3	178.9	176.6	-100.5	0	0	0	111.5	Q702 V703 A708 L709 C710	Q702-F706 VanDerWaalsContact O-CB 3.31Å; Q702-F706 WeakPolarHBondContact O-CB 3.26Å; Q702-F706 PolarHBondContact O-N 3.25Å; V703-F706 PolarHBondContact O-N 3.5Å; F706-A708 PolarHBondContact O-N 2.93Å; F706-L709 PolarHBondContact O-N 3.05Å; F706-C710 VanDerWaalsContact CZ-SG 3.56Å; F706-C710 WeakPolarHBondContact O-CB 3.48Å; F706-C710 PolarHBondContact O-N 2.85Å; F706-C710 PolarHBondContact O-SG 2.99Å
707	L	96	Very high	92.4	Very high	109 Å²	109	72.5 Å²	72.5	57%	0.571	40%	0.401	S	S	*	.	H	α-helix	trans	-63.7	-41	176.1	-66.5	175.6	0	0	0	112.3	V703 P704 V705 C710 K711	V703-L707 HydrophobicContact CG1-CD1 4.5Å; V703-L707 WeakPolarHBondContact O-CG 3.18Å; V703-L707 PolarHBondContact O-N 3.25Å; V703-L707 VanDerWaalsContact O-N 3.12Å; P704-L707 PolarHBondContact O-N 2.99Å; V705-L707 VanDerWaalsContact C-N 3.28Å; V705-L707 PolarHBondContact O-N 3.38Å; L707-C710 PolarHBondContact O-N 3.24Å; L707-K711 WeakPolarHBondContact O-CB 3.33Å; L707-K711 PolarHBondContact O-N 3.12Å
708	A	94.6	Very high	92.1	Very high	10 Å²	10	75 Å²	75	8%	0.083	41%	0.407	C	S	.	.	H	α-helix	trans	-63	-42.7	176.4	0	0	0	0	0	111.9	F668 Y691 P704 V705 F706 K711 L712	F668-A708 HydrophobicContact CE2-CB 3.92Å; F668-A708 HydrophobicContact CZ-CB 4.15Å; Y691-A708 HydrophobicContact CD1-CB 4.43Å; Y691-A708 HydrophobicContact CE1-CB 4.18Å; Y691-A708 HydrophobicContact CE2-CB 4.29Å; P704-A708 WeakPolarHBondContact O-CB 3.49Å; P704-A708 PolarHBondContact O-N 3.49Å; V705-A708 WeakPolarHBondContact O-CB 3.4Å; V705-A708 PolarHBondContact O-N 3.49Å; V705-A708 VanDerWaalsContact O-N 3.09Å; F706-A708 PolarHBondContact O-N 2.93Å; A708-K711 WeakPolarHBondContact O-CB 3.28Å; A708-K711 PolarHBondContact O-N 3.06Å; A708-L712 WeakPolarHBondContact O-CB 3.22Å; A708-L712 PolarHBondContact O-N 2.94Å
709	L	94.1	Very high	91.9	Very high	45 Å²	45	78 Å²	78	24%	0.236	42%	0.417	C	S	.	.	H	α-helix	trans	-67.2	-40.2	175.8	-68.4	178.2	0	0	0	112.2	K688 Y691 V705 F706 L712 G713	K688-L709 HydrophobicContact CB-CD2 4.47Å; K688-L709 HydrophobicContact CG-CD2 3.88Å; Y691-L709 HydrophobicContact CD2-CD2 4.04Å; Y691-L709 HydrophobicContact CG-CD2 4.44Å; V705-L709 HydrophobicContact CG1-CD1 3.85Å; V705-L709 HydrophobicContact CG1-CG 4.18Å; V705-L709 WeakPolarHBondContact O-CG 3.32Å; V705-L709 PolarHBondContact O-N 2.94Å; F706-L709 PolarHBondContact O-N 3.05Å; L709-L712 WeakPolarHBondContact O-CB 3.14Å; L709-L712 PolarHBondContact O-N 3.37Å; L709-G713 PolarHBondContact O-N 3.41Å
710	C	94.8	Very high	91.5	Very high	56 Å²	56	79.8 Å²	79.8	38%	0.378	41%	0.413	S	S	.	.	H	α-helix	trans	-60.6	-47.1	172.9	-74.6	0	0	0	0	111.4	F706 L707 L712 G713 V714	F706-C710 VanDerWaalsContact CZ-SG 3.56Å; F706-C710 WeakPolarHBondContact O-CB 3.48Å; F706-C710 PolarHBondContact O-N 2.85Å; F706-C710 PolarHBondContact O-SG 2.99Å; L707-C710 PolarHBondContact O-N 3.24Å; C710-L712 VanDerWaalsContact C-N 3.32Å; C710-L712 PolarHBondContact O-N 3.35Å; C710-G713 PolarHBondContact O-N 3.31Å; C710-V714 WeakPolarHBondContact O-CG2 3.39Å; C710-V714 PolarHBondContact O-N 3.26Å
711	K	94.1	Very high	91.3	Very high	80 Å²	80	76.3 Å²	76.3	35%	0.348	39%	0.394	S	S	.	.	H	α-helix	trans	-56.7	-47	174	171.4	-156.4	161.9	-151.4	0	110.7	E675 L707 A708 G713 V714 V715	E675-K711 WeakPolarHBondContact OE1-CE 3.26Å; E675-K711 IonicContact OE1-NZ 2.73Å; E675-K711 PolarHBondContact OE1-NZ 3.06Å; E675-K711 IonicContact OE2-NZ 2.76Å; E675-K711 PolarHBondContact OE2-NZ 3.18Å; L707-K711 WeakPolarHBondContact O-CB 3.33Å; L707-K711 PolarHBondContact O-N 3.12Å; A708-K711 WeakPolarHBondContact O-CB 3.28Å; A708-K711 PolarHBondContact O-N 3.06Å; K711-G713 VanDerWaalsContact C-N 3.31Å; K711-G713 PolarHBondContact O-N 3.49Å; K711-V714 PolarHBondContact O-N 3.29Å; K711-V715 WeakPolarHBondContact O-CG2 3.41Å; K711-V715 PolarHBondContact O-N 3.41Å
712	L	90	Very high	90.7	Very high	20 Å²	20	86.3 Å²	86.3	11%	0.105	43%	0.429	C	S	.	.	H	α-helix	trans	-59.4	-43.5	178.8	-170.2	64.8	0	0	0	111.5	E675 I684 K688 A708 L709 C710 V715 Y716	E675-L712 HydrophobicContact CG-CD1 3.95Å; I684-L712 HydrophobicContact CG2-CD1 3.95Å; I684-L712 HydrophobicContact CG2-CD2 3.95Å; I684-L712 HydrophobicContact CG2-CG 4.23Å; K688-L712 HydrophobicContact CB-CD2 4.49Å; A708-L712 WeakPolarHBondContact O-CB 3.22Å; A708-L712 PolarHBondContact O-N 2.94Å; L709-L712 WeakPolarHBondContact O-CB 3.14Å; L709-L712 PolarHBondContact O-N 3.37Å; C710-L712 VanDerWaalsContact C-N 3.32Å; C710-L712 PolarHBondContact O-N 3.35Å; L712-V715 PolarHBondContact O-N 2.95Å; L712-Y716 WeakPolarHBondContact O-CB 3.34Å; L712-Y716 PolarHBondContact O-N 3.4Å
713	G	90.6	Very high	90	Very high	43 Å²	43	87.5 Å²	87.5	44%	0.443	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-41.9	174.7	0	0	0	0	0	113.1	L709 C710 K711 Y716 F717	L709-G713 PolarHBondContact O-N 3.41Å; C710-G713 PolarHBondContact O-N 3.31Å; K711-G713 VanDerWaalsContact C-N 3.31Å; K711-G713 PolarHBondContact O-N 3.49Å; G713-Y716 PolarHBondContact O-N 3.4Å; G713-F717 VanDerWaalsContact O-CB 3.29Å; G713-F717 WeakPolarHBondContact O-CB 3.45Å; G713-F717 PolarHBondContact O-N 3.31Å
714	V	92.5	Very high	88.9	Confident	85 Å²	85	85 Å²	85	52%	0.515	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-44.6	175.8	172.2	0	0	0	0	111.4	C710 K711 Y716 F717 L718	C710-V714 WeakPolarHBondContact O-CG2 3.39Å; C710-V714 PolarHBondContact O-N 3.26Å; K711-V714 PolarHBondContact O-N 3.29Å; V714-Y716 VanDerWaalsContact C-N 3.33Å; V714-Y716 PolarHBondContact O-N 3.37Å; V714-F717 PolarHBondContact O-N 2.94Å; V714-L718 HydrophobicContact CG1-CD1 4.07Å; V714-L718 HydrophobicContact CG1-CG 4.41Å; V714-L718 WeakPolarHBondContact O-CG 3.48Å; V714-L718 PolarHBondContact O-N 3.29Å
715	V	87.3	Confident	87.4	Confident	68 Å²	68	87.8 Å²	87.8	41%	0.412	43%	0.431	S	S	.	.	H	α-helix	trans	-61.4	-45	177.8	172.3	0	0	0	0	110.4	K711 L712 F717 L718 Q719	K711-V715 WeakPolarHBondContact O-CG2 3.41Å; K711-V715 PolarHBondContact O-N 3.41Å; L712-V715 PolarHBondContact O-N 2.95Å; V715-F717 PolarHBondContact O-N 3.3Å; V715-L718 PolarHBondContact O-N 2.93Å; V715-Q719 WeakPolarHBondContact O-CB 3.1Å; V715-Q719 PolarHBondContact O-N 2.85Å
716	Y	85.9	Confident	85.7	Confident	148 Å²	148	91.8 Å²	91.8	58%	0.58	45%	0.451	S	S	*	.	H	α-helix	trans	-62.5	-42.7	176.8	-170.8	-99.3	0	0	0	111.8	L712 G713 V714 L718 Q719 Y720	L712-Y716 WeakPolarHBondContact O-CB 3.34Å; L712-Y716 PolarHBondContact O-N 3.4Å; G713-Y716 PolarHBondContact O-N 3.4Å; V714-Y716 VanDerWaalsContact C-N 3.33Å; V714-Y716 PolarHBondContact O-N 3.37Å; Y716-L718 PolarHBondContact O-N 2.89Å; Y716-Q719 PolarHBondContact O-N 3.24Å; Y716-Y720 WeakPolarHBondContact O-CB 3.41Å; Y716-Y720 PolarHBondContact O-N 3.43Å
717	F	87.1	Confident	83.9	Confident	124 Å²	124	95.2 Å²	95.2	54%	0.544	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-42.5	175.6	179.5	-106.4	0	0	0	112.6	G713 V714 V715 Y720 I721	G713-F717 VanDerWaalsContact O-CB 3.29Å; G713-F717 WeakPolarHBondContact O-CB 3.45Å; G713-F717 PolarHBondContact O-N 3.31Å; V714-F717 PolarHBondContact O-N 2.94Å; V715-F717 PolarHBondContact O-N 3.3Å; F717-Y720 PolarHBondContact O-N 3.16Å; F717-I721 HydrophobicContact CD1-CD1 3.84Å; F717-I721 HydrophobicContact CE1-CD1 3.29Å; F717-I721 HydrophobicContact CE1-CG1 4.41Å; F717-I721 HydrophobicContact CE2-CD1 4.13Å; F717-I721 HydrophobicContact CG-CD1 4.47Å; F717-I721 HydrophobicContact CZ-CD1 3.47Å; F717-I721 VanDerWaalsContact CZ-CD1 3.47Å; F717-I721 HydrophobicContact CZ-CG1 4.34Å; F717-I721 WeakPolarHBondContact O-CG1 3.2Å; F717-I721 PolarHBondContact O-N 2.86Å
718	L	87.4	Confident	82.2	Confident	104 Å²	104	94.7 Å²	94.7	55%	0.545	46%	0.458	S	S	.	.	H	α-helix	trans	-66.6	-39.6	175.8	-72.1	173.7	0	0	0	112.2	V714 V715 Y716 I721 R722	V714-L718 HydrophobicContact CG1-CD1 4.07Å; V714-L718 HydrophobicContact CG1-CG 4.41Å; V714-L718 WeakPolarHBondContact O-CG 3.48Å; V714-L718 PolarHBondContact O-N 3.29Å; V715-L718 PolarHBondContact O-N 2.93Å; Y716-L718 PolarHBondContact O-N 2.89Å; L718-I721 PolarHBondContact O-N 3.45Å; L718-R722 WeakPolarHBondContact O-CB 3.42Å; L718-R722 PolarHBondContact O-N 3.41Å
719	Q	85	Confident	80.4	Confident	91 Å²	91	99.4 Å²	99.4	43%	0.425	48%	0.48	S	S	.	.	H	α-helix	trans	-64.8	-42.6	175.6	-174.1	171	-7.7	0	0	110.9	V715 Y716 I721 R722 E723	V715-Q719 WeakPolarHBondContact O-CB 3.1Å; V715-Q719 PolarHBondContact O-N 2.85Å; Y716-Q719 PolarHBondContact O-N 3.24Å; Q719-I721 PolarHBondContact O-N 2.96Å; Q719-R722 PolarHBondContact O-N 3.29Å; Q719-R722 VanDerWaalsContact O-N 3.12Å; Q719-E723 HydrophobicContact CG-CG 4.49Å; Q719-E723 WeakPolarHBondContact CG-OE1 3.31Å; Q719-E723 PolarHBondContact NE2-OE1 2.96Å; Q719-E723 WeakPolarHBondContact O-CG 3.49Å; Q719-E723 PolarHBondContact O-N 3.34Å
720	Y	84.1	Confident	78.7	Confident	134 Å²	134	104 Å²	104	53%	0.525	50%	0.498	S	S	.	.	H	α-helix	trans	-58.9	-45.2	173.7	-179.5	-98	0	0	0	112.2	Y716 F717 R722 E723 T724	Y716-Y720 WeakPolarHBondContact O-CB 3.41Å; Y716-Y720 PolarHBondContact O-N 3.43Å; F717-Y720 PolarHBondContact O-N 3.16Å; Y720-R722 VanDerWaalsContact C-N 3.29Å; Y720-R722 PolarHBondContact O-N 2.87Å; Y720-E723 PolarHBondContact O-N 2.92Å; Y720-T724 HydrophobicContact CD1-CG2 4.47Å; Y720-T724 HydrophobicContact CE1-CG2 4.02Å; Y720-T724 HydrophobicContact CE2-CG2 4.09Å; Y720-T724 WeakPolarHBondContact O-CB 3.45Å; Y720-T724 PolarHBondContact O-N 3.32Å; Y720-T724 PolarHBondContact O-OG1 2.89Å
721	I	83.9	Confident	76.9	Confident	58 Å²	58	106.5 Å²	106.5	30%	0.297	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-34.7	175.1	-73	173.5	0	0	0	112.1	F717 L718 Q719 T724 I726	F717-I721 HydrophobicContact CD1-CD1 3.84Å; F717-I721 HydrophobicContact CE1-CD1 3.29Å; F717-I721 HydrophobicContact CE1-CG1 4.41Å; F717-I721 HydrophobicContact CE2-CD1 4.13Å; F717-I721 HydrophobicContact CG-CD1 4.47Å; F717-I721 HydrophobicContact CZ-CD1 3.47Å; F717-I721 VanDerWaalsContact CZ-CD1 3.47Å; F717-I721 HydrophobicContact CZ-CG1 4.34Å; F717-I721 WeakPolarHBondContact O-CG1 3.2Å; F717-I721 PolarHBondContact O-N 2.86Å; L718-I721 PolarHBondContact O-N 3.45Å; Q719-I721 PolarHBondContact O-N 2.96Å; I721-T724 WeakPolarHBondContact CA-OG1 3.39Å; I721-T724 PolarHBondContact O-OG1 2.85Å; I721-I726 HydrophobicContact CG2-CD1 3.79Å; I721-I726 HydrophobicContact CG2-CG1 4.23Å
722	R	81	Confident	75.2	Confident	223 Å²	223	110.9 Å²	110.9	84%	0.842	53%	0.533	S	S	*	.	H	α-helix	trans	-72.7	-38.5	178.5	178.1	-179.7	-105.8	174.4	-5	112	L718 Q719 Y720	L718-R722 WeakPolarHBondContact O-CB 3.42Å; L718-R722 PolarHBondContact O-N 3.41Å; Q719-R722 PolarHBondContact O-N 3.29Å; Q719-R722 VanDerWaalsContact O-N 3.12Å; Y720-R722 VanDerWaalsContact C-N 3.29Å; Y720-R722 PolarHBondContact O-N 2.87Å
723	E	79.6	Confident	73.6	Confident	139 Å²	139	113.8 Å²	113.8	65%	0.65	55%	0.549	S	S	*	.	H	α-helix	trans	-76.8	-29.5	179.4	-72.4	175.3	-168	0	0	111.8	Q719 Y720	Q719-E723 HydrophobicContact CG-CG 4.49Å; Q719-E723 WeakPolarHBondContact CG-OE1 3.31Å; Q719-E723 PolarHBondContact NE2-OE1 2.96Å; Q719-E723 WeakPolarHBondContact O-CG 3.49Å; Q719-E723 PolarHBondContact O-N 3.34Å; Y720-E723 PolarHBondContact O-N 2.92Å
724	T	72.1	Confident	72.1	Confident	47 Å²	47	116.6 Å²	116.6	29%	0.288	55%	0.553	S	S	.	*	S	Bend	trans	-79.4	119.1	170.3	47.5	0	0	0	0	110.3	Y720 I721 I726	Y720-T724 HydrophobicContact CD1-CG2 4.47Å; Y720-T724 HydrophobicContact CE1-CG2 4.02Å; Y720-T724 HydrophobicContact CE2-CG2 4.09Å; Y720-T724 WeakPolarHBondContact O-CB 3.45Å; Y720-T724 PolarHBondContact O-N 3.32Å; Y720-T724 PolarHBondContact O-OG1 2.89Å; I721-T724 WeakPolarHBondContact CA-OG1 3.39Å; I721-T724 PolarHBondContact O-OG1 2.85Å; T724-I726 PolarHBondContact O-N 3.39Å
725	N	63.3	Low	70.6	Confident	119 Å²	119	115.8 Å²	115.8	64%	0.636	55%	0.545	S	S	*	.			trans	-64	100.8	173.7	-119.6	-17.6	0	0	0	108.3	R727 D728	N725-R727 PolarHBondContact O-N 3Å; N725-D728 PolarHBondContact O-N 3.24Å
726	I	61.5	Low	69.4	Low	89 Å²	89	117.4 Å²	117.4	46%	0.456	55%	0.551	S	S	.	*	H	α-helix	trans	-54.5	-24.2	-177	-56.7	170.2	0	0	0	111.6	I721 T724 F730	I721-I726 HydrophobicContact CG2-CD1 3.79Å; I721-I726 HydrophobicContact CG2-CG1 4.23Å; T724-I726 PolarHBondContact O-N 3.39Å; I726-F730 HydrophobicContact CG2-CD2 3.73Å; I726-F730 HydrophobicContact CG2-CE2 4Å; I726-F730 PolarHBondContact O-N 2.89Å; I726-F730 VanDerWaalsContact O-N 3.1Å
727	R	57.4	Low	68.4	Low	208 Å²	208	118.7 Å²	118.7	79%	0.785	56%	0.562	S	S	*	*	H	α-helix	trans	-63.2	-37.9	171.9	-92.3	-178.1	172.8	169.5	-1.8	114.1	N725 T731	N725-R727 PolarHBondContact O-N 3Å; R727-T731 WeakPolarHBondContact O-CB 3.4Å; R727-T731 WeakPolarHBondContact O-CG2 3.5Å; R727-T731 PolarHBondContact O-N 3.33Å; R727-T731 PolarHBondContact O-OG1 3.39Å
728	D	59.3	Low	67.3	Low	98 Å²	98	118.8 Å²	118.8	52%	0.524	57%	0.568	S	S	.	*	H	α-helix	trans	-75.1	-33.5	-179.9	-73.3	-18.8	0	0	0	111.2	N725 T731 Q732	N725-D728 PolarHBondContact O-N 3.24Å; D728-T731 WeakPolarHBondContact CA-OG1 3.39Å; D728-T731 PolarHBondContact O-OG1 3.29Å; D728-Q732 WeakPolarHBondContact O-CG 3.43Å; D728-Q732 PolarHBondContact O-N 3.16Å
729	M	57.4	Low	66.1	Low	109 Å²	109	117.6 Å²	117.6	54%	0.537	56%	0.562	S	S	.	*	H	α-helix	trans	-70	-40.9	175.9	-158.3	-176.6	75	0	0	111.9	L733	M729-L733 PolarHBondContact O-N 2.92Å
730	F	58	Low	65.4	Low	142 Å²	142	114.5 Å²	114.5	62%	0.623	55%	0.554	S	S	*	*	H	α-helix	trans	-76.2	-21.9	177	-92.6	-82.9	0	0	0	114.2	I726	I726-F730 HydrophobicContact CG2-CD2 3.73Å; I726-F730 HydrophobicContact CG2-CE2 4Å; I726-F730 PolarHBondContact O-N 2.89Å; I726-F730 VanDerWaalsContact O-N 3.1Å
731	T	57.8	Low	64.8	Low	108 Å²	108	113.2 Å²	113.2	66%	0.663	56%	0.562	S	S	*	*	H	α-helix	trans	-84.8	-17.4	175	49.9	0	0	0	0	113.1	R727 D728	R727-T731 WeakPolarHBondContact O-CB 3.4Å; R727-T731 WeakPolarHBondContact O-CG2 3.5Å; R727-T731 PolarHBondContact O-N 3.33Å; R727-T731 PolarHBondContact O-OG1 3.39Å; D728-T731 WeakPolarHBondContact CA-OG1 3.39Å; D728-T731 PolarHBondContact O-OG1 3.29Å
732	Q	57.2	Low	64.4	Low	172 Å²	172	115.6 Å²	115.6	80%	0.804	57%	0.572	S	S	*	*	H	α-helix	trans	-87.3	-14.2	171.6	-76.5	-176.4	-12.4	0	0	114.1	D728 D734	D728-Q732 WeakPolarHBondContact O-CG 3.43Å; D728-Q732 PolarHBondContact O-N 3.16Å; Q732-D734 PolarHBondContact O-N 3.33Å
733	L	57.6	Low	64.3	Low	81 Å²	81	108.7 Å²	108.7	42%	0.424	55%	0.546	S	S	.	.			trans	-91	83.1	174.5	-92.1	144	0	0	0	109.8	M729 M735 L738	M729-L733 PolarHBondContact O-N 2.92Å; L733-M735 PolarHBondContact O-N 3.44Å; L733-L738 HydrophobicContact CD2-CD2 4.46Å
734	D	59.5	Low	64	Low	101 Å²	101	106.7 Å²	106.7	54%	0.54	54%	0.539	S	S	.	.			trans	-73.9	92.1	170.5	-149.2	-1.6	0	0	0	108.6	Q732 D736 Q737 L738	Q732-D734 PolarHBondContact O-N 3.33Å; D734-D736 PolarHBondContact O-N 2.91Å; D734-D736 VanDerWaalsContact O-N 3.12Å; D734-Q737 HydrophobicContact CB-CB 4.39Å; D734-Q737 PolarHBondContact O-N 3.04Å; D734-L738 PolarHBondContact O-N 3.23Å
735	M	60.9	Low	64.2	Low	68 Å²	68	108.9 Å²	108.9	34%	0.335	55%	0.549	S	S	.	.	H	α-helix	trans	-58.5	-25.6	-175	-70.5	-63.2	-131.7	0	0	112.5	L733 Q737 L738 L739 W743	L733-M735 PolarHBondContact O-N 3.44Å; M735-Q737 VanDerWaalsContact C-N 3.28Å; M735-Q737 PolarHBondContact O-N 3.43Å; M735-L738 PolarHBondContact O-N 3.44Å; M735-L739 PolarHBondContact O-N 3.06Å; M735-L739 HydrophobicContact SD-CD1 4.06Å; M735-W743 HydrophobicContact CB-CE3 4.22Å; M735-W743 HydrophobicContact CE-CH2 3.71Å; M735-W743 HydrophobicContact CE-CZ2 4.09Å; M735-W743 HydrophobicContact CE-CZ3 4.08Å; M735-W743 HydrophobicContact CG-CZ3 4.38Å
736	D	61	Low	64.9	Low	103 Å²	103	110.1 Å²	110.1	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-65.2	-31.1	175.3	-70.1	-10.8	0	0	0	112.3	D734 G740	D734-D736 PolarHBondContact O-N 2.91Å; D734-D736 VanDerWaalsContact O-N 3.12Å; D736-G740 CarbonylContact O-C 3.59Å; D736-G740 VanDerWaalsContact O-CA 3.22Å; D736-G740 WeakPolarHBondContact O-CA 3.46Å; D736-G740 PolarHBondContact O-N 2.9Å
737	Q	65.4	Low	65.8	Low	175 Å²	175	109.1 Å²	109.1	82%	0.818	54%	0.541	S	S	*	.	H	α-helix	trans	-85.8	-28.6	180	-157.1	172.4	25.9	0	0	112.5	D734 M735	D734-Q737 HydrophobicContact CB-CB 4.39Å; D734-Q737 PolarHBondContact O-N 3.04Å; M735-Q737 VanDerWaalsContact C-N 3.28Å; M735-Q737 PolarHBondContact O-N 3.43Å
738	L	63.9	Low	66.9	Low	126 Å²	126	105.3 Å²	105.3	66%	0.66	53%	0.534	S	S	*	.	H	α-helix	trans	-86.3	-37.7	-177.3	-159.3	81.2	0	0	0	113	L733 D734 M735	L733-L738 HydrophobicContact CD2-CD2 4.46Å; D734-L738 PolarHBondContact O-N 3.23Å; M735-L738 PolarHBondContact O-N 3.44Å
739	L	62.7	Low	68.1	Low	79 Å²	79	104.1 Å²	104.1	41%	0.414	53%	0.53	S	S	.	.	H	α-helix	trans	-120.9	-1.9	-171	-71.7	149.6	0	0	0	113.2	M735 W743	M735-L739 PolarHBondContact O-N 3.06Å; M735-L739 HydrophobicContact SD-CD1 4.06Å; L739-W743 HydrophobicContact CB-CB 3.74Å; L739-W743 HydrophobicContact CB-CD2 4.43Å; L739-W743 HydrophobicContact CB-CG 3.53Å; L739-W743 VanDerWaalsContact CD1-CD1 3.47Å; L739-W743 HydrophobicContact CD1-CD2 3.9Å; L739-W743 HydrophobicContact CD1-CG 3.84Å; L739-W743 HydrophobicContact CD1-CZ2 4.21Å; L739-W743 HydrophobicContact CG-CG 4.17Å
740	G	70.7	Confident	69.3	Low	25 Å²	25	103.6 Å²	103.6	26%	0.258	53%	0.528	S	S	.	.			trans	85.4	164.2	-177.7	0	0	0	0	0	112.8	D736 E742 W743	D736-G740 CarbonylContact O-C 3.59Å; D736-G740 VanDerWaalsContact O-CA 3.22Å; D736-G740 WeakPolarHBondContact O-CA 3.46Å; D736-G740 PolarHBondContact O-N 2.9Å; G740-E742 PolarHBondContact O-N 3.03Å; G740-E742 VanDerWaalsContact O-N 3.08Å; G740-W743 PolarHBondContact O-N 2.93Å
741	P	71.6	Confident	70.6	Confident	107 Å²	107	100.4 Å²	100.4	70%	0.695	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-10.1	-171.6	26.7	-35.2	0	0	0	114.9
742	E	74.1	Confident	71.9	Confident	108 Å²	108	98.1 Å²	98.1	51%	0.505	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	24.5	-178.4	-58.1	-88	160.8	0	0	110.9	G740 D744 L745 Y746	G740-E742 PolarHBondContact O-N 3.03Å; G740-E742 VanDerWaalsContact O-N 3.08Å; E742-D744 WeakPolarHBondContact CA-OD1 3.39Å; E742-D744 PolarHBondContact O-N 2.78Å; E742-L745 HydrophobicContact CB-CB 4.46Å; E742-L745 WeakPolarHBondContact O-CB 3.42Å; E742-L745 PolarHBondContact O-N 3.25Å; E742-L745 WeakPolarHBondContact OE2-CD1 3.49Å; E742-Y746 VanDerWaalsContact O-CD2 3.26Å; E742-Y746 WeakPolarHBondContact O-CD2 3.32Å; E742-Y746 PolarHBondContact O-N 3.09Å
743	W	79.3	Confident	73.2	Confident	78 Å²	78	95.8 Å²	95.8	30%	0.295	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-31.7	-179.5	179.6	59.9	0	0	0	112.9	M735 L739 G740 L745 Y746 L747	M735-W743 HydrophobicContact CB-CE3 4.22Å; M735-W743 HydrophobicContact CE-CH2 3.71Å; M735-W743 HydrophobicContact CE-CZ2 4.09Å; M735-W743 HydrophobicContact CE-CZ3 4.08Å; M735-W743 HydrophobicContact CG-CZ3 4.38Å; L739-W743 HydrophobicContact CB-CB 3.74Å; L739-W743 HydrophobicContact CB-CD2 4.43Å; L739-W743 HydrophobicContact CB-CG 3.53Å; L739-W743 VanDerWaalsContact CD1-CD1 3.47Å; L739-W743 HydrophobicContact CD1-CD2 3.9Å; L739-W743 HydrophobicContact CD1-CG 3.84Å; L739-W743 HydrophobicContact CD1-CZ2 4.21Å; L739-W743 HydrophobicContact CG-CG 4.17Å; G740-W743 PolarHBondContact O-N 2.93Å; W743-L745 VanDerWaalsContact C-N 3.27Å; W743-L745 PolarHBondContact O-N 2.73Å; W743-Y746 PolarHBondContact O-N 2.63Å; W743-L747 HydrophobicContact CH2-CD2 3.96Å; W743-L747 HydrophobicContact CZ2-CD1 4.34Å; W743-L747 HydrophobicContact CZ2-CD2 4.25Å; W743-L747 HydrophobicContact CZ3-CD2 4.28Å; W743-L747 WeakPolarHBondContact O-CB 3.49Å; W743-L747 PolarHBondContact O-N 3.03Å
744	D	73.6	Confident	74.5	Confident	97 Å²	97	97 Å²	97	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-57.2	-38.3	172.7	63.7	-21.5	0	0	0	112.5	E742 L747 M748	E742-D744 WeakPolarHBondContact CA-OD1 3.39Å; E742-D744 PolarHBondContact O-N 2.78Å; D744-L747 PolarHBondContact O-N 2.82Å; D744-M748 WeakPolarHBondContact O-CB 3.25Å; D744-M748 WeakPolarHBondContact O-CG 3.4Å; D744-M748 PolarHBondContact O-N 3.17Å
745	L	75.8	Confident	75.7	Confident	94 Å²	94	96.9 Å²	96.9	49%	0.492	51%	0.507	S	S	.	.	H	α-helix	trans	-70.6	-39.8	178.2	-120	149.9	0	0	0	112.2	E742 W743 T749	E742-L745 HydrophobicContact CB-CB 4.46Å; E742-L745 WeakPolarHBondContact O-CB 3.42Å; E742-L745 PolarHBondContact O-N 3.25Å; E742-L745 WeakPolarHBondContact OE2-CD1 3.49Å; W743-L745 VanDerWaalsContact C-N 3.27Å; W743-L745 PolarHBondContact O-N 2.73Å; L745-T749 WeakPolarHBondContact O-CB 3.35Å; L745-T749 VanDerWaalsContact O-CG2 3.26Å; L745-T749 WeakPolarHBondContact O-CG2 3.49Å; L745-T749 PolarHBondContact O-N 2.92Å; L745-T749 PolarHBondContact O-OG1 3.14Å
746	Y	78.6	Confident	76.8	Confident	144 Å²	144	95.4 Å²	95.4	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-66.7	-39	172.9	-62.8	-67.8	0	0	0	112	E742 W743 T749 I750	E742-Y746 VanDerWaalsContact O-CD2 3.26Å; E742-Y746 WeakPolarHBondContact O-CD2 3.32Å; E742-Y746 PolarHBondContact O-N 3.09Å; W743-Y746 PolarHBondContact O-N 2.63Å; Y746-T749 WeakPolarHBondContact CA-OG1 3.3Å; Y746-T749 PolarHBondContact O-OG1 3.37Å; Y746-I750 WeakPolarHBondContact O-CD1 3.37Å; Y746-I750 VanDerWaalsContact O-CG1 3.26Å; Y746-I750 WeakPolarHBondContact O-CG1 3.49Å; Y746-I750 PolarHBondContact O-N 3.16Å; Y746-I750 VanDerWaalsContact O-N 3.09Å
747	L	80.8	Confident	77.8	Confident	68 Å²	68	94.1 Å²	94.1	36%	0.356	51%	0.505	S	S	.	.	H	α-helix	trans	-67.2	-45	177.7	-173.9	65.9	0	0	0	111.4	W743 D744 T749 I750 I751	W743-L747 HydrophobicContact CH2-CD2 3.96Å; W743-L747 HydrophobicContact CZ2-CD1 4.34Å; W743-L747 HydrophobicContact CZ2-CD2 4.25Å; W743-L747 HydrophobicContact CZ3-CD2 4.28Å; W743-L747 WeakPolarHBondContact O-CB 3.49Å; W743-L747 PolarHBondContact O-N 3.03Å; D744-L747 PolarHBondContact O-N 2.82Å; L747-T749 VanDerWaalsContact C-N 3.34Å; L747-T749 PolarHBondContact O-N 3.39Å; L747-I750 PolarHBondContact O-N 3.39Å; L747-I751 HydrophobicContact CD1-CD1 4.19Å; L747-I751 HydrophobicContact CG-CD1 3.87Å; L747-I751 WeakPolarHBondContact O-CB 3.32Å; L747-I751 VanDerWaalsContact O-CG1 3.27Å; L747-I751 WeakPolarHBondContact O-CG1 3.5Å; L747-I751 PolarHBondContact O-N 3.12Å
748	M	80.9	Confident	78.6	Confident	129 Å²	129	89.9 Å²	89.9	64%	0.635	49%	0.491	S	S	*	.	H	α-helix	trans	-64.1	-37.6	178.1	-72.6	-64.2	-75.3	0	0	112.4	D744 I751 A752	D744-M748 WeakPolarHBondContact O-CB 3.25Å; D744-M748 WeakPolarHBondContact O-CG 3.4Å; D744-M748 PolarHBondContact O-N 3.17Å; M748-I751 PolarHBondContact O-N 2.94Å; M748-A752 VanDerWaalsContact O-CB 3.25Å; M748-A752 WeakPolarHBondContact O-CB 3.18Å; M748-A752 PolarHBondContact O-N 2.89Å
749	T	83	Confident	79.5	Confident	72 Å²	72	88.3 Å²	88.3	44%	0.442	48%	0.482	S	S	.	.	H	α-helix	trans	-68.3	-40.3	175.9	50.7	0	0	0	0	112.3	L745 Y746 L747 A752 L753	L745-T749 WeakPolarHBondContact O-CB 3.35Å; L745-T749 VanDerWaalsContact O-CG2 3.26Å; L745-T749 WeakPolarHBondContact O-CG2 3.49Å; L745-T749 PolarHBondContact O-N 2.92Å; L745-T749 PolarHBondContact O-OG1 3.14Å; Y746-T749 WeakPolarHBondContact CA-OG1 3.3Å; Y746-T749 PolarHBondContact O-OG1 3.37Å; L747-T749 VanDerWaalsContact C-N 3.34Å; L747-T749 PolarHBondContact O-N 3.39Å; T749-A752 PolarHBondContact O-N 3.33Å; T749-L753 WeakPolarHBondContact O-CB 3.44Å; T749-L753 PolarHBondContact O-N 3.05Å
750	I	83.8	Confident	80.2	Confident	98 Å²	98	87 Å²	87	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-64.1	-44	175	-69.4	167.1	0	0	0	110.8	Y746 L747 L753 L754	Y746-I750 WeakPolarHBondContact O-CD1 3.37Å; Y746-I750 VanDerWaalsContact O-CG1 3.26Å; Y746-I750 WeakPolarHBondContact O-CG1 3.49Å; Y746-I750 PolarHBondContact O-N 3.16Å; Y746-I750 VanDerWaalsContact O-N 3.09Å; L747-I750 PolarHBondContact O-N 3.39Å; I750-L753 PolarHBondContact O-N 3.26Å; I750-L754 HydrophobicContact CG2-CD1 4.38Å; I750-L754 WeakPolarHBondContact O-CB 3.27Å; I750-L754 PolarHBondContact O-N 3.26Å
751	I	84.7	Confident	80.6	Confident	75 Å²	75	93.5 Å²	93.5	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-40.9	177.9	-68.9	169.3	0	0	0	110.9	L747 M748 L753 L754 L755	L747-I751 HydrophobicContact CD1-CD1 4.19Å; L747-I751 HydrophobicContact CG-CD1 3.87Å; L747-I751 WeakPolarHBondContact O-CB 3.32Å; L747-I751 VanDerWaalsContact O-CG1 3.27Å; L747-I751 WeakPolarHBondContact O-CG1 3.5Å; L747-I751 PolarHBondContact O-N 3.12Å; M748-I751 PolarHBondContact O-N 2.94Å; I751-L753 PolarHBondContact O-N 2.87Å; I751-L754 PolarHBondContact O-N 2.99Å; I751-L755 HydrophobicContact CG2-CD1 3.85Å; I751-L755 WeakPolarHBondContact O-CB 3.1Å; I751-L755 PolarHBondContact O-N 3.35Å
752	A	84.3	Confident	80.7	Confident	61 Å²	61	97 Å²	97	50%	0.504	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-38.4	175.7	0	0	0	0	0	112.3	M748 T749 G756	M748-A752 VanDerWaalsContact O-CB 3.25Å; M748-A752 WeakPolarHBondContact O-CB 3.18Å; M748-A752 PolarHBondContact O-N 2.89Å; T749-A752 PolarHBondContact O-N 3.33Å; A752-G756 PolarHBondContact O-N 3.49Å
753	L	85.9	Confident	80.3	Confident	122 Å²	122	98.1 Å²	98.1	64%	0.639	51%	0.506	S	S	*	.	H	α-helix	trans	-66.6	-40.9	173.8	-113	157.2	0	0	0	112.2	T749 I750 I751 G756 T757	T749-L753 WeakPolarHBondContact O-CB 3.44Å; T749-L753 PolarHBondContact O-N 3.05Å; I750-L753 PolarHBondContact O-N 3.26Å; I751-L753 PolarHBondContact O-N 2.87Å; L753-G756 PolarHBondContact O-N 2.95Å; L753-T757 WeakPolarHBondContact O-CB 3.39Å; L753-T757 VanDerWaalsContact O-CG2 3.26Å; L753-T757 WeakPolarHBondContact O-CG2 3.28Å; L753-T757 PolarHBondContact O-N 3.49Å; L753-T757 PolarHBondContact O-OG1 2.87Å
754	L	84.3	Confident	79.7	Confident	106 Å²	106	103.3 Å²	103.3	56%	0.555	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-42.6	174.9	-102.5	161.1	0	0	0	112	I750 I751 T757 V758	I750-L754 HydrophobicContact CG2-CD1 4.38Å; I750-L754 WeakPolarHBondContact O-CB 3.27Å; I750-L754 PolarHBondContact O-N 3.26Å; I751-L754 PolarHBondContact O-N 2.99Å; L754-T757 WeakPolarHBondContact CA-OG1 3.12Å; L754-T757 PolarHBondContact O-N 2.87Å; L754-T757 PolarHBondContact O-OG1 3.43Å; L754-V758 WeakPolarHBondContact O-CB 3.21Å; L754-V758 VanDerWaalsContact O-CG2 3.22Å; L754-V758 WeakPolarHBondContact O-CG2 3.47Å; L754-V758 PolarHBondContact O-N 3.41Å
755	L	83.9	Confident	79	Confident	99 Å²	99	104.4 Å²	104.4	52%	0.518	53%	0.527	S	S	.	.	H	α-helix	trans	-67.2	-42	175	-89.1	155.9	0	0	0	111.7	I751 T757 V758 I759	I751-L755 HydrophobicContact CG2-CD1 3.85Å; I751-L755 WeakPolarHBondContact O-CB 3.1Å; I751-L755 PolarHBondContact O-N 3.35Å; L755-T757 PolarHBondContact O-N 3.08Å; L755-V758 PolarHBondContact O-N 3.31Å; L755-I759 WeakPolarHBondContact O-CB 3.23Å; L755-I759 WeakPolarHBondContact O-CD1 3.3Å; L755-I759 WeakPolarHBondContact O-CG1 3.07Å; L755-I759 PolarHBondContact O-N 3.45Å
756	G	84	Confident	78.1	Confident	38 Å²	38	107 Å²	107	39%	0.392	54%	0.537	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.6	0	0	0	0	0	112.6	A752 L753 I759 A760	A752-G756 PolarHBondContact O-N 3.49Å; L753-G756 PolarHBondContact O-N 2.95Å; G756-I759 PolarHBondContact O-N 3.03Å; G756-A760 VanDerWaalsContact O-CB 3.3Å; G756-A760 WeakPolarHBondContact O-CB 3.3Å; G756-A760 PolarHBondContact O-N 2.99Å
757	T	81.8	Confident	77.1	Confident	76 Å²	76	108.1 Å²	108.1	47%	0.466	55%	0.547	S	S	.	.	H	α-helix	trans	-68.5	-39.6	176	49.6	0	0	0	0	112.2	L753 L754 L755 A760 Y761	L753-T757 WeakPolarHBondContact O-CB 3.39Å; L753-T757 VanDerWaalsContact O-CG2 3.26Å; L753-T757 WeakPolarHBondContact O-CG2 3.28Å; L753-T757 PolarHBondContact O-N 3.49Å; L753-T757 PolarHBondContact O-OG1 2.87Å; L754-T757 WeakPolarHBondContact CA-OG1 3.12Å; L754-T757 PolarHBondContact O-N 2.87Å; L754-T757 PolarHBondContact O-OG1 3.43Å; L755-T757 PolarHBondContact O-N 3.08Å; T757-A760 PolarHBondContact O-N 3Å; T757-Y761 VanDerWaalsContact O-CB 3.32Å; T757-Y761 WeakPolarHBondContact O-CB 3.1Å; T757-Y761 PolarHBondContact O-N 2.86Å
758	V	83.3	Confident	75.8	Confident	85 Å²	85	111.4 Å²	111.4	52%	0.515	57%	0.565	S	S	.	*	H	α-helix	trans	-64.1	-42.8	174.3	169.7	0	0	0	0	111.3	L754 L755 Y761 R762	L754-V758 WeakPolarHBondContact O-CB 3.21Å; L754-V758 VanDerWaalsContact O-CG2 3.22Å; L754-V758 WeakPolarHBondContact O-CG2 3.47Å; L754-V758 PolarHBondContact O-N 3.41Å; L755-V758 PolarHBondContact O-N 3.31Å; V758-Y761 PolarHBondContact O-N 3.23Å; V758-R762 WeakPolarHBondContact O-CB 3.45Å; V758-R762 PolarHBondContact O-N 3.4Å
759	I	82.1	Confident	74.4	Confident	93 Å²	93	111.7 Å²	111.7	48%	0.477	57%	0.568	S	S	.	*	H	α-helix	trans	-65.5	-43.8	177.2	-68.3	165	0	0	0	111	L755 G756 Y761 R762 Q763	L755-I759 WeakPolarHBondContact O-CB 3.23Å; L755-I759 WeakPolarHBondContact O-CD1 3.3Å; L755-I759 WeakPolarHBondContact O-CG1 3.07Å; L755-I759 PolarHBondContact O-N 3.45Å; G756-I759 PolarHBondContact O-N 3.03Å; I759-Y761 VanDerWaalsContact C-N 3.31Å; I759-Y761 PolarHBondContact O-N 3.19Å; I759-R762 PolarHBondContact O-N 3.02Å; I759-Q763 PolarHBondContact O-N 3.08Å
760	A	78.8	Confident	73.1	Confident	53 Å²	53	113.8 Å²	113.8	44%	0.438	58%	0.583	S	S	.	*	H	α-helix	trans	-62.4	-38.8	175.9	0	0	0	0	0	112.1	G756 T757 Q763 R764	G756-A760 VanDerWaalsContact O-CB 3.3Å; G756-A760 WeakPolarHBondContact O-CB 3.3Å; G756-A760 PolarHBondContact O-N 2.99Å; T757-A760 PolarHBondContact O-N 3Å; A760-Q763 PolarHBondContact O-N 3.45Å; A760-R764 PolarHBondContact O-N 2.94Å; A760-R764 VanDerWaalsContact O-N 3.11Å
761	Y	78.1	Confident	71.7	Confident	160 Å²	160	113.6 Å²	113.6	63%	0.627	60%	0.596	S	S	*	*	H	α-helix	trans	-65.7	-40.6	175	-161.9	-95.5	0	0	0	111.7	T757 V758 I759 R764 Q765	T757-Y761 VanDerWaalsContact O-CB 3.32Å; T757-Y761 WeakPolarHBondContact O-CB 3.1Å; T757-Y761 PolarHBondContact O-N 2.86Å; V758-Y761 PolarHBondContact O-N 3.23Å; I759-Y761 VanDerWaalsContact C-N 3.31Å; I759-Y761 PolarHBondContact O-N 3.19Å; Y761-R764 PolarHBondContact O-N 2.66Å; Y761-Q765 PolarHBondContact O-N 3.25Å
762	R	73.5	Confident	70.3	Confident	180 Å²	180	116.1 Å²	116.1	68%	0.679	62%	0.617	S	S	*	*	H	α-helix	trans	-68	-38.2	176.6	-129.6	-177.3	-176.5	-171.9	1.2	113	V758 I759 Q765 H766	V758-R762 WeakPolarHBondContact O-CB 3.45Å; V758-R762 PolarHBondContact O-N 3.4Å; I759-R762 PolarHBondContact O-N 3.02Å; R762-Q765 PolarHBondContact O-N 3.21Å; R762-H766 PolarHBondContact O-N 2.99Å
763	Q	65.4	Low	68.8	Low	133 Å²	133	124.5 Å²	124.5	62%	0.621	64%	0.636	S	S	*	*	H	α-helix	trans	-66.8	-35.9	175.5	-80.4	-176.3	-16.9	0	0	112.3	I759 A760 H766	I759-Q763 PolarHBondContact O-N 3.08Å; A760-Q763 PolarHBondContact O-N 3.45Å; Q763-H766 PolarHBondContact O-N 3.15Å
764	R	66.8	Low	67	Low	187 Å²	187	124.5 Å²	124.5	71%	0.706	64%	0.643	S	S	*	*	H	α-helix	trans	-61.4	-42.4	173.5	-117.1	176.9	178.3	171.6	-0.2	112.3	A760 Y761 H766 Q767	A760-R764 PolarHBondContact O-N 2.94Å; A760-R764 VanDerWaalsContact O-N 3.11Å; Y761-R764 PolarHBondContact O-N 2.66Å; R764-H766 PolarHBondContact O-N 3.5Å; R764-Q767 PolarHBondContact O-N 3.3Å
765	Q	59.6	Low	65.7	Low	119 Å²	119	125.6 Å²	125.6	56%	0.556	66%	0.657	S	S	*	*	H	α-helix	trans	-63.4	-25.8	177.8	-75.2	-172.2	-31.6	0	0	114	Y761 R762	Y761-Q765 PolarHBondContact O-N 3.25Å; R762-Q765 PolarHBondContact O-N 3.21Å
766	H	56.3	Low	64.5	Low	150 Å²	150	123.7 Å²	123.7	69%	0.694	66%	0.661	S	S	*	*	H	α-helix	trans	-79.5	-14.8	177.7	-88.2	-65.5	0	0	0	114.3	R762 Q763 R764	R762-H766 PolarHBondContact O-N 2.99Å; Q763-H766 PolarHBondContact O-N 3.15Å; R764-H766 PolarHBondContact O-N 3.5Å
767	Q	57.4	Low	62.8	Low	167 Å²	167	128.4 Å²	128.4	78%	0.78	69%	0.685	S	S	*	*	H	α-helix	trans	-87.6	-14.4	178.1	-72.8	-176.3	-21.9	0	0	113.7	R764	R764-Q767 PolarHBondContact O-N 3.3Å
768	D	53.8	Low	61.2	Low	137 Å²	137	136.5 Å²	136.5	73%	0.733	71%	0.707	S	S	*	*			trans	-100.1	20.1	-174.6	-72	-31.6	0	0	0	114.7	P770	D768-P770 WeakPolarHBondContact O-CD 3.4Å
769	L	51.6	Low	59.6	Low	135 Å²	135	138.5 Å²	138.5	71%	0.707	72%	0.721	S	S	*	*			trans	-89.9	114.8	176.2	-98.7	136.5	0	0	0	111.8
770	P	56.3	Low	57.9	Low	116 Å²	116	138.6 Å²	138.6	75%	0.753	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-71.1	147.9	174.4	-7	22.6	0	0	0	111.5	D768	D768-P770 WeakPolarHBondContact O-CD 3.4Å
771	A	54.3	Low	56.3	Low	94 Å²	94	141.7 Å²	141.7	78%	0.777	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57.1	140.3	-179.9	0	0	0	0	0	113
772	P	53.9	Low	54.6	Low	127 Å²	127	140.1 Å²	140.1	83%	0.825	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.8	-178.1	27.1	-29.9	0	0	0	112.1
773	R	52.9	Low	52.9	Low	238 Å²	238	140.9 Å²	140.9	90%	0.898	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.8	150.8	173.8	-71.6	-178.6	-174.8	176.8	1.9	111.4
774	P	49.8	Very low	51.5	Low	121 Å²	121	144 Å²	144	79%	0.786	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.9	147.5	-179.3	27	-33	0	0	0	112.3
775	P	56.6	Low	50.1	Low	129 Å²	129	144.6 Å²	144.6	84%	0.838	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.5	133.6	-174.2	29	-32.6	0	0	0	112.5
776	G	57.5	Low	49	Very low	59 Å²	59	143.3 Å²	143.3	61%	0.608	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.2	163.8	165.7	0	0	0	0	0	112.7
777	P	48.3	Very low	48.2	Very low	137 Å²	137	141.8 Å²	141.8	89%	0.89	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.7	142.7	-172.4	26.4	-31.8	0	0	0	113.2
778	R	48.7	Very low	47.4	Very low	246 Å²	246	140.2 Å²	140.2	93%	0.928	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-79.7	139	-174.9	-67.4	-179	-175.4	179.5	0.9	112.6
779	P	49.1	Very low	46.5	Very low	127 Å²	127	143.2 Å²	143.2	83%	0.825	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-77.2	150.5	164.6	-6.3	23.3	0	0	0	112.3
780	A	46.6	Very low	46	Very low	95 Å²	95	145.6 Å²	145.6	79%	0.785	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-75.3	150.1	-178.4	0	0	0	0	0	113.1
781	P	45.5	Very low	44.8	Very low	118 Å²	118	149 Å²	149	77%	0.766	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-82.5	152.4	-173.9	31.1	-33.2	0	0	0	114.1
782	P	42.9	Very low	43.9	Very low	128 Å²	128	149.9 Å²	149.9	83%	0.831	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-79	144.6	-178.7	-5.1	23.3	0	0	0	112.9
783	Q	38	Very low	43.9	Very low	195 Å²	195	149.3 Å²	149.3	91%	0.911	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78	141.1	175.8	-71.7	179.1	-28.7	0	0	111.7
784	Q	36.2	Very low	43.3	Very low	200 Å²	200	151 Å²	151	94%	0.935	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-76.9	130.2	175.4	-77.7	168.6	-42.7	0	0	111.1
785	E	36.6	Very low	42.9	Very low	199 Å²	199	152.5 Å²	152.5	93%	0.93	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-85.7	137.3	167.7	-84.3	177.8	154.8	0	0	111.5
786	A	36.1	Very low	42.2	Very low	91 Å²	91	153.7 Å²	153.7	75%	0.752	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-96.4	161.2	179.7	0	0	0	0	0	111.1
787	P	39.5	Very low	41.4	Very low	118 Å²	118	158.9 Å²	158.9	77%	0.766	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-80.3	162.6	-163.7	32.7	-33.7	0	0	0	114.1
788	P	42	Very low	41	Very low	134 Å²	134	160.2 Å²	160.2	87%	0.87	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-85.7	132.4	-166.3	32.7	-32.4	0	0	0	113.2
789	E	33.1	Very low	40.5	Very low	200 Å²	200	154.9 Å²	154.9	94%	0.935	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-101.8	134.9	164.7	-106.3	179.9	158.2	0	0	110.5
790	Q	41.7	Very low	39.9	Very low	186 Å²	186	156.7 Å²	156.7	87%	0.869	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-76.3	148.8	176.9	-65.7	168.8	-33.1	0	0	111.8
791	Q	31.6	Very low	39.4	Very low	187 Å²	187	161.1 Å²	161.1	87%	0.874	87%	0.871	S	S	*	*			trans	-179.8	169.1	134.3	-107.3	178.7	29.3	0	0	113.9
792	P	36	Very low	38.9	Very low	113 Å²	113	164.5 Å²	164.5	73%	0.734	88%	0.879	S	S	*	*				-123.2	-149.9	-115.2	45.4	-25.9	0	0	0	113.4
793	P	52.9	Low	38.6	Very low	115 Å²	115	167.5 Å²	167.5	75%	0.747	88%	0.883	S	S	*	*				-91.7	159.8	-129.1	39.5	-23.5	0	0	0	115.5
794	Q	39.8	Very low	38.7	Very low	272 Å²	272	165 Å²	165	100%	1.271	88%	0.88	S	S	*	*			trans	-144	0	147.6	-79.3	-161.9	-14.9	0	0	110.5

Retrieved 794 of 794 residues in 4159.1 ms (Link to these results)

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