A0A096MPW2_PAPAN Loading...

Nuclear receptor subfamily 0 group B member 1

Nuclear receptor that lacks a DNA-binding domain and acts as a corepressor that inhibits the transcriptional activity of other nuclear receptors through heterodimeric interactions. Component of a cascade required for the development of the hypothalamic-pituitary-adrenal-gonadal axis. May also have a role in the development of the embryo and in the maintenance of embryonic stem cell pluripotency.

AlphaFold DB , UniProt , Accession A0A096MPW2, Species PAPAN (Papio anubis, Olive baboon), Gene NR0B1, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	39	Very low	236 Å²	236	130.8 Å²	130.8	100%	1.163	71%	0.714	S	S	*	*				0	91.4	0	-59.9	-146.8	-68.8	0	0	105.8
2	A	35.9	Very low	39.7	Very low	110 Å²	110	130.9 Å²	130.9	91%	0.909	71%	0.711	S	S	*	*				83.2	131.2	88.9	0	0	0	0	0	111.1
3	G	29.5	Very low	39.8	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	71%	0.706	S	S	*	*			trans	132.7	71.8	177.1	0	0	0	0	0	111.8
4	E	39.3	Very low	40.2	Very low	178 Å²	178	128.6 Å²	128.6	83%	0.832	69%	0.685	S	S	*	*				78	142.1	101.8	-71.3	177.3	-177.1	0	0	112.7
5	N	36	Very low	40.6	Very low	115 Å²	115	126.5 Å²	126.5	62%	0.615	67%	0.674	S	S	*	*			cis	-167.2	135.6	-12.1	-108.5	-20.8	0	0	0	105.9
6	H	42	Very low	40.8	Very low	135 Å²	135	126.9 Å²	126.9	63%	0.625	67%	0.673	S	S	*	*			trans	35.6	114.4	149.9	-51	-68.1	0	0	0	122.1
7	Q	39.9	Very low	40.8	Very low	168 Å²	168	125.9 Å²	125.9	79%	0.785	67%	0.668	S	S	*	*	S	Bend		-161.3	99.9	123.4	-121.6	170.6	-12.3	0	0	104.7
8	W	38.6	Very low	40.7	Very low	194 Å²	194	125.2 Å²	125.2	74%	0.735	66%	0.661	S	S	*	*				-169.5	53.9	97.1	-80.5	100.2	0	0	0	111.4	G10	W8-G10 PolarHBondContact O-N 3.43Å
9	Q	42.3	Very low	40.9	Very low	144 Å²	144	123.9 Å²	123.9	67%	0.673	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	46.9	171.8	-86.6	-179.8	-26	0	0	113.1
10	G	48.1	Very low	40.8	Very low	60 Å²	60	121.9 Å²	121.9	62%	0.619	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157	4	176.8	0	0	0	0	0	114.4	W8	W8-G10 PolarHBondContact O-N 3.43Å
11	S	45.4	Very low	40.7	Very low	36 Å²	36	124.4 Å²	124.4	25%	0.252	67%	0.67	S	S	.	*			trans	-77	132	173.7	82.7	0	0	0	0	109.5	L13 Y14 N15	S11-L13 PolarHBondContact O-N 3.42Å; S11-Y14 PolarHBondContact O-N 3.34Å; S11-Y14 PolarHBondContact OG-N 3.24Å; S11-N15 PolarHBondContact O-N 3.1Å
12	I	46.9	Very low	40.9	Very low	132 Å²	132	121.3 Å²	121.3	68%	0.677	65%	0.652	S	S	*	*	H	α-helix	trans	-53.2	-29.3	174.5	-65.9	166.9	0	0	0	110.6	M16	I12-M16 HydrophobicContact CG2-CE 4.21Å; I12-M16 HydrophobicContact CG2-SD 4.26Å; I12-M16 WeakPolarHBondContact O-CB 3.31Å; I12-M16 WeakPolarHBondContact O-CG 3.45Å; I12-M16 PolarHBondContact O-N 3.13Å
13	L	41.5	Very low	40.6	Very low	123 Å²	123	122.8 Å²	122.8	64%	0.644	65%	0.65	S	S	*	*	H	α-helix	trans	-63	-40.2	173.8	-89	151.1	0	0	0	114	S11 L17	S11-L13 PolarHBondContact O-N 3.42Å; L13-L17 VanDerWaalsContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 WeakPolarHBondContact O-CD1 3.38Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.26Å
14	Y	45.4	Very low	40.8	Very low	106 Å²	106	131.6 Å²	131.6	42%	0.416	66%	0.664	S	S	.	*	H	α-helix	trans	-70	-39.5	179	-175.6	-96.5	0	0	0	111.9	S11 L17 M18	S11-Y14 PolarHBondContact O-N 3.34Å; S11-Y14 PolarHBondContact OG-N 3.24Å; Y14-L17 PolarHBondContact O-N 3.43Å; Y14-M18 HydrophobicContact CE1-CG 4.16Å; Y14-M18 HydrophobicContact CE2-CG 4.41Å; Y14-M18 WeakPolarHBondContact O-CG 3.39Å; Y14-M18 PolarHBondContact O-N 3.08Å
15	N	46.3	Very low	40.3	Very low	98 Å²	98	128 Å²	128	52%	0.524	66%	0.664	S	S	.	*	H	α-helix	trans	-71.3	-34.4	176.4	-72.1	-25.4	0	0	0	112.3	S11 S19	S11-N15 PolarHBondContact O-N 3.1Å; N15-S19 WeakPolarHBondContact O-CB 3.1Å; N15-S19 PolarHBondContact O-N 3.19Å; N15-S19 VanDerWaalsContact O-N 3.17Å; N15-S19 PolarHBondContact O-OG 3.38Å
16	M	42.8	Very low	39.9	Very low	133 Å²	133	126.7 Å²	126.7	66%	0.655	67%	0.67	S	S	*	*	H	α-helix	trans	-67.4	-40.4	171	-81.8	-175.8	170.9	0	0	112.4	I12 A20	I12-M16 HydrophobicContact CG2-CE 4.21Å; I12-M16 HydrophobicContact CG2-SD 4.26Å; I12-M16 WeakPolarHBondContact O-CB 3.31Å; I12-M16 WeakPolarHBondContact O-CG 3.45Å; I12-M16 PolarHBondContact O-N 3.13Å; M16-A20 PolarHBondContact O-N 3.06Å
17	L	41.2	Very low	39.4	Very low	110 Å²	110	126.5 Å²	126.5	58%	0.576	68%	0.68	S	S	*	*	H	α-helix	trans	-70.1	-32.8	-179.8	-86.3	160	0	0	0	113.4	L13 Y14	L13-L17 VanDerWaalsContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 WeakPolarHBondContact O-CD1 3.38Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.26Å; Y14-L17 PolarHBondContact O-N 3.43Å
18	M	39.1	Very low	39	Very low	112 Å²	112	127.7 Å²	127.7	55%	0.552	69%	0.686	S	S	*	*	H	α-helix	trans	-84.1	-27.9	178.8	-67.8	-59.9	-75.1	0	0	113.3	Y14 A20	Y14-M18 HydrophobicContact CE1-CG 4.16Å; Y14-M18 HydrophobicContact CE2-CG 4.41Å; Y14-M18 WeakPolarHBondContact O-CG 3.39Å; Y14-M18 PolarHBondContact O-N 3.08Å; M18-A20 VanDerWaalsContact C-N 3.27Å; M18-A20 PolarHBondContact O-N 3.17Å
19	S	44.4	Very low	39	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	69%	0.687	S	S	*	*	H	α-helix	trans	-72.9	-20.4	173.9	-56.7	0	0	0	0	112.8	N15	N15-S19 WeakPolarHBondContact O-CB 3.1Å; N15-S19 PolarHBondContact O-N 3.19Å; N15-S19 VanDerWaalsContact O-N 3.17Å; N15-S19 PolarHBondContact O-OG 3.38Å
20	A	39.3	Very low	38.5	Very low	84 Å²	84	121.9 Å²	121.9	69%	0.694	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	0	-178.7	0	0	0	0	0	115	M16 M18	M16-A20 PolarHBondContact O-N 3.06Å; M18-A20 VanDerWaalsContact C-N 3.27Å; M18-A20 PolarHBondContact O-N 3.17Å
21	K	37.9	Very low	37.5	Very low	175 Å²	175	126.5 Å²	126.5	76%	0.761	70%	0.699	S	S	*	*	S	Bend	trans	-113.8	1	-171.1	-95.1	-174.3	176	-177.5	0	117.4
22	Q	36.7	Very low	37.1	Very low	171 Å²	171	132 Å²	132	80%	0.799	73%	0.731	S	S	*	*	S	Bend	trans	-126	102	167.8	-76.2	165.3	-8.3	0	0	106
23	T	29.3	Very low	36.1	Very low	140 Å²	140	135.4 Å²	135.4	86%	0.859	74%	0.735	S	S	*	*			cis	-163.9	131.8	40.3	11.1	0	0	0	0	108.2
24	R	34.8	Very low	35.5	Very low	249 Å²	249	137.3 Å²	137.3	94%	0.94	75%	0.745	S	S	*	*			trans	-83.6	154.3	160.6	-72.4	-175	174.7	-174.1	-2.2	107.7
25	A	28.5	Very low	35	Very low	102 Å²	102	138.9 Å²	138.9	84%	0.843	77%	0.765	S	S	*	*				-162.3	160.8	55.2	0	0	0	0	0	114.7
26	A	27.2	Very low	34.3	Very low	88 Å²	88	141 Å²	141	73%	0.727	78%	0.777	S	S	*	*			trans	-73.7	176.5	-177.8	0	0	0	0	0	114.5
27	P	32.3	Very low	34.3	Very low	131 Å²	131	141.7 Å²	141.7	85%	0.851	78%	0.778	S	S	*	*				-119.7	169.3	105.7	35.8	-31.9	0	0	0	113.5
28	E	31.1	Very low	34.4	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	76%	0.764	S	S	*	*			trans	-62.6	155.3	-147.4	-58.7	-170	141.7	0	0	118.9
29	A	37.5	Very low	34.6	Very low	93 Å²	93	140.9 Å²	140.9	77%	0.769	77%	0.767	S	S	*	*			trans	-83.4	164.1	179.5	0	0	0	0	0	113
30	P	31.8	Very low	34.5	Very low	123 Å²	123	136.9 Å²	136.9	80%	0.799	74%	0.743	S	S	*	*			trans	-122.8	134.8	131.5	33.7	-24.2	0	0	0	112
31	E	28.5	Very low	34.6	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.734	72%	0.716	S	S	*	*			trans	6.3	114.8	157.7	-62.6	180	163.9	0	0	118.1	R33	E31-R33 PolarHBondContact O-N 3.34Å
32	T	36.2	Very low	34.9	Very low	151 Å²	151	127.7 Å²	127.7	93%	0.926	70%	0.695	S	S	*	*			trans	-61.6	94.1	159.3	44.6	0	0	0	0	110.4
33	R	27.1	Very low	35	Very low	205 Å²	205	121.3 Å²	121.3	77%	0.774	67%	0.669	S	S	*	*			trans	-87.2	142.3	151.6	-69	-175.1	-178.3	-179.5	0.6	108.3	E31 V35	E31-R33 PolarHBondContact O-N 3.34Å; R33-V35 PolarHBondContact O-N 3.1Å
34	L	28.6	Very low	35.3	Very low	163 Å²	163	116.4 Å²	116.4	85%	0.853	65%	0.646	S	S	*	*			trans	-28.8	117.5	170.8	-76.5	142.7	0	0	0	111	D36	L34-D36 PolarHBondContact O-N 3.41Å
35	V	33.4	Very low	35.2	Very low	138 Å²	138	111.2 Å²	111.2	84%	0.836	64%	0.637	S	S	*	*			trans	-70.6	89.4	176.4	179.6	0	0	0	0	107	R33 Q37	R33-V35 PolarHBondContact O-N 3.1Å; V35-Q37 PolarHBondContact O-N 3.01Å
36	D	32.1	Very low	35.6	Very low	142 Å²	142	113.4 Å²	113.4	76%	0.759	63%	0.629	S	S	*	*			trans	-53.7	120.4	162.8	-72.3	-35.6	0	0	0	107.5	L34 C38	L34-D36 PolarHBondContact O-N 3.41Å; D36-C38 PolarHBondContact O-N 3.15Å
37	Q	42.5	Very low	35.9	Very low	148 Å²	148	114.1 Å²	114.1	69%	0.692	63%	0.627	S	S	*	*			trans	-61.7	98.2	174.4	-76.3	173.4	-1	0	0	108.4	V35 W39	V35-Q37 PolarHBondContact O-N 3.01Å; Q37-W39 PolarHBondContact O-N 3.02Å
38	C	43.5	Very low	36	Very low	40 Å²	40	111.8 Å²	111.8	27%	0.27	63%	0.626	S	S	.	*			trans	-75.4	102.8	174.1	-171.7	0	0	0	0	108.1	D36 G40 C66 C69	D36-C38 PolarHBondContact O-N 3.15Å; C38-G40 PolarHBondContact O-N 3.37Å; C38-C66 PolarHBondContact SG-SG 3.39Å; C38-C69 HydrophobicContact CB-CB 3.9Å; C38-C69 WeakPolarHBondContact CB-SG 3.44Å; C38-C69 WeakPolarHBondContact SG-CB 3.31Å; C38-C69 CovalentContact SG-SG 2.07Å; C38-C69 PolarHBondContact SG-SG 3.41Å
39	W	43.6	Very low	36.3	Very low	165 Å²	165	108.8 Å²	108.8	63%	0.625	62%	0.621	S	S	*	*			trans	-72	-0.8	177.7	-65.1	90.9	0	0	0	113.8	Q37	Q37-W39 PolarHBondContact O-N 3.02Å
40	G	42.3	Very low	35.9	Very low	18 Å²	18	107.2 Å²	107.2	19%	0.186	61%	0.614	C	S	.	*			trans	75	162.7	177.7	0	0	0	0	0	113.7	C38 Y64	C38-G40 PolarHBondContact O-N 3.37Å; G40-Y64 WeakPolarHBondContact CA-OH 3.43Å
41	C	42.2	Very low	36.2	Very low	19 Å²	19	113.6 Å²	113.6	13%	0.128	62%	0.622	C	S	.	*			trans	-128.5	138.3	175	85.5	0	0	0	0	109.1	C43 Y64 C67	C41-C43 WeakPolarHBondContact CB-SG 3.34Å; C41-C43 PolarHBondContact O-N 3.4Å; C41-C43 WeakPolarHBondContact SG-CB 3.49Å; C41-C43 CovalentContact SG-SG 2.06Å; C41-C43 PolarHBondContact SG-SG 3.4Å; C41-Y64 PolarHBondContact N-OH 2.86Å; C41-Y64 WeakPolarHBondContact O-CD2 3.5Å; C41-Y64 WeakPolarHBondContact O-CE2 3.45Å; C41-C67 PolarHBondContact SG-N 3.41Å
42	S	43.8	Very low	36.4	Very low	47 Å²	47	114.9 Å²	114.9	33%	0.329	63%	0.628	S	S	.	*	S	Bend	trans	-75.3	26.8	180	-50.5	0	0	0	0	114.1	S78 E464	S42-S78 PolarHBondContact OG-OG 2.93Å; S42-E464 PolarHBondContact OG-OE1 3.47Å
43	C	37.8	Very low	36.5	Very low	37 Å²	37	111.5 Å²	111.5	25%	0.25	62%	0.624	C	S	.	*			trans	-87.2	104.5	175.4	-3.5	0	0	0	0	109.9	C41 C67	C41-C43 WeakPolarHBondContact CB-SG 3.34Å; C41-C43 PolarHBondContact O-N 3.4Å; C41-C43 WeakPolarHBondContact SG-CB 3.49Å; C41-C43 CovalentContact SG-SG 2.06Å; C41-C43 PolarHBondContact SG-SG 3.4Å; C43-C67 WeakPolarHBondContact CB-SG 3.37Å
44	G	36.2	Very low	36.8	Very low	36 Å²	36	110 Å²	110	37%	0.371	63%	0.63	S	S	.	*			trans	-165	121.4	169	0	0	0	0	0	111.2
45	D	33.3	Very low	37.2	Very low	141 Å²	141	111 Å²	111	75%	0.754	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-66.9	142.1	162.1	-76.5	-36.8	0	0	0	108.6
46	E	36.8	Very low	37.1	Very low	147 Å²	147	107.8 Å²	107.8	69%	0.687	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.8	171.1	-70.4	-145.5	141.8	0	0	109	G48	E46-G48 PolarHBondContact O-N 3.03Å; E46-G48 VanDerWaalsContact O-N 3.08Å
47	P	33.5	Very low	37.3	Very low	103 Å²	103	105.4 Å²	105.4	67%	0.669	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-61.7	119.6	162.3	26.2	-28.3	0	0	0	105.9	V49	P47-V49 PolarHBondContact O-N 3.42Å
48	G	35	Very low	36.8	Very low	82 Å²	82	109.2 Å²	109.2	85%	0.845	65%	0.647	S	S	*	*			trans	-60.3	89.1	176.6	0	0	0	0	0	109.7	E46 G50	E46-G48 PolarHBondContact O-N 3.03Å; E46-G48 VanDerWaalsContact O-N 3.08Å; G48-G50 PolarHBondContact O-N 3.45Å
49	V	36.2	Very low	36.4	Very low	129 Å²	129	115.5 Å²	115.5	78%	0.782	68%	0.678	S	S	*	*			trans	-79.5	108.8	170.9	178.7	0	0	0	0	105.9	P47 R51	P47-V49 PolarHBondContact O-N 3.42Å; V49-R51 PolarHBondContact O-N 2.96Å
50	G	30.4	Very low	36.2	Very low	61 Å²	61	113.4 Å²	113.4	63%	0.629	68%	0.683	S	S	*	*			trans	-46.5	135.3	171.4	0	0	0	0	0	110.5	G48 E52	G48-G50 PolarHBondContact O-N 3.45Å; G50-E52 PolarHBondContact O-N 2.88Å
51	R	36.7	Very low	36.3	Very low	256 Å²	256	116.6 Å²	116.6	97%	0.966	70%	0.702	S	S	*	*			trans	-69	78	179.8	-162.3	-174.1	-154	-133.3	7.4	109.7	V49	V49-R51 PolarHBondContact O-N 2.96Å
52	E	33.4	Very low	36.7	Very low	185 Å²	185	120 Å²	120	86%	0.864	72%	0.719	S	S	*	*			trans	-124.3	116.3	164.5	-82.1	-179.4	152.6	0	0	109.2	G50	G50-E52 PolarHBondContact O-N 2.88Å
53	G	38.8	Very low	37.1	Very low	80 Å²	80	122.7 Å²	122.7	83%	0.825	73%	0.729	S	S	*	*			trans	-67.8	140.6	-167.7	0	0	0	0	0	112.7
54	L	32	Very low	37.8	Very low	174 Å²	174	121.6 Å²	121.6	91%	0.911	72%	0.719	S	S	*	*			trans	-141.4	116	159.5	-94	156.5	0	0	0	108.6	G56	L54-G56 PolarHBondContact O-N 3.25Å
55	L	37.5	Very low	38.5	Very low	184 Å²	184	127.8 Å²	127.8	96%	0.963	73%	0.732	S	S	*	*			trans	-57.8	124.1	164.7	-76.1	146.8	0	0	0	109.1
56	G	31.3	Very low	39.3	Very low	70 Å²	70	121.1 Å²	121.1	72%	0.722	70%	0.696	S	S	*	*			trans	157.7	103.9	170.2	0	0	0	0	0	112.6	L54 R58	L54-G56 PolarHBondContact O-N 3.25Å; G56-R58 PolarHBondContact O-N 2.9Å
57	G	36.7	Very low	39.8	Very low	92 Å²	92	119 Å²	119	95%	0.948	70%	0.696	S	S	*	*			trans	-59.8	104.6	175.2	0	0	0	0	0	111.9
58	R	31.6	Very low	40.2	Very low	228 Å²	228	123.1 Å²	123.1	86%	0.86	70%	0.704	S	S	*	*			trans	-133.7	129.7	157.5	-97.5	-178.9	170.3	-177.8	-3	107.2	G56 V60	G56-R58 PolarHBondContact O-N 2.9Å; R58-V60 PolarHBondContact O-N 3.47Å
59	N	35.3	Very low	41	Very low	172 Å²	172	121.3 Å²	121.3	92%	0.92	68%	0.678	S	S	*	*			trans	-55.2	101.1	170.4	-95	-21.9	0	0	0	108.5	S61	N59-S61 PolarHBondContact O-N 3.35Å
60	V	39.9	Very low	41.8	Very low	121 Å²	121	117 Å²	117	73%	0.733	66%	0.66	S	S	*	*			trans	-74.5	97.6	170.9	-176.6	0	0	0	0	105.9	R58 L62	R58-V60 PolarHBondContact O-N 3.47Å; V60-L62 PolarHBondContact O-N 2.79Å
61	S	43.5	Very low	43	Very low	84 Å²	84	121.2 Å²	121.2	59%	0.587	66%	0.661	S	S	*	*			trans	-62.2	101.4	169.1	38.8	0	0	0	0	108.1	N59 L63	N59-S61 PolarHBondContact O-N 3.35Å; S61-L63 PolarHBondContact O-N 3.32Å
62	L	51.8	Low	43.9	Very low	92 Å²	92	113.9 Å²	113.9	48%	0.482	64%	0.641	S	S	.	*			trans	-61.1	107.8	176.7	-70.1	163.6	0	0	0	108.7	V60 R75	V60-L62 PolarHBondContact O-N 2.79Å; L62-R75 HydrophobicContact CB-CG 4.31Å; L62-R75 WeakPolarHBondContact O-CG 3.45Å; L62-R75 PolarHBondContact O-N 3.26Å; L62-R75 VanDerWaalsContact O-N 3.08Å
63	L	50.9	Low	44.9	Very low	102 Å²	102	107.1 Å²	107.1	53%	0.534	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.8	149.3	172.1	-65.3	167.8	0	0	0	109.2	S61 D72 H73 P74	S61-L63 PolarHBondContact O-N 3.32Å; L63-D72 HydrophobicContact CB-CB 4.5Å; L63-H73 CarbonylContact C-O 3.58Å; L63-H73 VanDerWaalsContact CA-O 3.28Å; L63-H73 WeakPolarHBondContact CA-O 3.49Å; L63-P74 HydrophobicContact CD2-CB 4.28Å
64	Y	52.6	Low	45.7	Very low	14 Å²	14	106.7 Å²	106.7	6%	0.055	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.1	151.2	170.9	72.3	-90.3	0	0	0	110.3	G40 C41 C66 D72 H73 R75	G40-Y64 WeakPolarHBondContact CA-OH 3.43Å; C41-Y64 PolarHBondContact N-OH 2.86Å; C41-Y64 WeakPolarHBondContact O-CD2 3.5Å; C41-Y64 WeakPolarHBondContact O-CE2 3.45Å; Y64-C66 HydrophobicContact CE2-CB 4.35Å; Y64-D72 CarbonylContact O-C 3.56Å; Y64-D72 VanDerWaalsContact O-CA 3.3Å; Y64-D72 WeakPolarHBondContact O-CA 3.37Å; Y64-H73 VanDerWaalsContact CD1-O 3.31Å; Y64-H73 WeakPolarHBondContact CD1-O 3.35Å; Y64-H73 HydrophobicContact CE1-CB 4.01Å; Y64-H73 HydrophobicContact CE2-CB 4.31Å; Y64-H73 PolarHBondContact N-O 2.91Å; Y64-H73 PolarHBondContact O-N 3.23Å; Y64-R75 HydrophobicContact CD1-CG 3.79Å; Y64-R75 HydrophobicContact CE1-CG 4.45Å
65	R	50.9	Low	46.5	Very low	167 Å²	167	103.5 Å²	103.5	63%	0.63	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.9	115.8	-178.3	-165.1	168.4	-175.1	171.8	-0.5	111.4	C67 G70 D72	R65-C67 PolarHBondContact O-N 2.91Å; R65-G70 PolarHBondContact NE-O 3.41Å; R65-D72 WeakPolarHBondContact CA-OD1 3.3Å; R65-D72 VanDerWaalsContact CB-OD1 3.23Å; R65-D72 WeakPolarHBondContact CB-OD1 3.48Å; R65-D72 WeakPolarHBondContact CG-OD1 3.45Å
66	C	49.7	Very low	46.9	Very low	1 Å²	1	102 Å²	102	1%	0.007	56%	0.555	C	S	.	*			trans	-70.9	123.9	-178.3	179.1	0	0	0	0	111.7	C38 Y64 F68 C69 G70 K71	C38-C66 PolarHBondContact SG-SG 3.39Å; Y64-C66 HydrophobicContact CE2-CB 4.35Å; C66-F68 PolarHBondContact O-N 2.99Å; C66-F68 PolarHBondContact SG-N 3.04Å; C66-F68 VanDerWaalsContact SG-N 3.36Å; C66-C69 VanDerWaalsContact SG-SG 3.64Å; C66-G70 WeakPolarHBondContact O-CA 3.28Å; C66-G70 PolarHBondContact O-N 3.04Å; C66-K71 PolarHBondContact N-O 3.42Å
67	C	47.6	Very low	47.5	Very low	101 Å²	101	101.3 Å²	101.3	68%	0.682	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.2	175.3	-66	0	0	0	0	114.1	C41 C43 R65	C41-C67 PolarHBondContact SG-N 3.41Å; C43-C67 WeakPolarHBondContact CB-SG 3.37Å; R65-C67 PolarHBondContact O-N 2.91Å
68	F	42.2	Very low	48.1	Very low	190 Å²	190	97.3 Å²	97.3	83%	0.833	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-44.9	-177.9	-153.7	-93	0	0	0	112.4	C66	C66-F68 PolarHBondContact O-N 2.99Å; C66-F68 PolarHBondContact SG-N 3.04Å; C66-F68 VanDerWaalsContact SG-N 3.36Å
69	C	52.4	Low	48.9	Very low	45 Å²	45	87.5 Å²	87.5	30%	0.304	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-2.9	-178.1	59.9	0	0	0	0	114.3	C38 C66 K71 H73	C38-C69 HydrophobicContact CB-CB 3.9Å; C38-C69 WeakPolarHBondContact CB-SG 3.44Å; C38-C69 WeakPolarHBondContact SG-CB 3.31Å; C38-C69 CovalentContact SG-SG 2.07Å; C38-C69 PolarHBondContact SG-SG 3.41Å; C66-C69 VanDerWaalsContact SG-SG 3.64Å; C69-K71 PolarHBondContact O-N 3.21Å; C69-H73 PolarHBondContact SG-NE2 3.33Å
70	G	51.6	Low	49.3	Very low	39 Å²	39	80.2 Å²	80.2	40%	0.402	43%	0.431	S	S	.	.			trans	72.4	0.5	175.8	0	0	0	0	0	116	R65 C66	R65-G70 PolarHBondContact NE-O 3.41Å; C66-G70 WeakPolarHBondContact O-CA 3.28Å; C66-G70 PolarHBondContact O-N 3.04Å
71	K	57.6	Low	49.7	Very low	149 Å²	149	78.4 Å²	78.4	65%	0.648	41%	0.412	S	S	*	.			trans	-100.3	158.2	-174.5	-64.9	178.8	-177.2	178.6	0	112.5	C66 C69 H73	C66-K71 PolarHBondContact N-O 3.42Å; C69-K71 PolarHBondContact O-N 3.21Å; K71-H73 PolarHBondContact O-CD2 3.47Å
72	D	54.4	Low	49.8	Very low	102 Å²	102	76.5 Å²	76.5	55%	0.545	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.4	177.1	-61.3	-40.8	0	0	0	111.9	L63 Y64 R65	L63-D72 HydrophobicContact CB-CB 4.5Å; Y64-D72 CarbonylContact O-C 3.56Å; Y64-D72 VanDerWaalsContact O-CA 3.3Å; Y64-D72 WeakPolarHBondContact O-CA 3.37Å; R65-D72 WeakPolarHBondContact CA-OD1 3.3Å; R65-D72 VanDerWaalsContact CB-OD1 3.23Å; R65-D72 WeakPolarHBondContact CB-OD1 3.48Å; R65-D72 WeakPolarHBondContact CG-OD1 3.45Å
73	H	53.6	Low	49.7	Very low	43 Å²	43	73.5 Å²	73.5	20%	0.199	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.8	-178.6	-68.8	-89.3	0	0	0	112.2	L63 Y64 C69 K71	L63-H73 CarbonylContact C-O 3.58Å; L63-H73 VanDerWaalsContact CA-O 3.28Å; L63-H73 WeakPolarHBondContact CA-O 3.49Å; Y64-H73 VanDerWaalsContact CD1-O 3.31Å; Y64-H73 WeakPolarHBondContact CD1-O 3.35Å; Y64-H73 HydrophobicContact CE1-CB 4.01Å; Y64-H73 HydrophobicContact CE2-CB 4.31Å; Y64-H73 PolarHBondContact N-O 2.91Å; Y64-H73 PolarHBondContact O-N 3.23Å; C69-H73 PolarHBondContact SG-NE2 3.33Å; K71-H73 PolarHBondContact O-CD2 3.47Å
74	P	56	Low	49.4	Very low	70 Å²	70	72.9 Å²	72.9	46%	0.455	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	136.4	173.1	27.9	-32.6	0	0	0	111.3	L63 Q76	L63-P74 HydrophobicContact CD2-CB 4.28Å; P74-Q76 PolarHBondContact O-N 3.04Å; P74-Q76 VanDerWaalsContact O-N 3.08Å
75	R	49.3	Very low	48.8	Very low	108 Å²	108	73.9 Å²	73.9	41%	0.408	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-58.7	-20.3	176.7	-80	-172.6	-175.3	-133.8	3.4	114.4	L62 Y64 G77 Y81	L62-R75 HydrophobicContact CB-CG 4.31Å; L62-R75 WeakPolarHBondContact O-CG 3.45Å; L62-R75 PolarHBondContact O-N 3.26Å; L62-R75 VanDerWaalsContact O-N 3.08Å; Y64-R75 HydrophobicContact CD1-CG 3.79Å; Y64-R75 HydrophobicContact CE1-CG 4.45Å; R75-G77 PolarHBondContact O-N 3.18Å; R75-Y81 WeakPolarHBondContact O-CB 3.39Å; R75-Y81 VanDerWaalsContact O-CG 3.22Å
76	Q	45.8	Very low	48.4	Very low	152 Å²	152	69.1 Å²	69.1	71%	0.71	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-69.3	13.9	-177	-101.8	171.6	-0.1	0	0	116	P74 Y81	P74-Q76 PolarHBondContact O-N 3.04Å; P74-Q76 VanDerWaalsContact O-N 3.08Å; Q76-Y81 HydrophobicContact CB-CE1 4.26Å; Q76-Y81 HydrophobicContact CG-CE1 3.83Å; Q76-Y81 HydrophobicContact CG-CE2 4.48Å; Q76-Y81 VanDerWaalsContact CG-OH 3.31Å; Q76-Y81 WeakPolarHBondContact CG-OH 3.44Å
77	G	43.9	Very low	47.8	Very low	56 Å²	56	70.8 Å²	70.8	58%	0.577	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-142.4	5.7	-177.7	0	0	0	0	0	116.5	R75	R75-G77 PolarHBondContact O-N 3.18Å
78	S	48.9	Very low	47.1	Very low	7 Å²	7	73.8 Å²	73.8	5%	0.049	39%	0.394	C	S	.	.			trans	-75	148.5	174.5	72.3	0	0	0	0	111.1	S42 L80 Y81 S82	S42-S78 PolarHBondContact OG-OG 2.93Å; S78-L80 PolarHBondContact O-N 3.46Å; S78-Y81 CarbonylContact O-C 3.53Å; S78-Y81 WeakPolarHBondContact O-CA 3.48Å; S78-Y81 WeakPolarHBondContact O-CB 3.41Å; S78-Y81 PolarHBondContact O-N 2.83Å; S78-Y81 VanDerWaalsContact OG-CB 3.23Å; S78-Y81 WeakPolarHBondContact OG-CB 3.39Å; S78-Y81 PolarHBondContact OG-N 3.17Å; S78-Y81 VanDerWaalsContact OG-N 3.1Å; S78-S82 PolarHBondContact O-N 3.32Å
79	I	48.4	Very low	46.6	Very low	23 Å²	23	72.7 Å²	72.7	12%	0.118	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-37.6	-179.9	-62.6	155.7	0	0	0	110.1	S82 M83 V456	I79-S82 PolarHBondContact O-N 3.26Å; I79-S82 PolarHBondContact O-OG 2.98Å; I79-M83 HydrophobicContact CG2-CE 4.3Å; I79-M83 WeakPolarHBondContact O-CG 3.32Å; I79-M83 PolarHBondContact O-N 3.12Å; I79-V456 HydrophobicContact CD1-CG1 3.85Å; I79-V456 HydrophobicContact CD1-CG2 4.18Å; I79-V456 HydrophobicContact CG1-CG2 4.37Å
80	L	45.3	Very low	45.6	Very low	19 Å²	19	75.5 Å²	75.5	10%	0.099	41%	0.408	C	S	.	.	H	α-helix	trans	-62.3	-40.9	170.2	-111.4	147.3	0	0	0	112.4	S78 M83 L84 E464 T468 L470	S78-L80 PolarHBondContact O-N 3.46Å; L80-M83 HydrophobicContact CG-CE 4.12Å; L80-M83 PolarHBondContact O-N 3.01Å; L80-L84 HydrophobicContact CD2-CD1 3.94Å; L80-L84 HydrophobicContact CD2-CG 4.4Å; L80-L84 VanDerWaalsContact O-CB 3.24Å; L80-L84 WeakPolarHBondContact O-CB 3.2Å; L80-L84 WeakPolarHBondContact O-CD1 3.16Å; L80-L84 WeakPolarHBondContact O-CG 3.17Å; L80-L84 PolarHBondContact O-N 2.92Å; L80-E464 HydrophobicContact CD1-CG 4.17Å; L80-T468 HydrophobicContact CD1-CG2 3.88Å; L80-T468 WeakPolarHBondContact CD1-OG1 3.26Å; L80-L470 HydrophobicContact CD2-CD2 4.49Å
81	Y	48.3	Very low	44.6	Very low	82 Å²	82	82.5 Å²	82.5	32%	0.322	42%	0.423	S	S	.	.	H	α-helix	trans	-62.9	-44.9	173.1	178.7	-91.4	0	0	0	110.9	R75 Q76 S78 M83 L84 T85	R75-Y81 WeakPolarHBondContact O-CB 3.39Å; R75-Y81 VanDerWaalsContact O-CG 3.22Å; Q76-Y81 HydrophobicContact CB-CE1 4.26Å; Q76-Y81 HydrophobicContact CG-CE1 3.83Å; Q76-Y81 HydrophobicContact CG-CE2 4.48Å; Q76-Y81 VanDerWaalsContact CG-OH 3.31Å; Q76-Y81 WeakPolarHBondContact CG-OH 3.44Å; S78-Y81 CarbonylContact O-C 3.53Å; S78-Y81 WeakPolarHBondContact O-CA 3.48Å; S78-Y81 WeakPolarHBondContact O-CB 3.41Å; S78-Y81 PolarHBondContact O-N 2.83Å; S78-Y81 VanDerWaalsContact OG-CB 3.23Å; S78-Y81 WeakPolarHBondContact OG-CB 3.39Å; S78-Y81 PolarHBondContact OG-N 3.17Å; S78-Y81 VanDerWaalsContact OG-N 3.1Å; Y81-M83 PolarHBondContact O-N 3.46Å; Y81-L84 CarbonylContact O-C 3.53Å; Y81-L84 PolarHBondContact O-N 2.93Å; Y81-T85 HydrophobicContact CD1-CG2 3.91Å; Y81-T85 HydrophobicContact CD2-CG2 3.82Å; Y81-T85 HydrophobicContact CE1-CG2 3.54Å; Y81-T85 HydrophobicContact CE2-CG2 3.46Å; Y81-T85 VanDerWaalsContact CE2-CG2 3.46Å; Y81-T85 HydrophobicContact CG-CG2 4.04Å; Y81-T85 WeakPolarHBondContact O-CB 3.49Å; Y81-T85 WeakPolarHBondContact O-CG2 3.26Å; Y81-T85 PolarHBondContact O-N 2.77Å; Y81-T85 PolarHBondContact O-OG1 2.93Å
82	S	45.3	Very low	43.2	Very low	44 Å²	44	80.3 Å²	80.3	31%	0.308	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-43	177.8	85.4	0	0	0	0	111.8	S78 I79 S86	S78-S82 PolarHBondContact O-N 3.32Å; I79-S82 PolarHBondContact O-N 3.26Å; I79-S82 PolarHBondContact O-OG 2.98Å; S82-S86 WeakPolarHBondContact O-CB 3.48Å; S82-S86 PolarHBondContact O-N 3.45Å; S82-S86 PolarHBondContact O-OG 3.34Å
83	M	48.2	Very low	41.7	Very low	29 Å²	29	79.5 Å²	79.5	14%	0.143	44%	0.441	C	S	.	.	H	α-helix	trans	-60.8	-45.4	173.5	-73.3	-169.8	-67.9	0	0	111.6	I79 L80 Y81 A87 I452 M461	I79-M83 HydrophobicContact CG2-CE 4.3Å; I79-M83 WeakPolarHBondContact O-CG 3.32Å; I79-M83 PolarHBondContact O-N 3.12Å; L80-M83 HydrophobicContact CG-CE 4.12Å; L80-M83 PolarHBondContact O-N 3.01Å; Y81-M83 PolarHBondContact O-N 3.46Å; M83-A87 PolarHBondContact O-N 3.49Å; M83-I452 HydrophobicContact CG-CG2 4.27Å; M83-M461 HydrophobicContact CE-SD 4.5Å; M83-M461 HydrophobicContact SD-CE 4.5Å; M83-M461 HydrophobicContact SD-SD 4.35Å
84	L	44.7	Very low	40.5	Very low	89 Å²	89	83.4 Å²	83.4	47%	0.466	47%	0.47	S	S	.	.	H	α-helix	trans	-74	-29.3	-178	-69.7	169.8	0	0	0	113.8	L80 Y81 K88	L80-L84 HydrophobicContact CD2-CD1 3.94Å; L80-L84 HydrophobicContact CD2-CG 4.4Å; L80-L84 VanDerWaalsContact O-CB 3.24Å; L80-L84 WeakPolarHBondContact O-CB 3.2Å; L80-L84 WeakPolarHBondContact O-CD1 3.16Å; L80-L84 WeakPolarHBondContact O-CG 3.17Å; L80-L84 PolarHBondContact O-N 2.92Å; Y81-L84 CarbonylContact O-C 3.53Å; Y81-L84 PolarHBondContact O-N 2.93Å; L84-K88 WeakPolarHBondContact O-CG 3.1Å
85	T	41.6	Very low	39.2	Very low	35 Å²	35	90.1 Å²	90.1	22%	0.215	49%	0.492	C	S	.	.	H	α-helix	trans	-88.7	-30.5	178.8	56.2	0	0	0	0	113.6	Y81 A87 K88 Q89	Y81-T85 HydrophobicContact CD1-CG2 3.91Å; Y81-T85 HydrophobicContact CD2-CG2 3.82Å; Y81-T85 HydrophobicContact CE1-CG2 3.54Å; Y81-T85 HydrophobicContact CE2-CG2 3.46Å; Y81-T85 VanDerWaalsContact CE2-CG2 3.46Å; Y81-T85 HydrophobicContact CG-CG2 4.04Å; Y81-T85 WeakPolarHBondContact O-CB 3.49Å; Y81-T85 WeakPolarHBondContact O-CG2 3.26Å; Y81-T85 PolarHBondContact O-N 2.77Å; Y81-T85 PolarHBondContact O-OG1 2.93Å; T85-A87 PolarHBondContact O-N 3.07Å; T85-K88 PolarHBondContact O-N 3.46Å; T85-Q89 PolarHBondContact O-N 3.21Å
86	S	42.5	Very low	38	Very low	68 Å²	68	89.5 Å²	89.5	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-35.7	169.9	-55	0	0	0	0	110.7	S82 K88	S82-S86 WeakPolarHBondContact O-CB 3.48Å; S82-S86 PolarHBondContact O-N 3.45Å; S82-S86 PolarHBondContact O-OG 3.34Å; S86-K88 VanDerWaalsContact C-N 3.31Å; S86-K88 PolarHBondContact O-N 2.98Å
87	A	36	Very low	37.2	Very low	35 Å²	35	88.4 Å²	88.4	29%	0.289	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.7	174	0	0	0	0	0	114.4	M83 T85	M83-A87 PolarHBondContact O-N 3.49Å; T85-A87 PolarHBondContact O-N 3.07Å
88	K	32.4	Very low	36.4	Very low	164 Å²	164	94.8 Å²	94.8	71%	0.713	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-15.4	-176.1	-78.5	-176.6	178	-175.9	0	114.7	L84 T85 S86 T90	L84-K88 WeakPolarHBondContact O-CG 3.1Å; T85-K88 PolarHBondContact O-N 3.46Å; S86-K88 VanDerWaalsContact C-N 3.31Å; S86-K88 PolarHBondContact O-N 2.98Å; K88-T90 VanDerWaalsContact C-N 3.26Å; K88-T90 PolarHBondContact O-N 3.33Å
89	Q	32.2	Very low	35.4	Very low	168 Å²	168	98.7 Å²	98.7	79%	0.785	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-3.2	-170.8	-91.9	175.8	-13.7	0	0	115.8	T85	T85-Q89 PolarHBondContact O-N 3.21Å
90	T	32.5	Very low	34.3	Very low	103 Å²	103	103.4 Å²	103.4	63%	0.632	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	1.8	-175.4	35.3	0	0	0	0	116	K88	K88-T90 VanDerWaalsContact C-N 3.26Å; K88-T90 PolarHBondContact O-N 3.33Å
91	Y	30.4	Very low	33.8	Very low	186 Å²	186	110.5 Å²	110.5	73%	0.729	63%	0.631	S	S	*	*			trans	-117.6	92.9	179	-76.3	-81.7	0	0	0	113.2	A93	Y91-A93 PolarHBondContact O-N 3.38Å
92	A	26.9	Very low	32.9	Very low	103 Å²	103	109.7 Å²	109.7	85%	0.851	65%	0.647	S	S	*	*			trans	-76.3	104.2	143.2	0	0	0	0	0	107.2
93	A	24	Very low	32.4	Very low	86 Å²	86	113.2 Å²	113.2	71%	0.711	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-77.3	144.6	-174.8	0	0	0	0	0	113	Y91	Y91-A93 PolarHBondContact O-N 3.38Å
94	P	28.2	Very low	32	Very low	125 Å²	125	114 Å²	114	81%	0.812	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-92.3	148.5	146.7	7.4	12.5	0	0	0	110.6
95	K	28	Very low	31.7	Very low	210 Å²	210	116.6 Å²	116.6	91%	0.913	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-57.6	145.9	-171.3	-71.3	176.7	173.7	178	0	115
96	A	25.1	Very low	31.4	Very low	95 Å²	95	115.7 Å²	115.7	79%	0.785	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-76.2	165	171.1	0	0	0	0	0	113.8
97	P	27.5	Very low	31.1	Very low	129 Å²	129	114.9 Å²	114.9	84%	0.838	67%	0.672	S	S	*	*			trans	-117.8	158.4	141.4	34.1	-21.7	0	0	0	112.9
98	E	29.1	Very low	31.1	Very low	191 Å²	191	117.2 Å²	117.2	89%	0.893	69%	0.686	S	S	*	*			trans	-82.7	163.3	-165.3	-69.8	171.7	131.7	0	0	116.6
99	A	26	Very low	31.3	Very low	89 Å²	89	112 Å²	112	74%	0.736	67%	0.67	S	S	*	*			trans	69.1	130	163.3	0	0	0	0	0	117.1
100	T	26	Very low	31.3	Very low	121 Å²	121	106.1 Å²	106.1	74%	0.742	65%	0.653	S	S	*	*				-171.9	143.4	62	-41.3	0	0	0	0	110.5
101	L	35.8	Very low	31.3	Very low	169 Å²	169	107 Å²	107	89%	0.885	66%	0.664	S	S	*	*			trans	38.6	103.2	161.9	-96.8	78	0	0	0	119.5
102	G	28.7	Very low	31.3	Very low	64 Å²	64	104.1 Å²	104.1	66%	0.66	66%	0.661	S	S	*	*			trans	-106.2	154.1	158.3	0	0	0	0	0	112	C104	G102-C104 PolarHBondContact O-N 3.06Å
103	P	35.3	Very low	31.5	Very low	119 Å²	119	104.3 Å²	104.3	77%	0.773	65%	0.653	S	S	*	*			trans	-71.2	117.9	-176.9	27.5	-31.6	0	0	0	111.6
104	C	38.9	Very low	32	Very low	46 Å²	46	104.1 Å²	104.1	31%	0.311	66%	0.66	S	S	.	*			trans	-80.4	125.2	178.7	-178.9	0	0	0	0	111.3	G102 G106 C132 C135	G102-C104 PolarHBondContact O-N 3.06Å; C104-G106 PolarHBondContact O-N 3.17Å; C104-C132 PolarHBondContact SG-SG 2.96Å; C104-C135 PolarHBondContact SG-SG 3.2Å
105	W	38	Very low	32.4	Very low	143 Å²	143	104.4 Å²	104.4	54%	0.542	66%	0.659	S	S	.	*			trans	-92.7	88.5	175.2	-66	79.8	0	0	0	109.1	T375 A379	W105-T375 HydrophobicContact CH2-CG2 3.2Å; W105-T375 HydrophobicContact CZ2-CG2 3.07Å; W105-T375 HydrophobicContact CZ3-CG2 4.39Å; W105-A379 HydrophobicContact CH2-CB 4.42Å; W105-A379 HydrophobicContact CZ3-CB 4.2Å
106	G	36.1	Very low	32.5	Very low	15 Å²	15	97.3 Å²	97.3	16%	0.155	65%	0.646	C	S	.	*			trans	-59.2	148.6	-168	0	0	0	0	0	117.1	C104 Y130	C104-G106 PolarHBondContact O-N 3.17Å; G106-Y130 WeakPolarHBondContact CA-OH 3.33Å
107	C	36.5	Very low	33	Very low	52 Å²	52	105.2 Å²	105.2	35%	0.351	66%	0.655	S	S	.	*			trans	-100	142.7	170.4	177	0	0	0	0	110.9	C109 Y130	C107-C109 VanDerWaalsContact C-N 3.26Å; C107-C109 WeakPolarHBondContact CB-SG 3.36Å; C107-C109 PolarHBondContact O-N 3.18Å; C107-C109 WeakPolarHBondContact SG-CB 3.42Å; C107-C109 PolarHBondContact SG-N 2.79Å; C107-C109 VanDerWaalsContact SG-N 3.38Å; C107-C109 CovalentContact SG-SG 2.06Å; C107-C109 PolarHBondContact SG-SG 3.36Å; C107-Y130 WeakPolarHBondContact O-CD2 3.3Å; C107-Y130 WeakPolarHBondContact O-CE2 3.43Å
108	S	34.6	Very low	33.1	Very low	84 Å²	84	103.7 Å²	103.7	59%	0.587	65%	0.654	S	S	*	*			trans	-89.2	54.1	167.7	-66	0	0	0	0	112.1
109	C	36.8	Very low	33.6	Very low	55 Å²	55	98.4 Å²	98.4	37%	0.372	65%	0.65	S	S	.	*			trans	-118.4	83.6	175.5	43.5	0	0	0	0	108.8	C107 C133	C107-C109 VanDerWaalsContact C-N 3.26Å; C107-C109 WeakPolarHBondContact CB-SG 3.36Å; C107-C109 PolarHBondContact O-N 3.18Å; C107-C109 WeakPolarHBondContact SG-CB 3.42Å; C107-C109 PolarHBondContact SG-N 2.79Å; C107-C109 VanDerWaalsContact SG-N 3.38Å; C107-C109 CovalentContact SG-SG 2.06Å; C107-C109 PolarHBondContact SG-SG 3.36Å; C109-C133 PolarHBondContact O-SG 2.85Å; C109-C133 PolarHBondContact SG-SG 3.03Å
110	G	32.2	Very low	33.8	Very low	43 Å²	43	102.2 Å²	102.2	44%	0.443	66%	0.657	S	S	.	*			trans	-150.6	110.5	173.6	0	0	0	0	0	109.9
111	S	32.7	Very low	34.5	Very low	122 Å²	122	102.6 Å²	102.6	85%	0.853	66%	0.662	S	S	*	*			trans	-58.9	141	164.9	-49.8	0	0	0	0	109.1
112	D	31.9	Very low	34.4	Very low	125 Å²	125	97.8 Å²	97.8	67%	0.668	65%	0.653	S	S	*	*			trans	-53.6	130.1	174.4	-85.5	-37.1	0	0	0	109.7	G114	D112-G114 PolarHBondContact O-N 3.04Å
113	P	31.3	Very low	35	Very low	107 Å²	107	99 Å²	99	70%	0.695	67%	0.666	S	S	*	*			trans	-64	111.3	162	4.6	7	0	0	0	106.2	V115	P113-V115 VanDerWaalsContact C-N 3.32Å; P113-V115 HydrophobicContact CB-CG2 4.42Å; P113-V115 PolarHBondContact O-N 3.19Å
114	G	34.1	Very low	34.8	Very low	82 Å²	82	103.9 Å²	103.9	85%	0.845	67%	0.669	S	S	*	*			trans	-59.9	97	169.4	0	0	0	0	0	108.9	D112	D112-G114 PolarHBondContact O-N 3.04Å
115	V	36.3	Very low	34.5	Very low	131 Å²	131	107.8 Å²	107.8	79%	0.794	69%	0.694	S	S	*	*			trans	-100.2	109.8	171.2	179.8	0	0	0	0	107.7	P113	P113-V115 VanDerWaalsContact C-N 3.32Å; P113-V115 HydrophobicContact CB-CG2 4.42Å; P113-V115 PolarHBondContact O-N 3.19Å
116	G	30.5	Very low	34.5	Very low	62 Å²	62	106.9 Å²	106.9	64%	0.639	70%	0.704	S	S	*	*			trans	-54.7	147.4	174.3	0	0	0	0	0	112.4	A118	G116-A118 PolarHBondContact O-N 3.05Å
117	R	34.6	Very low	34.8	Very low	260 Å²	260	109.4 Å²	109.4	98%	0.981	72%	0.723	S	S	*	*			trans	-57.7	101	175.9	-161.3	-177.2	-160.8	-150.3	5.5	110.4
118	A	31	Very low	35.3	Very low	98 Å²	98	111.9 Å²	111.9	81%	0.81	73%	0.733	S	S	*	*			trans	-144.1	109.7	158.7	0	0	0	0	0	108	G116	G116-A118 PolarHBondContact O-N 3.05Å
119	G	38.3	Very low	35.9	Very low	79 Å²	79	112.5 Å²	112.5	81%	0.814	73%	0.729	S	S	*	*			trans	-74.6	148	-172.7	0	0	0	0	0	113.3
120	L	30.9	Very low	36.5	Very low	169 Å²	169	111.5 Å²	111.5	89%	0.885	72%	0.717	S	S	*	*			trans	-146.5	141.2	154.8	-93.4	161.6	0	0	0	108.4
121	P	40.8	Very low	37.1	Very low	129 Å²	129	117.5 Å²	117.5	84%	0.838	73%	0.727	S	S	*	*			trans	-88.8	123	-173.6	34.1	-28.7	0	0	0	110
122	G	34	Very low	37.8	Very low	68 Å²	68	111.8 Å²	111.8	70%	0.701	69%	0.686	S	S	*	*			trans	176	97.2	174.6	0	0	0	0	0	109.7	R124	G122-R124 PolarHBondContact O-N 3.36Å
123	G	40.8	Very low	38.3	Very low	91 Å²	91	110.4 Å²	110.4	94%	0.938	69%	0.685	S	S	*	*			trans	-60.4	95.6	176.1	0	0	0	0	0	111
124	R	31.8	Very low	38.5	Very low	221 Å²	221	113 Å²	113	83%	0.834	69%	0.686	S	S	*	*			trans	-117.6	140.4	155.1	-85.5	-173.9	178.7	-163.6	0.1	107.9	G122 V126	G122-R124 PolarHBondContact O-N 3.36Å; R124-V126 PolarHBondContact O-N 2.82Å
125	P	31.8	Very low	39	Very low	127 Å²	127	111.6 Å²	111.6	83%	0.825	66%	0.663	S	S	*	*			trans	-60.4	112.1	172.7	25.6	-30.7	0	0	0	107.5	A127	P125-A127 VanDerWaalsContact C-N 3.29Å; P125-A127 PolarHBondContact O-N 3.19Å
126	V	38.8	Very low	39.3	Very low	125 Å²	125	106.9 Å²	106.9	76%	0.758	64%	0.641	S	S	*	*			trans	-69.1	95.3	173.1	179.2	0	0	0	0	105.9	R124 L128	R124-V126 PolarHBondContact O-N 2.82Å; V126-L128 PolarHBondContact O-N 3.44Å
127	A	41.3	Very low	40.2	Very low	67 Å²	67	110 Å²	110	55%	0.554	64%	0.638	S	S	*	*			trans	-62.4	109.4	168.2	0	0	0	0	0	106.4	P125 L129	P125-A127 VanDerWaalsContact C-N 3.29Å; P125-A127 PolarHBondContact O-N 3.19Å; A127-L129 PolarHBondContact O-N 3.36Å
128	L	46.2	Very low	40.9	Very low	105 Å²	105	102 Å²	102	55%	0.55	62%	0.615	S	S	.	*			trans	-63.5	101.6	173	-68.1	168.1	0	0	0	107	V126 R141	V126-L128 PolarHBondContact O-N 3.44Å; L128-R141 HydrophobicContact CB-CG 4.25Å; L128-R141 WeakPolarHBondContact O-CB 3.4Å; L128-R141 VanDerWaalsContact O-CG 3.25Å; L128-R141 WeakPolarHBondContact O-CG 3.28Å; L128-R141 PolarHBondContact O-N 2.86Å; L128-R141 VanDerWaalsContact O-N 3.08Å
129	L	47.3	Very low	41.7	Very low	97 Å²	97	100.1 Å²	100.1	51%	0.508	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84	147.8	172.8	-66.4	168.2	0	0	0	108.7	A127 D138 H139 P140	A127-L129 PolarHBondContact O-N 3.36Å; L129-D138 HydrophobicContact CB-CB 4.29Å; L129-D138 HydrophobicContact CD1-CB 4.47Å; L129-H139 CarbonylContact C-O 3.52Å; L129-H139 VanDerWaalsContact CA-O 3.26Å; L129-H139 WeakPolarHBondContact CA-O 3.31Å; L129-H139 VanDerWaalsContact CD2-C 3.49Å; L129-P140 HydrophobicContact CD2-CB 4.33Å
130	Y	50.3	Low	42.2	Very low	34 Å²	34	100 Å²	100	13%	0.133	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.8	142.7	167.2	75.2	-82.2	0	0	0	109.5	G106 C107 C132 D138 H139 R141	G106-Y130 WeakPolarHBondContact CA-OH 3.33Å; C107-Y130 WeakPolarHBondContact O-CD2 3.3Å; C107-Y130 WeakPolarHBondContact O-CE2 3.43Å; Y130-C132 HydrophobicContact CE2-CB 4.28Å; Y130-D138 WeakPolarHBondContact O-CA 3.16Å; Y130-H139 HydrophobicContact CD1-CB 4.38Å; Y130-H139 VanDerWaalsContact CD1-O 3.25Å; Y130-H139 WeakPolarHBondContact CD1-O 3.41Å; Y130-H139 HydrophobicContact CE1-CB 3.78Å; Y130-H139 PolarHBondContact N-O 3.14Å; Y130-H139 PolarHBondContact O-N 3.14Å; Y130-R141 HydrophobicContact CD1-CG 4.14Å
131	R	45.5	Very low	42.8	Very low	169 Å²	169	96.9 Å²	96.9	64%	0.638	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.2	122.1	176.7	-162.5	167.5	-174	169	1.3	109.9	G136 D138	R131-G136 PolarHBondContact NE-O 3.16Å; R131-G136 PolarHBondContact NH2-O 3.45Å; R131-D138 VanDerWaalsContact CA-OD1 3.24Å; R131-D138 WeakPolarHBondContact CA-OD1 3.29Å; R131-D138 WeakPolarHBondContact CB-OD1 3.48Å; R131-D138 WeakPolarHBondContact CG-OD1 3.47Å; R131-D138 PolarHBondContact N-OD1 3.5Å
132	C	46	Very low	42.9	Very low	1 Å²	1	100.1 Å²	100.1	1%	0.007	56%	0.555	C	S	.	*			trans	-79.5	123.2	-178.4	179.7	0	0	0	0	111.2	C104 Y130 F134 C135 G136 E137	C104-C132 PolarHBondContact SG-SG 2.96Å; Y130-C132 HydrophobicContact CE2-CB 4.28Å; C132-F134 PolarHBondContact O-N 3.27Å; C132-F134 VanDerWaalsContact O-N 3.12Å; C132-F134 PolarHBondContact SG-N 3.05Å; C132-F134 VanDerWaalsContact SG-N 3.37Å; C132-C135 VanDerWaalsContact CB-SG 3.55Å; C132-G136 VanDerWaalsContact O-CA 3.28Å; C132-G136 WeakPolarHBondContact O-CA 3.18Å; C132-G136 PolarHBondContact O-N 3.38Å; C132-E137 PolarHBondContact N-O 3.05Å
133	C	42	Very low	43	Very low	96 Å²	96	99.9 Å²	99.9	65%	0.649	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-9.8	176	-63	0	0	0	0	114.5	C109	C109-C133 PolarHBondContact O-SG 2.85Å; C109-C133 PolarHBondContact SG-SG 3.03Å
134	F	37.1	Very low	43	Very low	161 Å²	161	96.5 Å²	96.5	71%	0.706	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-42.5	-179.2	-165.7	-98	0	0	0	113.2	C132	C132-F134 PolarHBondContact O-N 3.27Å; C132-F134 VanDerWaalsContact O-N 3.12Å; C132-F134 PolarHBondContact SG-N 3.05Å; C132-F134 VanDerWaalsContact SG-N 3.37Å
135	C	43.4	Very low	43.6	Very low	54 Å²	54	87.6 Å²	87.6	37%	0.365	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-11.9	179.6	62.8	0	0	0	0	114.3	C104 C132 E137	C104-C135 PolarHBondContact SG-SG 3.2Å; C132-C135 VanDerWaalsContact CB-SG 3.55Å; C135-E137 PolarHBondContact O-N 3.28Å
136	G	43.8	Very low	43.8	Very low	31 Å²	31	83.8 Å²	83.8	32%	0.32	46%	0.456	S	S	.	.	S	Bend	trans	79.7	-3.1	-177.6	0	0	0	0	0	115.5	R131 C132	R131-G136 PolarHBondContact NE-O 3.16Å; R131-G136 PolarHBondContact NH2-O 3.45Å; C132-G136 VanDerWaalsContact O-CA 3.28Å; C132-G136 WeakPolarHBondContact O-CA 3.18Å; C132-G136 PolarHBondContact O-N 3.38Å
137	E	49.3	Very low	43.9	Very low	127 Å²	127	83.6 Å²	83.6	59%	0.593	44%	0.442	S	S	*	.			trans	-95.9	158.7	-175.5	-61.5	-62.2	146.1	0	0	113.4	C132 C135	C132-E137 PolarHBondContact N-O 3.05Å; C135-E137 PolarHBondContact O-N 3.28Å
138	D	48.8	Very low	43.7	Very low	93 Å²	93	83.2 Å²	83.2	50%	0.497	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.8	179.7	-71.1	-37.8	0	0	0	112.6	L129 Y130 R131	L129-D138 HydrophobicContact CB-CB 4.29Å; L129-D138 HydrophobicContact CD1-CB 4.47Å; Y130-D138 WeakPolarHBondContact O-CA 3.16Å; R131-D138 VanDerWaalsContact CA-OD1 3.24Å; R131-D138 WeakPolarHBondContact CA-OD1 3.29Å; R131-D138 WeakPolarHBondContact CB-OD1 3.48Å; R131-D138 WeakPolarHBondContact CG-OD1 3.47Å; R131-D138 PolarHBondContact N-OD1 3.5Å
139	H	47.5	Very low	43.4	Very low	58 Å²	58	80.2 Å²	80.2	27%	0.269	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.4	-178.5	-64.8	-62.4	0	0	0	113.6	L129 Y130	L129-H139 CarbonylContact C-O 3.52Å; L129-H139 VanDerWaalsContact CA-O 3.26Å; L129-H139 WeakPolarHBondContact CA-O 3.31Å; L129-H139 VanDerWaalsContact CD2-C 3.49Å; Y130-H139 HydrophobicContact CD1-CB 4.38Å; Y130-H139 VanDerWaalsContact CD1-O 3.25Å; Y130-H139 WeakPolarHBondContact CD1-O 3.41Å; Y130-H139 HydrophobicContact CE1-CB 3.78Å; Y130-H139 PolarHBondContact N-O 3.14Å; Y130-H139 PolarHBondContact O-N 3.14Å
140	P	48.7	Very low	43	Very low	76 Å²	76	79.4 Å²	79.4	49%	0.494	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	136.3	177.1	27.5	-32.9	0	0	0	112.2	L129 Q142	L129-P140 HydrophobicContact CD2-CB 4.33Å; P140-Q142 PolarHBondContact O-N 3.14Å; P140-Q142 VanDerWaalsContact O-N 3.16Å
141	R	44	Very low	42.5	Very low	105 Å²	105	80 Å²	80	40%	0.396	42%	0.423	S	S	.	.	S	Bend	trans	-62.8	-18.1	-177.9	-81.3	-175.7	-173.2	-137.2	5	115.5	L128 Y130 G143	L128-R141 HydrophobicContact CB-CG 4.25Å; L128-R141 WeakPolarHBondContact O-CB 3.4Å; L128-R141 VanDerWaalsContact O-CG 3.25Å; L128-R141 WeakPolarHBondContact O-CG 3.28Å; L128-R141 PolarHBondContact O-N 2.86Å; L128-R141 VanDerWaalsContact O-N 3.08Å; Y130-R141 HydrophobicContact CD1-CG 4.14Å; R141-G143 PolarHBondContact O-N 3.41Å; R141-G143 VanDerWaalsContact O-N 3.17Å
142	Q	42.8	Very low	42.1	Very low	196 Å²	196	73.9 Å²	73.9	92%	0.916	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	86.1	173.5	-75.9	174.6	-2.8	0	0	109.9	P140	P140-Q142 PolarHBondContact O-N 3.14Å; P140-Q142 VanDerWaalsContact O-N 3.16Å
143	G	36.4	Very low	41.4	Very low	63 Å²	63	77 Å²	77	65%	0.649	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.2	-9.9	173.8	0	0	0	0	0	117.8	R141 I145	R141-G143 PolarHBondContact O-N 3.41Å; R141-G143 VanDerWaalsContact O-N 3.17Å; G143-I145 PolarHBondContact O-N 3.45Å
144	S	40.8	Very low	40.9	Very low	21 Å²	21	81.6 Å²	81.6	15%	0.147	44%	0.44	C	S	.	.			trans	-80.4	116.8	177.9	109.8	0	0	0	0	110	L146 Y147 S148	S144-L146 PolarHBondContact O-N 3Å; S144-Y147 WeakPolarHBondContact O-CB 3.47Å; S144-Y147 PolarHBondContact O-N 2.89Å; S144-Y147 WeakPolarHBondContact OG-CB 3.27Å; S144-Y147 PolarHBondContact OG-N 3.4Å; S144-S148 PolarHBondContact O-N 3.29Å
145	I	43.8	Very low	40.9	Very low	34 Å²	34	81.1 Å²	81.1	17%	0.174	44%	0.44	C	S	.	.	H	α-helix	trans	-56.8	-31.7	177.1	-65.1	168.9	0	0	0	110.7	G143 S148 L149 K376 Y380	G143-I145 PolarHBondContact O-N 3.45Å; I145-S148 PolarHBondContact O-N 3.31Å; I145-L149 HydrophobicContact CG2-CD1 4.39Å; I145-L149 WeakPolarHBondContact O-CG 3.42Å; I145-L149 PolarHBondContact O-N 2.89Å; I145-L149 VanDerWaalsContact O-N 3.14Å; I145-K376 HydrophobicContact CD1-CB 4.06Å; I145-K376 HydrophobicContact CD1-CD 3.79Å; I145-K376 HydrophobicContact CD1-CG 3.61Å; I145-K376 HydrophobicContact CG1-CD 4.48Å; I145-Y380 HydrophobicContact CG2-CD1 4.31Å; I145-Y380 HydrophobicContact CG2-CE1 3.27Å; I145-Y380 WeakPolarHBondContact CG2-OH 3.38Å
146	L	35.6	Very low	40.2	Very low	47 Å²	47	83.4 Å²	83.4	25%	0.246	45%	0.453	C	S	.	.	H	α-helix	trans	-65.9	-37.9	174.5	-74.7	163.9	0	0	0	113.1	S144 L149 L150 L272	S144-L146 PolarHBondContact O-N 3Å; L146-L149 PolarHBondContact O-N 3.42Å; L146-L150 WeakPolarHBondContact O-CB 3.27Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 3.03Å; L146-L272 HydrophobicContact CD2-CD2 3.6Å
147	Y	40.4	Very low	39.7	Very low	121 Å²	121	90.6 Å²	90.6	48%	0.475	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-43.4	175.7	-178.6	-96.4	0	0	0	110.8	S144 L149 L150 T151	S144-Y147 WeakPolarHBondContact O-CB 3.47Å; S144-Y147 PolarHBondContact O-N 2.89Å; S144-Y147 WeakPolarHBondContact OG-CB 3.27Å; S144-Y147 PolarHBondContact OG-N 3.4Å; Y147-L149 VanDerWaalsContact C-N 3.33Å; Y147-L149 PolarHBondContact O-N 3.34Å; Y147-L150 PolarHBondContact O-N 3.29Å; Y147-T151 HydrophobicContact CD1-CG2 4.18Å; Y147-T151 HydrophobicContact CD2-CG2 4.35Å; Y147-T151 HydrophobicContact CE1-CG2 3.79Å; Y147-T151 HydrophobicContact CE2-CG2 3.97Å; Y147-T151 HydrophobicContact CG-CG2 4.45Å; Y147-T151 PolarHBondContact O-N 2.83Å; Y147-T151 PolarHBondContact O-OG1 3.25Å
148	S	38.9	Very low	38.6	Very low	58 Å²	58	91.4 Å²	91.4	41%	0.406	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-39.7	175.6	-57.5	0	0	0	0	112.8	S144 I145 T151 S152	S144-S148 PolarHBondContact O-N 3.29Å; I145-S148 PolarHBondContact O-N 3.31Å; S148-T151 PolarHBondContact O-OG1 3.39Å; S148-S152 VanDerWaalsContact O-CB 3.31Å; S148-S152 WeakPolarHBondContact O-CB 3.4Å; S148-S152 PolarHBondContact O-N 2.95Å; S148-S152 VanDerWaalsContact O-N 3.12Å
149	L	38.1	Very low	37.6	Very low	43 Å²	43	91.2 Å²	91.2	23%	0.225	50%	0.502	C	S	.	.	H	α-helix	trans	-63.3	-42.5	174.3	-76.7	163.9	0	0	0	112	I145 L146 Y147 I410	I145-L149 HydrophobicContact CG2-CD1 4.39Å; I145-L149 WeakPolarHBondContact O-CG 3.42Å; I145-L149 PolarHBondContact O-N 2.89Å; I145-L149 VanDerWaalsContact O-N 3.14Å; L146-L149 PolarHBondContact O-N 3.42Å; Y147-L149 VanDerWaalsContact C-N 3.33Å; Y147-L149 PolarHBondContact O-N 3.34Å; L149-I410 HydrophobicContact CB-CD1 4.19Å; L149-I410 HydrophobicContact CD2-CD1 3.43Å; L149-I410 VanDerWaalsContact CD2-CD1 3.43Å; L149-I410 HydrophobicContact CD2-CG1 4.29Å; L149-I410 HydrophobicContact CG-CD1 3.57Å
150	L	38.8	Very low	36.6	Very low	79 Å²	79	94.6 Å²	94.6	41%	0.414	53%	0.529	S	S	.	.	H	α-helix	trans	-74.8	-31.8	-178.1	-71.3	167.5	0	0	0	113.4	L146 Y147	L146-L150 WeakPolarHBondContact O-CB 3.27Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 3.03Å; Y147-L150 PolarHBondContact O-N 3.29Å
151	T	41.4	Very low	35.5	Very low	47 Å²	47	95.9 Å²	95.9	29%	0.288	55%	0.546	S	S	.	.	H	α-helix	trans	-83.4	-27.9	178.6	54	0	0	0	0	113.4	Y147 S148 K154	Y147-T151 HydrophobicContact CD1-CG2 4.18Å; Y147-T151 HydrophobicContact CD2-CG2 4.35Å; Y147-T151 HydrophobicContact CE1-CG2 3.79Å; Y147-T151 HydrophobicContact CE2-CG2 3.97Å; Y147-T151 HydrophobicContact CG-CG2 4.45Å; Y147-T151 PolarHBondContact O-N 2.83Å; Y147-T151 PolarHBondContact O-OG1 3.25Å; S148-T151 PolarHBondContact O-OG1 3.39Å; T151-K154 PolarHBondContact O-N 3.39Å
152	S	35.9	Very low	34.5	Very low	40 Å²	40	95.3 Å²	95.3	28%	0.28	56%	0.564	S	S	.	*	H	α-helix	trans	-68.4	-37.5	175.4	178.9	0	0	0	0	112.3	S148 K154 Q155	S148-S152 VanDerWaalsContact O-CB 3.31Å; S148-S152 WeakPolarHBondContact O-CB 3.4Å; S148-S152 PolarHBondContact O-N 2.95Å; S148-S152 VanDerWaalsContact O-N 3.12Å; S152-K154 PolarHBondContact O-N 3.48Å; S152-K154 VanDerWaalsContact O-N 3.15Å; S152-Q155 PolarHBondContact O-N 3.42Å
153	A	31.7	Very low	34.3	Very low	66 Å²	66	91.3 Å²	91.3	55%	0.545	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-14	177.9	0	0	0	0	0	114.2
154	K	32.6	Very low	33.8	Very low	194 Å²	194	97.3 Å²	97.3	84%	0.843	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-3.9	172.3	-75	-169	175.3	-175.4	0	113.9	T151 S152	T151-K154 PolarHBondContact O-N 3.39Å; S152-K154 PolarHBondContact O-N 3.48Å; S152-K154 VanDerWaalsContact O-N 3.15Å
155	Q	36	Very low	32.9	Very low	150 Å²	150	101.2 Å²	101.2	70%	0.701	60%	0.599	S	S	*	*			trans	-109.7	7.9	-168.9	-82.2	178.2	-13	0	0	115.8	S152 H157	S152-Q155 PolarHBondContact O-N 3.42Å; Q155-H157 PolarHBondContact O-N 2.89Å; Q155-H157 VanDerWaalsContact O-N 3.1Å
156	T	29.1	Very low	32	Very low	102 Å²	102	111 Å²	111	63%	0.626	63%	0.634	S	S	*	*			trans	-87.8	62.4	169.8	56.5	0	0	0	0	111.6
157	H	32.4	Very low	31.9	Very low	183 Å²	183	113.9 Å²	113.9	85%	0.847	66%	0.656	S	S	*	*			trans	-157.3	97.7	147.8	-84.8	-66.1	0	0	0	107	Q155	Q155-H157 PolarHBondContact O-N 2.89Å; Q155-H157 VanDerWaalsContact O-N 3.1Å
158	V	27.7	Very low	31.1	Very low	144 Å²	144	114.9 Å²	114.9	87%	0.873	67%	0.674	S	S	*	*			trans	173.7	127	137.3	157.3	0	0	0	0	107.5
159	A	26.1	Very low	30.4	Very low	88 Å²	88	115.1 Å²	115.1	73%	0.727	69%	0.686	S	S	*	*			trans	-75.9	150.4	179.9	0	0	0	0	0	112.1
160	P	26.6	Very low	29.9	Very low	130 Å²	130	117 Å²	117	84%	0.844	71%	0.708	S	S	*	*			trans	-93	130.6	163.4	33.4	-25.1	0	0	0	110.3
161	A	27.1	Very low	29.1	Very low	103 Å²	103	123 Å²	123	85%	0.851	73%	0.725	S	S	*	*			trans	-136.7	119.4	147.3	0	0	0	0	0	107.9
162	A	23	Very low	28.3	Very low	93 Å²	93	130.6 Å²	130.6	77%	0.769	75%	0.748	S	S	*	*			trans	-83.6	177.7	173.2	0	0	0	0	0	110.2
163	P	37.2	Very low	27.6	Very low	111 Å²	111	134.7 Å²	134.7	72%	0.721	77%	0.767	S	S	*	*			cis	-135.9	170.8	-1.3	35.4	-15	0	0	0	116.6
164	E	26.8	Very low	27.2	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	78%	0.779	S	S	*	*			trans	89	136.8	142.6	-86.6	178.5	-158.4	0	0	125
165	A	22.8	Very low	26.8	Very low	102 Å²	102	136.7 Å²	136.7	84%	0.843	77%	0.769	S	S	*	*			trans	85.3	114.5	160.9	0	0	0	0	0	121.1
166	R	23.1	Very low	26.2	Very low	239 Å²	239	139.3 Å²	139.3	90%	0.902	77%	0.774	S	S	*	*			trans	-62.7	179.4	166	-77	-178.9	173.8	178.6	-1	113.1
167	P	34.7	Very low	25.9	Very low	109 Å²	109	143.2 Å²	143.2	71%	0.708	78%	0.783	S	S	*	*			cis	-137.9	-179.2	-9.2	24.9	0.4	0	0	0	115.4
168	V	23.4	Very low	25.5	Very low	141 Å²	141	138.3 Å²	138.3	86%	0.855	77%	0.774	S	S	*	*			trans	87.7	119.2	153.8	-163.4	0	0	0	0	118.4
169	G	23.7	Very low	25.2	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	77%	0.773	S	S	*	*				94	94.4	129.8	0	0	0	0	0	118.1
170	A	27.3	Very low	25.3	Very low	82 Å²	82	147.4 Å²	147.4	68%	0.678	78%	0.782	S	S	*	*				56.2	128.3	127	0	0	0	0	0	120.2
171	W	22	Very low	25.4	Very low	205 Å²	205	147.4 Å²	147.4	78%	0.777	78%	0.782	S	S	*	*			trans	84.2	135.3	160.1	-55	11.9	0	0	0	112.3
172	W	24.3	Very low	25.2	Very low	206 Å²	206	145.6 Å²	145.6	78%	0.78	77%	0.774	S	S	*	*			cis	-151.5	145.2	41.1	-56	80.7	0	0	0	107.8
173	D	23	Very low	25.2	Very low	127 Å²	127	148.2 Å²	148.2	68%	0.679	78%	0.78	S	S	*	*				49.2	124.9	74.7	-147.8	17.3	0	0	0	115.8
174	R	23	Very low	24.7	Very low	210 Å²	210	154.1 Å²	154.1	79%	0.792	79%	0.787	S	S	*	*			trans	62.5	120.6	152.5	-90.4	170.9	172.7	-165.3	-1	122.6
175	S	22.8	Very low	24.6	Very low	91 Å²	91	154.6 Å²	154.6	64%	0.636	79%	0.79	S	S	*	*				94	103	119.9	-64.2	0	0	0	0	119.6
176	Y	23.7	Very low	24.6	Very low	205 Å²	205	154.5 Å²	154.5	80%	0.804	79%	0.789	S	S	*	*				56.5	126.9	115.6	-82	-70.8	0	0	0	121.7
177	F	23.1	Very low	24.9	Very low	184 Å²	184	150.7 Å²	150.7	81%	0.807	79%	0.786	S	S	*	*			trans	90.9	127.4	137.2	-93.9	-70.8	0	0	0	121.6
178	A	23.8	Very low	24.7	Very low	80 Å²	80	151.7 Å²	151.7	66%	0.661	79%	0.792	S	S	*	*			trans	75.3	131.5	145.1	0	0	0	0	0	114.7
179	Q	22.4	Very low	24.8	Very low	184 Å²	184	148 Å²	148	86%	0.86	78%	0.782	S	S	*	*				-169.1	154.2	50.9	-83.1	176.7	12.8	0	0	110.9
180	R	28.1	Very low	24.8	Very low	239 Å²	239	149 Å²	149	90%	0.902	79%	0.793	S	S	*	*			trans	-67	152	158.7	-90.2	-173.9	-173.4	-178.1	3	109.8
181	P	28.1	Very low	24.7	Very low	130 Å²	130	156.7 Å²	156.7	84%	0.844	80%	0.804	S	S	*	*				-138.8	160.5	75.6	22.6	0.8	0	0	0	111.5
182	G	23.1	Very low	24.9	Very low	66 Å²	66	151.7 Å²	151.7	68%	0.68	81%	0.807	S	S	*	*			cis	121.4	137.3	40.2	0	0	0	0	0	107.8
183	V	23	Very low	25	Very low	148 Å²	148	150.3 Å²	150.3	90%	0.897	81%	0.811	S	S	*	*			trans	103.9	102.6	166.7	-166.9	0	0	0	0	118
184	R	26.2	Very low	25.1	Very low	234 Å²	234	147.3 Å²	147.3	88%	0.883	81%	0.811	S	S	*	*			trans	2.1	133.6	143.8	-89.1	176.8	170.3	-148.4	-1.7	119.2
185	E	24.5	Very low	25.3	Very low	200 Å²	200	143.7 Å²	143.7	94%	0.935	81%	0.806	S	S	*	*				-165.2	165.7	114.9	-105.2	158.9	-175.8	0	0	112.5
186	A	23.3	Very low	25.4	Very low	101 Å²	101	147.5 Å²	147.5	84%	0.835	82%	0.819	S	S	*	*			trans	-88.4	159	-143.1	0	0	0	0	0	117.8
187	L	30.4	Very low	25.7	Very low	159 Å²	159	145.4 Å²	145.4	83%	0.832	81%	0.81	S	S	*	*			trans	-53.7	160.3	172.5	-100.4	121.3	0	0	0	115.4
188	P	30.1	Very low	25.7	Very low	129 Å²	129	147.6 Å²	147.6	84%	0.838	81%	0.813	S	S	*	*				-149.2	143.5	74.8	35.3	-13.9	0	0	0	119
189	G	24.9	Very low	25.7	Very low	63 Å²	63	149.8 Å²	149.8	65%	0.649	82%	0.822	S	S	*	*				69.3	77.3	129.6	0	0	0	0	0	119.6	R191	G189-R191 PolarHBondContact O-N 2.93Å
190	G	24.3	Very low	25.9	Very low	85 Å²	85	145.9 Å²	145.9	88%	0.876	81%	0.814	S	S	*	*			trans	-75.4	114.4	165.1	0	0	0	0	0	112.2
191	R	25.3	Very low	25.9	Very low	244 Å²	244	143.8 Å²	143.8	92%	0.921	81%	0.812	S	S	*	*			trans	-64.2	135.9	168	-83.6	-179.2	-175.6	-172.6	0.6	110.8	G189 M193	G189-R191 PolarHBondContact O-N 2.93Å; R191-M193 PolarHBondContact O-N 3.31Å
192	A	24.8	Very low	25.8	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	82%	0.817	S	S	*	*			trans	-60.6	124.7	166	0	0	0	0	0	110.2	G194	A192-G194 PolarHBondContact O-N 2.91Å
193	M	26.3	Very low	25.8	Very low	177 Å²	177	144.4 Å²	144.4	87%	0.872	82%	0.818	S	S	*	*			trans	-83.2	92.3	179.9	-161.3	175.3	-78.5	0	0	108.9	R191 L195	R191-M193 PolarHBondContact O-N 3.31Å; M193-L195 PolarHBondContact O-N 2.78Å
194	G	26.4	Very low	26	Very low	65 Å²	65	146.5 Å²	146.5	67%	0.67	82%	0.818	S	S	*	*			trans	-75.7	110.3	169.2	0	0	0	0	0	110	A192 L196	A192-G194 PolarHBondContact O-N 2.91Å; G194-L196 PolarHBondContact O-N 2.67Å
195	L	27.7	Very low	25.9	Very low	133 Å²	133	142.9 Å²	142.9	70%	0.696	82%	0.816	S	S	*	*			trans	-74.1	91.7	173.9	-70.8	167.7	0	0	0	109.5	M193 Y197	M193-L195 PolarHBondContact O-N 2.78Å; L195-Y197 HydrophobicContact CB-CE2 4.15Å; L195-Y197 PolarHBondContact O-N 2.88Å
196	L	23.8	Very low	25.9	Very low	172 Å²	172	142.3 Å²	142.3	90%	0.901	81%	0.813	S	S	*	*			trans	-74.9	105.2	166.8	-81	160	0	0	0	109	G194 R198	G194-L196 PolarHBondContact O-N 2.67Å; L196-R198 PolarHBondContact O-N 3.38Å
197	Y	29.4	Very low	26.2	Very low	160 Å²	160	143.3 Å²	143.3	63%	0.627	81%	0.811	S	S	*	*			trans	-77.2	111.5	172.5	-80	-89.9	0	0	0	110.2	L195	L195-Y197 HydrophobicContact CB-CE2 4.15Å; L195-Y197 PolarHBondContact O-N 2.88Å
198	R	23.7	Very low	26	Very low	231 Å²	231	144.9 Å²	144.9	87%	0.872	81%	0.814	S	S	*	*			trans	-93.1	114.7	169.9	-164.7	176.1	-169	178	2.6	108.3	L196	L196-R198 PolarHBondContact O-N 3.38Å
199	C	23.8	Very low	25.8	Very low	125 Å²	125	148.2 Å²	148.2	85%	0.845	82%	0.819	S	S	*	*			trans	-83	117.2	179	-166.9	0	0	0	0	109.4
200	C	26.4	Very low	25.8	Very low	102 Å²	102	148.7 Å²	148.7	69%	0.689	82%	0.823	S	S	*	*			trans	-117.7	115.6	168.5	-67.8	0	0	0	0	108.1
201	F	27.9	Very low	25.8	Very low	196 Å²	196	150.6 Å²	150.6	86%	0.86	82%	0.823	S	S	*	*			trans	-157.5	114.9	158.7	-108.7	-78.2	0	0	0	110.2
202	C	25.9	Very low	26	Very low	140 Å²	140	145 Å²	145	95%	0.946	82%	0.816	S	S	*	*			trans	-139.8	117.8	146.2	-79.6	0	0	0	0	105.8
203	G	24	Very low	26.1	Very low	68 Å²	68	148.6 Å²	148.6	70%	0.701	82%	0.821	S	S	*	*			trans	-130.9	94	165.8	0	0	0	0	0	106.5
204	E	25.9	Very low	26	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	82%	0.819	S	S	*	*			trans	-121.7	116	156.5	-78.6	-167.5	147.2	0	0	106.4	H206	E204-H206 PolarHBondContact O-N 2.99Å
205	D	25.2	Very low	25.9	Very low	158 Å²	158	153.6 Å²	153.6	85%	0.845	83%	0.83	S	S	*	*			trans	-67.7	115.8	173.9	-70	-58.5	0	0	0	109.6
206	H	25.3	Very low	25.7	Very low	187 Å²	187	155.2 Å²	155.2	87%	0.866	84%	0.836	S	S	*	*			trans	-142.5	149.1	148.6	-93.5	-0.7	0	0	0	110.3	E204	E204-H206 PolarHBondContact O-N 2.99Å
207	P	28	Very low	26.1	Very low	123 Å²	123	152.3 Å²	152.3	80%	0.799	83%	0.827	S	S	*	*			trans	-82.7	161.8	-147	32.4	-35.1	0	0	0	114.7
208	Q	26.5	Very low	25.9	Very low	191 Å²	191	151.6 Å²	151.6	89%	0.893	84%	0.84	S	S	*	*			trans	-41.2	136.4	-175.3	-60.5	-175.6	-13.8	0	0	116.9
209	Q	26.3	Very low	26	Very low	200 Å²	200	145.4 Å²	145.4	94%	0.935	83%	0.832	S	S	*	*			trans	-149.4	126.9	130.8	-114.1	173.5	10.3	0	0	109.6
210	G	23.8	Very low	26.1	Very low	72 Å²	72	145 Å²	145	74%	0.742	83%	0.825	S	S	*	*			trans	-81.2	161.7	-163.6	0	0	0	0	0	116
211	S	26.2	Very low	26.2	Very low	126 Å²	126	146.6 Å²	146.6	88%	0.881	83%	0.827	S	S	*	*				-172.8	124.8	126.5	-91.5	0	0	0	0	110.3
212	T	28.6	Very low	26.1	Very low	126 Å²	126	145.6 Å²	145.6	77%	0.773	83%	0.825	S	S	*	*			trans	-52.1	126.1	162.3	-43.4	0	0	0	0	111
213	L	26.2	Very low	26	Very low	176 Å²	176	144.1 Å²	144.1	92%	0.921	81%	0.812	S	S	*	*			trans	-152.9	121.6	145.7	-87.1	-175.6	0	0	0	110.5
214	Y	24.7	Very low	26.2	Very low	214 Å²	214	149.7 Å²	149.7	84%	0.839	82%	0.82	S	S	*	*			trans	-62.8	148.1	167.5	-96.6	-102.7	0	0	0	111.1
215	C	24.9	Very low	26.4	Very low	133 Å²	133	145.8 Å²	145.8	90%	0.899	82%	0.82	S	S	*	*			trans	-166.7	124.7	136.5	-102.7	0	0	0	0	111.9
216	M	23.5	Very low	26.4	Very low	167 Å²	167	142.3 Å²	142.3	82%	0.823	81%	0.814	S	S	*	*			trans	-79.5	164.8	162.5	-88.2	-66.2	-78.1	0	0	110.5
217	P	30.9	Very low	26.6	Very low	110 Å²	110	139.2 Å²	139.2	71%	0.714	81%	0.81	S	S	*	*			trans	-93.8	150.7	-152	36.7	-33.5	0	0	0	113.3
218	T	25.6	Very low	26.5	Very low	146 Å²	146	142.8 Å²	142.8	90%	0.896	82%	0.816	S	S	*	*			trans	-114.3	131.7	164.9	4.9	0	0	0	0	110.8
219	S	26.2	Very low	26.4	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	81%	0.814	S	S	*	*			trans	-56.3	141.6	174.1	177.2	0	0	0	0	113.6
220	T	26.4	Very low	26.6	Very low	116 Å²	116	143.8 Å²	143.8	71%	0.712	81%	0.811	S	S	*	*				163.9	137.3	111.2	36.6	0	0	0	0	113.7
221	N	28.4	Very low	27	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	82%	0.815	S	S	*	*			trans	75.6	113.3	146.8	-65.2	-24.4	0	0	0	123.3
222	Q	26.3	Very low	27.3	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	81%	0.808	S	S	*	*			trans	33.4	130.4	134.6	-63.3	-178	15.5	0	0	119.9
223	V	23.5	Very low	27.8	Very low	110 Å²	110	145 Å²	145	67%	0.667	78%	0.782	S	S	*	*				172.4	137.5	106.4	157	0	0	0	0	110.8
224	Q	26.7	Very low	28.4	Very low	185 Å²	185	142.1 Å²	142.1	86%	0.864	77%	0.774	S	S	*	*			trans	74.3	121.8	158.3	-79.1	158.4	-0.9	0	0	122.2
225	A	31.7	Very low	29.4	Very low	110 Å²	110	137.5 Å²	137.5	91%	0.909	76%	0.755	S	S	*	*			trans	-67.3	130	168.4	0	0	0	0	0	111.7
226	A	24.4	Very low	30.2	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	73%	0.727	S	S	*	*			trans	-117.9	148.6	163.5	0	0	0	0	0	108.1	E228	A226-E228 PolarHBondContact O-N 3.15Å
227	P	29.5	Very low	30.7	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	72%	0.72	S	S	*	*			trans	-65.6	136.7	-175.4	24.7	-26	0	0	0	109.9	E229	P227-E229 PolarHBondContact O-N 2.81Å
228	E	25.7	Very low	31.3	Very low	197 Å²	197	132.6 Å²	132.6	92%	0.921	71%	0.714	S	S	*	*			trans	-59.3	93.1	-175.6	-151.2	175.9	-174.4	0	0	110.8	A226 R230	A226-E228 PolarHBondContact O-N 3.15Å; E228-R230 PolarHBondContact O-N 2.95Å
229	E	25.5	Very low	32	Very low	184 Å²	184	130.6 Å²	130.6	86%	0.86	71%	0.706	S	S	*	*			trans	-69.7	118.1	170.1	-79.5	-168.6	151.3	0	0	109.2	P227	P227-E229 PolarHBondContact O-N 2.81Å
230	R	29.5	Very low	32.9	Very low	228 Å²	228	132 Å²	132	86%	0.86	72%	0.716	S	S	*	*			trans	-53.3	137.8	170.4	-68.7	177.1	174.4	173.1	-2.1	109.6	E228 R232	E228-R230 PolarHBondContact O-N 2.95Å; R230-R232 PolarHBondContact O-N 3.27Å
231	P	32.2	Very low	33.9	Very low	128 Å²	128	128 Å²	128	83%	0.831	70%	0.698	S	S	*	*			trans	-59.3	110.8	178.8	-19.1	29.7	0	0	0	110.4	A233	P231-A233 PolarHBondContact O-N 3.3Å
232	R	33.7	Very low	34.9	Very low	196 Å²	196	123.2 Å²	123.2	74%	0.74	68%	0.678	S	S	*	*			trans	-71.8	109.3	170	-157.6	-168.8	-97.4	-147.9	0.5	106.2	R230	R230-R232 PolarHBondContact O-N 3.27Å
233	A	37.7	Very low	36.5	Very low	27 Å²	27	122.5 Å²	122.5	22%	0.223	68%	0.678	C	S	.	*			trans	-74.9	148.6	176.8	0	0	0	0	0	111.3	P231 W235 W236	P231-A233 PolarHBondContact O-N 3.3Å; A233-W235 PolarHBondContact O-N 2.07Å; A233-W236 VanDerWaalsContact CA-CH2 3.47Å; A233-W236 HydrophobicContact CB-CD2 4.48Å; A233-W236 HydrophobicContact CB-CE3 3.82Å; A233-W236 HydrophobicContact CB-CH2 3Å; A233-W236 HydrophobicContact CB-CZ2 3.73Å; A233-W236 HydrophobicContact CB-CZ3 3.05Å; A233-W236 VanDerWaalsContact O-CD2 3.22Å
234	P	39.4	Very low	38.9	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-4.7	-153.5	-11.9	31.2	0	0	0	114.2
235	W	45.7	Very low	41.6	Very low	117 Å²	117	116.7 Å²	116.7	44%	0.443	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.4	0.7	-168.8	63.2	-87.5	0	0	0	114.2	A233 C363 L435	A233-W235 PolarHBondContact O-N 2.07Å; W235-C363 HydrophobicContact CZ3-CB 3.88Å; W235-L435 HydrophobicContact CH2-CD2 4.46Å; W235-L435 HydrophobicContact CZ2-CD2 3.59Å
236	W	42.2	Very low	44.2	Very low	86 Å²	86	111.7 Å²	111.7	33%	0.326	60%	0.6	S	S	.	*			trans	-110.1	24.7	176.9	61	75.9	0	0	0	113.8	A233 T238 F438	A233-W236 VanDerWaalsContact CA-CH2 3.47Å; A233-W236 HydrophobicContact CB-CD2 4.48Å; A233-W236 HydrophobicContact CB-CE3 3.82Å; A233-W236 HydrophobicContact CB-CH2 3Å; A233-W236 HydrophobicContact CB-CZ2 3.73Å; A233-W236 HydrophobicContact CB-CZ3 3.05Å; A233-W236 VanDerWaalsContact O-CD2 3.22Å; W236-T238 PolarHBondContact O-N 2.82Å; W236-F438 HydrophobicContact CH2-CD1 4.28Å; W236-F438 AromaticContact CH2-CE1 3.67Å; W236-F438 HydrophobicContact CH2-CE1 3.67Å; W236-F438 AromaticContact CH2-CZ 3.86Å; W236-F438 HydrophobicContact CH2-CZ 3.86Å; W236-F438 HydrophobicContact CZ3-CD1 4.29Å; W236-F438 AromaticContact CZ3-CE1 3.99Å; W236-F438 HydrophobicContact CZ3-CE1 3.99Å; W236-F438 HydrophobicContact CZ3-CE2 4.31Å; W236-F438 AromaticContact CZ3-CZ 3.99Å; W236-F438 HydrophobicContact CZ3-CZ 3.99Å
237	D	32.7	Very low	47.2	Very low	124 Å²	124	109.5 Å²	109.5	66%	0.663	58%	0.581	S	S	*	*			trans	-47.6	107.5	-179.4	-100.5	-18.7	0	0	0	110.7	S239	D237-S239 PolarHBondContact O-N 3.26Å
238	T	43.8	Very low	50	Low	98 Å²	98	104.5 Å²	104.5	60%	0.601	55%	0.548	S	S	*	.			trans	-73.7	68.7	176.8	40.6	0	0	0	0	107.4	W236 S240 A242	W236-T238 PolarHBondContact O-N 2.82Å; T238-S240 PolarHBondContact O-N 3.36Å; T238-A242 HydrophobicContact CG2-CB 4.44Å
239	S	40.5	Very low	53	Low	103 Å²	103	100.7 Å²	100.7	72%	0.72	53%	0.529	S	S	*	.			trans	-78.1	104.8	164.8	74.7	0	0	0	0	107.6	D237 G241	D237-S239 PolarHBondContact O-N 3.26Å; S239-G241 PolarHBondContact O-N 3.42Å
240	S	46.2	Very low	56	Low	130 Å²	130	94.4 Å²	94.4	91%	0.909	51%	0.505	S	S	*	.	S	Bend	trans	49.4	-3.2	152.7	-144.9	0	0	0	0	121.8	T238	T238-S240 PolarHBondContact O-N 3.36Å
241	G	45.6	Very low	58.7	Low	33 Å²	33	86.2 Å²	86.2	34%	0.34	48%	0.481	S	S	.	.			trans	-100.7	5.4	177.3	0	0	0	0	0	114.5	S239 L243	S239-G241 PolarHBondContact O-N 3.42Å; G241-L243 VanDerWaalsContact C-N 3.32Å; G241-L243 PolarHBondContact O-N 3.21Å
242	A	51.4	Low	61	Low	36 Å²	36	87.8 Å²	87.8	30%	0.298	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-0.3	-149.9	0	0	0	0	0	118	T238	T238-A242 HydrophobicContact CG2-CB 4.44Å
243	L	58.9	Low	63.5	Low	158 Å²	158	83.2 Å²	83.2	83%	0.827	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.5	8.4	-174.4	-69.4	170.6	0	0	0	114.5	G241 P245	G241-L243 VanDerWaalsContact C-N 3.32Å; G241-L243 PolarHBondContact O-N 3.21Å; L243-P245 WeakPolarHBondContact O-CD 3.36Å
244	R	74.9	Confident	65.9	Low	135 Å²	135	82.1 Å²	82.1	51%	0.509	46%	0.461	S	S	.	.			trans	-70.2	123	-179.4	-65.1	-172.1	-174	174	3.4	110.3	E310 S354 A355	R244-E310 WeakPolarHBondContact CD-OE1 3.34Å; R244-E310 WeakPolarHBondContact CD-OE2 3.44Å; R244-E310 IonicContact CZ-OE2 3.74Å; R244-E310 IonicContact NH1-OE1 3.19Å; R244-E310 PolarHBondContact NH1-OE1 3.4Å; R244-E310 IonicContact NH1-OE2 3.06Å; R244-E310 PolarHBondContact NH1-OE2 2.93Å; R244-S354 CarbonylContact O-C 3.57Å; R244-S354 WeakPolarHBondContact O-CA 3.45Å; R244-A355 PolarHBondContact O-N 2.98Å
245	P	82.6	Confident	68.3	Low	38 Å²	38	76.7 Å²	76.7	25%	0.247	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-69.7	138	175.3	27.5	-31.6	0	0	0	109.8	L243 V311 V352	L243-P245 WeakPolarHBondContact O-CD 3.36Å; P245-V311 HydrophobicContact CB-CB 4.47Å; P245-V311 HydrophobicContact CG-CB 4.33Å; P245-V311 PolarHBondContact O-N 2.86Å; P245-V352 HydrophobicContact CB-CB 3.72Å; P245-V352 HydrophobicContact CB-CG1 3.61Å
246	V	86.1	Confident	70.1	Confident	6 Å²	6	74.9 Å²	74.9	4%	0.036	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.2	-174.5	174.1	0	0	0	0	110	T308 V309 V352 P353 A355 V358	V246-T308 HydrophobicContact CG1-CG2 3.83Å; V246-V309 WeakPolarHBondContact CA-O 3.16Å; V246-V352 VanDerWaalsContact O-CG1 3.28Å; V246-V352 WeakPolarHBondContact O-CG1 3.4Å; V246-P353 PolarHBondContact N-O 2.92Å; V246-A355 HydrophobicContact CG2-CB 3.61Å; V246-V358 HydrophobicContact CB-CG2 4.43Å; V246-V358 HydrophobicContact CG1-CG2 4.4Å
247	A	86.9	Confident	72.2	Confident	39 Å²	39	72.6 Å²	72.6	32%	0.322	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	157.7	176	0	0	0	0	0	111.4	T308 V309 V311	A247-T308 CarbonylContact O-C 3.48Å; A247-T308 WeakPolarHBondContact O-CA 3.41Å; A247-T308 WeakPolarHBondContact O-CB 3.42Å; A247-V309 PolarHBondContact N-O 3.19Å; A247-V309 PolarHBondContact O-N 3.05Å; A247-V311 HydrophobicContact CB-CG2 3.52Å
248	L	89.4	Confident	75	Confident	18 Å²	18	66.7 Å²	66.7	9%	0.094	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	139.2	173.2	-64.7	172	0	0	0	110.3	P251 V254 F306 T308 L447 F448	L248-P251 HydrophobicContact CB-CB 4.15Å; L248-P251 HydrophobicContact CD1-CB 4.5Å; L248-V254 HydrophobicContact CD1-CB 4.12Å; L248-V254 HydrophobicContact CD1-CG1 3.96Å; L248-V254 HydrophobicContact CD2-CG1 4.08Å; L248-F306 HydrophobicContact CD2-CB 4.43Å; L248-F306 HydrophobicContact CD2-CD2 3.6Å; L248-F306 HydrophobicContact CD2-CE2 4.21Å; L248-F306 HydrophobicContact CD2-CG 4.26Å; L248-T308 HydrophobicContact CD2-CG2 4.17Å; L248-L447 HydrophobicContact CD1-CD1 4.37Å; L248-L447 HydrophobicContact CD1-CG 4.48Å; L248-L447 VanDerWaalsContact CD1-O 3.31Å; L248-L447 WeakPolarHBondContact CD1-O 3.48Å; L248-L447 HydrophobicContact CD2-CD1 3.85Å; L248-L447 HydrophobicContact CD2-CG 4.2Å; L248-L447 HydrophobicContact CG-CD1 3.8Å; L248-L447 HydrophobicContact CG-CG 4.34Å; L248-F448 HydrophobicContact CD1-CD1 4.47Å
249	K	88.7	Confident	77.2	Confident	117 Å²	117	63 Å²	63	51%	0.509	37%	0.369	S	S	.	.	S	Bend	trans	-66.3	-43.7	172.4	-77.8	-167.2	-168.8	173.7	0	112.2	P251 E307 V309	K249-P251 VanDerWaalsContact C-CD 3.43Å; K249-P251 WeakPolarHBondContact O-CD 3.35Å; K249-E307 HydrophobicContact CB-CB 4.26Å; K249-E307 HydrophobicContact CD-CB 3.64Å; K249-E307 VanDerWaalsContact CD-OE2 3.26Å; K249-E307 WeakPolarHBondContact CD-OE2 3.35Å; K249-E307 WeakPolarHBondContact CE-OE2 3.43Å; K249-E307 HydrophobicContact CG-CB 4.03Å; K249-E307 PolarHBondContact N-O 3.2Å; K249-E307 IonicContact NZ-OE2 2.67Å; K249-E307 PolarHBondContact NZ-OE2 3Å; K249-V309 HydrophobicContact CD-CG2 3.87Å; K249-V309 VanDerWaalsContact CE-CG2 3.48Å; K249-V309 HydrophobicContact CG-CB 4.35Å; K249-V309 HydrophobicContact CG-CG2 3.36Å
250	S	88.4	Confident	79.4	Confident	52 Å²	52	60.9 Å²	60.9	36%	0.364	36%	0.358	S	S	.	.	S	Bend	trans	-120.9	67.5	-177.7	46.6	0	0	0	0	110.2	Q252 V253 V254	S250-Q252 VanDerWaalsContact C-N 3.28Å; S250-Q252 PolarHBondContact O-N 3.49Å; S250-V253 PolarHBondContact O-N 3.19Å; S250-V254 WeakPolarHBondContact O-CG2 3.27Å; S250-V254 PolarHBondContact O-N 2.06Å; S250-V254 VanDerWaalsContact O-N 3.16Å
251	P	85.6	Confident	81.4	Confident	56 Å²	56	54.8 Å²	54.8	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-38.7	-172.1	22.3	-32	0	0	0	112.3	L248 K249 C255	L248-P251 HydrophobicContact CB-CB 4.15Å; L248-P251 HydrophobicContact CD1-CB 4.5Å; K249-P251 VanDerWaalsContact C-CD 3.43Å; K249-P251 WeakPolarHBondContact O-CD 3.35Å; P251-C255 WeakPolarHBondContact O-CB 3.45Å; P251-C255 PolarHBondContact O-N 3.39Å; P251-C255 PolarHBondContact O-SG 2.81Å
252	Q	80.6	Confident	83.7	Confident	161 Å²	161	53.3 Å²	53.3	75%	0.752	30%	0.299	S	S	*	.	H	α-helix	trans	-58.1	-54.6	-179.6	-67	176.1	-10.2	0	0	112.1	S250 E256	S250-Q252 VanDerWaalsContact C-N 3.28Å; S250-Q252 PolarHBondContact O-N 3.49Å; Q252-E256 VanDerWaalsContact O-CB 3.26Å; Q252-E256 WeakPolarHBondContact O-CB 3.22Å; Q252-E256 PolarHBondContact O-N 2.85Å
253	V	85.4	Confident	85.5	Confident	99 Å²	99	53.5 Å²	53.5	60%	0.6	30%	0.295	S	S	*	.	H	α-helix	trans	-66.2	-44.8	-176.8	-178.4	0	0	0	0	111.6	S250 A257	S250-V253 PolarHBondContact O-N 3.19Å; V253-A257 WeakPolarHBondContact O-CB 3.29Å; V253-A257 PolarHBondContact O-N 3.07Å
254	V	89.5	Confident	86.9	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	27%	0.273	C	S	.	.	H	α-helix	trans	-71.2	-41	-175.6	177.8	0	0	0	0	111.2	L248 S250 A257 A258 L304 F306 F448	L248-V254 HydrophobicContact CD1-CB 4.12Å; L248-V254 HydrophobicContact CD1-CG1 3.96Å; L248-V254 HydrophobicContact CD2-CG1 4.08Å; S250-V254 WeakPolarHBondContact O-CG2 3.27Å; S250-V254 PolarHBondContact O-N 2.06Å; S250-V254 VanDerWaalsContact O-N 3.16Å; V254-A257 PolarHBondContact O-N 2.79Å; V254-A258 WeakPolarHBondContact O-CB 3.44Å; V254-A258 PolarHBondContact O-N 3.38Å; V254-L304 HydrophobicContact CG1-CD2 4.44Å; V254-F306 HydrophobicContact CB-CB 4.44Å; V254-F306 HydrophobicContact CG1-CB 3.8Å; V254-F306 HydrophobicContact CG1-CG 4.26Å; V254-F306 HydrophobicContact CG2-CB 3.71Å; V254-F448 HydrophobicContact CG1-CD1 3.88Å; V254-F448 HydrophobicContact CG1-CE1 3.69Å
255	C	88.4	Confident	87.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-70.7	-34.9	178.6	-60.2	0	0	0	0	111.3	P251 A258 S259 F448 I452	P251-C255 WeakPolarHBondContact O-CB 3.45Å; P251-C255 PolarHBondContact O-N 3.39Å; P251-C255 PolarHBondContact O-SG 2.81Å; C255-A258 PolarHBondContact O-N 2.63Å; C255-S259 WeakPolarHBondContact O-CB 3.4Å; C255-S259 PolarHBondContact O-N 3.37Å; C255-S259 PolarHBondContact O-OG 3.29Å; C255-F448 WeakPolarHBondContact CB-O 3.26Å; C255-F448 PolarHBondContact SG-O 3.05Å; C255-I452 HydrophobicContact CB-CD1 3.36Å; C255-I452 HydrophobicContact CB-CG1 3.78Å; C255-I452 WeakPolarHBondContact O-CD1 3.38Å
256	E	83.9	Confident	88.2	Confident	78 Å²	78	41.7 Å²	41.7	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-48.5	172.2	-176.9	177.9	-175.6	0	0	111.2	Q252 A258 S259 A260	Q252-E256 VanDerWaalsContact O-CB 3.26Å; Q252-E256 WeakPolarHBondContact O-CB 3.22Å; Q252-E256 PolarHBondContact O-N 2.85Å; E256-A258 VanDerWaalsContact C-N 3.33Å; E256-A258 PolarHBondContact O-N 2.92Å; E256-S259 WeakPolarHBondContact O-CB 3.43Å; E256-S259 PolarHBondContact O-N 3.22Å; E256-S259 VanDerWaalsContact O-N 3.16Å; E256-A260 PolarHBondContact O-N 3.31Å
257	A	86.8	Confident	88.3	Confident	39 Å²	39	45.7 Å²	45.7	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-41.6	176.3	0	0	0	0	0	112.2	V253 V254 S259 A260 G261 L304	V253-A257 WeakPolarHBondContact O-CB 3.29Å; V253-A257 PolarHBondContact O-N 3.07Å; V254-A257 PolarHBondContact O-N 2.79Å; A257-S259 VanDerWaalsContact C-N 3.34Å; A257-S259 PolarHBondContact O-N 2.06Å; A257-A260 PolarHBondContact O-N 3.37Å; A257-G261 PolarHBondContact O-N 3.29Å; A257-L304 HydrophobicContact CB-CD1 3.83Å
258	A	92.1	Very high	88.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-37.7	175.3	0	0	0	0	0	112.6	V254 C255 E256 G261 L262 L295 L299 F448 F449	V254-A258 WeakPolarHBondContact O-CB 3.44Å; V254-A258 PolarHBondContact O-N 3.38Å; C255-A258 PolarHBondContact O-N 2.63Å; E256-A258 VanDerWaalsContact C-N 3.33Å; E256-A258 PolarHBondContact O-N 2.92Å; A258-G261 PolarHBondContact O-N 3.06Å; A258-L262 PolarHBondContact O-N 2.78Å; A258-L295 WeakPolarHBondContact O-CD1 3.46Å; A258-L299 HydrophobicContact CB-CD2 4.34Å; A258-F448 HydrophobicContact CB-CB 3.77Å; A258-F448 HydrophobicContact CB-CD1 3.97Å; A258-F448 HydrophobicContact CB-CG 3.97Å; A258-F449 HydrophobicContact CB-CZ 4.44Å
259	S	88.8	Confident	88.7	Confident	21 Å²	21	45.5 Å²	45.5	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-42.5	175.4	-58.4	0	0	0	0	111.8	C255 E256 A257 G261 L262 L263 I452	C255-S259 WeakPolarHBondContact O-CB 3.4Å; C255-S259 PolarHBondContact O-N 3.37Å; C255-S259 PolarHBondContact O-OG 3.29Å; E256-S259 WeakPolarHBondContact O-CB 3.43Å; E256-S259 PolarHBondContact O-N 3.22Å; E256-S259 VanDerWaalsContact O-N 3.16Å; A257-S259 VanDerWaalsContact C-N 3.34Å; A257-S259 PolarHBondContact O-N 2.06Å; S259-G261 VanDerWaalsContact C-N 3.32Å; S259-G261 PolarHBondContact O-N 3.3Å; S259-L262 PolarHBondContact O-N 2.92Å; S259-L263 PolarHBondContact O-N 3.25Å; S259-I452 VanDerWaalsContact OG-CD1 3.32Å; S259-I452 WeakPolarHBondContact OG-CD1 3.23Å
260	A	86.6	Confident	88.7	Confident	58 Å²	58	41.9 Å²	41.9	48%	0.479	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-41.6	172.6	0	0	0	0	0	111.6	E256 A257 L263 K264	E256-A260 PolarHBondContact O-N 3.31Å; A257-A260 PolarHBondContact O-N 3.37Å; A260-L263 PolarHBondContact O-N 3.17Å; A260-K264 WeakPolarHBondContact O-CB 3.38Å; A260-K264 PolarHBondContact O-N 3.36Å
261	G	89.3	Confident	88.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-41.5	173.6	0	0	0	0	0	112.7	A257 A258 S259 K264 T265	A257-G261 PolarHBondContact O-N 3.29Å; A258-G261 PolarHBondContact O-N 3.06Å; S259-G261 VanDerWaalsContact C-N 3.32Å; S259-G261 PolarHBondContact O-N 3.3Å; G261-K264 PolarHBondContact O-N 3.03Å; G261-T265 WeakPolarHBondContact O-CB 3.08Å; G261-T265 PolarHBondContact O-N 3.13Å; G261-T265 PolarHBondContact O-OG1 3.26Å
262	L	93.2	Very high	88.8	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-42.6	176.8	-175.6	63	0	0	0	111.6	A258 S259 T265 L266 W291 L295 F449 M458 M461 M462 M465	A258-L262 PolarHBondContact O-N 2.78Å; S259-L262 PolarHBondContact O-N 2.92Å; L262-T265 WeakPolarHBondContact O-CB 3.16Å; L262-T265 PolarHBondContact O-N 3.27Å; L262-L266 PolarHBondContact O-N 2.9Å; L262-W291 HydrophobicContact CD1-CE3 4.11Å; L262-L295 HydrophobicContact CB-CD1 4.08Å; L262-F449 HydrophobicContact CB-CE1 4.15Å; L262-F449 HydrophobicContact CB-CZ 4Å; L262-F449 HydrophobicContact CD2-CD1 4.41Å; L262-F449 HydrophobicContact CD2-CE1 3.62Å; L262-F449 HydrophobicContact CD2-CZ 3.74Å; L262-F449 HydrophobicContact CG-CZ 4.37Å; L262-M458 HydrophobicContact CD2-CE 4.02Å; L262-M461 HydrophobicContact CD2-SD 3.73Å; L262-M462 HydrophobicContact CD1-CE 4.1Å; L262-M462 HydrophobicContact CD2-CE 3.98Å; L262-M465 HydrophobicContact CD2-SD 4.16Å; L262-M465 HydrophobicContact CG-CE 4.27Å; L262-M465 HydrophobicContact CG-SD 4.34Å
263	L	89.1	Confident	89.1	Confident	40 Å²	40	38.4 Å²	38.4	21%	0.209	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-46.1	175.2	179.4	62.6	0	0	0	111.5	S259 A260 T265 L266 R267 M465 L470	S259-L263 PolarHBondContact O-N 3.25Å; A260-L263 PolarHBondContact O-N 3.17Å; L263-T265 VanDerWaalsContact C-N 3.3Å; L263-T265 PolarHBondContact O-N 3.41Å; L263-L266 PolarHBondContact O-N 3.08Å; L263-R267 WeakPolarHBondContact O-CB 3.23Å; L263-R267 PolarHBondContact O-N 3.13Å; L263-M465 HydrophobicContact CB-CE 4.24Å; L263-M465 HydrophobicContact CD1-CE 3.99Å; L263-L470 HydrophobicContact CD1-CB 4.21Å; L263-L470 HydrophobicContact CD1-CD1 3.96Å; L263-L470 HydrophobicContact CD1-CD2 3.61Å; L263-L470 HydrophobicContact CD1-CG 4.13Å
264	K	89.1	Confident	89.2	Confident	83 Å²	83	34.4 Å²	34.4	36%	0.361	18%	0.176	S	C	.	.	H	α-helix	trans	-59.9	-41.4	175.7	-173.5	-179.7	177.2	-152.6	0	111.6	A260 G261 F268 E298 D302	A260-K264 WeakPolarHBondContact O-CB 3.38Å; A260-K264 PolarHBondContact O-N 3.36Å; G261-K264 PolarHBondContact O-N 3.03Å; K264-F268 WeakPolarHBondContact O-CB 3.15Å; K264-F268 PolarHBondContact O-N 3.31Å; K264-E298 HydrophobicContact CD-CG 4.12Å; K264-E298 VanDerWaalsContact CD-OE1 3.31Å; K264-E298 WeakPolarHBondContact CD-OE1 3.29Å; K264-E298 WeakPolarHBondContact CE-OE1 3.27Å; K264-E298 IonicContact NZ-OE1 2.73Å; K264-E298 PolarHBondContact NZ-OE1 2.74Å; K264-D302 VanDerWaalsContact NZ-CG 3.25Å; K264-D302 IonicContact NZ-OD1 3.52Å; K264-D302 PolarHBondContact NZ-OD1 3.5Å; K264-D302 IonicContact NZ-OD2 2.81Å; K264-D302 PolarHBondContact NZ-OD2 2.87Å
265	T	93.6	Very high	89.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-53	176.4	-63.8	0	0	0	0	111.7	G261 L262 L263 R267 F268 V269 L294 E298	G261-T265 WeakPolarHBondContact O-CB 3.08Å; G261-T265 PolarHBondContact O-N 3.13Å; G261-T265 PolarHBondContact O-OG1 3.26Å; L262-T265 WeakPolarHBondContact O-CB 3.16Å; L262-T265 PolarHBondContact O-N 3.27Å; L263-T265 VanDerWaalsContact C-N 3.3Å; L263-T265 PolarHBondContact O-N 3.41Å; T265-R267 VanDerWaalsContact C-N 3.32Å; T265-R267 PolarHBondContact O-N 3.3Å; T265-F268 WeakPolarHBondContact O-CB 3.18Å; T265-F268 PolarHBondContact O-N 3.38Å; T265-V269 WeakPolarHBondContact O-CG2 3.37Å; T265-V269 PolarHBondContact O-N 2.88Å; T265-L294 HydrophobicContact CG2-CB 3.38Å; T265-L294 HydrophobicContact CG2-CD1 4.04Å; T265-L294 HydrophobicContact CG2-CG 4.34Å; T265-E298 WeakPolarHBondContact OG1-CB 3.14Å
266	L	91.1	Very high	89.5	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-70	-32.1	-178.8	-68	-162.5	0	0	0	112.5	L262 L263 V269 K270 V287 M462 M465 L470	L262-L266 PolarHBondContact O-N 2.9Å; L263-L266 PolarHBondContact O-N 3.08Å; L266-V269 PolarHBondContact O-N 3.04Å; L266-K270 WeakPolarHBondContact O-CB 3.42Å; L266-K270 PolarHBondContact O-N 2.86Å; L266-V287 HydrophobicContact CD2-CG1 3.65Å; L266-M462 HydrophobicContact CD1-SD 3.87Å; L266-M462 HydrophobicContact CD2-SD 4.32Å; L266-M465 HydrophobicContact CB-CE 4.27Å; L266-M465 HydrophobicContact CD1-CB 3.36Å; L266-M465 HydrophobicContact CD1-CE 3.77Å; L266-M465 HydrophobicContact CD1-CG 4.09Å; L266-M465 HydrophobicContact CD1-SD 3.63Å; L266-M465 HydrophobicContact CG-CE 4.23Å; L266-L470 HydrophobicContact CB-CD1 4.16Å
267	R	88.3	Confident	89.8	Confident	89 Å²	89	40.8 Å²	40.8	34%	0.336	21%	0.213	S	C	.	.	H	α-helix	trans	-59	-48.9	169.5	-174.2	176.6	-72.6	158.4	-1.1	110.8	L263 T265 V269 K270 Y271 L470	L263-R267 WeakPolarHBondContact O-CB 3.23Å; L263-R267 PolarHBondContact O-N 3.13Å; T265-R267 VanDerWaalsContact C-N 3.32Å; T265-R267 PolarHBondContact O-N 3.3Å; R267-V269 PolarHBondContact O-N 3.47Å; R267-K270 PolarHBondContact O-N 3.37Å; R267-Y271 HydrophobicContact CG-CD2 3.56Å; R267-Y271 HydrophobicContact CG-CE2 3.55Å; R267-Y271 WeakPolarHBondContact O-CD2 3.28Å; R267-Y271 PolarHBondContact O-N 3.12Å; R267-Y271 VanDerWaalsContact O-N 3.13Å; R267-L470 PolarHBondContact NH2-OXT 2.67Å
268	F	90.1	Very high	90	Very high	54 Å²	54	39.4 Å²	39.4	24%	0.237	20%	0.2	C	C	.	.	H	α-helix	trans	-53.8	-52.4	175.5	163.1	-97.7	0	0	0	111.1	K264 T265 K270 Y271 L272 K382	K264-F268 WeakPolarHBondContact O-CB 3.15Å; K264-F268 PolarHBondContact O-N 3.31Å; T265-F268 WeakPolarHBondContact O-CB 3.18Å; T265-F268 PolarHBondContact O-N 3.38Å; F268-K270 PolarHBondContact O-N 3.48Å; F268-Y271 PolarHBondContact O-N 3.44Å; F268-L272 HydrophobicContact CE1-CD1 4.06Å; F268-L272 HydrophobicContact CE2-CD2 4.13Å; F268-L272 HydrophobicContact CZ-CD1 4.16Å; F268-L272 HydrophobicContact CZ-CD2 4.16Å; F268-L272 WeakPolarHBondContact O-CG 3.36Å; F268-K382 HydrophobicContact CD1-CD 4.38Å; F268-K382 HydrophobicContact CE1-CB 3.79Å; F268-K382 HydrophobicContact CE1-CD 4.28Å; F268-K382 HydrophobicContact CZ-CB 4.18Å
269	V	93.8	Very high	90	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-48.3	-179.2	175.1	0	0	0	0	111.7	T265 L266 R267 Y271 L272 F275 V287 L294 L386	T265-V269 WeakPolarHBondContact O-CG2 3.37Å; T265-V269 PolarHBondContact O-N 2.88Å; L266-V269 PolarHBondContact O-N 3.04Å; R267-V269 PolarHBondContact O-N 3.47Å; V269-Y271 VanDerWaalsContact C-N 3.26Å; V269-Y271 PolarHBondContact O-N 3.04Å; V269-L272 WeakPolarHBondContact O-CB 3.4Å; V269-L272 PolarHBondContact O-N 2.86Å; V269-L272 VanDerWaalsContact O-N 3.12Å; V269-F275 HydrophobicContact CG1-CD1 3.8Å; V269-F275 HydrophobicContact CG1-CD2 3.83Å; V269-F275 HydrophobicContact CG1-CE1 3.64Å; V269-F275 HydrophobicContact CG1-CE2 3.67Å; V269-F275 HydrophobicContact CG1-CG 3.88Å; V269-F275 HydrophobicContact CG1-CZ 3.56Å; V269-V287 HydrophobicContact CG1-CG2 4.01Å; V269-L294 HydrophobicContact CG2-CD1 3.75Å; V269-L386 HydrophobicContact CG1-CD1 3.87Å; V269-L386 HydrophobicContact CG1-CD2 4Å; V269-L386 HydrophobicContact CG2-CD1 4.21Å; V269-L386 HydrophobicContact CG2-CD2 4.18Å
270	K	88.6	Confident	90.2	Very high	41 Å²	41	45.7 Å²	45.7	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-31.2	-176.1	-178.4	167.8	178	151.9	0	113.2	L266 R267 F268 Q276 L466 T468	L266-K270 WeakPolarHBondContact O-CB 3.42Å; L266-K270 PolarHBondContact O-N 2.86Å; R267-K270 PolarHBondContact O-N 3.37Å; F268-K270 PolarHBondContact O-N 3.48Å; K270-Q276 VanDerWaalsContact O-CG 3.26Å; K270-Q276 WeakPolarHBondContact O-CG 3.18Å; K270-Q276 PolarHBondContact O-NE2 3.2Å; K270-L466 PolarHBondContact NZ-O 3.38Å; K270-T468 PolarHBondContact NZ-O 2.7Å
271	Y	87.4	Confident	90.6	Very high	133 Å²	133	46.8 Å²	46.8	52%	0.522	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	2.7	179.4	-73.2	-65	0	0	0	114.1	R267 F268 V269 P273 L470	R267-Y271 HydrophobicContact CG-CD2 3.56Å; R267-Y271 HydrophobicContact CG-CE2 3.55Å; R267-Y271 WeakPolarHBondContact O-CD2 3.28Å; R267-Y271 PolarHBondContact O-N 3.12Å; R267-Y271 VanDerWaalsContact O-N 3.13Å; F268-Y271 PolarHBondContact O-N 3.44Å; V269-Y271 VanDerWaalsContact C-N 3.26Å; V269-Y271 PolarHBondContact O-N 3.04Å; Y271-P273 WeakPolarHBondContact O-CD 3.37Å; Y271-L470 PolarHBondContact OH-O 3.16Å
272	L	89.4	Confident	90.9	Very high	12 Å²	12	47 Å²	47	6%	0.063	23%	0.234	C	C	.	.			trans	-73.7	121.1	172	-64.8	174.9	0	0	0	110.4	L146 F268 V269 C274 F275 Q276 L386 F387	L146-L272 HydrophobicContact CD2-CD2 3.6Å; F268-L272 HydrophobicContact CE1-CD1 4.06Å; F268-L272 HydrophobicContact CE2-CD2 4.13Å; F268-L272 HydrophobicContact CZ-CD1 4.16Å; F268-L272 HydrophobicContact CZ-CD2 4.16Å; F268-L272 WeakPolarHBondContact O-CG 3.36Å; V269-L272 WeakPolarHBondContact O-CB 3.4Å; V269-L272 PolarHBondContact O-N 2.86Å; V269-L272 VanDerWaalsContact O-N 3.12Å; L272-C274 VanDerWaalsContact C-N 3.29Å; L272-C274 PolarHBondContact O-N 3.16Å; L272-F275 HydrophobicContact CB-CB 3.79Å; L272-F275 WeakPolarHBondContact O-CB 3.49Å; L272-F275 PolarHBondContact O-N 2.9Å; L272-Q276 WeakPolarHBondContact O-CG 3.04Å; L272-Q276 PolarHBondContact O-N 2.97Å; L272-L386 HydrophobicContact CD1-CD2 3.47Å; L272-L386 VanDerWaalsContact CD1-CD2 3.47Å; L272-F387 HydrophobicContact CD1-CZ 4.14Å
273	P	87	Confident	91	Very high	51 Å²	51	48.2 Å²	48.2	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-39.2	180	-25.6	35.3	0	0	0	113	Y271 F275 Q276 V277	Y271-P273 WeakPolarHBondContact O-CD 3.37Å; P273-F275 PolarHBondContact O-N 2.98Å; P273-Q276 PolarHBondContact O-N 2.89Å; P273-V277 WeakPolarHBondContact O-CG2 3.42Å; P273-V277 PolarHBondContact O-N 3.33Å
274	C	87.8	Confident	91.3	Very high	14 Å²	14	47.3 Å²	47.3	10%	0.095	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-21.6	176.6	52.3	0	0	0	0	113.6	L272 F387 Y399 L403	L272-C274 VanDerWaalsContact C-N 3.29Å; L272-C274 PolarHBondContact O-N 3.16Å; C274-F387 VanDerWaalsContact SG-CZ 3.57Å; C274-Y399 VanDerWaalsContact CA-OH 3.3Å; C274-Y399 WeakPolarHBondContact CA-OH 3.32Å; C274-Y399 WeakPolarHBondContact CB-OH 3.49Å; C274-Y399 WeakPolarHBondContact O-CE1 3.47Å; C274-Y399 PolarHBondContact O-OH 3.17Å; C274-L403 HydrophobicContact CB-CD1 3.9Å; C274-L403 HydrophobicContact CB-CD2 3.72Å; C274-L403 HydrophobicContact CB-CG 4.5Å
275	F	92.8	Very high	91.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-83.7	-39.9	174.6	-172.8	-97.3	0	0	0	111.3	V269 L272 P273 V277 L278 Q283 L286 V287 L386 L466	V269-F275 HydrophobicContact CG1-CD1 3.8Å; V269-F275 HydrophobicContact CG1-CD2 3.83Å; V269-F275 HydrophobicContact CG1-CE1 3.64Å; V269-F275 HydrophobicContact CG1-CE2 3.67Å; V269-F275 HydrophobicContact CG1-CG 3.88Å; V269-F275 HydrophobicContact CG1-CZ 3.56Å; L272-F275 HydrophobicContact CB-CB 3.79Å; L272-F275 WeakPolarHBondContact O-CB 3.49Å; L272-F275 PolarHBondContact O-N 2.9Å; P273-F275 PolarHBondContact O-N 2.98Å; F275-V277 PolarHBondContact O-N 2.85Å; F275-L278 HydrophobicContact CD2-CD1 4.13Å; F275-L278 HydrophobicContact CE2-CD1 4.49Å; F275-L278 VanDerWaalsContact O-CB 3.28Å; F275-L278 WeakPolarHBondContact O-CB 3.25Å; F275-L278 PolarHBondContact O-N 3.23Å; F275-Q283 HydrophobicContact CD1-CG 4Å; F275-Q283 HydrophobicContact CE1-CB 3.64Å; F275-Q283 HydrophobicContact CE1-CG 3.5Å; F275-Q283 VanDerWaalsContact CE1-OE1 3.28Å; F275-Q283 HydrophobicContact CE2-CB 4.15Å; F275-Q283 HydrophobicContact CE2-CG 4.19Å; F275-Q283 HydrophobicContact CZ-CB 3.37Å; F275-Q283 HydrophobicContact CZ-CG 3.62Å; F275-Q283 PolarHBondContact O-NE2 3.15Å; F275-L286 HydrophobicContact CD2-CD1 4.26Å; F275-L286 HydrophobicContact CE2-CB 4.23Å; F275-L286 HydrophobicContact CE2-CD1 3.95Å; F275-V287 HydrophobicContact CE2-CG2 4.18Å; F275-V287 HydrophobicContact CZ-CG2 3.65Å; F275-L386 HydrophobicContact CD2-CD1 4.3Å; F275-L386 HydrophobicContact CD2-CD2 4.27Å; F275-L386 HydrophobicContact CE2-CD1 4.07Å; F275-L466 HydrophobicContact CE1-CD2 4.07Å; F275-L466 HydrophobicContact CZ-CD2 4.4Å
276	Q	91.4	Very high	91.9	Very high	105 Å²	105	45.2 Å²	45.2	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-25.2	-179.8	-69.2	178.3	4.7	0	0	114.1	K270 L272 P273 L278	K270-Q276 VanDerWaalsContact O-CG 3.26Å; K270-Q276 WeakPolarHBondContact O-CG 3.18Å; K270-Q276 PolarHBondContact O-NE2 3.2Å; L272-Q276 WeakPolarHBondContact O-CG 3.04Å; L272-Q276 PolarHBondContact O-N 2.97Å; P273-Q276 PolarHBondContact O-N 2.89Å; Q276-L278 PolarHBondContact O-N 3.17Å
277	V	90.2	Very high	92.2	Very high	112 Å²	112	45.2 Å²	45.2	68%	0.679	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-21	176.8	175.1	0	0	0	0	111.9	P273 F275	P273-V277 WeakPolarHBondContact O-CG2 3.42Å; P273-V277 PolarHBondContact O-N 3.33Å; F275-V277 PolarHBondContact O-N 2.85Å
278	L	91	Very high	92.6	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.23	C	C	.	.	S	Bend	trans	-74	144.4	-179.7	-62.9	174.4	0	0	0	111.4	F275 Q276 Q282 Q283 L286 C396 Y399 I400	F275-L278 HydrophobicContact CD2-CD1 4.13Å; F275-L278 HydrophobicContact CE2-CD1 4.49Å; F275-L278 VanDerWaalsContact O-CB 3.28Å; F275-L278 WeakPolarHBondContact O-CB 3.25Å; F275-L278 PolarHBondContact O-N 3.23Å; Q276-L278 PolarHBondContact O-N 3.17Å; L278-Q282 HydrophobicContact CB-CB 4.36Å; L278-Q283 HydrophobicContact CB-CG 3.71Å; L278-Q283 PolarHBondContact O-NE2 3.03Å; L278-L286 HydrophobicContact CD1-CD1 3.6Å; L278-C396 HydrophobicContact CD2-CB 4.27Å; L278-Y399 HydrophobicContact CD2-CD1 3.61Å; L278-Y399 HydrophobicContact CD2-CE1 3.68Å; L278-Y399 HydrophobicContact CG-CE1 4.18Å; L278-I400 HydrophobicContact CD1-CD1 3.95Å; L278-I400 HydrophobicContact CD2-CD1 4.32Å
279	P	92.3	Very high	92.9	Very high	74 Å²	74	46.7 Å²	46.7	48%	0.481	24%	0.24	S	C	.	.			trans	-55.8	148.8	165.4	-25.5	36.1	0	0	0	112.1	D281 Q282 Q283	P279-D281 VanDerWaalsContact C-N 3.27Å; P279-D281 WeakPolarHBondContact CB-OD1 3.44Å; P279-D281 PolarHBondContact O-N 3.46Å; P279-Q282 HydrophobicContact CB-CG 4.19Å; P279-Q282 HydrophobicContact CG-CG 4.27Å; P279-Q282 WeakPolarHBondContact O-CA 3.25Å; P279-Q282 WeakPolarHBondContact O-CB 3.45Å; P279-Q282 PolarHBondContact O-N 3.16Å; P279-Q283 WeakPolarHBondContact O-CG 3.32Å; P279-Q283 PolarHBondContact O-N 2.94Å
280	L	92.4	Very high	93	Very high	80 Å²	80	46.9 Å²	46.9	42%	0.419	24%	0.241	S	C	.	.	H	α-helix	trans	-58.1	-37.9	-175.4	178.9	63.3	0	0	0	112.9	Q282 Q283 L284	L280-Q282 VanDerWaalsContact C-N 3.32Å; L280-Q282 PolarHBondContact O-N 3.13Å; L280-Q283 WeakPolarHBondContact O-CB 3.47Å; L280-Q283 PolarHBondContact O-N 2.98Å; L280-L284 WeakPolarHBondContact O-CB 3.3Å; L280-L284 PolarHBondContact O-N 2.92Å
281	D	94	Very high	93.4	Very high	80 Å²	80	45.5 Å²	45.5	43%	0.428	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-40.7	175.7	60.2	-65.1	0	0	0	111.5	P279 L284 V285	P279-D281 VanDerWaalsContact C-N 3.27Å; P279-D281 WeakPolarHBondContact CB-OD1 3.44Å; P279-D281 PolarHBondContact O-N 3.46Å; D281-L284 PolarHBondContact O-N 3.48Å; D281-V285 VanDerWaalsContact O-CG2 3.31Å; D281-V285 WeakPolarHBondContact O-CG2 3.33Å; D281-V285 PolarHBondContact O-N 3.19Å
282	Q	96.3	Very high	93.8	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.028	21%	0.213	C	C	.	.	H	α-helix	trans	-71.4	-39	176.6	-59.1	-58.5	-62.9	0	0	111.9	L278 P279 L280 L284 V285 L286	L278-Q282 HydrophobicContact CB-CB 4.36Å; P279-Q282 HydrophobicContact CB-CG 4.19Å; P279-Q282 HydrophobicContact CG-CG 4.27Å; P279-Q282 WeakPolarHBondContact O-CA 3.25Å; P279-Q282 WeakPolarHBondContact O-CB 3.45Å; P279-Q282 PolarHBondContact O-N 3.16Å; L280-Q282 VanDerWaalsContact C-N 3.32Å; L280-Q282 PolarHBondContact O-N 3.13Å; Q282-L284 VanDerWaalsContact C-N 3.31Å; Q282-L284 PolarHBondContact O-N 3.22Å; Q282-V285 PolarHBondContact O-N 3.18Å; Q282-L286 PolarHBondContact O-N 3.08Å
283	Q	95.5	Very high	94.2	Very high	28 Å²	28	40.5 Å²	40.5	13%	0.131	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-45.5	172	-70.9	-174.8	25.5	0	0	111.3	F275 L278 P279 L280 L286 V287	F275-Q283 HydrophobicContact CD1-CG 4Å; F275-Q283 HydrophobicContact CE1-CB 3.64Å; F275-Q283 HydrophobicContact CE1-CG 3.5Å; F275-Q283 VanDerWaalsContact CE1-OE1 3.28Å; F275-Q283 HydrophobicContact CE2-CB 4.15Å; F275-Q283 HydrophobicContact CE2-CG 4.19Å; F275-Q283 HydrophobicContact CZ-CB 3.37Å; F275-Q283 HydrophobicContact CZ-CG 3.62Å; F275-Q283 PolarHBondContact O-NE2 3.15Å; L278-Q283 HydrophobicContact CB-CG 3.71Å; L278-Q283 PolarHBondContact O-NE2 3.03Å; P279-Q283 WeakPolarHBondContact O-CG 3.32Å; P279-Q283 PolarHBondContact O-N 2.94Å; L280-Q283 WeakPolarHBondContact O-CB 3.47Å; L280-Q283 PolarHBondContact O-N 2.98Å; Q283-L286 PolarHBondContact O-N 3.1Å; Q283-V287 WeakPolarHBondContact O-CG2 3.47Å; Q283-V287 PolarHBondContact O-N 3.5Å
284	L	95.9	Very high	94.8	Very high	21 Å²	21	38.1 Å²	38.1	11%	0.11	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-40.5	-179.2	-173.5	65.1	0	0	0	112	L280 D281 Q282 L286 V287 R288 M462 L463 L466	L280-L284 WeakPolarHBondContact O-CB 3.3Å; L280-L284 PolarHBondContact O-N 2.92Å; D281-L284 PolarHBondContact O-N 3.48Å; Q282-L284 VanDerWaalsContact C-N 3.31Å; Q282-L284 PolarHBondContact O-N 3.22Å; L284-L286 VanDerWaalsContact C-N 3.34Å; L284-L286 PolarHBondContact O-N 2.87Å; L284-V287 PolarHBondContact O-N 3.21Å; L284-R288 HydrophobicContact CD1-CG 4.02Å; L284-R288 HydrophobicContact CG-CG 4.17Å; L284-R288 VanDerWaalsContact O-CB 3.3Å; L284-R288 WeakPolarHBondContact O-CB 3.34Å; L284-R288 WeakPolarHBondContact O-CG 3.41Å; L284-R288 PolarHBondContact O-N 3.35Å; L284-M462 HydrophobicContact CD1-CB 4.41Å; L284-L463 HydrophobicContact CD1-CB 3.99Å; L284-L463 HydrophobicContact CD1-CD1 4.27Å; L284-L463 HydrophobicContact CD2-CD1 3.94Å; L284-L466 HydrophobicContact CB-CD1 4.39Å; L284-L466 HydrophobicContact CD1-CD1 3.96Å
285	V	97.5	Very high	95.3	Very high	38 Å²	38	37.4 Å²	37.4	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-47.7	175.1	166.8	0	0	0	0	111	D281 Q282 N289 V391 L394	D281-V285 VanDerWaalsContact O-CG2 3.31Å; D281-V285 WeakPolarHBondContact O-CG2 3.33Å; D281-V285 PolarHBondContact O-N 3.19Å; Q282-V285 PolarHBondContact O-N 3.18Å; V285-N289 WeakPolarHBondContact O-CB 3.36Å; V285-N289 PolarHBondContact O-N 3.47Å; V285-V391 HydrophobicContact CG1-CB 4.5Å; V285-V391 HydrophobicContact CG1-CG1 3.57Å; V285-L394 HydrophobicContact CB-CD2 4.29Å; V285-L394 HydrophobicContact CG1-CD2 3.74Å; V285-L394 HydrophobicContact CG1-CG 3.92Å
286	L	97.4	Very high	95.5	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-51.6	177.8	-67.4	175	0	0	0	111.4	F275 L278 Q282 Q283 L284 R288 N289 C290 L386 L394 I400	F275-L286 HydrophobicContact CD2-CD1 4.26Å; F275-L286 HydrophobicContact CE2-CB 4.23Å; F275-L286 HydrophobicContact CE2-CD1 3.95Å; L278-L286 HydrophobicContact CD1-CD1 3.6Å; Q282-L286 PolarHBondContact O-N 3.08Å; Q283-L286 PolarHBondContact O-N 3.1Å; L284-L286 VanDerWaalsContact C-N 3.34Å; L284-L286 PolarHBondContact O-N 2.87Å; L286-R288 PolarHBondContact O-N 3.07Å; L286-N289 PolarHBondContact O-N 3.4Å; L286-N289 VanDerWaalsContact O-N 3.16Å; L286-C290 PolarHBondContact O-N 3.36Å; L286-C290 PolarHBondContact O-SG 3.39Å; L286-L386 HydrophobicContact CB-CD1 4.34Å; L286-L394 HydrophobicContact CD2-CD1 3.87Å; L286-L394 HydrophobicContact CD2-CD2 3.8Å; L286-L394 HydrophobicContact CD2-CG 4.37Å; L286-L394 HydrophobicContact CG-CD2 4.02Å; L286-I400 HydrophobicContact CD1-CD1 3.8Å
287	V	97.3	Very high	95.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-43	-174.8	171.1	0	0	0	0	112.1	L266 V269 F275 Q283 L284 N289 C290 W291 M462 L466	L266-V287 HydrophobicContact CD2-CG1 3.65Å; V269-V287 HydrophobicContact CG1-CG2 4.01Å; F275-V287 HydrophobicContact CE2-CG2 4.18Å; F275-V287 HydrophobicContact CZ-CG2 3.65Å; Q283-V287 WeakPolarHBondContact O-CG2 3.47Å; Q283-V287 PolarHBondContact O-N 3.5Å; L284-V287 PolarHBondContact O-N 3.21Å; V287-N289 PolarHBondContact O-N 3.38Å; V287-C290 PolarHBondContact O-N 2.92Å; V287-W291 VanDerWaalsContact O-CB 3.32Å; V287-W291 WeakPolarHBondContact O-CB 3.29Å; V287-W291 PolarHBondContact O-N 3.12Å; V287-M462 HydrophobicContact CG1-CB 4.05Å; V287-M462 HydrophobicContact CG1-CG 4.04Å; V287-M462 HydrophobicContact CG1-SD 3.86Å; V287-L466 HydrophobicContact CB-CD1 4.03Å; V287-L466 HydrophobicContact CG1-CD1 4.28Å; V287-L466 HydrophobicContact CG2-CD1 4.05Å; V287-L466 HydrophobicContact CG2-CD2 4.22Å
288	R	96.1	Very high	96.2	Very high	92 Å²	92	27.3 Å²	27.3	35%	0.347	15%	0.146	S	C	.	.	H	α-helix	trans	-58.6	-35.7	175.1	-77.1	-176.9	172.3	168.3	-6	112.1	L284 L286 W291 D459 M462	L284-R288 HydrophobicContact CD1-CG 4.02Å; L284-R288 HydrophobicContact CG-CG 4.17Å; L284-R288 VanDerWaalsContact O-CB 3.3Å; L284-R288 WeakPolarHBondContact O-CB 3.34Å; L284-R288 WeakPolarHBondContact O-CG 3.41Å; L284-R288 PolarHBondContact O-N 3.35Å; L286-R288 PolarHBondContact O-N 3.07Å; R288-W291 VanDerWaalsContact O-CD1 3.27Å; R288-D459 PolarHBondContact NE-O 3.25Å; R288-D459 IonicContact NE-OD1 3.87Å; R288-D459 PolarHBondContact NH2-O 3.1Å; R288-M462 HydrophobicContact CG-CB 4.41Å
289	N	95.9	Very high	96.5	Very high	83 Å²	83	27 Å²	27	44%	0.444	14%	0.144	S	C	.	.	H	α-helix	trans	-76.1	-32.1	179.2	-171.7	79	0	0	0	113.3	V285 L286 V287 V391	V285-N289 WeakPolarHBondContact O-CB 3.36Å; V285-N289 PolarHBondContact O-N 3.47Å; L286-N289 PolarHBondContact O-N 3.4Å; L286-N289 VanDerWaalsContact O-N 3.16Å; V287-N289 PolarHBondContact O-N 3.38Å; N289-V391 HydrophobicContact CB-CG1 3.66Å; N289-V391 HydrophobicContact CB-CG2 4.06Å; N289-V391 VanDerWaalsContact ND2-CG2 3.35Å; N289-V391 WeakPolarHBondContact ND2-CG2 3.11Å
290	C	96.1	Very high	96.8	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.027	12%	0.121	C	C	.	.	H	α-helix	trans	-118.2	-5.6	-166.7	77.4	0	0	0	0	116	L286 V287 A292 S293 L294 V385	L286-C290 PolarHBondContact O-N 3.36Å; L286-C290 PolarHBondContact O-SG 3.39Å; V287-C290 PolarHBondContact O-N 2.92Å; C290-A292 PolarHBondContact O-N 2.97Å; C290-A292 VanDerWaalsContact O-N 3.16Å; C290-S293 PolarHBondContact O-N 3.48Å; C290-L294 HydrophobicContact CB-CG 4.47Å; C290-L294 WeakPolarHBondContact O-CG 3.46Å; C290-L294 PolarHBondContact O-N 3.26Å; C290-L294 WeakPolarHBondContact SG-CD1 3.35Å; C290-V385 HydrophobicContact CB-CG1 3.85Å
291	W	97	Very high	97	Very high	12 Å²	12	21.4 Å²	21.4	5%	0.045	11%	0.109	C	C	.	.	H	α-helix	trans	-53.5	-40.6	-175.5	71.1	-92.1	0	0	0	112.9	L262 V287 R288 L294 L295 A441 I444 A445 F449 M458 M462	L262-W291 HydrophobicContact CD1-CE3 4.11Å; V287-W291 VanDerWaalsContact O-CB 3.32Å; V287-W291 WeakPolarHBondContact O-CB 3.29Å; V287-W291 PolarHBondContact O-N 3.12Å; R288-W291 VanDerWaalsContact O-CD1 3.27Å; W291-L294 PolarHBondContact O-N 3.42Å; W291-L295 HydrophobicContact CZ3-CD2 4.18Å; W291-L295 VanDerWaalsContact O-CB 3.27Å; W291-L295 WeakPolarHBondContact O-CB 3.47Å; W291-L295 PolarHBondContact O-N 3.15Å; W291-A441 HydrophobicContact CZ2-CB 4.07Å; W291-I444 HydrophobicContact CH2-CB 4.46Å; W291-I444 HydrophobicContact CH2-CG2 4.01Å; W291-I444 HydrophobicContact CZ3-CG2 3.84Å; W291-A445 HydrophobicContact CH2-CB 4.23Å; W291-F449 HydrophobicContact CZ3-CD2 4.37Å; W291-F449 AromaticContact CZ3-CE2 3.89Å; W291-F449 HydrophobicContact CZ3-CE2 3.89Å; W291-M458 HydrophobicContact CD2-CE 4.28Å; W291-M458 HydrophobicContact CE3-CE 3.82Å; W291-M458 HydrophobicContact CH2-CE 3.45Å; W291-M458 VanDerWaalsContact CH2-CE 3.45Å; W291-M458 HydrophobicContact CH2-CG 3.99Å; W291-M458 HydrophobicContact CH2-SD 4.4Å; W291-M458 HydrophobicContact CZ2-CB 3.92Å; W291-M458 HydrophobicContact CZ2-CE 3.92Å; W291-M458 HydrophobicContact CZ2-CG 3.8Å; W291-M458 HydrophobicContact CZ3-CE 3.39Å; W291-M462 HydrophobicContact CB-CE 3.98Å; W291-M462 HydrophobicContact CB-CG 4.38Å; W291-M462 HydrophobicContact CB-SD 3.51Å; W291-M462 VanDerWaalsContact CB-SD 3.51Å; W291-M462 HydrophobicContact CD2-CE 3.67Å; W291-M462 HydrophobicContact CD2-SD 4.37Å; W291-M462 HydrophobicContact CE3-CE 3.94Å; W291-M462 HydrophobicContact CG-CE 3.69Å; W291-M462 HydrophobicContact CG-CG 4.21Å; W291-M462 HydrophobicContact CG-SD 3.74Å
292	A	97.4	Very high	97.1	Very high	8 Å²	8	21.7 Å²	21.7	7%	0.066	11%	0.111	C	C	.	.	H	α-helix	trans	-67.6	-45.2	-177.6	0	0	0	0	0	111.7	C290 L295 M296 A441 I444	C290-A292 PolarHBondContact O-N 2.97Å; C290-A292 VanDerWaalsContact O-N 3.16Å; A292-L295 PolarHBondContact O-N 3.38Å; A292-M296 WeakPolarHBondContact O-CG 3.37Å; A292-M296 PolarHBondContact O-N 3.1Å; A292-A441 HydrophobicContact CB-CB 3.54Å; A292-I444 HydrophobicContact CB-CD1 3.83Å
293	S	97.7	Very high	97.1	Very high	32 Å²	32	27 Å²	27	22%	0.224	13%	0.131	C	C	.	.	H	α-helix	trans	-66.8	-39.3	177.1	-60	0	0	0	0	112.1	C290 M296 L297	C290-S293 PolarHBondContact O-N 3.48Å; S293-M296 PolarHBondContact O-N 2.96Å; S293-L297 PolarHBondContact O-N 3.49Å; S293-L297 VanDerWaalsContact O-N 3.15Å
294	L	97.9	Very high	97.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-42.7	175.1	-67.5	178.3	0	0	0	111.8	T265 V269 C290 W291 M296 L297 E298 K382 V385 L386	T265-L294 HydrophobicContact CG2-CB 3.38Å; T265-L294 HydrophobicContact CG2-CD1 4.04Å; T265-L294 HydrophobicContact CG2-CG 4.34Å; V269-L294 HydrophobicContact CG2-CD1 3.75Å; C290-L294 HydrophobicContact CB-CG 4.47Å; C290-L294 WeakPolarHBondContact O-CG 3.46Å; C290-L294 PolarHBondContact O-N 3.26Å; C290-L294 WeakPolarHBondContact SG-CD1 3.35Å; W291-L294 PolarHBondContact O-N 3.42Å; L294-M296 VanDerWaalsContact C-N 3.34Å; L294-M296 PolarHBondContact O-N 2.93Å; L294-L297 PolarHBondContact O-N 3.47Å; L294-E298 PolarHBondContact O-N 2.97Å; L294-K382 HydrophobicContact CD2-CB 3.77Å; L294-K382 HydrophobicContact CD2-CG 4Å; L294-K382 WeakPolarHBondContact CD2-O 3.39Å; L294-V385 HydrophobicContact CD2-CB 3.93Å; L294-V385 HydrophobicContact CD2-CG1 3.7Å; L294-V385 HydrophobicContact CG-CG1 3.9Å; L294-L386 HydrophobicContact CD1-CD1 4.43Å
295	L	98.3	Very high	96.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-45.3	174.4	176.6	66.1	0	0	0	110.9	A258 L262 W291 A292 L297 E298 L299 I444 F449	A258-L295 WeakPolarHBondContact O-CD1 3.46Å; L262-L295 HydrophobicContact CB-CD1 4.08Å; W291-L295 HydrophobicContact CZ3-CD2 4.18Å; W291-L295 VanDerWaalsContact O-CB 3.27Å; W291-L295 WeakPolarHBondContact O-CB 3.47Å; W291-L295 PolarHBondContact O-N 3.15Å; A292-L295 PolarHBondContact O-N 3.38Å; L295-L297 VanDerWaalsContact C-N 3.29Å; L295-L297 PolarHBondContact O-N 3.31Å; L295-E298 WeakPolarHBondContact O-CA 3.4Å; L295-E298 WeakPolarHBondContact O-CB 3.47Å; L295-E298 PolarHBondContact O-N 3.48Å; L295-L299 HydrophobicContact CD1-CD1 4.16Å; L295-L299 HydrophobicContact CD1-CD2 4.14Å; L295-L299 HydrophobicContact CD1-CG 3.95Å; L295-L299 HydrophobicContact CD2-CD1 4.4Å; L295-L299 HydrophobicContact CG-CD1 3.9Å; L295-L299 HydrophobicContact CG-CG 4.11Å; L295-L299 VanDerWaalsContact O-CG 3.31Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.33Å; L295-I444 HydrophobicContact CD2-CG2 3.78Å; L295-F449 HydrophobicContact CD2-CE2 3.42Å; L295-F449 VanDerWaalsContact CD2-CE2 3.42Å; L295-F449 HydrophobicContact CD2-CZ 3.47Å; L295-F449 VanDerWaalsContact CD2-CZ 3.47Å
296	M	98.3	Very high	96.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-40.5	177.6	-75.5	-51.6	-49.5	0	0	112.5	A292 S293 L294 A300 I361 F364 L365 L436 I439 I444	A292-M296 WeakPolarHBondContact O-CG 3.37Å; A292-M296 PolarHBondContact O-N 3.1Å; S293-M296 PolarHBondContact O-N 2.96Å; L294-M296 VanDerWaalsContact C-N 3.34Å; L294-M296 PolarHBondContact O-N 2.93Å; M296-A300 WeakPolarHBondContact O-CB 3.29Å; M296-A300 PolarHBondContact O-N 3.28Å; M296-I361 HydrophobicContact CE-CG2 3.62Å; M296-I361 HydrophobicContact SD-CG2 4.05Å; M296-F364 HydrophobicContact CB-CD1 4.22Å; M296-F364 HydrophobicContact CB-CE1 3.78Å; M296-F364 HydrophobicContact CE-CD1 3.59Å; M296-F364 HydrophobicContact CE-CE1 4.12Å; M296-L365 HydrophobicContact CE-CD1 4.41Å; M296-L365 HydrophobicContact CE-CD2 3.61Å; M296-L365 HydrophobicContact CE-CG 3.85Å; M296-L436 HydrophobicContact CB-CD2 3.62Å; M296-L436 HydrophobicContact CG-CD2 4.23Å; M296-I439 HydrophobicContact CE-CD1 4.24Å; M296-I439 HydrophobicContact CG-CD1 4.3Å; M296-I444 HydrophobicContact CG-CD1 3.63Å; M296-I444 HydrophobicContact SD-CD1 3.9Å; M296-I444 HydrophobicContact SD-CG1 4.22Å
297	L	98.3	Very high	96.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-38.7	173.3	-71.7	169.7	0	0	0	112.1	S293 L294 L295 Q301 F364 Y378 L381 K382 V385 L433 L436	S293-L297 PolarHBondContact O-N 3.49Å; S293-L297 VanDerWaalsContact O-N 3.15Å; L294-L297 PolarHBondContact O-N 3.47Å; L295-L297 VanDerWaalsContact C-N 3.29Å; L295-L297 PolarHBondContact O-N 3.31Å; L297-Q301 WeakPolarHBondContact O-CB 3.25Å; L297-Q301 PolarHBondContact O-N 3.37Å; L297-F364 HydrophobicContact CD2-CZ 4.01Å; L297-Y378 HydrophobicContact CD2-CD1 4.29Å; L297-Y378 HydrophobicContact CD2-CE1 4.32Å; L297-L381 HydrophobicContact CD1-CB 4.1Å; L297-L381 HydrophobicContact CD2-CB 4.32Å; L297-L381 HydrophobicContact CD2-CD1 4.26Å; L297-K382 HydrophobicContact CB-CG 4.19Å; L297-K382 HydrophobicContact CD1-CG 3.97Å; L297-V385 HydrophobicContact CD1-CG2 4.02Å; L297-L433 HydrophobicContact CD1-CD2 4.17Å; L297-L433 HydrophobicContact CD2-CD2 4.34Å; L297-L436 HydrophobicContact CD1-CD1 4.3Å; L297-L436 HydrophobicContact CD2-CD1 4.33Å; L297-L436 HydrophobicContact CG-CD1 4.1Å
298	E	97.8	Very high	96.1	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-47.1	176.6	-164.2	70.6	-114.8	0	0	111.9	K264 T265 L294 L295 A300 Q301 D302 K382	K264-E298 HydrophobicContact CD-CG 4.12Å; K264-E298 VanDerWaalsContact CD-OE1 3.31Å; K264-E298 WeakPolarHBondContact CD-OE1 3.29Å; K264-E298 WeakPolarHBondContact CE-OE1 3.27Å; K264-E298 IonicContact NZ-OE1 2.73Å; K264-E298 PolarHBondContact NZ-OE1 2.74Å; T265-E298 WeakPolarHBondContact OG1-CB 3.14Å; L294-E298 PolarHBondContact O-N 2.97Å; L295-E298 WeakPolarHBondContact O-CA 3.4Å; L295-E298 WeakPolarHBondContact O-CB 3.47Å; L295-E298 PolarHBondContact O-N 3.48Å; E298-A300 VanDerWaalsContact C-N 3.28Å; E298-A300 PolarHBondContact O-N 2.89Å; E298-Q301 WeakPolarHBondContact O-CB 3.35Å; E298-Q301 PolarHBondContact O-N 3.3Å; E298-Q301 VanDerWaalsContact O-N 3.12Å; E298-D302 PolarHBondContact O-N 3.21Å; E298-K382 IonicContact OE1-NZ 3.95Å; E298-K382 PolarHBondContact OE1-NZ 3.07Å; E298-K382 IonicContact OE2-NZ 2.68Å; E298-K382 PolarHBondContact OE2-NZ 2.71Å
299	L	97.9	Very high	95.6	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-35.9	177.6	-62.4	176.4	0	0	0	111.7	A258 L295 R303 L304 L365 F448	A258-L299 HydrophobicContact CB-CD2 4.34Å; L295-L299 HydrophobicContact CD1-CD1 4.16Å; L295-L299 HydrophobicContact CD1-CD2 4.14Å; L295-L299 HydrophobicContact CD1-CG 3.95Å; L295-L299 HydrophobicContact CD2-CD1 4.4Å; L295-L299 HydrophobicContact CG-CD1 3.9Å; L295-L299 HydrophobicContact CG-CG 4.11Å; L295-L299 VanDerWaalsContact O-CG 3.31Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.33Å; L299-R303 PolarHBondContact O-N 2.8Å; L299-L304 HydrophobicContact CB-CB 4.19Å; L299-L304 HydrophobicContact CB-CD2 4.25Å; L299-L304 HydrophobicContact CD1-CD2 4.06Å; L299-L304 HydrophobicContact CD2-CB 4.38Å; L299-L304 HydrophobicContact CD2-CD2 3.52Å; L299-L304 HydrophobicContact CG-CD2 4.12Å; L299-L304 PolarHBondContact O-N 3.45Å; L299-L365 HydrophobicContact CB-CD2 4.28Å; L299-F448 HydrophobicContact CD1-CE2 4.42Å
300	A	97.8	Very high	95	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-45.5	172.1	0	0	0	0	0	111.6	M296 E298 R303 F364 L365 C368 W369 Y378	M296-A300 WeakPolarHBondContact O-CB 3.29Å; M296-A300 PolarHBondContact O-N 3.28Å; E298-A300 VanDerWaalsContact C-N 3.28Å; E298-A300 PolarHBondContact O-N 2.89Å; A300-R303 PolarHBondContact O-N 3.22Å; A300-R303 VanDerWaalsContact O-N 3.13Å; A300-F364 HydrophobicContact CB-CE1 4.42Å; A300-L365 HydrophobicContact CB-CD2 3.77Å; A300-C368 HydrophobicContact CB-CB 3.7Å; A300-W369 PolarHBondContact O-NE1 3.42Å; A300-Y378 HydrophobicContact CB-CE1 4.2Å
301	Q	97.1	Very high	94	Very high	38 Å²	38	41.8 Å²	41.8	18%	0.178	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-40.4	178.9	-174.9	173.2	2.6	0	0	112.1	L297 E298 R303 Y378	L297-Q301 WeakPolarHBondContact O-CB 3.25Å; L297-Q301 PolarHBondContact O-N 3.37Å; E298-Q301 WeakPolarHBondContact O-CB 3.35Å; E298-Q301 PolarHBondContact O-N 3.3Å; E298-Q301 VanDerWaalsContact O-N 3.12Å; Q301-R303 PolarHBondContact O-N 3.45Å; Q301-Y378 HydrophobicContact CB-CD1 4.13Å; Q301-Y378 HydrophobicContact CB-CD2 3.97Å; Q301-Y378 HydrophobicContact CB-CE1 4.12Å; Q301-Y378 HydrophobicContact CB-CE2 3.93Å; Q301-Y378 HydrophobicContact CB-CG 4.07Å; Q301-Y378 HydrophobicContact CG-CD2 3.76Å; Q301-Y378 HydrophobicContact CG-CE2 4.03Å; Q301-Y378 HydrophobicContact CG-CG 4.1Å
302	D	96.1	Very high	92.3	Very high	85 Å²	85	46.3 Å²	46.3	46%	0.455	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	4.4	177.2	-71	-15.3	0	0	0	113.1	K264 E298 L304	K264-D302 VanDerWaalsContact NZ-CG 3.25Å; K264-D302 IonicContact NZ-OD1 3.52Å; K264-D302 PolarHBondContact NZ-OD1 3.5Å; K264-D302 IonicContact NZ-OD2 2.81Å; K264-D302 PolarHBondContact NZ-OD2 2.87Å; E298-D302 PolarHBondContact O-N 3.21Å; D302-L304 VanDerWaalsContact C-N 3.26Å; D302-L304 PolarHBondContact O-N 3.36Å
303	R	95.4	Very high	90.4	Very high	119 Å²	119	52.2 Å²	52.2	45%	0.449	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	38.5	178.3	-57.2	-76.4	-172.1	170.7	0.6	112.6	L299 A300 Q301 Q305 W369	L299-R303 PolarHBondContact O-N 2.8Å; A300-R303 PolarHBondContact O-N 3.22Å; A300-R303 VanDerWaalsContact O-N 3.13Å; Q301-R303 PolarHBondContact O-N 3.45Å; R303-Q305 PolarHBondContact O-N 3.44Å; R303-Q305 VanDerWaalsContact O-N 3.15Å; R303-W369 VanDerWaalsContact CD-CD1 3.47Å; R303-W369 VanDerWaalsContact NH1-CD1 3.27Å; R303-W369 PolarHBondContact NH1-O 3.21Å
304	L	94.9	Very high	88.3	Confident	24 Å²	24	53.7 Å²	53.7	13%	0.126	28%	0.277	C	S	.	.			trans	-63	117.1	-179.6	-179.7	67.2	0	0	0	110.9	V254 A257 L299 D302 W369	V254-L304 HydrophobicContact CG1-CD2 4.44Å; A257-L304 HydrophobicContact CB-CD1 3.83Å; L299-L304 HydrophobicContact CB-CB 4.19Å; L299-L304 HydrophobicContact CB-CD2 4.25Å; L299-L304 HydrophobicContact CD1-CD2 4.06Å; L299-L304 HydrophobicContact CD2-CB 4.38Å; L299-L304 HydrophobicContact CD2-CD2 3.52Å; L299-L304 HydrophobicContact CG-CD2 4.12Å; L299-L304 PolarHBondContact O-N 3.45Å; D302-L304 VanDerWaalsContact C-N 3.26Å; D302-L304 PolarHBondContact O-N 3.36Å; L304-W369 VanDerWaalsContact O-CH2 3.29Å; L304-W369 WeakPolarHBondContact O-CH2 3.46Å; L304-W369 VanDerWaalsContact O-CZ2 3.28Å; L304-W369 WeakPolarHBondContact O-CZ2 3.36Å
305	Q	92.9	Very high	86.4	Confident	154 Å²	154	56.6 Å²	56.6	72%	0.72	30%	0.298	S	S	*	.			trans	-105.5	137.2	172.3	-64.8	175.8	19.6	0	0	109.5	R303 W369	R303-Q305 PolarHBondContact O-N 3.44Å; R303-Q305 VanDerWaalsContact O-N 3.15Å; Q305-W369 HydrophobicContact CG-CH2 3.88Å; Q305-W369 HydrophobicContact CG-CZ3 4.31Å
306	F	93.7	Very high	84.5	Confident	20 Å²	20	64 Å²	64	9%	0.088	33%	0.334	C	S	.	.			trans	-146.6	146.9	176.6	66	-89.1	0	0	0	111.5	L248 V254 T308 V358 I361 K362 L365 L447 F448	L248-F306 HydrophobicContact CD2-CB 4.43Å; L248-F306 HydrophobicContact CD2-CD2 3.6Å; L248-F306 HydrophobicContact CD2-CE2 4.21Å; L248-F306 HydrophobicContact CD2-CG 4.26Å; V254-F306 HydrophobicContact CB-CB 4.44Å; V254-F306 HydrophobicContact CG1-CB 3.8Å; V254-F306 HydrophobicContact CG1-CG 4.26Å; V254-F306 HydrophobicContact CG2-CB 3.71Å; F306-T308 HydrophobicContact CD2-CG2 3.94Å; F306-T308 HydrophobicContact CE2-CG2 3.98Å; F306-V358 HydrophobicContact CE2-CG1 3.97Å; F306-I361 HydrophobicContact CE1-CG2 4.15Å; F306-I361 HydrophobicContact CZ-CG2 3.84Å; F306-K362 HydrophobicContact CE2-CG 4.21Å; F306-K362 HydrophobicContact CZ-CG 3.88Å; F306-L365 HydrophobicContact CD1-CD1 4.46Å; F306-L365 HydrophobicContact CE1-CD1 3.74Å; F306-L447 HydrophobicContact CE2-CD2 4.28Å; F306-L447 HydrophobicContact CZ-CD2 4.45Å; F306-F448 HydrophobicContact CD1-CE1 4.4Å; F306-F448 HydrophobicContact CD1-CZ 4.45Å; F306-F448 HydrophobicContact CE1-CE1 4.32Å; F306-F448 AromaticContact CE1-CZ 3.94Å; F306-F448 HydrophobicContact CE1-CZ 3.94Å; F306-F448 HydrophobicContact CZ-CZ 4.06Å
307	E	91.3	Very high	82.5	Confident	114 Å²	114	69.7 Å²	69.7	53%	0.533	36%	0.364	S	S	.	.			trans	-109.7	154.7	177.6	-66.4	-174.6	-172.1	0	0	111	K249	K249-E307 HydrophobicContact CB-CB 4.26Å; K249-E307 HydrophobicContact CD-CB 3.64Å; K249-E307 VanDerWaalsContact CD-OE2 3.26Å; K249-E307 WeakPolarHBondContact CD-OE2 3.35Å; K249-E307 WeakPolarHBondContact CE-OE2 3.43Å; K249-E307 HydrophobicContact CG-CB 4.03Å; K249-E307 PolarHBondContact N-O 3.2Å; K249-E307 IonicContact NZ-OE2 2.67Å; K249-E307 PolarHBondContact NZ-OE2 3Å
308	T	89.5	Confident	80.5	Confident	34 Å²	34	74.7 Å²	74.7	21%	0.209	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	151.7	-176.3	56.8	0	0	0	0	111.9	V246 A247 L248 F306 V358 K362	V246-T308 HydrophobicContact CG1-CG2 3.83Å; A247-T308 CarbonylContact O-C 3.48Å; A247-T308 WeakPolarHBondContact O-CA 3.41Å; A247-T308 WeakPolarHBondContact O-CB 3.42Å; L248-T308 HydrophobicContact CD2-CG2 4.17Å; F306-T308 HydrophobicContact CD2-CG2 3.94Å; F306-T308 HydrophobicContact CE2-CG2 3.98Å; T308-V358 HydrophobicContact CG2-CG1 3.79Å; T308-K362 PolarHBondContact OG1-NZ 3.37Å
309	V	87	Confident	78.9	Confident	73 Å²	73	79 Å²	79	44%	0.442	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.7	177.5	166.6	0	0	0	0	108.9	V246 A247 K249 V311	V246-V309 WeakPolarHBondContact CA-O 3.16Å; A247-V309 PolarHBondContact N-O 3.19Å; A247-V309 PolarHBondContact O-N 3.05Å; K249-V309 HydrophobicContact CD-CG2 3.87Å; K249-V309 VanDerWaalsContact CE-CG2 3.48Å; K249-V309 HydrophobicContact CG-CB 4.35Å; K249-V309 HydrophobicContact CG-CG2 3.36Å; V309-V311 PolarHBondContact O-N 2.82Å
310	E	82.8	Confident	77.6	Confident	97 Å²	97	83.6 Å²	83.6	45%	0.453	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	125.9	171.4	-66.2	-167.9	168.4	0	0	109.3	R244 S312	R244-E310 WeakPolarHBondContact CD-OE1 3.34Å; R244-E310 WeakPolarHBondContact CD-OE2 3.44Å; R244-E310 IonicContact CZ-OE2 3.74Å; R244-E310 IonicContact NH1-OE1 3.19Å; R244-E310 PolarHBondContact NH1-OE1 3.4Å; R244-E310 IonicContact NH1-OE2 3.06Å; R244-E310 PolarHBondContact NH1-OE2 2.93Å; E310-S312 PolarHBondContact O-N 3.17Å
311	V	74.8	Confident	75.8	Confident	61 Å²	61	88.9 Å²	88.9	37%	0.37	46%	0.457	S	S	.	.			trans	-84.3	96.8	174.8	-175	0	0	0	0	106.9	P245 A247 V309 E313	P245-V311 HydrophobicContact CB-CB 4.47Å; P245-V311 HydrophobicContact CG-CB 4.33Å; P245-V311 PolarHBondContact O-N 2.86Å; A247-V311 HydrophobicContact CB-CG2 3.52Å; V309-V311 PolarHBondContact O-N 2.82Å; V311-E313 PolarHBondContact O-N 3.49Å; V311-E313 VanDerWaalsContact O-N 3.11Å
312	S	62.2	Low	73.9	Confident	107 Å²	107	91.3 Å²	91.3	75%	0.748	48%	0.475	S	S	*	.			trans	-67.4	107.9	167.3	-66.2	0	0	0	0	108.4	E310	E310-S312 PolarHBondContact O-N 3.17Å
313	E	56	Low	72	Confident	132 Å²	132	91.5 Å²	91.5	62%	0.617	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-56.9	128.1	162.7	-81	-115.5	165.5	0	0	107.9	V311 S315 K319	V311-E313 PolarHBondContact O-N 3.49Å; V311-E313 VanDerWaalsContact O-N 3.11Å; E313-S315 PolarHBondContact O-N 3.39Å; E313-K319 IonicContact OE2-NZ 3.03Å; E313-K319 PolarHBondContact OE2-NZ 2.9Å
314	P	53.5	Low	69.7	Low	62 Å²	62	94 Å²	94	40%	0.403	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-57.7	128.8	172	23.2	-29.5	0	0	0	107.1	Q318 K319	P314-Q318 HydrophobicContact CB-CB 4.14Å; P314-Q318 HydrophobicContact CB-CG 4.24Å; P314-K319 HydrophobicContact CG-CG 4.24Å; P314-K319 WeakPolarHBondContact O-CE 3.07Å
315	S	58.2	Low	67.4	Low	62 Å²	62	103 Å²	103	43%	0.434	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-50.7	149.1	-175.4	67.5	0	0	0	0	109.9	E313 L317 Q318 K319	E313-S315 PolarHBondContact O-N 3.39Å; S315-L317 CarbonylContact O-C 3.54Å; S315-L317 PolarHBondContact O-N 3.25Å; S315-Q318 WeakPolarHBondContact O-CA 3.4Å; S315-Q318 WeakPolarHBondContact O-CB 3.3Å; S315-Q318 PolarHBondContact O-N 2.94Å; S315-Q318 PolarHBondContact OG-N 2.98Å; S315-Q318 VanDerWaalsContact OG-N 3.16Å; S315-K319 PolarHBondContact O-N 3.08Å
316	M	59.1	Low	65.4	Low	155 Å²	155	106.8 Å²	106.8	76%	0.764	53%	0.529	S	S	*	.	H	α-helix	trans	-52.5	-32.2	176.7	-71.9	-139.3	-68.1	0	0	111.5	K319 I320	M316-K319 PolarHBondContact O-N 3.07Å; M316-I320 WeakPolarHBondContact O-CB 3.13Å; M316-I320 WeakPolarHBondContact O-CD1 3.43Å; M316-I320 WeakPolarHBondContact O-CG1 2.71Å; M316-I320 PolarHBondContact O-N 3.48Å
317	L	57.1	Low	63.2	Low	121 Å²	121	113.4 Å²	113.4	63%	0.634	56%	0.56	S	S	*	*	H	α-helix	trans	-61.2	-44.2	170.8	-66.9	174.5	0	0	0	112.6	S315 I320 L321	S315-L317 CarbonylContact O-C 3.54Å; S315-L317 PolarHBondContact O-N 3.25Å; L317-I320 PolarHBondContact O-N 3.4Å; L317-L321 VanDerWaalsContact O-CB 3.26Å; L317-L321 WeakPolarHBondContact O-CB 3.44Å; L317-L321 WeakPolarHBondContact O-CD1 3.31Å; L317-L321 WeakPolarHBondContact O-CG 3.28Å; L317-L321 PolarHBondContact O-N 3.42Å
318	Q	56.5	Low	61	Low	105 Å²	105	113.9 Å²	113.9	49%	0.491	57%	0.571	S	S	.	*	H	α-helix	trans	-66.8	-35.6	176.7	-160.7	171.7	11.8	0	0	112.4	P314 S315 T322	P314-Q318 HydrophobicContact CB-CB 4.14Å; P314-Q318 HydrophobicContact CB-CG 4.24Å; S315-Q318 WeakPolarHBondContact O-CA 3.4Å; S315-Q318 WeakPolarHBondContact O-CB 3.3Å; S315-Q318 PolarHBondContact O-N 2.94Å; S315-Q318 PolarHBondContact OG-N 2.98Å; S315-Q318 VanDerWaalsContact OG-N 3.16Å; Q318-T322 WeakPolarHBondContact O-CB 3.5Å; Q318-T322 VanDerWaalsContact O-CG2 3.28Å; Q318-T322 WeakPolarHBondContact O-CG2 3.21Å; Q318-T322 PolarHBondContact O-N 3.44Å; Q318-T322 PolarHBondContact O-OG1 3.37Å
319	K	64.1	Low	58.6	Low	94 Å²	94	115.4 Å²	115.4	41%	0.409	59%	0.593	S	S	.	*	H	α-helix	trans	-64.5	-41.4	170.6	-66.4	-178.2	-173.6	172.1	0	111.9	E313 P314 S315 M316 T322 T323	E313-K319 IonicContact OE2-NZ 3.03Å; E313-K319 PolarHBondContact OE2-NZ 2.9Å; P314-K319 HydrophobicContact CG-CG 4.24Å; P314-K319 WeakPolarHBondContact O-CE 3.07Å; S315-K319 PolarHBondContact O-N 3.08Å; M316-K319 PolarHBondContact O-N 3.07Å; K319-T322 PolarHBondContact O-OG1 2.73Å; K319-T323 WeakPolarHBondContact O-CG2 3.24Å; K319-T323 PolarHBondContact O-N 2.81Å; K319-T323 PolarHBondContact O-OG1 2.84Å
320	I	68.8	Low	56.2	Low	98 Å²	98	115.4 Å²	115.4	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-70.3	-39.5	176.8	-67.4	162.7	0	0	0	111.7	M316 L317 T323 R324	M316-I320 WeakPolarHBondContact O-CB 3.13Å; M316-I320 WeakPolarHBondContact O-CD1 3.43Å; M316-I320 WeakPolarHBondContact O-CG1 2.71Å; M316-I320 PolarHBondContact O-N 3.48Å; L317-I320 PolarHBondContact O-N 3.4Å; I320-T323 VanDerWaalsContact CA-OG1 3.31Å; I320-T323 WeakPolarHBondContact CA-OG1 3.36Å; I320-T323 PolarHBondContact O-OG1 3.45Å; I320-R324 VanDerWaalsContact O-CB 3.27Å; I320-R324 WeakPolarHBondContact O-CB 3.18Å; I320-R324 PolarHBondContact O-N 3.43Å
321	L	60.4	Low	54	Low	112 Å²	112	118.6 Å²	118.6	59%	0.586	63%	0.628	S	S	*	*	H	α-helix	trans	-71.1	-34.9	-179.4	-72.5	168.5	0	0	0	112.1	L317 R325	L317-L321 VanDerWaalsContact O-CB 3.26Å; L317-L321 WeakPolarHBondContact O-CB 3.44Å; L317-L321 WeakPolarHBondContact O-CD1 3.31Å; L317-L321 WeakPolarHBondContact O-CG 3.28Å; L317-L321 PolarHBondContact O-N 3.42Å; L321-R325 WeakPolarHBondContact O-CB 3.26Å; L321-R325 PolarHBondContact O-N 2.88Å
322	T	56.9	Low	51.8	Low	89 Å²	89	124.5 Å²	124.5	55%	0.546	65%	0.652	S	S	.	*	H	α-helix	trans	-76.7	-33.6	177.5	48.7	0	0	0	0	112.8	Q318 K319	Q318-T322 WeakPolarHBondContact O-CB 3.5Å; Q318-T322 VanDerWaalsContact O-CG2 3.28Å; Q318-T322 WeakPolarHBondContact O-CG2 3.21Å; Q318-T322 PolarHBondContact O-N 3.44Å; Q318-T322 PolarHBondContact O-OG1 3.37Å; K319-T322 PolarHBondContact O-OG1 2.73Å
323	T	56.6	Low	50.9	Low	88 Å²	88	123.7 Å²	123.7	54%	0.54	64%	0.644	S	S	.	*	H	α-helix	trans	-67	-46.3	170.4	40.3	0	0	0	0	111.2	K319 I320 R325 R326	K319-T323 WeakPolarHBondContact O-CG2 3.24Å; K319-T323 PolarHBondContact O-N 2.81Å; K319-T323 PolarHBondContact O-OG1 2.84Å; I320-T323 VanDerWaalsContact CA-OG1 3.31Å; I320-T323 WeakPolarHBondContact CA-OG1 3.36Å; I320-T323 PolarHBondContact O-OG1 3.45Å; T323-R325 VanDerWaalsContact C-N 3.35Å; T323-R325 PolarHBondContact O-N 3.11Å; T323-R326 WeakPolarHBondContact O-CB 3.41Å; T323-R326 PolarHBondContact O-N 3.12Å; T323-R326 VanDerWaalsContact O-N 3.15Å
324	R	47.6	Very low	49.8	Very low	173 Å²	173	125.2 Å²	125.2	65%	0.653	66%	0.656	S	S	*	*	H	α-helix	trans	-64	-34.1	177.2	-169.8	178.8	-118.6	-165.3	-1.8	113.5	I320 R326 E327 T328	I320-R324 VanDerWaalsContact O-CB 3.27Å; I320-R324 WeakPolarHBondContact O-CB 3.18Å; I320-R324 PolarHBondContact O-N 3.43Å; R324-R326 PolarHBondContact O-N 2.83Å; R324-E327 PolarHBondContact O-N 3.32Å; R324-E327 VanDerWaalsContact O-N 3.11Å; R324-T328 PolarHBondContact O-OG1 2.9Å
325	R	45.7	Very low	49.1	Very low	213 Å²	213	127.8 Å²	127.8	80%	0.804	67%	0.672	S	S	*	*	H	α-helix	trans	-65.8	-21.9	176.6	-179	172.4	-80.8	-103	1.5	112.9	L321 T323 E327	L321-R325 WeakPolarHBondContact O-CB 3.26Å; L321-R325 PolarHBondContact O-N 2.88Å; T323-R325 VanDerWaalsContact C-N 3.35Å; T323-R325 PolarHBondContact O-N 3.11Å; R325-E327 VanDerWaalsContact C-N 3.27Å
326	R	50.9	Low	48.2	Very low	232 Å²	232	131 Å²	131	88%	0.875	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-12.6	175.1	-132.8	-179.1	-159	-134.2	3.6	113.2	T323 R324	T323-R326 WeakPolarHBondContact O-CB 3.41Å; T323-R326 PolarHBondContact O-N 3.12Å; T323-R326 VanDerWaalsContact O-N 3.15Å; R324-R326 PolarHBondContact O-N 2.83Å
327	E	47.7	Very low	46.8	Very low	160 Å²	160	129 Å²	129	75%	0.748	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-5.2	-176.5	-63.7	178.2	162.3	0	0	113.5	R324 R325	R324-E327 PolarHBondContact O-N 3.32Å; R324-E327 VanDerWaalsContact O-N 3.11Å; R325-E327 VanDerWaalsContact C-N 3.27Å
328	T	45.6	Very low	45.7	Very low	123 Å²	123	128.9 Å²	128.9	76%	0.755	69%	0.694	S	S	*	*	S	Bend	trans	-116.1	30.3	-172.9	-39.9	0	0	0	0	114.1	R324	R324-T328 PolarHBondContact O-OG1 2.9Å
329	G	38.8	Very low	44.5	Very low	67 Å²	67	131.9 Å²	131.9	69%	0.691	71%	0.713	S	S	*	*	S	Bend	trans	-135.9	91.8	168.5	0	0	0	0	0	110.9
330	G	36	Very low	42.8	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	73%	0.725	S	S	*	*			trans	-66.4	167.7	166.9	0	0	0	0	0	111.3
331	D	36.9	Very low	41.4	Very low	165 Å²	165	135 Å²	135	88%	0.882	74%	0.737	S	S	*	*			cis	-152.3	136	8.4	-94.3	-40.5	0	0	0	106.6
332	E	28.6	Very low	39.8	Very low	184 Å²	184	137.4 Å²	137.4	86%	0.86	75%	0.745	S	S	*	*			trans	-177.4	136.2	146.7	-108.6	-67.4	102.6	0	0	110
333	P	44	Very low	38.9	Very low	91 Å²	91	141.5 Å²	141.5	59%	0.591	76%	0.763	S	S	*	*			trans	-99	152.2	-164.6	36.2	-29.7	0	0	0	115
334	L	32.3	Very low	37.3	Very low	164 Å²	164	141.4 Å²	141.4	86%	0.859	77%	0.771	S	S	*	*			trans	132.3	155.9	146.1	-71.7	156.8	0	0	0	114.2
335	P	38.3	Very low	36.5	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	77%	0.774	S	S	*	*			cis	-118	165.1	-44.8	33.9	-18.5	0	0	0	111.9	S337	P335-S337 PolarHBondContact O-N 2.88Å
336	V	40.3	Very low	36	Very low	131 Å²	131	134.2 Å²	134.2	79%	0.794	77%	0.774	S	S	*	*			trans	-44.5	125.8	-177.3	-179.3	0	0	0	0	114.1
337	S	30	Very low	35.3	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	77%	0.77	S	S	*	*			trans	-128.2	107.7	151.1	-159.5	0	0	0	0	109.2	P335 L339	P335-S337 PolarHBondContact O-N 2.88Å; S337-L339 PolarHBondContact O-N 3.49Å; S337-L339 VanDerWaalsContact O-N 3.12Å
338	T	33.1	Very low	34.9	Very low	119 Å²	119	128.7 Å²	128.7	73%	0.73	77%	0.774	S	S	*	*			trans	-61.3	102.4	-180	-44.6	0	0	0	0	110.2
339	L	32.3	Very low	34.8	Very low	168 Å²	168	126.8 Å²	126.8	88%	0.88	77%	0.771	S	S	*	*			trans	-98	93.9	165.9	-98.4	147	0	0	0	108.5	S337	S337-L339 PolarHBondContact O-N 3.49Å; S337-L339 VanDerWaalsContact O-N 3.12Å
340	Q	28.9	Very low	35.5	Very low	142 Å²	142	134 Å²	134	66%	0.664	78%	0.777	S	S	*	*			trans	-77.3	145.3	157.9	-107.5	-173.2	1.9	0	0	109.6	H342	Q340-H342 PolarHBondContact O-N 3.46Å; Q340-H342 VanDerWaalsContact O-N 3.11Å
341	P	38.8	Very low	37	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	78%	0.777	S	S	*	*			trans	-80.7	94.8	-172	31.8	-31.1	0	0	0	110.2	L343	P341-L343 PolarHBondContact O-N 3.35Å
342	H	27.1	Very low	38.9	Very low	162 Å²	162	133.6 Å²	133.6	75%	0.75	75%	0.752	S	S	*	*			trans	-81.7	107.3	166.2	-68.2	-59.3	0	0	0	109.4	Q340 A344	Q340-H342 PolarHBondContact O-N 3.46Å; Q340-H342 VanDerWaalsContact O-N 3.11Å; H342-A344 PolarHBondContact O-N 2.86Å
343	L	36.5	Very low	41.6	Very low	175 Å²	175	125.2 Å²	125.2	92%	0.916	71%	0.714	S	S	*	*			trans	-19.3	90.2	157.5	-70.3	133.8	0	0	0	113.2	P341	P341-L343 PolarHBondContact O-N 3.35Å
344	A	24.7	Very low	43.7	Very low	86 Å²	86	121.6 Å²	121.6	71%	0.711	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-89	132	157	0	0	0	0	0	107.2	H342	H342-A344 PolarHBondContact O-N 2.86Å
345	P	29.8	Very low	46.4	Very low	111 Å²	111	115.3 Å²	115.3	72%	0.721	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-55.7	150.1	168.6	25.5	-31	0	0	0	108.7	A347	P345-A347 PolarHBondContact O-N 3.41Å
346	P	34.8	Very low	48.7	Very low	124 Å²	124	112.4 Å²	112.4	81%	0.805	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-56.4	118.7	-174.2	23.1	-30.6	0	0	0	108.5	E348	P346-E348 PolarHBondContact O-N 3.21Å
347	A	36.9	Very low	51.1	Low	95 Å²	95	109.9 Å²	109.9	79%	0.785	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-46.1	117.8	170.6	0	0	0	0	0	107.2	P345 A349	P345-A347 PolarHBondContact O-N 3.41Å; A347-A349 PolarHBondContact O-N 2.91Å
348	E	38.9	Very low	54.1	Low	181 Å²	181	104.7 Å²	104.7	85%	0.846	59%	0.588	S	S	*	*			trans	-41.8	113.2	-175	-65.2	-176.5	154.3	0	0	109	P346 R350	P346-E348 PolarHBondContact O-N 3.21Å; E348-R350 PolarHBondContact O-N 3.43Å
349	A	43.5	Very low	56.8	Low	82 Å²	82	103.8 Å²	103.8	68%	0.678	58%	0.575	S	S	*	*			trans	-50	114.2	-174.9	0	0	0	0	0	108	A347 K351	A347-A349 PolarHBondContact O-N 2.91Å; A349-K351 VanDerWaalsContact C-N 3.31Å; A349-K351 PolarHBondContact O-N 3.27Å
350	R	53.9	Low	59.7	Low	220 Å²	220	96.7 Å²	96.7	83%	0.83	54%	0.541	S	S	*	.			trans	-51.5	98.4	175.2	-167	175.1	-173.6	169	1.7	106.8	E348 V352	E348-R350 PolarHBondContact O-N 3.43Å; R350-V352 VanDerWaalsContact C-N 3.26Å; R350-V352 PolarHBondContact O-N 2.86Å
351	K	67.8	Low	62.9	Low	168 Å²	168	90 Å²	90	73%	0.73	51%	0.509	S	S	*	.			trans	-77	83.4	-172.3	-91.7	178.4	-179.6	172.9	0	108.1	A349	A349-K351 VanDerWaalsContact C-N 3.31Å; A349-K351 PolarHBondContact O-N 3.27Å
352	V	76.5	Confident	65.5	Low	60 Å²	60	86.8 Å²	86.8	36%	0.364	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-63.4	129.6	172.2	-176.1	0	0	0	0	108.2	P245 V246 R350 S354	P245-V352 HydrophobicContact CB-CB 3.72Å; P245-V352 HydrophobicContact CB-CG1 3.61Å; V246-V352 VanDerWaalsContact O-CG1 3.28Å; V246-V352 WeakPolarHBondContact O-CG1 3.4Å; R350-V352 VanDerWaalsContact C-N 3.26Å; R350-V352 PolarHBondContact O-N 2.86Å; V352-S354 PolarHBondContact O-N 3.41Å
353	P	85.9	Confident	68.7	Low	8 Å²	8	81 Å²	81	5%	0.052	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-52.5	137.6	176.9	-29.8	37.1	0	0	0	112.5	V246 V358 V443 E446 L447	V246-P353 PolarHBondContact N-O 2.92Å; P353-V358 HydrophobicContact CB-CG2 3.82Å; P353-V443 HydrophobicContact CB-CG1 4.13Å; P353-E446 HydrophobicContact CG-CB 4Å; P353-L447 HydrophobicContact CG-CB 3.99Å; P353-L447 HydrophobicContact CG-CD1 4.24Å
354	S	87.9	Confident	71.6	Confident	15 Å²	15	72.9 Å²	72.9	11%	0.105	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-77	154.9	175.4	76.9	0	0	0	0	111.6	R244 V352 S356 Q357 V358	R244-S354 CarbonylContact O-C 3.57Å; R244-S354 WeakPolarHBondContact O-CA 3.45Å; V352-S354 PolarHBondContact O-N 3.41Å; S354-S356 VanDerWaalsContact C-N 3.25Å; S354-S356 PolarHBondContact O-N 2.93Å; S354-S356 PolarHBondContact OG-OG 2.91Å; S354-Q357 PolarHBondContact O-N 2.86Å; S354-Q357 VanDerWaalsContact O-N 3.12Å; S354-Q357 VanDerWaalsContact OG-CG 3.26Å; S354-Q357 WeakPolarHBondContact OG-CG 3.17Å; S354-Q357 PolarHBondContact OG-N 3.47Å; S354-Q357 PolarHBondContact OG-OE1 2.79Å; S354-V358 WeakPolarHBondContact O-CG2 3.39Å; S354-V358 PolarHBondContact O-N 2.63Å
355	A	88.1	Confident	75	Confident	31 Å²	31	68.9 Å²	68.9	26%	0.256	39%	0.385	S	S	.	.	H	α-helix	trans	-53.5	-40.6	176.3	0	0	0	0	0	113.2	R244 V246 V358 Q359	R244-A355 PolarHBondContact O-N 2.98Å; V246-A355 HydrophobicContact CG2-CB 3.61Å; A355-V358 PolarHBondContact O-N 2.75Å; A355-Q359 VanDerWaalsContact O-CB 3.29Å; A355-Q359 WeakPolarHBondContact O-CB 3.37Å; A355-Q359 PolarHBondContact O-N 3.02Å
356	S	87.8	Confident	78.1	Confident	55 Å²	55	66.7 Å²	66.7	39%	0.385	37%	0.372	S	S	.	.	H	α-helix	trans	-66.7	-38.7	179	54.5	0	0	0	0	112.7	S354 Q359 A360	S354-S356 VanDerWaalsContact C-N 3.25Å; S354-S356 PolarHBondContact O-N 2.93Å; S354-S356 PolarHBondContact OG-OG 2.91Å; S356-Q359 PolarHBondContact O-N 3.45Å; S356-A360 PolarHBondContact O-N 3.25Å
357	Q	90.5	Very high	81	Confident	78 Å²	78	64.5 Å²	64.5	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-66.9	-43.4	176.6	-70.3	172	-30.4	0	0	111.5	S354 Q359 A360 I361 V443	S354-Q357 PolarHBondContact O-N 2.86Å; S354-Q357 VanDerWaalsContact O-N 3.12Å; S354-Q357 VanDerWaalsContact OG-CG 3.26Å; S354-Q357 WeakPolarHBondContact OG-CG 3.17Å; S354-Q357 PolarHBondContact OG-N 3.47Å; S354-Q357 PolarHBondContact OG-OE1 2.79Å; Q357-Q359 VanDerWaalsContact C-N 3.3Å; Q357-Q359 PolarHBondContact O-N 2.9Å; Q357-A360 PolarHBondContact O-N 2.97Å; Q357-I361 PolarHBondContact O-N 2.95Å; Q357-V443 HydrophobicContact CB-CG1 3.81Å; Q357-V443 HydrophobicContact CB-CG2 4.05Å; Q357-V443 VanDerWaalsContact CD-CG2 3.43Å; Q357-V443 HydrophobicContact CG-CG2 4.02Å
358	V	91.9	Very high	83.8	Confident	2 Å²	2	60 Å²	60	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-37.4	174.8	177.3	0	0	0	0	110.9	V246 F306 T308 P353 S354 A355 A360 I361 K362 L447	V246-V358 HydrophobicContact CB-CG2 4.43Å; V246-V358 HydrophobicContact CG1-CG2 4.4Å; F306-V358 HydrophobicContact CE2-CG1 3.97Å; T308-V358 HydrophobicContact CG2-CG1 3.79Å; P353-V358 HydrophobicContact CB-CG2 3.82Å; S354-V358 WeakPolarHBondContact O-CG2 3.39Å; S354-V358 PolarHBondContact O-N 2.63Å; A355-V358 PolarHBondContact O-N 2.75Å; V358-A360 VanDerWaalsContact C-N 3.34Å; V358-A360 PolarHBondContact O-N 3.41Å; V358-I361 WeakPolarHBondContact O-CB 3.43Å; V358-I361 PolarHBondContact O-N 3.03Å; V358-K362 PolarHBondContact O-N 3.01Å; V358-L447 HydrophobicContact CG2-CD1 4.39Å; V358-L447 HydrophobicContact CG2-CD2 4.28Å
359	Q	91	Very high	86.5	Confident	99 Å²	99	53.7 Å²	53.7	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-39	176.6	-172.2	60	24.4	0	0	111.7	A355 S356 Q357 I361 K362 C363	A355-Q359 VanDerWaalsContact O-CB 3.29Å; A355-Q359 WeakPolarHBondContact O-CB 3.37Å; A355-Q359 PolarHBondContact O-N 3.02Å; S356-Q359 PolarHBondContact O-N 3.45Å; Q357-Q359 VanDerWaalsContact C-N 3.3Å; Q357-Q359 PolarHBondContact O-N 2.9Å; Q359-I361 VanDerWaalsContact C-N 3.3Å; Q359-I361 PolarHBondContact O-N 3.24Å; Q359-K362 PolarHBondContact O-N 3.39Å; Q359-C363 PolarHBondContact NE2-SG 3.3Å; Q359-C363 VanDerWaalsContact NE2-SG 3.42Å; Q359-C363 WeakPolarHBondContact O-CB 3.46Å; Q359-C363 PolarHBondContact O-N 2.88Å; Q359-C363 PolarHBondContact O-SG 3.24Å
360	A	92.3	Very high	88.9	Confident	19 Å²	19	53.3 Å²	53.3	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-41.5	174.5	0	0	0	0	0	112.2	S356 Q357 V358 C363 F364	S356-A360 PolarHBondContact O-N 3.25Å; Q357-A360 PolarHBondContact O-N 2.97Å; V358-A360 VanDerWaalsContact C-N 3.34Å; V358-A360 PolarHBondContact O-N 3.41Å; A360-C363 PolarHBondContact O-N 3.13Å; A360-F364 PolarHBondContact O-N 3.47Å
361	I	95.5	Very high	90.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-50.8	173.4	-65.6	173.4	0	0	0	110.1	M296 F306 Q357 V358 Q359 C363 F364 L365 I439 V443 I444 L447 F448	M296-I361 HydrophobicContact CE-CG2 3.62Å; M296-I361 HydrophobicContact SD-CG2 4.05Å; F306-I361 HydrophobicContact CE1-CG2 4.15Å; F306-I361 HydrophobicContact CZ-CG2 3.84Å; Q357-I361 PolarHBondContact O-N 2.95Å; V358-I361 WeakPolarHBondContact O-CB 3.43Å; V358-I361 PolarHBondContact O-N 3.03Å; Q359-I361 VanDerWaalsContact C-N 3.3Å; Q359-I361 PolarHBondContact O-N 3.24Å; I361-C363 PolarHBondContact O-N 3.27Å; I361-F364 PolarHBondContact O-N 3.34Å; I361-L365 HydrophobicContact CG2-CD1 4.33Å; I361-L365 WeakPolarHBondContact O-CG 3.33Å; I361-L365 PolarHBondContact O-N 3.15Å; I361-L365 VanDerWaalsContact O-N 3.08Å; I361-I439 HydrophobicContact CD1-CG2 4.38Å; I361-I439 HydrophobicContact CG1-CG2 3.74Å; I361-V443 HydrophobicContact CD1-CG1 3.91Å; I361-I444 HydrophobicContact CD1-CG1 4.21Å; I361-L447 HydrophobicContact CD1-CD2 3.99Å; I361-F448 HydrophobicContact CD1-CE2 4.44Å; I361-F448 HydrophobicContact CG2-CZ 4.42Å
362	K	94.6	Very high	91.8	Very high	50 Å²	50	40.8 Å²	40.8	22%	0.217	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-45.3	179.4	-70.2	-178.6	-179.1	176.3	0	112.2	F306 T308 V358 Q359 F364 L365 S366	F306-K362 HydrophobicContact CE2-CG 4.21Å; F306-K362 HydrophobicContact CZ-CG 3.88Å; T308-K362 PolarHBondContact OG1-NZ 3.37Å; V358-K362 PolarHBondContact O-N 3.01Å; Q359-K362 PolarHBondContact O-N 3.39Å; K362-F364 VanDerWaalsContact C-N 3.32Å; K362-F364 PolarHBondContact O-N 3.2Å; K362-L365 PolarHBondContact O-N 3.33Å; K362-S366 PolarHBondContact O-N 3.47Å; K362-S366 PolarHBondContact O-OG 3.4Å; K362-S366 VanDerWaalsContact O-OG 3.12Å
363	C	94.3	Very high	92.6	Very high	42 Å²	42	38.6 Å²	38.6	28%	0.284	22%	0.217	S	C	.	.	H	α-helix	trans	-58.9	-42.7	177.5	-74.4	0	0	0	0	112	W235 Q359 A360 I361 S366 K367	W235-C363 HydrophobicContact CZ3-CB 3.88Å; Q359-C363 PolarHBondContact NE2-SG 3.3Å; Q359-C363 VanDerWaalsContact NE2-SG 3.42Å; Q359-C363 WeakPolarHBondContact O-CB 3.46Å; Q359-C363 PolarHBondContact O-N 2.88Å; Q359-C363 PolarHBondContact O-SG 3.24Å; A360-C363 PolarHBondContact O-N 3.13Å; I361-C363 PolarHBondContact O-N 3.27Å; C363-S366 PolarHBondContact O-N 3.11Å; C363-K367 WeakPolarHBondContact O-CB 3.5Å; C363-K367 PolarHBondContact O-N 2.81Å
364	F	96.3	Very high	92.9	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-48.7	175.4	170.8	-95.8	0	0	0	112	M296 L297 A300 A360 I361 K362 S366 K367 C368 T432 L435 L436 I439	M296-F364 HydrophobicContact CB-CD1 4.22Å; M296-F364 HydrophobicContact CB-CE1 3.78Å; M296-F364 HydrophobicContact CE-CD1 3.59Å; M296-F364 HydrophobicContact CE-CE1 4.12Å; L297-F364 HydrophobicContact CD2-CZ 4.01Å; A300-F364 HydrophobicContact CB-CE1 4.42Å; A360-F364 PolarHBondContact O-N 3.47Å; I361-F364 PolarHBondContact O-N 3.34Å; K362-F364 VanDerWaalsContact C-N 3.32Å; K362-F364 PolarHBondContact O-N 3.2Å; F364-S366 PolarHBondContact O-N 3.06Å; F364-K367 PolarHBondContact O-N 2.83Å; F364-C368 WeakPolarHBondContact CZ-SG 3.27Å; F364-C368 PolarHBondContact O-N 3.38Å; F364-T432 HydrophobicContact CE2-CG2 3.96Å; F364-L435 HydrophobicContact CD2-CB 4.09Å; F364-L436 HydrophobicContact CD1-CD2 4.07Å; F364-L436 HydrophobicContact CD2-CD2 3.89Å; F364-L436 HydrophobicContact CD2-CG 4.07Å; F364-L436 HydrophobicContact CE1-CD2 3.62Å; F364-L436 HydrophobicContact CE1-CG 4.46Å; F364-L436 HydrophobicContact CE2-CD1 4.15Å; F364-L436 HydrophobicContact CE2-CD2 3.42Å; F364-L436 VanDerWaalsContact CE2-CD2 3.42Å; F364-L436 HydrophobicContact CE2-CG 3.4Å; F364-L436 VanDerWaalsContact CE2-CG 3.4Å; F364-L436 HydrophobicContact CG-CD2 4.2Å; F364-L436 HydrophobicContact CZ-CD1 4.06Å; F364-L436 HydrophobicContact CZ-CD2 3.25Å; F364-L436 HydrophobicContact CZ-CG 3.63Å; F364-I439 HydrophobicContact CB-CD1 3.64Å; F364-I439 HydrophobicContact CD1-CD1 4.12Å; F364-I439 HydrophobicContact CD2-CD1 4.48Å; F364-I439 HydrophobicContact CG-CD1 3.8Å
365	L	96.6	Very high	93.1	Very high	3 Å²	3	43 Å²	43	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-47.6	178	-65.6	176.5	0	0	0	111.2	M296 L299 A300 F306 I361 K362 K367 C368 W369	M296-L365 HydrophobicContact CE-CD1 4.41Å; M296-L365 HydrophobicContact CE-CD2 3.61Å; M296-L365 HydrophobicContact CE-CG 3.85Å; L299-L365 HydrophobicContact CB-CD2 4.28Å; A300-L365 HydrophobicContact CB-CD2 3.77Å; F306-L365 HydrophobicContact CD1-CD1 4.46Å; F306-L365 HydrophobicContact CE1-CD1 3.74Å; I361-L365 HydrophobicContact CG2-CD1 4.33Å; I361-L365 WeakPolarHBondContact O-CG 3.33Å; I361-L365 PolarHBondContact O-N 3.15Å; I361-L365 VanDerWaalsContact O-N 3.08Å; K362-L365 PolarHBondContact O-N 3.33Å; L365-K367 VanDerWaalsContact C-N 3.33Å; L365-K367 PolarHBondContact O-N 3.03Å; L365-C368 WeakPolarHBondContact O-CB 3.41Å; L365-C368 PolarHBondContact O-N 2.9Å; L365-W369 HydrophobicContact CB-CH2 3.9Å; L365-W369 HydrophobicContact CB-CZ2 3.79Å; L365-W369 HydrophobicContact CB-CZ3 4.37Å; L365-W369 HydrophobicContact CD1-CH2 4.49Å; L365-W369 HydrophobicContact CD1-CZ2 4.47Å; L365-W369 PolarHBondContact O-N 3.11Å
366	S	95.4	Very high	93.1	Very high	64 Å²	64	46.3 Å²	46.3	45%	0.448	25%	0.254	S	S	.	.	H	α-helix	trans	-60.8	-39.2	176.9	-60.8	0	0	0	0	112.7	K362 C363 F364 W369 S370	K362-S366 PolarHBondContact O-N 3.47Å; K362-S366 PolarHBondContact O-OG 3.4Å; K362-S366 VanDerWaalsContact O-OG 3.12Å; C363-S366 PolarHBondContact O-N 3.11Å; F364-S366 PolarHBondContact O-N 3.06Å; S366-W369 WeakPolarHBondContact O-CB 3.32Å; S366-W369 PolarHBondContact O-N 2.95Å; S366-S370 PolarHBondContact O-N 2.81Å
367	K	94.6	Very high	93.4	Very high	78 Å²	78	43.8 Å²	43.8	34%	0.339	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-47.1	175.2	-178.2	58.6	173.9	174.4	0	111.1	C363 F364 L365 W369 S370 L371 T432 L435	C363-K367 WeakPolarHBondContact O-CB 3.5Å; C363-K367 PolarHBondContact O-N 2.81Å; F364-K367 PolarHBondContact O-N 2.83Å; L365-K367 VanDerWaalsContact C-N 3.33Å; L365-K367 PolarHBondContact O-N 3.03Å; K367-W369 PolarHBondContact O-N 3.13Å; K367-S370 PolarHBondContact O-N 3.29Å; K367-S370 PolarHBondContact O-OG 3Å; K367-L371 HydrophobicContact CD-CG 4.38Å; K367-L371 VanDerWaalsContact O-CG 3.3Å; K367-L371 WeakPolarHBondContact O-CG 3.41Å; K367-L371 PolarHBondContact O-N 2.77Å; K367-T432 HydrophobicContact CG-CG2 4.38Å; K367-L435 HydrophobicContact CB-CD1 4.21Å; K367-L435 HydrophobicContact CG-CD1 3.83Å
368	C	95.9	Very high	93.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.9	-38.1	174.6	-73.8	0	0	0	0	112.2	A300 F364 L365 L371 I373 T432	A300-C368 HydrophobicContact CB-CB 3.7Å; F364-C368 WeakPolarHBondContact CZ-SG 3.27Å; F364-C368 PolarHBondContact O-N 3.38Å; L365-C368 WeakPolarHBondContact O-CB 3.41Å; L365-C368 PolarHBondContact O-N 2.9Å; C368-L371 PolarHBondContact O-N 3.27Å; C368-I373 HydrophobicContact CB-CD1 4.09Å; C368-T432 VanDerWaalsContact SG-CG2 3.56Å
369	W	96.1	Very high	93.8	Very high	49 Å²	49	41.1 Å²	41.1	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	-70.8	-37.4	179.7	-64.2	-17	0	0	0	114.2	A300 R303 L304 Q305 L365 S366 K367 L371 N372	A300-W369 PolarHBondContact O-NE1 3.42Å; R303-W369 VanDerWaalsContact CD-CD1 3.47Å; R303-W369 VanDerWaalsContact NH1-CD1 3.27Å; R303-W369 PolarHBondContact NH1-O 3.21Å; L304-W369 VanDerWaalsContact O-CH2 3.29Å; L304-W369 WeakPolarHBondContact O-CH2 3.46Å; L304-W369 VanDerWaalsContact O-CZ2 3.28Å; L304-W369 WeakPolarHBondContact O-CZ2 3.36Å; Q305-W369 HydrophobicContact CG-CH2 3.88Å; Q305-W369 HydrophobicContact CG-CZ3 4.31Å; L365-W369 HydrophobicContact CB-CH2 3.9Å; L365-W369 HydrophobicContact CB-CZ2 3.79Å; L365-W369 HydrophobicContact CB-CZ3 4.37Å; L365-W369 HydrophobicContact CD1-CH2 4.49Å; L365-W369 HydrophobicContact CD1-CZ2 4.47Å; L365-W369 PolarHBondContact O-N 3.11Å; S366-W369 WeakPolarHBondContact O-CB 3.32Å; S366-W369 PolarHBondContact O-N 2.95Å; K367-W369 PolarHBondContact O-N 3.13Å; W369-L371 PolarHBondContact O-N 3.44Å; W369-N372 PolarHBondContact O-N 2.84Å
370	S	94.8	Very high	93.9	Very high	74 Å²	74	37 Å²	37	52%	0.517	21%	0.206	S	C	.	.	H	α-helix	trans	-67.7	-25	177.5	75.9	0	0	0	0	112.3	S366 K367 N372	S366-S370 PolarHBondContact O-N 2.81Å; K367-S370 PolarHBondContact O-N 3.29Å; K367-S370 PolarHBondContact O-OG 3Å; S370-N372 VanDerWaalsContact C-N 3.34Å
371	L	91.8	Very high	94.1	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.047	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.6	-177.3	-67.7	-168	0	0	0	114.5	K367 C368 W369 I373 R425 E428 T432	K367-L371 HydrophobicContact CD-CG 4.38Å; K367-L371 VanDerWaalsContact O-CG 3.3Å; K367-L371 WeakPolarHBondContact O-CG 3.41Å; K367-L371 PolarHBondContact O-N 2.77Å; C368-L371 PolarHBondContact O-N 3.27Å; W369-L371 PolarHBondContact O-N 3.44Å; L371-I373 HydrophobicContact CB-CD1 4.28Å; L371-I373 HydrophobicContact CB-CG1 3.71Å; L371-I373 HydrophobicContact CD1-CD1 4.47Å; L371-I373 PolarHBondContact O-N 3.05Å; L371-R425 VanDerWaalsContact O-CZ 3.24Å; L371-R425 PolarHBondContact O-NH1 3.01Å; L371-R425 PolarHBondContact O-NH2 2.96Å; L371-E428 HydrophobicContact CD1-CG 3.8Å; L371-E428 HydrophobicContact CD2-CG 3.65Å; L371-E428 WeakPolarHBondContact CD2-OE1 3.33Å; L371-E428 HydrophobicContact CG-CG 4.36Å; L371-T432 HydrophobicContact CD1-CG2 4.41Å; L371-T432 WeakPolarHBondContact CD1-OG1 3.31Å
372	N	90.4	Very high	94.2	Very high	117 Å²	117	36.5 Å²	36.5	63%	0.626	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	46.1	-177.3	-62.9	-50	0	0	0	112.6	W369 S370 S374	W369-N372 PolarHBondContact O-N 2.84Å; S370-N372 VanDerWaalsContact C-N 3.34Å; N372-S374 PolarHBondContact O-N 3.08Å
373	I	93.8	Very high	94.2	Very high	14 Å²	14	34.3 Å²	34.3	7%	0.072	19%	0.192	C	C	.	.			trans	-61.5	125.4	-177.1	-54.9	176.8	0	0	0	109.4	C368 L371 E377 Y378 L381 L429	C368-I373 HydrophobicContact CB-CD1 4.09Å; L371-I373 HydrophobicContact CB-CD1 4.28Å; L371-I373 HydrophobicContact CB-CG1 3.71Å; L371-I373 HydrophobicContact CD1-CD1 4.47Å; L371-I373 PolarHBondContact O-N 3.05Å; I373-E377 WeakPolarHBondContact CA-OE2 3.29Å; I373-E377 HydrophobicContact CG2-CB 3.55Å; I373-Y378 HydrophobicContact CB-CD2 3.97Å; I373-Y378 HydrophobicContact CB-CE1 4.37Å; I373-Y378 HydrophobicContact CB-CE2 3.52Å; I373-Y378 HydrophobicContact CD1-CE1 4.23Å; I373-Y378 HydrophobicContact CG2-CD1 4.12Å; I373-Y378 HydrophobicContact CG2-CD2 3.58Å; I373-Y378 HydrophobicContact CG2-CE1 4.18Å; I373-Y378 HydrophobicContact CG2-CE2 3.66Å; I373-Y378 HydrophobicContact CG2-CG 3.82Å; I373-Y378 WeakPolarHBondContact O-CE2 3.37Å; I373-L381 HydrophobicContact CD1-CD1 4.21Å; I373-L381 HydrophobicContact CG2-CD1 4.17Å; I373-L429 HydrophobicContact CD1-CD2 4.16Å; I373-L429 HydrophobicContact CG1-CD2 3.91Å; I373-L429 HydrophobicContact CG2-CD2 4.22Å
374	S	91.7	Very high	94.3	Very high	40 Å²	40	33.1 Å²	33.1	28%	0.28	18%	0.183	S	C	.	.			trans	-73.3	158.9	-179.5	89.5	0	0	0	0	111.4	N372 K376 E377 Y378	N372-S374 PolarHBondContact O-N 3.08Å; S374-K376 PolarHBondContact O-N 3.48Å; S374-K376 PolarHBondContact OG-N 2.85Å; S374-E377 PolarHBondContact N-OE2 2.95Å; S374-E377 PolarHBondContact O-N 3.08Å; S374-E377 VanDerWaalsContact O-N 3.11Å; S374-E377 WeakPolarHBondContact OG-CG 3.37Å; S374-E377 PolarHBondContact OG-N 3.1Å; S374-E377 VanDerWaalsContact OG-N 3.11Å; S374-Y378 WeakPolarHBondContact O-CD2 3.42Å; S374-Y378 PolarHBondContact O-N 2.99Å
375	T	90.9	Very high	94.3	Very high	75 Å²	75	34.1 Å²	34.1	46%	0.46	19%	0.189	S	C	.	.	H	α-helix	trans	-55	-35.2	174.5	-59.4	0	0	0	0	113	W105 A379	W105-T375 HydrophobicContact CH2-CG2 3.2Å; W105-T375 HydrophobicContact CZ2-CG2 3.07Å; W105-T375 HydrophobicContact CZ3-CG2 4.39Å; T375-A379 PolarHBondContact O-N 2.89Å
376	K	88.8	Confident	94.3	Very high	101 Å²	101	34 Å²	34	44%	0.439	19%	0.189	S	C	.	.	H	α-helix	trans	-72.6	-44.5	176.4	-59.3	-165	176.5	174.8	0	111.2	I145 S374 Y378 A379 Y380	I145-K376 HydrophobicContact CD1-CB 4.06Å; I145-K376 HydrophobicContact CD1-CD 3.79Å; I145-K376 HydrophobicContact CD1-CG 3.61Å; I145-K376 HydrophobicContact CG1-CD 4.48Å; S374-K376 PolarHBondContact O-N 3.48Å; S374-K376 PolarHBondContact OG-N 2.85Å; K376-Y378 PolarHBondContact O-N 3.3Å; K376-A379 WeakPolarHBondContact O-CB 3.39Å; K376-A379 PolarHBondContact O-N 3.47Å; K376-A379 VanDerWaalsContact O-N 3.13Å; K376-Y380 HydrophobicContact CB-CE2 4.02Å; K376-Y380 WeakPolarHBondContact O-CD2 3.47Å; K376-Y380 WeakPolarHBondContact O-CE2 3.1Å; K376-Y380 PolarHBondContact O-N 3.38Å; K376-Y380 VanDerWaalsContact O-N 3.08Å
377	E	94	Very high	94.4	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-47.1	176.2	-69.2	170.9	154.3	0	0	110.5	I373 S374 A379 Y380 L381 H419 R425 L429	I373-E377 WeakPolarHBondContact CA-OE2 3.29Å; I373-E377 HydrophobicContact CG2-CB 3.55Å; S374-E377 PolarHBondContact N-OE2 2.95Å; S374-E377 PolarHBondContact O-N 3.08Å; S374-E377 VanDerWaalsContact O-N 3.11Å; S374-E377 WeakPolarHBondContact OG-CG 3.37Å; S374-E377 PolarHBondContact OG-N 3.1Å; S374-E377 VanDerWaalsContact OG-N 3.11Å; E377-A379 VanDerWaalsContact C-N 3.3Å; E377-A379 PolarHBondContact O-N 2.73Å; E377-Y380 PolarHBondContact O-N 2.9Å; E377-Y380 VanDerWaalsContact O-N 3.1Å; E377-L381 VanDerWaalsContact O-CG 3.29Å; E377-L381 WeakPolarHBondContact O-CG 2.97Å; E377-L381 PolarHBondContact O-N 3.43Å; E377-H419 IonicContact OE1-CD2 3.72Å; E377-H419 IonicContact OE1-NE2 3.7Å; E377-H419 PolarHBondContact OE1-NE2 2.91Å; E377-H419 VanDerWaalsContact OE1-NE2 3.13Å; E377-R425 IonicContact OE1-CZ 3.76Å; E377-R425 IonicContact OE1-NE 2.63Å; E377-R425 PolarHBondContact OE1-NE 3.48Å; E377-R425 IonicContact OE1-NH2 3.4Å; E377-R425 IonicContact OE2-CZ 2.67Å; E377-R425 IonicContact OE2-NE 3.9Å; E377-R425 IonicContact OE2-NH2 2.81Å; E377-R425 PolarHBondContact OE2-NH2 3.46Å; E377-L429 HydrophobicContact CB-CD1 4.26Å; E377-L429 HydrophobicContact CG-CD1 3.95Å
378	Y	95.9	Very high	94.5	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-56.7	-40.3	174.3	-85	-66.4	0	0	0	113.3	L297 A300 Q301 I373 S374 K376 Y380 L381 K382	L297-Y378 HydrophobicContact CD2-CD1 4.29Å; L297-Y378 HydrophobicContact CD2-CE1 4.32Å; A300-Y378 HydrophobicContact CB-CE1 4.2Å; Q301-Y378 HydrophobicContact CB-CD1 4.13Å; Q301-Y378 HydrophobicContact CB-CD2 3.97Å; Q301-Y378 HydrophobicContact CB-CE1 4.12Å; Q301-Y378 HydrophobicContact CB-CE2 3.93Å; Q301-Y378 HydrophobicContact CB-CG 4.07Å; Q301-Y378 HydrophobicContact CG-CD2 3.76Å; Q301-Y378 HydrophobicContact CG-CE2 4.03Å; Q301-Y378 HydrophobicContact CG-CG 4.1Å; I373-Y378 HydrophobicContact CB-CD2 3.97Å; I373-Y378 HydrophobicContact CB-CE1 4.37Å; I373-Y378 HydrophobicContact CB-CE2 3.52Å; I373-Y378 HydrophobicContact CD1-CE1 4.23Å; I373-Y378 HydrophobicContact CG2-CD1 4.12Å; I373-Y378 HydrophobicContact CG2-CD2 3.58Å; I373-Y378 HydrophobicContact CG2-CE1 4.18Å; I373-Y378 HydrophobicContact CG2-CE2 3.66Å; I373-Y378 HydrophobicContact CG2-CG 3.82Å; I373-Y378 WeakPolarHBondContact O-CE2 3.37Å; S374-Y378 WeakPolarHBondContact O-CD2 3.42Å; S374-Y378 PolarHBondContact O-N 2.99Å; K376-Y378 PolarHBondContact O-N 3.3Å; Y378-Y380 VanDerWaalsContact C-N 3.35Å; Y378-Y380 PolarHBondContact O-N 2.98Å; Y378-L381 PolarHBondContact O-N 3.37Å; Y378-K382 WeakPolarHBondContact O-CB 3.27Å; Y378-K382 VanDerWaalsContact O-CG 3.29Å; Y378-K382 WeakPolarHBondContact O-CG 2.91Å; Y378-K382 PolarHBondContact O-N 3.23Å
379	A	94.6	Very high	94.5	Very high	15 Å²	15	30.4 Å²	30.4	12%	0.124	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-41.6	176.9	0	0	0	0	0	111.7	W105 T375 K376 E377 K382 G383	W105-A379 HydrophobicContact CH2-CB 4.42Å; W105-A379 HydrophobicContact CZ3-CB 4.2Å; T375-A379 PolarHBondContact O-N 2.89Å; K376-A379 WeakPolarHBondContact O-CB 3.39Å; K376-A379 PolarHBondContact O-N 3.47Å; K376-A379 VanDerWaalsContact O-N 3.13Å; E377-A379 VanDerWaalsContact C-N 3.3Å; E377-A379 PolarHBondContact O-N 2.73Å; A379-K382 PolarHBondContact O-N 3.07Å; A379-G383 PolarHBondContact O-N 3.14Å
380	Y	93.8	Very high	94.4	Very high	14 Å²	14	34.4 Å²	34.4	6%	0.055	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-41.2	175.3	-56.5	-45.1	0	0	0	112.5	I145 K376 E377 Y378 K382 G383 T384 T407 I410 L411 H414	I145-Y380 HydrophobicContact CG2-CD1 4.31Å; I145-Y380 HydrophobicContact CG2-CE1 3.27Å; I145-Y380 WeakPolarHBondContact CG2-OH 3.38Å; K376-Y380 HydrophobicContact CB-CE2 4.02Å; K376-Y380 WeakPolarHBondContact O-CD2 3.47Å; K376-Y380 WeakPolarHBondContact O-CE2 3.1Å; K376-Y380 PolarHBondContact O-N 3.38Å; K376-Y380 VanDerWaalsContact O-N 3.08Å; E377-Y380 PolarHBondContact O-N 2.9Å; E377-Y380 VanDerWaalsContact O-N 3.1Å; Y378-Y380 VanDerWaalsContact C-N 3.35Å; Y378-Y380 PolarHBondContact O-N 2.98Å; Y380-K382 VanDerWaalsContact C-N 3.33Å; Y380-K382 PolarHBondContact O-N 2.89Å; Y380-G383 CarbonylContact O-C 3.59Å; Y380-G383 WeakPolarHBondContact O-CA 3.28Å; Y380-G383 PolarHBondContact O-N 2.88Å; Y380-G383 VanDerWaalsContact O-N 3.13Å; Y380-T384 PolarHBondContact O-N 3.3Å; Y380-T384 PolarHBondContact O-OG1 2.94Å; Y380-T407 VanDerWaalsContact O-CG2 3.27Å; Y380-T407 WeakPolarHBondContact O-CG2 3.5Å; Y380-I410 HydrophobicContact CD1-CG2 4.09Å; Y380-I410 HydrophobicContact CE1-CB 4.27Å; Y380-I410 HydrophobicContact CE1-CG2 3.31Å; Y380-I410 HydrophobicContact CE2-CG2 4.21Å; Y380-I410 VanDerWaalsContact CZ-CG2 3.4Å; Y380-I410 WeakPolarHBondContact OH-CG2 3.17Å; Y380-L411 HydrophobicContact CD2-CB 4.37Å; Y380-L411 HydrophobicContact CD2-CD1 3.9Å; Y380-L411 HydrophobicContact CG-CB 4.31Å; Y380-L411 HydrophobicContact CG-CD1 4.34Å; Y380-H414 HydrophobicContact CE2-CB 3.8Å; Y380-H414 AromaticContact CE2-CD2 3.81Å; Y380-H414 AromaticContact CE2-CG 3.84Å
381	L	96.6	Very high	94.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-42.8	175.6	-66.7	-176.7	0	0	0	111.7	L297 I373 E377 Y378 G383 T384 V385 L411 L429 L433	L297-L381 HydrophobicContact CD1-CB 4.1Å; L297-L381 HydrophobicContact CD2-CB 4.32Å; L297-L381 HydrophobicContact CD2-CD1 4.26Å; I373-L381 HydrophobicContact CD1-CD1 4.21Å; I373-L381 HydrophobicContact CG2-CD1 4.17Å; E377-L381 VanDerWaalsContact O-CG 3.29Å; E377-L381 WeakPolarHBondContact O-CG 2.97Å; E377-L381 PolarHBondContact O-N 3.43Å; Y378-L381 PolarHBondContact O-N 3.37Å; L381-G383 VanDerWaalsContact C-N 3.34Å; L381-T384 PolarHBondContact O-N 2.84Å; L381-V385 WeakPolarHBondContact O-CG2 3.26Å; L381-V385 PolarHBondContact O-N 2.76Å; L381-L411 HydrophobicContact CD2-CD2 4.14Å; L381-L429 HydrophobicContact CD1-CD2 4.38Å; L381-L429 HydrophobicContact CD2-CB 4.2Å; L381-L433 HydrophobicContact CB-CD2 4.11Å; L381-L433 HydrophobicContact CD2-CD1 3.58Å; L381-L433 HydrophobicContact CD2-CD2 4.15Å; L381-L433 HydrophobicContact CD2-CG 3.76Å
382	K	96.8	Very high	94.6	Very high	8 Å²	8	36.2 Å²	36.2	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-42.1	172.8	-71.6	173.8	-169.9	172.6	0	111.2	F268 L294 L297 E298 Y378 A379 Y380 V385 L386	F268-K382 HydrophobicContact CD1-CD 4.38Å; F268-K382 HydrophobicContact CE1-CB 3.79Å; F268-K382 HydrophobicContact CE1-CD 4.28Å; F268-K382 HydrophobicContact CZ-CB 4.18Å; L294-K382 HydrophobicContact CD2-CB 3.77Å; L294-K382 HydrophobicContact CD2-CG 4Å; L294-K382 WeakPolarHBondContact CD2-O 3.39Å; L297-K382 HydrophobicContact CB-CG 4.19Å; L297-K382 HydrophobicContact CD1-CG 3.97Å; E298-K382 IonicContact OE1-NZ 3.95Å; E298-K382 PolarHBondContact OE1-NZ 3.07Å; E298-K382 IonicContact OE2-NZ 2.68Å; E298-K382 PolarHBondContact OE2-NZ 2.71Å; Y378-K382 WeakPolarHBondContact O-CB 3.27Å; Y378-K382 VanDerWaalsContact O-CG 3.29Å; Y378-K382 WeakPolarHBondContact O-CG 2.91Å; Y378-K382 PolarHBondContact O-N 3.23Å; A379-K382 PolarHBondContact O-N 3.07Å; Y380-K382 VanDerWaalsContact C-N 3.33Å; Y380-K382 PolarHBondContact O-N 2.89Å; K382-V385 PolarHBondContact O-N 3.25Å; K382-L386 VanDerWaalsContact O-CB 3.29Å; K382-L386 WeakPolarHBondContact O-CB 3.37Å; K382-L386 PolarHBondContact O-N 2.96Å
383	G	95.5	Very high	94.7	Very high	5 Å²	5	33.3 Å²	33.3	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-44.2	173.5	0	0	0	0	0	113	A379 Y380 L381 V385 L386 F387	A379-G383 PolarHBondContact O-N 3.14Å; Y380-G383 CarbonylContact O-C 3.59Å; Y380-G383 WeakPolarHBondContact O-CA 3.28Å; Y380-G383 PolarHBondContact O-N 2.88Å; Y380-G383 VanDerWaalsContact O-N 3.13Å; L381-G383 VanDerWaalsContact C-N 3.34Å; G383-V385 VanDerWaalsContact C-N 3.32Å; G383-V385 PolarHBondContact O-N 3.48Å; G383-L386 PolarHBondContact O-N 2.92Å; G383-F387 WeakPolarHBondContact O-CB 3.38Å; G383-F387 WeakPolarHBondContact O-CD2 3.34Å; G383-F387 PolarHBondContact O-N 3.36Å
384	T	95.6	Very high	94.8	Very high	16 Å²	16	33.5 Å²	33.5	10%	0.098	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-40.9	177.2	-67.1	0	0	0	0	111.9	Y380 L381 Q408 L433	Y380-T384 PolarHBondContact O-N 3.3Å; Y380-T384 PolarHBondContact O-OG1 2.94Å; L381-T384 PolarHBondContact O-N 2.84Å; T384-Q408 PolarHBondContact OG1-NE2 2.85Å; T384-L433 HydrophobicContact CG2-CD1 3.6Å
385	V	97	Very high	94.9	Very high	24 Å²	24	39.3 Å²	39.3	15%	0.145	23%	0.226	C	C	.	.	H	α-helix	trans	-70.7	-40.3	177.7	166.7	0	0	0	0	111.6	C290 L294 L297 L381 K382 G383 L433 L436	C290-V385 HydrophobicContact CB-CG1 3.85Å; L294-V385 HydrophobicContact CD2-CB 3.93Å; L294-V385 HydrophobicContact CD2-CG1 3.7Å; L294-V385 HydrophobicContact CG-CG1 3.9Å; L297-V385 HydrophobicContact CD1-CG2 4.02Å; L381-V385 WeakPolarHBondContact O-CG2 3.26Å; L381-V385 PolarHBondContact O-N 2.76Å; K382-V385 PolarHBondContact O-N 3.25Å; G383-V385 VanDerWaalsContact C-N 3.32Å; G383-V385 PolarHBondContact O-N 3.48Å; V385-L433 HydrophobicContact CG2-CD2 3.71Å; V385-L436 HydrophobicContact CG2-CD1 4.31Å
386	L	97.3	Very high	95	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-70	-45	-179.1	178.4	65.1	0	0	0	112.2	V269 L272 F275 L286 L294 K382 G383 N388	V269-L386 HydrophobicContact CG1-CD1 3.87Å; V269-L386 HydrophobicContact CG1-CD2 4Å; V269-L386 HydrophobicContact CG2-CD1 4.21Å; V269-L386 HydrophobicContact CG2-CD2 4.18Å; L272-L386 HydrophobicContact CD1-CD2 3.47Å; L272-L386 VanDerWaalsContact CD1-CD2 3.47Å; F275-L386 HydrophobicContact CD2-CD1 4.3Å; F275-L386 HydrophobicContact CD2-CD2 4.27Å; F275-L386 HydrophobicContact CE2-CD1 4.07Å; L286-L386 HydrophobicContact CB-CD1 4.34Å; L294-L386 HydrophobicContact CD1-CD1 4.43Å; K382-L386 VanDerWaalsContact O-CB 3.29Å; K382-L386 WeakPolarHBondContact O-CB 3.37Å; K382-L386 PolarHBondContact O-N 2.96Å; G383-L386 PolarHBondContact O-N 2.92Å; L386-N388 VanDerWaalsContact C-N 3.32Å; L386-N388 PolarHBondContact O-N 3.38Å; L386-N388 VanDerWaalsContact O-N 3.14Å
387	F	96.8	Very high	95.3	Very high	7 Å²	7	35.1 Å²	35.1	3%	0.031	21%	0.209	C	C	.	.			trans	-91.4	65	-176.1	-54.5	-48.2	0	0	0	111.2	L272 C274 G383 I400 L403 Q404	L272-F387 HydrophobicContact CD1-CZ 4.14Å; C274-F387 VanDerWaalsContact SG-CZ 3.57Å; G383-F387 WeakPolarHBondContact O-CB 3.38Å; G383-F387 WeakPolarHBondContact O-CD2 3.34Å; G383-F387 PolarHBondContact O-N 3.36Å; F387-I400 HydrophobicContact CB-CG2 4.11Å; F387-L403 HydrophobicContact CB-CB 4.07Å; F387-L403 HydrophobicContact CD1-CB 4.02Å; F387-L403 HydrophobicContact CD1-CD1 3.69Å; F387-L403 HydrophobicContact CD2-CB 3.81Å; F387-L403 HydrophobicContact CE1-CB 4.46Å; F387-L403 HydrophobicContact CE1-CD1 3.6Å; F387-L403 HydrophobicContact CE2-CB 4.26Å; F387-L403 HydrophobicContact CG-CB 3.69Å; F387-L403 HydrophobicContact CG-CD1 4.23Å; F387-L403 HydrophobicContact CZ-CD1 4.05Å; F387-Q404 HydrophobicContact CB-CB 4.26Å; F387-Q404 WeakPolarHBondContact O-CB 3.47Å; F387-Q404 WeakPolarHBondContact O-CG 3.23Å; F387-Q404 PolarHBondContact O-NE2 3.29Å
388	N	95.7	Very high	95.3	Very high	45 Å²	45	43.9 Å²	43.9	24%	0.241	25%	0.247	C	C	.	.			trans	-97.2	112.3	174.9	-177.4	6.2	0	0	0	110.5	L386 D390 V391 L394	L386-N388 VanDerWaalsContact C-N 3.32Å; L386-N388 PolarHBondContact O-N 3.38Å; L386-N388 VanDerWaalsContact O-N 3.14Å; N388-D390 PolarHBondContact O-N 3.47Å; N388-D390 WeakPolarHBondContact OD1-CB 3.41Å; N388-D390 PolarHBondContact OD1-N 2.99Å; N388-V391 HydrophobicContact CB-CG2 3.86Å; N388-V391 WeakPolarHBondContact O-CG2 3.24Å; N388-L394 VanDerWaalsContact O-CD1 3.31Å; N388-L394 WeakPolarHBondContact O-CD1 3.12Å
389	P	95.8	Very high	95.2	Very high	14 Å²	14	47.6 Å²	47.6	9%	0.091	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.7	179.5	31.1	-35.7	0	0	0	113.2	V391 V397 I400 Q401 Q404	P389-V391 PolarHBondContact O-N 2.88Å; P389-V397 HydrophobicContact CB-CG1 3.97Å; P389-I400 HydrophobicContact CB-CG2 4.36Å; P389-Q401 HydrophobicContact CB-CB 4.22Å; P389-Q404 VanDerWaalsContact CD-CD 3.4Å; P389-Q404 VanDerWaalsContact CG-OE1 3.28Å
390	D	95.8	Very high	95.3	Very high	132 Å²	132	46.9 Å²	46.9	71%	0.706	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	4.6	-175.5	-57	-38.4	0	0	0	113	N388 P392	N388-D390 PolarHBondContact O-N 3.47Å; N388-D390 WeakPolarHBondContact OD1-CB 3.41Å; N388-D390 PolarHBondContact OD1-N 2.99Å; D390-P392 WeakPolarHBondContact O-CD 3.42Å
391	V	95.1	Very high	95.2	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	28%	0.279	C	S	.	.			trans	-71	123.9	-179.8	-178.9	0	0	0	0	110.2	V285 N289 N388 P389 L394	V285-V391 HydrophobicContact CG1-CB 4.5Å; V285-V391 HydrophobicContact CG1-CG1 3.57Å; N289-V391 HydrophobicContact CB-CG1 3.66Å; N289-V391 HydrophobicContact CB-CG2 4.06Å; N289-V391 VanDerWaalsContact ND2-CG2 3.35Å; N289-V391 WeakPolarHBondContact ND2-CG2 3.11Å; N388-V391 HydrophobicContact CB-CG2 3.86Å; N388-V391 WeakPolarHBondContact O-CG2 3.24Å; P389-V391 PolarHBondContact O-N 2.88Å; V391-L394 HydrophobicContact CB-CD1 3.75Å; V391-L394 HydrophobicContact CB-CG 4.01Å; V391-L394 HydrophobicContact CG2-CD1 4.45Å; V391-L394 WeakPolarHBondContact O-CG 3.44Å; V391-L394 PolarHBondContact O-N 3.25Å
392	P	94.6	Very high	94.9	Very high	111 Å²	111	53.6 Å²	53.6	72%	0.721	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	138.9	176.6	-23.3	34.1	0	0	0	112.1	D390	D390-P392 WeakPolarHBondContact O-CD 3.42Å
393	G	93.3	Very high	94.7	Very high	56 Å²	56	54.5 Å²	54.5	58%	0.577	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-3.7	-179.7	0	0	0	0	0	114.8
394	L	95.1	Very high	94.6	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.099	31%	0.313	C	S	.	.			trans	-70.9	130.4	171.8	-74.2	179.3	0	0	0	112.1	V285 L286 N388 V391 V397 I400	V285-L394 HydrophobicContact CB-CD2 4.29Å; V285-L394 HydrophobicContact CG1-CD2 3.74Å; V285-L394 HydrophobicContact CG1-CG 3.92Å; L286-L394 HydrophobicContact CD2-CD1 3.87Å; L286-L394 HydrophobicContact CD2-CD2 3.8Å; L286-L394 HydrophobicContact CD2-CG 4.37Å; L286-L394 HydrophobicContact CG-CD2 4.02Å; N388-L394 VanDerWaalsContact O-CD1 3.31Å; N388-L394 WeakPolarHBondContact O-CD1 3.12Å; V391-L394 HydrophobicContact CB-CD1 3.75Å; V391-L394 HydrophobicContact CB-CG 4.01Å; V391-L394 HydrophobicContact CG2-CD1 4.45Å; V391-L394 WeakPolarHBondContact O-CG 3.44Å; V391-L394 PolarHBondContact O-N 3.25Å; L394-V397 HydrophobicContact CB-CG2 4.09Å; L394-I400 HydrophobicContact CD1-CG1 4.38Å
395	Q	94.6	Very high	94.4	Very high	162 Å²	162	63.6 Å²	63.6	76%	0.757	34%	0.337	S	S	*	.	S	Bend	trans	-99.1	-27.5	172.3	-59.4	179.1	19.3	0	0	111.1	V397	Q395-V397 VanDerWaalsContact C-N 3.34Å; Q395-V397 PolarHBondContact O-N 2.89Å
396	C	92.2	Very high	94.1	Very high	28 Å²	28	62.9 Å²	62.9	19%	0.189	34%	0.335	C	S	.	.			trans	-93.3	36.1	-177.4	59.3	0	0	0	0	113.9	L278 K398 Y399 I400	L278-C396 HydrophobicContact CD2-CB 4.27Å; C396-K398 PolarHBondContact O-N 3.49Å; C396-Y399 WeakPolarHBondContact O-CB 3.45Å; C396-Y399 PolarHBondContact O-N 3.33Å; C396-I400 PolarHBondContact O-N 2.68Å; C396-I400 VanDerWaalsContact O-N 3.13Å
397	V	95.9	Very high	93.8	Very high	60 Å²	60	63 Å²	63	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-52.3	-47.4	-171.7	-178.7	0	0	0	0	113.2	P389 L394 Q395 Y399 I400 Q401	P389-V397 HydrophobicContact CB-CG1 3.97Å; L394-V397 HydrophobicContact CB-CG2 4.09Å; Q395-V397 VanDerWaalsContact C-N 3.34Å; Q395-V397 PolarHBondContact O-N 2.89Å; V397-Y399 VanDerWaalsContact C-N 3.3Å; V397-Y399 PolarHBondContact O-N 2.89Å; V397-I400 PolarHBondContact O-N 2.86Å; V397-Q401 WeakPolarHBondContact O-CB 3.37Å; V397-Q401 PolarHBondContact O-N 3.46Å
398	K	93.4	Very high	93.4	Very high	185 Å²	185	64.3 Å²	64.3	80%	0.804	34%	0.342	S	S	*	.	H	α-helix	trans	-61.5	-37.4	-179.5	-67.7	-176.4	-180	178.4	0	113	C396 G402	C396-K398 PolarHBondContact O-N 3.49Å; K398-G402 PolarHBondContact O-N 2.86Å; K398-G402 VanDerWaalsContact O-N 3.1Å
399	Y	93.3	Very high	93.1	Very high	87 Å²	87	66.1 Å²	66.1	34%	0.341	35%	0.349	S	S	.	.	H	α-helix	trans	-67.4	-47.5	178	176.8	-105.9	0	0	0	110.5	C274 L278 C396 V397 Q401 G402 L403	C274-Y399 VanDerWaalsContact CA-OH 3.3Å; C274-Y399 WeakPolarHBondContact CA-OH 3.32Å; C274-Y399 WeakPolarHBondContact CB-OH 3.49Å; C274-Y399 WeakPolarHBondContact O-CE1 3.47Å; C274-Y399 PolarHBondContact O-OH 3.17Å; L278-Y399 HydrophobicContact CD2-CD1 3.61Å; L278-Y399 HydrophobicContact CD2-CE1 3.68Å; L278-Y399 HydrophobicContact CG-CE1 4.18Å; C396-Y399 WeakPolarHBondContact O-CB 3.45Å; C396-Y399 PolarHBondContact O-N 3.33Å; V397-Y399 VanDerWaalsContact C-N 3.3Å; V397-Y399 PolarHBondContact O-N 2.89Å; Y399-Q401 VanDerWaalsContact C-N 3.32Å; Y399-Q401 PolarHBondContact O-N 2.69Å; Y399-G402 PolarHBondContact O-N 3.23Å; Y399-G402 VanDerWaalsContact O-N 3.17Å; Y399-L403 HydrophobicContact CD1-CD1 4.05Å; Y399-L403 HydrophobicContact CE1-CD1 3.48Å; Y399-L403 VanDerWaalsContact CE1-CD1 3.48Å; Y399-L403 HydrophobicContact CE1-CG 4.23Å; Y399-L403 PolarHBondContact O-N 3.03Å; Y399-L403 VanDerWaalsContact O-N 3.08Å
400	I	96.8	Very high	92.8	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-40.9	177.2	-57.7	-55.4	0	0	0	111.3	L278 L286 F387 P389 L394 C396 V397 G402 L403 Q404	L278-I400 HydrophobicContact CD1-CD1 3.95Å; L278-I400 HydrophobicContact CD2-CD1 4.32Å; L286-I400 HydrophobicContact CD1-CD1 3.8Å; F387-I400 HydrophobicContact CB-CG2 4.11Å; P389-I400 HydrophobicContact CB-CG2 4.36Å; L394-I400 HydrophobicContact CD1-CG1 4.38Å; C396-I400 PolarHBondContact O-N 2.68Å; C396-I400 VanDerWaalsContact O-N 3.13Å; V397-I400 PolarHBondContact O-N 2.86Å; I400-G402 VanDerWaalsContact C-N 3.32Å; I400-G402 PolarHBondContact O-N 3.01Å; I400-L403 HydrophobicContact CD1-CD1 4.45Å; I400-L403 PolarHBondContact O-N 2.89Å; I400-Q404 WeakPolarHBondContact O-CB 3.46Å; I400-Q404 PolarHBondContact O-N 3.43Å
401	Q	93.2	Very high	92.5	Very high	113 Å²	113	60.3 Å²	60.3	53%	0.528	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-40.3	175.5	-170.4	178.4	13.9	0	0	112.1	P389 V397 Y399 Q404 W405	P389-Q401 HydrophobicContact CB-CB 4.22Å; V397-Q401 WeakPolarHBondContact O-CB 3.37Å; V397-Q401 PolarHBondContact O-N 3.46Å; Y399-Q401 VanDerWaalsContact C-N 3.32Å; Y399-Q401 PolarHBondContact O-N 2.69Å; Q401-Q404 PolarHBondContact O-N 2.96Å; Q401-W405 WeakPolarHBondContact O-CB 3.37Å; Q401-W405 PolarHBondContact O-N 3.38Å
402	G	89.6	Confident	92.3	Very high	41 Å²	41	62 Å²	62	42%	0.423	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-42.3	174	0	0	0	0	0	112.8	K398 Y399 I400 W405 G406	K398-G402 PolarHBondContact O-N 2.86Å; K398-G402 VanDerWaalsContact O-N 3.1Å; Y399-G402 PolarHBondContact O-N 3.23Å; Y399-G402 VanDerWaalsContact O-N 3.17Å; I400-G402 VanDerWaalsContact C-N 3.32Å; I400-G402 PolarHBondContact O-N 3.01Å; G402-W405 PolarHBondContact O-N 3.12Å; G402-G406 PolarHBondContact O-N 2.94Å
403	L	91.6	Very high	92	Very high	28 Å²	28	60.9 Å²	60.9	15%	0.147	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-40.6	175.4	-64.8	-179.8	0	0	0	112.4	C274 F387 Y399 I400 G406 T407	C274-L403 HydrophobicContact CB-CD1 3.9Å; C274-L403 HydrophobicContact CB-CD2 3.72Å; C274-L403 HydrophobicContact CB-CG 4.5Å; F387-L403 HydrophobicContact CB-CB 4.07Å; F387-L403 HydrophobicContact CD1-CB 4.02Å; F387-L403 HydrophobicContact CD1-CD1 3.69Å; F387-L403 HydrophobicContact CD2-CB 3.81Å; F387-L403 HydrophobicContact CE1-CB 4.46Å; F387-L403 HydrophobicContact CE1-CD1 3.6Å; F387-L403 HydrophobicContact CE2-CB 4.26Å; F387-L403 HydrophobicContact CG-CB 3.69Å; F387-L403 HydrophobicContact CG-CD1 4.23Å; F387-L403 HydrophobicContact CZ-CD1 4.05Å; Y399-L403 HydrophobicContact CD1-CD1 4.05Å; Y399-L403 HydrophobicContact CE1-CD1 3.48Å; Y399-L403 VanDerWaalsContact CE1-CD1 3.48Å; Y399-L403 HydrophobicContact CE1-CG 4.23Å; Y399-L403 PolarHBondContact O-N 3.03Å; Y399-L403 VanDerWaalsContact O-N 3.08Å; I400-L403 HydrophobicContact CD1-CD1 4.45Å; I400-L403 PolarHBondContact O-N 2.89Å; L403-G406 PolarHBondContact O-N 2.86Å; L403-T407 WeakPolarHBondContact O-CB 3.37Å; L403-T407 PolarHBondContact O-N 3.45Å; L403-T407 PolarHBondContact O-OG1 2.82Å
404	Q	94.2	Very high	91.7	Very high	52 Å²	52	59.6 Å²	59.6	24%	0.243	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-48.5	176.1	-165.7	-177.3	37.8	0	0	110.8	F387 P389 I400 Q401 T407 Q408	F387-Q404 HydrophobicContact CB-CB 4.26Å; F387-Q404 WeakPolarHBondContact O-CB 3.47Å; F387-Q404 WeakPolarHBondContact O-CG 3.23Å; F387-Q404 PolarHBondContact O-NE2 3.29Å; P389-Q404 VanDerWaalsContact CD-CD 3.4Å; P389-Q404 VanDerWaalsContact CG-OE1 3.28Å; I400-Q404 WeakPolarHBondContact O-CB 3.46Å; I400-Q404 PolarHBondContact O-N 3.43Å; Q401-Q404 PolarHBondContact O-N 2.96Å; Q404-T407 PolarHBondContact O-N 3.04Å; Q404-Q408 WeakPolarHBondContact O-CG 3.38Å; Q404-Q408 PolarHBondContact O-N 2.87Å
405	W	92.1	Very high	91.4	Very high	160 Å²	160	58.7 Å²	58.7	61%	0.606	29%	0.288	S	S	*	.	H	α-helix	trans	-57.9	-51.1	176.7	178.6	-101.5	0	0	0	111.4	Q401 G402 T407 Q408 Q409	Q401-W405 WeakPolarHBondContact O-CB 3.37Å; Q401-W405 PolarHBondContact O-N 3.38Å; G402-W405 PolarHBondContact O-N 3.12Å; W405-T407 VanDerWaalsContact C-N 3.28Å; W405-T407 PolarHBondContact O-N 3.37Å; W405-Q408 PolarHBondContact O-N 2.96Å; W405-Q409 HydrophobicContact CD2-CG 4.3Å; W405-Q409 HydrophobicContact CG-CG 4.46Å; W405-Q409 HydrophobicContact CZ2-CG 4.21Å; W405-Q409 WeakPolarHBondContact O-CG 3.46Å; W405-Q409 PolarHBondContact O-N 3.5Å
406	G	88.9	Confident	91	Very high	9 Å²	9	56.8 Å²	56.8	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-39.9	177.9	0	0	0	0	0	112.8	G402 L403 Q409 I410	G402-G406 PolarHBondContact O-N 2.94Å; L403-G406 PolarHBondContact O-N 2.86Å; G406-Q409 PolarHBondContact O-N 3.29Å; G406-I410 WeakPolarHBondContact O-CG1 3.17Å; G406-I410 PolarHBondContact O-N 2.79Å; G406-I410 VanDerWaalsContact O-N 3.07Å
407	T	91.7	Very high	90.7	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-45.3	177.4	-56.6	0	0	0	0	111.9	Y380 L403 Q404 W405 I410 L411	Y380-T407 VanDerWaalsContact O-CG2 3.27Å; Y380-T407 WeakPolarHBondContact O-CG2 3.5Å; L403-T407 WeakPolarHBondContact O-CB 3.37Å; L403-T407 PolarHBondContact O-N 3.45Å; L403-T407 PolarHBondContact O-OG1 2.82Å; Q404-T407 PolarHBondContact O-N 3.04Å; W405-T407 VanDerWaalsContact C-N 3.28Å; W405-T407 PolarHBondContact O-N 3.37Å; T407-I410 PolarHBondContact O-N 3.12Å; T407-L411 WeakPolarHBondContact O-CB 3.46Å; T407-L411 PolarHBondContact O-N 3Å
408	Q	89.6	Confident	89.9	Confident	36 Å²	36	62.2 Å²	62.2	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-38.6	178.3	-72.7	-68.7	-7.8	0	0	112.5	T384 Q404 W405 L411 S412 N430	T384-Q408 PolarHBondContact OG1-NE2 2.85Å; Q404-Q408 WeakPolarHBondContact O-CG 3.38Å; Q404-Q408 PolarHBondContact O-N 2.87Å; W405-Q408 PolarHBondContact O-N 2.96Å; Q408-L411 PolarHBondContact O-N 3.49Å; Q408-S412 WeakPolarHBondContact O-CB 3.49Å; Q408-S412 PolarHBondContact O-N 3.24Å; Q408-N430 PolarHBondContact NE2-OD1 2.9Å
409	Q	89.4	Confident	89	Confident	82 Å²	82	56.7 Å²	56.7	38%	0.383	28%	0.277	S	S	.	.	H	α-helix	trans	-61.4	-47.5	175	-72.7	-62.1	-44.3	0	0	111.6	W405 G406 L411 S412 E413	W405-Q409 HydrophobicContact CD2-CG 4.3Å; W405-Q409 HydrophobicContact CG-CG 4.46Å; W405-Q409 HydrophobicContact CZ2-CG 4.21Å; W405-Q409 WeakPolarHBondContact O-CG 3.46Å; W405-Q409 PolarHBondContact O-N 3.5Å; G406-Q409 PolarHBondContact O-N 3.29Å; Q409-L411 VanDerWaalsContact C-N 3.35Å; Q409-L411 PolarHBondContact O-N 3.33Å; Q409-S412 PolarHBondContact O-N 3.4Å; Q409-E413 WeakPolarHBondContact O-CB 3.07Å; Q409-E413 PolarHBondContact O-N 3.26Å
410	I	88.6	Confident	87.5	Confident	24 Å²	24	62.5 Å²	62.5	12%	0.123	31%	0.307	C	S	.	.	H	α-helix	trans	-68.5	-36	179.9	-65.5	-174.8	0	0	0	111.7	L149 Y380 G406 T407 H414	L149-I410 HydrophobicContact CB-CD1 4.19Å; L149-I410 HydrophobicContact CD2-CD1 3.43Å; L149-I410 VanDerWaalsContact CD2-CD1 3.43Å; L149-I410 HydrophobicContact CD2-CG1 4.29Å; L149-I410 HydrophobicContact CG-CD1 3.57Å; Y380-I410 HydrophobicContact CD1-CG2 4.09Å; Y380-I410 HydrophobicContact CE1-CB 4.27Å; Y380-I410 HydrophobicContact CE1-CG2 3.31Å; Y380-I410 HydrophobicContact CE2-CG2 4.21Å; Y380-I410 VanDerWaalsContact CZ-CG2 3.4Å; Y380-I410 WeakPolarHBondContact OH-CG2 3.17Å; G406-I410 WeakPolarHBondContact O-CG1 3.17Å; G406-I410 PolarHBondContact O-N 2.79Å; G406-I410 VanDerWaalsContact O-N 3.07Å; T407-I410 PolarHBondContact O-N 3.12Å; I410-H414 VanDerWaalsContact O-CB 3.27Å; I410-H414 WeakPolarHBondContact O-CB 3.31Å; I410-H414 PolarHBondContact O-N 3.32Å
411	L	89.8	Confident	86	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-47.5	172.8	178	57.4	0	0	0	111.6	Y380 L381 T407 Q408 Q409 H414 A415 F426 L429	Y380-L411 HydrophobicContact CD2-CB 4.37Å; Y380-L411 HydrophobicContact CD2-CD1 3.9Å; Y380-L411 HydrophobicContact CG-CB 4.31Å; Y380-L411 HydrophobicContact CG-CD1 4.34Å; L381-L411 HydrophobicContact CD2-CD2 4.14Å; T407-L411 WeakPolarHBondContact O-CB 3.46Å; T407-L411 PolarHBondContact O-N 3Å; Q408-L411 PolarHBondContact O-N 3.49Å; Q409-L411 VanDerWaalsContact C-N 3.35Å; Q409-L411 PolarHBondContact O-N 3.33Å; L411-H414 PolarHBondContact O-N 3.49Å; L411-A415 WeakPolarHBondContact O-CB 3.35Å; L411-A415 PolarHBondContact O-N 3.02Å; L411-F426 HydrophobicContact CB-CE2 4.37Å; L411-F426 HydrophobicContact CD2-CD2 4.23Å; L411-F426 HydrophobicContact CD2-CE2 4.06Å; L411-F426 HydrophobicContact CG-CD2 3.96Å; L411-F426 HydrophobicContact CG-CE2 4.07Å; L411-L429 HydrophobicContact CD1-CD1 3.82Å
412	S	89.9	Confident	84.3	Confident	47 Å²	47	60.8 Å²	60.8	33%	0.329	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-45.9	178.8	-175.6	0	0	0	0	111.6	Q408 Q409 A415 R416	Q408-S412 WeakPolarHBondContact O-CB 3.49Å; Q408-S412 PolarHBondContact O-N 3.24Å; Q409-S412 PolarHBondContact O-N 3.4Å; S412-A415 PolarHBondContact O-N 3.01Å; S412-R416 WeakPolarHBondContact O-CB 3.31Å; S412-R416 PolarHBondContact O-N 3.3Å
413	E	88.5	Confident	83	Confident	86 Å²	86	65.8 Å²	65.8	40%	0.402	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-41.7	177.5	178.4	57.2	-165.2	0	0	112.1	Q409 A415 R416 M417	Q409-E413 WeakPolarHBondContact O-CB 3.07Å; Q409-E413 PolarHBondContact O-N 3.26Å; E413-A415 PolarHBondContact O-N 3.48Å; E413-R416 VanDerWaalsContact CD-NH2 3.3Å; E413-R416 PolarHBondContact O-N 3.12Å; E413-R416 IonicContact OE1-CZ 3Å; E413-R416 IonicContact OE1-NE 3.83Å; E413-R416 IonicContact OE1-NH2 3.13Å; E413-R416 PolarHBondContact OE1-NH2 2.8Å; E413-R416 IonicContact OE2-CZ 2.69Å; E413-R416 IonicContact OE2-NE 3.59Å; E413-R416 PolarHBondContact OE2-NE 3.23Å; E413-R416 IonicContact OE2-NH2 3.23Å; E413-R416 PolarHBondContact OE2-NH2 3.18Å; E413-R416 VanDerWaalsContact OE2-NH2 3.15Å; E413-M417 WeakPolarHBondContact O-CB 3.45Å; E413-M417 VanDerWaalsContact O-CG 3.29Å; E413-M417 WeakPolarHBondContact O-CG 3.46Å; E413-M417 PolarHBondContact O-N 3.08Å; E413-M417 WeakPolarHBondContact OE1-CG 3.41Å
414	H	87.8	Confident	82.5	Confident	29 Å²	29	70 Å²	70	13%	0.134	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-42.6	176.6	-178.8	54.7	0	0	0	112.2	Y380 I410 L411 R416 M417 T418	Y380-H414 HydrophobicContact CE2-CB 3.8Å; Y380-H414 AromaticContact CE2-CD2 3.81Å; Y380-H414 AromaticContact CE2-CG 3.84Å; I410-H414 VanDerWaalsContact O-CB 3.27Å; I410-H414 WeakPolarHBondContact O-CB 3.31Å; I410-H414 PolarHBondContact O-N 3.32Å; L411-H414 PolarHBondContact O-N 3.49Å; H414-R416 VanDerWaalsContact C-N 3.32Å; H414-R416 PolarHBondContact O-N 2.91Å; H414-M417 PolarHBondContact O-N 3.4Å; H414-T418 PolarHBondContact CE1-OG1 3.3Å; H414-T418 PolarHBondContact ND1-OG1 3.41Å; H414-T418 WeakPolarHBondContact O-CB 3.49Å; H414-T418 PolarHBondContact O-N 3.35Å; H414-T418 VanDerWaalsContact O-N 3.07Å; H414-T418 PolarHBondContact O-OG1 3.03Å
415	A	88.1	Confident	82.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-43.1	175.9	0	0	0	0	0	111.1	L411 S412 E413 M417 H419 R425 F426	L411-A415 WeakPolarHBondContact O-CB 3.35Å; L411-A415 PolarHBondContact O-N 3.02Å; S412-A415 PolarHBondContact O-N 3.01Å; E413-A415 PolarHBondContact O-N 3.48Å; A415-M417 PolarHBondContact O-N 3.19Å; A415-H419 PolarHBondContact O-N 3.48Å; A415-R425 HydrophobicContact CB-CB 4.22Å; A415-R425 HydrophobicContact CB-CG 4.13Å; A415-F426 HydrophobicContact CB-CB 4.31Å
416	R	86.9	Confident	82.2	Confident	122 Å²	122	62.7 Å²	62.7	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-38.5	176.5	-171.1	-170.7	72.3	73.6	-1	113.6	S412 E413 H414 P422	S412-R416 WeakPolarHBondContact O-CB 3.31Å; S412-R416 PolarHBondContact O-N 3.3Å; E413-R416 VanDerWaalsContact CD-NH2 3.3Å; E413-R416 PolarHBondContact O-N 3.12Å; E413-R416 IonicContact OE1-CZ 3Å; E413-R416 IonicContact OE1-NE 3.83Å; E413-R416 IonicContact OE1-NH2 3.13Å; E413-R416 PolarHBondContact OE1-NH2 2.8Å; E413-R416 IonicContact OE2-CZ 2.69Å; E413-R416 IonicContact OE2-NE 3.59Å; E413-R416 PolarHBondContact OE2-NE 3.23Å; E413-R416 IonicContact OE2-NH2 3.23Å; E413-R416 PolarHBondContact OE2-NH2 3.18Å; E413-R416 VanDerWaalsContact OE2-NH2 3.15Å; H414-R416 VanDerWaalsContact C-N 3.32Å; H414-R416 PolarHBondContact O-N 2.91Å; R416-P422 HydrophobicContact CB-CB 3.91Å; R416-P422 HydrophobicContact CB-CG 4.36Å; R416-P422 HydrophobicContact CG-CB 3.81Å; R416-P422 HydrophobicContact CG-CG 3.9Å
417	M	84.9	Confident	82.2	Confident	123 Å²	123	66.2 Å²	66.2	61%	0.606	33%	0.333	S	S	*	.	H	α-helix	trans	-82.4	-23.1	-176.1	-71.4	-63.6	-68.9	0	0	113.9	E413 H414 A415	E413-M417 WeakPolarHBondContact O-CB 3.45Å; E413-M417 VanDerWaalsContact O-CG 3.29Å; E413-M417 WeakPolarHBondContact O-CG 3.46Å; E413-M417 PolarHBondContact O-N 3.08Å; E413-M417 WeakPolarHBondContact OE1-CG 3.41Å; H414-M417 PolarHBondContact O-N 3.4Å; A415-M417 PolarHBondContact O-N 3.19Å
418	T	79.3	Confident	82.2	Confident	80 Å²	80	69.3 Å²	69.3	49%	0.491	35%	0.348	S	S	.	.	H	α-helix	trans	-104.9	-20.5	-170.3	-43	0	0	0	0	112.8	H414	H414-T418 PolarHBondContact CE1-OG1 3.3Å; H414-T418 PolarHBondContact ND1-OG1 3.41Å; H414-T418 WeakPolarHBondContact O-CB 3.49Å; H414-T418 PolarHBondContact O-N 3.35Å; H414-T418 VanDerWaalsContact O-N 3.07Å; H414-T418 PolarHBondContact O-OG1 3.03Å
419	H	75.8	Confident	82.4	Confident	68 Å²	68	67.6 Å²	67.6	32%	0.315	34%	0.339	S	S	.	.			trans	-126.9	140.5	-174.1	-61.7	-81.9	0	0	0	111.8	E377 A415 G421 R425	E377-H419 IonicContact OE1-CD2 3.72Å; E377-H419 IonicContact OE1-NE2 3.7Å; E377-H419 PolarHBondContact OE1-NE2 2.91Å; E377-H419 VanDerWaalsContact OE1-NE2 3.13Å; A415-H419 PolarHBondContact O-N 3.48Å; H419-G421 PolarHBondContact O-N 2.96Å; H419-R425 HydrophobicContact CB-CB 4.45Å
420	Q	61.2	Low	82.5	Confident	210 Å²	210	65 Å²	65	98%	0.981	33%	0.328	S	S	*	.	S	Bend	trans	-68.2	-13.9	-178.2	-68.4	-177.3	-6	0	0	113.4
421	G	64.3	Low	82.6	Confident	31 Å²	31	66.7 Å²	66.7	32%	0.32	34%	0.342	S	S	.	.	S	Bend	trans	-118.5	85.5	170.5	0	0	0	0	0	112.1	H419 H423 R425	H419-G421 PolarHBondContact O-N 2.96Å; G421-H423 PolarHBondContact O-N 3.25Å; G421-R425 PolarHBondContact O-N 3.44Å
422	P	58.1	Low	82.7	Confident	45 Å²	45	66.7 Å²	66.7	29%	0.292	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-43.9	-171.7	-31.3	38.4	0	0	0	116	R416	R416-P422 HydrophobicContact CB-CB 3.91Å; R416-P422 HydrophobicContact CB-CG 4.36Å; R416-P422 HydrophobicContact CG-CB 3.81Å; R416-P422 HydrophobicContact CG-CG 3.9Å
423	H	63	Low	82.8	Confident	147 Å²	147	65.6 Å²	65.6	68%	0.681	33%	0.332	S	S	*	.	H	α-helix	trans	-74.8	-36.3	-174.2	-77.2	-67.5	0	0	0	111.6	G421 I427	G421-H423 PolarHBondContact O-N 3.25Å; H423-I427 WeakPolarHBondContact O-CD1 3.41Å; H423-I427 WeakPolarHBondContact O-CG1 3.35Å; H423-I427 PolarHBondContact O-N 3.29Å
424	D	80.1	Confident	82.9	Confident	117 Å²	117	66.1 Å²	66.1	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-67.2	-42.9	-177.4	-58.7	-25	0	0	0	111.1	I427 E428	D424-I427 PolarHBondContact O-N 3.38Å; D424-E428 VanDerWaalsContact O-CB 3.25Å; D424-E428 WeakPolarHBondContact O-CB 3.38Å; D424-E428 PolarHBondContact O-N 3.22Å
425	R	90.5	Very high	83	Confident	18 Å²	18	66.1 Å²	66.1	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-64.8	-46.2	-178.9	-176.6	63.6	176.3	175.3	-8.2	112.6	L371 E377 A415 H419 G421 I427 E428 L429	L371-R425 VanDerWaalsContact O-CZ 3.24Å; L371-R425 PolarHBondContact O-NH1 3.01Å; L371-R425 PolarHBondContact O-NH2 2.96Å; E377-R425 IonicContact OE1-CZ 3.76Å; E377-R425 IonicContact OE1-NE 2.63Å; E377-R425 PolarHBondContact OE1-NE 3.48Å; E377-R425 IonicContact OE1-NH2 3.4Å; E377-R425 IonicContact OE2-CZ 2.67Å; E377-R425 IonicContact OE2-NE 3.9Å; E377-R425 IonicContact OE2-NH2 2.81Å; E377-R425 PolarHBondContact OE2-NH2 3.46Å; A415-R425 HydrophobicContact CB-CB 4.22Å; A415-R425 HydrophobicContact CB-CG 4.13Å; H419-R425 HydrophobicContact CB-CB 4.45Å; G421-R425 PolarHBondContact O-N 3.44Å; R425-I427 VanDerWaalsContact C-N 3.31Å; R425-I427 PolarHBondContact O-N 3.22Å; R425-E428 IonicContact NH1-OE2 3.15Å; R425-E428 PolarHBondContact NH1-OE2 3.25Å; R425-E428 PolarHBondContact O-N 2.97Å; R425-L429 HydrophobicContact CG-CD1 4.1Å; R425-L429 HydrophobicContact CG-CG 4.39Å; R425-L429 WeakPolarHBondContact O-CB 3.37Å; R425-L429 VanDerWaalsContact O-CG 3.27Å; R425-L429 WeakPolarHBondContact O-CG 3.39Å; R425-L429 PolarHBondContact O-N 3.17Å
426	F	89.6	Confident	83.1	Confident	39 Å²	39	66.5 Å²	66.5	17%	0.171	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-42.5	178.6	177.2	-95.7	0	0	0	111.6	L411 A415 N430	L411-F426 HydrophobicContact CB-CE2 4.37Å; L411-F426 HydrophobicContact CD2-CD2 4.23Å; L411-F426 HydrophobicContact CD2-CE2 4.06Å; L411-F426 HydrophobicContact CG-CD2 3.96Å; L411-F426 HydrophobicContact CG-CE2 4.07Å; A415-F426 HydrophobicContact CB-CB 4.31Å; F426-N430 VanDerWaalsContact CE1-ND2 3.27Å; F426-N430 WeakPolarHBondContact CE1-ND2 3.29Å; F426-N430 WeakPolarHBondContact CE2-ND2 3.39Å; F426-N430 WeakPolarHBondContact CZ-ND2 3.49Å; F426-N430 PolarHBondContact O-N 3.03Å; F426-N430 VanDerWaalsContact O-N 3.1Å; F426-N430 PolarHBondContact O-ND2 2.67Å
427	I	89.9	Confident	83.1	Confident	83 Å²	83	67.5 Å²	67.5	43%	0.426	34%	0.34	S	S	.	.	H	α-helix	trans	-65.7	-42.9	177.6	-67.1	167.3	0	0	0	110.5	H423 D424 R425 N430 S431	H423-I427 WeakPolarHBondContact O-CD1 3.41Å; H423-I427 WeakPolarHBondContact O-CG1 3.35Å; H423-I427 PolarHBondContact O-N 3.29Å; D424-I427 PolarHBondContact O-N 3.38Å; R425-I427 VanDerWaalsContact C-N 3.31Å; R425-I427 PolarHBondContact O-N 3.22Å; I427-N430 PolarHBondContact O-N 3.42Å; I427-S431 VanDerWaalsContact O-CB 3.29Å; I427-S431 WeakPolarHBondContact O-CB 3.49Å; I427-S431 PolarHBondContact O-N 2.81Å; I427-S431 PolarHBondContact O-OG 2.95Å
428	E	91.8	Very high	83.2	Confident	69 Å²	69	65.7 Å²	65.7	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-42.8	-179.7	-173.1	179.8	-135.2	0	0	112.4	L371 D424 R425 S431 T432	L371-E428 HydrophobicContact CD1-CG 3.8Å; L371-E428 HydrophobicContact CD2-CG 3.65Å; L371-E428 WeakPolarHBondContact CD2-OE1 3.33Å; L371-E428 HydrophobicContact CG-CG 4.36Å; D424-E428 VanDerWaalsContact O-CB 3.25Å; D424-E428 WeakPolarHBondContact O-CB 3.38Å; D424-E428 PolarHBondContact O-N 3.22Å; R425-E428 IonicContact NH1-OE2 3.15Å; R425-E428 PolarHBondContact NH1-OE2 3.25Å; R425-E428 PolarHBondContact O-N 2.97Å; E428-S431 WeakPolarHBondContact O-CB 3.41Å; E428-S431 PolarHBondContact O-N 3.38Å; E428-T432 PolarHBondContact O-N 3.07Å; E428-T432 PolarHBondContact O-OG1 3.44Å
429	L	93.4	Very high	83.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-45.7	175.7	-71.1	178.4	0	0	0	111.6	I373 E377 L381 L411 R425 S431 T432 L433	I373-L429 HydrophobicContact CD1-CD2 4.16Å; I373-L429 HydrophobicContact CG1-CD2 3.91Å; I373-L429 HydrophobicContact CG2-CD2 4.22Å; E377-L429 HydrophobicContact CB-CD1 4.26Å; E377-L429 HydrophobicContact CG-CD1 3.95Å; L381-L429 HydrophobicContact CD1-CD2 4.38Å; L381-L429 HydrophobicContact CD2-CB 4.2Å; L411-L429 HydrophobicContact CD1-CD1 3.82Å; R425-L429 HydrophobicContact CG-CD1 4.1Å; R425-L429 HydrophobicContact CG-CG 4.39Å; R425-L429 WeakPolarHBondContact O-CB 3.37Å; R425-L429 VanDerWaalsContact O-CG 3.27Å; R425-L429 WeakPolarHBondContact O-CG 3.39Å; R425-L429 PolarHBondContact O-N 3.17Å; L429-S431 VanDerWaalsContact C-N 3.33Å; L429-S431 PolarHBondContact O-N 3.45Å; L429-T432 WeakPolarHBondContact O-CB 3.35Å; L429-T432 PolarHBondContact O-N 2.87Å; L429-T432 VanDerWaalsContact O-N 3.15Å; L429-L433 PolarHBondContact O-N 3.18Å; L429-L433 VanDerWaalsContact O-N 3.12Å
430	N	91.1	Very high	84.5	Confident	28 Å²	28	63.6 Å²	63.6	15%	0.15	32%	0.317	C	S	.	.	H	α-helix	trans	-67.9	-32.4	175.6	-78	-69.5	0	0	0	112.6	Q408 F426 I427 T432 L433 F434	Q408-N430 PolarHBondContact NE2-OD1 2.9Å; F426-N430 VanDerWaalsContact CE1-ND2 3.27Å; F426-N430 WeakPolarHBondContact CE1-ND2 3.29Å; F426-N430 WeakPolarHBondContact CE2-ND2 3.39Å; F426-N430 WeakPolarHBondContact CZ-ND2 3.49Å; F426-N430 PolarHBondContact O-N 3.03Å; F426-N430 VanDerWaalsContact O-N 3.1Å; F426-N430 PolarHBondContact O-ND2 2.67Å; I427-N430 PolarHBondContact O-N 3.42Å; N430-T432 PolarHBondContact O-N 2.75Å; N430-L433 WeakPolarHBondContact O-CB 3.42Å; N430-L433 PolarHBondContact O-N 3.12Å; N430-F434 PolarHBondContact O-N 2.59Å
431	S	90.9	Very high	86.1	Confident	58 Å²	58	55.1 Å²	55.1	41%	0.406	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-30.5	172.4	-59.8	0	0	0	0	111.6	I427 E428 L429 F434 L435	I427-S431 VanDerWaalsContact O-CB 3.29Å; I427-S431 WeakPolarHBondContact O-CB 3.49Å; I427-S431 PolarHBondContact O-N 2.81Å; I427-S431 PolarHBondContact O-OG 2.95Å; E428-S431 WeakPolarHBondContact O-CB 3.41Å; E428-S431 PolarHBondContact O-N 3.38Å; L429-S431 VanDerWaalsContact C-N 3.33Å; L429-S431 PolarHBondContact O-N 3.45Å; S431-F434 VanDerWaalsContact O-CB 3.27Å; S431-F434 WeakPolarHBondContact O-CB 3.42Å; S431-F434 PolarHBondContact O-N 2.93Å; S431-L435 PolarHBondContact O-N 2.89Å
432	T	92.1	Very high	87.5	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-71.8	-40.2	173.6	-56.8	0	0	0	0	111.5	F364 K367 C368 L371 E428 L429 N430 F434 L435	F364-T432 HydrophobicContact CE2-CG2 3.96Å; K367-T432 HydrophobicContact CG-CG2 4.38Å; C368-T432 VanDerWaalsContact SG-CG2 3.56Å; L371-T432 HydrophobicContact CD1-CG2 4.41Å; L371-T432 WeakPolarHBondContact CD1-OG1 3.31Å; E428-T432 PolarHBondContact O-N 3.07Å; E428-T432 PolarHBondContact O-OG1 3.44Å; L429-T432 WeakPolarHBondContact O-CB 3.35Å; L429-T432 PolarHBondContact O-N 2.87Å; L429-T432 VanDerWaalsContact O-N 3.15Å; N430-T432 PolarHBondContact O-N 2.75Å; T432-F434 PolarHBondContact O-N 3.43Å; T432-L435 WeakPolarHBondContact O-CB 3.3Å; T432-L435 PolarHBondContact O-N 3.38Å; T432-L435 VanDerWaalsContact O-N 3.1Å
433	L	92.4	Very high	89.2	Confident	23 Å²	23	57.4 Å²	57.4	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-35.6	170.2	-70	179.2	0	0	0	112.3	L297 L381 T384 V385 L429 N430 L435 L436	L297-L433 HydrophobicContact CD1-CD2 4.17Å; L297-L433 HydrophobicContact CD2-CD2 4.34Å; L381-L433 HydrophobicContact CB-CD2 4.11Å; L381-L433 HydrophobicContact CD2-CD1 3.58Å; L381-L433 HydrophobicContact CD2-CD2 4.15Å; L381-L433 HydrophobicContact CD2-CG 3.76Å; T384-L433 HydrophobicContact CG2-CD1 3.6Å; V385-L433 HydrophobicContact CG2-CD2 3.71Å; L429-L433 PolarHBondContact O-N 3.18Å; L429-L433 VanDerWaalsContact O-N 3.12Å; N430-L433 WeakPolarHBondContact O-CB 3.42Å; N430-L433 PolarHBondContact O-N 3.12Å; L433-L435 PolarHBondContact O-N 3.41Å; L433-L436 HydrophobicContact CD2-CD1 3.72Å; L433-L436 WeakPolarHBondContact O-CB 3.43Å; L433-L436 PolarHBondContact O-N 3.16Å; L433-L436 VanDerWaalsContact O-N 3.07Å
434	F	89.8	Confident	90.7	Very high	97 Å²	97	50.5 Å²	50.5	43%	0.425	25%	0.253	S	S	.	.	H	α-helix	trans	-56.5	-35.4	174.8	-174.6	-75.8	0	0	0	111.1	N430 S431 T432 L436 R437 F438	N430-F434 PolarHBondContact O-N 2.59Å; S431-F434 VanDerWaalsContact O-CB 3.27Å; S431-F434 WeakPolarHBondContact O-CB 3.42Å; S431-F434 PolarHBondContact O-N 2.93Å; T432-F434 PolarHBondContact O-N 3.43Å; F434-L436 VanDerWaalsContact C-N 3.31Å; F434-L436 PolarHBondContact O-N 2.99Å; F434-R437 WeakPolarHBondContact O-CG 3.22Å; F434-R437 PolarHBondContact O-N 2.93Å; F434-R437 PolarHBondContact O-NH1 3.01Å; F434-F438 AromaticContact CD1-CE2 3.89Å; F434-F438 HydrophobicContact CD1-CE2 3.89Å; F434-F438 AromaticContact CE1-CE2 3.58Å; F434-F438 HydrophobicContact CE1-CE2 3.58Å; F434-F438 AromaticContact CE1-CZ 3.78Å; F434-F438 HydrophobicContact CE1-CZ 3.78Å; F434-F438 HydrophobicContact CZ-CZ 4.4Å
435	L	89.8	Confident	91.4	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-29.5	178.1	-58.6	175.8	0	0	0	113.4	W235 F364 K367 S431 T432 L433 R437 F438	W235-L435 HydrophobicContact CH2-CD2 4.46Å; W235-L435 HydrophobicContact CZ2-CD2 3.59Å; F364-L435 HydrophobicContact CD2-CB 4.09Å; K367-L435 HydrophobicContact CB-CD1 4.21Å; K367-L435 HydrophobicContact CG-CD1 3.83Å; S431-L435 PolarHBondContact O-N 2.89Å; T432-L435 WeakPolarHBondContact O-CB 3.3Å; T432-L435 PolarHBondContact O-N 3.38Å; T432-L435 VanDerWaalsContact O-N 3.1Å; L433-L435 PolarHBondContact O-N 3.41Å; L435-R437 PolarHBondContact O-N 3.45Å; L435-F438 PolarHBondContact O-N 3.03Å
436	L	90.6	Very high	91.5	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-29.9	-179.2	-76.4	169.5	0	0	0	113	M296 L297 F364 V385 L433 F434 F438 I439	M296-L436 HydrophobicContact CB-CD2 3.62Å; M296-L436 HydrophobicContact CG-CD2 4.23Å; L297-L436 HydrophobicContact CD1-CD1 4.3Å; L297-L436 HydrophobicContact CD2-CD1 4.33Å; L297-L436 HydrophobicContact CG-CD1 4.1Å; F364-L436 HydrophobicContact CD1-CD2 4.07Å; F364-L436 HydrophobicContact CD2-CD2 3.89Å; F364-L436 HydrophobicContact CD2-CG 4.07Å; F364-L436 HydrophobicContact CE1-CD2 3.62Å; F364-L436 HydrophobicContact CE1-CG 4.46Å; F364-L436 HydrophobicContact CE2-CD1 4.15Å; F364-L436 HydrophobicContact CE2-CD2 3.42Å; F364-L436 VanDerWaalsContact CE2-CD2 3.42Å; F364-L436 HydrophobicContact CE2-CG 3.4Å; F364-L436 VanDerWaalsContact CE2-CG 3.4Å; F364-L436 HydrophobicContact CG-CD2 4.2Å; F364-L436 HydrophobicContact CZ-CD1 4.06Å; F364-L436 HydrophobicContact CZ-CD2 3.25Å; F364-L436 HydrophobicContact CZ-CG 3.63Å; V385-L436 HydrophobicContact CG2-CD1 4.31Å; L433-L436 HydrophobicContact CD2-CD1 3.72Å; L433-L436 WeakPolarHBondContact O-CB 3.43Å; L433-L436 PolarHBondContact O-N 3.16Å; L433-L436 VanDerWaalsContact O-N 3.07Å; F434-L436 VanDerWaalsContact C-N 3.31Å; F434-L436 PolarHBondContact O-N 2.99Å; L436-F438 PolarHBondContact O-N 2.91Å; L436-F438 VanDerWaalsContact O-N 3.15Å; L436-I439 HydrophobicContact CD2-CD1 4.25Å; L436-I439 PolarHBondContact O-N 3.45Å
437	R	86.8	Confident	91.6	Very high	144 Å²	144	45.7 Å²	45.7	54%	0.543	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.3	-177.1	85.8	173.6	60.9	78.9	-6	114	F434 L435 I439	F434-R437 WeakPolarHBondContact O-CG 3.22Å; F434-R437 PolarHBondContact O-N 2.93Å; F434-R437 PolarHBondContact O-NH1 3.01Å; L435-R437 PolarHBondContact O-N 3.45Å; R437-I439 VanDerWaalsContact C-N 3.34Å
438	F	86.1	Confident	91.8	Very high	84 Å²	84	41.8 Å²	41.8	37%	0.368	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.8	176.7	-56.7	-75.1	0	0	0	112.3	W236 F434 L435 L436	W236-F438 HydrophobicContact CH2-CD1 4.28Å; W236-F438 AromaticContact CH2-CE1 3.67Å; W236-F438 HydrophobicContact CH2-CE1 3.67Å; W236-F438 AromaticContact CH2-CZ 3.86Å; W236-F438 HydrophobicContact CH2-CZ 3.86Å; W236-F438 HydrophobicContact CZ3-CD1 4.29Å; W236-F438 AromaticContact CZ3-CE1 3.99Å; W236-F438 HydrophobicContact CZ3-CE1 3.99Å; W236-F438 HydrophobicContact CZ3-CE2 4.31Å; W236-F438 AromaticContact CZ3-CZ 3.99Å; W236-F438 HydrophobicContact CZ3-CZ 3.99Å; F434-F438 AromaticContact CD1-CE2 3.89Å; F434-F438 HydrophobicContact CD1-CE2 3.89Å; F434-F438 AromaticContact CE1-CE2 3.58Å; F434-F438 HydrophobicContact CE1-CE2 3.58Å; F434-F438 AromaticContact CE1-CZ 3.78Å; F434-F438 HydrophobicContact CE1-CZ 3.78Å; F434-F438 HydrophobicContact CZ-CZ 4.4Å; L435-F438 PolarHBondContact O-N 3.03Å; L436-F438 PolarHBondContact O-N 2.91Å; L436-F438 VanDerWaalsContact O-N 3.15Å
439	I	92.2	Very high	91.7	Very high	21 Å²	21	38.5 Å²	38.5	11%	0.108	20%	0.196	C	C	.	.	S	Bend	trans	-96	120.9	175.7	-53.6	178.1	0	0	0	108.8	M296 I361 F364 L436 R437 I444	M296-I439 HydrophobicContact CE-CD1 4.24Å; M296-I439 HydrophobicContact CG-CD1 4.3Å; I361-I439 HydrophobicContact CD1-CG2 4.38Å; I361-I439 HydrophobicContact CG1-CG2 3.74Å; F364-I439 HydrophobicContact CB-CD1 3.64Å; F364-I439 HydrophobicContact CD1-CD1 4.12Å; F364-I439 HydrophobicContact CD2-CD1 4.48Å; F364-I439 HydrophobicContact CG-CD1 3.8Å; L436-I439 HydrophobicContact CD2-CD1 4.25Å; L436-I439 PolarHBondContact O-N 3.45Å; R437-I439 VanDerWaalsContact C-N 3.34Å; I439-I444 HydrophobicContact CG2-CD1 3.57Å; I439-I444 HydrophobicContact CG2-CG1 3.93Å
440	N	91.4	Very high	91.4	Very high	84 Å²	84	42.4 Å²	42.4	45%	0.449	21%	0.21	S	C	.	.			trans	-84.6	128.6	-178.8	-172.3	-33.8	0	0	0	110.9	N442 V443 I444	N440-N442 PolarHBondContact O-N 2.95Å; N440-N442 WeakPolarHBondContact OD1-CB 3.45Å; N440-N442 PolarHBondContact OD1-N 3.29Å; N440-V443 HydrophobicContact CB-CB 4.39Å; N440-V443 HydrophobicContact CB-CG2 3.89Å; N440-V443 WeakPolarHBondContact O-CB 3.43Å; N440-V443 PolarHBondContact O-N 3.13Å; N440-I444 PolarHBondContact O-N 2.91Å
441	A	94.3	Very high	91	Very high	32 Å²	32	44.8 Å²	44.8	26%	0.264	23%	0.227	S	C	.	.	H	α-helix	trans	-56	-34.9	176.8	0	0	0	0	0	113.1	W291 A292 V443 I444 A445	W291-A441 HydrophobicContact CZ2-CB 4.07Å; A292-A441 HydrophobicContact CB-CB 3.54Å; A441-V443 VanDerWaalsContact C-N 3.32Å; A441-V443 PolarHBondContact O-N 2.73Å; A441-I444 WeakPolarHBondContact O-CB 3.31Å; A441-I444 PolarHBondContact O-N 2.93Å; A441-A445 WeakPolarHBondContact O-CB 3.47Å; A441-A445 PolarHBondContact O-N 2.99Å
442	N	92.9	Very high	90.4	Very high	113 Å²	113	44.5 Å²	44.5	60%	0.604	22%	0.221	S	C	*	.	H	α-helix	trans	-66.4	-35	177.2	-65.3	-22.6	0	0	0	111.8	N440 I444 A445 E446	N440-N442 PolarHBondContact O-N 2.95Å; N440-N442 WeakPolarHBondContact OD1-CB 3.45Å; N440-N442 PolarHBondContact OD1-N 3.29Å; N442-I444 VanDerWaalsContact C-N 3.34Å; N442-A445 PolarHBondContact O-N 3.2Å; N442-E446 WeakPolarHBondContact O-CB 3.11Å; N442-E446 VanDerWaalsContact O-CG 3.32Å; N442-E446 WeakPolarHBondContact O-CG 3.28Å; N442-E446 PolarHBondContact O-N 3.32Å
443	V	93.9	Very high	89.7	Confident	10 Å²	10	45.2 Å²	45.2	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-66.2	-42.1	175.5	174	0	0	0	0	109.9	P353 Q357 I361 N440 A441 E446 L447	P353-V443 HydrophobicContact CB-CG1 4.13Å; Q357-V443 HydrophobicContact CB-CG1 3.81Å; Q357-V443 HydrophobicContact CB-CG2 4.05Å; Q357-V443 VanDerWaalsContact CD-CG2 3.43Å; Q357-V443 HydrophobicContact CG-CG2 4.02Å; I361-V443 HydrophobicContact CD1-CG1 3.91Å; N440-V443 HydrophobicContact CB-CB 4.39Å; N440-V443 HydrophobicContact CB-CG2 3.89Å; N440-V443 WeakPolarHBondContact O-CB 3.43Å; N440-V443 PolarHBondContact O-N 3.13Å; A441-V443 VanDerWaalsContact C-N 3.32Å; A441-V443 PolarHBondContact O-N 2.73Å; V443-E446 PolarHBondContact O-N 2.87Å; V443-L447 WeakPolarHBondContact O-CB 3.29Å; V443-L447 PolarHBondContact O-N 3Å
444	I	95.4	Very high	89.2	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-45.6	175.8	-67.9	166.4	0	0	0	110.2	W291 A292 L295 M296 I361 I439 N440 A441 N442 L447 F448 F449	W291-I444 HydrophobicContact CH2-CB 4.46Å; W291-I444 HydrophobicContact CH2-CG2 4.01Å; W291-I444 HydrophobicContact CZ3-CG2 3.84Å; A292-I444 HydrophobicContact CB-CD1 3.83Å; L295-I444 HydrophobicContact CD2-CG2 3.78Å; M296-I444 HydrophobicContact CG-CD1 3.63Å; M296-I444 HydrophobicContact SD-CD1 3.9Å; M296-I444 HydrophobicContact SD-CG1 4.22Å; I361-I444 HydrophobicContact CD1-CG1 4.21Å; I439-I444 HydrophobicContact CG2-CD1 3.57Å; I439-I444 HydrophobicContact CG2-CG1 3.93Å; N440-I444 PolarHBondContact O-N 2.91Å; A441-I444 WeakPolarHBondContact O-CB 3.31Å; A441-I444 PolarHBondContact O-N 2.93Å; N442-I444 VanDerWaalsContact C-N 3.34Å; I444-L447 PolarHBondContact O-N 3.48Å; I444-F448 HydrophobicContact CB-CD2 4.45Å; I444-F448 HydrophobicContact CG2-CD2 3.9Å; I444-F448 HydrophobicContact CG2-CE2 4.49Å; I444-F448 WeakPolarHBondContact O-CB 3.46Å; I444-F448 WeakPolarHBondContact O-CD2 3.31Å; I444-F448 PolarHBondContact O-N 3.3Å; I444-F449 HydrophobicContact CG2-CE2 4.11Å
445	A	94.1	Very high	88.7	Confident	14 Å²	14	46.9 Å²	46.9	12%	0.116	25%	0.25	C	S	.	.	I	π-helix	trans	-58.1	-51.2	176.2	0	0	0	0	0	111.9	W291 A441 N442 L447 F449 R450 M458	W291-A445 HydrophobicContact CH2-CB 4.23Å; A441-A445 WeakPolarHBondContact O-CB 3.47Å; A441-A445 PolarHBondContact O-N 2.99Å; N442-A445 PolarHBondContact O-N 3.2Å; A445-L447 PolarHBondContact O-N 3.4Å; A445-F449 CarbonylContact O-C 3.57Å; A445-F449 WeakPolarHBondContact O-CA 3.28Å; A445-F449 WeakPolarHBondContact O-CB 3.49Å; A445-F449 PolarHBondContact O-N 3.47Å; A445-R450 PolarHBondContact O-N 3.45Å; A445-M458 HydrophobicContact CB-CG 3.73Å; A445-M458 HydrophobicContact CB-SD 4.44Å
446	E	92	Very high	88.3	Confident	53 Å²	53	46.8 Å²	46.8	25%	0.248	25%	0.251	C	S	.	.	I	π-helix	trans	-64.2	-39.3	179.7	-72.1	-59.6	145.2	0	0	112.6	P353 N442 V443 R450	P353-E446 HydrophobicContact CG-CB 4Å; N442-E446 WeakPolarHBondContact O-CB 3.11Å; N442-E446 VanDerWaalsContact O-CG 3.32Å; N442-E446 WeakPolarHBondContact O-CG 3.28Å; N442-E446 PolarHBondContact O-N 3.32Å; V443-E446 PolarHBondContact O-N 2.87Å; E446-R450 WeakPolarHBondContact O-CB 3.33Å; E446-R450 IonicContact OE1-NE 3.03Å; E446-R450 WeakPolarHBondContact OE2-CG 3.4Å
447	L	93.7	Very high	88.2	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.037	27%	0.266	C	S	.	.	I	π-helix	trans	-74.6	-47.5	-176.8	-173.4	63.2	0	0	0	112.8	L248 F306 P353 V358 I361 V443 I444 A445	L248-L447 HydrophobicContact CD1-CD1 4.37Å; L248-L447 HydrophobicContact CD1-CG 4.48Å; L248-L447 VanDerWaalsContact CD1-O 3.31Å; L248-L447 WeakPolarHBondContact CD1-O 3.48Å; L248-L447 HydrophobicContact CD2-CD1 3.85Å; L248-L447 HydrophobicContact CD2-CG 4.2Å; L248-L447 HydrophobicContact CG-CD1 3.8Å; L248-L447 HydrophobicContact CG-CG 4.34Å; F306-L447 HydrophobicContact CE2-CD2 4.28Å; F306-L447 HydrophobicContact CZ-CD2 4.45Å; P353-L447 HydrophobicContact CG-CB 3.99Å; P353-L447 HydrophobicContact CG-CD1 4.24Å; V358-L447 HydrophobicContact CG2-CD1 4.39Å; V358-L447 HydrophobicContact CG2-CD2 4.28Å; I361-L447 HydrophobicContact CD1-CD2 3.99Å; V443-L447 WeakPolarHBondContact O-CB 3.29Å; V443-L447 PolarHBondContact O-N 3Å; I444-L447 PolarHBondContact O-N 3.48Å; A445-L447 PolarHBondContact O-N 3.4Å
448	F	92.3	Very high	88.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-105.3	-23.7	-167.5	-62.3	-64.2	0	0	0	114.6	L248 V254 C255 A258 L299 F306 I361 I444	L248-F448 HydrophobicContact CD1-CD1 4.47Å; V254-F448 HydrophobicContact CG1-CD1 3.88Å; V254-F448 HydrophobicContact CG1-CE1 3.69Å; C255-F448 WeakPolarHBondContact CB-O 3.26Å; C255-F448 PolarHBondContact SG-O 3.05Å; A258-F448 HydrophobicContact CB-CB 3.77Å; A258-F448 HydrophobicContact CB-CD1 3.97Å; A258-F448 HydrophobicContact CB-CG 3.97Å; L299-F448 HydrophobicContact CD1-CE2 4.42Å; F306-F448 HydrophobicContact CD1-CE1 4.4Å; F306-F448 HydrophobicContact CD1-CZ 4.45Å; F306-F448 HydrophobicContact CE1-CE1 4.32Å; F306-F448 AromaticContact CE1-CZ 3.94Å; F306-F448 HydrophobicContact CE1-CZ 3.94Å; F306-F448 HydrophobicContact CZ-CZ 4.06Å; I361-F448 HydrophobicContact CD1-CE2 4.44Å; I361-F448 HydrophobicContact CG2-CZ 4.42Å; I444-F448 HydrophobicContact CB-CD2 4.45Å; I444-F448 HydrophobicContact CG2-CD2 3.9Å; I444-F448 HydrophobicContact CG2-CE2 4.49Å; I444-F448 WeakPolarHBondContact O-CB 3.46Å; I444-F448 WeakPolarHBondContact O-CD2 3.31Å; I444-F448 PolarHBondContact O-N 3.3Å
449	F	89.6	Confident	88.4	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	24%	0.244	C	C	.	.	I	π-helix	trans	-116.1	-38	-170.3	-62.6	-76.7	0	0	0	113.1	A258 L262 W291 L295 I444 A445 P451 I452 I453 M458	A258-F449 HydrophobicContact CB-CZ 4.44Å; L262-F449 HydrophobicContact CB-CE1 4.15Å; L262-F449 HydrophobicContact CB-CZ 4Å; L262-F449 HydrophobicContact CD2-CD1 4.41Å; L262-F449 HydrophobicContact CD2-CE1 3.62Å; L262-F449 HydrophobicContact CD2-CZ 3.74Å; L262-F449 HydrophobicContact CG-CZ 4.37Å; W291-F449 HydrophobicContact CZ3-CD2 4.37Å; W291-F449 AromaticContact CZ3-CE2 3.89Å; W291-F449 HydrophobicContact CZ3-CE2 3.89Å; L295-F449 HydrophobicContact CD2-CE2 3.42Å; L295-F449 VanDerWaalsContact CD2-CE2 3.42Å; L295-F449 HydrophobicContact CD2-CZ 3.47Å; L295-F449 VanDerWaalsContact CD2-CZ 3.47Å; I444-F449 HydrophobicContact CG2-CE2 4.11Å; A445-F449 CarbonylContact O-C 3.57Å; A445-F449 WeakPolarHBondContact O-CA 3.28Å; A445-F449 WeakPolarHBondContact O-CB 3.49Å; A445-F449 PolarHBondContact O-N 3.47Å; F449-P451 VanDerWaalsContact C-N 3.26Å; F449-P451 VanDerWaalsContact O-N 3.16Å; F449-I452 WeakPolarHBondContact O-CA 3.48Å; F449-I452 PolarHBondContact O-N 3.39Å; F449-I453 HydrophobicContact CB-CD1 4.02Å; F449-I453 HydrophobicContact CB-CG1 4.44Å; F449-I453 WeakPolarHBondContact O-CG1 3.17Å; F449-I453 PolarHBondContact O-N 3.24Å; F449-M458 HydrophobicContact CB-SD 3.95Å; F449-M458 HydrophobicContact CD1-CE 4.33Å; F449-M458 HydrophobicContact CD2-CE 3.79Å; F449-M458 HydrophobicContact CD2-SD 4.23Å; F449-M458 HydrophobicContact CE2-CE 4.03Å; F449-M458 HydrophobicContact CG-CE 3.94Å; F449-M458 HydrophobicContact CG-SD 4.03Å; F449-M458 HydrophobicContact CZ-CE 4.42Å
450	R	87.9	Confident	88.1	Confident	81 Å²	81	45.6 Å²	45.6	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-51.3	-37.5	178.2	-159.8	79.7	-178	171.9	-9	114	A445 E446 I452 G454 T455	A445-R450 PolarHBondContact O-N 3.45Å; E446-R450 WeakPolarHBondContact O-CB 3.33Å; E446-R450 IonicContact OE1-NE 3.03Å; E446-R450 WeakPolarHBondContact OE2-CG 3.4Å; R450-I452 PolarHBondContact O-N 3.36Å; R450-G454 WeakPolarHBondContact CD-O 3.45Å; R450-G454 PolarHBondContact NE-O 2.75Å; R450-G454 PolarHBondContact NH1-O 2.93Å; R450-G454 PolarHBondContact O-N 3.16Å; R450-G454 VanDerWaalsContact O-N 3.14Å; R450-T455 VanDerWaalsContact NH1-CA 3.35Å
451	P	83.1	Confident	87.8	Confident	78 Å²	78	41.6 Å²	41.6	51%	0.506	24%	0.242	S	C	.	.	H	α-helix	trans	-63.1	-25	174.7	-24.6	36.6	0	0	0	114.6	F449	F449-P451 VanDerWaalsContact C-N 3.26Å; F449-P451 VanDerWaalsContact O-N 3.16Å
452	I	78.1	Confident	87.6	Confident	52 Å²	52	40 Å²	40	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-96.7	-51.3	-178.2	-61.1	177.9	0	0	0	110.8	M83 C255 S259 F449 R450	M83-I452 HydrophobicContact CG-CG2 4.27Å; C255-I452 HydrophobicContact CB-CD1 3.36Å; C255-I452 HydrophobicContact CB-CG1 3.78Å; C255-I452 WeakPolarHBondContact O-CD1 3.38Å; S259-I452 VanDerWaalsContact OG-CD1 3.32Å; S259-I452 WeakPolarHBondContact OG-CD1 3.23Å; F449-I452 WeakPolarHBondContact O-CA 3.48Å; F449-I452 PolarHBondContact O-N 3.39Å; R450-I452 PolarHBondContact O-N 3.36Å
453	I	77.9	Confident	87.3	Confident	17 Å²	17	37.5 Å²	37.5	9%	0.087	22%	0.215	C	C	.	.	H	α-helix	trans	-94.3	-7	-167.4	75.6	-179.5	0	0	0	113.4	F449 T455 V456 M458 M461	F449-I453 HydrophobicContact CB-CD1 4.02Å; F449-I453 HydrophobicContact CB-CG1 4.44Å; F449-I453 WeakPolarHBondContact O-CG1 3.17Å; F449-I453 PolarHBondContact O-N 3.24Å; I453-T455 PolarHBondContact O-N 3.18Å; I453-V456 HydrophobicContact CB-CB 4.17Å; I453-V456 HydrophobicContact CD1-CB 4.29Å; I453-V456 WeakPolarHBondContact CD1-O 3.37Å; I453-V456 HydrophobicContact CG1-CB 4.23Å; I453-V456 WeakPolarHBondContact O-CG2 3.37Å; I453-V456 PolarHBondContact O-N 3.16Å; I453-M458 HydrophobicContact CD1-SD 3.75Å; I453-M461 HydrophobicContact CB-CE 4.25Å; I453-M461 HydrophobicContact CD1-CE 3.35Å; I453-M461 HydrophobicContact CG1-CE 4.35Å; I453-M461 HydrophobicContact CG2-CE 3.58Å
454	G	81	Confident	86.7	Confident	33 Å²	33	38 Å²	38	34%	0.34	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	-123.1	-177.7	0	0	0	0	0	111.3	R450 V456	R450-G454 WeakPolarHBondContact CD-O 3.45Å; R450-G454 PolarHBondContact NE-O 2.75Å; R450-G454 PolarHBondContact NH1-O 2.93Å; R450-G454 PolarHBondContact O-N 3.16Å; R450-G454 VanDerWaalsContact O-N 3.14Å; G454-V456 PolarHBondContact O-N 2.98Å
455	T	79.8	Confident	86.2	Confident	121 Å²	121	38.1 Å²	38.1	74%	0.742	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.2	-173.2	53.8	0	0	0	0	115.3	R450 I453	R450-T455 VanDerWaalsContact NH1-CA 3.35Å; I453-T455 PolarHBondContact O-N 3.18Å
456	V	81.6	Confident	85.7	Confident	28 Å²	28	37.9 Å²	37.9	17%	0.17	21%	0.214	C	C	.	.			trans	-63	137.2	-176.9	176.5	0	0	0	0	111.3	I79 I453 G454	I79-V456 HydrophobicContact CD1-CG1 3.85Å; I79-V456 HydrophobicContact CD1-CG2 4.18Å; I79-V456 HydrophobicContact CG1-CG2 4.37Å; I453-V456 HydrophobicContact CB-CB 4.17Å; I453-V456 HydrophobicContact CD1-CB 4.29Å; I453-V456 WeakPolarHBondContact CD1-O 3.37Å; I453-V456 HydrophobicContact CG1-CB 4.23Å; I453-V456 WeakPolarHBondContact O-CG2 3.37Å; I453-V456 PolarHBondContact O-N 3.16Å; G454-V456 PolarHBondContact O-N 2.98Å
457	S	87.3	Confident	85.1	Confident	50 Å²	50	38.2 Å²	38.2	35%	0.35	22%	0.221	S	C	.	.			trans	-73.5	139.8	176.4	-180	0	0	0	0	111.5	D459 D460 M461	S457-D459 PolarHBondContact O-N 2.9Å; S457-D459 PolarHBondContact OG-N 3.35Å; S457-D459 VanDerWaalsContact OG-N 3.13Å; S457-D460 PolarHBondContact O-N 3.27Å; S457-M461 PolarHBondContact O-N 2.76Å
458	M	90.1	Very high	84.1	Confident	18 Å²	18	38.1 Å²	38.1	9%	0.089	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-31.1	170.2	-67.5	-55.9	-71.9	0	0	111.5	L262 W291 A445 F449 I453 D460 M461 M462	L262-M458 HydrophobicContact CD2-CE 4.02Å; W291-M458 HydrophobicContact CD2-CE 4.28Å; W291-M458 HydrophobicContact CE3-CE 3.82Å; W291-M458 HydrophobicContact CH2-CE 3.45Å; W291-M458 VanDerWaalsContact CH2-CE 3.45Å; W291-M458 HydrophobicContact CH2-CG 3.99Å; W291-M458 HydrophobicContact CH2-SD 4.4Å; W291-M458 HydrophobicContact CZ2-CB 3.92Å; W291-M458 HydrophobicContact CZ2-CE 3.92Å; W291-M458 HydrophobicContact CZ2-CG 3.8Å; W291-M458 HydrophobicContact CZ3-CE 3.39Å; A445-M458 HydrophobicContact CB-CG 3.73Å; A445-M458 HydrophobicContact CB-SD 4.44Å; F449-M458 HydrophobicContact CB-SD 3.95Å; F449-M458 HydrophobicContact CD1-CE 4.33Å; F449-M458 HydrophobicContact CD2-CE 3.79Å; F449-M458 HydrophobicContact CD2-SD 4.23Å; F449-M458 HydrophobicContact CE2-CE 4.03Å; F449-M458 HydrophobicContact CG-CE 3.94Å; F449-M458 HydrophobicContact CG-SD 4.03Å; F449-M458 HydrophobicContact CZ-CE 4.42Å; I453-M458 HydrophobicContact CD1-SD 3.75Å; M458-D460 VanDerWaalsContact C-N 3.34Å; M458-D460 PolarHBondContact O-N 2.99Å; M458-M461 HydrophobicContact CE-CE 4.42Å; M458-M461 HydrophobicContact CE-SD 4.13Å; M458-M461 WeakPolarHBondContact O-CB 3.41Å; M458-M461 PolarHBondContact O-N 3.02Å; M458-M461 HydrophobicContact SD-CE 3.85Å; M458-M461 HydrophobicContact SD-SD 4.31Å; M458-M462 HydrophobicContact CE-CE 3.57Å; M458-M462 VanDerWaalsContact O-CG 3.3Å; M458-M462 WeakPolarHBondContact O-CG 3.19Å; M458-M462 PolarHBondContact O-N 3.11Å
459	D	88.5	Confident	82.6	Confident	70 Å²	70	46.9 Å²	46.9	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-67.7	-34	179.8	-74.8	-25.1	0	0	0	113.4	R288 S457 L463	R288-D459 PolarHBondContact NE-O 3.25Å; R288-D459 IonicContact NE-OD1 3.87Å; R288-D459 PolarHBondContact NH2-O 3.1Å; S457-D459 PolarHBondContact O-N 2.9Å; S457-D459 PolarHBondContact OG-N 3.35Å; S457-D459 VanDerWaalsContact OG-N 3.13Å; D459-L463 PolarHBondContact O-N 3.22Å
460	D	84.3	Confident	80.8	Confident	93 Å²	93	48.9 Å²	48.9	50%	0.497	27%	0.27	S	S	.	.	H	α-helix	trans	-73.6	-39.4	175.3	-64	-27.4	0	0	0	109.8	S457 M458 L463 E464	S457-D460 PolarHBondContact O-N 3.27Å; M458-D460 VanDerWaalsContact C-N 3.34Å; M458-D460 PolarHBondContact O-N 2.99Å; D460-L463 PolarHBondContact O-N 3.41Å; D460-E464 PolarHBondContact O-N 3.15Å
461	M	85.1	Confident	80.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-45.2	174.6	-171.3	-170	-57	0	0	112.1	M83 L262 I453 S457 M458 L463 E464 M465	M83-M461 HydrophobicContact CE-SD 4.5Å; M83-M461 HydrophobicContact SD-CE 4.5Å; M83-M461 HydrophobicContact SD-SD 4.35Å; L262-M461 HydrophobicContact CD2-SD 3.73Å; I453-M461 HydrophobicContact CB-CE 4.25Å; I453-M461 HydrophobicContact CD1-CE 3.35Å; I453-M461 HydrophobicContact CG1-CE 4.35Å; I453-M461 HydrophobicContact CG2-CE 3.58Å; S457-M461 PolarHBondContact O-N 2.76Å; M458-M461 HydrophobicContact CE-CE 4.42Å; M458-M461 HydrophobicContact CE-SD 4.13Å; M458-M461 WeakPolarHBondContact O-CB 3.41Å; M458-M461 PolarHBondContact O-N 3.02Å; M458-M461 HydrophobicContact SD-CE 3.85Å; M458-M461 HydrophobicContact SD-SD 4.31Å; M461-L463 VanDerWaalsContact C-N 3.27Å; M461-L463 PolarHBondContact O-N 2.83Å; M461-E464 PolarHBondContact O-N 3.17Å; M461-M465 HydrophobicContact CG-CG 4.2Å; M461-M465 HydrophobicContact CG-SD 3.79Å; M461-M465 WeakPolarHBondContact O-CB 3.44Å; M461-M465 VanDerWaalsContact O-CG 3.28Å; M461-M465 WeakPolarHBondContact O-CG 3.28Å; M461-M465 PolarHBondContact O-N 3.22Å; M461-M465 HydrophobicContact SD-SD 4.08Å
462	M	91.1	Very high	80.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-41.8	176.9	-67.2	-47.5	127	0	0	111.4	L262 L266 L284 V287 R288 W291 M458 L466	L262-M462 HydrophobicContact CD1-CE 4.1Å; L262-M462 HydrophobicContact CD2-CE 3.98Å; L266-M462 HydrophobicContact CD1-SD 3.87Å; L266-M462 HydrophobicContact CD2-SD 4.32Å; L284-M462 HydrophobicContact CD1-CB 4.41Å; V287-M462 HydrophobicContact CG1-CB 4.05Å; V287-M462 HydrophobicContact CG1-CG 4.04Å; V287-M462 HydrophobicContact CG1-SD 3.86Å; R288-M462 HydrophobicContact CG-CB 4.41Å; W291-M462 HydrophobicContact CB-CE 3.98Å; W291-M462 HydrophobicContact CB-CG 4.38Å; W291-M462 HydrophobicContact CB-SD 3.51Å; W291-M462 VanDerWaalsContact CB-SD 3.51Å; W291-M462 HydrophobicContact CD2-CE 3.67Å; W291-M462 HydrophobicContact CD2-SD 4.37Å; W291-M462 HydrophobicContact CE3-CE 3.94Å; W291-M462 HydrophobicContact CG-CE 3.69Å; W291-M462 HydrophobicContact CG-CG 4.21Å; W291-M462 HydrophobicContact CG-SD 3.74Å; M458-M462 HydrophobicContact CE-CE 3.57Å; M458-M462 VanDerWaalsContact O-CG 3.3Å; M458-M462 WeakPolarHBondContact O-CG 3.19Å; M458-M462 PolarHBondContact O-N 3.11Å; M462-L466 WeakPolarHBondContact O-CB 3.48Å; M462-L466 WeakPolarHBondContact O-CG 3.36Å; M462-L466 PolarHBondContact O-N 3.38Å
463	L	87.1	Confident	80.4	Confident	59 Å²	59	45.3 Å²	45.3	31%	0.309	26%	0.255	S	S	.	.	H	α-helix	trans	-63.3	-48.4	176.7	176.1	61.4	0	0	0	111.4	L284 D459 D460 M461 M465 L466 C467	L284-L463 HydrophobicContact CD1-CB 3.99Å; L284-L463 HydrophobicContact CD1-CD1 4.27Å; L284-L463 HydrophobicContact CD2-CD1 3.94Å; D459-L463 PolarHBondContact O-N 3.22Å; D460-L463 PolarHBondContact O-N 3.41Å; M461-L463 VanDerWaalsContact C-N 3.27Å; M461-L463 PolarHBondContact O-N 2.83Å; L463-M465 PolarHBondContact O-N 3.11Å; L463-L466 PolarHBondContact O-N 3.02Å; L463-C467 PolarHBondContact O-N 3.48Å; L463-C467 VanDerWaalsContact O-N 3.07Å; L463-C467 PolarHBondContact O-SG 2.98Å
464	E	81.3	Confident	80.5	Confident	21 Å²	21	47 Å²	47	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-60.4	-47.8	178.8	-170.2	-177.5	174.1	0	0	111.1	S42 L80 D460 M461 L466 C467 T468	S42-E464 PolarHBondContact OG-OE1 3.47Å; L80-E464 HydrophobicContact CD1-CG 4.17Å; D460-E464 PolarHBondContact O-N 3.15Å; M461-E464 PolarHBondContact O-N 3.17Å; E464-L466 VanDerWaalsContact C-N 3.32Å; E464-L466 PolarHBondContact O-N 3.06Å; E464-C467 PolarHBondContact O-N 3.28Å; E464-T468 HydrophobicContact CG-CG2 4Å; E464-T468 WeakPolarHBondContact O-CB 3.4Å; E464-T468 WeakPolarHBondContact O-CG2 3.27Å; E464-T468 PolarHBondContact O-N 3.15Å; E464-T468 PolarHBondContact O-OG1 3.19Å
465	M	84.4	Confident	80.5	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-32.8	-178.9	-68.9	-179.3	77.3	0	0	112.9	L262 L263 L266 M461 L463 T468 L470	L262-M465 HydrophobicContact CD2-SD 4.16Å; L262-M465 HydrophobicContact CG-CE 4.27Å; L262-M465 HydrophobicContact CG-SD 4.34Å; L263-M465 HydrophobicContact CB-CE 4.24Å; L263-M465 HydrophobicContact CD1-CE 3.99Å; L266-M465 HydrophobicContact CB-CE 4.27Å; L266-M465 HydrophobicContact CD1-CB 3.36Å; L266-M465 HydrophobicContact CD1-CE 3.77Å; L266-M465 HydrophobicContact CD1-CG 4.09Å; L266-M465 HydrophobicContact CD1-SD 3.63Å; L266-M465 HydrophobicContact CG-CE 4.23Å; M461-M465 HydrophobicContact CG-CG 4.2Å; M461-M465 HydrophobicContact CG-SD 3.79Å; M461-M465 WeakPolarHBondContact O-CB 3.44Å; M461-M465 VanDerWaalsContact O-CG 3.28Å; M461-M465 WeakPolarHBondContact O-CG 3.28Å; M461-M465 PolarHBondContact O-N 3.22Å; M461-M465 HydrophobicContact SD-SD 4.08Å; L463-M465 PolarHBondContact O-N 3.11Å; M465-T468 WeakPolarHBondContact CA-OG1 3.33Å; M465-T468 PolarHBondContact O-OG1 2.77Å; M465-L470 HydrophobicContact CB-CD1 4.46Å; M465-L470 WeakPolarHBondContact O-CD1 3.26Å; M465-L470 WeakPolarHBondContact O-CG 3.11Å
466	L	83.9	Confident	80.5	Confident	9 Å²	9	43 Å²	43	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-40.7	173.4	-79.7	176.7	0	0	0	112.4	K270 F275 L284 V287 M462 L463 E464	K270-L466 PolarHBondContact NZ-O 3.38Å; F275-L466 HydrophobicContact CE1-CD2 4.07Å; F275-L466 HydrophobicContact CZ-CD2 4.4Å; L284-L466 HydrophobicContact CB-CD1 4.39Å; L284-L466 HydrophobicContact CD1-CD1 3.96Å; V287-L466 HydrophobicContact CB-CD1 4.03Å; V287-L466 HydrophobicContact CG1-CD1 4.28Å; V287-L466 HydrophobicContact CG2-CD1 4.05Å; V287-L466 HydrophobicContact CG2-CD2 4.22Å; M462-L466 WeakPolarHBondContact O-CB 3.48Å; M462-L466 WeakPolarHBondContact O-CG 3.36Å; M462-L466 PolarHBondContact O-N 3.38Å; L463-L466 PolarHBondContact O-N 3.02Å; E464-L466 VanDerWaalsContact C-N 3.32Å; E464-L466 PolarHBondContact O-N 3.06Å
467	C	78.5	Confident	80.5	Confident	59 Å²	59	44.1 Å²	44.1	40%	0.399	23%	0.232	S	C	.	.	H	α-helix	trans	-76	-32.6	-177.4	-63.2	0	0	0	0	112.8	L463 E464	L463-C467 PolarHBondContact O-N 3.48Å; L463-C467 VanDerWaalsContact O-N 3.07Å; L463-C467 PolarHBondContact O-SG 2.98Å; E464-C467 PolarHBondContact O-N 3.28Å
468	T	74.1	Confident	79.9	Confident	6 Å²	6	43.6 Å²	43.6	4%	0.037	22%	0.223	C	C	.	.	S	Bend	trans	-77.1	140.6	-176.4	51	0	0	0	0	112.2	L80 K270 E464 M465 L470	L80-T468 HydrophobicContact CD1-CG2 3.88Å; L80-T468 WeakPolarHBondContact CD1-OG1 3.26Å; K270-T468 PolarHBondContact NZ-O 2.7Å; E464-T468 HydrophobicContact CG-CG2 4Å; E464-T468 WeakPolarHBondContact O-CB 3.4Å; E464-T468 WeakPolarHBondContact O-CG2 3.27Å; E464-T468 PolarHBondContact O-N 3.15Å; E464-T468 PolarHBondContact O-OG1 3.19Å; M465-T468 WeakPolarHBondContact CA-OG1 3.33Å; M465-T468 PolarHBondContact O-OG1 2.77Å; T468-L470 PolarHBondContact O-N 3.03Å
469	K	59.6	Low	79.1	Confident	183 Å²	183	45.8 Å²	45.8	80%	0.796	23%	0.234	S	C	*	.			trans	-69.5	104.1	171.2	-68.4	179.1	-177.9	169.4	0	107.5
470	L	51	Low	78.2	Confident	44 Å²	44	43.5 Å²	43.5	23%	0.23	22%	0.222	C	C	.	.			trans	-86.7	0	-177.5	-64.1	177.8	0	0	0	113.4	L80 L263 L266 R267 Y271 M465 T468	L80-L470 HydrophobicContact CD2-CD2 4.49Å; L263-L470 HydrophobicContact CD1-CB 4.21Å; L263-L470 HydrophobicContact CD1-CD1 3.96Å; L263-L470 HydrophobicContact CD1-CD2 3.61Å; L263-L470 HydrophobicContact CD1-CG 4.13Å; L266-L470 HydrophobicContact CB-CD1 4.16Å; R267-L470 PolarHBondContact NH2-OXT 2.67Å; Y271-L470 PolarHBondContact OH-O 3.16Å; M465-L470 HydrophobicContact CB-CD1 4.46Å; M465-L470 WeakPolarHBondContact O-CD1 3.26Å; M465-L470 WeakPolarHBondContact O-CG 3.11Å; T468-L470 PolarHBondContact O-N 3.03Å

Retrieved 470 of 470 residues in 105.6 ms (Link to these results)

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