A0A087X7L0_POEFO Loading...

Exocyst complex component Sec8

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087X7L0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 984 aa.

						>A0A087X7L0_POEFO|A0A087X7L0
MAAETGKYRSAVSKNKDPSGLLISVIRTLSSSDDVQDRETEKGRLEEAFETCDRDLDKLIVQHYAELTTAIRTYQSITERITSSRNKIKQVKENLLSCKMLLHCKRDELRKLWIEGIEHKHVLQLLDEIESIKQVPQRLETYMASKHYLHATDMLVTAVKSLEGPLFQVEGLGDLRLELKNKKLNIHLVLIDELHRHLYIKSTSRLGHKNKDKNASRLPGSLTKDISPMPVLEVSGLSTPRKLLDSSQFSTPGSSSVRELQQDIRDPSQADLSEVDPEENSAEFMGILIKALAKLKKLPDTTKAIMERLEPELKQIVKRSTTQIADHAYQRGENLAQESQPRLLLELLELLFDKFKAVAQAHSVVLAHMQQIAAHAPGVTHEEEIKLYEQADVSAKIQAVLQVLLMEYLDVKNSRSSTEQSAQLSYASTGSEFAAFFAKKKPQRAKQSLFKFESSSHAISMSAYLREQRRELYSKSGELQGGADDNLIEGGEMKFVCKPGARNITVIFQPLLRFIQEIEMNMGPSQAKQCQLRTFLTYYINDLFLNQVRTEINKEIEAVSKAADPLKILASADTMKLLGVQRPLLQSTVVVEKSIQDLMSLMQDLSAYSNQFLEMVCDKLKEYKEICNTAYRGIVQCEEKLTISASWAKDEDISRLLQSLPNWTNMAQPRQTRQKREDEEDFTRAAFAKESEVLTGNLGDKLIPQNEILRDVSDLKALANLQESMEWLAGRLRSFFTNLPQMSSACPSTADSQVLGESERSREQILQTLSDLSRGFQDIADRCLLVLHLEVRVHCFHYLIPLTKQGNYAIVANVESMDYDPLVVKLNKDISAIEEAMGAALQQHKFQYIFEAGLGHLISCILINGAQYFKRISESGIKKMCRNIFVLQQNLTNITMSREADLDFARQYYEMLYNTPDELLNLVVDQGVRYTELEYINALSLLHRSQTGVGDMSTQNVRLQRLKEIICEQAAIKQATKDKKITTV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	35.7	Very low	245 Å²	245	153.8 Å²	153.8	100%	1.207	86%	0.86	S	S	*	*				0	156.1	0	-73.1	176.6	172.2	0	0	108.2
2	A	32.1	Very low	36.2	Very low	105 Å²	105	152.3 Å²	152.3	87%	0.868	86%	0.857	S	S	*	*			trans	-19.6	151.4	-180	0	0	0	0	0	119
3	A	35.9	Very low	35.7	Very low	90 Å²	90	149.8 Å²	149.8	74%	0.744	86%	0.856	S	S	*	*			cis	-155.2	169.8	-9.9	0	0	0	0	0	105.8
4	E	36.1	Very low	36.1	Very low	168 Å²	168	152.1 Å²	152.1	79%	0.785	85%	0.851	S	S	*	*			cis	-160	138.8	44	-82.7	-172.8	117	0	0	108.7
5	T	42	Very low	35.9	Very low	136 Å²	136	152.1 Å²	152.1	83%	0.834	85%	0.849	S	S	*	*				55.4	142.6	108.3	84.1	0	0	0	0	117.5
6	G	30.1	Very low	36	Very low	76 Å²	76	154.6 Å²	154.6	78%	0.784	85%	0.848	S	S	*	*			cis	-155.4	-157.9	15.1	0	0	0	0	0	116.5
7	K	39.9	Very low	36.2	Very low	200 Å²	200	153.7 Å²	153.7	87%	0.87	84%	0.842	S	S	*	*			trans	-110.4	173.6	-162	-57.9	166.5	177.3	170.4	0	112.2
8	Y	30.8	Very low	37.2	Very low	231 Å²	231	151.2 Å²	151.2	91%	0.906	83%	0.834	S	S	*	*				-146.5	-135.2	117.6	-125.2	-81.8	0	0	0	114.2
9	R	37	Very low	37.8	Very low	231 Å²	231	147.2 Å²	147.2	87%	0.872	82%	0.818	S	S	*	*			trans	-157.8	174.7	-156.9	-143.7	173.2	-174.3	179.9	2.1	114.5
10	S	44.5	Very low	38.7	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	81%	0.806	S	S	*	*			trans	-100.4	173.4	-178	62.7	0	0	0	0	114.9
11	A	30.9	Very low	39.6	Very low	100 Å²	100	141.3 Å²	141.3	83%	0.826	80%	0.796	S	S	*	*			trans	-151.1	165.4	160.3	0	0	0	0	0	111.2
12	V	41.7	Very low	40.8	Very low	135 Å²	135	135.5 Å²	135.5	82%	0.818	77%	0.769	S	S	*	*			trans	-134.8	152	-165.9	170	0	0	0	0	111.1
13	S	29.7	Very low	42.1	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	75%	0.754	S	S	*	*			trans	-152.9	161.4	153.7	-163.9	0	0	0	0	112.9
14	K	41	Very low	43.2	Very low	182 Å²	182	134.3 Å²	134.3	79%	0.791	74%	0.74	S	S	*	*			trans	-112.8	151.6	-171.9	-59.2	174.2	175.7	-179.8	0	112
15	N	33.3	Very low	44.4	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	71%	0.708	S	S	*	*				-176.2	147	121.1	-104.3	-30	0	0	0	117.1
16	K	38.8	Very low	45.2	Very low	192 Å²	192	125.7 Å²	125.7	84%	0.835	69%	0.694	S	S	*	*			trans	62.9	102.6	157.4	-69.6	-174.6	174.8	-177.6	0	120.4
17	D	38.7	Very low	46.7	Very low	139 Å²	139	129.9 Å²	129.9	74%	0.743	69%	0.686	S	S	*	*			trans	-73.1	144.7	164.5	-65.5	-70.8	0	0	0	113.8	S19	D17-S19 VanDerWaalsContact C-N 3.31Å; D17-S19 WeakPolarHBondContact CB-OG 3.42Å
18	P	53.8	Low	47.4	Very low	109 Å²	109	123.8 Å²	123.8	71%	0.708	67%	0.665	S	S	*	*	S	Bend	trans	-80.9	-4.7	170.6	33.3	-35.5	0	0	0	114.1	G20 L21	P18-G20 PolarHBondContact O-N 3.49Å; P18-G20 VanDerWaalsContact O-N 3.17Å; P18-L21 PolarHBondContact O-N 2.9Å
19	S	49.3	Very low	48.7	Very low	75 Å²	75	115.6 Å²	115.6	52%	0.524	64%	0.637	S	S	.	*	H	α-helix	trans	-62.5	-24.1	-170.9	54.1	0	0	0	0	114.9	D17	D17-S19 VanDerWaalsContact C-N 3.31Å; D17-S19 WeakPolarHBondContact CB-OG 3.42Å
20	G	55.2	Low	49.8	Very low	56 Å²	56	109.7 Å²	109.7	58%	0.577	63%	0.631	S	S	*	*	H	α-helix	trans	-68.7	-29.8	177.1	0	0	0	0	0	114.4	P18	P18-G20 PolarHBondContact O-N 3.49Å; P18-G20 VanDerWaalsContact O-N 3.17Å
21	L	57.2	Low	50.2	Low	115 Å²	115	109.3 Å²	109.3	60%	0.602	63%	0.629	S	S	*	*	H	α-helix	trans	-70.7	-45	-178.1	-132.3	82.3	0	0	0	111.2	P18 I23 S24 V25	P18-L21 PolarHBondContact O-N 2.9Å; L21-I23 VanDerWaalsContact C-N 3.34Å; L21-I23 PolarHBondContact O-N 3.05Å; L21-S24 WeakPolarHBondContact O-CB 3.44Å; L21-S24 PolarHBondContact O-N 3.13Å; L21-S24 VanDerWaalsContact O-N 3.15Å; L21-V25 PolarHBondContact O-N 2.84Å
22	L	58.2	Low	51.2	Low	123 Å²	123	106.7 Å²	106.7	64%	0.644	60%	0.604	S	S	*	*	H	α-helix	trans	-61.6	-40.7	-174.4	-137.7	94.3	0	0	0	112.4	S24 V25 I26	L22-S24 VanDerWaalsContact C-N 3.28Å; L22-S24 PolarHBondContact O-N 2.79Å; L22-V25 PolarHBondContact O-N 2.77Å; L22-I26 HydrophobicContact CD2-CD1 4.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.32Å; L22-I26 PolarHBondContact O-N 3.32Å
23	I	60.2	Low	51.7	Low	105 Å²	105	108.8 Å²	108.8	54%	0.538	61%	0.611	S	S	.	*	H	α-helix	trans	-70.6	-24.9	-179.1	-67.7	-178.4	0	0	0	112	L21	L21-I23 VanDerWaalsContact C-N 3.34Å; L21-I23 PolarHBondContact O-N 3.05Å
24	S	59.2	Low	52.8	Low	65 Å²	65	107.5 Å²	107.5	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-71.1	-47.7	171	-162.4	0	0	0	0	111.1	L21 L22 I26 R27 T28	L21-S24 WeakPolarHBondContact O-CB 3.44Å; L21-S24 PolarHBondContact O-N 3.13Å; L21-S24 VanDerWaalsContact O-N 3.15Å; L22-S24 VanDerWaalsContact C-N 3.28Å; L22-S24 PolarHBondContact O-N 2.79Å; S24-I26 PolarHBondContact O-N 3.3Å; S24-R27 PolarHBondContact O-N 2.81Å; S24-T28 PolarHBondContact O-N 3.19Å; S24-T28 PolarHBondContact O-OG1 3.44Å
25	V	60.4	Low	53.8	Low	20 Å²	20	104.1 Å²	104.1	12%	0.121	59%	0.589	C	S	.	*	H	α-helix	trans	-61.7	-44.4	-178.3	173.9	0	0	0	0	111.7	L21 L22 R27 T28 L29 L45	L21-V25 PolarHBondContact O-N 2.84Å; L22-V25 PolarHBondContact O-N 2.77Å; V25-R27 PolarHBondContact O-N 3.36Å; V25-T28 PolarHBondContact O-N 2.96Å; V25-L29 HydrophobicContact CG1-CD1 3.66Å; V25-L29 HydrophobicContact CG1-CG 4.26Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.27Å; V25-L29 WeakPolarHBondContact O-CG 3.45Å; V25-L29 PolarHBondContact O-N 3.47Å; V25-L29 VanDerWaalsContact O-N 3.12Å; V25-L45 HydrophobicContact CG1-CD1 3.96Å; V25-L45 HydrophobicContact CG2-CD1 4.14Å
26	I	60.4	Low	55.3	Low	102 Å²	102	103.5 Å²	103.5	52%	0.523	58%	0.581	S	S	.	*	H	α-helix	trans	-60.6	-34.2	177.8	-67.4	165.6	0	0	0	111.9	L22 S24	L22-I26 HydrophobicContact CD2-CD1 4.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.32Å; L22-I26 PolarHBondContact O-N 3.32Å; S24-I26 PolarHBondContact O-N 3.3Å
27	R	59.8	Low	56.3	Low	164 Å²	164	98.4 Å²	98.4	62%	0.619	56%	0.563	S	S	*	*	H	α-helix	trans	-71.4	-44.5	-179.1	-163.8	-179.1	-61.6	119.4	1.8	111.7	S24 V25 S30 S31	S24-R27 PolarHBondContact O-N 2.81Å; V25-R27 PolarHBondContact O-N 3.36Å; R27-S30 PolarHBondContact O-N 3.11Å; R27-S31 PolarHBondContact O-OG 3.44Å
28	T	56	Low	57.4	Low	72 Å²	72	98.4 Å²	98.4	44%	0.442	55%	0.553	S	S	.	*	H	α-helix	trans	-66.8	-40.6	179.5	-43	0	0	0	0	112	S24 V25 S30 S31	S24-T28 PolarHBondContact O-N 3.19Å; S24-T28 PolarHBondContact O-OG1 3.44Å; V25-T28 PolarHBondContact O-N 2.96Å; T28-S30 PolarHBondContact O-N 3.41Å; T28-S30 VanDerWaalsContact O-N 3.08Å; T28-S31 PolarHBondContact O-N 2.79Å
29	L	57.9	Low	57.9	Low	59 Å²	59	98.6 Å²	98.6	31%	0.309	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-8	179.7	-71.2	173.8	0	0	0	115.2	V25 R38	V25-L29 HydrophobicContact CG1-CD1 3.66Å; V25-L29 HydrophobicContact CG1-CG 4.26Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.27Å; V25-L29 WeakPolarHBondContact O-CG 3.45Å; V25-L29 PolarHBondContact O-N 3.47Å; V25-L29 VanDerWaalsContact O-N 3.12Å; L29-R38 HydrophobicContact CD2-CG 3.55Å; L29-R38 PolarHBondContact O-NH1 3.03Å
30	S	58.8	Low	58.9	Low	107 Å²	107	99.3 Å²	99.3	75%	0.748	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	2.1	-173.8	-164.8	0	0	0	0	114.2	R27 T28	R27-S30 PolarHBondContact O-N 3.11Å; T28-S30 PolarHBondContact O-N 3.41Å; T28-S30 VanDerWaalsContact O-N 3.08Å
31	S	54.7	Low	59.2	Low	103 Å²	103	98.8 Å²	98.8	72%	0.72	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	8.4	-180	72.1	0	0	0	0	115.1	R27 T28	R27-S31 PolarHBondContact O-OG 3.44Å; T28-S31 PolarHBondContact O-N 2.79Å
32	S	50.6	Low	59.8	Low	45 Å²	45	97.9 Å²	97.9	32%	0.315	52%	0.519	S	S	.	.			trans	-108.8	122.4	166.4	-168.2	0	0	0	0	108.7	D34 D37	S32-D34 PolarHBondContact OG-N 3.09Å; S32-D37 PolarHBondContact OG-OD2 3.44Å
33	D	51.7	Low	60.4	Low	178 Å²	178	93.5 Å²	93.5	95%	0.952	50%	0.503	S	S	*	.			trans	-79.8	-0.4	172.5	-96.7	-31.3	0	0	0	112.1
34	D	53.2	Low	61.1	Low	93 Å²	93	94 Å²	94	50%	0.497	50%	0.498	S	S	.	.			trans	-90.3	120.9	178.3	-156.4	-27.7	0	0	0	111.4	S32 Q36 D37	S32-D34 PolarHBondContact OG-N 3.09Å; D34-Q36 PolarHBondContact O-N 3.44Å; D34-Q36 WeakPolarHBondContact OD1-CB 3.24Å; D34-Q36 PolarHBondContact OD1-N 2.82Å; D34-D37 PolarHBondContact O-N 3.28Å
35	V	62	Low	61.5	Low	111 Å²	111	94.7 Å²	94.7	67%	0.673	50%	0.497	S	S	*	.	H	α-helix	trans	-63.5	-27.2	176.7	177.9	0	0	0	0	110.9	R38	V35-R38 PolarHBondContact O-N 2.99Å
36	Q	64.6	Low	62.2	Low	141 Å²	141	98.8 Å²	98.8	66%	0.659	52%	0.515	S	S	*	.	H	α-helix	trans	-67.7	-39.7	-176.7	-156.6	70.4	13.5	0	0	112.6	D34 R38 T40	D34-Q36 PolarHBondContact O-N 3.44Å; D34-Q36 WeakPolarHBondContact OD1-CB 3.24Å; D34-Q36 PolarHBondContact OD1-N 2.82Å; Q36-R38 VanDerWaalsContact C-N 3.26Å; Q36-R38 PolarHBondContact O-N 2.76Å; Q36-T40 PolarHBondContact O-N 3.33Å; Q36-T40 PolarHBondContact O-OG1 3.09Å; Q36-T40 VanDerWaalsContact O-OG1 3.12Å
37	D	60	Low	63	Low	84 Å²	84	100.3 Å²	100.3	45%	0.449	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-33.5	177.9	-80.6	-19.8	0	0	0	112.2	S32 D34 T40 E41	S32-D37 PolarHBondContact OG-OD2 3.44Å; D34-D37 PolarHBondContact O-N 3.28Å; D37-T40 VanDerWaalsContact C-OG1 3.32Å; D37-T40 WeakPolarHBondContact CA-OG1 3.21Å; D37-T40 PolarHBondContact O-OG1 2.9Å; D37-E41 PolarHBondContact O-N 3.12Å
38	R	61.4	Low	63.6	Low	140 Å²	140	95 Å²	95	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-70.2	-37.4	-173.2	-154.8	-174.4	176.1	96.2	2.4	112.2	L29 V35 Q36 K42	L29-R38 HydrophobicContact CD2-CG 3.55Å; L29-R38 PolarHBondContact O-NH1 3.03Å; V35-R38 PolarHBondContact O-N 2.99Å; Q36-R38 VanDerWaalsContact C-N 3.26Å; Q36-R38 PolarHBondContact O-N 2.76Å; R38-K42 PolarHBondContact O-N 3.11Å
39	E	65.3	Low	64.6	Low	112 Å²	112	98.6 Å²	98.6	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-79.4	-33.2	-179.8	-146.8	66.3	-143.9	0	0	111.6	K42 G43	E39-K42 PolarHBondContact O-N 2.88Å; E39-K42 IonicContact OE1-NZ 3.42Å; E39-K42 PolarHBondContact OE1-NZ 2.97Å; E39-G43 PolarHBondContact O-N 3.13Å
40	T	69.9	Low	65.6	Low	91 Å²	91	102.6 Å²	102.6	56%	0.558	54%	0.538	S	S	*	.	H	α-helix	trans	-64.5	-43.4	174.4	33.9	0	0	0	0	113.5	Q36 D37 K42 G43 R44	Q36-T40 PolarHBondContact O-N 3.33Å; Q36-T40 PolarHBondContact O-OG1 3.09Å; Q36-T40 VanDerWaalsContact O-OG1 3.12Å; D37-T40 VanDerWaalsContact C-OG1 3.32Å; D37-T40 WeakPolarHBondContact CA-OG1 3.21Å; D37-T40 PolarHBondContact O-OG1 2.9Å; T40-K42 VanDerWaalsContact C-N 3.33Å; T40-K42 PolarHBondContact O-N 3.29Å; T40-G43 PolarHBondContact O-N 3.03Å; T40-R44 PolarHBondContact O-N 3.4Å
41	E	62.6	Low	66.4	Low	44 Å²	44	100.1 Å²	100.1	21%	0.206	52%	0.518	C	S	.	.	H	α-helix	trans	-74.2	-26.1	-179.1	-173.4	62.7	-178.7	0	0	112.3	D37 R44 L45	D37-E41 PolarHBondContact O-N 3.12Å; E41-R44 IonicContact OE1-CZ 2.76Å; E41-R44 IonicContact OE1-NE 3.32Å; E41-R44 PolarHBondContact OE1-NE 2.98Å; E41-R44 IonicContact OE1-NH2 3.67Å; E41-R44 PolarHBondContact OE1-NH2 3.04Å; E41-R44 IonicContact OE2-CZ 3.57Å; E41-R44 IonicContact OE2-NE 2.77Å; E41-R44 PolarHBondContact OE2-NE 3.32Å; E41-R44 IonicContact OE2-NH2 3.85Å; E41-L45 PolarHBondContact O-N 3.33Å
42	K	68.6	Low	67.5	Low	96 Å²	96	99.5 Å²	99.5	42%	0.417	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-49.7	167.4	174	179.3	162	-112.9	0	111.3	R38 E39 T40 R44 L45 E46	R38-K42 PolarHBondContact O-N 3.11Å; E39-K42 PolarHBondContact O-N 2.88Å; E39-K42 IonicContact OE1-NZ 3.42Å; E39-K42 PolarHBondContact OE1-NZ 2.97Å; T40-K42 VanDerWaalsContact C-N 3.33Å; T40-K42 PolarHBondContact O-N 3.29Å; K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 3.48Å; K42-L45 WeakPolarHBondContact O-CB 3.29Å; K42-L45 PolarHBondContact O-N 3.05Å; K42-E46 VanDerWaalsContact CE-OE1 3.27Å; K42-E46 WeakPolarHBondContact CE-OE1 3.27Å; K42-E46 IonicContact NZ-OE1 2.68Å; K42-E46 PolarHBondContact O-N 3.34Å
43	G	71.8	Confident	68.8	Low	31 Å²	31	101.3 Å²	101.3	32%	0.32	52%	0.519	S	S	.	.	H	α-helix	trans	-58.3	-39.9	177	0	0	0	0	0	112.9	E39 T40 L45 E46 E47	E39-G43 PolarHBondContact O-N 3.13Å; T40-G43 PolarHBondContact O-N 3.03Å; G43-L45 VanDerWaalsContact C-N 3.26Å; G43-L45 PolarHBondContact O-N 3.22Å; G43-E46 PolarHBondContact O-N 3.05Å; G43-E47 WeakPolarHBondContact O-CB 3.47Å; G43-E47 PolarHBondContact O-N 3.32Å
44	R	74.2	Confident	70	Confident	115 Å²	115	99.6 Å²	99.6	43%	0.434	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-29.9	175.5	-159.9	-174.6	69.5	72.6	1.5	113.4	T40 E41 K42 A48	T40-R44 PolarHBondContact O-N 3.4Å; E41-R44 IonicContact OE1-CZ 2.76Å; E41-R44 IonicContact OE1-NE 3.32Å; E41-R44 PolarHBondContact OE1-NE 2.98Å; E41-R44 IonicContact OE1-NH2 3.67Å; E41-R44 PolarHBondContact OE1-NH2 3.04Å; E41-R44 IonicContact OE2-CZ 3.57Å; E41-R44 IonicContact OE2-NE 2.77Å; E41-R44 PolarHBondContact OE2-NE 3.32Å; E41-R44 IonicContact OE2-NH2 3.85Å; K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 3.48Å; R44-A48 VanDerWaalsContact O-CB 3.32Å; R44-A48 WeakPolarHBondContact O-CB 3.34Å; R44-A48 PolarHBondContact O-N 3.06Å
45	L	68.1	Low	71.1	Confident	80 Å²	80	98.7 Å²	98.7	42%	0.419	49%	0.494	S	S	.	.	H	α-helix	trans	-77.7	-39.8	177.1	-111.1	159	0	0	0	112	V25 E41 K42 G43 A48 F49	V25-L45 HydrophobicContact CG1-CD1 3.96Å; V25-L45 HydrophobicContact CG2-CD1 4.14Å; E41-L45 PolarHBondContact O-N 3.33Å; K42-L45 WeakPolarHBondContact O-CB 3.29Å; K42-L45 PolarHBondContact O-N 3.05Å; G43-L45 VanDerWaalsContact C-N 3.26Å; G43-L45 PolarHBondContact O-N 3.22Å; L45-A48 PolarHBondContact O-N 3.03Å; L45-F49 PolarHBondContact O-N 3.27Å
46	E	75	Confident	71.7	Confident	107 Å²	107	97.9 Å²	97.9	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-47	174.5	-69.8	169.4	171.9	0	0	110.6	K42 G43 A48 F49 E50	K42-E46 VanDerWaalsContact CE-OE1 3.27Å; K42-E46 WeakPolarHBondContact CE-OE1 3.27Å; K42-E46 IonicContact NZ-OE1 2.68Å; K42-E46 PolarHBondContact O-N 3.34Å; G43-E46 PolarHBondContact O-N 3.05Å; E46-A48 PolarHBondContact O-N 3.49Å; E46-F49 PolarHBondContact O-N 3.49Å; E46-F49 VanDerWaalsContact O-N 3.13Å; E46-E50 PolarHBondContact O-N 3.46Å
47	E	76.1	Confident	72.3	Confident	133 Å²	133	95.7 Å²	95.7	62%	0.621	48%	0.478	S	S	*	.	H	α-helix	trans	-63.8	-35.8	177.1	-170.7	178.8	-144.1	0	0	113.1	G43 T51	G43-E47 WeakPolarHBondContact O-CB 3.47Å; G43-E47 PolarHBondContact O-N 3.32Å; E47-T51 WeakPolarHBondContact O-CB 3.45Å; E47-T51 PolarHBondContact O-N 3.28Å; E47-T51 PolarHBondContact O-OG1 3.12Å
48	A	74.1	Confident	73.1	Confident	52 Å²	52	97.2 Å²	97.2	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-69.2	-35.1	174	0	0	0	0	0	112.4	R44 L45 E46 C52	R44-A48 VanDerWaalsContact O-CB 3.32Å; R44-A48 WeakPolarHBondContact O-CB 3.34Å; R44-A48 PolarHBondContact O-N 3.06Å; L45-A48 PolarHBondContact O-N 3.03Å; E46-A48 PolarHBondContact O-N 3.49Å; A48-C52 WeakPolarHBondContact O-CB 3.47Å; A48-C52 PolarHBondContact O-N 3.49Å; A48-C52 VanDerWaalsContact O-N 3.11Å
49	F	76.9	Confident	73.7	Confident	149 Å²	149	95.6 Å²	95.6	65%	0.654	48%	0.482	S	S	*	.	H	α-helix	trans	-69.2	-49.1	176.3	-160.1	-82.5	0	0	0	110.9	L45 E46 T51 C52 D53	L45-F49 PolarHBondContact O-N 3.27Å; E46-F49 PolarHBondContact O-N 3.49Å; E46-F49 VanDerWaalsContact O-N 3.13Å; F49-T51 VanDerWaalsContact C-N 3.25Å; F49-T51 PolarHBondContact O-N 2.88Å; F49-C52 PolarHBondContact O-N 3.38Å; F49-C52 VanDerWaalsContact O-N 3.12Å; F49-D53 WeakPolarHBondContact O-CB 3.18Å; F49-D53 PolarHBondContact O-N 3.36Å
50	E	77.1	Confident	74.1	Confident	143 Å²	143	93.5 Å²	93.5	67%	0.668	47%	0.474	S	S	*	.	H	α-helix	trans	-57.2	-38	174.5	-73.8	-166.5	150.9	0	0	112.5	E46 R54	E46-E50 PolarHBondContact O-N 3.46Å; E50-R54 WeakPolarHBondContact O-CB 3.46Å; E50-R54 PolarHBondContact O-N 2.97Å
51	T	77.1	Confident	74.4	Confident	54 Å²	54	94.6 Å²	94.6	33%	0.331	48%	0.48	S	S	.	.	H	α-helix	trans	-66	-42.7	177	-63	0	0	0	0	111.8	E47 F49 D55	E47-T51 WeakPolarHBondContact O-CB 3.45Å; E47-T51 PolarHBondContact O-N 3.28Å; E47-T51 PolarHBondContact O-OG1 3.12Å; F49-T51 VanDerWaalsContact C-N 3.25Å; F49-T51 PolarHBondContact O-N 2.88Å; T51-D55 PolarHBondContact O-N 2.69Å; T51-D55 VanDerWaalsContact O-N 3.09Å
52	C	76.6	Confident	74.9	Confident	90 Å²	90	99.5 Å²	99.5	61%	0.608	50%	0.503	S	S	*	.	H	α-helix	trans	-68.4	-41.7	179.2	-157.5	0	0	0	0	111.8	A48 F49 D55 L56	A48-C52 WeakPolarHBondContact O-CB 3.47Å; A48-C52 PolarHBondContact O-N 3.49Å; A48-C52 VanDerWaalsContact O-N 3.11Å; F49-C52 PolarHBondContact O-N 3.38Å; F49-C52 VanDerWaalsContact O-N 3.12Å; C52-D55 PolarHBondContact O-N 2.81Å; C52-L56 WeakPolarHBondContact O-CB 3.38Å; C52-L56 PolarHBondContact O-N 3.47Å
53	D	78.1	Confident	75.1	Confident	83 Å²	83	99.1 Å²	99.1	44%	0.444	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-42.1	178.2	-151.3	41	0	0	0	110.8	F49 D55 L56 D57	F49-D53 WeakPolarHBondContact O-CB 3.18Å; F49-D53 PolarHBondContact O-N 3.36Å; D53-D55 PolarHBondContact O-N 3.5Å; D53-L56 WeakPolarHBondContact O-CB 3.38Å; D53-L56 PolarHBondContact O-N 3.3Å; D53-D57 WeakPolarHBondContact O-CB 3.34Å; D53-D57 PolarHBondContact O-N 3.27Å
54	R	77.5	Confident	75.3	Confident	142 Å²	142	104.9 Å²	104.9	54%	0.536	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-34.4	174.8	-175	-178.7	64.3	-155.7	-8.1	113.8	E50 K58	E50-R54 WeakPolarHBondContact O-CB 3.46Å; E50-R54 PolarHBondContact O-N 2.97Å; R54-K58 WeakPolarHBondContact O-CG 3.44Å; R54-K58 PolarHBondContact O-N 2.78Å; R54-K58 VanDerWaalsContact O-N 3.09Å
55	D	76.3	Confident	75.3	Confident	74 Å²	74	102.7 Å²	102.7	40%	0.396	52%	0.523	S	S	.	.	H	α-helix	trans	-78.1	-32.2	175.3	-78.6	-11.9	0	0	0	111.8	T51 C52 D53 K58 L59	T51-D55 PolarHBondContact O-N 2.69Å; T51-D55 VanDerWaalsContact O-N 3.09Å; C52-D55 PolarHBondContact O-N 2.81Å; D53-D55 PolarHBondContact O-N 3.5Å; D55-K58 PolarHBondContact O-N 2.69Å; D55-K58 IonicContact OD1-NZ 3.52Å; D55-L59 PolarHBondContact O-N 3.47Å
56	L	73.7	Confident	75.6	Confident	95 Å²	95	105.1 Å²	105.1	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-46.3	168.9	-179.5	64.9	0	0	0	111.1	C52 D53 K58 L59 I60	C52-L56 WeakPolarHBondContact O-CB 3.38Å; C52-L56 PolarHBondContact O-N 3.47Å; D53-L56 WeakPolarHBondContact O-CB 3.38Å; D53-L56 PolarHBondContact O-N 3.3Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 3.16Å; L56-L59 PolarHBondContact O-N 3.1Å; L56-L59 VanDerWaalsContact O-N 3.11Å; L56-I60 HydrophobicContact CD1-CD1 4.06Å; L56-I60 HydrophobicContact CD1-CG1 4.27Å; L56-I60 HydrophobicContact CD2-CD1 4.38Å; L56-I60 HydrophobicContact CG-CD1 3.8Å; L56-I60 HydrophobicContact CG-CG1 4.38Å; L56-I60 WeakPolarHBondContact O-CB 3.32Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 2.72Å
57	D	77.6	Confident	75.7	Confident	95 Å²	95	104.9 Å²	104.9	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-60.1	-41.7	175.2	-106.4	-5.9	0	0	0	111.5	D53 L59 I60 V61	D53-D57 WeakPolarHBondContact O-CB 3.34Å; D53-D57 PolarHBondContact O-N 3.27Å; D57-L59 VanDerWaalsContact C-N 3.35Å; D57-L59 PolarHBondContact O-N 2.92Å; D57-I60 PolarHBondContact O-N 3.28Å; D57-V61 VanDerWaalsContact O-CB 3.29Å; D57-V61 WeakPolarHBondContact O-CB 3.41Å; D57-V61 WeakPolarHBondContact O-CG2 3.45Å; D57-V61 PolarHBondContact O-N 3.36Å
58	K	76.4	Confident	75.8	Confident	116 Å²	116	100.4 Å²	100.4	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-43.1	171.9	-80.9	175.3	-175.6	163.9	0	112.6	R54 D55 L56 V61 Q62	R54-K58 WeakPolarHBondContact O-CG 3.44Å; R54-K58 PolarHBondContact O-N 2.78Å; R54-K58 VanDerWaalsContact O-N 3.09Å; D55-K58 PolarHBondContact O-N 2.69Å; D55-K58 IonicContact OD1-NZ 3.52Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 3.16Å; K58-V61 PolarHBondContact O-N 3.13Å; K58-Q62 WeakPolarHBondContact O-CB 3.27Å; K58-Q62 VanDerWaalsContact O-CG 3.32Å; K58-Q62 WeakPolarHBondContact O-CG 3.27Å; K58-Q62 PolarHBondContact O-N 3.33Å
59	L	74.1	Confident	76.1	Confident	105 Å²	105	101.6 Å²	101.6	55%	0.55	52%	0.517	S	S	.	.	H	α-helix	trans	-69.4	-40.2	179.2	-114.3	123.2	0	0	0	112.1	D55 L56 D57 Q62 H63	D55-L59 PolarHBondContact O-N 3.47Å; L56-L59 PolarHBondContact O-N 3.1Å; L56-L59 VanDerWaalsContact O-N 3.11Å; D57-L59 VanDerWaalsContact C-N 3.35Å; D57-L59 PolarHBondContact O-N 2.92Å; L59-Q62 PolarHBondContact O-N 3.12Å; L59-H63 PolarHBondContact O-N 3.08Å
60	I	73.6	Confident	76.1	Confident	69 Å²	69	97.1 Å²	97.1	35%	0.354	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-44.7	174.1	-71.3	173.6	0	0	0	109.8	L56 D57 Q62 H63 Y64	L56-I60 HydrophobicContact CD1-CD1 4.06Å; L56-I60 HydrophobicContact CD1-CG1 4.27Å; L56-I60 HydrophobicContact CD2-CD1 4.38Å; L56-I60 HydrophobicContact CG-CD1 3.8Å; L56-I60 HydrophobicContact CG-CG1 4.38Å; L56-I60 WeakPolarHBondContact O-CB 3.32Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 2.72Å; D57-I60 PolarHBondContact O-N 3.28Å; I60-Q62 VanDerWaalsContact C-N 3.34Å; I60-Q62 PolarHBondContact O-N 2.87Å; I60-H63 CarbonylContact O-C 3.56Å; I60-H63 PolarHBondContact O-N 3.48Å; I60-Y64 HydrophobicContact CG2-CD2 4.05Å; I60-Y64 VanDerWaalsContact O-CA 3.27Å; I60-Y64 WeakPolarHBondContact O-CA 3.35Å; I60-Y64 VanDerWaalsContact O-CB 3.24Å; I60-Y64 WeakPolarHBondContact O-CB 3.48Å; I60-Y64 PolarHBondContact O-N 3.17Å
61	V	76.5	Confident	76.3	Confident	114 Å²	114	94.6 Å²	94.6	69%	0.691	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-37.7	175	169.2	0	0	0	0	111.6	D57 K58	D57-V61 VanDerWaalsContact O-CB 3.29Å; D57-V61 WeakPolarHBondContact O-CB 3.41Å; D57-V61 WeakPolarHBondContact O-CG2 3.45Å; D57-V61 PolarHBondContact O-N 3.36Å; K58-V61 PolarHBondContact O-N 3.13Å
62	Q	74.6	Confident	76.5	Confident	146 Å²	146	99.9 Å²	99.9	68%	0.682	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-40.1	175.2	-79.7	179.1	-7.6	0	0	113.3	K58 L59 I60	K58-Q62 WeakPolarHBondContact O-CB 3.27Å; K58-Q62 VanDerWaalsContact O-CG 3.32Å; K58-Q62 WeakPolarHBondContact O-CG 3.27Å; K58-Q62 PolarHBondContact O-N 3.33Å; L59-Q62 PolarHBondContact O-N 3.12Å; I60-Q62 VanDerWaalsContact C-N 3.34Å; I60-Q62 PolarHBondContact O-N 2.87Å
63	H	71.4	Confident	76.7	Confident	89 Å²	89	99.1 Å²	99.1	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-109.8	11	-174.3	-72.7	-87.8	0	0	0	115.3	L59 I60 A65 E66 L67	L59-H63 PolarHBondContact O-N 3.08Å; I60-H63 CarbonylContact O-C 3.56Å; I60-H63 PolarHBondContact O-N 3.48Å; H63-A65 PolarHBondContact O-N 3.42Å; H63-A65 VanDerWaalsContact O-N 3.13Å; H63-E66 IonicContact CE1-OE2 2.7Å; H63-E66 IonicContact CG-OE2 2.88Å; H63-E66 IonicContact ND1-OE2 3.16Å; H63-E66 PolarHBondContact ND1-OE2 3.06Å; H63-E66 PolarHBondContact O-N 3.15Å; H63-L67 PolarHBondContact O-N 3.2Å
64	Y	76.3	Confident	76.9	Confident	151 Å²	151	103.2 Å²	103.2	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-53.6	-38.9	-176.1	-163.6	-96.2	0	0	0	113.2	I60 T68	I60-Y64 HydrophobicContact CG2-CD2 4.05Å; I60-Y64 VanDerWaalsContact O-CA 3.27Å; I60-Y64 WeakPolarHBondContact O-CA 3.35Å; I60-Y64 VanDerWaalsContact O-CB 3.24Å; I60-Y64 WeakPolarHBondContact O-CB 3.48Å; I60-Y64 PolarHBondContact O-N 3.17Å; Y64-T68 WeakPolarHBondContact O-CB 3.45Å; Y64-T68 PolarHBondContact O-N 3.3Å; Y64-T68 VanDerWaalsContact O-N 3.1Å; Y64-T68 PolarHBondContact O-OG1 3.18Å
65	A	74.4	Confident	77.1	Confident	70 Å²	70	101.7 Å²	101.7	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-65	-42.7	179.5	0	0	0	0	0	112.5	H63 T69	H63-A65 PolarHBondContact O-N 3.42Å; H63-A65 VanDerWaalsContact O-N 3.13Å; A65-T69 WeakPolarHBondContact O-CB 3.35Å; A65-T69 PolarHBondContact O-N 3.48Å; A65-T69 VanDerWaalsContact O-N 3.13Å; A65-T69 PolarHBondContact O-OG1 3.47Å
66	E	74.8	Confident	77.5	Confident	130 Å²	130	100.9 Å²	100.9	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-69.6	-45.7	-178.5	-64.8	-177	158.3	0	0	111	H63 T68 T69 A70	H63-E66 IonicContact CE1-OE2 2.7Å; H63-E66 IonicContact CG-OE2 2.88Å; H63-E66 IonicContact ND1-OE2 3.16Å; H63-E66 PolarHBondContact ND1-OE2 3.06Å; H63-E66 PolarHBondContact O-N 3.15Å; E66-T68 PolarHBondContact O-N 3.24Å; E66-T69 PolarHBondContact O-N 3.27Å; E66-T69 VanDerWaalsContact O-N 3.16Å; E66-A70 PolarHBondContact O-N 3.36Å
67	L	76.8	Confident	78	Confident	103 Å²	103	100.9 Å²	100.9	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-46.4	177.7	-174.2	68.9	0	0	0	111.9	H63 T69 A70 I71	H63-L67 PolarHBondContact O-N 3.2Å; L67-T69 PolarHBondContact O-N 3.44Å; L67-A70 PolarHBondContact O-N 3.45Å; L67-I71 HydrophobicContact CG-CD1 4.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.47Å; L67-I71 PolarHBondContact O-N 3.5Å
68	T	77.9	Confident	78.3	Confident	38 Å²	38	99.2 Å²	99.2	23%	0.233	51%	0.507	C	S	.	.	H	α-helix	trans	-61.3	-35.8	177.5	-57.6	0	0	0	0	111.7	Y64 E66 R72	Y64-T68 WeakPolarHBondContact O-CB 3.45Å; Y64-T68 PolarHBondContact O-N 3.3Å; Y64-T68 VanDerWaalsContact O-N 3.1Å; Y64-T68 PolarHBondContact O-OG1 3.18Å; E66-T68 PolarHBondContact O-N 3.24Å; T68-R72 WeakPolarHBondContact O-CG 3.37Å; T68-R72 PolarHBondContact O-N 3.07Å; T68-R72 VanDerWaalsContact O-N 3.17Å
69	T	80.1	Confident	78.7	Confident	77 Å²	77	100.1 Å²	100.1	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-73.4	-39.1	178.9	-53.7	0	0	0	0	111.8	A65 E66 L67 R72 T73	A65-T69 WeakPolarHBondContact O-CB 3.35Å; A65-T69 PolarHBondContact O-N 3.48Å; A65-T69 VanDerWaalsContact O-N 3.13Å; A65-T69 PolarHBondContact O-OG1 3.47Å; E66-T69 PolarHBondContact O-N 3.27Å; E66-T69 VanDerWaalsContact O-N 3.16Å; L67-T69 PolarHBondContact O-N 3.44Å; T69-R72 PolarHBondContact O-N 3.43Å; T69-T73 WeakPolarHBondContact O-CG2 3.43Å; T69-T73 PolarHBondContact O-N 3.28Å; T69-T73 PolarHBondContact O-OG1 2.99Å
70	A	78.3	Confident	79.2	Confident	56 Å²	56	104.2 Å²	104.2	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-43	174.4	0	0	0	0	0	112.5	E66 L67 T73 Y74	E66-A70 PolarHBondContact O-N 3.36Å; L67-A70 PolarHBondContact O-N 3.45Å; A70-T73 WeakPolarHBondContact CA-OG1 3.29Å; A70-T73 PolarHBondContact O-N 2.96Å; A70-T73 PolarHBondContact O-OG1 3.38Å; A70-Y74 PolarHBondContact O-N 2.9Å; A70-Y74 VanDerWaalsContact O-N 3.08Å
71	I	79.6	Confident	79.7	Confident	90 Å²	90	105.5 Å²	105.5	46%	0.462	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-45.6	178.1	-66.3	170.4	0	0	0	111.1	L67 T73 Y74 Q75	L67-I71 HydrophobicContact CG-CD1 4.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.47Å; L67-I71 PolarHBondContact O-N 3.5Å; I71-T73 PolarHBondContact O-N 3.08Å; I71-Y74 PolarHBondContact O-N 3.17Å; I71-Q75 WeakPolarHBondContact O-CG 3.46Å; I71-Q75 PolarHBondContact O-N 2.93Å
72	R	81.9	Confident	80.1	Confident	164 Å²	164	103.5 Å²	103.5	62%	0.619	52%	0.516	S	S	*	.	H	α-helix	trans	-61.4	-41.5	176.6	-77.4	-174.7	-170.2	137.9	4.8	112.9	T68 T69 Q75 S76	T68-R72 WeakPolarHBondContact O-CG 3.37Å; T68-R72 PolarHBondContact O-N 3.07Å; T68-R72 VanDerWaalsContact O-N 3.17Å; T69-R72 PolarHBondContact O-N 3.43Å; R72-Q75 PolarHBondContact O-N 3.43Å; R72-S76 VanDerWaalsContact O-CB 3.29Å; R72-S76 WeakPolarHBondContact O-CB 3.47Å; R72-S76 PolarHBondContact O-N 3.46Å
73	T	81.1	Confident	80.6	Confident	74 Å²	74	99.3 Å²	99.3	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-39.7	179.2	48.2	0	0	0	0	111.5	T69 A70 I71 S76 I77	T69-T73 WeakPolarHBondContact O-CG2 3.43Å; T69-T73 PolarHBondContact O-N 3.28Å; T69-T73 PolarHBondContact O-OG1 2.99Å; A70-T73 WeakPolarHBondContact CA-OG1 3.29Å; A70-T73 PolarHBondContact O-N 2.96Å; A70-T73 PolarHBondContact O-OG1 3.38Å; I71-T73 PolarHBondContact O-N 3.08Å; T73-S76 PolarHBondContact O-N 2.98Å; T73-I77 WeakPolarHBondContact O-CB 3.47Å; T73-I77 WeakPolarHBondContact O-CD1 3.27Å; T73-I77 VanDerWaalsContact O-CG1 3.24Å; T73-I77 WeakPolarHBondContact O-CG1 3.45Å; T73-I77 PolarHBondContact O-N 2.79Å
74	Y	82.9	Confident	81.3	Confident	170 Å²	170	98 Å²	98	67%	0.667	50%	0.503	S	S	*	.	H	α-helix	trans	-64.7	-43.6	173.9	-174.2	-97.3	0	0	0	113.2	A70 I71 I77 T78	A70-Y74 PolarHBondContact O-N 2.9Å; A70-Y74 VanDerWaalsContact O-N 3.08Å; I71-Y74 PolarHBondContact O-N 3.17Å; Y74-I77 PolarHBondContact O-N 2.99Å; Y74-T78 WeakPolarHBondContact O-CB 3.5Å; Y74-T78 PolarHBondContact O-N 3.45Å; Y74-T78 PolarHBondContact O-OG1 2.93Å
75	Q	81.6	Confident	81.7	Confident	109 Å²	109	99.9 Å²	99.9	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-59.8	-49.1	173.6	-75.1	175.4	-27.5	0	0	111	I71 R72 I77 T78 E79	I71-Q75 WeakPolarHBondContact O-CG 3.46Å; I71-Q75 PolarHBondContact O-N 2.93Å; R72-Q75 PolarHBondContact O-N 3.43Å; Q75-I77 PolarHBondContact O-N 2.92Å; Q75-T78 WeakPolarHBondContact O-CB 3.24Å; Q75-T78 PolarHBondContact O-N 2.89Å; Q75-T78 VanDerWaalsContact O-N 3.12Å; Q75-E79 WeakPolarHBondContact O-CG 3.45Å; Q75-E79 PolarHBondContact O-N 3.28Å
76	S	83.6	Confident	82.2	Confident	57 Å²	57	101.4 Å²	101.4	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-40.4	179	-173.1	0	0	0	0	113.1	R72 T73 R80	R72-S76 VanDerWaalsContact O-CB 3.29Å; R72-S76 WeakPolarHBondContact O-CB 3.47Å; R72-S76 PolarHBondContact O-N 3.46Å; T73-S76 PolarHBondContact O-N 2.98Å; S76-R80 WeakPolarHBondContact O-CB 3.39Å; S76-R80 VanDerWaalsContact O-CG 3.27Å; S76-R80 WeakPolarHBondContact O-CG 3.28Å; S76-R80 PolarHBondContact O-N 3.34Å
77	I	84.2	Confident	82.8	Confident	96 Å²	96	101.5 Å²	101.5	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-43.3	174.7	-70.4	165.6	0	0	0	110.6	T73 Y74 Q75 R80 I81	T73-I77 WeakPolarHBondContact O-CB 3.47Å; T73-I77 WeakPolarHBondContact O-CD1 3.27Å; T73-I77 VanDerWaalsContact O-CG1 3.24Å; T73-I77 WeakPolarHBondContact O-CG1 3.45Å; T73-I77 PolarHBondContact O-N 2.79Å; Y74-I77 PolarHBondContact O-N 2.99Å; Q75-I77 PolarHBondContact O-N 2.92Å; I77-R80 PolarHBondContact O-N 2.99Å; I77-I81 HydrophobicContact CG2-CD1 3.79Å; I77-I81 HydrophobicContact CG2-CG1 4.48Å; I77-I81 WeakPolarHBondContact O-CG1 3.33Å; I77-I81 PolarHBondContact O-N 2.93Å
78	T	83.6	Confident	83.2	Confident	60 Å²	60	102 Å²	102	37%	0.368	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-42.3	178.8	-57.3	0	0	0	0	111.7	Y74 Q75 T82	Y74-T78 WeakPolarHBondContact O-CB 3.5Å; Y74-T78 PolarHBondContact O-N 3.45Å; Y74-T78 PolarHBondContact O-OG1 2.93Å; Q75-T78 WeakPolarHBondContact O-CB 3.24Å; Q75-T78 PolarHBondContact O-N 2.89Å; Q75-T78 VanDerWaalsContact O-N 3.12Å; T78-T82 WeakPolarHBondContact O-CB 3.25Å; T78-T82 PolarHBondContact O-N 3.3Å; T78-T82 PolarHBondContact O-OG1 2.8Å
79	E	84.8	Confident	83.7	Confident	134 Å²	134	106.5 Å²	106.5	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-46	172.6	-73.3	176.5	172.5	0	0	112.2	Q75 I81 T82 S83	Q75-E79 WeakPolarHBondContact O-CG 3.45Å; Q75-E79 PolarHBondContact O-N 3.28Å; E79-I81 PolarHBondContact O-N 3.45Å; E79-T82 PolarHBondContact O-N 2.87Å; E79-S83 VanDerWaalsContact O-CB 3.25Å; E79-S83 WeakPolarHBondContact O-CB 3.4Å; E79-S83 PolarHBondContact O-N 2.77Å
80	R	84.9	Confident	84	Confident	192 Å²	192	108.3 Å²	108.3	73%	0.725	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-39.9	177.9	-72.9	-179.8	90.7	-151.9	6.9	112.2	S76 I77 S84	S76-R80 WeakPolarHBondContact O-CB 3.39Å; S76-R80 VanDerWaalsContact O-CG 3.27Å; S76-R80 WeakPolarHBondContact O-CG 3.28Å; S76-R80 PolarHBondContact O-N 3.34Å; I77-R80 PolarHBondContact O-N 2.99Å; R80-S84 VanDerWaalsContact O-CB 3.28Å; R80-S84 WeakPolarHBondContact O-CB 3.47Å; R80-S84 PolarHBondContact O-N 3.12Å
81	I	85.3	Confident	84.4	Confident	96 Å²	96	110.2 Å²	110.2	49%	0.492	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-43.6	175.7	-70.1	169.6	0	0	0	110.8	I77 E79 S84 R85	I77-I81 HydrophobicContact CG2-CD1 3.79Å; I77-I81 HydrophobicContact CG2-CG1 4.48Å; I77-I81 WeakPolarHBondContact O-CG1 3.33Å; I77-I81 PolarHBondContact O-N 2.93Å; E79-I81 PolarHBondContact O-N 3.45Å; I81-S84 PolarHBondContact O-N 2.99Å; I81-R85 PolarHBondContact O-N 2.93Å
82	T	84.5	Confident	84.7	Confident	72 Å²	72	113 Å²	113	44%	0.442	54%	0.542	S	S	.	.	H	α-helix	trans	-66.3	-44	179.1	-54.1	0	0	0	0	111.3	T78 E79 S84 R85 N86	T78-T82 WeakPolarHBondContact O-CB 3.25Å; T78-T82 PolarHBondContact O-N 3.3Å; T78-T82 PolarHBondContact O-OG1 2.8Å; E79-T82 PolarHBondContact O-N 2.87Å; T82-S84 VanDerWaalsContact C-N 3.34Å; T82-S84 PolarHBondContact O-N 3.33Å; T82-R85 PolarHBondContact O-N 3.32Å; T82-N86 PolarHBondContact O-N 3.45Å
83	S	84.8	Confident	84.9	Confident	58 Å²	58	109.9 Å²	109.9	41%	0.406	54%	0.535	S	S	.	.	H	α-helix	trans	-58.7	-43.4	172.5	-173.6	0	0	0	0	111.9	E79 N86 K87	E79-S83 VanDerWaalsContact O-CB 3.25Å; E79-S83 WeakPolarHBondContact O-CB 3.4Å; E79-S83 PolarHBondContact O-N 2.77Å; S83-N86 PolarHBondContact O-N 2.9Å; S83-K87 WeakPolarHBondContact O-CG 3.3Å; S83-K87 PolarHBondContact O-N 3.34Å
84	S	85	Confident	85.2	Confident	61 Å²	61	110.7 Å²	110.7	43%	0.427	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-45.8	176.8	-170.8	0	0	0	0	112.1	R80 I81 T82 N86 K87 I88	R80-S84 VanDerWaalsContact O-CB 3.28Å; R80-S84 WeakPolarHBondContact O-CB 3.47Å; R80-S84 PolarHBondContact O-N 3.12Å; I81-S84 PolarHBondContact O-N 2.99Å; T82-S84 VanDerWaalsContact C-N 3.34Å; T82-S84 PolarHBondContact O-N 3.33Å; S84-N86 VanDerWaalsContact C-N 3.33Å; S84-N86 PolarHBondContact O-N 3.41Å; S84-K87 PolarHBondContact O-N 2.87Å; S84-I88 VanDerWaalsContact O-CG1 3.31Å; S84-I88 WeakPolarHBondContact O-CG1 3.39Å; S84-I88 PolarHBondContact O-N 3.24Å
85	R	85.5	Confident	85.2	Confident	191 Å²	191	108.7 Å²	108.7	72%	0.721	54%	0.536	S	S	*	.	H	α-helix	trans	-57.6	-44.1	173.7	-96	-177.8	167.2	162.1	-2.7	112.4	I81 T82 I88 K89	I81-R85 PolarHBondContact O-N 2.93Å; T82-R85 PolarHBondContact O-N 3.32Å; R85-I88 PolarHBondContact O-N 2.93Å; R85-K89 PolarHBondContact O-N 3.02Å
86	N	85.4	Confident	85.3	Confident	101 Å²	101	108.1 Å²	108.1	54%	0.54	54%	0.536	S	S	.	.	H	α-helix	trans	-65.8	-43	178.2	-70.5	-11.7	0	0	0	111.7	T82 S83 S84 I88 K89 Q90	T82-N86 PolarHBondContact O-N 3.45Å; S83-N86 PolarHBondContact O-N 2.9Å; S84-N86 VanDerWaalsContact C-N 3.33Å; S84-N86 PolarHBondContact O-N 3.41Å; N86-I88 PolarHBondContact O-N 3.4Å; N86-K89 PolarHBondContact O-N 2.92Å; N86-Q90 WeakPolarHBondContact O-CB 3.31Å; N86-Q90 PolarHBondContact O-N 3.47Å
87	K	86.1	Confident	85.2	Confident	133 Å²	133	108.5 Å²	108.5	58%	0.578	54%	0.539	S	S	*	.	H	α-helix	trans	-59.6	-44.3	173.7	-75.6	-179.8	179.7	-175.9	0	112.4	S83 S84 K89 Q90 V91	S83-K87 WeakPolarHBondContact O-CG 3.3Å; S83-K87 PolarHBondContact O-N 3.34Å; S84-K87 PolarHBondContact O-N 2.87Å; K87-K89 VanDerWaalsContact C-N 3.32Å; K87-K89 PolarHBondContact O-N 3.34Å; K87-Q90 PolarHBondContact O-N 3.45Å; K87-V91 WeakPolarHBondContact O-CB 3.37Å; K87-V91 VanDerWaalsContact O-CG2 3.3Å; K87-V91 WeakPolarHBondContact O-CG2 3.49Å; K87-V91 PolarHBondContact O-N 3.27Å
88	I	86.6	Confident	85.1	Confident	112 Å²	112	107.1 Å²	107.1	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-62.9	-40.5	177.5	-67.9	169.5	0	0	0	110.9	S84 R85 N86 V91 K92	S84-I88 VanDerWaalsContact O-CG1 3.31Å; S84-I88 WeakPolarHBondContact O-CG1 3.39Å; S84-I88 PolarHBondContact O-N 3.24Å; R85-I88 PolarHBondContact O-N 2.93Å; N86-I88 PolarHBondContact O-N 3.4Å; I88-V91 PolarHBondContact O-N 3.49Å; I88-K92 WeakPolarHBondContact O-CB 3.48Å; I88-K92 PolarHBondContact O-N 3.04Å
89	K	86.9	Confident	85	Confident	133 Å²	133	111.8 Å²	111.8	58%	0.578	55%	0.552	S	S	*	*	H	α-helix	trans	-62.7	-47.6	176.5	-155.9	-175.1	-179.8	-166.2	0	111.3	R85 N86 K87 V91 K92 E93	R85-K89 PolarHBondContact O-N 3.02Å; N86-K89 PolarHBondContact O-N 2.92Å; K87-K89 VanDerWaalsContact C-N 3.32Å; K87-K89 PolarHBondContact O-N 3.34Å; K89-V91 PolarHBondContact O-N 3.45Å; K89-K92 WeakPolarHBondContact O-CB 3.46Å; K89-K92 PolarHBondContact O-N 2.93Å; K89-E93 WeakPolarHBondContact O-CG 3.5Å; K89-E93 PolarHBondContact O-N 2.88Å
90	Q	87.4	Confident	84.7	Confident	115 Å²	115	111.9 Å²	111.9	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-63.9	-39.3	177.6	-167.3	175.6	19.6	0	0	112.8	N86 K87 K92 E93 N94	N86-Q90 WeakPolarHBondContact O-CB 3.31Å; N86-Q90 PolarHBondContact O-N 3.47Å; K87-Q90 PolarHBondContact O-N 3.45Å; Q90-K92 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 3.34Å; Q90-E93 PolarHBondContact O-N 3.39Å; Q90-N94 WeakPolarHBondContact O-CB 3.34Å; Q90-N94 PolarHBondContact O-N 2.99Å
91	V	86.6	Confident	84.4	Confident	96 Å²	96	108.3 Å²	108.3	58%	0.582	55%	0.549	S	S	*	.	H	α-helix	trans	-63.3	-40.2	173.6	168.1	0	0	0	0	111.1	K87 I88 K89 N94 L95	K87-V91 WeakPolarHBondContact O-CB 3.37Å; K87-V91 VanDerWaalsContact O-CG2 3.3Å; K87-V91 WeakPolarHBondContact O-CG2 3.49Å; K87-V91 PolarHBondContact O-N 3.27Å; I88-V91 PolarHBondContact O-N 3.49Å; K89-V91 PolarHBondContact O-N 3.45Å; V91-N94 PolarHBondContact O-N 3.49Å; V91-L95 WeakPolarHBondContact O-CB 3.38Å; V91-L95 PolarHBondContact O-N 3.47Å
92	K	86.6	Confident	84	Confident	148 Å²	148	109.8 Å²	109.8	64%	0.643	56%	0.557	S	S	*	*	H	α-helix	trans	-66.4	-40.2	177.2	-169.8	178.6	-179.4	-178.1	0	112.2	I88 K89 Q90 L95 L96	I88-K92 WeakPolarHBondContact O-CB 3.48Å; I88-K92 PolarHBondContact O-N 3.04Å; K89-K92 WeakPolarHBondContact O-CB 3.46Å; K89-K92 PolarHBondContact O-N 2.93Å; Q90-K92 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 3.34Å; K92-L95 PolarHBondContact O-N 3.49Å; K92-L96 WeakPolarHBondContact O-CG 3.48Å; K92-L96 PolarHBondContact O-N 3.46Å; K92-L96 VanDerWaalsContact O-N 3.13Å
93	E	86.6	Confident	83.5	Confident	100 Å²	100	111 Å²	111	47%	0.467	56%	0.558	S	S	.	*	H	α-helix	trans	-64.4	-47.7	173.9	-73.3	164	-170.7	0	0	111	K89 Q90 L95 L96 S97	K89-E93 WeakPolarHBondContact O-CG 3.5Å; K89-E93 PolarHBondContact O-N 2.88Å; Q90-E93 PolarHBondContact O-N 3.39Å; E93-L95 VanDerWaalsContact C-N 3.32Å; E93-L95 PolarHBondContact O-N 3.18Å; E93-L96 WeakPolarHBondContact O-CB 3.48Å; E93-L96 PolarHBondContact O-N 3.2Å; E93-L96 VanDerWaalsContact O-N 3.17Å; E93-S97 PolarHBondContact O-N 3.15Å; E93-S97 PolarHBondContact O-OG 3.43Å
94	N	86.2	Confident	82.8	Confident	91 Å²	91	111.9 Å²	111.9	49%	0.487	56%	0.563	S	S	.	*	H	α-helix	trans	-59.2	-39.4	175.7	-72.4	-12.2	0	0	0	112.8	Q90 V91 S97 C98	Q90-N94 WeakPolarHBondContact O-CB 3.34Å; Q90-N94 PolarHBondContact O-N 2.99Å; V91-N94 PolarHBondContact O-N 3.49Å; N94-S97 PolarHBondContact O-N 2.98Å; N94-C98 PolarHBondContact O-N 3.49Å; N94-C98 PolarHBondContact O-SG 2.97Å
95	L	83.6	Confident	82.2	Confident	127 Å²	127	114.8 Å²	114.8	67%	0.665	57%	0.568	S	S	*	*	H	α-helix	trans	-67.6	-36.8	178	-161	78.2	0	0	0	112	V91 K92 E93 K99	V91-L95 WeakPolarHBondContact O-CB 3.38Å; V91-L95 PolarHBondContact O-N 3.47Å; K92-L95 PolarHBondContact O-N 3.49Å; E93-L95 VanDerWaalsContact C-N 3.32Å; E93-L95 PolarHBondContact O-N 3.18Å; L95-K99 WeakPolarHBondContact O-CB 3.44Å; L95-K99 PolarHBondContact O-N 2.98Å
96	L	83.8	Confident	81.9	Confident	98 Å²	98	112.6 Å²	112.6	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-64.9	-45	172.6	-78.5	163.3	0	0	0	111.3	K92 E93 C98 K99 M100	K92-L96 WeakPolarHBondContact O-CG 3.48Å; K92-L96 PolarHBondContact O-N 3.46Å; K92-L96 VanDerWaalsContact O-N 3.13Å; E93-L96 WeakPolarHBondContact O-CB 3.48Å; E93-L96 PolarHBondContact O-N 3.2Å; E93-L96 VanDerWaalsContact O-N 3.17Å; L96-C98 PolarHBondContact O-N 3.48Å; L96-K99 WeakPolarHBondContact O-CB 3.48Å; L96-K99 PolarHBondContact O-N 3.17Å; L96-M100 PolarHBondContact O-N 2.99Å
97	S	81.1	Confident	81.5	Confident	64 Å²	64	111 Å²	111	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-59.9	-44	174.7	-60.8	0	0	0	0	112.2	E93 N94 K99 M100 L101	E93-S97 PolarHBondContact O-N 3.15Å; E93-S97 PolarHBondContact O-OG 3.43Å; N94-S97 PolarHBondContact O-N 2.98Å; S97-K99 VanDerWaalsContact C-N 3.35Å; S97-K99 PolarHBondContact O-N 3.13Å; S97-M100 PolarHBondContact O-N 3Å; S97-L101 WeakPolarHBondContact O-CB 3.47Å; S97-L101 WeakPolarHBondContact O-CG 3.47Å; S97-L101 PolarHBondContact O-N 3.18Å
98	C	81.8	Confident	81.2	Confident	68 Å²	68	109.2 Å²	109.2	46%	0.459	55%	0.545	S	S	.	.	H	α-helix	trans	-61.8	-41	175.1	-67.1	0	0	0	0	112	N94 L96 M100 L101 L102	N94-C98 PolarHBondContact O-N 3.49Å; N94-C98 PolarHBondContact O-SG 2.97Å; L96-C98 PolarHBondContact O-N 3.48Å; C98-M100 PolarHBondContact O-N 2.91Å; C98-L101 PolarHBondContact O-N 3.24Å; C98-L102 WeakPolarHBondContact O-CB 3.46Å; C98-L102 WeakPolarHBondContact O-CG 3.48Å; C98-L102 PolarHBondContact O-N 3.37Å
99	K	81.9	Confident	80.8	Confident	158 Å²	158	109.5 Å²	109.5	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-62.6	-40.7	175.9	-175.6	-179.7	177.1	-177.2	0	112.1	L95 L96 S97 H103	L95-K99 WeakPolarHBondContact O-CB 3.44Å; L95-K99 PolarHBondContact O-N 2.98Å; L96-K99 WeakPolarHBondContact O-CB 3.48Å; L96-K99 PolarHBondContact O-N 3.17Å; S97-K99 VanDerWaalsContact C-N 3.35Å; S97-K99 PolarHBondContact O-N 3.13Å; K99-H103 PolarHBondContact O-N 2.95Å
100	M	78.5	Confident	80.6	Confident	136 Å²	136	111.4 Å²	111.4	67%	0.67	55%	0.55	S	S	*	*	H	α-helix	trans	-67.2	-47.1	175.7	-71.1	-176.7	67.5	0	0	111.8	L96 S97 C98 L102 H103 C104	L96-M100 PolarHBondContact O-N 2.99Å; S97-M100 PolarHBondContact O-N 3Å; C98-M100 PolarHBondContact O-N 2.91Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 2.93Å; M100-H103 WeakPolarHBondContact O-CB 3.47Å; M100-H103 PolarHBondContact O-N 3.27Å; M100-H103 VanDerWaalsContact O-N 3.09Å; M100-C104 PolarHBondContact O-N 3.47Å; M100-C104 PolarHBondContact O-SG 3.09Å; M100-C104 VanDerWaalsContact O-SG 3.41Å
101	L	77.8	Confident	80.4	Confident	116 Å²	116	111.9 Å²	111.9	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-57.9	-42.8	177.6	-80.2	160.4	0	0	0	112.7	S97 C98 C104 K105	S97-L101 WeakPolarHBondContact O-CB 3.47Å; S97-L101 WeakPolarHBondContact O-CG 3.47Å; S97-L101 PolarHBondContact O-N 3.18Å; C98-L101 PolarHBondContact O-N 3.24Å; L101-C104 PolarHBondContact O-N 3.07Å; L101-K105 PolarHBondContact O-N 3.38Å
102	L	76.5	Confident	80.2	Confident	128 Å²	128	112.4 Å²	112.4	67%	0.67	55%	0.55	S	S	*	.	H	α-helix	trans	-65.7	-35.7	175.5	-73.7	169	0	0	0	112.7	C98 M100 R106	C98-L102 WeakPolarHBondContact O-CB 3.46Å; C98-L102 WeakPolarHBondContact O-CG 3.48Å; C98-L102 PolarHBondContact O-N 3.37Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 2.93Å; L102-R106 PolarHBondContact O-N 3.41Å; L102-R106 VanDerWaalsContact O-N 3.07Å
103	H	74.4	Confident	80.1	Confident	97 Å²	97	113.5 Å²	113.5	45%	0.449	55%	0.55	S	S	.	.	H	α-helix	trans	-67.3	-47.3	175.5	-163.7	-71	0	0	0	111.4	K99 M100 K105 R106 D107	K99-H103 PolarHBondContact O-N 2.95Å; M100-H103 WeakPolarHBondContact O-CB 3.47Å; M100-H103 PolarHBondContact O-N 3.27Å; M100-H103 VanDerWaalsContact O-N 3.09Å; H103-K105 VanDerWaalsContact C-N 3.32Å; H103-K105 PolarHBondContact O-N 3.43Å; H103-R106 PolarHBondContact CE1-NH2 3.4Å; H103-R106 PolarHBondContact NE2-NH2 2.92Å; H103-R106 WeakPolarHBondContact O-CB 3.4Å; H103-R106 PolarHBondContact O-N 3.38Å; H103-R106 VanDerWaalsContact O-N 3.12Å; H103-D107 IonicContact CE1-OD1 2.78Å; H103-D107 IonicContact CE1-OD2 3.86Å; H103-D107 PolarHBondContact CE1-OD2 3.04Å; H103-D107 IonicContact CG-OD2 3.48Å; H103-D107 IonicContact ND1-OD1 2.83Å; H103-D107 IonicContact ND1-OD2 3.61Å; H103-D107 PolarHBondContact ND1-OD2 2.73Å; H103-D107 PolarHBondContact O-N 3Å
104	C	70.3	Confident	80.1	Confident	77 Å²	77	111.9 Å²	111.9	52%	0.52	54%	0.544	S	S	.	.	H	α-helix	trans	-57.4	-44.3	175.3	-65.8	0	0	0	0	111.6	M100 L101 R106 D107 E108	M100-C104 PolarHBondContact O-N 3.47Å; M100-C104 PolarHBondContact O-SG 3.09Å; M100-C104 VanDerWaalsContact O-SG 3.41Å; L101-C104 PolarHBondContact O-N 3.07Å; C104-R106 VanDerWaalsContact C-N 3.32Å; C104-R106 PolarHBondContact O-N 2.66Å; C104-D107 PolarHBondContact O-N 2.97Å; C104-E108 VanDerWaalsContact O-CB 3.29Å; C104-E108 WeakPolarHBondContact O-CB 3.45Å; C104-E108 PolarHBondContact O-N 3.12Å
105	K	72.3	Confident	80	Confident	121 Å²	121	110.4 Å²	110.4	53%	0.526	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-32.2	177	-77.3	-70.9	164.8	-155	0	113.5	L101 H103 E108 L109	L101-K105 PolarHBondContact O-N 3.38Å; H103-K105 VanDerWaalsContact C-N 3.32Å; H103-K105 PolarHBondContact O-N 3.43Å; K105-E108 IonicContact NZ-OE2 3.71Å; K105-E108 PolarHBondContact NZ-OE2 2.93Å; K105-L109 WeakPolarHBondContact O-CB 3.45Å; K105-L109 PolarHBondContact O-N 3.43Å
106	R	78.9	Confident	80.1	Confident	146 Å²	146	106.2 Å²	106.2	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-67.7	-44.3	173.6	-171.8	-163.1	67.2	-174.1	-6	111.9	L102 H103 C104 L109 R110	L102-R106 PolarHBondContact O-N 3.41Å; L102-R106 VanDerWaalsContact O-N 3.07Å; H103-R106 PolarHBondContact CE1-NH2 3.4Å; H103-R106 PolarHBondContact NE2-NH2 2.92Å; H103-R106 WeakPolarHBondContact O-CB 3.4Å; H103-R106 PolarHBondContact O-N 3.38Å; H103-R106 VanDerWaalsContact O-N 3.12Å; C104-R106 VanDerWaalsContact C-N 3.32Å; C104-R106 PolarHBondContact O-N 2.66Å; R106-L109 PolarHBondContact O-N 2.99Å; R106-R110 WeakPolarHBondContact O-CB 3.29Å; R106-R110 PolarHBondContact O-N 3.29Å
107	D	77.1	Confident	80.2	Confident	66 Å²	66	105.5 Å²	105.5	35%	0.353	52%	0.517	S	S	.	.	H	α-helix	trans	-72.3	-35.1	-177.5	-55.9	-26.4	0	0	0	111.1	H103 C104 R110 K111	H103-D107 IonicContact CE1-OD1 2.78Å; H103-D107 IonicContact CE1-OD2 3.86Å; H103-D107 PolarHBondContact CE1-OD2 3.04Å; H103-D107 IonicContact CG-OD2 3.48Å; H103-D107 IonicContact ND1-OD1 2.83Å; H103-D107 IonicContact ND1-OD2 3.61Å; H103-D107 PolarHBondContact ND1-OD2 2.73Å; H103-D107 PolarHBondContact O-N 3Å; C104-D107 PolarHBondContact O-N 2.97Å; D107-R110 PolarHBondContact O-N 3.25Å; D107-K111 PolarHBondContact O-N 3.45Å
108	E	79.8	Confident	80.3	Confident	97 Å²	97	107.7 Å²	107.7	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-66	-42.3	171.3	-167.1	171.3	-134.3	0	0	112	C104 K105 R110 K111 L112	C104-E108 VanDerWaalsContact O-CB 3.29Å; C104-E108 WeakPolarHBondContact O-CB 3.45Å; C104-E108 PolarHBondContact O-N 3.12Å; K105-E108 IonicContact NZ-OE2 3.71Å; K105-E108 PolarHBondContact NZ-OE2 2.93Å; E108-R110 VanDerWaalsContact C-N 3.33Å; E108-R110 PolarHBondContact O-N 2.95Å; E108-K111 PolarHBondContact O-N 3.09Å; E108-L112 WeakPolarHBondContact O-CG 3.29Å; E108-L112 PolarHBondContact O-N 2.86Å
109	L	79.1	Confident	80.4	Confident	118 Å²	118	110.2 Å²	110.2	62%	0.618	53%	0.525	S	S	*	.	H	α-helix	trans	-60.9	-41.1	170.4	-113.2	82.3	0	0	0	112.2	K105 R106 K111 L112 W113	K105-L109 WeakPolarHBondContact O-CB 3.45Å; K105-L109 PolarHBondContact O-N 3.43Å; R106-L109 PolarHBondContact O-N 2.99Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-L112 PolarHBondContact O-N 3.4Å; L109-W113 VanDerWaalsContact O-CB 3.29Å; L109-W113 WeakPolarHBondContact O-CB 3.45Å; L109-W113 PolarHBondContact O-N 3.36Å
110	R	81.6	Confident	80.6	Confident	172 Å²	172	109.3 Å²	109.3	65%	0.649	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-40.5	179.3	-174.7	177.8	-179.1	175.8	0.9	111.1	R106 D107 E108 W113 I114	R106-R110 WeakPolarHBondContact O-CB 3.29Å; R106-R110 PolarHBondContact O-N 3.29Å; D107-R110 PolarHBondContact O-N 3.25Å; E108-R110 VanDerWaalsContact C-N 3.33Å; E108-R110 PolarHBondContact O-N 2.95Å; R110-W113 PolarHBondContact O-N 3.47Å; R110-I114 HydrophobicContact CG-CD1 4.19Å; R110-I114 VanDerWaalsContact O-CG1 3.3Å; R110-I114 WeakPolarHBondContact O-CG1 3.37Å; R110-I114 PolarHBondContact O-N 3.43Å
111	K	84.4	Confident	80.8	Confident	126 Å²	126	108 Å²	108	55%	0.548	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-53.5	172.8	179.8	179.4	166.7	-179.3	0	110.9	D107 E108 L109 W113 I114 E115	D107-K111 PolarHBondContact O-N 3.45Å; E108-K111 PolarHBondContact O-N 3.09Å; L109-K111 VanDerWaalsContact C-N 3.34Å; K111-W113 PolarHBondContact O-N 3.03Å; K111-I114 PolarHBondContact O-N 2.86Å; K111-I114 VanDerWaalsContact O-N 3.11Å; K111-E115 VanDerWaalsContact CE-CD 3.5Å; K111-E115 WeakPolarHBondContact CE-OE1 2.75Å; K111-E115 HydrophobicContact CG-CG 4.43Å; K111-E115 IonicContact NZ-OE1 2.62Å; K111-E115 WeakPolarHBondContact O-CG 3.43Å; K111-E115 PolarHBondContact O-N 3.21Å
112	L	83	Confident	81	Confident	107 Å²	107	106.1 Å²	106.1	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-60.8	-31	179	-71.4	168.6	0	0	0	113.2	E108 L109 G116	E108-L112 WeakPolarHBondContact O-CG 3.29Å; E108-L112 PolarHBondContact O-N 2.86Å; L109-L112 PolarHBondContact O-N 3.4Å; L112-G116 PolarHBondContact O-N 2.97Å
113	W	82.9	Confident	81.3	Confident	170 Å²	170	104.9 Å²	104.9	64%	0.644	50%	0.5	S	S	*	.	H	α-helix	trans	-73.8	-37.9	175.1	179.6	82.1	0	0	0	112.6	L109 R110 K111 G116 I117	L109-W113 VanDerWaalsContact O-CB 3.29Å; L109-W113 WeakPolarHBondContact O-CB 3.45Å; L109-W113 PolarHBondContact O-N 3.36Å; R110-W113 PolarHBondContact O-N 3.47Å; K111-W113 PolarHBondContact O-N 3.03Å; W113-G116 PolarHBondContact O-N 2.94Å; W113-I117 HydrophobicContact CD2-CD1 3.85Å; W113-I117 HydrophobicContact CE3-CD1 3.97Å; W113-I117 HydrophobicContact CH2-CD1 3.49Å; W113-I117 VanDerWaalsContact CH2-CD1 3.49Å; W113-I117 HydrophobicContact CZ2-CD1 3.35Å; W113-I117 HydrophobicContact CZ3-CD1 3.8Å; W113-I117 WeakPolarHBondContact O-CG1 3.3Å; W113-I117 PolarHBondContact O-N 3.31Å
114	I	86.8	Confident	81.7	Confident	66 Å²	66	104.9 Å²	104.9	34%	0.338	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-50.6	172.3	-68.1	166.9	0	0	0	109.7	R110 K111 G116 I117 E118	R110-I114 HydrophobicContact CG-CD1 4.19Å; R110-I114 VanDerWaalsContact O-CG1 3.3Å; R110-I114 WeakPolarHBondContact O-CG1 3.37Å; R110-I114 PolarHBondContact O-N 3.43Å; K111-I114 PolarHBondContact O-N 2.86Å; K111-I114 VanDerWaalsContact O-N 3.11Å; I114-G116 PolarHBondContact O-N 3.1Å; I114-I117 PolarHBondContact O-N 3.37Å; I114-E118 HydrophobicContact CG2-CG 4.4Å; I114-E118 WeakPolarHBondContact CG2-OE1 3.31Å; I114-E118 WeakPolarHBondContact O-CG 3.31Å; I114-E118 PolarHBondContact O-N 3.42Å
115	E	85.3	Confident	82	Confident	61 Å²	61	103.6 Å²	103.6	29%	0.285	49%	0.488	S	S	.	.	H	α-helix	trans	-57.1	-38.5	174.7	-70.1	173.6	159	0	0	111.2	K111 E118 H119	K111-E115 VanDerWaalsContact CE-CD 3.5Å; K111-E115 WeakPolarHBondContact CE-OE1 2.75Å; K111-E115 HydrophobicContact CG-CG 4.43Å; K111-E115 IonicContact NZ-OE1 2.62Å; K111-E115 WeakPolarHBondContact O-CG 3.43Å; K111-E115 PolarHBondContact O-N 3.21Å; E115-E118 PolarHBondContact O-N 2.86Å; E115-H119 VanDerWaalsContact O-CB 3.31Å; E115-H119 WeakPolarHBondContact O-CB 3.46Å; E115-H119 PolarHBondContact O-CD2 3.28Å; E115-H119 PolarHBondContact O-N 2.9Å; E115-H119 PolarHBondContact O-ND1 2.88Å
116	G	85.8	Confident	82.3	Confident	39 Å²	39	102.4 Å²	102.4	40%	0.402	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-33.3	174.6	0	0	0	0	0	114.4	L112 W113 I114 K120	L112-G116 PolarHBondContact O-N 2.97Å; W113-G116 PolarHBondContact O-N 2.94Å; I114-G116 PolarHBondContact O-N 3.1Å; G116-K120 VanDerWaalsContact O-CB 3.31Å; G116-K120 WeakPolarHBondContact O-CB 3.48Å; G116-K120 PolarHBondContact O-N 3.11Å; G116-K120 VanDerWaalsContact O-N 3.1Å
117	I	85.3	Confident	82.4	Confident	83 Å²	83	100.3 Å²	100.3	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-73.2	-44.1	172.7	-75.9	173.5	0	0	0	110.7	W113 I114 K120 H121	W113-I117 HydrophobicContact CD2-CD1 3.85Å; W113-I117 HydrophobicContact CE3-CD1 3.97Å; W113-I117 HydrophobicContact CH2-CD1 3.49Å; W113-I117 VanDerWaalsContact CH2-CD1 3.49Å; W113-I117 HydrophobicContact CZ2-CD1 3.35Å; W113-I117 HydrophobicContact CZ3-CD1 3.8Å; W113-I117 WeakPolarHBondContact O-CG1 3.3Å; W113-I117 PolarHBondContact O-N 3.31Å; I114-I117 PolarHBondContact O-N 3.37Å; I117-K120 PolarHBondContact O-N 2.93Å; I117-H121 PolarHBondContact O-N 2.83Å
118	E	83.2	Confident	82.4	Confident	110 Å²	110	101.2 Å²	101.2	51%	0.514	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-48.8	176.6	-71.4	172.5	174.7	0	0	110.6	I114 E115 K120 H121 V122	I114-E118 HydrophobicContact CG2-CG 4.4Å; I114-E118 WeakPolarHBondContact CG2-OE1 3.31Å; I114-E118 WeakPolarHBondContact O-CG 3.31Å; I114-E118 PolarHBondContact O-N 3.42Å; E115-E118 PolarHBondContact O-N 2.86Å; E118-K120 VanDerWaalsContact C-N 3.32Å; E118-K120 PolarHBondContact O-N 3Å; E118-H121 PolarHBondContact O-N 3.45Å; E118-V122 WeakPolarHBondContact O-CB 3.43Å; E118-V122 WeakPolarHBondContact O-CG2 3.3Å; E118-V122 PolarHBondContact O-N 3.13Å
119	H	84.6	Confident	82.3	Confident	121 Å²	121	98.6 Å²	98.6	56%	0.56	48%	0.477	S	S	*	.	H	α-helix	trans	-60	-38.9	174.2	-67.3	168.3	0	0	0	112.6	E115 V122 L123	E115-H119 VanDerWaalsContact O-CB 3.31Å; E115-H119 WeakPolarHBondContact O-CB 3.46Å; E115-H119 PolarHBondContact O-CD2 3.28Å; E115-H119 PolarHBondContact O-N 2.9Å; E115-H119 PolarHBondContact O-ND1 2.88Å; H119-V122 PolarHBondContact O-N 3.01Å; H119-L123 WeakPolarHBondContact O-CB 3.49Å; H119-L123 WeakPolarHBondContact O-CG 3.49Å; H119-L123 PolarHBondContact O-N 2.86Å
120	K	85.9	Confident	82.4	Confident	138 Å²	138	98.3 Å²	98.3	60%	0.6	47%	0.473	S	S	*	.	H	α-helix	trans	-66.1	-38.4	176.2	-174.2	175	-179.3	178.9	0	112.1	G116 I117 E118 Q124	G116-K120 VanDerWaalsContact O-CB 3.31Å; G116-K120 WeakPolarHBondContact O-CB 3.48Å; G116-K120 PolarHBondContact O-N 3.11Å; G116-K120 VanDerWaalsContact O-N 3.1Å; I117-K120 PolarHBondContact O-N 2.93Å; E118-K120 VanDerWaalsContact C-N 3.32Å; E118-K120 PolarHBondContact O-N 3Å; K120-Q124 WeakPolarHBondContact O-CG 3.32Å; K120-Q124 PolarHBondContact O-N 3.45Å; K120-Q124 VanDerWaalsContact O-N 3.13Å
121	H	81.3	Confident	82.2	Confident	108 Å²	108	93 Å²	93	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-71.1	-39.6	176.2	-174	44.3	0	0	0	112	I117 E118 L123 Q124 L125	I117-H121 PolarHBondContact O-N 2.83Å; E118-H121 PolarHBondContact O-N 3.45Å; H121-L123 VanDerWaalsContact C-N 3.35Å; H121-Q124 PolarHBondContact O-N 3.49Å; H121-L125 PolarHBondContact O-N 3.27Å
122	V	82.5	Confident	82	Confident	77 Å²	77	87.5 Å²	87.5	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-62.1	-40.8	173.2	169.6	0	0	0	0	111.4	E118 H119 L125 L126	E118-V122 WeakPolarHBondContact O-CB 3.43Å; E118-V122 WeakPolarHBondContact O-CG2 3.3Å; E118-V122 PolarHBondContact O-N 3.13Å; H119-V122 PolarHBondContact O-N 3.01Å; V122-L125 PolarHBondContact O-N 3.11Å; V122-L126 HydrophobicContact CG1-CD1 3.96Å; V122-L126 HydrophobicContact CG1-CG 4.43Å; V122-L126 WeakPolarHBondContact O-CB 3.36Å; V122-L126 VanDerWaalsContact O-CG 3.3Å; V122-L126 WeakPolarHBondContact O-CG 3.46Å; V122-L126 PolarHBondContact O-N 3.39Å
123	L	83.1	Confident	81.9	Confident	102 Å²	102	89.7 Å²	89.7	53%	0.534	44%	0.444	S	S	.	.	H	α-helix	trans	-60.9	-46.1	173.1	-78.5	165.6	0	0	0	111.8	H119 H121 L125 L126 D127	H119-L123 WeakPolarHBondContact O-CB 3.49Å; H119-L123 WeakPolarHBondContact O-CG 3.49Å; H119-L123 PolarHBondContact O-N 2.86Å; H121-L123 VanDerWaalsContact C-N 3.35Å; L123-L125 VanDerWaalsContact C-N 3.33Å; L123-L125 PolarHBondContact O-N 2.91Å; L123-L126 PolarHBondContact O-N 2.91Å; L123-L126 VanDerWaalsContact O-N 3.11Å; L123-D127 VanDerWaalsContact O-CG 3.29Å; L123-D127 PolarHBondContact O-N 3.34Å
124	Q	81.8	Confident	81.9	Confident	98 Å²	98	84.6 Å²	84.6	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-59.4	-41.9	175.9	-72	173.9	-36.5	0	0	112.5	K120 H121 D127 E128	K120-Q124 WeakPolarHBondContact O-CG 3.32Å; K120-Q124 PolarHBondContact O-N 3.45Å; K120-Q124 VanDerWaalsContact O-N 3.13Å; H121-Q124 PolarHBondContact O-N 3.49Å; Q124-D127 PolarHBondContact O-N 2.98Å; Q124-E128 WeakPolarHBondContact O-CG 3.37Å; Q124-E128 PolarHBondContact O-N 2.97Å
125	L	77.1	Confident	81.7	Confident	49 Å²	49	82 Å²	82	26%	0.257	41%	0.414	S	S	.	.	H	α-helix	trans	-64.7	-37.9	174.6	-76.8	161.4	0	0	0	112.4	H121 V122 L123 I129 L166	H121-L125 PolarHBondContact O-N 3.27Å; V122-L125 PolarHBondContact O-N 3.11Å; L123-L125 VanDerWaalsContact C-N 3.33Å; L123-L125 PolarHBondContact O-N 2.91Å; L125-I129 WeakPolarHBondContact O-CB 3.44Å; L125-I129 WeakPolarHBondContact O-CD1 3.42Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 2.85Å; L125-L166 HydrophobicContact CD2-CD2 3.81Å
126	L	78.6	Confident	81.5	Confident	96 Å²	96	79.7 Å²	79.7	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-68.6	-41.3	176.1	-73.1	169.2	0	0	0	112	V122 L123 I129 E130	V122-L126 HydrophobicContact CG1-CD1 3.96Å; V122-L126 HydrophobicContact CG1-CG 4.43Å; V122-L126 WeakPolarHBondContact O-CB 3.36Å; V122-L126 VanDerWaalsContact O-CG 3.3Å; V122-L126 WeakPolarHBondContact O-CG 3.46Å; V122-L126 PolarHBondContact O-N 3.39Å; L123-L126 PolarHBondContact O-N 2.91Å; L123-L126 VanDerWaalsContact O-N 3.11Å; L126-I129 PolarHBondContact O-N 3Å; L126-E130 WeakPolarHBondContact O-CB 3.43Å; L126-E130 PolarHBondContact O-N 3.37Å
127	D	81.2	Confident	81.4	Confident	102 Å²	102	84.7 Å²	84.7	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-43.5	174.4	-67	-26.8	0	0	0	110.9	L123 Q124 E130 S131	L123-D127 VanDerWaalsContact O-CG 3.29Å; L123-D127 PolarHBondContact O-N 3.34Å; Q124-D127 PolarHBondContact O-N 2.98Å; D127-E130 PolarHBondContact O-N 2.82Å; D127-S131 WeakPolarHBondContact O-CB 3.18Å; D127-S131 PolarHBondContact O-N 3.28Å
128	E	76.4	Confident	81.2	Confident	85 Å²	85	86.7 Å²	86.7	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-45.4	173.9	-76.2	-177.7	-166.6	0	0	111.7	Q124 S131 I132 L166	Q124-E128 WeakPolarHBondContact O-CG 3.37Å; Q124-E128 PolarHBondContact O-N 2.97Å; E128-S131 PolarHBondContact O-N 3.35Å; E128-S131 PolarHBondContact O-OG 3.44Å; E128-I132 WeakPolarHBondContact O-CG1 3.39Å; E128-I132 PolarHBondContact O-N 3.18Å; E128-L166 HydrophobicContact CB-CD1 4.32Å
129	I	79.4	Confident	81.1	Confident	43 Å²	43	81.5 Å²	81.5	22%	0.221	40%	0.395	C	S	.	.	H	α-helix	trans	-62.6	-43.6	177	-73.8	167	0	0	0	111.6	L125 L126 I132 K133 L166 L172	L125-I129 WeakPolarHBondContact O-CB 3.44Å; L125-I129 WeakPolarHBondContact O-CD1 3.42Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 2.85Å; L126-I129 PolarHBondContact O-N 3Å; I129-I132 PolarHBondContact O-N 3.33Å; I129-K133 WeakPolarHBondContact O-CB 3.3Å; I129-K133 PolarHBondContact O-N 2.82Å; I129-L166 HydrophobicContact CD1-CD2 4.21Å; I129-L166 HydrophobicContact CG1-CD2 3.87Å; I129-L172 HydrophobicContact CG1-CD1 4.13Å; I129-L172 HydrophobicContact CG2-CD2 4.2Å
130	E	79.4	Confident	81	Confident	111 Å²	111	80.4 Å²	80.4	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-63.7	-42.5	176.7	-179.7	164.9	-172.6	0	0	111.1	L126 D127 I132 K133 Q134	L126-E130 WeakPolarHBondContact O-CB 3.43Å; L126-E130 PolarHBondContact O-N 3.37Å; D127-E130 PolarHBondContact O-N 2.82Å; E130-I132 VanDerWaalsContact C-N 3.3Å; E130-I132 PolarHBondContact O-N 3.29Å; E130-K133 PolarHBondContact O-N 3.32Å; E130-Q134 WeakPolarHBondContact O-CG 3.49Å; E130-Q134 PolarHBondContact O-N 2.93Å; E130-Q134 PolarHBondContact OE1-NE2 3.18Å
131	S	77.9	Confident	80.9	Confident	62 Å²	62	78.3 Å²	78.3	43%	0.434	39%	0.389	S	S	.	.	H	α-helix	trans	-58.5	-42	176.6	82.2	0	0	0	0	112.1	D127 E128 Q134	D127-S131 WeakPolarHBondContact O-CB 3.18Å; D127-S131 PolarHBondContact O-N 3.28Å; E128-S131 PolarHBondContact O-N 3.35Å; E128-S131 PolarHBondContact O-OG 3.44Å; S131-Q134 PolarHBondContact O-N 2.71Å
132	I	80.6	Confident	80.8	Confident	9 Å²	9	77 Å²	77	5%	0.046	38%	0.38	C	S	.	.	H	α-helix	trans	-74.9	-35.7	-179.7	-66.8	162.8	0	0	0	111.4	E128 I129 E130 Q134 V135 L162 L166 L175 L179	E128-I132 WeakPolarHBondContact O-CG1 3.39Å; E128-I132 PolarHBondContact O-N 3.18Å; I129-I132 PolarHBondContact O-N 3.33Å; E130-I132 VanDerWaalsContact C-N 3.3Å; E130-I132 PolarHBondContact O-N 3.29Å; I132-Q134 PolarHBondContact O-N 3.28Å; I132-V135 VanDerWaalsContact O-CB 3.32Å; I132-V135 WeakPolarHBondContact O-CB 3.4Å; I132-V135 PolarHBondContact O-N 2.95Å; I132-L162 HydrophobicContact CD1-CG 4.41Å; I132-L162 HydrophobicContact CG2-CD1 3.8Å; I132-L162 HydrophobicContact CG2-CD2 3.99Å; I132-L162 HydrophobicContact CG2-CG 3.91Å; I132-L166 HydrophobicContact CD1-CD1 3.25Å; I132-L175 HydrophobicContact CG2-CD2 4Å; I132-L179 HydrophobicContact CG2-CD1 4.23Å
133	K	80.6	Confident	80.7	Confident	154 Å²	154	75.7 Å²	75.7	67%	0.67	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-29	173.8	-175.5	-179.8	175.9	-174.6	0	112.6	I129 E130 P136	I129-K133 WeakPolarHBondContact O-CB 3.3Å; I129-K133 PolarHBondContact O-N 2.82Å; E130-K133 PolarHBondContact O-N 3.32Å; K133-P136 WeakPolarHBondContact O-CD 3.48Å
134	Q	82.2	Confident	80.6	Confident	63 Å²	63	74.8 Å²	74.8	29%	0.294	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-11.4	176.1	-64.4	-178.6	25.3	0	0	113.8	E130 S131 I132 R138	E130-Q134 WeakPolarHBondContact O-CG 3.49Å; E130-Q134 PolarHBondContact O-N 2.93Å; E130-Q134 PolarHBondContact OE1-NE2 3.18Å; S131-Q134 PolarHBondContact O-N 2.71Å; I132-Q134 PolarHBondContact O-N 3.28Å; Q134-R138 WeakPolarHBondContact O-CG 3.15Å; Q134-R138 PolarHBondContact O-N 2.88Å
135	V	83.3	Confident	80.4	Confident	12 Å²	12	72.5 Å²	72.5	7%	0.073	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-44.9	-177.4	171.1	0	0	0	0	113.5	I132 Q137 R138 L139 M154 A158 L179	I132-V135 VanDerWaalsContact O-CB 3.32Å; I132-V135 WeakPolarHBondContact O-CB 3.4Å; I132-V135 PolarHBondContact O-N 2.95Å; V135-Q137 PolarHBondContact O-N 3.07Å; V135-R138 PolarHBondContact O-N 2.87Å; V135-L139 VanDerWaalsContact O-CB 3.23Å; V135-L139 WeakPolarHBondContact O-CB 3.4Å; V135-L139 PolarHBondContact O-N 3.44Å; V135-M154 HydrophobicContact CG1-CE 4.03Å; V135-A158 HydrophobicContact CB-CB 4.41Å; V135-A158 HydrophobicContact CG1-CB 3.89Å; V135-A158 HydrophobicContact CG2-CB 4Å; V135-L179 HydrophobicContact CG1-CD2 3.87Å
136	P	81.8	Confident	80.6	Confident	12 Å²	12	72.6 Å²	72.6	8%	0.078	37%	0.371	C	S	.	.	H	α-helix	trans	-59.1	-44.4	-178.7	-25.6	34.7	0	0	0	113.9	K133 L139 E140 L175 L179	K133-P136 WeakPolarHBondContact O-CD 3.48Å; P136-L139 WeakPolarHBondContact O-CB 3.47Å; P136-L139 PolarHBondContact O-N 2.8Å; P136-E140 PolarHBondContact O-N 3.09Å; P136-L175 HydrophobicContact CG-CD1 3.69Å; P136-L179 HydrophobicContact CG-CD2 4.19Å
137	Q	83.3	Confident	80.8	Confident	144 Å²	144	72 Å²	72	67%	0.673	37%	0.365	S	S	*	.	H	α-helix	trans	-67.3	-41.8	179.2	-69.9	-179.6	-18.7	0	0	112.3	V135 L139 E140 T141	V135-Q137 PolarHBondContact O-N 3.07Å; Q137-L139 VanDerWaalsContact C-N 3.33Å; Q137-E140 PolarHBondContact O-N 2.87Å; Q137-T141 PolarHBondContact O-N 3.27Å; Q137-T141 VanDerWaalsContact O-N 3.11Å; Q137-T141 PolarHBondContact O-OG1 3.41Å
138	R	81.2	Confident	80.8	Confident	125 Å²	125	67.8 Å²	67.8	47%	0.472	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-37.9	174.2	-67.2	178.1	-174.1	-170.3	2.4	111.4	Q134 V135 T141 Y142 M154	Q134-R138 WeakPolarHBondContact O-CG 3.15Å; Q134-R138 PolarHBondContact O-N 2.88Å; V135-R138 PolarHBondContact O-N 2.87Å; R138-T141 PolarHBondContact O-N 3.36Å; R138-Y142 HydrophobicContact CB-CE2 4.5Å; R138-Y142 WeakPolarHBondContact O-CD2 3.39Å; R138-Y142 PolarHBondContact O-N 3Å; R138-M154 HydrophobicContact CB-CE 3.58Å; R138-M154 HydrophobicContact CB-SD 4.32Å
139	L	81.8	Confident	81.1	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-45.7	176.3	-178.9	69.2	0	0	0	111.3	V135 P136 Q137 T141 Y142 M143 A151 M154 L155 K182 I186	V135-L139 VanDerWaalsContact O-CB 3.23Å; V135-L139 WeakPolarHBondContact O-CB 3.4Å; V135-L139 PolarHBondContact O-N 3.44Å; P136-L139 WeakPolarHBondContact O-CB 3.47Å; P136-L139 PolarHBondContact O-N 2.8Å; Q137-L139 VanDerWaalsContact C-N 3.33Å; L139-T141 VanDerWaalsContact C-N 3.31Å; L139-T141 PolarHBondContact O-N 3.05Å; L139-Y142 PolarHBondContact O-N 2.9Å; L139-M143 HydrophobicContact CG-SD 4.2Å; L139-M143 WeakPolarHBondContact O-CB 3.32Å; L139-M143 VanDerWaalsContact O-CG 3.31Å; L139-M143 WeakPolarHBondContact O-CG 3.36Å; L139-M143 PolarHBondContact O-N 3.34Å; L139-A151 HydrophobicContact CD1-CB 3.84Å; L139-A151 WeakPolarHBondContact CD1-O 3.49Å; L139-M154 HydrophobicContact CB-CE 4.37Å; L139-L155 HydrophobicContact CD1-CB 4.22Å; L139-L155 HydrophobicContact CD1-CD2 4.42Å; L139-L155 HydrophobicContact CD2-CD1 4.18Å; L139-L155 HydrophobicContact CD2-CD2 4.11Å; L139-K182 HydrophobicContact CD2-CB 4.08Å; L139-K182 HydrophobicContact CD2-CD 4.46Å; L139-K182 HydrophobicContact CD2-CG 4.43Å; L139-I186 HydrophobicContact CD1-CD1 4.41Å
140	E	82.1	Confident	81.2	Confident	98 Å²	98	68.8 Å²	68.8	46%	0.458	35%	0.346	S	S	.	.	H	α-helix	trans	-63.1	-38.5	176.4	-72.3	178.6	172.1	0	0	112	P136 Q137 M143 A144 K182	P136-E140 PolarHBondContact O-N 3.09Å; Q137-E140 PolarHBondContact O-N 2.87Å; E140-M143 PolarHBondContact O-N 3.44Å; E140-A144 WeakPolarHBondContact O-CB 3.46Å; E140-A144 PolarHBondContact O-N 2.84Å; E140-K182 IonicContact OE1-NZ 3.93Å; E140-K182 PolarHBondContact OE1-NZ 2.94Å
141	T	83	Confident	81.4	Confident	94 Å²	94	63.5 Å²	63.5	58%	0.577	32%	0.322	S	S	*	.	H	α-helix	trans	-63.7	-44	175.1	-51.3	0	0	0	0	111.8	Q137 R138 L139 A144 S145	Q137-T141 PolarHBondContact O-N 3.27Å; Q137-T141 VanDerWaalsContact O-N 3.11Å; Q137-T141 PolarHBondContact O-OG1 3.41Å; R138-T141 PolarHBondContact O-N 3.36Å; L139-T141 VanDerWaalsContact C-N 3.31Å; L139-T141 PolarHBondContact O-N 3.05Å; T141-A144 PolarHBondContact O-N 3.15Å; T141-S145 PolarHBondContact O-N 3.21Å; T141-S145 PolarHBondContact O-OG 3.26Å
142	Y	79.8	Confident	81.6	Confident	79 Å²	79	60.5 Å²	60.5	31%	0.31	30%	0.301	S	S	.	.	H	α-helix	trans	-72.6	-28.1	176.7	-72.1	-56.6	0	0	0	113.9	R138 L139 S145 K146 H147 H150 M154	R138-Y142 HydrophobicContact CB-CE2 4.5Å; R138-Y142 WeakPolarHBondContact O-CD2 3.39Å; R138-Y142 PolarHBondContact O-N 3Å; L139-Y142 PolarHBondContact O-N 2.9Å; Y142-S145 WeakPolarHBondContact CA-OG 3.47Å; Y142-S145 PolarHBondContact O-OG 2.83Å; Y142-K146 PolarHBondContact O-N 2.74Å; Y142-H147 HydrophobicContact CD1-CB 4.03Å; Y142-H147 PolarHBondContact O-N 2.78Å; Y142-H150 AromaticContact CD2-CD2 3.9Å; Y142-H150 AromaticContact CE1-CD2 3.87Å; Y142-H150 AromaticContact CE2-CD2 3.49Å; Y142-H150 VanDerWaalsContact CE2-CD2 3.49Å; Y142-H150 WeakPolarHBondContact CE2-CD2 3.31Å; Y142-H150 AromaticContact CE2-NE2 3.77Å; Y142-H150 AromaticContact CZ-CD2 3.48Å; Y142-H150 VanDerWaalsContact CZ-CD2 3.48Å; Y142-H150 AromaticContact CZ-NE2 3.68Å; Y142-M154 HydrophobicContact CD2-CE 4.23Å; Y142-M154 HydrophobicContact CD2-SD 4.43Å; Y142-M154 HydrophobicContact CE2-CE 4.43Å; Y142-M154 HydrophobicContact CE2-SD 4.11Å
143	M	80.6	Confident	81.8	Confident	50 Å²	50	63.1 Å²	63.1	25%	0.246	32%	0.315	C	S	.	.	H	α-helix	trans	-69.9	-43	171.1	-75.4	-178.5	64.6	0	0	111.3	L139 E140 S145 K146 V189	L139-M143 HydrophobicContact CG-SD 4.2Å; L139-M143 WeakPolarHBondContact O-CB 3.32Å; L139-M143 VanDerWaalsContact O-CG 3.31Å; L139-M143 WeakPolarHBondContact O-CG 3.36Å; L139-M143 PolarHBondContact O-N 3.34Å; E140-M143 PolarHBondContact O-N 3.44Å; M143-S145 VanDerWaalsContact C-N 3.33Å; M143-S145 PolarHBondContact O-N 2.95Å; M143-K146 PolarHBondContact O-N 2.92Å; M143-K146 VanDerWaalsContact O-N 3.15Å; M143-V189 HydrophobicContact CE-CG1 4.37Å; M143-V189 HydrophobicContact CE-CG2 4.25Å
144	A	79.5	Confident	81.8	Confident	84 Å²	84	57.5 Å²	57.5	69%	0.694	29%	0.292	S	S	*	.	H	α-helix	trans	-63.8	-37.2	176	0	0	0	0	0	112.4	E140 T141 K146	E140-A144 WeakPolarHBondContact O-CB 3.46Å; E140-A144 PolarHBondContact O-N 2.84Å; T141-A144 PolarHBondContact O-N 3.15Å; A144-K146 VanDerWaalsContact C-N 3.28Å; A144-K146 PolarHBondContact O-N 3.35Å
145	S	79.5	Confident	81.8	Confident	50 Å²	50	54.5 Å²	54.5	35%	0.35	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9.8	174.6	69.5	0	0	0	0	114.4	T141 Y142 M143 H147	T141-S145 PolarHBondContact O-N 3.21Å; T141-S145 PolarHBondContact O-OG 3.26Å; Y142-S145 WeakPolarHBondContact CA-OG 3.47Å; Y142-S145 PolarHBondContact O-OG 2.83Å; M143-S145 VanDerWaalsContact C-N 3.33Å; M143-S145 PolarHBondContact O-N 2.95Å; S145-H147 PolarHBondContact O-CE1 3.13Å; S145-H147 PolarHBondContact O-N 2.89Å; S145-H147 VanDerWaalsContact O-N 3.08Å; S145-H147 PolarHBondContact O-ND1 3.46Å; S145-H147 PolarHBondContact OG-ND1 3.38Å; S145-H147 VanDerWaalsContact OG-ND1 3.09Å
146	K	80	Confident	81.9	Confident	51 Å²	51	54.6 Å²	54.6	22%	0.222	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	19.9	176.4	-60.1	179.1	176.9	173.3	0	115.6	Y142 M143 A144 Y148 E278	Y142-K146 PolarHBondContact O-N 2.74Å; M143-K146 PolarHBondContact O-N 2.92Å; M143-K146 VanDerWaalsContact O-N 3.15Å; A144-K146 VanDerWaalsContact C-N 3.28Å; A144-K146 PolarHBondContact O-N 3.35Å; K146-Y148 HydrophobicContact CB-CD2 4.24Å; K146-Y148 HydrophobicContact CB-CE2 3.73Å; K146-Y148 HydrophobicContact CG-CE2 3.97Å; K146-Y148 WeakPolarHBondContact O-CD2 3.45Å; K146-Y148 PolarHBondContact O-N 3.42Å; K146-E278 IonicContact NZ-OE1 3.55Å; K146-E278 PolarHBondContact NZ-OE1 2.93Å
147	H	82.7	Confident	82	Confident	84 Å²	84	57.5 Å²	57.5	39%	0.389	30%	0.296	S	S	.	.			trans	-80.7	53.8	176.1	-73.7	79.1	0	0	0	111.6	Y142 S145 L149 H150 A151	Y142-H147 HydrophobicContact CD1-CB 4.03Å; Y142-H147 PolarHBondContact O-N 2.78Å; S145-H147 PolarHBondContact O-CE1 3.13Å; S145-H147 PolarHBondContact O-N 2.89Å; S145-H147 VanDerWaalsContact O-N 3.08Å; S145-H147 PolarHBondContact O-ND1 3.46Å; S145-H147 PolarHBondContact OG-ND1 3.38Å; S145-H147 VanDerWaalsContact OG-ND1 3.09Å; H147-L149 VanDerWaalsContact C-N 3.31Å; H147-L149 PolarHBondContact O-N 3.14Å; H147-H150 PolarHBondContact O-N 3.28Å; H147-H150 VanDerWaalsContact O-N 3.15Å; H147-A151 PolarHBondContact O-N 3.45Å
148	Y	82.6	Confident	81.8	Confident	13 Å²	13	51 Å²	51	5%	0.051	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-33.9	-166.3	-69	-68.4	0	0	0	115	K146 T152 V189 L190 E193 F284 L288	K146-Y148 HydrophobicContact CB-CD2 4.24Å; K146-Y148 HydrophobicContact CB-CE2 3.73Å; K146-Y148 HydrophobicContact CG-CE2 3.97Å; K146-Y148 WeakPolarHBondContact O-CD2 3.45Å; K146-Y148 PolarHBondContact O-N 3.42Å; Y148-T152 VanDerWaalsContact O-CB 3.24Å; Y148-T152 WeakPolarHBondContact O-CB 3.37Å; Y148-T152 PolarHBondContact O-N 2.97Å; Y148-T152 PolarHBondContact O-OG1 3.26Å; Y148-V189 HydrophobicContact CE1-CG1 3.98Å; Y148-L190 HydrophobicContact CD1-CD2 4.15Å; Y148-L190 HydrophobicContact CG-CD2 3.99Å; Y148-E193 HydrophobicContact CE2-CG 4.21Å; Y148-F284 HydrophobicContact CD2-CE2 4.31Å; Y148-F284 AromaticContact CD2-CZ 3.87Å; Y148-F284 HydrophobicContact CD2-CZ 3.87Å; Y148-F284 AromaticContact CE2-CZ 3.85Å; Y148-F284 HydrophobicContact CE2-CZ 3.85Å; Y148-L288 HydrophobicContact CD2-CD2 3.72Å; Y148-L288 HydrophobicContact CE2-CD2 4.34Å; Y148-L288 HydrophobicContact CG-CD2 4.09Å
149	L	81.7	Confident	81.8	Confident	52 Å²	52	45.2 Å²	45.2	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-68.8	-42.6	178.6	-179.8	64.1	0	0	0	112	H147 T152 D153 I287 K290 A291 K294	H147-L149 VanDerWaalsContact C-N 3.31Å; H147-L149 PolarHBondContact O-N 3.14Å; L149-T152 PolarHBondContact O-N 3.15Å; L149-D153 WeakPolarHBondContact O-CB 3.19Å; L149-D153 PolarHBondContact O-N 3.38Å; L149-I287 HydrophobicContact CB-CG2 3.75Å; L149-K290 HydrophobicContact CD1-CB 4.03Å; L149-A291 HydrophobicContact CD1-CB 4.31Å; L149-K294 HydrophobicContact CD1-CD 4.15Å
150	H	80.7	Confident	81.8	Confident	96 Å²	96	51.7 Å²	51.7	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-71.1	-43.2	177.9	-170.1	82.1	0	0	0	111.1	Y142 H147 T152 D153 M154	Y142-H150 AromaticContact CD2-CD2 3.9Å; Y142-H150 AromaticContact CE1-CD2 3.87Å; Y142-H150 AromaticContact CE2-CD2 3.49Å; Y142-H150 VanDerWaalsContact CE2-CD2 3.49Å; Y142-H150 WeakPolarHBondContact CE2-CD2 3.31Å; Y142-H150 AromaticContact CE2-NE2 3.77Å; Y142-H150 AromaticContact CZ-CD2 3.48Å; Y142-H150 VanDerWaalsContact CZ-CD2 3.48Å; Y142-H150 AromaticContact CZ-NE2 3.68Å; H147-H150 PolarHBondContact O-N 3.28Å; H147-H150 VanDerWaalsContact O-N 3.15Å; H150-T152 VanDerWaalsContact C-N 3.3Å; H150-T152 PolarHBondContact O-N 3.04Å; H150-D153 PolarHBondContact O-N 3.48Å; H150-M154 WeakPolarHBondContact O-CB 3.31Å; H150-M154 PolarHBondContact O-N 3.45Å
151	A	83.9	Confident	81.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-52.1	-47.8	171	0	0	0	0	0	112.2	L139 H147 L155 I186	L139-A151 HydrophobicContact CD1-CB 3.84Å; L139-A151 WeakPolarHBondContact CD1-O 3.49Å; H147-A151 PolarHBondContact O-N 3.45Å; A151-L155 VanDerWaalsContact O-CB 3.29Å; A151-L155 WeakPolarHBondContact O-CB 3.38Å; A151-L155 PolarHBondContact O-N 2.91Å; A151-I186 HydrophobicContact CB-CD1 4.48Å
152	T	82.8	Confident	81.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-40.7	179.5	-60.8	0	0	0	0	112.2	Y148 L149 H150 L155 V156 A291 K294 L295	Y148-T152 VanDerWaalsContact O-CB 3.24Å; Y148-T152 WeakPolarHBondContact O-CB 3.37Å; Y148-T152 PolarHBondContact O-N 2.97Å; Y148-T152 PolarHBondContact O-OG1 3.26Å; L149-T152 PolarHBondContact O-N 3.15Å; H150-T152 VanDerWaalsContact C-N 3.3Å; H150-T152 PolarHBondContact O-N 3.04Å; T152-L155 PolarHBondContact O-N 3.44Å; T152-V156 HydrophobicContact CG2-CG2 4.34Å; T152-V156 WeakPolarHBondContact O-CB 3.43Å; T152-V156 VanDerWaalsContact O-CG2 3.29Å; T152-V156 WeakPolarHBondContact O-CG2 3.39Å; T152-V156 PolarHBondContact O-N 3.46Å; T152-A291 HydrophobicContact CG2-CB 4.33Å; T152-K294 HydrophobicContact CG2-CB 4.25Å; T152-L295 HydrophobicContact CG2-CD1 3.91Å; T152-L295 HydrophobicContact CG2-CD2 3.92Å; T152-L295 HydrophobicContact CG2-CG 3.6Å
153	D	84	Confident	80.7	Confident	64 Å²	64	45.3 Å²	45.3	34%	0.342	25%	0.245	S	C	.	.	H	α-helix	trans	-68.4	-43.3	-179.4	-152.2	33.8	0	0	0	112.4	L149 H150 L155 V156 T157 K294	L149-D153 WeakPolarHBondContact O-CB 3.19Å; L149-D153 PolarHBondContact O-N 3.38Å; H150-D153 PolarHBondContact O-N 3.48Å; D153-L155 VanDerWaalsContact C-N 3.33Å; D153-L155 PolarHBondContact O-N 2.76Å; D153-V156 PolarHBondContact O-N 3.29Å; D153-T157 VanDerWaalsContact O-CB 3.31Å; D153-T157 WeakPolarHBondContact O-CB 3.16Å; D153-T157 PolarHBondContact O-N 3.11Å; D153-T157 PolarHBondContact O-OG1 3.37Å; D153-K294 HydrophobicContact CB-CD 4.45Å; D153-K294 IonicContact OD1-NZ 2.9Å; D153-K294 PolarHBondContact OD1-NZ 3.45Å; D153-K294 IonicContact OD2-NZ 3.97Å; D153-K294 PolarHBondContact OD2-NZ 3.42Å
154	M	82.3	Confident	80.3	Confident	36 Å²	36	44.8 Å²	44.8	18%	0.177	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-41.4	175.7	-162.7	-179.8	77	0	0	110.8	V135 R138 L139 Y142 H150 A158	V135-M154 HydrophobicContact CG1-CE 4.03Å; R138-M154 HydrophobicContact CB-CE 3.58Å; R138-M154 HydrophobicContact CB-SD 4.32Å; L139-M154 HydrophobicContact CB-CE 4.37Å; Y142-M154 HydrophobicContact CD2-CE 4.23Å; Y142-M154 HydrophobicContact CD2-SD 4.43Å; Y142-M154 HydrophobicContact CE2-CE 4.43Å; Y142-M154 HydrophobicContact CE2-SD 4.11Å; H150-M154 WeakPolarHBondContact O-CB 3.31Å; H150-M154 PolarHBondContact O-N 3.45Å; M154-A158 VanDerWaalsContact O-CB 3.28Å; M154-A158 WeakPolarHBondContact O-CB 3.41Å; M154-A158 PolarHBondContact O-N 3.02Å
155	L	82.3	Confident	79.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.8	-44.4	176	-179.5	58.4	0	0	0	113.1	L139 A151 T152 D153 T157 A158 V159 L179 K183 I186	L139-L155 HydrophobicContact CD1-CB 4.22Å; L139-L155 HydrophobicContact CD1-CD2 4.42Å; L139-L155 HydrophobicContact CD2-CD1 4.18Å; L139-L155 HydrophobicContact CD2-CD2 4.11Å; A151-L155 VanDerWaalsContact O-CB 3.29Å; A151-L155 WeakPolarHBondContact O-CB 3.38Å; A151-L155 PolarHBondContact O-N 2.91Å; T152-L155 PolarHBondContact O-N 3.44Å; D153-L155 VanDerWaalsContact C-N 3.33Å; D153-L155 PolarHBondContact O-N 2.76Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 2.89Å; L155-A158 PolarHBondContact O-N 3.31Å; L155-V159 HydrophobicContact CD1-CG2 4.16Å; L155-V159 WeakPolarHBondContact O-CB 3.44Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 3.08Å; L155-L179 HydrophobicContact CD1-CB 4.29Å; L155-L179 HydrophobicContact CD1-CD2 3.67Å; L155-K183 HydrophobicContact CD2-CB 4.08Å; L155-K183 HydrophobicContact CG-CB 4.29Å; L155-I186 HydrophobicContact CD2-CB 4.48Å; L155-I186 HydrophobicContact CD2-CD1 4.2Å; L155-I186 HydrophobicContact CD2-CG2 4Å
156	V	84.3	Confident	78.9	Confident	14 Å²	14	42.8 Å²	42.8	9%	0.085	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-37	176.9	167.7	0	0	0	0	110.9	T152 D153 K160 L295	T152-V156 HydrophobicContact CG2-CG2 4.34Å; T152-V156 WeakPolarHBondContact O-CB 3.43Å; T152-V156 VanDerWaalsContact O-CG2 3.29Å; T152-V156 WeakPolarHBondContact O-CG2 3.39Å; T152-V156 PolarHBondContact O-N 3.46Å; D153-V156 PolarHBondContact O-N 3.29Å; V156-K160 HydrophobicContact CG1-CD 4.39Å; V156-K160 VanDerWaalsContact O-CG 3.3Å; V156-K160 WeakPolarHBondContact O-CG 3.23Å; V156-K160 PolarHBondContact O-N 2.95Å; V156-K160 VanDerWaalsContact O-N 3.16Å; V156-L295 HydrophobicContact CG2-CD2 3.95Å
157	T	83.3	Confident	78.2	Confident	73 Å²	73	46.1 Å²	46.1	45%	0.448	25%	0.246	S	C	.	.	H	α-helix	trans	-69.9	-47.9	176.4	-55.7	0	0	0	0	111.3	D153 L155 V159 K160 S161	D153-T157 VanDerWaalsContact O-CB 3.31Å; D153-T157 WeakPolarHBondContact O-CB 3.16Å; D153-T157 PolarHBondContact O-N 3.11Å; D153-T157 PolarHBondContact O-OG1 3.37Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 2.89Å; T157-V159 VanDerWaalsContact C-N 3.34Å; T157-V159 PolarHBondContact O-N 3.15Å; T157-K160 WeakPolarHBondContact O-CB 3.24Å; T157-K160 PolarHBondContact O-N 3.22Å; T157-K160 VanDerWaalsContact O-N 3.13Å; T157-S161 PolarHBondContact O-N 2.86Å; T157-S161 PolarHBondContact O-OG 3.31Å
158	A	80.8	Confident	77.2	Confident	7 Å²	7	50.7 Å²	50.7	6%	0.058	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-41.3	177.3	0	0	0	0	0	112.8	V135 M154 L155 S161 L162	V135-A158 HydrophobicContact CB-CB 4.41Å; V135-A158 HydrophobicContact CG1-CB 3.89Å; V135-A158 HydrophobicContact CG2-CB 4Å; M154-A158 VanDerWaalsContact O-CB 3.28Å; M154-A158 WeakPolarHBondContact O-CB 3.41Å; M154-A158 PolarHBondContact O-N 3.02Å; L155-A158 PolarHBondContact O-N 3.31Å; A158-S161 PolarHBondContact O-N 2.81Å; A158-L162 WeakPolarHBondContact O-CB 3.29Å; A158-L162 WeakPolarHBondContact O-CG 3.28Å; A158-L162 PolarHBondContact O-N 3.18Å
159	V	81.1	Confident	76.7	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-39.2	175.6	171.3	0	0	0	0	111.5	L155 T157 L162 E163 L179 K183	L155-V159 HydrophobicContact CD1-CG2 4.16Å; L155-V159 WeakPolarHBondContact O-CB 3.44Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 3.08Å; T157-V159 VanDerWaalsContact C-N 3.34Å; T157-V159 PolarHBondContact O-N 3.15Å; V159-L162 PolarHBondContact O-N 2.71Å; V159-E163 WeakPolarHBondContact O-CB 3.41Å; V159-E163 WeakPolarHBondContact O-CG 3.13Å; V159-E163 PolarHBondContact O-N 3.05Å; V159-L179 HydrophobicContact CG2-CB 4.13Å; V159-K183 HydrophobicContact CB-CD 4.45Å; V159-K183 HydrophobicContact CG1-CD 4.17Å; V159-K183 HydrophobicContact CG2-CD 4.2Å
160	K	80.8	Confident	75.8	Confident	138 Å²	138	59 Å²	59	60%	0.6	31%	0.309	S	S	*	.	H	α-helix	trans	-63.1	-42.9	173.7	-74.7	170.6	-178.9	177	0	112.2	V156 T157 L162 E163 G164	V156-K160 HydrophobicContact CG1-CD 4.39Å; V156-K160 VanDerWaalsContact O-CG 3.3Å; V156-K160 WeakPolarHBondContact O-CG 3.23Å; V156-K160 PolarHBondContact O-N 2.95Å; V156-K160 VanDerWaalsContact O-N 3.16Å; T157-K160 WeakPolarHBondContact O-CB 3.24Å; T157-K160 PolarHBondContact O-N 3.22Å; T157-K160 VanDerWaalsContact O-N 3.13Å; K160-L162 VanDerWaalsContact C-N 3.35Å; K160-L162 PolarHBondContact O-N 2.96Å; K160-E163 PolarHBondContact O-N 3.1Å; K160-G164 PolarHBondContact O-N 2.99Å
161	S	77.8	Confident	75.3	Confident	45 Å²	45	58 Å²	58	32%	0.315	32%	0.324	S	S	.	.	H	α-helix	trans	-64.4	-38.1	177.9	-58.4	0	0	0	0	112.5	T157 A158 E163 G164 P165	T157-S161 PolarHBondContact O-N 2.86Å; T157-S161 PolarHBondContact O-OG 3.31Å; A158-S161 PolarHBondContact O-N 2.81Å; S161-E163 VanDerWaalsContact C-N 3.33Å; S161-G164 PolarHBondContact O-N 3.02Å; S161-P165 WeakPolarHBondContact O-CD 3.48Å
162	L	72.1	Confident	74.6	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-69.8	-25.6	174.6	-77.8	167.1	0	0	0	114.2	I132 A158 V159 K160 L172 L179	I132-L162 HydrophobicContact CD1-CG 4.41Å; I132-L162 HydrophobicContact CG2-CD1 3.8Å; I132-L162 HydrophobicContact CG2-CD2 3.99Å; I132-L162 HydrophobicContact CG2-CG 3.91Å; A158-L162 WeakPolarHBondContact O-CB 3.29Å; A158-L162 WeakPolarHBondContact O-CG 3.28Å; A158-L162 PolarHBondContact O-N 3.18Å; V159-L162 PolarHBondContact O-N 2.71Å; K160-L162 VanDerWaalsContact C-N 3.35Å; K160-L162 PolarHBondContact O-N 2.96Å; L162-L172 HydrophobicContact CD2-CB 4.29Å; L162-L172 HydrophobicContact CD2-CD1 4.04Å; L162-L179 HydrophobicContact CD1-CD1 3.44Å; L162-L179 VanDerWaalsContact CD1-CD1 3.44Å
163	E	72.3	Confident	74.2	Confident	90 Å²	90	60.1 Å²	60.1	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-88.9	-12.9	176.2	-70.4	-179.2	147.3	0	0	113.1	V159 K160 S161 K180	V159-E163 WeakPolarHBondContact O-CB 3.41Å; V159-E163 WeakPolarHBondContact O-CG 3.13Å; V159-E163 PolarHBondContact O-N 3.05Å; K160-E163 PolarHBondContact O-N 3.1Å; S161-E163 VanDerWaalsContact C-N 3.33Å; E163-K180 WeakPolarHBondContact OE1-CE 3.5Å; E163-K180 IonicContact OE1-NZ 2.72Å; E163-K180 PolarHBondContact OE1-NZ 3.49Å
164	G	72.7	Confident	73.9	Confident	39 Å²	39	63.7 Å²	63.7	40%	0.402	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-113.9	177.9	0	0	0	0	0	113.6	K160 S161 L166 F167	K160-G164 PolarHBondContact O-N 2.99Å; S161-G164 PolarHBondContact O-N 3.02Å; G164-L166 PolarHBondContact O-N 3.48Å; G164-L166 VanDerWaalsContact O-N 3.14Å; G164-F167 WeakPolarHBondContact O-CB 3.2Å; G164-F167 PolarHBondContact O-N 3.05Å
165	P	64.9	Low	73.8	Confident	92 Å²	92	63.4 Å²	63.4	60%	0.597	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.4	-169.4	24.3	-34.9	0	0	0	114.2	S161	S161-P165 WeakPolarHBondContact O-CD 3.48Å
166	L	64.9	Low	73.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3.3	-175.4	-66	167.1	0	0	0	113.9	L125 E128 I129 I132 G164 Q168 V169 L172	L125-L166 HydrophobicContact CD2-CD2 3.81Å; E128-L166 HydrophobicContact CB-CD1 4.32Å; I129-L166 HydrophobicContact CD1-CD2 4.21Å; I129-L166 HydrophobicContact CG1-CD2 3.87Å; I132-L166 HydrophobicContact CD1-CD1 3.25Å; G164-L166 PolarHBondContact O-N 3.48Å; G164-L166 VanDerWaalsContact O-N 3.14Å; L166-Q168 PolarHBondContact O-N 3.48Å; L166-V169 PolarHBondContact O-N 2.92Å; L166-L172 HydrophobicContact CB-CD1 3.98Å; L166-L172 HydrophobicContact CD2-CD1 4.45Å
167	F	64.3	Low	73.6	Confident	120 Å²	120	70.2 Å²	70.2	53%	0.526	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-34.1	-175.8	-176.2	-91.9	0	0	0	113.2	G164 V169 R176	G164-F167 WeakPolarHBondContact O-CB 3.2Å; G164-F167 PolarHBondContact O-N 3.05Å; F167-V169 VanDerWaalsContact C-N 3.28Å; F167-V169 PolarHBondContact O-N 3.18Å; F167-R176 PolarHBondContact O-NH1 3.45Å; F167-R176 PolarHBondContact O-NH2 3.38Å
168	Q	62.6	Low	73.6	Confident	181 Å²	181	70.5 Å²	70.5	85%	0.846	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-10	-176	-60.2	-178.6	9.1	0	0	114.2	L166 E170	L166-Q168 PolarHBondContact O-N 3.48Å; Q168-E170 PolarHBondContact O-N 3.33Å
169	V	71.4	Confident	73.7	Confident	56 Å²	56	70.2 Å²	70.2	34%	0.339	39%	0.388	S	S	.	.			trans	-87.7	103.3	-179.8	-174.7	0	0	0	0	109.9	L166 F167 G171 L172 R176	L166-V169 PolarHBondContact O-N 2.92Å; F167-V169 VanDerWaalsContact C-N 3.28Å; F167-V169 PolarHBondContact O-N 3.18Å; V169-G171 VanDerWaalsContact C-N 3.29Å; V169-G171 PolarHBondContact O-N 3.01Å; V169-L172 HydrophobicContact CB-CD1 3.93Å; V169-L172 HydrophobicContact CB-CG 4.14Å; V169-L172 HydrophobicContact CG1-CD1 4.15Å; V169-L172 HydrophobicContact CG1-CG 3.93Å; V169-L172 PolarHBondContact O-N 3.4Å; V169-R176 PolarHBondContact O-NH2 3.36Å
170	E	63.6	Low	73.7	Confident	182 Å²	182	73.9 Å²	73.9	85%	0.85	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-60.3	-35.3	-178.9	-68.1	-171.4	145.9	0	0	113.1	Q168 L172 G173	Q168-E170 PolarHBondContact O-N 3.33Å; E170-L172 PolarHBondContact O-N 2.88Å; E170-G173 PolarHBondContact O-N 3Å
171	G	69.6	Low	73.9	Confident	75 Å²	75	71.6 Å²	71.6	77%	0.773	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-63.6	-7.6	177.9	0	0	0	0	0	115.4	V169	V169-G171 VanDerWaalsContact C-N 3.29Å; V169-G171 PolarHBondContact O-N 3.01Å
172	L	68.9	Low	74.2	Confident	14 Å²	14	72 Å²	72	7%	0.073	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-95.6	6.3	172.1	-60.6	175.9	0	0	0	112.8	I129 L162 L166 V169 E170 L175 R176	I129-L172 HydrophobicContact CG1-CD1 4.13Å; I129-L172 HydrophobicContact CG2-CD2 4.2Å; L162-L172 HydrophobicContact CD2-CB 4.29Å; L162-L172 HydrophobicContact CD2-CD1 4.04Å; L166-L172 HydrophobicContact CB-CD1 3.98Å; L166-L172 HydrophobicContact CD2-CD1 4.45Å; V169-L172 HydrophobicContact CB-CD1 3.93Å; V169-L172 HydrophobicContact CB-CG 4.14Å; V169-L172 HydrophobicContact CG1-CD1 4.15Å; V169-L172 HydrophobicContact CG1-CG 3.93Å; V169-L172 PolarHBondContact O-N 3.4Å; E170-L172 PolarHBondContact O-N 2.88Å; L172-L175 HydrophobicContact CD2-CD2 4.37Å; L172-R176 WeakPolarHBondContact O-CB 3.43Å; L172-R176 PolarHBondContact O-N 3.47Å
173	G	74.8	Confident	74.7	Confident	32 Å²	32	75.2 Å²	75.2	33%	0.33	41%	0.408	S	S	.	.	H	α-helix	trans	-56.7	-50.6	-178.1	0	0	0	0	0	113.5	E170 R176 L177	E170-G173 PolarHBondContact O-N 3Å; G173-R176 WeakPolarHBondContact O-CB 3.38Å; G173-R176 PolarHBondContact O-N 3.41Å; G173-L177 PolarHBondContact O-N 3.02Å
174	D	78	Confident	75.1	Confident	139 Å²	139	76 Å²	76	74%	0.743	41%	0.414	S	S	*	.	H	α-helix	trans	-66.2	-44.5	-178.5	-63.7	-31.4	0	0	0	112	R176 L177 E178	D174-R176 VanDerWaalsContact C-N 3.29Å; D174-R176 PolarHBondContact O-N 3.07Å; D174-L177 WeakPolarHBondContact O-CB 3.36Å; D174-L177 PolarHBondContact O-N 3.01Å; D174-L177 VanDerWaalsContact O-N 3.16Å; D174-E178 WeakPolarHBondContact O-CB 3.31Å; D174-E178 PolarHBondContact O-N 3.2Å
175	L	79.6	Confident	75.6	Confident	29 Å²	29	77.6 Å²	77.6	15%	0.152	41%	0.414	C	S	.	.	H	α-helix	trans	-64	-34.9	176.8	-176.4	60.8	0	0	0	112	I132 P136 L172 L179	I132-L175 HydrophobicContact CG2-CD2 4Å; P136-L175 HydrophobicContact CG-CD1 3.69Å; L172-L175 HydrophobicContact CD2-CD2 4.37Å; L175-L179 HydrophobicContact CD1-CD1 4.05Å; L175-L179 HydrophobicContact CD1-CG 4.36Å; L175-L179 HydrophobicContact CG-CD1 4.04Å; L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 WeakPolarHBondContact O-CG 3.5Å; L175-L179 PolarHBondContact O-N 3.16Å
176	R	81.1	Confident	76.6	Confident	37 Å²	37	73.4 Å²	73.4	14%	0.14	39%	0.386	C	S	.	.	H	α-helix	trans	-67.9	-39.8	173.9	-170.8	-169.8	-47.1	-171.6	3.1	111.2	F167 V169 L172 G173 D174 K180	F167-R176 PolarHBondContact O-NH1 3.45Å; F167-R176 PolarHBondContact O-NH2 3.38Å; V169-R176 PolarHBondContact O-NH2 3.36Å; L172-R176 WeakPolarHBondContact O-CB 3.43Å; L172-R176 PolarHBondContact O-N 3.47Å; G173-R176 WeakPolarHBondContact O-CB 3.38Å; G173-R176 PolarHBondContact O-N 3.41Å; D174-R176 VanDerWaalsContact C-N 3.29Å; D174-R176 PolarHBondContact O-N 3.07Å; R176-K180 VanDerWaalsContact O-CB 3.3Å; R176-K180 WeakPolarHBondContact O-CB 3.29Å; R176-K180 VanDerWaalsContact O-CG 3.23Å; R176-K180 WeakPolarHBondContact O-CG 3.4Å; R176-K180 PolarHBondContact O-N 2.97Å
177	L	81.8	Confident	77.3	Confident	120 Å²	120	74.7 Å²	74.7	63%	0.628	39%	0.392	S	S	*	.	H	α-helix	trans	-66.7	-44.1	173.8	-176.9	63.4	0	0	0	111.1	G173 D174 K180 N181	G173-L177 PolarHBondContact O-N 3.02Å; D174-L177 WeakPolarHBondContact O-CB 3.36Å; D174-L177 PolarHBondContact O-N 3.01Å; D174-L177 VanDerWaalsContact O-N 3.16Å; L177-K180 PolarHBondContact O-N 3.42Å; L177-N181 WeakPolarHBondContact O-CB 3.22Å; L177-N181 PolarHBondContact O-N 3.07Å
178	E	82.8	Confident	78.3	Confident	80 Å²	80	73.5 Å²	73.5	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-52.2	177.3	-169.9	-169.4	167.8	0	0	111.4	D174 K180 N181 K182	D174-E178 WeakPolarHBondContact O-CB 3.31Å; D174-E178 PolarHBondContact O-N 3.2Å; E178-K180 VanDerWaalsContact C-N 3.33Å; E178-K180 PolarHBondContact O-N 3.02Å; E178-N181 CarbonylContact O-C 3.6Å; E178-N181 WeakPolarHBondContact O-CB 3.3Å; E178-N181 PolarHBondContact O-N 2.88Å; E178-N181 VanDerWaalsContact O-N 3.11Å; E178-K182 HydrophobicContact CG-CG 4.44Å; E178-K182 VanDerWaalsContact O-CG 3.31Å; E178-K182 WeakPolarHBondContact O-CG 3.31Å; E178-K182 PolarHBondContact O-N 3.45Å
179	L	82.1	Confident	79.4	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-32	179.9	-72.3	166.1	0	0	0	112.4	I132 V135 P136 L155 V159 L162 L175 K183	I132-L179 HydrophobicContact CG2-CD1 4.23Å; V135-L179 HydrophobicContact CG1-CD2 3.87Å; P136-L179 HydrophobicContact CG-CD2 4.19Å; L155-L179 HydrophobicContact CD1-CB 4.29Å; L155-L179 HydrophobicContact CD1-CD2 3.67Å; V159-L179 HydrophobicContact CG2-CB 4.13Å; L162-L179 HydrophobicContact CD1-CD1 3.44Å; L162-L179 VanDerWaalsContact CD1-CD1 3.44Å; L175-L179 HydrophobicContact CD1-CD1 4.05Å; L175-L179 HydrophobicContact CD1-CG 4.36Å; L175-L179 HydrophobicContact CG-CD1 4.04Å; L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 WeakPolarHBondContact O-CG 3.5Å; L175-L179 PolarHBondContact O-N 3.16Å; L179-K183 VanDerWaalsContact O-CB 3.28Å; L179-K183 WeakPolarHBondContact O-CB 3.34Å; L179-K183 PolarHBondContact O-N 3.37Å
180	K	81.6	Confident	80	Confident	81 Å²	81	64.6 Å²	64.6	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-65.8	-41.3	169.3	-77.8	-177	178.8	-157.1	0	112.1	E163 R176 L177 E178 K183 L184	E163-K180 WeakPolarHBondContact OE1-CE 3.5Å; E163-K180 IonicContact OE1-NZ 2.72Å; E163-K180 PolarHBondContact OE1-NZ 3.49Å; R176-K180 VanDerWaalsContact O-CB 3.3Å; R176-K180 WeakPolarHBondContact O-CB 3.29Å; R176-K180 VanDerWaalsContact O-CG 3.23Å; R176-K180 WeakPolarHBondContact O-CG 3.4Å; R176-K180 PolarHBondContact O-N 2.97Å; L177-K180 PolarHBondContact O-N 3.42Å; E178-K180 VanDerWaalsContact C-N 3.33Å; E178-K180 PolarHBondContact O-N 3.02Å; K180-K183 PolarHBondContact O-N 3.19Å; K180-L184 WeakPolarHBondContact O-CG 3.44Å; K180-L184 PolarHBondContact O-N 3.17Å
181	N	85.5	Confident	81	Confident	89 Å²	89	56.3 Å²	56.3	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-66.4	-45.7	176.1	-165.8	4.7	0	0	0	111.2	L177 E178 K183 L184 N185	L177-N181 WeakPolarHBondContact O-CB 3.22Å; L177-N181 PolarHBondContact O-N 3.07Å; E178-N181 CarbonylContact O-C 3.6Å; E178-N181 WeakPolarHBondContact O-CB 3.3Å; E178-N181 PolarHBondContact O-N 2.88Å; E178-N181 VanDerWaalsContact O-N 3.11Å; N181-K183 VanDerWaalsContact C-N 3.29Å; N181-K183 PolarHBondContact O-N 3.18Å; N181-L184 CarbonylContact O-C 3.59Å; N181-L184 WeakPolarHBondContact O-CA 3.44Å; N181-L184 WeakPolarHBondContact O-CB 3.45Å; N181-L184 PolarHBondContact O-N 3.17Å; N181-N185 VanDerWaalsContact O-CG 3.29Å; N181-N185 PolarHBondContact O-N 3.06Å; N181-N185 PolarHBondContact O-ND2 3.24Å; N181-N185 VanDerWaalsContact O-ND2 3.13Å; N181-N185 PolarHBondContact OD1-ND2 3.16Å
182	K	82.8	Confident	81.7	Confident	53 Å²	53	55 Å²	55	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-38.7	172.6	-64.8	-83.7	-168.4	171.5	0	111.6	L139 E140 E178 N185 I186	L139-K182 HydrophobicContact CD2-CB 4.08Å; L139-K182 HydrophobicContact CD2-CD 4.46Å; L139-K182 HydrophobicContact CD2-CG 4.43Å; E140-K182 IonicContact OE1-NZ 3.93Å; E140-K182 PolarHBondContact OE1-NZ 2.94Å; E178-K182 HydrophobicContact CG-CG 4.44Å; E178-K182 VanDerWaalsContact O-CG 3.31Å; E178-K182 WeakPolarHBondContact O-CG 3.31Å; E178-K182 PolarHBondContact O-N 3.45Å; K182-N185 PolarHBondContact O-N 3.34Å; K182-I186 WeakPolarHBondContact O-CB 3.16Å; K182-I186 PolarHBondContact O-N 2.87Å
183	K	82.8	Confident	82.4	Confident	70 Å²	70	55.5 Å²	55.5	30%	0.304	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-33.8	173	-178	-179.2	174.3	-174.7	0	113	L155 V159 L179 K180 N181 L295	L155-K183 HydrophobicContact CD2-CB 4.08Å; L155-K183 HydrophobicContact CG-CB 4.29Å; V159-K183 HydrophobicContact CB-CD 4.45Å; V159-K183 HydrophobicContact CG1-CD 4.17Å; V159-K183 HydrophobicContact CG2-CD 4.2Å; L179-K183 VanDerWaalsContact O-CB 3.28Å; L179-K183 WeakPolarHBondContact O-CB 3.34Å; L179-K183 PolarHBondContact O-N 3.37Å; K180-K183 PolarHBondContact O-N 3.19Å; N181-K183 VanDerWaalsContact C-N 3.29Å; N181-K183 PolarHBondContact O-N 3.18Å; K183-L295 HydrophobicContact CG-CD2 4.16Å
184	L	80.5	Confident	82.8	Confident	107 Å²	107	54 Å²	54	56%	0.56	27%	0.272	S	S	*	.	H	α-helix	trans	-73.9	-25.6	171.1	-70.9	174.1	0	0	0	112.6	K180 N181 H187	K180-L184 WeakPolarHBondContact O-CG 3.44Å; K180-L184 PolarHBondContact O-N 3.17Å; N181-L184 CarbonylContact O-C 3.59Å; N181-L184 WeakPolarHBondContact O-CA 3.44Å; N181-L184 WeakPolarHBondContact O-CB 3.45Å; N181-L184 PolarHBondContact O-N 3.17Å; L184-H187 PolarHBondContact O-CE1 3.09Å; L184-H187 PolarHBondContact O-ND1 2.97Å
185	N	84.3	Confident	83.2	Confident	73 Å²	73	47.8 Å²	47.8	39%	0.39	24%	0.238	S	C	.	.	H	α-helix	trans	-91.2	-32.6	-179.5	-63.9	-33.1	0	0	0	113.5	N181 K182 H187 L188 V189	N181-N185 VanDerWaalsContact O-CG 3.29Å; N181-N185 PolarHBondContact O-N 3.06Å; N181-N185 PolarHBondContact O-ND2 3.24Å; N181-N185 VanDerWaalsContact O-ND2 3.13Å; N181-N185 PolarHBondContact OD1-ND2 3.16Å; K182-N185 PolarHBondContact O-N 3.34Å; N185-H187 VanDerWaalsContact C-N 3.27Å; N185-H187 PolarHBondContact O-N 3.42Å; N185-L188 WeakPolarHBondContact O-CB 3.39Å; N185-L188 PolarHBondContact O-N 3.12Å; N185-V189 PolarHBondContact O-N 3.43Å
186	I	85.2	Confident	83.4	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-32	-176.3	-164.1	168.6	0	0	0	113.3	L139 A151 L155 K182 L188 V189 L190 L295	L139-I186 HydrophobicContact CD1-CD1 4.41Å; A151-I186 HydrophobicContact CB-CD1 4.48Å; L155-I186 HydrophobicContact CD2-CB 4.48Å; L155-I186 HydrophobicContact CD2-CD1 4.2Å; L155-I186 HydrophobicContact CD2-CG2 4Å; K182-I186 WeakPolarHBondContact O-CB 3.16Å; K182-I186 PolarHBondContact O-N 2.87Å; I186-L188 VanDerWaalsContact C-N 3.3Å; I186-L188 PolarHBondContact O-N 3.48Å; I186-V189 PolarHBondContact O-N 3.28Å; I186-L190 HydrophobicContact CG1-CD1 4.4Å; I186-L190 WeakPolarHBondContact O-CB 3.23Å; I186-L190 VanDerWaalsContact O-CG 3.29Å; I186-L190 WeakPolarHBondContact O-CG 3.25Å; I186-L190 PolarHBondContact O-N 2.63Å; I186-L295 HydrophobicContact CG2-CD1 3.84Å; I186-L295 HydrophobicContact CG2-CD2 4.2Å
187	H	81.1	Confident	83.4	Confident	28 Å²	28	46.8 Å²	46.8	13%	0.13	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-31.2	176.9	84.3	-81.3	0	0	0	112.6	L184 N185 I191 L292 L295 K297	L184-H187 PolarHBondContact O-CE1 3.09Å; L184-H187 PolarHBondContact O-ND1 2.97Å; N185-H187 VanDerWaalsContact C-N 3.27Å; N185-H187 PolarHBondContact O-N 3.42Å; H187-I191 WeakPolarHBondContact O-CB 3.44Å; H187-I191 WeakPolarHBondContact O-CD1 3.42Å; H187-I191 WeakPolarHBondContact O-CG1 3.31Å; H187-I191 PolarHBondContact O-N 2.62Å; H187-L292 HydrophobicContact CB-CD2 4.19Å; H187-L295 HydrophobicContact CB-CD1 4.07Å; H187-K297 HydrophobicContact CB-CB 4.45Å; H187-K297 HydrophobicContact CB-CG 4.37Å
188	L	84.1	Confident	83.4	Confident	94 Å²	94	41.1 Å²	41.1	49%	0.492	20%	0.203	S	C	.	.	H	α-helix	trans	-69.5	-42.5	174.4	-60.3	175.7	0	0	0	110.9	N185 I186 I191 D192	N185-L188 WeakPolarHBondContact O-CB 3.39Å; N185-L188 PolarHBondContact O-N 3.12Å; I186-L188 VanDerWaalsContact C-N 3.3Å; I186-L188 PolarHBondContact O-N 3.48Å; L188-I191 PolarHBondContact O-N 2.61Å; L188-D192 PolarHBondContact O-N 3.45Å
189	V	85.4	Confident	83.4	Confident	51 Å²	51	37.3 Å²	37.3	31%	0.309	19%	0.185	S	C	.	.	H	α-helix	trans	-62.1	-44.5	176	-179.6	0	0	0	0	111.3	M143 Y148 N185 I186 I191 D192 E193	M143-V189 HydrophobicContact CE-CG1 4.37Å; M143-V189 HydrophobicContact CE-CG2 4.25Å; Y148-V189 HydrophobicContact CE1-CG1 3.98Å; N185-V189 PolarHBondContact O-N 3.43Å; I186-V189 PolarHBondContact O-N 3.28Å; V189-I191 VanDerWaalsContact C-N 3.33Å; V189-I191 PolarHBondContact O-N 3.36Å; V189-D192 PolarHBondContact O-N 2.96Å; V189-E193 PolarHBondContact O-N 2.81Å
190	L	84.6	Confident	83.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-40.5	175.2	-75.5	168.4	0	0	0	112.6	Y148 I186 L194 L288 A291 L292 L295	Y148-L190 HydrophobicContact CD1-CD2 4.15Å; Y148-L190 HydrophobicContact CG-CD2 3.99Å; I186-L190 HydrophobicContact CG1-CD1 4.4Å; I186-L190 WeakPolarHBondContact O-CB 3.23Å; I186-L190 VanDerWaalsContact O-CG 3.29Å; I186-L190 WeakPolarHBondContact O-CG 3.25Å; I186-L190 PolarHBondContact O-N 2.63Å; L190-L194 VanDerWaalsContact O-CB 3.25Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 3.19Å; L190-L288 HydrophobicContact CD2-CD2 3.55Å; L190-A291 HydrophobicContact CD1-CB 3.89Å; L190-A291 HydrophobicContact CD2-CB 3.84Å; L190-L292 HydrophobicContact CB-CD1 4.22Å; L190-L292 HydrophobicContact CB-CD2 3.65Å; L190-L292 HydrophobicContact CB-CG 3.87Å; L190-L292 HydrophobicContact CD1-CD2 3.86Å; L190-L292 HydrophobicContact CD1-CG 4.04Å; L190-L292 HydrophobicContact CG-CD2 4.41Å; L190-L295 HydrophobicContact CD1-CD1 3.53Å
191	I	84.1	Confident	83.2	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-68.9	-40.4	176.8	-73.9	168.1	0	0	0	110.9	H187 L188 V189 L194 H195 L292 T301 A304	H187-I191 WeakPolarHBondContact O-CB 3.44Å; H187-I191 WeakPolarHBondContact O-CD1 3.42Å; H187-I191 WeakPolarHBondContact O-CG1 3.31Å; H187-I191 PolarHBondContact O-N 2.62Å; L188-I191 PolarHBondContact O-N 2.61Å; V189-I191 VanDerWaalsContact C-N 3.33Å; V189-I191 PolarHBondContact O-N 3.36Å; I191-L194 PolarHBondContact O-N 3.5Å; I191-H195 WeakPolarHBondContact CG2-CE1 3.43Å; I191-H195 VanDerWaalsContact O-CG 3.24Å; I191-H195 PolarHBondContact O-N 3.39Å; I191-H195 PolarHBondContact O-ND1 2.95Å; I191-L292 HydrophobicContact CG1-CD1 4.28Å; I191-L292 HydrophobicContact CG1-CD2 4.1Å; I191-T301 HydrophobicContact CG1-CG2 4.34Å; I191-A304 HydrophobicContact CG2-CB 4.04Å
192	D	84.6	Confident	82.8	Confident	48 Å²	48	34.3 Å²	34.3	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-67.3	-42.9	178.7	-132.3	45.1	0	0	0	112.1	L188 V189 L194 H195 R196 R308 Q480	L188-D192 PolarHBondContact O-N 3.45Å; V189-D192 PolarHBondContact O-N 2.96Å; D192-L194 VanDerWaalsContact C-N 3.33Å; D192-L194 PolarHBondContact O-N 3.37Å; D192-H195 PolarHBondContact O-N 3.09Å; D192-R196 WeakPolarHBondContact O-CB 3.29Å; D192-R196 PolarHBondContact O-N 2.92Å; D192-R308 IonicContact OD1-CZ 2.71Å; D192-R308 IonicContact OD1-NH1 2.79Å; D192-R308 PolarHBondContact OD1-NH1 3.16Å; D192-R308 IonicContact OD1-NH2 3.19Å; D192-Q480 PolarHBondContact OD2-NE2 3.39Å
193	E	83.1	Confident	82.5	Confident	24 Å²	24	32.6 Å²	32.6	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-68.3	-33.7	176.4	-159.2	61.5	-150.8	0	0	111.7	Y148 V189 R196 H197 F284 L288	Y148-E193 HydrophobicContact CE2-CG 4.21Å; V189-E193 PolarHBondContact O-N 2.81Å; E193-R196 PolarHBondContact O-N 3.33Å; E193-R196 VanDerWaalsContact OE1-CD 3.25Å; E193-R196 WeakPolarHBondContact OE1-CD 3.45Å; E193-R196 IonicContact OE1-NE 3.37Å; E193-R196 PolarHBondContact OE1-NE 2.89Å; E193-R196 IonicContact OE2-NE 3Å; E193-H197 PolarHBondContact O-CD2 3.05Å; E193-H197 PolarHBondContact O-N 2.88Å; E193-H197 IonicContact OE1-CD2 3.96Å; E193-H197 IonicContact OE1-NE2 2.69Å; E193-F284 HydrophobicContact CG-CE1 3.95Å; E193-F284 HydrophobicContact CG-CZ 4.39Å; E193-L288 HydrophobicContact CB-CD1 4.34Å; E193-L288 HydrophobicContact CG-CD1 4.47Å
194	L	84	Confident	81.8	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-43.8	171.6	-176.4	62	0	0	0	111.3	L190 I191 D192 H197 L198 M285 L288 L292 T301 I305 V365	L190-L194 VanDerWaalsContact O-CB 3.25Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 3.19Å; I191-L194 PolarHBondContact O-N 3.5Å; D192-L194 VanDerWaalsContact C-N 3.33Å; D192-L194 PolarHBondContact O-N 3.37Å; L194-H197 PolarHBondContact O-N 3.2Å; L194-L198 HydrophobicContact CD1-CD1 4.48Å; L194-L198 HydrophobicContact CG-CD1 4.05Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 VanDerWaalsContact O-CG 3.31Å; L194-L198 WeakPolarHBondContact O-CG 3.29Å; L194-L198 PolarHBondContact O-N 3.38Å; L194-M285 HydrophobicContact CD1-CB 4.17Å; L194-M285 HydrophobicContact CD1-CG 3.96Å; L194-L288 HydrophobicContact CB-CD1 4.06Å; L194-L288 HydrophobicContact CD1-CD1 4.28Å; L194-L292 HydrophobicContact CD2-CD1 4.29Å; L194-T301 HydrophobicContact CD2-CG2 4.11Å; L194-I305 HydrophobicContact CD2-CD1 3.99Å; L194-V365 HydrophobicContact CD1-CG2 4.01Å
195	H	85.2	Confident	80.9	Confident	7 Å²	7	35.3 Å²	35.3	3%	0.032	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-41.9	174.4	-67.9	139.8	0	0	0	112.6	I191 D192 H197 L198 Y199 R308	I191-H195 WeakPolarHBondContact CG2-CE1 3.43Å; I191-H195 VanDerWaalsContact O-CG 3.24Å; I191-H195 PolarHBondContact O-N 3.39Å; I191-H195 PolarHBondContact O-ND1 2.95Å; D192-H195 PolarHBondContact O-N 3.09Å; H195-H197 VanDerWaalsContact C-N 3.31Å; H195-H197 PolarHBondContact O-N 3.41Å; H195-L198 PolarHBondContact O-N 2.93Å; H195-Y199 HydrophobicContact CB-CD2 4.29Å; H195-Y199 HydrophobicContact CB-CE2 4.46Å; H195-Y199 AromaticContact CD2-CE2 3.89Å; H195-Y199 WeakPolarHBondContact O-CD2 3.23Å; H195-Y199 PolarHBondContact O-N 3.11Å; H195-R308 VanDerWaalsContact CE1-CD 3.43Å; H195-R308 WeakPolarHBondContact CE1-CD 3.44Å; H195-R308 PolarHBondContact ND1-NH1 2.86Å
196	R	84.1	Confident	79.7	Confident	46 Å²	46	33.5 Å²	33.5	17%	0.174	17%	0.168	C	C	.	.	I	π-helix	trans	-58.6	-42.3	174.7	171.4	173.1	152.2	69.2	5.5	111.7	D192 E193 I200 K201 E278 G477	D192-R196 WeakPolarHBondContact O-CB 3.29Å; D192-R196 PolarHBondContact O-N 2.92Å; E193-R196 PolarHBondContact O-N 3.33Å; E193-R196 VanDerWaalsContact OE1-CD 3.25Å; E193-R196 WeakPolarHBondContact OE1-CD 3.45Å; E193-R196 IonicContact OE1-NE 3.37Å; E193-R196 PolarHBondContact OE1-NE 2.89Å; E193-R196 IonicContact OE2-NE 3Å; R196-I200 WeakPolarHBondContact O-CA 3.45Å; R196-I200 WeakPolarHBondContact O-CB 3.28Å; R196-I200 PolarHBondContact O-N 3.33Å; R196-K201 PolarHBondContact O-N 2.93Å; R196-E278 IonicContact NH2-OE1 2.7Å; R196-E278 IonicContact NH2-OE2 2.63Å; R196-G477 PolarHBondContact NH1-O 3.33Å
197	H	81.1	Confident	78	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-68.8	-42.9	173.8	-88.1	-112	0	0	0	113	E193 L194 H195 K201 S202 S281 F284 M285	E193-H197 PolarHBondContact O-CD2 3.05Å; E193-H197 PolarHBondContact O-N 2.88Å; E193-H197 IonicContact OE1-CD2 3.96Å; E193-H197 IonicContact OE1-NE2 2.69Å; L194-H197 PolarHBondContact O-N 3.2Å; H195-H197 VanDerWaalsContact C-N 3.31Å; H195-H197 PolarHBondContact O-N 3.41Å; H197-K201 PolarHBondContact CE1-NZ 3.31Å; H197-S202 PolarHBondContact O-N 2.93Å; H197-S281 PolarHBondContact ND1-OG 2.74Å; H197-F284 AromaticContact CD2-CD1 3.92Å; H197-F284 AromaticContact CD2-CE1 3.89Å; H197-F284 AromaticContact CE1-CD1 3.23Å; H197-F284 WeakPolarHBondContact CE1-CD1 3.4Å; H197-F284 AromaticContact CE1-CE1 3.77Å; H197-F284 AromaticContact CE1-CG 3.98Å; H197-F284 AromaticContact ND1-CD1 3.72Å; H197-F284 AromaticContact NE2-CD1 3.42Å; H197-F284 WeakPolarHBondContact NE2-CD1 3.47Å; H197-F284 AromaticContact NE2-CE1 3.44Å; H197-F284 WeakPolarHBondContact NE2-CE1 3.3Å; H197-M285 HydrophobicContact CB-CG 3.95Å; H197-M285 HydrophobicContact CB-SD 4.21Å
198	L	81.6	Confident	76.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-63.3	-42.3	-179.7	-81.7	170.4	0	0	0	114.1	L194 H195 S202 M285 I305 A361 V365	L194-L198 HydrophobicContact CD1-CD1 4.48Å; L194-L198 HydrophobicContact CG-CD1 4.05Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 VanDerWaalsContact O-CG 3.31Å; L194-L198 WeakPolarHBondContact O-CG 3.29Å; L194-L198 PolarHBondContact O-N 3.38Å; H195-L198 PolarHBondContact O-N 2.93Å; L198-S202 VanDerWaalsContact C-OG 3.28Å; L198-S202 WeakPolarHBondContact O-CB 3.45Å; L198-S202 PolarHBondContact O-OG 3.14Å; L198-M285 HydrophobicContact CD2-SD 4.21Å; L198-M285 HydrophobicContact CG-SD 4.42Å; L198-I305 HydrophobicContact CD1-CD1 4.47Å; L198-I305 HydrophobicContact CD1-CG1 4.49Å; L198-A361 HydrophobicContact CD2-CB 3.86Å; L198-V365 HydrophobicContact CD2-CG2 3.82Å; L198-V365 HydrophobicContact CG-CG2 4.41Å
199	Y	83.8	Confident	74.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-114.3	-32.7	-169.7	-56	-61.6	0	0	0	114.9	H195 T203 L309 E312 I316 V358 H362	H195-Y199 HydrophobicContact CB-CD2 4.29Å; H195-Y199 HydrophobicContact CB-CE2 4.46Å; H195-Y199 AromaticContact CD2-CE2 3.89Å; H195-Y199 WeakPolarHBondContact O-CD2 3.23Å; H195-Y199 PolarHBondContact O-N 3.11Å; Y199-T203 WeakPolarHBondContact O-CG2 3.45Å; Y199-T203 PolarHBondContact O-OG1 3.33Å; Y199-L309 HydrophobicContact CE1-CD1 3.81Å; Y199-L309 WeakPolarHBondContact OH-CA 3.21Å; Y199-L309 WeakPolarHBondContact OH-CD1 3.32Å; Y199-E312 HydrophobicContact CD1-CB 4.01Å; Y199-E312 HydrophobicContact CD2-CB 3.77Å; Y199-E312 HydrophobicContact CD2-CG 3.6Å; Y199-E312 HydrophobicContact CE1-CB 4.21Å; Y199-E312 HydrophobicContact CE2-CB 3.97Å; Y199-E312 HydrophobicContact CE2-CG 3.82Å; Y199-E312 HydrophobicContact CG-CB 3.79Å; Y199-E312 HydrophobicContact CG-CG 4.09Å; Y199-I316 HydrophobicContact CD1-CD1 4.32Å; Y199-V358 HydrophobicContact CD1-CG1 3.93Å; Y199-V358 HydrophobicContact CD1-CG2 4.23Å; Y199-V358 HydrophobicContact CE1-CG1 3.84Å; Y199-H362 AromaticContact CE1-NE2 3.47Å; Y199-H362 WeakPolarHBondContact CE1-NE2 3.45Å; Y199-H362 AromaticContact CZ-NE2 3.68Å; Y199-H362 PolarHBondContact OH-CE1 3.48Å; Y199-H362 PolarHBondContact OH-NE2 3.05Å
200	I	79.6	Confident	72.2	Confident	60 Å²	60	46.9 Å²	46.9	31%	0.308	24%	0.235	S	C	.	.	I	π-helix	trans	-95.3	-52.9	-174.6	-53.7	177.9	0	0	0	110.6	R196 T203 S204	R196-I200 WeakPolarHBondContact O-CA 3.45Å; R196-I200 WeakPolarHBondContact O-CB 3.28Å; R196-I200 PolarHBondContact O-N 3.33Å; I200-T203 PolarHBondContact O-N 3.01Å; I200-T203 PolarHBondContact O-OG1 2.79Å; I200-S204 VanDerWaalsContact O-CB 3.32Å; I200-S204 WeakPolarHBondContact O-CB 2.96Å; I200-S204 PolarHBondContact O-N 2.95Å; I200-S204 PolarHBondContact O-OG 3.16Å
201	K	80	Confident	70.1	Confident	24 Å²	24	55.3 Å²	55.3	10%	0.104	27%	0.271	C	S	.	.	I	π-helix	trans	-78.1	-31.3	-173.9	-166.1	169.2	169.9	176.9	0	113.6	R196 H197 T203 S204 E278	R196-K201 PolarHBondContact O-N 2.93Å; H197-K201 PolarHBondContact CE1-NZ 3.31Å; K201-T203 VanDerWaalsContact C-N 3.33Å; K201-S204 PolarHBondContact O-OG 3.36Å; K201-E278 VanDerWaalsContact NZ-CD 3.31Å; K201-E278 PolarHBondContact NZ-O 2.84Å; K201-E278 IonicContact NZ-OE2 3.67Å; K201-E278 PolarHBondContact NZ-OE2 3.24Å
202	S	76.7	Confident	67.6	Low	24 Å²	24	60.7 Å²	60.7	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-38.3	170.1	59.4	0	0	0	0	112.6	H197 L198	H197-S202 PolarHBondContact O-N 2.93Å; L198-S202 VanDerWaalsContact C-OG 3.28Å; L198-S202 WeakPolarHBondContact O-CB 3.45Å; L198-S202 PolarHBondContact O-OG 3.14Å
203	T	77	Confident	65.4	Low	16 Å²	16	67.4 Å²	67.4	10%	0.098	33%	0.327	C	S	.	.	H	α-helix	trans	-95.2	-23.2	-173.3	64.9	0	0	0	0	114.2	Y199 I200 K201 R205 L206 I316 K354 V358	Y199-T203 WeakPolarHBondContact O-CG2 3.45Å; Y199-T203 PolarHBondContact O-OG1 3.33Å; I200-T203 PolarHBondContact O-N 3.01Å; I200-T203 PolarHBondContact O-OG1 2.79Å; K201-T203 VanDerWaalsContact C-N 3.33Å; T203-R205 PolarHBondContact O-N 3.14Å; T203-L206 PolarHBondContact O-N 2.65Å; T203-I316 HydrophobicContact CG2-CD1 4.15Å; T203-K354 HydrophobicContact CG2-CB 3.92Å; T203-K354 HydrophobicContact CG2-CG 4.2Å; T203-V358 HydrophobicContact CG2-CG2 3.71Å
204	S	68.4	Low	63.1	Low	67 Å²	67	73.4 Å²	73.4	47%	0.469	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-36.6	-175.9	64.6	0	0	0	0	114	I200 K201 L206	I200-S204 VanDerWaalsContact O-CB 3.32Å; I200-S204 WeakPolarHBondContact O-CB 2.96Å; I200-S204 PolarHBondContact O-N 2.95Å; I200-S204 PolarHBondContact O-OG 3.16Å; K201-S204 PolarHBondContact O-OG 3.36Å; S204-L206 PolarHBondContact O-N 3.28Å
205	R	60.8	Low	60.8	Low	167 Å²	167	77.2 Å²	77.2	63%	0.63	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-67.4	-18.4	-177.8	-63.2	-168.1	-177.9	-147.1	5.2	113.9	T203	T203-R205 PolarHBondContact O-N 3.14Å
206	L	60.3	Low	58.2	Low	35 Å²	35	82.3 Å²	82.3	18%	0.183	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-84.4	-23.5	-174.6	-68.1	167.7	0	0	0	113.7	T203 S204 H208 D353 A357	T203-L206 PolarHBondContact O-N 2.65Å; S204-L206 PolarHBondContact O-N 3.28Å; L206-H208 PolarHBondContact O-N 3.39Å; L206-H208 VanDerWaalsContact O-N 3.11Å; L206-D353 HydrophobicContact CD1-CB 4.27Å; L206-D353 WeakPolarHBondContact CD1-O 3.32Å; L206-A357 HydrophobicContact CD1-CB 3.75Å
207	G	48.2	Very low	55.8	Low	29 Å²	29	91.5 Å²	91.5	30%	0.299	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-68.2	-8.8	-175.7	0	0	0	0	0	116.4
208	H	47.2	Very low	53.5	Low	150 Å²	150	99.8 Å²	99.8	69%	0.694	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-99.2	-15.6	-173.2	-74.6	84.1	0	0	0	114.7	L206 N210 K211	L206-H208 PolarHBondContact O-N 3.39Å; L206-H208 VanDerWaalsContact O-N 3.11Å; H208-N210 VanDerWaalsContact C-N 3.27Å; H208-N210 PolarHBondContact O-N 3.14Å; H208-N210 VanDerWaalsContact O-N 3.12Å; H208-K211 PolarHBondContact O-N 3.39Å
209	K	40.8	Very low	51.3	Low	135 Å²	135	105.8 Å²	105.8	59%	0.587	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.8	-167.7	-71.1	-175.8	176	177.8	0	116.1	K211	K209-K211 VanDerWaalsContact C-N 3.33Å; K209-K211 PolarHBondContact O-N 3.28Å
210	N	40.3	Very low	48.6	Very low	144 Å²	144	109.3 Å²	109.3	77%	0.77	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-7.7	-179.8	-81.3	0.5	0	0	0	114.4	H208	H208-N210 VanDerWaalsContact C-N 3.27Å; H208-N210 PolarHBondContact O-N 3.14Å; H208-N210 VanDerWaalsContact O-N 3.12Å
211	K	40.6	Very low	46.1	Very low	176 Å²	176	112.6 Å²	112.6	77%	0.765	61%	0.61	S	S	*	*	S	Bend	trans	-83	-35.1	-178.5	-137.5	177	-175.8	-177	0	113.5	H208 K209	H208-K211 PolarHBondContact O-N 3.39Å; K209-K211 VanDerWaalsContact C-N 3.33Å; K209-K211 PolarHBondContact O-N 3.28Å
212	D	33.2	Very low	44.1	Very low	122 Å²	122	119.2 Å²	119.2	65%	0.652	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-85.3	-20.1	-165.1	-58.9	-37.9	0	0	0	114.6	N214 A215	D212-N214 PolarHBondContact O-N 3.39Å; D212-A215 PolarHBondContact O-N 2.91Å
213	K	37.8	Very low	41.8	Very low	189 Å²	189	125 Å²	125	82%	0.822	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-67.6	-20.2	177.3	-78.8	-175.5	175.5	176.9	0	114.1
214	N	35.1	Very low	39.7	Very low	149 Å²	149	133.5 Å²	133.5	80%	0.797	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-99.9	-2.3	-178.9	-75.3	-8.6	0	0	0	114.2	D212	D212-N214 PolarHBondContact O-N 3.39Å
215	A	34.2	Very low	37.6	Very low	81 Å²	81	137.7 Å²	137.7	67%	0.669	73%	0.733	S	S	*	*	S	Bend	trans	-90.4	-11.2	-173.4	0	0	0	0	0	114.9	D212	D212-A215 PolarHBondContact O-N 2.91Å
216	S	31.6	Very low	36	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	74%	0.739	S	S	*	*			trans	-104	57.4	-174.7	-161.2	0	0	0	0	113.7
217	R	32.9	Very low	34.4	Very low	240 Å²	240	140.2 Å²	140.2	91%	0.906	77%	0.766	S	S	*	*			trans	-142.8	108.5	160.7	-69.3	-166.3	-176.7	-165.4	1.3	110.4
218	L	32.4	Very low	33.6	Very low	173 Å²	173	144.3 Å²	144.3	91%	0.906	79%	0.787	S	S	*	*			trans	-71.1	146.3	168.8	-81.5	146.9	0	0	0	110.5
219	P	36.4	Very low	32.6	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	80%	0.795	S	S	*	*			trans	-85.6	137.2	-177.7	33.2	-33.3	0	0	0	112.1
220	G	27.4	Very low	31.9	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	80%	0.803	S	S	*	*			trans	-163.7	112.5	179	0	0	0	0	0	115.5
221	S	27.6	Very low	31.3	Very low	128 Å²	128	144.1 Å²	144.1	90%	0.895	81%	0.805	S	S	*	*			trans	75	139.7	162.8	-149.2	0	0	0	0	120.4
222	L	36.4	Very low	30.7	Very low	164 Å²	164	143.4 Å²	143.4	86%	0.859	81%	0.809	S	S	*	*			trans	-102.5	129.6	178.1	-69.7	138.5	0	0	0	110.3
223	T	29.5	Very low	30.1	Very low	144 Å²	144	146.3 Å²	146.3	88%	0.883	82%	0.818	S	S	*	*			trans	-152	137	146.5	40.1	0	0	0	0	109.6
224	K	32.6	Very low	29.8	Very low	196 Å²	196	143.5 Å²	143.5	85%	0.852	82%	0.817	S	S	*	*			trans	-70.7	143.1	167.5	-75.8	175.8	170.1	178.9	0	109.8
225	D	24.3	Very low	29.4	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	82%	0.821	S	S	*	*				-168.1	-178.8	113.7	-96.7	-19.5	0	0	0	112
226	I	27.2	Very low	29	Very low	147 Å²	147	142.3 Å²	142.3	75%	0.754	83%	0.827	S	S	*	*			trans	-113.4	142.3	-144.7	-69	165.6	0	0	0	113.6
227	S	27.3	Very low	28.9	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	83%	0.831	S	S	*	*			trans	74.5	163.2	166.7	78.1	0	0	0	0	118.1
228	P	30.6	Very low	28.5	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	83%	0.829	S	S	*	*				-125.4	165.1	-56.1	36.1	-23.8	0	0	0	113.2
229	M	27	Very low	28.2	Very low	174 Å²	174	137 Å²	137	86%	0.857	82%	0.823	S	S	*	*			trans	12.5	112.4	164.5	-95.7	-67.7	-158.8	0	0	119.3	V231	M229-V231 PolarHBondContact O-N 3.48Å
230	P	26	Very low	28.3	Very low	119 Å²	119	136.7 Å²	136.7	77%	0.773	82%	0.82	S	S	*	*			trans	-74.6	123.7	163.8	-6.7	23.8	0	0	0	111
231	V	27	Very low	28.2	Very low	133 Å²	133	145.3 Å²	145.3	81%	0.806	83%	0.83	S	S	*	*			trans	-66.5	130.1	165.6	174.1	0	0	0	0	108.9	M229 E233	M229-V231 PolarHBondContact O-N 3.48Å; V231-E233 PolarHBondContact O-N 2.86Å
232	L	28	Very low	28.3	Very low	161 Å²	161	148.6 Å²	148.6	84%	0.843	83%	0.828	S	S	*	*			trans	-80.5	93	170.9	-93.1	159.6	0	0	0	109.7	V234	L232-V234 PolarHBondContact O-N 2.95Å
233	E	21.6	Very low	27.6	Very low	182 Å²	182	148 Å²	148	85%	0.85	82%	0.824	S	S	*	*			trans	-62.4	121.9	161.5	-74.9	-172.4	132.9	0	0	109.7	V231	V231-E233 PolarHBondContact O-N 2.86Å
234	V	30.3	Very low	27.4	Very low	131 Å²	131	148.5 Å²	148.5	79%	0.794	82%	0.821	S	S	*	*			trans	-112.6	100.1	167.9	179.5	0	0	0	0	107.6	L232	L232-V234 PolarHBondContact O-N 2.95Å
235	S	26.4	Very low	26.8	Very low	126 Å²	126	145.5 Å²	145.5	88%	0.881	81%	0.814	S	S	*	*			trans	-150.5	114.6	171.7	-80.6	0	0	0	0	109.5
236	G	26.1	Very low	26.8	Very low	78 Å²	78	142.4 Å²	142.4	80%	0.804	81%	0.805	S	S	*	*			trans	171.9	50.9	-170	0	0	0	0	0	112.8
237	L	29.5	Very low	26.8	Very low	168 Å²	168	139.8 Å²	139.8	88%	0.88	80%	0.8	S	S	*	*			trans	-70.1	139.4	170.8	-83.1	157.8	0	0	0	110.5
238	S	24.3	Very low	26.9	Very low	122 Å²	122	142 Å²	142	85%	0.853	80%	0.798	S	S	*	*			trans	-138	96.4	167.2	-69.4	0	0	0	0	109.9
239	T	26.2	Very low	26.7	Very low	127 Å²	127	144.9 Å²	144.9	78%	0.779	80%	0.799	S	S	*	*			trans	-86.4	157	170.6	35.4	0	0	0	0	111.5
240	P	39.5	Very low	26.6	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	79%	0.791	S	S	*	*			trans	-92.9	141.6	-162.4	34.7	-34.6	0	0	0	113.5
241	R	24.5	Very low	26.5	Very low	256 Å²	256	142 Å²	142	97%	0.966	79%	0.793	S	S	*	*			trans	-159.5	151.9	152.1	-112.1	160	-164.8	-175.3	4.2	113.8
242	K	30.7	Very low	26.9	Very low	198 Å²	198	141.8 Å²	141.8	86%	0.861	80%	0.795	S	S	*	*			trans	-69.3	151.8	-175.7	-55.4	169.2	176	179.7	0	112.7
243	L	21.7	Very low	26.5	Very low	150 Å²	150	137.3 Å²	137.3	79%	0.785	79%	0.787	S	S	*	*				-175.7	128.5	129.1	-94.1	156.4	0	0	0	107.5
244	L	23.8	Very low	26.6	Very low	156 Å²	156	134.4 Å²	134.4	82%	0.817	79%	0.788	S	S	*	*				55.8	137.4	107.7	-108.8	65.2	0	0	0	115.3
245	D	21.5	Very low	26.2	Very low	132 Å²	132	134 Å²	134	71%	0.706	79%	0.79	S	S	*	*			cis	-173.2	166.2	-22.9	-179.1	25.7	0	0	0	107
246	S	24.3	Very low	26.2	Very low	91 Å²	91	133 Å²	133	64%	0.636	78%	0.783	S	S	*	*			trans	16.3	140.4	146.9	-67.2	0	0	0	0	119.5
247	S	26.2	Very low	26.3	Very low	91 Å²	91	135.4 Å²	135.4	64%	0.636	78%	0.782	S	S	*	*			cis	-178.2	175.3	22.7	36.7	0	0	0	0	107.3
248	Q	30.1	Very low	26.3	Very low	155 Å²	155	138.3 Å²	138.3	72%	0.724	78%	0.782	S	S	*	*				176.7	152.1	73.8	-75	-169	3.5	0	0	105.8
249	F	26.1	Very low	26.5	Very low	175 Å²	175	141.6 Å²	141.6	77%	0.768	78%	0.783	S	S	*	*			cis	-161.2	161.3	9.1	-125.9	-143.4	0	0	0	105.7
250	S	24.7	Very low	26.8	Very low	98 Å²	98	143.9 Å²	143.9	69%	0.685	79%	0.79	S	S	*	*			cis	-149.5	155.5	16.8	-57.6	0	0	0	0	111.9
251	T	25	Very low	26.3	Very low	133 Å²	133	145.2 Å²	145.2	82%	0.816	79%	0.786	S	S	*	*			trans	-100	-169.3	164.6	65.1	0	0	0	0	109.2
252	P	34.4	Very low	26.7	Very low	129 Å²	129	140.2 Å²	140.2	84%	0.838	77%	0.773	S	S	*	*			cis	-135.4	170.3	42.7	36.4	-15.7	0	0	0	115.4
253	G	20.5	Very low	26.3	Very low	67 Å²	67	138 Å²	138	69%	0.691	77%	0.771	S	S	*	*			cis	171.3	168.7	-7	0	0	0	0	0	113.7
254	S	22	Very low	26.9	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	77%	0.767	S	S	*	*			trans	56.2	107.9	159.8	-179.3	0	0	0	0	121.2
255	S	22.1	Very low	27.2	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	77%	0.768	S	S	*	*				-171	161.9	102.2	56.9	0	0	0	0	112
256	S	27	Very low	27.4	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	76%	0.763	S	S	*	*			trans	-110.8	160.6	-176.2	66.7	0	0	0	0	112.7
257	V	28.8	Very low	27.9	Very low	129 Å²	129	141.5 Å²	141.5	78%	0.782	77%	0.774	S	S	*	*	S	Bend	trans	79.2	125.6	160.2	176.5	0	0	0	0	116.2
258	R	29.2	Very low	28.3	Very low	229 Å²	229	141.3 Å²	141.3	86%	0.864	77%	0.772	S	S	*	*			trans	76	112.3	179.7	-65.8	168.1	174.9	-178	-2.5	116.3
259	E	28.6	Very low	28.5	Very low	190 Å²	190	142 Å²	142	89%	0.888	78%	0.775	S	S	*	*			trans	-152.5	54.2	138.4	-115.9	159.3	-142.8	0	0	110.7	Q261	E259-Q261 VanDerWaalsContact C-N 3.3Å
260	L	32.8	Very low	28.8	Very low	175 Å²	175	138.4 Å²	138.4	92%	0.916	78%	0.778	S	S	*	*	S	Bend	trans	-98.4	54	154	-100.9	171.6	0	0	0	108.3
261	Q	28.1	Very low	29.3	Very low	147 Å²	147	140.1 Å²	140.1	69%	0.687	78%	0.78	S	S	*	*	S	Bend	trans	-162.3	134.6	170.1	-156.1	75.2	52.1	0	0	109.5	E259	E259-Q261 VanDerWaalsContact C-N 3.3Å
262	Q	32.5	Very low	30.1	Very low	150 Å²	150	141.7 Å²	141.7	70%	0.701	78%	0.782	S	S	*	*			trans	55.5	94.8	164.3	-75.6	163.4	-40.2	0	0	117.2	I264	Q262-I264 HydrophobicContact CG-CD1 4.23Å; Q262-I264 HydrophobicContact CG-CG1 4.29Å
263	D	23.7	Very low	30.2	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	77%	0.771	S	S	*	*				-123.2	93.3	114.4	-147.8	-2.4	0	0	0	109.1	R265	D263-R265 PolarHBondContact O-N 3.22Å
264	I	33.3	Very low	31.4	Very low	139 Å²	139	146.3 Å²	146.3	71%	0.713	79%	0.785	S	S	*	*			trans	-78.3	79.4	169.7	-60.1	173.1	0	0	0	105.6	Q262 D266	Q262-I264 HydrophobicContact CG-CD1 4.23Å; Q262-I264 HydrophobicContact CG-CG1 4.29Å; I264-D266 PolarHBondContact O-N 3.06Å
265	R	29.9	Very low	32.7	Very low	220 Å²	220	144.4 Å²	144.4	83%	0.83	77%	0.768	S	S	*	*			trans	-81.1	107.7	167.4	-139.5	173.2	-170.9	-154.5	-1.5	108.1	D263	D263-R265 PolarHBondContact O-N 3.22Å
266	D	26.1	Very low	34.3	Very low	113 Å²	113	142.9 Å²	142.9	60%	0.604	75%	0.75	S	S	*	*			trans	-48.9	120.6	-177.9	-148.9	-43.3	0	0	0	110.2	I264 S268	I264-D266 PolarHBondContact O-N 3.06Å; D266-S268 PolarHBondContact O-N 3.36Å; D266-S268 PolarHBondContact OD1-OG 3.36Å
267	P	35.5	Very low	35.7	Very low	132 Å²	132	139.7 Å²	139.7	86%	0.857	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	21.7	-170.1	32.3	-37.3	0	0	0	113.6
268	S	33.2	Very low	37.4	Very low	87 Å²	87	134.6 Å²	134.6	61%	0.608	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-8.8	-175.1	51	0	0	0	0	113.9	D266	D266-S268 PolarHBondContact O-N 3.36Å; D266-S268 PolarHBondContact OD1-OG 3.36Å
269	Q	35.2	Very low	39	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	68%	0.684	S	S	*	*			trans	-135.9	57.4	-177.5	-68.2	-170.7	-12.4	0	0	113.6
270	A	32.4	Very low	41.1	Very low	101 Å²	101	125.2 Å²	125.2	84%	0.835	66%	0.663	S	S	*	*			trans	-98.5	79.1	153.5	0	0	0	0	0	107.9	L272	A270-L272 PolarHBondContact O-N 2.95Å
271	D	34.3	Very low	43.1	Very low	134 Å²	134	118.2 Å²	118.2	72%	0.717	63%	0.628	S	S	*	*			trans	-61.2	122	174.5	-85.7	-42.3	0	0	0	110.4	S273	D271-S273 PolarHBondContact O-N 3.44Å
272	L	43.2	Very low	45.4	Very low	165 Å²	165	113 Å²	113	86%	0.864	61%	0.611	S	S	*	*			trans	31.6	58.7	144	-64.9	165	0	0	0	116.6	A270	A270-L272 PolarHBondContact O-N 2.95Å
273	S	36.6	Very low	47.6	Very low	87 Å²	87	111.5 Å²	111.5	61%	0.608	60%	0.604	S	S	*	*			trans	-78.5	121.2	162.7	52.6	0	0	0	0	109.6	D271 V275	D271-S273 PolarHBondContact O-N 3.44Å; S273-V275 PolarHBondContact O-N 3.43Å
274	E	45.5	Very low	50.3	Low	207 Å²	207	104.4 Å²	104.4	97%	0.967	57%	0.566	S	S	*	*			trans	-68.7	30.4	177.4	-58.6	-177.2	131.9	0	0	114
275	V	48.8	Very low	52.6	Low	82 Å²	82	98.1 Å²	98.1	50%	0.497	53%	0.533	S	S	.	.	S	Bend	trans	-94.9	127.9	178.4	-177.7	0	0	0	0	107.9	S273 P277 E279	S273-V275 PolarHBondContact O-N 3.43Å; V275-P277 VanDerWaalsContact O-CD 3.3Å; V275-P277 WeakPolarHBondContact O-CD 3.36Å; V275-P277 VanDerWaalsContact O-N 3.16Å; V275-E279 HydrophobicContact CG1-CG 4.33Å
276	D	55.2	Low	55.1	Low	90 Å²	90	87.7 Å²	87.7	48%	0.481	49%	0.494	S	S	.	.			trans	-57	118.6	175.4	-177.5	6.9	0	0	0	109.3	E278 E279	D276-E278 PolarHBondContact O-N 3.03Å; D276-E278 WeakPolarHBondContact OD1-CB 3.42Å; D276-E278 PolarHBondContact OD1-N 3.46Å; D276-E279 HydrophobicContact CB-CG 4.41Å; D276-E279 PolarHBondContact O-N 3.44Å
277	P	57.2	Low	57.8	Low	37 Å²	37	84.7 Å²	84.7	24%	0.24	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-18.9	-179.8	-27.4	35.7	0	0	0	113.5	V275 F284	V275-P277 VanDerWaalsContact O-CD 3.3Å; V275-P277 WeakPolarHBondContact O-CD 3.36Å; V275-P277 VanDerWaalsContact O-N 3.16Å; P277-F284 HydrophobicContact CB-CD2 3.82Å; P277-F284 HydrophobicContact CB-CE2 3.77Å; P277-F284 WeakPolarHBondContact O-CD2 3.36Å
278	E	64.6	Low	60	Low	23 Å²	23	78.4 Å²	78.4	11%	0.107	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-9.8	178.2	-94.2	-161.2	-133.8	0	0	116.1	K146 R196 K201 D276	K146-E278 IonicContact NZ-OE1 3.55Å; K146-E278 PolarHBondContact NZ-OE1 2.93Å; R196-E278 IonicContact NH2-OE1 2.7Å; R196-E278 IonicContact NH2-OE2 2.63Å; K201-E278 VanDerWaalsContact NZ-CD 3.31Å; K201-E278 PolarHBondContact NZ-O 2.84Å; K201-E278 IonicContact NZ-OE2 3.67Å; K201-E278 PolarHBondContact NZ-OE2 3.24Å; D276-E278 PolarHBondContact O-N 3.03Å; D276-E278 WeakPolarHBondContact OD1-CB 3.42Å; D276-E278 PolarHBondContact OD1-N 3.46Å
279	E	61.8	Low	62.5	Low	138 Å²	138	74.4 Å²	74.4	65%	0.645	41%	0.409	S	S	*	.	S	Bend	trans	-61.4	-51.4	-177.3	-75.1	-155.7	143.2	0	0	112.5	V275 D276 S281	V275-E279 HydrophobicContact CG1-CG 4.33Å; D276-E279 HydrophobicContact CB-CG 4.41Å; D276-E279 PolarHBondContact O-N 3.44Å; E279-S281 PolarHBondContact O-N 3.33Å
280	N	72.3	Confident	64.6	Low	84 Å²	84	71.2 Å²	71.2	45%	0.449	39%	0.392	S	S	.	.	S	Bend	trans	-96.4	84.2	178.7	-170.6	4.6	0	0	0	111.2	A282 E283 F284	N280-A282 PolarHBondContact O-N 3.45Å; N280-E283 HydrophobicContact CB-CB 4.12Å; N280-E283 WeakPolarHBondContact ND2-CB 3.37Å; N280-E283 PolarHBondContact ND2-OE2 3.36Å; N280-E283 PolarHBondContact O-N 3.33Å; N280-E283 VanDerWaalsContact O-N 3.1Å; N280-F284 PolarHBondContact O-N 2.92Å
281	S	76.6	Confident	67	Low	27 Å²	27	66.4 Å²	66.4	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-55.8	-27	-176.1	-173.2	0	0	0	0	114.8	H197 E279 M285	H197-S281 PolarHBondContact ND1-OG 2.74Å; E279-S281 PolarHBondContact O-N 3.33Å; S281-M285 WeakPolarHBondContact O-CE 3.24Å; S281-M285 VanDerWaalsContact O-CG 3.29Å; S281-M285 WeakPolarHBondContact O-CG 3.48Å; S281-M285 PolarHBondContact O-N 3.48Å
282	A	76.5	Confident	69.3	Low	39 Å²	39	60 Å²	60	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-70.6	-47.6	177.5	0	0	0	0	0	111.3	N280 M285 G286 V364	N280-A282 PolarHBondContact O-N 3.45Å; A282-M285 PolarHBondContact O-N 3.11Å; A282-G286 PolarHBondContact O-N 3.03Å; A282-G286 VanDerWaalsContact O-N 3.14Å; A282-V364 HydrophobicContact CB-CG1 4.04Å
283	E	77	Confident	71.1	Confident	118 Å²	118	53.3 Å²	53.3	55%	0.551	29%	0.287	S	S	*	.	H	α-helix	trans	-67.7	-38.7	178.7	-174.8	161.7	-155.5	0	0	111.8	N280 M285 G286 I287	N280-E283 HydrophobicContact CB-CB 4.12Å; N280-E283 WeakPolarHBondContact ND2-CB 3.37Å; N280-E283 PolarHBondContact ND2-OE2 3.36Å; N280-E283 PolarHBondContact O-N 3.33Å; N280-E283 VanDerWaalsContact O-N 3.1Å; E283-M285 PolarHBondContact O-N 3.31Å; E283-G286 CarbonylContact O-C 3.59Å; E283-G286 WeakPolarHBondContact O-CA 3.41Å; E283-G286 PolarHBondContact O-N 3.47Å; E283-G286 VanDerWaalsContact O-N 3.07Å; E283-I287 WeakPolarHBondContact O-CG1 3.31Å; E283-I287 PolarHBondContact O-N 3.42Å
284	F	81.8	Confident	73.1	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-42.4	173.4	-169	-104.2	0	0	0	113	Y148 E193 H197 P277 N280 G286 I287 L288	Y148-F284 HydrophobicContact CD2-CE2 4.31Å; Y148-F284 AromaticContact CD2-CZ 3.87Å; Y148-F284 HydrophobicContact CD2-CZ 3.87Å; Y148-F284 AromaticContact CE2-CZ 3.85Å; Y148-F284 HydrophobicContact CE2-CZ 3.85Å; E193-F284 HydrophobicContact CG-CE1 3.95Å; E193-F284 HydrophobicContact CG-CZ 4.39Å; H197-F284 AromaticContact CD2-CD1 3.92Å; H197-F284 AromaticContact CD2-CE1 3.89Å; H197-F284 AromaticContact CE1-CD1 3.23Å; H197-F284 WeakPolarHBondContact CE1-CD1 3.4Å; H197-F284 AromaticContact CE1-CE1 3.77Å; H197-F284 AromaticContact CE1-CG 3.98Å; H197-F284 AromaticContact ND1-CD1 3.72Å; H197-F284 AromaticContact NE2-CD1 3.42Å; H197-F284 WeakPolarHBondContact NE2-CD1 3.47Å; H197-F284 AromaticContact NE2-CE1 3.44Å; H197-F284 WeakPolarHBondContact NE2-CE1 3.3Å; P277-F284 HydrophobicContact CB-CD2 3.82Å; P277-F284 HydrophobicContact CB-CE2 3.77Å; P277-F284 WeakPolarHBondContact O-CD2 3.36Å; N280-F284 PolarHBondContact O-N 2.92Å; F284-G286 VanDerWaalsContact C-N 3.27Å; F284-G286 PolarHBondContact O-N 2.97Å; F284-I287 WeakPolarHBondContact O-CB 3.5Å; F284-I287 PolarHBondContact O-N 2.75Å; F284-I287 VanDerWaalsContact O-N 3.09Å; F284-L288 HydrophobicContact CD1-CD1 3.91Å; F284-L288 HydrophobicContact CD1-CG 4.23Å; F284-L288 HydrophobicContact CE1-CD1 3.76Å; F284-L288 HydrophobicContact CE1-CD2 4.28Å; F284-L288 HydrophobicContact CE1-CG 4.08Å; F284-L288 HydrophobicContact CZ-CD2 4.4Å; F284-L288 WeakPolarHBondContact O-CG 3.49Å; F284-L288 PolarHBondContact O-N 3.12Å
285	M	81.8	Confident	74.7	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-39.9	171.4	-72.6	-175.7	-59	0	0	111.3	L194 H197 L198 S281 A282 E283 I287 L288 I289 A361 V364 V365	L194-M285 HydrophobicContact CD1-CB 4.17Å; L194-M285 HydrophobicContact CD1-CG 3.96Å; H197-M285 HydrophobicContact CB-CG 3.95Å; H197-M285 HydrophobicContact CB-SD 4.21Å; L198-M285 HydrophobicContact CD2-SD 4.21Å; L198-M285 HydrophobicContact CG-SD 4.42Å; S281-M285 WeakPolarHBondContact O-CE 3.24Å; S281-M285 VanDerWaalsContact O-CG 3.29Å; S281-M285 WeakPolarHBondContact O-CG 3.48Å; S281-M285 PolarHBondContact O-N 3.48Å; A282-M285 PolarHBondContact O-N 3.11Å; E283-M285 PolarHBondContact O-N 3.31Å; M285-I287 PolarHBondContact O-N 3.44Å; M285-L288 PolarHBondContact O-N 3.46Å; M285-I289 VanDerWaalsContact O-CD1 3.32Å; M285-I289 WeakPolarHBondContact O-CD1 3.32Å; M285-I289 WeakPolarHBondContact O-CG1 3.43Å; M285-I289 PolarHBondContact O-N 3.23Å; M285-A361 HydrophobicContact CE-CB 4.21Å; M285-A361 HydrophobicContact SD-CB 4.38Å; M285-V364 HydrophobicContact CE-CB 4.17Å; M285-V364 HydrophobicContact CE-CG1 4.01Å; M285-V365 HydrophobicContact CB-CG2 4.23Å; M285-V365 HydrophobicContact CG-CG2 4.47Å; M285-V365 HydrophobicContact SD-CG2 3.86Å
286	G	81.3	Confident	76.1	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-40	171.3	0	0	0	0	0	113.8	A282 E283 F284 K290 H368	A282-G286 PolarHBondContact O-N 3.03Å; A282-G286 VanDerWaalsContact O-N 3.14Å; E283-G286 CarbonylContact O-C 3.59Å; E283-G286 WeakPolarHBondContact O-CA 3.41Å; E283-G286 PolarHBondContact O-N 3.47Å; E283-G286 VanDerWaalsContact O-N 3.07Å; F284-G286 VanDerWaalsContact C-N 3.27Å; F284-G286 PolarHBondContact O-N 2.97Å; G286-K290 WeakPolarHBondContact O-CB 3.46Å; G286-K290 WeakPolarHBondContact O-CD 3.43Å; G286-K290 WeakPolarHBondContact O-CG 3.44Å; G286-K290 PolarHBondContact O-N 2.73Å; G286-H368 WeakPolarHBondContact CA-CD2 3.33Å
287	I	82.7	Confident	77.3	Confident	51 Å²	51	48.1 Å²	48.1	26%	0.262	24%	0.24	S	C	.	.	H	α-helix	trans	-64.3	-44.3	175.4	-67.9	168	0	0	0	111	L149 E283 F284 M285 K290 A291	L149-I287 HydrophobicContact CB-CG2 3.75Å; E283-I287 WeakPolarHBondContact O-CG1 3.31Å; E283-I287 PolarHBondContact O-N 3.42Å; F284-I287 WeakPolarHBondContact O-CB 3.5Å; F284-I287 PolarHBondContact O-N 2.75Å; F284-I287 VanDerWaalsContact O-N 3.09Å; M285-I287 PolarHBondContact O-N 3.44Å; I287-K290 PolarHBondContact O-N 3.02Å; I287-A291 PolarHBondContact O-N 3.34Å
288	L	82.9	Confident	78.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-44.9	176.6	-66.7	174.3	0	0	0	112.1	Y148 L190 E193 L194 F284 M285 A291 L292	Y148-L288 HydrophobicContact CD2-CD2 3.72Å; Y148-L288 HydrophobicContact CE2-CD2 4.34Å; Y148-L288 HydrophobicContact CG-CD2 4.09Å; L190-L288 HydrophobicContact CD2-CD2 3.55Å; E193-L288 HydrophobicContact CB-CD1 4.34Å; E193-L288 HydrophobicContact CG-CD1 4.47Å; L194-L288 HydrophobicContact CB-CD1 4.06Å; L194-L288 HydrophobicContact CD1-CD1 4.28Å; F284-L288 HydrophobicContact CD1-CD1 3.91Å; F284-L288 HydrophobicContact CD1-CG 4.23Å; F284-L288 HydrophobicContact CE1-CD1 3.76Å; F284-L288 HydrophobicContact CE1-CD2 4.28Å; F284-L288 HydrophobicContact CE1-CG 4.08Å; F284-L288 HydrophobicContact CZ-CD2 4.4Å; F284-L288 WeakPolarHBondContact O-CG 3.49Å; F284-L288 PolarHBondContact O-N 3.12Å; M285-L288 PolarHBondContact O-N 3.46Å; L288-A291 WeakPolarHBondContact O-CB 3.35Å; L288-A291 PolarHBondContact O-N 3.06Å; L288-L292 WeakPolarHBondContact O-CG 3.25Å; L288-L292 PolarHBondContact O-N 3.46Å
289	I	83.8	Confident	78.9	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-66.2	-39.8	178.4	-59.1	156.3	0	0	0	110.7	M285 A291 L292 A293 L298 V365 H368 M369 I372	M285-I289 VanDerWaalsContact O-CD1 3.32Å; M285-I289 WeakPolarHBondContact O-CD1 3.32Å; M285-I289 WeakPolarHBondContact O-CG1 3.43Å; M285-I289 PolarHBondContact O-N 3.23Å; I289-A291 VanDerWaalsContact C-N 3.3Å; I289-A291 PolarHBondContact O-N 2.95Å; I289-L292 PolarHBondContact O-N 2.87Å; I289-A293 WeakPolarHBondContact O-CB 3.48Å; I289-A293 PolarHBondContact O-N 3.26Å; I289-L298 HydrophobicContact CG2-CD2 4.15Å; I289-V365 HydrophobicContact CD1-CB 4.04Å; I289-V365 HydrophobicContact CD1-CG1 3.8Å; I289-V365 HydrophobicContact CD1-CG2 4.09Å; I289-V365 HydrophobicContact CG1-CG1 4.44Å; I289-H368 HydrophobicContact CD1-CB 3.74Å; I289-M369 HydrophobicContact CD1-CG 4.42Å; I289-M369 HydrophobicContact CG2-CG 3.68Å; I289-I372 HydrophobicContact CB-CD1 4.43Å; I289-I372 HydrophobicContact CG2-CD1 3.69Å
290	K	80.8	Confident	79.8	Confident	102 Å²	102	44 Å²	44	44%	0.443	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-38.3	173.2	-73.9	167.9	-176.2	175.8	0	111.9	L149 G286 I287 K294 I372	L149-K290 HydrophobicContact CD1-CB 4.03Å; G286-K290 WeakPolarHBondContact O-CB 3.46Å; G286-K290 WeakPolarHBondContact O-CD 3.43Å; G286-K290 WeakPolarHBondContact O-CG 3.44Å; G286-K290 PolarHBondContact O-N 2.73Å; I287-K290 PolarHBondContact O-N 3.02Å; K290-K294 PolarHBondContact O-N 2.95Å; K290-K294 VanDerWaalsContact O-N 3.09Å; K290-I372 HydrophobicContact CG-CD1 3.99Å
291	A	81.9	Confident	80.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-46	174.3	0	0	0	0	0	112.1	L149 T152 L190 I287 L288 I289 A293 K294 L295	L149-A291 HydrophobicContact CD1-CB 4.31Å; T152-A291 HydrophobicContact CG2-CB 4.33Å; L190-A291 HydrophobicContact CD1-CB 3.89Å; L190-A291 HydrophobicContact CD2-CB 3.84Å; I287-A291 PolarHBondContact O-N 3.34Å; L288-A291 WeakPolarHBondContact O-CB 3.35Å; L288-A291 PolarHBondContact O-N 3.06Å; I289-A291 VanDerWaalsContact C-N 3.3Å; I289-A291 PolarHBondContact O-N 2.95Å; A291-A293 VanDerWaalsContact C-N 3.28Å; A291-A293 PolarHBondContact O-N 3.13Å; A291-K294 PolarHBondContact O-N 2.61Å; A291-K294 VanDerWaalsContact O-N 3.16Å; A291-L295 PolarHBondContact O-N 3.23Å; A291-L295 VanDerWaalsContact O-N 3.14Å
292	L	82.4	Confident	80.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-33.5	175.9	-71.5	165.4	0	0	0	112.8	H187 L190 I191 L194 L288 I289 L295 K296 K297 L298 T301	H187-L292 HydrophobicContact CB-CD2 4.19Å; L190-L292 HydrophobicContact CB-CD1 4.22Å; L190-L292 HydrophobicContact CB-CD2 3.65Å; L190-L292 HydrophobicContact CB-CG 3.87Å; L190-L292 HydrophobicContact CD1-CD2 3.86Å; L190-L292 HydrophobicContact CD1-CG 4.04Å; L190-L292 HydrophobicContact CG-CD2 4.41Å; I191-L292 HydrophobicContact CG1-CD1 4.28Å; I191-L292 HydrophobicContact CG1-CD2 4.1Å; L194-L292 HydrophobicContact CD2-CD1 4.29Å; L288-L292 WeakPolarHBondContact O-CG 3.25Å; L288-L292 PolarHBondContact O-N 3.46Å; I289-L292 PolarHBondContact O-N 2.87Å; L292-L295 PolarHBondContact O-N 3.33Å; L292-K296 PolarHBondContact O-N 2.96Å; L292-K297 PolarHBondContact O-N 3.42Å; L292-L298 HydrophobicContact CB-CD2 4.49Å; L292-T301 HydrophobicContact CD1-CG2 3.84Å
293	A	81.9	Confident	81	Confident	24 Å²	24	43.4 Å²	43.4	20%	0.198	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-45.7	171.5	0	0	0	0	0	112.4	I289 A291 L295 K296 L298 I372	I289-A293 WeakPolarHBondContact O-CB 3.48Å; I289-A293 PolarHBondContact O-N 3.26Å; A291-A293 VanDerWaalsContact C-N 3.28Å; A291-A293 PolarHBondContact O-N 3.13Å; A293-L295 PolarHBondContact O-N 3.39Å; A293-K296 PolarHBondContact O-N 2.89Å; A293-L298 HydrophobicContact CB-CD1 4.03Å; A293-L298 HydrophobicContact CB-CD2 4.22Å; A293-L298 HydrophobicContact CB-CG 4.27Å; A293-I372 HydrophobicContact CB-CD1 4.31Å; A293-I372 HydrophobicContact CB-CG2 3.71Å
294	K	78.5	Confident	81.4	Confident	90 Å²	90	38.7 Å²	38.7	39%	0.391	19%	0.187	S	C	.	.	H	α-helix	trans	-59.3	-28.3	174	-76.6	-168.2	174.4	-168.1	0	112.9	L149 T152 D153 K290 A291 K296	L149-K294 HydrophobicContact CD1-CD 4.15Å; T152-K294 HydrophobicContact CG2-CB 4.25Å; D153-K294 HydrophobicContact CB-CD 4.45Å; D153-K294 IonicContact OD1-NZ 2.9Å; D153-K294 PolarHBondContact OD1-NZ 3.45Å; D153-K294 IonicContact OD2-NZ 3.97Å; D153-K294 PolarHBondContact OD2-NZ 3.42Å; K290-K294 PolarHBondContact O-N 2.95Å; K290-K294 VanDerWaalsContact O-N 3.09Å; A291-K294 PolarHBondContact O-N 2.61Å; A291-K294 VanDerWaalsContact O-N 3.16Å; K294-K296 VanDerWaalsContact C-N 3.34Å
295	L	78.8	Confident	81.6	Confident	17 Å²	17	38.6 Å²	38.6	9%	0.089	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.7	175	-68.4	165.8	0	0	0	114.4	T152 V156 K183 I186 H187 L190 A291 L292 A293 K297	T152-L295 HydrophobicContact CG2-CD1 3.91Å; T152-L295 HydrophobicContact CG2-CD2 3.92Å; T152-L295 HydrophobicContact CG2-CG 3.6Å; V156-L295 HydrophobicContact CG2-CD2 3.95Å; K183-L295 HydrophobicContact CG-CD2 4.16Å; I186-L295 HydrophobicContact CG2-CD1 3.84Å; I186-L295 HydrophobicContact CG2-CD2 4.2Å; H187-L295 HydrophobicContact CB-CD1 4.07Å; L190-L295 HydrophobicContact CD1-CD1 3.53Å; A291-L295 PolarHBondContact O-N 3.23Å; A291-L295 VanDerWaalsContact O-N 3.14Å; L292-L295 PolarHBondContact O-N 3.33Å; A293-L295 PolarHBondContact O-N 3.39Å; L295-K297 VanDerWaalsContact C-N 3.27Å; L295-K297 HydrophobicContact CB-CB 4.32Å; L295-K297 HydrophobicContact CB-CG 4.29Å; L295-K297 PolarHBondContact O-N 2.96Å
296	K	78.9	Confident	81.7	Confident	182 Å²	182	40.8 Å²	40.8	79%	0.791	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	35	-170	-58.1	-171.5	174.3	-168.6	0	113.5	L292 A293 K294	L292-K296 PolarHBondContact O-N 2.96Å; A293-K296 PolarHBondContact O-N 2.89Å; K294-K296 VanDerWaalsContact C-N 3.34Å
297	K	80	Confident	81.9	Confident	68 Å²	68	47.9 Å²	47.9	30%	0.296	23%	0.231	S	C	.	.			trans	-113.2	22	-175.3	-75.1	-65.1	-169.5	-177.7	0	114.8	H187 L292 L295 D300 T301	H187-K297 HydrophobicContact CB-CB 4.45Å; H187-K297 HydrophobicContact CB-CG 4.37Å; L292-K297 PolarHBondContact O-N 3.42Å; L295-K297 VanDerWaalsContact C-N 3.27Å; L295-K297 HydrophobicContact CB-CB 4.32Å; L295-K297 HydrophobicContact CB-CG 4.29Å; L295-K297 PolarHBondContact O-N 2.96Å; K297-D300 HydrophobicContact CD-CB 4.33Å; K297-D300 WeakPolarHBondContact CD-OD2 3.49Å; K297-D300 WeakPolarHBondContact CE-OD2 3.45Å; K297-D300 IonicContact NZ-OD2 3.63Å; K297-D300 PolarHBondContact NZ-OD2 2.91Å; K297-T301 PolarHBondContact O-N 3.23Å; K297-T301 PolarHBondContact O-OG1 3.44Å
298	L	77.9	Confident	82.1	Confident	18 Å²	18	49.8 Å²	49.8	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-46.9	175.2	-66	173.5	0	0	0	114.8	I289 L292 A293 D300 T301 T302 M369 I372 I385	I289-L298 HydrophobicContact CG2-CD2 4.15Å; L292-L298 HydrophobicContact CB-CD2 4.49Å; A293-L298 HydrophobicContact CB-CD1 4.03Å; A293-L298 HydrophobicContact CB-CD2 4.22Å; A293-L298 HydrophobicContact CB-CG 4.27Å; L298-D300 PolarHBondContact O-N 3.47Å; L298-T301 WeakPolarHBondContact O-CB 3.35Å; L298-T301 PolarHBondContact O-N 3.06Å; L298-T302 PolarHBondContact O-N 3.42Å; L298-T302 PolarHBondContact O-OG1 2.97Å; L298-M369 HydrophobicContact CD2-CE 4.37Å; L298-I372 HydrophobicContact CD1-CG2 4.05Å; L298-I385 HydrophobicContact CD1-CD1 4.32Å
299	P	78.3	Confident	82.2	Confident	37 Å²	37	49.8 Å²	49.8	24%	0.24	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-36.1	-179.2	24.5	-33.7	0	0	0	112.9	T301 T302 K303	P299-T301 VanDerWaalsContact C-N 3.32Å; P299-T302 PolarHBondContact O-N 3.27Å; P299-K303 WeakPolarHBondContact O-CG 3.43Å; P299-K303 PolarHBondContact O-N 3.31Å; P299-K303 VanDerWaalsContact O-N 3.1Å
300	D	80.7	Confident	82.4	Confident	56 Å²	56	52.6 Å²	52.6	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-67.3	-35.4	174.3	-65.6	-19.3	0	0	0	111.4	K297 L298 K303 A304	K297-D300 HydrophobicContact CD-CB 4.33Å; K297-D300 WeakPolarHBondContact CD-OD2 3.49Å; K297-D300 WeakPolarHBondContact CE-OD2 3.45Å; K297-D300 IonicContact NZ-OD2 3.63Å; K297-D300 PolarHBondContact NZ-OD2 2.91Å; L298-D300 PolarHBondContact O-N 3.47Å; D300-K303 PolarHBondContact O-N 3.31Å; D300-A304 WeakPolarHBondContact O-CB 3.45Å; D300-A304 PolarHBondContact O-N 3.27Å
301	T	82.4	Confident	82.7	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-46.5	172.4	-55.1	0	0	0	0	111.2	I191 L194 L292 K297 L298 P299 K303 A304 I305	I191-T301 HydrophobicContact CG1-CG2 4.34Å; L194-T301 HydrophobicContact CD2-CG2 4.11Å; L292-T301 HydrophobicContact CD1-CG2 3.84Å; K297-T301 PolarHBondContact O-N 3.23Å; K297-T301 PolarHBondContact O-OG1 3.44Å; L298-T301 WeakPolarHBondContact O-CB 3.35Å; L298-T301 PolarHBondContact O-N 3.06Å; P299-T301 VanDerWaalsContact C-N 3.32Å; T301-K303 VanDerWaalsContact C-N 3.35Å; T301-K303 PolarHBondContact O-N 3.43Å; T301-A304 PolarHBondContact O-N 3.07Å; T301-I305 HydrophobicContact CG2-CD1 3.83Å; T301-I305 HydrophobicContact CG2-CG1 4.4Å; T301-I305 WeakPolarHBondContact O-CG1 3.21Å; T301-I305 PolarHBondContact O-N 3.04Å
302	T	83.6	Confident	82.9	Confident	12 Å²	12	53 Å²	53	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-57	-46.5	176.6	-61.5	0	0	0	0	111.7	L298 P299 M306 M369 Y388	L298-T302 PolarHBondContact O-N 3.42Å; L298-T302 PolarHBondContact O-OG1 2.97Å; P299-T302 PolarHBondContact O-N 3.27Å; T302-M306 WeakPolarHBondContact O-CB 3.45Å; T302-M306 WeakPolarHBondContact O-CG 3.41Å; T302-M306 PolarHBondContact O-N 2.95Å; T302-M306 VanDerWaalsContact O-N 3.14Å; T302-M369 WeakPolarHBondContact OG1-CE 3.27Å; T302-Y388 HydrophobicContact CG2-CD1 4.05Å
303	K	84.4	Confident	83.2	Confident	124 Å²	124	53 Å²	53	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-50	176.9	-69.5	171.5	-174.7	167.8	0	111.4	P299 D300 T301 I305 M306 E307	P299-K303 WeakPolarHBondContact O-CG 3.43Å; P299-K303 PolarHBondContact O-N 3.31Å; P299-K303 VanDerWaalsContact O-N 3.1Å; D300-K303 PolarHBondContact O-N 3.31Å; T301-K303 VanDerWaalsContact C-N 3.35Å; T301-K303 PolarHBondContact O-N 3.43Å; K303-I305 VanDerWaalsContact C-N 3.35Å; K303-I305 PolarHBondContact O-N 3.22Å; K303-M306 PolarHBondContact O-N 2.86Å; K303-M306 VanDerWaalsContact O-N 3.16Å; K303-E307 WeakPolarHBondContact O-CG 3.42Å; K303-E307 PolarHBondContact O-N 2.96Å
304	A	84.6	Confident	83.4	Confident	18 Å²	18	56.6 Å²	56.6	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-41.6	-179.3	0	0	0	0	0	112.9	I191 D300 T301 R308	I191-A304 HydrophobicContact CG2-CB 4.04Å; D300-A304 WeakPolarHBondContact O-CB 3.45Å; D300-A304 PolarHBondContact O-N 3.27Å; T301-A304 PolarHBondContact O-N 3.07Å; A304-R308 WeakPolarHBondContact O-CB 3.42Å; A304-R308 WeakPolarHBondContact O-CG 3.41Å; A304-R308 PolarHBondContact O-N 2.7Å
305	I	85.8	Confident	83.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-47.4	175.6	-70.3	170.7	0	0	0	110.6	L194 L198 T301 K303 R308 L309 V365 Y388	L194-I305 HydrophobicContact CD2-CD1 3.99Å; L198-I305 HydrophobicContact CD1-CD1 4.47Å; L198-I305 HydrophobicContact CD1-CG1 4.49Å; T301-I305 HydrophobicContact CG2-CD1 3.83Å; T301-I305 HydrophobicContact CG2-CG1 4.4Å; T301-I305 WeakPolarHBondContact O-CG1 3.21Å; T301-I305 PolarHBondContact O-N 3.04Å; K303-I305 VanDerWaalsContact C-N 3.35Å; K303-I305 PolarHBondContact O-N 3.22Å; I305-R308 PolarHBondContact O-N 3.03Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 PolarHBondContact O-N 2.95Å; I305-V365 HydrophobicContact CD1-CG1 4.44Å; I305-Y388 HydrophobicContact CD1-CE1 4.39Å; I305-Y388 HydrophobicContact CG2-CE1 4.24Å
306	M	83.5	Confident	84.1	Confident	53 Å²	53	55.2 Å²	55.2	26%	0.261	26%	0.263	S	S	.	.	H	α-helix	trans	-67.8	-36.9	-177.4	-74.8	-62.2	-71.9	0	0	113.4	T302 K303 L309 Y388 D392	T302-M306 WeakPolarHBondContact O-CB 3.45Å; T302-M306 WeakPolarHBondContact O-CG 3.41Å; T302-M306 PolarHBondContact O-N 2.95Å; T302-M306 VanDerWaalsContact O-N 3.14Å; K303-M306 PolarHBondContact O-N 2.86Å; K303-M306 VanDerWaalsContact O-N 3.16Å; M306-L309 HydrophobicContact SD-CD2 4.5Å; M306-Y388 HydrophobicContact CG-CG 4.38Å; M306-Y388 HydrophobicContact SD-CD2 4.16Å; M306-Y388 HydrophobicContact SD-CG 4.01Å; M306-D392 HydrophobicContact CE-CB 3.72Å; M306-D392 HydrophobicContact SD-CB 4.31Å
307	E	86.5	Confident	84.5	Confident	149 Å²	149	46.8 Å²	46.8	70%	0.696	23%	0.227	S	C	*	.	H	α-helix	trans	-69.9	-37.9	175.5	-72.6	174.6	-179.7	0	0	112.2	K303 P311	K303-E307 WeakPolarHBondContact O-CG 3.42Å; K303-E307 PolarHBondContact O-N 2.96Å; E307-P311 WeakPolarHBondContact O-CD 3.4Å
308	R	86.6	Confident	84.7	Confident	92 Å²	92	50.3 Å²	50.3	35%	0.347	24%	0.242	S	C	.	.	H	α-helix	trans	-83.5	-17.4	179.6	-64.6	-161.4	-161.2	178.8	1.8	114.8	D192 H195 A304 I305 E310 P311 E312	D192-R308 IonicContact OD1-CZ 2.71Å; D192-R308 IonicContact OD1-NH1 2.79Å; D192-R308 PolarHBondContact OD1-NH1 3.16Å; D192-R308 IonicContact OD1-NH2 3.19Å; H195-R308 VanDerWaalsContact CE1-CD 3.43Å; H195-R308 WeakPolarHBondContact CE1-CD 3.44Å; H195-R308 PolarHBondContact ND1-NH1 2.86Å; A304-R308 WeakPolarHBondContact O-CB 3.42Å; A304-R308 WeakPolarHBondContact O-CG 3.41Å; A304-R308 PolarHBondContact O-N 2.7Å; I305-R308 PolarHBondContact O-N 3.03Å; R308-E310 PolarHBondContact O-N 2.93Å; R308-P311 VanDerWaalsContact O-CD 3.23Å; R308-P311 WeakPolarHBondContact O-CD 3.35Å; R308-P311 VanDerWaalsContact O-CG 3.3Å; R308-P311 WeakPolarHBondContact O-CG 3.43Å; R308-E312 WeakPolarHBondContact O-CB 3.33Å; R308-E312 VanDerWaalsContact O-CG 3.28Å; R308-E312 WeakPolarHBondContact O-CG 3.41Å; R308-E312 PolarHBondContact O-N 3.08Å; R308-E312 VanDerWaalsContact O-N 3.09Å
309	L	85.4	Confident	85	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.5	-49.7	-176.4	175.4	61	0	0	0	113.6	Y199 I305 M306 L313 V393 K396	Y199-L309 HydrophobicContact CE1-CD1 3.81Å; Y199-L309 WeakPolarHBondContact OH-CA 3.21Å; Y199-L309 WeakPolarHBondContact OH-CD1 3.32Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 PolarHBondContact O-N 2.95Å; M306-L309 HydrophobicContact SD-CD2 4.5Å; L309-L313 HydrophobicContact CD1-CD1 3.75Å; L309-L313 HydrophobicContact CD1-CG 4.03Å; L309-L313 HydrophobicContact CG-CD1 4Å; L309-L313 WeakPolarHBondContact O-CB 3.09Å; L309-L313 WeakPolarHBondContact O-CG 3.14Å; L309-L313 PolarHBondContact O-N 3.46Å; L309-V393 HydrophobicContact CD1-CG1 4.49Å; L309-V393 HydrophobicContact CD2-CB 4.48Å; L309-V393 HydrophobicContact CD2-CG1 4.48Å; L309-V393 HydrophobicContact CD2-CG2 4.37Å; L309-K396 HydrophobicContact CD2-CB 3.79Å; L309-K396 HydrophobicContact CD2-CG 3.82Å; L309-K396 HydrophobicContact CG-CB 4.07Å; L309-K396 HydrophobicContact CG-CG 4.32Å
310	E	86.8	Confident	85.4	Confident	60 Å²	60	51.4 Å²	51.4	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-47.6	-178.6	-168.4	-179.7	139.2	0	0	114.4	R308 L313 K314 K396 V400	R308-E310 PolarHBondContact O-N 2.93Å; E310-L313 PolarHBondContact O-N 3.33Å; E310-K314 WeakPolarHBondContact O-CG 3.33Å; E310-K314 PolarHBondContact O-N 2.88Å; E310-K314 VanDerWaalsContact O-N 3.13Å; E310-K314 WeakPolarHBondContact OE1-CE 3.28Å; E310-K314 IonicContact OE1-NZ 2.62Å; E310-K314 PolarHBondContact OE1-NZ 3.04Å; E310-K396 HydrophobicContact CB-CD 4.34Å; E310-K396 IonicContact OE2-NZ 2.77Å; E310-K396 PolarHBondContact OE2-NZ 3.1Å; E310-V400 HydrophobicContact CG-CG2 4.18Å
311	P	88.4	Confident	85.6	Confident	73 Å²	73	49.1 Å²	49.1	47%	0.474	23%	0.229	S	C	.	.	H	α-helix	trans	-65.5	-36.1	176.6	23.1	-32.2	0	0	0	113.2	E307 R308 K314 Q315	E307-P311 WeakPolarHBondContact O-CD 3.4Å; R308-P311 VanDerWaalsContact O-CD 3.23Å; R308-P311 WeakPolarHBondContact O-CD 3.35Å; R308-P311 VanDerWaalsContact O-CG 3.3Å; R308-P311 WeakPolarHBondContact O-CG 3.43Å; P311-K314 PolarHBondContact O-N 2.93Å; P311-Q315 PolarHBondContact O-N 3.29Å
312	E	86.4	Confident	85.6	Confident	39 Å²	39	51.8 Å²	51.8	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-42.9	176.2	-73.4	-66.9	156.5	0	0	112	Y199 R308 K314 Q315 I316	Y199-E312 HydrophobicContact CD1-CB 4.01Å; Y199-E312 HydrophobicContact CD2-CB 3.77Å; Y199-E312 HydrophobicContact CD2-CG 3.6Å; Y199-E312 HydrophobicContact CE1-CB 4.21Å; Y199-E312 HydrophobicContact CE2-CB 3.97Å; Y199-E312 HydrophobicContact CE2-CG 3.82Å; Y199-E312 HydrophobicContact CG-CB 3.79Å; Y199-E312 HydrophobicContact CG-CG 4.09Å; R308-E312 WeakPolarHBondContact O-CB 3.33Å; R308-E312 VanDerWaalsContact O-CG 3.28Å; R308-E312 WeakPolarHBondContact O-CG 3.41Å; R308-E312 PolarHBondContact O-N 3.08Å; R308-E312 VanDerWaalsContact O-N 3.09Å; E312-K314 VanDerWaalsContact C-N 3.31Å; E312-K314 PolarHBondContact O-N 3.22Å; E312-Q315 CarbonylContact O-C 3.52Å; E312-Q315 WeakPolarHBondContact O-CB 3.32Å; E312-Q315 PolarHBondContact O-N 3.48Å; E312-Q315 PolarHBondContact OE2-OE1 3.02Å; E312-I316 WeakPolarHBondContact O-CG1 3.21Å; E312-I316 PolarHBondContact O-N 3.49Å
313	L	87.6	Confident	85.5	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-42.2	172.8	-71.4	170.3	0	0	0	111.6	L309 E310 Q315 I316 V317 F355 V358 K396 I397 V400	L309-L313 HydrophobicContact CD1-CD1 3.75Å; L309-L313 HydrophobicContact CD1-CG 4.03Å; L309-L313 HydrophobicContact CG-CD1 4Å; L309-L313 WeakPolarHBondContact O-CB 3.09Å; L309-L313 WeakPolarHBondContact O-CG 3.14Å; L309-L313 PolarHBondContact O-N 3.46Å; E310-L313 PolarHBondContact O-N 3.33Å; L313-Q315 VanDerWaalsContact C-N 3.33Å; L313-Q315 PolarHBondContact O-N 2.89Å; L313-I316 PolarHBondContact O-N 2.81Å; L313-V317 WeakPolarHBondContact O-CG2 3.4Å; L313-V317 PolarHBondContact O-N 3.21Å; L313-F355 HydrophobicContact CB-CE1 4.31Å; L313-F355 HydrophobicContact CD2-CD1 3.5Å; L313-F355 HydrophobicContact CD2-CE1 3.45Å; L313-F355 VanDerWaalsContact CD2-CE1 3.45Å; L313-F355 HydrophobicContact CD2-CZ 4.43Å; L313-F355 HydrophobicContact CG-CE1 4.48Å; L313-V358 HydrophobicContact CD2-CG1 4.33Å; L313-K396 HydrophobicContact CD1-CB 4.06Å; L313-I397 HydrophobicContact CD1-CG1 3.91Å; L313-I397 HydrophobicContact CD2-CG1 3.95Å; L313-V400 HydrophobicContact CB-CB 4.43Å; L313-V400 HydrophobicContact CB-CG1 4.31Å; L313-V400 HydrophobicContact CB-CG2 3.97Å; L313-V400 HydrophobicContact CD1-CG2 4.4Å
314	K	86.9	Confident	85.4	Confident	99 Å²	99	49.6 Å²	49.6	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-64.6	-34.8	173.7	-69.4	172.5	-173.2	169.2	0	112.3	E310 P311 E312 V317 K318 V400	E310-K314 WeakPolarHBondContact O-CG 3.33Å; E310-K314 PolarHBondContact O-N 2.88Å; E310-K314 VanDerWaalsContact O-N 3.13Å; E310-K314 WeakPolarHBondContact OE1-CE 3.28Å; E310-K314 IonicContact OE1-NZ 2.62Å; E310-K314 PolarHBondContact OE1-NZ 3.04Å; P311-K314 PolarHBondContact O-N 2.93Å; E312-K314 VanDerWaalsContact C-N 3.31Å; E312-K314 PolarHBondContact O-N 3.22Å; K314-V317 WeakPolarHBondContact O-CB 3.4Å; K314-V317 PolarHBondContact O-N 3.42Å; K314-K318 PolarHBondContact O-N 2.93Å; K314-V400 HydrophobicContact CG-CG1 4.24Å; K314-V400 HydrophobicContact CG-CG2 4.15Å
315	Q	85.9	Confident	85.1	Confident	75 Å²	75	49.4 Å²	49.4	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-70.6	-36.9	175.6	-156.1	-175.5	39	0	0	112.1	P311 E312 L313 V317 K318 R319	P311-Q315 PolarHBondContact O-N 3.29Å; E312-Q315 CarbonylContact O-C 3.52Å; E312-Q315 WeakPolarHBondContact O-CB 3.32Å; E312-Q315 PolarHBondContact O-N 3.48Å; E312-Q315 PolarHBondContact OE2-OE1 3.02Å; L313-Q315 VanDerWaalsContact C-N 3.33Å; L313-Q315 PolarHBondContact O-N 2.89Å; Q315-V317 VanDerWaalsContact C-N 3.31Å; Q315-V317 PolarHBondContact O-N 2.95Å; Q315-K318 PolarHBondContact O-N 3.25Å; Q315-R319 VanDerWaalsContact CD-CZ 3.48Å; Q315-R319 WeakPolarHBondContact O-CB 3.38Å; Q315-R319 WeakPolarHBondContact O-CG 3.43Å; Q315-R319 PolarHBondContact O-N 3.17Å
316	I	85.9	Confident	84.7	Confident	3 Å²	3	52 Å²	52	2%	0.015	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-41.4	170.8	-69.2	165	0	0	0	110.6	Y199 T203 E312 L313 S320 L351 K354 F355 V358	Y199-I316 HydrophobicContact CD1-CD1 4.32Å; T203-I316 HydrophobicContact CG2-CD1 4.15Å; E312-I316 WeakPolarHBondContact O-CG1 3.21Å; E312-I316 PolarHBondContact O-N 3.49Å; L313-I316 PolarHBondContact O-N 2.81Å; I316-S320 VanDerWaalsContact O-CB 3.31Å; I316-S320 WeakPolarHBondContact O-CB 3.2Å; I316-S320 PolarHBondContact O-N 2.95Å; I316-S320 PolarHBondContact O-OG 3.32Å; I316-L351 HydrophobicContact CG2-CD2 4.39Å; I316-K354 HydrophobicContact CG2-CB 4.13Å; I316-K354 HydrophobicContact CG2-CD 4.06Å; I316-F355 HydrophobicContact CB-CE1 4.34Å; I316-F355 HydrophobicContact CG2-CD1 4.48Å; I316-F355 HydrophobicContact CG2-CE1 3.98Å; I316-V358 HydrophobicContact CD1-CG2 3.89Å
317	V	87.3	Confident	84.4	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-55.8	171.6	175.9	0	0	0	0	110.7	L313 K314 Q315 R319 S320 T321 L351 F355 V400 L404	L313-V317 WeakPolarHBondContact O-CG2 3.4Å; L313-V317 PolarHBondContact O-N 3.21Å; K314-V317 WeakPolarHBondContact O-CB 3.4Å; K314-V317 PolarHBondContact O-N 3.42Å; Q315-V317 VanDerWaalsContact C-N 3.31Å; Q315-V317 PolarHBondContact O-N 2.95Å; V317-R319 VanDerWaalsContact C-N 3.33Å; V317-R319 PolarHBondContact O-N 3.43Å; V317-S320 PolarHBondContact O-N 3.14Å; V317-S320 VanDerWaalsContact O-N 3.07Å; V317-T321 WeakPolarHBondContact O-CB 3.11Å; V317-T321 PolarHBondContact O-N 3.1Å; V317-T321 PolarHBondContact O-OG1 3.07Å; V317-T321 VanDerWaalsContact O-OG1 3.08Å; V317-L351 HydrophobicContact CG2-CD1 4.27Å; V317-L351 HydrophobicContact CG2-CD2 4.05Å; V317-F355 HydrophobicContact CG2-CZ 3.77Å; V317-V400 HydrophobicContact CG2-CG1 3.91Å; V317-L404 HydrophobicContact CG1-CD1 3.79Å; V317-L404 HydrophobicContact CG1-CD2 4.11Å
318	K	84.9	Confident	83.9	Confident	143 Å²	143	46.5 Å²	46.5	62%	0.622	22%	0.222	S	C	*	.	H	α-helix	trans	-53.2	-47.4	-179.6	-169.2	179.1	-178.8	-176	0	112.1	K314 Q315 T322	K314-K318 PolarHBondContact O-N 2.93Å; Q315-K318 PolarHBondContact O-N 3.25Å; K318-T322 PolarHBondContact O-N 3.45Å; K318-T322 VanDerWaalsContact O-N 3.1Å; K318-T322 PolarHBondContact O-OG1 3.46Å; K318-T322 VanDerWaalsContact O-OG1 3.12Å
319	R	84.1	Confident	83.2	Confident	77 Å²	77	48.5 Å²	48.5	29%	0.291	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-40.3	177.7	-71.9	173.1	178.7	146.6	1	112.7	Q315 V317 T322 Q323	Q315-R319 VanDerWaalsContact CD-CZ 3.48Å; Q315-R319 WeakPolarHBondContact O-CB 3.38Å; Q315-R319 WeakPolarHBondContact O-CG 3.43Å; Q315-R319 PolarHBondContact O-N 3.17Å; V317-R319 VanDerWaalsContact C-N 3.33Å; V317-R319 PolarHBondContact O-N 3.43Å; R319-T322 WeakPolarHBondContact CA-OG1 3.47Å; R319-T322 PolarHBondContact O-OG1 2.75Å; R319-Q323 WeakPolarHBondContact O-CB 3.33Å; R319-Q323 PolarHBondContact O-N 3.04Å
320	S	85.4	Confident	82.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-73.8	-39.9	-179.2	-54.3	0	0	0	0	112.2	I316 V317 T322 Q323 I324 K354	I316-S320 VanDerWaalsContact O-CB 3.31Å; I316-S320 WeakPolarHBondContact O-CB 3.2Å; I316-S320 PolarHBondContact O-N 2.95Å; I316-S320 PolarHBondContact O-OG 3.32Å; V317-S320 PolarHBondContact O-N 3.14Å; V317-S320 VanDerWaalsContact O-N 3.07Å; S320-T322 PolarHBondContact O-N 3.14Å; S320-Q323 WeakPolarHBondContact O-CB 3.32Å; S320-Q323 PolarHBondContact O-N 3.36Å; S320-I324 PolarHBondContact O-N 2.73Å; S320-I324 VanDerWaalsContact O-N 3.12Å; S320-K354 WeakPolarHBondContact OG-CD 3.12Å; S320-K354 PolarHBondContact OG-NZ 3.09Å
321	T	84.4	Confident	82	Confident	9 Å²	9	55.4 Å²	55.4	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-46.3	171.5	-63.3	0	0	0	0	111.1	V317 I324 A325 K494 V496	V317-T321 WeakPolarHBondContact O-CB 3.11Å; V317-T321 PolarHBondContact O-N 3.1Å; V317-T321 PolarHBondContact O-OG1 3.07Å; V317-T321 VanDerWaalsContact O-OG1 3.08Å; T321-I324 PolarHBondContact O-N 2.83Å; T321-A325 WeakPolarHBondContact O-CB 3.41Å; T321-A325 PolarHBondContact O-N 3.07Å; T321-K494 WeakPolarHBondContact CG2-O 3.41Å; T321-V496 HydrophobicContact CG2-CG2 3.83Å
322	T	82.6	Confident	80.9	Confident	58 Å²	58	54.6 Å²	54.6	36%	0.356	26%	0.264	S	S	.	.	H	α-helix	trans	-65.2	-40.1	174.9	47	0	0	0	0	112.8	K318 R319 S320 I324 A325 D326	K318-T322 PolarHBondContact O-N 3.45Å; K318-T322 VanDerWaalsContact O-N 3.1Å; K318-T322 PolarHBondContact O-OG1 3.46Å; K318-T322 VanDerWaalsContact O-OG1 3.12Å; R319-T322 WeakPolarHBondContact CA-OG1 3.47Å; R319-T322 PolarHBondContact O-OG1 2.75Å; S320-T322 PolarHBondContact O-N 3.14Å; T322-I324 VanDerWaalsContact C-N 3.29Å; T322-I324 PolarHBondContact O-N 3.09Å; T322-A325 PolarHBondContact O-N 3.33Å; T322-D326 WeakPolarHBondContact O-CB 3.36Å; T322-D326 PolarHBondContact O-N 3.41Å
323	Q	82.1	Confident	80	Confident	78 Å²	78	55.5 Å²	55.5	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-57.7	-41.2	179.1	-177.2	-178.8	-2.6	0	0	112.1	R319 S320 H327	R319-Q323 WeakPolarHBondContact O-CB 3.33Å; R319-Q323 PolarHBondContact O-N 3.04Å; S320-Q323 WeakPolarHBondContact O-CB 3.32Å; S320-Q323 PolarHBondContact O-N 3.36Å; Q323-H327 PolarHBondContact O-N 3.2Å
324	I	82.8	Confident	78.8	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-82.2	-38.1	-179.2	-66.7	173.3	0	0	0	111.6	S320 T321 T322 D326 H327 A328 E346 L347 L350 V496	S320-I324 PolarHBondContact O-N 2.73Å; S320-I324 VanDerWaalsContact O-N 3.12Å; T321-I324 PolarHBondContact O-N 2.83Å; T322-I324 VanDerWaalsContact C-N 3.29Å; T322-I324 PolarHBondContact O-N 3.09Å; I324-D326 VanDerWaalsContact C-N 3.28Å; I324-D326 PolarHBondContact O-N 2.72Å; I324-H327 PolarHBondContact O-N 3.34Å; I324-H327 VanDerWaalsContact O-N 3.11Å; I324-A328 WeakPolarHBondContact O-CB 3.49Å; I324-A328 PolarHBondContact O-N 2.82Å; I324-E346 HydrophobicContact CD1-CB 4.24Å; I324-E346 WeakPolarHBondContact CD1-O 3.35Å; I324-L347 HydrophobicContact CD1-CB 3.77Å; I324-L347 HydrophobicContact CD1-CD1 4.01Å; I324-L350 HydrophobicContact CD1-CB 4.36Å; I324-L350 HydrophobicContact CD1-CD2 3.83Å; I324-L350 HydrophobicContact CG1-CD2 4.13Å; I324-V496 HydrophobicContact CG2-CG1 3.83Å
325	A	78.4	Confident	77.5	Confident	15 Å²	15	58.8 Å²	58.8	12%	0.124	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-40.3	173.4	0	0	0	0	0	112.1	T321 T322 Y329 L335	T321-A325 WeakPolarHBondContact O-CB 3.41Å; T321-A325 PolarHBondContact O-N 3.07Å; T322-A325 PolarHBondContact O-N 3.33Å; A325-Y329 WeakPolarHBondContact O-CB 3.36Å; A325-Y329 PolarHBondContact O-N 3.35Å; A325-L335 HydrophobicContact CB-CD1 4.3Å
326	D	77.2	Confident	75.9	Confident	54 Å²	54	58.7 Å²	58.7	29%	0.289	30%	0.302	S	S	.	.	H	α-helix	trans	-71.4	-30.9	175.1	-77	-31.8	0	0	0	112.8	T322 I324 Q330 R466	T322-D326 WeakPolarHBondContact O-CB 3.36Å; T322-D326 PolarHBondContact O-N 3.41Å; I324-D326 VanDerWaalsContact C-N 3.28Å; I324-D326 PolarHBondContact O-N 2.72Å; D326-Q330 WeakPolarHBondContact O-CG 3.32Å; D326-Q330 PolarHBondContact O-N 3.03Å; D326-Q330 VanDerWaalsContact O-N 3.07Å; D326-Q330 PolarHBondContact O-NE2 3.42Å; D326-R466 VanDerWaalsContact OD1-CD 3.25Å; D326-R466 WeakPolarHBondContact OD1-CD 3.36Å; D326-R466 IonicContact OD1-NH1 3.69Å
327	H	76.7	Confident	74.2	Confident	87 Å²	87	66 Å²	66	40%	0.403	34%	0.336	S	S	.	.	H	α-helix	trans	-71.3	-44.1	174.5	-175.2	-103.3	0	0	0	112.2	Q323 I324 Y329 Q330 R331	Q323-H327 PolarHBondContact O-N 3.2Å; I324-H327 PolarHBondContact O-N 3.34Å; I324-H327 VanDerWaalsContact O-N 3.11Å; H327-Y329 VanDerWaalsContact C-N 3.31Å; H327-Y329 PolarHBondContact O-N 3.47Å; H327-Q330 CarbonylContact O-C 3.58Å; H327-Q330 WeakPolarHBondContact O-CA 3.45Å; H327-Q330 WeakPolarHBondContact O-CB 3.48Å; H327-Q330 PolarHBondContact O-N 2.88Å; H327-Q330 VanDerWaalsContact O-N 3.1Å; H327-R331 PolarHBondContact CE1-NH1 3.02Å; H327-R331 PolarHBondContact O-N 2.93Å
328	A	75.9	Confident	72.6	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-42.3	173.6	0	0	0	0	0	111.3	I324 Q330 R331 G332 E333 L335 L343	I324-A328 WeakPolarHBondContact O-CB 3.49Å; I324-A328 PolarHBondContact O-N 2.82Å; A328-Q330 VanDerWaalsContact C-N 3.33Å; A328-Q330 PolarHBondContact O-N 3.01Å; A328-R331 CarbonylContact O-C 3.56Å; A328-R331 PolarHBondContact O-N 3.1Å; A328-R331 VanDerWaalsContact O-N 3.09Å; A328-G332 PolarHBondContact O-N 2.88Å; A328-G332 VanDerWaalsContact O-N 3.13Å; A328-E333 VanDerWaalsContact CA-OE2 3.32Å; A328-E333 WeakPolarHBondContact CA-OE2 3.46Å; A328-E333 HydrophobicContact CB-CB 4.2Å; A328-E333 WeakPolarHBondContact CB-OE2 3.4Å; A328-E333 WeakPolarHBondContact O-CB 3.46Å; A328-E333 PolarHBondContact O-N 3.49Å; A328-L335 HydrophobicContact CB-CD2 4.24Å; A328-L343 HydrophobicContact CB-CD1 3.9Å; A328-L343 HydrophobicContact CB-CD2 4.25Å
329	Y	70.9	Confident	71.2	Confident	134 Å²	134	69.1 Å²	69.1	53%	0.525	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-38.8	172.8	-171.4	-101	0	0	0	112.7	A325 H327 R331 G332 R466	A325-Y329 WeakPolarHBondContact O-CB 3.36Å; A325-Y329 PolarHBondContact O-N 3.35Å; H327-Y329 VanDerWaalsContact C-N 3.31Å; H327-Y329 PolarHBondContact O-N 3.47Å; Y329-R331 VanDerWaalsContact C-N 3.34Å; Y329-G332 PolarHBondContact O-N 3.21Å; Y329-G332 VanDerWaalsContact O-N 3.12Å; Y329-R466 VanDerWaalsContact CE1-NH1 3.33Å
330	Q	73.6	Confident	70.5	Confident	105 Å²	105	66.8 Å²	66.8	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-67.5	-29.3	173.5	-80.2	158.2	71.8	0	0	113.1	D326 H327 A328 G332	D326-Q330 WeakPolarHBondContact O-CG 3.32Å; D326-Q330 PolarHBondContact O-N 3.03Å; D326-Q330 VanDerWaalsContact O-N 3.07Å; D326-Q330 PolarHBondContact O-NE2 3.42Å; H327-Q330 CarbonylContact O-C 3.58Å; H327-Q330 WeakPolarHBondContact O-CA 3.45Å; H327-Q330 WeakPolarHBondContact O-CB 3.48Å; H327-Q330 PolarHBondContact O-N 2.88Å; H327-Q330 VanDerWaalsContact O-N 3.1Å; A328-Q330 VanDerWaalsContact C-N 3.33Å; A328-Q330 PolarHBondContact O-N 3.01Å; Q330-G332 VanDerWaalsContact C-N 3.27Å
331	R	74.7	Confident	69.9	Low	99 Å²	99	68 Å²	68	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-77	-8.4	170.4	-68.7	-166.4	-66.6	-140.7	-9.2	113.6	H327 A328 Y329 E333 E346	H327-R331 PolarHBondContact CE1-NH1 3.02Å; H327-R331 PolarHBondContact O-N 2.93Å; A328-R331 CarbonylContact O-C 3.56Å; A328-R331 PolarHBondContact O-N 3.1Å; A328-R331 VanDerWaalsContact O-N 3.09Å; Y329-R331 VanDerWaalsContact C-N 3.34Å; R331-E333 HydrophobicContact CB-CG 3.93Å; R331-E333 IonicContact CZ-OE1 2.73Å; R331-E333 IonicContact CZ-OE2 2.8Å; R331-E333 VanDerWaalsContact CZ-OE2 3.26Å; R331-E333 VanDerWaalsContact NE-CD 3.3Å; R331-E333 IonicContact NE-OE1 3.53Å; R331-E333 PolarHBondContact NE-OE1 3.4Å; R331-E333 IonicContact NE-OE2 3.93Å; R331-E333 PolarHBondContact NE-OE2 3.07Å; R331-E333 IonicContact NH2-OE1 3.75Å; R331-E333 IonicContact NH2-OE2 3.25Å; R331-E333 PolarHBondContact NH2-OE2 3.37Å; R331-E346 IonicContact CZ-OE1 3.53Å; R331-E346 IonicContact CZ-OE2 3.78Å; R331-E346 IonicContact NH1-OE1 3.98Å; R331-E346 PolarHBondContact NH1-OE1 2.66Å; R331-E346 IonicContact NH1-OE2 2.73Å; R331-E346 IonicContact NH2-OE1 2.74Å; R331-E346 PolarHBondContact NH2-OE1 2.73Å; R331-E346 IonicContact NH2-OE2 2.83Å; R331-E346 PolarHBondContact NH2-OE2 3.34Å
332	G	65.4	Low	69.7	Low	57 Å²	57	76.9 Å²	76.9	59%	0.588	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	16.5	-175.4	0	0	0	0	0	114.3	A328 Y329 Q330	A328-G332 PolarHBondContact O-N 2.88Å; A328-G332 VanDerWaalsContact O-N 3.13Å; Y329-G332 PolarHBondContact O-N 3.21Å; Y329-G332 VanDerWaalsContact O-N 3.12Å; Q330-G332 VanDerWaalsContact C-N 3.27Å
333	E	68.1	Low	69.6	Low	57 Å²	57	74.3 Å²	74.3	27%	0.266	38%	0.379	S	S	.	.			trans	-80.8	124	-176	-64.6	169.2	148.1	0	0	111.1	A328 R331 L335	A328-E333 VanDerWaalsContact CA-OE2 3.32Å; A328-E333 WeakPolarHBondContact CA-OE2 3.46Å; A328-E333 HydrophobicContact CB-CB 4.2Å; A328-E333 WeakPolarHBondContact CB-OE2 3.4Å; A328-E333 WeakPolarHBondContact O-CB 3.46Å; A328-E333 PolarHBondContact O-N 3.49Å; R331-E333 HydrophobicContact CB-CG 3.93Å; R331-E333 IonicContact CZ-OE1 2.73Å; R331-E333 IonicContact CZ-OE2 2.8Å; R331-E333 VanDerWaalsContact CZ-OE2 3.26Å; R331-E333 VanDerWaalsContact NE-CD 3.3Å; R331-E333 IonicContact NE-OE1 3.53Å; R331-E333 PolarHBondContact NE-OE1 3.4Å; R331-E333 IonicContact NE-OE2 3.93Å; R331-E333 PolarHBondContact NE-OE2 3.07Å; R331-E333 IonicContact NH2-OE1 3.75Å; R331-E333 IonicContact NH2-OE2 3.25Å; R331-E333 PolarHBondContact NH2-OE2 3.37Å; E333-L335 PolarHBondContact O-N 3.36Å
334	N	60.7	Low	69.8	Low	111 Å²	111	70.8 Å²	70.8	59%	0.594	36%	0.363	S	S	*	.			trans	-85.4	90.8	-178.5	-81.3	-51.2	0	0	0	112.1	A336 Q337	N334-A336 PolarHBondContact O-N 2.95Å; N334-Q337 PolarHBondContact O-N 3.49Å; N334-Q337 VanDerWaalsContact O-N 3.11Å
335	L	59.3	Low	70	Confident	57 Å²	57	72.1 Å²	72.1	30%	0.298	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-23.9	176.7	-65.1	163.1	0	0	0	115.5	A325 A328 E333 L343 V496	A325-L335 HydrophobicContact CB-CD1 4.3Å; A328-L335 HydrophobicContact CB-CD2 4.24Å; E333-L335 PolarHBondContact O-N 3.36Å; L335-L343 HydrophobicContact CD2-CD1 3.84Å; L335-V496 HydrophobicContact CD2-CG1 3.99Å; L335-V496 VanDerWaalsContact CD2-O 3.23Å; L335-V496 WeakPolarHBondContact CD2-O 3.42Å
336	A	54	Low	70.3	Confident	74 Å²	74	74.3 Å²	74.3	61%	0.612	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.8	-174.3	0	0	0	0	0	115.6	N334 K498	N334-A336 PolarHBondContact O-N 2.95Å; A336-K498 WeakPolarHBondContact O-CE 3.34Å; A336-K498 PolarHBondContact O-NZ 3.12Å
337	Q	50.5	Low	70.8	Confident	157 Å²	157	71.8 Å²	71.8	73%	0.734	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-26.6	-169.6	-89.5	-178.7	-32.5	0	0	115.7	N334	N334-Q337 PolarHBondContact O-N 3.49Å; N334-Q337 VanDerWaalsContact O-N 3.11Å
338	E	53.1	Low	71.4	Confident	121 Å²	121	67.8 Å²	67.8	57%	0.565	35%	0.346	S	S	*	.	S	Bend	trans	-113.9	145.2	-178.6	-70.6	-178.7	171.3	0	0	112.5	Q340	E338-Q340 HydrophobicContact CB-CG 3.65Å; E338-Q340 PolarHBondContact O-N 3.16Å; E338-Q340 VanDerWaalsContact O-N 3.1Å; E338-Q340 PolarHBondContact OE2-NE2 3.06Å
339	S	55.7	Low	72	Confident	90 Å²	90	72.5 Å²	72.5	63%	0.629	37%	0.368	S	S	*	.			trans	-72.3	96.9	163.2	-177.7	0	0	0	0	107.4	P341	S339-P341 WeakPolarHBondContact O-CD 3.33Å
340	Q	68.4	Low	72.8	Confident	29 Å²	29	67.5 Å²	67.5	14%	0.136	35%	0.35	C	S	.	.			trans	-111.9	69.1	-179.5	-64.2	-171.5	-10.4	0	0	110.9	E338 R342 L343 C497	E338-Q340 HydrophobicContact CB-CG 3.65Å; E338-Q340 PolarHBondContact O-N 3.16Å; E338-Q340 VanDerWaalsContact O-N 3.1Å; E338-Q340 PolarHBondContact OE2-NE2 3.06Å; Q340-R342 PolarHBondContact O-N 3.48Å; Q340-L343 HydrophobicContact CB-CD1 4.29Å; Q340-L343 HydrophobicContact CB-CG 4.23Å; Q340-L343 PolarHBondContact O-N 3.35Å; Q340-L343 VanDerWaalsContact OE1-CD1 3.32Å; Q340-C497 VanDerWaalsContact C-SG 3.53Å
341	P	72.7	Confident	73.5	Confident	24 Å²	24	62.5 Å²	62.5	16%	0.156	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-14.6	177.9	27.3	-36.1	0	0	0	112.9	S339 L343 L344 L345 V506	S339-P341 WeakPolarHBondContact O-CD 3.33Å; P341-L343 VanDerWaalsContact C-N 3.32Å; P341-L343 PolarHBondContact O-N 3.31Å; P341-L344 WeakPolarHBondContact O-CB 3.49Å; P341-L344 PolarHBondContact O-N 3.43Å; P341-L345 PolarHBondContact O-N 2.64Å; P341-V506 HydrophobicContact CB-CB 4.12Å; P341-V506 HydrophobicContact CB-CG2 3.77Å; P341-V506 HydrophobicContact CG-CG2 3.74Å
342	R	80.2	Confident	74.3	Confident	196 Å²	196	58.3 Å²	58.3	74%	0.74	31%	0.311	S	S	*	.	H	α-helix	trans	-59.2	-36.7	169.9	-64.6	-177.9	-179	171.5	0.6	113.3	Q340 L344 L345 E346	Q340-R342 PolarHBondContact O-N 3.48Å; R342-L344 VanDerWaalsContact C-N 3.34Å; R342-L345 WeakPolarHBondContact O-CB 3.47Å; R342-L345 PolarHBondContact O-N 3.1Å; R342-E346 PolarHBondContact O-N 3.14Å
343	L	82	Confident	75.3	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-73.9	-29.1	178	-58.9	-178.8	0	0	0	112.1	A328 L335 Q340 P341 L347 V496	A328-L343 HydrophobicContact CB-CD1 3.9Å; A328-L343 HydrophobicContact CB-CD2 4.25Å; L335-L343 HydrophobicContact CD2-CD1 3.84Å; Q340-L343 HydrophobicContact CB-CD1 4.29Å; Q340-L343 HydrophobicContact CB-CG 4.23Å; Q340-L343 PolarHBondContact O-N 3.35Å; Q340-L343 VanDerWaalsContact OE1-CD1 3.32Å; P341-L343 VanDerWaalsContact C-N 3.32Å; P341-L343 PolarHBondContact O-N 3.31Å; L343-L347 WeakPolarHBondContact O-CB 3.02Å; L343-L347 PolarHBondContact O-N 2.97Å; L343-V496 HydrophobicContact CB-CG1 3.56Å; L343-V496 HydrophobicContact CD1-CG1 4.02Å; L343-V496 HydrophobicContact CG-CG1 4.4Å
344	L	85.4	Confident	76.2	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-68.5	-36.8	169.8	179.1	61.2	0	0	0	111.1	P341 R342 L347 L348 Y408 C497 N503 I507	P341-L344 WeakPolarHBondContact O-CB 3.49Å; P341-L344 PolarHBondContact O-N 3.43Å; R342-L344 VanDerWaalsContact C-N 3.34Å; L344-L347 HydrophobicContact CD1-CD2 4.49Å; L344-L347 PolarHBondContact O-N 3.36Å; L344-L348 VanDerWaalsContact O-CB 3.32Å; L344-L348 WeakPolarHBondContact O-CB 3.48Å; L344-L348 PolarHBondContact O-N 3.04Å; L344-Y408 HydrophobicContact CD1-CD1 3.64Å; L344-Y408 HydrophobicContact CD1-CD2 4.03Å; L344-Y408 HydrophobicContact CD1-CE1 3.91Å; L344-Y408 HydrophobicContact CD1-CE2 4.29Å; L344-Y408 HydrophobicContact CD1-CG 3.69Å; L344-Y408 HydrophobicContact CD2-CD1 4.09Å; L344-Y408 HydrophobicContact CD2-CG 4.26Å; L344-Y408 HydrophobicContact CG-CD1 4.38Å; L344-C497 HydrophobicContact CB-CB 4.5Å; L344-N503 HydrophobicContact CD2-CB 3.93Å; L344-I507 HydrophobicContact CD2-CD1 4.38Å; L344-I507 HydrophobicContact CD2-CG2 4.02Å; L344-I507 HydrophobicContact CG-CG2 3.98Å
345	L	86.1	Confident	77.6	Confident	40 Å²	40	52.1 Å²	52.1	21%	0.209	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-50.8	171.4	177.6	62.5	0	0	0	111.8	P341 R342 L347 L348 E349 V506 P510	P341-L345 PolarHBondContact O-N 2.64Å; R342-L345 WeakPolarHBondContact O-CB 3.47Å; R342-L345 PolarHBondContact O-N 3.1Å; L345-L347 PolarHBondContact O-N 3.05Å; L345-L348 PolarHBondContact O-N 3.15Å; L345-L348 VanDerWaalsContact O-N 3.1Å; L345-E349 HydrophobicContact CD1-CG 3.98Å; L345-E349 HydrophobicContact CG-CG 4.44Å; L345-E349 WeakPolarHBondContact O-CG 3.35Å; L345-E349 PolarHBondContact O-N 3Å; L345-V506 HydrophobicContact CB-CG1 3.95Å; L345-V506 HydrophobicContact CD2-CG1 3.89Å; L345-V506 HydrophobicContact CG-CG1 4.42Å; L345-P510 HydrophobicContact CD1-CB 4.23Å; L345-P510 HydrophobicContact CD1-CG 3.51Å
346	E	85.8	Confident	78.9	Confident	60 Å²	60	52.8 Å²	52.8	28%	0.28	27%	0.266	S	S	.	.	H	α-helix	trans	-54.2	-39.1	175	-72.6	-176.8	169.7	0	0	111.4	I324 R331 R342 L350	I324-E346 HydrophobicContact CD1-CB 4.24Å; I324-E346 WeakPolarHBondContact CD1-O 3.35Å; R331-E346 IonicContact CZ-OE1 3.53Å; R331-E346 IonicContact CZ-OE2 3.78Å; R331-E346 IonicContact NH1-OE1 3.98Å; R331-E346 PolarHBondContact NH1-OE1 2.66Å; R331-E346 IonicContact NH1-OE2 2.73Å; R331-E346 IonicContact NH2-OE1 2.74Å; R331-E346 PolarHBondContact NH2-OE1 2.73Å; R331-E346 IonicContact NH2-OE2 2.83Å; R331-E346 PolarHBondContact NH2-OE2 3.34Å; R342-E346 PolarHBondContact O-N 3.14Å; E346-L350 VanDerWaalsContact O-CB 3.31Å; E346-L350 WeakPolarHBondContact O-CB 3.4Å; E346-L350 PolarHBondContact O-N 3.47Å
347	L	87.7	Confident	80.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-68	-46.2	175.9	178	62.8	0	0	0	112.6	I324 L343 L344 L345 L350 L351 Y408 V496	I324-L347 HydrophobicContact CD1-CB 3.77Å; I324-L347 HydrophobicContact CD1-CD1 4.01Å; L343-L347 WeakPolarHBondContact O-CB 3.02Å; L343-L347 PolarHBondContact O-N 2.97Å; L344-L347 HydrophobicContact CD1-CD2 4.49Å; L344-L347 PolarHBondContact O-N 3.36Å; L345-L347 PolarHBondContact O-N 3.05Å; L347-L350 PolarHBondContact O-N 2.84Å; L347-L351 HydrophobicContact CD1-CD1 3.93Å; L347-L351 HydrophobicContact CD1-CG 4.05Å; L347-L351 HydrophobicContact CG-CD1 3.91Å; L347-L351 HydrophobicContact CG-CG 4.41Å; L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 VanDerWaalsContact O-CG 3.23Å; L347-L351 WeakPolarHBondContact O-CG 3.43Å; L347-L351 PolarHBondContact O-N 3.27Å; L347-Y408 HydrophobicContact CD2-CE2 4.38Å; L347-V496 HydrophobicContact CD2-CG2 4.02Å
348	L	88.3	Confident	82.2	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-40.8	-176.1	-167.8	65.8	0	0	0	111.4	L344 L345 L351 F352 L401 I507 L511	L344-L348 VanDerWaalsContact O-CB 3.32Å; L344-L348 WeakPolarHBondContact O-CB 3.48Å; L344-L348 PolarHBondContact O-N 3.04Å; L345-L348 PolarHBondContact O-N 3.15Å; L345-L348 VanDerWaalsContact O-N 3.1Å; L348-L351 PolarHBondContact O-N 3Å; L348-F352 HydrophobicContact CD1-CD1 4.29Å; L348-F352 HydrophobicContact CD1-CE1 3.54Å; L348-F352 HydrophobicContact CD1-CE2 4.42Å; L348-F352 HydrophobicContact CD1-CZ 3.63Å; L348-F352 HydrophobicContact CD2-CE1 4.39Å; L348-F352 HydrophobicContact CD2-CE2 3.95Å; L348-F352 HydrophobicContact CD2-CZ 3.61Å; L348-F352 HydrophobicContact CG-CD1 4.38Å; L348-F352 HydrophobicContact CG-CD2 4.33Å; L348-F352 HydrophobicContact CG-CE1 3.73Å; L348-F352 HydrophobicContact CG-CE2 3.67Å; L348-F352 HydrophobicContact CG-CZ 3.33Å; L348-F352 WeakPolarHBondContact O-CB 3.31Å; L348-F352 WeakPolarHBondContact O-CD1 3.41Å; L348-F352 WeakPolarHBondContact O-CD2 3.46Å; L348-F352 WeakPolarHBondContact O-CG 3.31Å; L348-F352 PolarHBondContact O-N 3.06Å; L348-L401 HydrophobicContact CD1-CD2 4.04Å; L348-I507 HydrophobicContact CD2-CB 3.74Å; L348-I507 HydrophobicContact CD2-CG2 4.05Å; L348-L511 HydrophobicContact CD2-CB 4.44Å
349	E	89.1	Confident	83.8	Confident	100 Å²	100	37.6 Å²	37.6	47%	0.467	19%	0.188	S	C	.	.	H	α-helix	trans	-61.4	-46.4	173.1	-69.5	-178.1	156.2	0	0	111.8	L345 L351 F352 D353	L345-E349 HydrophobicContact CD1-CG 3.98Å; L345-E349 HydrophobicContact CG-CG 4.44Å; L345-E349 WeakPolarHBondContact O-CG 3.35Å; L345-E349 PolarHBondContact O-N 3Å; E349-L351 VanDerWaalsContact C-N 3.31Å; E349-L351 PolarHBondContact O-N 3.46Å; E349-F352 PolarHBondContact O-N 2.84Å; E349-D353 PolarHBondContact O-N 3.28Å
350	L	87.8	Confident	85.3	Confident	28 Å²	28	40 Å²	40	15%	0.147	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-36.5	176.7	-177.5	63.6	0	0	0	112.5	I324 E346 L347 K354	I324-L350 HydrophobicContact CD1-CB 4.36Å; I324-L350 HydrophobicContact CD1-CD2 3.83Å; I324-L350 HydrophobicContact CG1-CD2 4.13Å; E346-L350 VanDerWaalsContact O-CB 3.31Å; E346-L350 WeakPolarHBondContact O-CB 3.4Å; E346-L350 PolarHBondContact O-N 3.47Å; L347-L350 PolarHBondContact O-N 2.84Å; L350-K354 HydrophobicContact CD1-CD 4.49Å; L350-K354 HydrophobicContact CG-CD 4.34Å; L350-K354 WeakPolarHBondContact O-CB 3.43Å; L350-K354 VanDerWaalsContact O-CG 3.28Å; L350-K354 WeakPolarHBondContact O-CG 3.45Å; L350-K354 PolarHBondContact O-N 2.83Å; L350-K354 VanDerWaalsContact O-N 3.1Å
351	L	88.6	Confident	86.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.2	-39.9	175.6	-72.4	175.4	0	0	0	112.1	I316 V317 L347 L348 E349 K354 F355 L404	I316-L351 HydrophobicContact CG2-CD2 4.39Å; V317-L351 HydrophobicContact CG2-CD1 4.27Å; V317-L351 HydrophobicContact CG2-CD2 4.05Å; L347-L351 HydrophobicContact CD1-CD1 3.93Å; L347-L351 HydrophobicContact CD1-CG 4.05Å; L347-L351 HydrophobicContact CG-CD1 3.91Å; L347-L351 HydrophobicContact CG-CG 4.41Å; L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 VanDerWaalsContact O-CG 3.23Å; L347-L351 WeakPolarHBondContact O-CG 3.43Å; L347-L351 PolarHBondContact O-N 3.27Å; L348-L351 PolarHBondContact O-N 3Å; E349-L351 VanDerWaalsContact C-N 3.31Å; E349-L351 PolarHBondContact O-N 3.46Å; L351-K354 PolarHBondContact O-N 2.85Å; L351-F355 HydrophobicContact CB-CD2 4.33Å; L351-F355 HydrophobicContact CB-CE2 4.11Å; L351-F355 HydrophobicContact CD2-CE2 4.45Å; L351-F355 HydrophobicContact CD2-CZ 4.24Å; L351-F355 VanDerWaalsContact O-CB 3.32Å; L351-F355 WeakPolarHBondContact O-CB 3.43Å; L351-F355 VanDerWaalsContact O-CD2 3.28Å; L351-F355 WeakPolarHBondContact O-CD2 3.47Å; L351-F355 VanDerWaalsContact O-CG 3.22Å; L351-F355 WeakPolarHBondContact O-CG 3.32Å; L351-F355 PolarHBondContact O-N 2.99Å; L351-L404 HydrophobicContact CD1-CD2 3.47Å; L351-L404 VanDerWaalsContact CD1-CD2 3.47Å
352	F	91	Very high	86.8	Confident	11 Å²	11	38 Å²	38	5%	0.048	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-47.4	174.1	-67.4	-18.3	0	0	0	111.3	L348 E349 K354 F355 K356 L401 P510 L511 F514	L348-F352 HydrophobicContact CD1-CD1 4.29Å; L348-F352 HydrophobicContact CD1-CE1 3.54Å; L348-F352 HydrophobicContact CD1-CE2 4.42Å; L348-F352 HydrophobicContact CD1-CZ 3.63Å; L348-F352 HydrophobicContact CD2-CE1 4.39Å; L348-F352 HydrophobicContact CD2-CE2 3.95Å; L348-F352 HydrophobicContact CD2-CZ 3.61Å; L348-F352 HydrophobicContact CG-CD1 4.38Å; L348-F352 HydrophobicContact CG-CD2 4.33Å; L348-F352 HydrophobicContact CG-CE1 3.73Å; L348-F352 HydrophobicContact CG-CE2 3.67Å; L348-F352 HydrophobicContact CG-CZ 3.33Å; L348-F352 WeakPolarHBondContact O-CB 3.31Å; L348-F352 WeakPolarHBondContact O-CD1 3.41Å; L348-F352 WeakPolarHBondContact O-CD2 3.46Å; L348-F352 WeakPolarHBondContact O-CG 3.31Å; L348-F352 PolarHBondContact O-N 3.06Å; E349-F352 PolarHBondContact O-N 2.84Å; F352-K354 PolarHBondContact O-N 2.84Å; F352-F355 PolarHBondContact O-N 2.8Å; F352-K356 WeakPolarHBondContact O-CB 3.43Å; F352-K356 WeakPolarHBondContact O-CG 3.46Å; F352-K356 PolarHBondContact O-N 3.02Å; F352-L401 HydrophobicContact CD1-CD1 4.44Å; F352-L401 HydrophobicContact CE1-CD1 4.13Å; F352-L401 HydrophobicContact CE1-CD2 4.25Å; F352-P510 HydrophobicContact CE2-CB 4.13Å; F352-L511 HydrophobicContact CE1-CD1 4.3Å; F352-L511 HydrophobicContact CZ-CB 4.33Å; F352-L511 HydrophobicContact CZ-CD1 3.82Å; F352-F514 HydrophobicContact CB-CD2 3.62Å; F352-F514 HydrophobicContact CB-CE2 3.78Å; F352-F514 HydrophobicContact CB-CG 4.37Å; F352-F514 HydrophobicContact CD1-CB 4.11Å; F352-F514 AromaticContact CD1-CD1 3.58Å; F352-F514 HydrophobicContact CD1-CD1 3.58Å; F352-F514 AromaticContact CD1-CD2 3.45Å; F352-F514 HydrophobicContact CD1-CD2 3.45Å; F352-F514 VanDerWaalsContact CD1-CD2 3.45Å; F352-F514 AromaticContact CD1-CE1 3.75Å; F352-F514 HydrophobicContact CD1-CE1 3.75Å; F352-F514 AromaticContact CD1-CE2 3.63Å; F352-F514 HydrophobicContact CD1-CE2 3.63Å; F352-F514 AromaticContact CD1-CG 3.42Å; F352-F514 HydrophobicContact CD1-CG 3.42Å; F352-F514 VanDerWaalsContact CD1-CG 3.42Å; F352-F514 AromaticContact CD1-CZ 3.77Å; F352-F514 HydrophobicContact CD1-CZ 3.77Å; F352-F514 HydrophobicContact CD2-CB 3.86Å; F352-F514 HydrophobicContact CD2-CD2 4.03Å; F352-F514 HydrophobicContact CD2-CG 4Å; F352-F514 HydrophobicContact CE1-CB 3.9Å; F352-F514 AromaticContact CE1-CD1 3.37Å; F352-F514 HydrophobicContact CE1-CD1 3.37Å; F352-F514 HydrophobicContact CE1-CD2 4.05Å; F352-F514 AromaticContact CE1-CE1 3.81Å; F352-F514 HydrophobicContact CE1-CE1 3.81Å; F352-F514 HydrophobicContact CE1-CE2 4.43Å; F352-F514 AromaticContact CE1-CG 3.49Å; F352-F514 HydrophobicContact CE1-CG 3.49Å; F352-F514 VanDerWaalsContact CE1-CG 3.49Å; F352-F514 HydrophobicContact CE1-CZ 4.32Å; F352-F514 HydrophobicContact CE2-CB 3.64Å; F352-F514 HydrophobicContact CE2-CG 4.06Å; F352-F514 HydrophobicContact CG-CB 4.08Å; F352-F514 HydrophobicContact CG-CD1 4.32Å; F352-F514 AromaticContact CG-CD2 3.43Å; F352-F514 HydrophobicContact CG-CD2 3.43Å; F352-F514 VanDerWaalsContact CG-CD2 3.43Å; F352-F514 AromaticContact CG-CE2 3.87Å; F352-F514 HydrophobicContact CG-CE2 3.87Å; F352-F514 AromaticContact CG-CG 3.68Å; F352-F514 HydrophobicContact CG-CG 3.68Å; F352-F514 HydrophobicContact CG-CZ 4.47Å; F352-F514 HydrophobicContact CZ-CB 3.65Å; F352-F514 AromaticContact CZ-CD1 3.95Å; F352-F514 HydrophobicContact CZ-CD1 3.95Å; F352-F514 AromaticContact CZ-CG 3.8Å; F352-F514 HydrophobicContact CZ-CG 3.8Å
353	D	87	Confident	87	Confident	81 Å²	81	31.5 Å²	31.5	43%	0.433	17%	0.165	S	C	.	.	H	α-helix	trans	-61.8	-44.4	176.8	-85	-1.6	0	0	0	112.2	L206 E349 K356 A357	L206-D353 HydrophobicContact CD1-CB 4.27Å; L206-D353 WeakPolarHBondContact CD1-O 3.32Å; E349-D353 PolarHBondContact O-N 3.28Å; D353-K356 PolarHBondContact O-N 2.92Å; D353-A357 PolarHBondContact O-N 3.23Å
354	K	87.4	Confident	87.2	Confident	13 Å²	13	33.2 Å²	33.2	6%	0.057	18%	0.175	C	C	.	.	H	α-helix	trans	-65.8	-41.8	177.8	-72.5	178.9	-174.2	178.4	0	112.3	T203 I316 S320 L350 L351 F352 A357 V358	T203-K354 HydrophobicContact CG2-CB 3.92Å; T203-K354 HydrophobicContact CG2-CG 4.2Å; I316-K354 HydrophobicContact CG2-CB 4.13Å; I316-K354 HydrophobicContact CG2-CD 4.06Å; S320-K354 WeakPolarHBondContact OG-CD 3.12Å; S320-K354 PolarHBondContact OG-NZ 3.09Å; L350-K354 HydrophobicContact CD1-CD 4.49Å; L350-K354 HydrophobicContact CG-CD 4.34Å; L350-K354 WeakPolarHBondContact O-CB 3.43Å; L350-K354 VanDerWaalsContact O-CG 3.28Å; L350-K354 WeakPolarHBondContact O-CG 3.45Å; L350-K354 PolarHBondContact O-N 2.83Å; L350-K354 VanDerWaalsContact O-N 3.1Å; L351-K354 PolarHBondContact O-N 2.85Å; F352-K354 PolarHBondContact O-N 2.84Å; K354-A357 PolarHBondContact O-N 3.5Å; K354-V358 WeakPolarHBondContact O-CG2 3.32Å; K354-V358 PolarHBondContact O-N 3.07Å
355	F	89.7	Confident	87.2	Confident	1 Å²	1	33 Å²	33	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-71.1	-33.1	177.8	-66	-29.7	0	0	0	112.7	L313 I316 V317 L351 F352 V358 A359 I397 V400 L401 F514	L313-F355 HydrophobicContact CB-CE1 4.31Å; L313-F355 HydrophobicContact CD2-CD1 3.5Å; L313-F355 HydrophobicContact CD2-CE1 3.45Å; L313-F355 VanDerWaalsContact CD2-CE1 3.45Å; L313-F355 HydrophobicContact CD2-CZ 4.43Å; L313-F355 HydrophobicContact CG-CE1 4.48Å; I316-F355 HydrophobicContact CB-CE1 4.34Å; I316-F355 HydrophobicContact CG2-CD1 4.48Å; I316-F355 HydrophobicContact CG2-CE1 3.98Å; V317-F355 HydrophobicContact CG2-CZ 3.77Å; L351-F355 HydrophobicContact CB-CD2 4.33Å; L351-F355 HydrophobicContact CB-CE2 4.11Å; L351-F355 HydrophobicContact CD2-CE2 4.45Å; L351-F355 HydrophobicContact CD2-CZ 4.24Å; L351-F355 VanDerWaalsContact O-CB 3.32Å; L351-F355 WeakPolarHBondContact O-CB 3.43Å; L351-F355 VanDerWaalsContact O-CD2 3.28Å; L351-F355 WeakPolarHBondContact O-CD2 3.47Å; L351-F355 VanDerWaalsContact O-CG 3.22Å; L351-F355 WeakPolarHBondContact O-CG 3.32Å; L351-F355 PolarHBondContact O-N 2.99Å; F352-F355 PolarHBondContact O-N 2.8Å; F355-V358 PolarHBondContact O-N 2.99Å; F355-A359 WeakPolarHBondContact O-CB 3.22Å; F355-A359 PolarHBondContact O-N 3.01Å; F355-I397 HydrophobicContact CB-CD1 4.33Å; F355-I397 HydrophobicContact CB-CG2 3.98Å; F355-I397 HydrophobicContact CD2-CG2 3.95Å; F355-I397 HydrophobicContact CG-CG2 4.06Å; F355-V400 HydrophobicContact CZ-CG1 4.38Å; F355-L401 HydrophobicContact CD2-CD1 4.08Å; F355-L401 HydrophobicContact CD2-CD2 4.22Å; F355-L401 HydrophobicContact CD2-CG 4.11Å; F355-L401 HydrophobicContact CE2-CD1 4.25Å; F355-L401 HydrophobicContact CE2-CD2 3.75Å; F355-L401 HydrophobicContact CE2-CG 3.76Å; F355-F514 HydrophobicContact CB-CZ 4.47Å
356	K	87.4	Confident	87.2	Confident	71 Å²	71	31.5 Å²	31.5	31%	0.309	17%	0.166	S	C	.	.	H	α-helix	trans	-60.9	-44.5	168.9	-73.5	173	-166.7	-163.4	0	111.4	F352 D353 A359 Q360 F514 E517	F352-K356 WeakPolarHBondContact O-CB 3.43Å; F352-K356 WeakPolarHBondContact O-CG 3.46Å; F352-K356 PolarHBondContact O-N 3.02Å; D353-K356 PolarHBondContact O-N 2.92Å; K356-A359 PolarHBondContact O-N 3.48Å; K356-Q360 WeakPolarHBondContact O-CB 3.28Å; K356-Q360 PolarHBondContact O-N 3.39Å; K356-F514 HydrophobicContact CG-CE2 4.17Å; K356-E517 WeakPolarHBondContact CE-OE2 3.29Å; K356-E517 IonicContact NZ-OE1 3.85Å; K356-E517 PolarHBondContact NZ-OE1 3.14Å; K356-E517 IonicContact NZ-OE2 3.64Å; K356-E517 PolarHBondContact NZ-OE2 3.36Å
357	A	86.3	Confident	87.1	Confident	17 Å²	17	30.4 Å²	30.4	14%	0.14	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-39.8	177.1	0	0	0	0	0	113	L206 D353 K354 Q360 A361	L206-A357 HydrophobicContact CD1-CB 3.75Å; D353-A357 PolarHBondContact O-N 3.23Å; K354-A357 PolarHBondContact O-N 3.5Å; A357-Q360 PolarHBondContact O-N 2.83Å; A357-A361 WeakPolarHBondContact O-CB 3.28Å; A357-A361 PolarHBondContact O-N 3.1Å
358	V	87.6	Confident	86.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-49.4	172.4	170.5	0	0	0	0	110.6	Y199 T203 L313 I316 K354 F355 Q360 A361 H362	Y199-V358 HydrophobicContact CD1-CG1 3.93Å; Y199-V358 HydrophobicContact CD1-CG2 4.23Å; Y199-V358 HydrophobicContact CE1-CG1 3.84Å; T203-V358 HydrophobicContact CG2-CG2 3.71Å; L313-V358 HydrophobicContact CD2-CG1 4.33Å; I316-V358 HydrophobicContact CD1-CG2 3.89Å; K354-V358 WeakPolarHBondContact O-CG2 3.32Å; K354-V358 PolarHBondContact O-N 3.07Å; F355-V358 PolarHBondContact O-N 2.99Å; V358-Q360 VanDerWaalsContact C-N 3.3Å; V358-Q360 PolarHBondContact O-N 2.91Å; V358-A361 PolarHBondContact O-N 2.7Å; V358-A361 VanDerWaalsContact O-N 3.1Å; V358-H362 PolarHBondContact O-CD2 2.82Å; V358-H362 PolarHBondContact O-N 3.27Å
359	A	86.9	Confident	86.4	Confident	16 Å²	16	32.2 Å²	32.2	13%	0.132	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-37.9	178	0	0	0	0	0	112.7	F355 K356 S363 Q390 I397	F355-A359 WeakPolarHBondContact O-CB 3.22Å; F355-A359 PolarHBondContact O-N 3.01Å; K356-A359 PolarHBondContact O-N 3.48Å; A359-S363 PolarHBondContact O-N 2.91Å; A359-Q390 PolarHBondContact O-NE2 3.19Å; A359-I397 HydrophobicContact CB-CD1 4.15Å
360	Q	85.7	Confident	86.1	Confident	142 Å²	142	32.9 Å²	32.9	66%	0.664	18%	0.179	S	C	*	.	H	α-helix	trans	-67.5	-40.9	173.8	-172.5	178.7	9.4	0	0	112	K356 A357 V358 S363 V364	K356-Q360 WeakPolarHBondContact O-CB 3.28Å; K356-Q360 PolarHBondContact O-N 3.39Å; A357-Q360 PolarHBondContact O-N 2.83Å; V358-Q360 VanDerWaalsContact C-N 3.3Å; V358-Q360 PolarHBondContact O-N 2.91Å; Q360-S363 WeakPolarHBondContact O-CB 3.36Å; Q360-S363 PolarHBondContact O-N 3.39Å; Q360-V364 PolarHBondContact O-N 3.31Å; Q360-V364 VanDerWaalsContact O-N 3.08Å
361	A	85.6	Confident	85.7	Confident	9 Å²	9	36.4 Å²	36.4	7%	0.074	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-42.5	176.6	0	0	0	0	0	111.6	L198 M285 A357 V358 S363 V364 V365	L198-A361 HydrophobicContact CD2-CB 3.86Å; M285-A361 HydrophobicContact CE-CB 4.21Å; M285-A361 HydrophobicContact SD-CB 4.38Å; A357-A361 WeakPolarHBondContact O-CB 3.28Å; A357-A361 PolarHBondContact O-N 3.1Å; V358-A361 PolarHBondContact O-N 2.7Å; V358-A361 VanDerWaalsContact O-N 3.1Å; A361-S363 VanDerWaalsContact C-N 3.35Å; A361-S363 PolarHBondContact O-N 2.85Å; A361-V364 PolarHBondContact O-N 3.33Å; A361-V365 WeakPolarHBondContact O-CG2 3.23Å; A361-V365 PolarHBondContact O-N 3.49Å
362	H	86.8	Confident	85	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-39.1	171.6	-78.2	-76.5	0	0	0	112.8	Y199 V358 V364 V365 L366 Y388 V393	Y199-H362 AromaticContact CE1-NE2 3.47Å; Y199-H362 WeakPolarHBondContact CE1-NE2 3.45Å; Y199-H362 AromaticContact CZ-NE2 3.68Å; Y199-H362 PolarHBondContact OH-CE1 3.48Å; Y199-H362 PolarHBondContact OH-NE2 3.05Å; V358-H362 PolarHBondContact O-CD2 2.82Å; V358-H362 PolarHBondContact O-N 3.27Å; H362-V364 VanDerWaalsContact C-N 3.33Å; H362-V364 PolarHBondContact O-N 3.09Å; H362-V365 PolarHBondContact O-N 3.05Å; H362-L366 WeakPolarHBondContact O-CB 3.3Å; H362-L366 WeakPolarHBondContact O-CG 3.2Å; H362-L366 PolarHBondContact O-N 3.32Å; H362-Y388 HydrophobicContact CB-CE2 4.45Å; H362-Y388 AromaticContact ND1-CE2 3.76Å; H362-Y388 AromaticContact ND1-CZ 3.77Å; H362-Y388 PolarHBondContact ND1-OH 2.86Å; H362-V393 HydrophobicContact CB-CG1 4.29Å; H362-V393 HydrophobicContact CB-CG2 4.05Å
363	S	85.9	Confident	84	Confident	61 Å²	61	40 Å²	40	43%	0.427	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-40.1	175.7	-179.8	0	0	0	0	112.4	A359 Q360 A361 L366 A367	A359-S363 PolarHBondContact O-N 2.91Å; Q360-S363 WeakPolarHBondContact O-CB 3.36Å; Q360-S363 PolarHBondContact O-N 3.39Å; A361-S363 VanDerWaalsContact C-N 3.35Å; A361-S363 PolarHBondContact O-N 2.85Å; S363-L366 PolarHBondContact O-N 2.97Å; S363-A367 WeakPolarHBondContact O-CB 3.44Å; S363-A367 PolarHBondContact O-N 3.39Å
364	V	85.8	Confident	83	Confident	39 Å²	39	40.3 Å²	40.3	24%	0.236	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-43.9	173.6	173.6	0	0	0	0	111.6	A282 M285 Q360 A361 H362 A367 H368	A282-V364 HydrophobicContact CB-CG1 4.04Å; M285-V364 HydrophobicContact CE-CB 4.17Å; M285-V364 HydrophobicContact CE-CG1 4.01Å; Q360-V364 PolarHBondContact O-N 3.31Å; Q360-V364 VanDerWaalsContact O-N 3.08Å; A361-V364 PolarHBondContact O-N 3.33Å; H362-V364 VanDerWaalsContact C-N 3.33Å; H362-V364 PolarHBondContact O-N 3.09Å; V364-A367 PolarHBondContact O-N 3.41Å; V364-H368 PolarHBondContact O-CD2 3Å; V364-H368 PolarHBondContact O-N 3.06Å; V364-H368 VanDerWaalsContact O-N 3.14Å
365	V	85.6	Confident	81.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-47.1	176.1	168.1	0	0	0	0	111	L194 L198 M285 I289 I305 A361 H362 A367 H368 M369	L194-V365 HydrophobicContact CD1-CG2 4.01Å; L198-V365 HydrophobicContact CD2-CG2 3.82Å; L198-V365 HydrophobicContact CG-CG2 4.41Å; M285-V365 HydrophobicContact CB-CG2 4.23Å; M285-V365 HydrophobicContact CG-CG2 4.47Å; M285-V365 HydrophobicContact SD-CG2 3.86Å; I289-V365 HydrophobicContact CD1-CB 4.04Å; I289-V365 HydrophobicContact CD1-CG1 3.8Å; I289-V365 HydrophobicContact CD1-CG2 4.09Å; I289-V365 HydrophobicContact CG1-CG1 4.44Å; I305-V365 HydrophobicContact CD1-CG1 4.44Å; A361-V365 WeakPolarHBondContact O-CG2 3.23Å; A361-V365 PolarHBondContact O-N 3.49Å; H362-V365 PolarHBondContact O-N 3.05Å; V365-A367 PolarHBondContact O-N 3.29Å; V365-H368 PolarHBondContact O-N 2.91Å; V365-M369 HydrophobicContact CG1-CG 4.36Å; V365-M369 HydrophobicContact CG1-SD 3.82Å; V365-M369 WeakPolarHBondContact O-CG 3.38Å; V365-M369 PolarHBondContact O-N 3.47Å
366	L	84.6	Confident	80.1	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-43.6	177.3	-75.4	175.7	0	0	0	112.1	H362 S363 H368 M369 Q370 Y388 Q390	H362-L366 WeakPolarHBondContact O-CB 3.3Å; H362-L366 WeakPolarHBondContact O-CG 3.2Å; H362-L366 PolarHBondContact O-N 3.32Å; S363-L366 PolarHBondContact O-N 2.97Å; L366-H368 VanDerWaalsContact C-N 3.33Å; L366-H368 PolarHBondContact O-N 3.3Å; L366-M369 PolarHBondContact O-N 3.49Å; L366-Q370 WeakPolarHBondContact O-CB 3.44Å; L366-Q370 VanDerWaalsContact O-CG 3.24Å; L366-Q370 WeakPolarHBondContact O-CG 3.4Å; L366-Q370 PolarHBondContact O-N 3.42Å; L366-Y388 HydrophobicContact CD1-CD2 4.1Å; L366-Y388 HydrophobicContact CD1-CE2 3.78Å; L366-Y388 HydrophobicContact CD2-CD1 3.8Å; L366-Y388 HydrophobicContact CD2-CD2 3.86Å; L366-Y388 HydrophobicContact CD2-CE1 3.59Å; L366-Y388 HydrophobicContact CD2-CE2 3.66Å; L366-Y388 HydrophobicContact CD2-CG 3.94Å; L366-Y388 WeakPolarHBondContact CD2-O 3.36Å; L366-Y388 HydrophobicContact CG-CD2 4.29Å; L366-Y388 HydrophobicContact CG-CE1 4.33Å; L366-Y388 HydrophobicContact CG-CE2 3.73Å; L366-Q390 HydrophobicContact CD1-CB 4.41Å
367	A	84.2	Confident	78	Confident	38 Å²	38	53.1 Å²	53.1	31%	0.314	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-43.5	176.5	0	0	0	0	0	112	S363 V364 V365 Q371	S363-A367 WeakPolarHBondContact O-CB 3.44Å; S363-A367 PolarHBondContact O-N 3.39Å; V364-A367 PolarHBondContact O-N 3.41Å; V365-A367 PolarHBondContact O-N 3.29Å; A367-Q371 WeakPolarHBondContact O-CB 3.38Å; A367-Q371 VanDerWaalsContact O-CG 3.22Å; A367-Q371 WeakPolarHBondContact O-CG 3.41Å; A367-Q371 PolarHBondContact O-N 3.41Å
368	H	81.5	Confident	76.1	Confident	39 Å²	39	55.9 Å²	55.9	18%	0.181	35%	0.349	C	S	.	.	H	α-helix	trans	-70.4	-37.6	176.1	-72.2	-43	0	0	0	113.3	G286 I289 V364 V365 L366 Q371 I372	G286-H368 WeakPolarHBondContact CA-CD2 3.33Å; I289-H368 HydrophobicContact CD1-CB 3.74Å; V364-H368 PolarHBondContact O-CD2 3Å; V364-H368 PolarHBondContact O-N 3.06Å; V364-H368 VanDerWaalsContact O-N 3.14Å; V365-H368 PolarHBondContact O-N 2.91Å; L366-H368 VanDerWaalsContact C-N 3.33Å; L366-H368 PolarHBondContact O-N 3.3Å; H368-Q371 PolarHBondContact ND1-OE1 3.26Å; H368-Q371 PolarHBondContact O-N 3.1Å; H368-I372 WeakPolarHBondContact O-CB 3.31Å; H368-I372 WeakPolarHBondContact O-CD1 3.45Å; H368-I372 VanDerWaalsContact O-CG1 3.31Å; H368-I372 WeakPolarHBondContact O-CG1 3.36Å; H368-I372 PolarHBondContact O-N 2.93Å
369	M	80.7	Confident	73.9	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	38%	0.384	C	S	.	.	H	α-helix	trans	-64.5	-40.5	174	-69	179.6	86.6	0	0	111.7	I289 L298 T302 V365 L366 I372 A373 L387 Y388	I289-M369 HydrophobicContact CD1-CG 4.42Å; I289-M369 HydrophobicContact CG2-CG 3.68Å; L298-M369 HydrophobicContact CD2-CE 4.37Å; T302-M369 WeakPolarHBondContact OG1-CE 3.27Å; V365-M369 HydrophobicContact CG1-CG 4.36Å; V365-M369 HydrophobicContact CG1-SD 3.82Å; V365-M369 WeakPolarHBondContact O-CG 3.38Å; V365-M369 PolarHBondContact O-N 3.47Å; L366-M369 PolarHBondContact O-N 3.49Å; M369-I372 PolarHBondContact O-N 3.47Å; M369-A373 WeakPolarHBondContact O-CB 3.41Å; M369-A373 PolarHBondContact O-N 3.04Å; M369-L387 HydrophobicContact CB-CD1 4.41Å; M369-L387 HydrophobicContact CB-CD2 3.98Å; M369-L387 HydrophobicContact CE-CD2 3.84Å; M369-L387 HydrophobicContact SD-CD2 4.49Å; M369-Y388 HydrophobicContact SD-CE1 4.2Å
370	Q	81.6	Confident	71.5	Confident	113 Å²	113	66.9 Å²	66.9	53%	0.528	41%	0.414	S	S	.	.	H	α-helix	trans	-65.8	-43.8	175.1	-72.9	172	-6.1	0	0	112.1	L366 I372 A373 A374 L387	L366-Q370 WeakPolarHBondContact O-CB 3.44Å; L366-Q370 VanDerWaalsContact O-CG 3.24Å; L366-Q370 WeakPolarHBondContact O-CG 3.4Å; L366-Q370 PolarHBondContact O-N 3.42Å; Q370-I372 VanDerWaalsContact C-N 3.33Å; Q370-I372 PolarHBondContact O-N 2.81Å; Q370-A373 PolarHBondContact O-N 2.94Å; Q370-A374 WeakPolarHBondContact O-CB 3.46Å; Q370-A374 PolarHBondContact O-N 3.16Å; Q370-L387 HydrophobicContact CG-CD1 3.76Å
371	Q	79.8	Confident	69.4	Low	102 Å²	102	69.5 Å²	69.5	48%	0.477	43%	0.426	S	S	.	.	H	α-helix	trans	-57.6	-45	173.8	-76.9	168	-7	0	0	111.8	A367 H368 A374 H375	A367-Q371 WeakPolarHBondContact O-CB 3.38Å; A367-Q371 VanDerWaalsContact O-CG 3.22Å; A367-Q371 WeakPolarHBondContact O-CG 3.41Å; A367-Q371 PolarHBondContact O-N 3.41Å; H368-Q371 PolarHBondContact ND1-OE1 3.26Å; H368-Q371 PolarHBondContact O-N 3.1Å; Q371-A374 PolarHBondContact O-N 3.5Å; Q371-H375 WeakPolarHBondContact O-CB 3.43Å; Q371-H375 PolarHBondContact O-CD2 3.42Å; Q371-H375 PolarHBondContact O-N 3.4Å; Q371-H375 VanDerWaalsContact O-N 3.12Å
372	I	75.2	Confident	67	Low	39 Å²	39	77.1 Å²	77.1	20%	0.2	46%	0.46	C	S	.	.	H	α-helix	trans	-69.2	-39.4	179.8	-70.9	163.1	0	0	0	111.3	I289 K290 A293 L298 H368 M369 Q370 H375 A376	I289-I372 HydrophobicContact CB-CD1 4.43Å; I289-I372 HydrophobicContact CG2-CD1 3.69Å; K290-I372 HydrophobicContact CG-CD1 3.99Å; A293-I372 HydrophobicContact CB-CD1 4.31Å; A293-I372 HydrophobicContact CB-CG2 3.71Å; L298-I372 HydrophobicContact CD1-CG2 4.05Å; H368-I372 WeakPolarHBondContact O-CB 3.31Å; H368-I372 WeakPolarHBondContact O-CD1 3.45Å; H368-I372 VanDerWaalsContact O-CG1 3.31Å; H368-I372 WeakPolarHBondContact O-CG1 3.36Å; H368-I372 PolarHBondContact O-N 2.93Å; M369-I372 PolarHBondContact O-N 3.47Å; Q370-I372 VanDerWaalsContact C-N 3.33Å; Q370-I372 PolarHBondContact O-N 2.81Å; I372-H375 PolarHBondContact O-N 3.38Å; I372-A376 PolarHBondContact O-N 2.78Å
373	A	69.3	Low	65	Low	49 Å²	49	84.9 Å²	84.9	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-39.9	174.7	0	0	0	0	0	112.2	M369 Q370 H375	M369-A373 WeakPolarHBondContact O-CB 3.41Å; M369-A373 PolarHBondContact O-N 3.04Å; Q370-A373 PolarHBondContact O-N 2.94Å; A373-H375 VanDerWaalsContact C-N 3.33Å; A373-H375 PolarHBondContact O-N 3.44Å
374	A	65.9	Low	63.1	Low	86 Å²	86	91.3 Å²	91.3	71%	0.711	52%	0.52	S	S	*	.	H	α-helix	trans	-70.4	-25.8	177.3	0	0	0	0	0	113.8	Q370 Q371	Q370-A374 WeakPolarHBondContact O-CB 3.46Å; Q370-A374 PolarHBondContact O-N 3.16Å; Q371-A374 PolarHBondContact O-N 3.5Å
375	H	62.1	Low	61.8	Low	152 Å²	152	93.1 Å²	93.1	70%	0.704	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	6.6	-176.9	-78.1	-54.4	0	0	0	115.1	Q371 I372 A373 P377	Q371-H375 WeakPolarHBondContact O-CB 3.43Å; Q371-H375 PolarHBondContact O-CD2 3.42Å; Q371-H375 PolarHBondContact O-N 3.4Å; Q371-H375 VanDerWaalsContact O-N 3.12Å; I372-H375 PolarHBondContact O-N 3.38Å; A373-H375 VanDerWaalsContact C-N 3.33Å; A373-H375 PolarHBondContact O-N 3.44Å; H375-P377 WeakPolarHBondContact O-CD 3.46Å
376	A	54.1	Low	60.9	Low	74 Å²	74	102 Å²	102	61%	0.612	57%	0.566	S	S	*	*			trans	-89.5	100.8	177.6	0	0	0	0	0	111.9	I372	I372-A376 PolarHBondContact O-N 2.78Å
377	P	43.2	Very low	60.6	Low	129 Å²	129	103.6 Å²	103.6	84%	0.838	57%	0.574	S	S	*	*			trans	-94.8	109.9	-175.1	11.3	11.6	0	0	0	109.6	H375	H375-P377 WeakPolarHBondContact O-CD 3.46Å
378	G	46.5	Very low	60.5	Low	74 Å²	74	102.2 Å²	102.2	76%	0.763	56%	0.561	S	S	*	*			trans	91.4	73	167.1	0	0	0	0	0	116
379	V	41	Very low	60.6	Low	121 Å²	121	105.4 Å²	105.4	73%	0.733	58%	0.576	S	S	*	*			trans	-124.7	120.7	148.6	-178.4	0	0	0	0	108.1	H381	V379-H381 PolarHBondContact O-N 3.25Å
380	T	36.9	Very low	60.7	Low	127 Å²	127	107.4 Å²	107.4	78%	0.779	59%	0.585	S	S	*	*			trans	-76.5	115.7	175.5	45.3	0	0	0	0	110.6	E382	T380-E382 PolarHBondContact O-N 3.05Å; T380-E382 VanDerWaalsContact O-N 3.14Å
381	H	40.5	Very low	60.7	Low	196 Å²	196	102.7 Å²	102.7	91%	0.907	57%	0.565	S	S	*	*	S	Bend	trans	44.8	46	156.1	-70.8	-64.3	0	0	0	119.1	V379	V379-H381 PolarHBondContact O-N 3.25Å
382	E	36.7	Very low	60.9	Low	170 Å²	170	100.9 Å²	100.9	79%	0.794	56%	0.559	S	S	*	*	S	Bend	trans	-127.7	117.1	155.3	-72.8	-170.1	154.7	0	0	110	T380	T380-E382 PolarHBondContact O-N 3.05Å; T380-E382 VanDerWaalsContact O-N 3.14Å
383	E	44.5	Very low	61.4	Low	162 Å²	162	99 Å²	99	76%	0.757	55%	0.55	S	S	*	.			trans	52.9	97.9	178.4	-58.8	-168.5	165	0	0	117.2	I385	E383-I385 PolarHBondContact O-N 3.31Å; E383-I385 VanDerWaalsContact O-N 3.14Å
384	E	45.5	Very low	62.2	Low	196 Å²	196	97 Å²	97	92%	0.916	53%	0.532	S	S	*	.			trans	-54	117.4	158.5	-104.3	-177.2	160.1	0	0	109.6	K386	E384-K386 VanDerWaalsContact C-N 3.31Å; E384-K386 PolarHBondContact O-N 3.44Å
385	I	58.6	Low	63.2	Low	77 Å²	77	94.5 Å²	94.5	40%	0.395	51%	0.512	S	S	.	.			trans	-71.9	89.9	177.9	-55.2	176.9	0	0	0	108.4	L298 E383 L387	L298-I385 HydrophobicContact CD1-CD1 4.32Å; E383-I385 PolarHBondContact O-N 3.31Å; E383-I385 VanDerWaalsContact O-N 3.14Å; I385-L387 HydrophobicContact CG2-CD2 3.98Å; I385-L387 PolarHBondContact O-N 3.46Å
386	K	67.4	Low	64.4	Low	186 Å²	186	90.5 Å²	90.5	81%	0.809	49%	0.492	S	S	*	.			trans	-66.6	98.3	172.5	-168.8	175.4	-176.9	-179.9	0	109.5	E384	E384-K386 VanDerWaalsContact C-N 3.31Å; E384-K386 PolarHBondContact O-N 3.44Å
387	L	77.4	Confident	66	Low	43 Å²	43	87.2 Å²	87.2	23%	0.225	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-69.9	154.3	170.3	-61.3	178.1	0	0	0	110.1	M369 Q370 I385	M369-L387 HydrophobicContact CB-CD1 4.41Å; M369-L387 HydrophobicContact CB-CD2 3.98Å; M369-L387 HydrophobicContact CE-CD2 3.84Å; M369-L387 HydrophobicContact SD-CD2 4.49Å; Q370-L387 HydrophobicContact CG-CD1 3.76Å; I385-L387 HydrophobicContact CG2-CD2 3.98Å; I385-L387 PolarHBondContact O-N 3.46Å
388	Y	81.6	Confident	68.2	Low	9 Å²	9	81.1 Å²	81.1	4%	0.035	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-80.6	156.6	169.5	66.6	-81.8	0	0	0	110.2	T302 I305 M306 H362 L366 M369 V393	T302-Y388 HydrophobicContact CG2-CD1 4.05Å; I305-Y388 HydrophobicContact CD1-CE1 4.39Å; I305-Y388 HydrophobicContact CG2-CE1 4.24Å; M306-Y388 HydrophobicContact CG-CG 4.38Å; M306-Y388 HydrophobicContact SD-CD2 4.16Å; M306-Y388 HydrophobicContact SD-CG 4.01Å; H362-Y388 HydrophobicContact CB-CE2 4.45Å; H362-Y388 AromaticContact ND1-CE2 3.76Å; H362-Y388 AromaticContact ND1-CZ 3.77Å; H362-Y388 PolarHBondContact ND1-OH 2.86Å; L366-Y388 HydrophobicContact CD1-CD2 4.1Å; L366-Y388 HydrophobicContact CD1-CE2 3.78Å; L366-Y388 HydrophobicContact CD2-CD1 3.8Å; L366-Y388 HydrophobicContact CD2-CD2 3.86Å; L366-Y388 HydrophobicContact CD2-CE1 3.59Å; L366-Y388 HydrophobicContact CD2-CE2 3.66Å; L366-Y388 HydrophobicContact CD2-CG 3.94Å; L366-Y388 WeakPolarHBondContact CD2-O 3.36Å; L366-Y388 HydrophobicContact CG-CD2 4.29Å; L366-Y388 HydrophobicContact CG-CE1 4.33Å; L366-Y388 HydrophobicContact CG-CE2 3.73Å; M369-Y388 HydrophobicContact SD-CE1 4.2Å; Y388-V393 HydrophobicContact CD2-CG2 3.81Å; Y388-V393 HydrophobicContact CE2-CG2 3.62Å
389	E	83.2	Confident	70.2	Confident	106 Å²	106	79 Å²	79	50%	0.495	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-97.3	157.4	177.2	-66.9	-172.2	176.8	0	0	111.7	A391 D392 V393 Q526	E389-A391 HydrophobicContact CB-CB 3.97Å; E389-A391 PolarHBondContact O-N 2.94Å; E389-A391 VanDerWaalsContact O-N 3.15Å; E389-D392 PolarHBondContact N-OD2 3.07Å; E389-D392 WeakPolarHBondContact O-CB 3.4Å; E389-D392 PolarHBondContact O-N 3.16Å; E389-V393 PolarHBondContact O-N 2.81Å; E389-Q526 PolarHBondContact OE2-NE2 3.1Å
390	Q	83.1	Confident	72.4	Confident	45 Å²	45	73.7 Å²	73.7	21%	0.21	37%	0.368	C	S	.	.	H	α-helix	trans	-58.5	-24.3	167	-169.9	67.2	12.8	0	0	111.6	A359 L366 S394	A359-Q390 PolarHBondContact O-NE2 3.19Å; L366-Q390 HydrophobicContact CD1-CB 4.41Å; Q390-S394 WeakPolarHBondContact O-CB 3.22Å; Q390-S394 PolarHBondContact O-N 3.05Å; Q390-S394 PolarHBondContact O-OG 3.17Å
391	A	81.4	Confident	74.9	Confident	13 Å²	13	67.6 Å²	67.6	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-64.3	-43.3	173.1	0	0	0	0	0	112.8	E389 V393 S394 A395 M522	E389-A391 HydrophobicContact CB-CB 3.97Å; E389-A391 PolarHBondContact O-N 2.94Å; E389-A391 VanDerWaalsContact O-N 3.15Å; A391-V393 VanDerWaalsContact C-N 3.32Å; A391-V393 PolarHBondContact O-N 3.33Å; A391-S394 PolarHBondContact O-N 3.31Å; A391-A395 WeakPolarHBondContact O-CB 3.48Å; A391-A395 PolarHBondContact O-N 3.28Å; A391-M522 HydrophobicContact CB-SD 4.1Å
392	D	84.1	Confident	77.2	Confident	65 Å²	65	60.7 Å²	60.7	35%	0.348	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-42.6	177.8	-64.3	-49.8	0	0	0	111.1	M306 E389 A395 K396	M306-D392 HydrophobicContact CE-CB 3.72Å; M306-D392 HydrophobicContact SD-CB 4.31Å; E389-D392 PolarHBondContact N-OD2 3.07Å; E389-D392 WeakPolarHBondContact O-CB 3.4Å; E389-D392 PolarHBondContact O-N 3.16Å; D392-A395 PolarHBondContact O-N 3Å; D392-K396 PolarHBondContact O-N 3.3Å
393	V	85.9	Confident	79.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-47.5	176	-176.9	0	0	0	0	110.7	L309 H362 Y388 E389 A391 A395 K396 I397	L309-V393 HydrophobicContact CD1-CG1 4.49Å; L309-V393 HydrophobicContact CD2-CB 4.48Å; L309-V393 HydrophobicContact CD2-CG1 4.48Å; L309-V393 HydrophobicContact CD2-CG2 4.37Å; H362-V393 HydrophobicContact CB-CG1 4.29Å; H362-V393 HydrophobicContact CB-CG2 4.05Å; Y388-V393 HydrophobicContact CD2-CG2 3.81Å; Y388-V393 HydrophobicContact CE2-CG2 3.62Å; E389-V393 PolarHBondContact O-N 2.81Å; A391-V393 VanDerWaalsContact C-N 3.32Å; A391-V393 PolarHBondContact O-N 3.33Å; V393-A395 PolarHBondContact O-N 3.47Å; V393-K396 PolarHBondContact O-N 3.07Å; V393-I397 HydrophobicContact CG1-CD1 4.06Å; V393-I397 WeakPolarHBondContact O-CG1 3.25Å; V393-I397 PolarHBondContact O-N 2.78Å
394	S	86.1	Confident	81.7	Confident	6 Å²	6	49 Å²	49	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-36.8	179.6	-59.5	0	0	0	0	112.3	Q390 A391 I397 Q398 M522	Q390-S394 WeakPolarHBondContact O-CB 3.22Å; Q390-S394 PolarHBondContact O-N 3.05Å; Q390-S394 PolarHBondContact O-OG 3.17Å; A391-S394 PolarHBondContact O-N 3.31Å; S394-I397 PolarHBondContact O-N 3.45Å; S394-Q398 VanDerWaalsContact O-CG 3.27Å; S394-Q398 WeakPolarHBondContact O-CG 3.49Å; S394-Q398 PolarHBondContact O-N 3.17Å; S394-Q398 PolarHBondContact O-NE2 3.05Å; S394-M522 WeakPolarHBondContact CB-SD 3.3Å
395	A	86.9	Confident	83.7	Confident	33 Å²	33	39.8 Å²	39.8	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-65.8	-40.8	175.2	0	0	0	0	0	112	A391 D392 V393 Q398 A399	A391-A395 WeakPolarHBondContact O-CB 3.48Å; A391-A395 PolarHBondContact O-N 3.28Å; D392-A395 PolarHBondContact O-N 3Å; V393-A395 PolarHBondContact O-N 3.47Å; A395-Q398 PolarHBondContact O-N 3Å; A395-A399 WeakPolarHBondContact O-CB 3.4Å; A395-A399 PolarHBondContact O-N 3.41Å
396	K	87.9	Confident	85.1	Confident	68 Å²	68	39.1 Å²	39.1	30%	0.296	20%	0.202	S	C	.	.	H	α-helix	trans	-67.2	-38.4	174.1	-71.5	-60.6	-166.1	176.4	0	112.8	L309 E310 L313 D392 V393 A399 V400	L309-K396 HydrophobicContact CD2-CB 3.79Å; L309-K396 HydrophobicContact CD2-CG 3.82Å; L309-K396 HydrophobicContact CG-CB 4.07Å; L309-K396 HydrophobicContact CG-CG 4.32Å; E310-K396 HydrophobicContact CB-CD 4.34Å; E310-K396 IonicContact OE2-NZ 2.77Å; E310-K396 PolarHBondContact OE2-NZ 3.1Å; L313-K396 HydrophobicContact CD1-CB 4.06Å; D392-K396 PolarHBondContact O-N 3.3Å; V393-K396 PolarHBondContact O-N 3.07Å; K396-A399 PolarHBondContact O-N 3.48Å; K396-V400 WeakPolarHBondContact O-CG2 3.48Å; K396-V400 PolarHBondContact O-N 3.1Å; K396-V400 VanDerWaalsContact O-N 3.07Å
397	I	88.4	Confident	85.9	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-46.4	172.2	-69.8	166.3	0	0	0	110.7	L313 F355 A359 V393 S394 A399 V400 L401 F514	L313-I397 HydrophobicContact CD1-CG1 3.91Å; L313-I397 HydrophobicContact CD2-CG1 3.95Å; F355-I397 HydrophobicContact CB-CD1 4.33Å; F355-I397 HydrophobicContact CB-CG2 3.98Å; F355-I397 HydrophobicContact CD2-CG2 3.95Å; F355-I397 HydrophobicContact CG-CG2 4.06Å; A359-I397 HydrophobicContact CB-CD1 4.15Å; V393-I397 HydrophobicContact CG1-CD1 4.06Å; V393-I397 WeakPolarHBondContact O-CG1 3.25Å; V393-I397 PolarHBondContact O-N 2.78Å; S394-I397 PolarHBondContact O-N 3.45Å; I397-A399 PolarHBondContact O-N 3.14Å; I397-V400 PolarHBondContact O-N 3.07Å; I397-L401 HydrophobicContact CG2-CD1 3.99Å; I397-L401 WeakPolarHBondContact O-CB 3.47Å; I397-L401 PolarHBondContact O-N 3.45Å; I397-F514 HydrophobicContact CG2-CE1 4.47Å; I397-F514 HydrophobicContact CG2-CZ 4.2Å
398	Q	87.9	Confident	86.2	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-45.9	176.1	-74.1	173.3	57.3	0	0	112.1	S394 A395 V400 L401 Q402 I518 C530 L532	S394-Q398 VanDerWaalsContact O-CG 3.27Å; S394-Q398 WeakPolarHBondContact O-CG 3.49Å; S394-Q398 PolarHBondContact O-N 3.17Å; S394-Q398 PolarHBondContact O-NE2 3.05Å; A395-Q398 PolarHBondContact O-N 3Å; Q398-V400 PolarHBondContact O-N 3.12Å; Q398-L401 PolarHBondContact O-N 3.13Å; Q398-Q402 VanDerWaalsContact O-CB 3.32Å; Q398-Q402 WeakPolarHBondContact O-CB 3.48Å; Q398-Q402 PolarHBondContact O-N 3.09Å; Q398-I518 HydrophobicContact CG-CD1 4.25Å; Q398-C530 PolarHBondContact OE1-SG 2.95Å; Q398-L532 HydrophobicContact CB-CB 4.15Å; Q398-L532 HydrophobicContact CG-CB 3.91Å; Q398-L532 HydrophobicContact CG-CD2 4.47Å
399	A	88.4	Confident	86.3	Confident	30 Å²	30	30.8 Å²	30.8	25%	0.248	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-42.9	179.9	0	0	0	0	0	112.7	A395 K396 I397 Q402 V403	A395-A399 WeakPolarHBondContact O-CB 3.4Å; A395-A399 PolarHBondContact O-N 3.41Å; K396-A399 PolarHBondContact O-N 3.48Å; I397-A399 PolarHBondContact O-N 3.14Å; A399-Q402 PolarHBondContact O-N 3.06Å; A399-V403 WeakPolarHBondContact O-CG2 3.36Å; A399-V403 PolarHBondContact O-N 2.95Å
400	V	88.9	Confident	86.3	Confident	8 Å²	8	27.6 Å²	27.6	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-40.9	177.4	172.9	0	0	0	0	111.5	E310 L313 K314 V317 F355 K396 I397 Q398 L404	E310-V400 HydrophobicContact CG-CG2 4.18Å; L313-V400 HydrophobicContact CB-CB 4.43Å; L313-V400 HydrophobicContact CB-CG1 4.31Å; L313-V400 HydrophobicContact CB-CG2 3.97Å; L313-V400 HydrophobicContact CD1-CG2 4.4Å; K314-V400 HydrophobicContact CG-CG1 4.24Å; K314-V400 HydrophobicContact CG-CG2 4.15Å; V317-V400 HydrophobicContact CG2-CG1 3.91Å; F355-V400 HydrophobicContact CZ-CG1 4.38Å; K396-V400 WeakPolarHBondContact O-CG2 3.48Å; K396-V400 PolarHBondContact O-N 3.1Å; K396-V400 VanDerWaalsContact O-N 3.07Å; I397-V400 PolarHBondContact O-N 3.07Å; Q398-V400 PolarHBondContact O-N 3.12Å; V400-L404 PolarHBondContact O-N 3.23Å; V400-L404 VanDerWaalsContact O-N 3.13Å
401	L	89.1	Confident	86	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.4	-39.6	173.5	-79.2	169.4	0	0	0	112.6	L348 F352 F355 I397 Q398 L404 L405 F514 L532	L348-L401 HydrophobicContact CD1-CD2 4.04Å; F352-L401 HydrophobicContact CD1-CD1 4.44Å; F352-L401 HydrophobicContact CE1-CD1 4.13Å; F352-L401 HydrophobicContact CE1-CD2 4.25Å; F355-L401 HydrophobicContact CD2-CD1 4.08Å; F355-L401 HydrophobicContact CD2-CD2 4.22Å; F355-L401 HydrophobicContact CD2-CG 4.11Å; F355-L401 HydrophobicContact CE2-CD1 4.25Å; F355-L401 HydrophobicContact CE2-CD2 3.75Å; F355-L401 HydrophobicContact CE2-CG 3.76Å; I397-L401 HydrophobicContact CG2-CD1 3.99Å; I397-L401 WeakPolarHBondContact O-CB 3.47Å; I397-L401 PolarHBondContact O-N 3.45Å; Q398-L401 PolarHBondContact O-N 3.13Å; L401-L404 PolarHBondContact O-N 3.22Å; L401-L405 WeakPolarHBondContact O-CB 3.39Å; L401-L405 VanDerWaalsContact O-CG 3.26Å; L401-L405 WeakPolarHBondContact O-CG 3.45Å; L401-L405 PolarHBondContact O-N 2.83Å; L401-F514 HydrophobicContact CD1-CD1 4.09Å; L401-F514 HydrophobicContact CD1-CE1 3.29Å; L401-F514 HydrophobicContact CD1-CZ 3.96Å; L401-L532 HydrophobicContact CB-CD1 4.38Å; L401-L532 HydrophobicContact CB-CD2 4.49Å; L401-L532 HydrophobicContact CD1-CD2 4.24Å
402	Q	88.6	Confident	85.5	Confident	50 Å²	50	32.2 Å²	32.2	23%	0.234	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-46.1	177.4	-179.5	178.1	-6.4	0	0	111.1	Q398 A399 L404 L405 M406 F535	Q398-Q402 VanDerWaalsContact O-CB 3.32Å; Q398-Q402 WeakPolarHBondContact O-CB 3.48Å; Q398-Q402 PolarHBondContact O-N 3.09Å; A399-Q402 PolarHBondContact O-N 3.06Å; Q402-L404 PolarHBondContact O-N 2.97Å; Q402-L405 PolarHBondContact O-N 3.34Å; Q402-M406 HydrophobicContact CG-CG 4.48Å; Q402-M406 HydrophobicContact CG-SD 4.29Å; Q402-M406 WeakPolarHBondContact O-CB 3.32Å; Q402-M406 VanDerWaalsContact O-CG 3.28Å; Q402-M406 WeakPolarHBondContact O-CG 3.44Å; Q402-M406 PolarHBondContact O-N 2.96Å; Q402-F535 HydrophobicContact CG-CB 4.2Å; Q402-F535 HydrophobicContact CG-CD1 4.05Å; Q402-F535 HydrophobicContact CG-CD2 3.94Å; Q402-F535 HydrophobicContact CG-CE1 4.46Å; Q402-F535 HydrophobicContact CG-CE2 4.37Å; Q402-F535 HydrophobicContact CG-CG 3.77Å
403	V	88.8	Confident	84.9	Confident	78 Å²	78	33.7 Å²	33.7	47%	0.473	18%	0.177	S	C	.	.	H	α-helix	trans	-60.2	-45.6	176	172.9	0	0	0	0	110.9	A399 L405 M406 E407	A399-V403 WeakPolarHBondContact O-CG2 3.36Å; A399-V403 PolarHBondContact O-N 2.95Å; V403-L405 PolarHBondContact O-N 2.83Å; V403-M406 PolarHBondContact O-N 3.38Å; V403-E407 PolarHBondContact O-N 3.33Å
404	L	87.1	Confident	83.8	Confident	8 Å²	8	34.1 Å²	34.1	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-47.2	176.9	-173.8	66.2	0	0	0	112.1	V317 L351 V400 L401 Q402 E407 Y408	V317-L404 HydrophobicContact CG1-CD1 3.79Å; V317-L404 HydrophobicContact CG1-CD2 4.11Å; L351-L404 HydrophobicContact CD1-CD2 3.47Å; L351-L404 VanDerWaalsContact CD1-CD2 3.47Å; V400-L404 PolarHBondContact O-N 3.23Å; V400-L404 VanDerWaalsContact O-N 3.13Å; L401-L404 PolarHBondContact O-N 3.22Å; Q402-L404 PolarHBondContact O-N 2.97Å; L404-E407 PolarHBondContact O-N 2.77Å; L404-Y408 HydrophobicContact CD1-CD2 3.86Å; L404-Y408 HydrophobicContact CD1-CE2 3.61Å; L404-Y408 HydrophobicContact CG-CD2 4.08Å; L404-Y408 HydrophobicContact CG-CE2 4.24Å; L404-Y408 WeakPolarHBondContact O-CD2 3.41Å; L404-Y408 PolarHBondContact O-N 3.31Å; L404-Y408 VanDerWaalsContact O-N 3.09Å
405	L	87.6	Confident	82.6	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-38.1	178.1	-70.7	170.9	0	0	0	111.9	L401 Q402 V403 E407 Y408 L409 I507 L511 L532 F535	L401-L405 WeakPolarHBondContact O-CB 3.39Å; L401-L405 VanDerWaalsContact O-CG 3.26Å; L401-L405 WeakPolarHBondContact O-CG 3.45Å; L401-L405 PolarHBondContact O-N 2.83Å; Q402-L405 PolarHBondContact O-N 3.34Å; V403-L405 PolarHBondContact O-N 2.83Å; L405-E407 PolarHBondContact O-N 3.11Å; L405-Y408 PolarHBondContact O-N 3.36Å; L405-L409 HydrophobicContact CB-CD1 4.17Å; L405-L409 WeakPolarHBondContact O-CB 3.23Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.45Å; L405-L409 PolarHBondContact O-N 3.45Å; L405-I507 HydrophobicContact CD2-CD1 3.61Å; L405-L511 HydrophobicContact CD1-CD1 4.03Å; L405-L511 HydrophobicContact CD1-CD2 3.77Å; L405-L532 HydrophobicContact CD1-CD1 3.82Å; L405-F535 HydrophobicContact CB-CE1 3.93Å; L405-F535 HydrophobicContact CB-CZ 4.47Å; L405-F535 HydrophobicContact CD1-CE1 4.41Å
406	M	86.4	Confident	81.1	Confident	64 Å²	64	42.8 Å²	42.8	32%	0.315	22%	0.217	S	C	.	.	H	α-helix	trans	-59.5	-32.4	176.4	-77.8	-178.7	69.8	0	0	113.1	Q402 V403 V411 F535	Q402-M406 HydrophobicContact CG-CG 4.48Å; Q402-M406 HydrophobicContact CG-SD 4.29Å; Q402-M406 WeakPolarHBondContact O-CB 3.32Å; Q402-M406 VanDerWaalsContact O-CG 3.28Å; Q402-M406 WeakPolarHBondContact O-CG 3.44Å; Q402-M406 PolarHBondContact O-N 2.96Å; V403-M406 PolarHBondContact O-N 3.38Å; M406-V411 HydrophobicContact CB-CB 4.48Å; M406-V411 HydrophobicContact CB-CG2 4.22Å; M406-V411 HydrophobicContact CE-CG1 4.37Å; M406-V411 HydrophobicContact CG-CG2 4.15Å; M406-V411 PolarHBondContact O-N 3.02Å; M406-F535 HydrophobicContact CG-CD2 4.44Å; M406-F535 HydrophobicContact CG-CE2 3.46Å; M406-F535 VanDerWaalsContact CG-CE2 3.46Å; M406-F535 HydrophobicContact CG-CZ 3.57Å; M406-F535 HydrophobicContact SD-CE2 4.2Å
407	E	85.1	Confident	79.2	Confident	59 Å²	59	43.1 Å²	43.1	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-79.8	-46.5	176.4	-63.2	179.6	167.2	0	0	111.9	V403 L404 L405 L409 D410 F495 P499	V403-E407 PolarHBondContact O-N 3.33Å; L404-E407 PolarHBondContact O-N 2.77Å; L405-E407 PolarHBondContact O-N 3.11Å; E407-L409 PolarHBondContact O-N 2.95Å; E407-D410 PolarHBondContact O-N 3.01Å; E407-F495 HydrophobicContact CB-CE1 3.81Å; E407-F495 HydrophobicContact CB-CZ 4.11Å; E407-P499 WeakPolarHBondContact O-CB 3.26Å
408	Y	84.5	Confident	77.2	Confident	3 Å²	3	46.1 Å²	46.1	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-72.6	-25.9	-179.6	-85.4	-81.8	0	0	0	115	L344 L347 L404 L405 D410 F495 V496 P499 G500 N503	L344-Y408 HydrophobicContact CD1-CD1 3.64Å; L344-Y408 HydrophobicContact CD1-CD2 4.03Å; L344-Y408 HydrophobicContact CD1-CE1 3.91Å; L344-Y408 HydrophobicContact CD1-CE2 4.29Å; L344-Y408 HydrophobicContact CD1-CG 3.69Å; L344-Y408 HydrophobicContact CD2-CD1 4.09Å; L344-Y408 HydrophobicContact CD2-CG 4.26Å; L344-Y408 HydrophobicContact CG-CD1 4.38Å; L347-Y408 HydrophobicContact CD2-CE2 4.38Å; L404-Y408 HydrophobicContact CD1-CD2 3.86Å; L404-Y408 HydrophobicContact CD1-CE2 3.61Å; L404-Y408 HydrophobicContact CG-CD2 4.08Å; L404-Y408 HydrophobicContact CG-CE2 4.24Å; L404-Y408 WeakPolarHBondContact O-CD2 3.41Å; L404-Y408 PolarHBondContact O-N 3.31Å; L404-Y408 VanDerWaalsContact O-N 3.09Å; L405-Y408 PolarHBondContact O-N 3.36Å; Y408-D410 VanDerWaalsContact C-N 3.33Å; Y408-F495 HydrophobicContact CD1-CD1 4.07Å; Y408-F495 HydrophobicContact CD2-CD1 4.27Å; Y408-F495 HydrophobicContact CD2-CE1 4.44Å; Y408-F495 HydrophobicContact CE1-CB 4.16Å; Y408-F495 AromaticContact CE1-CD1 3.75Å; Y408-F495 HydrophobicContact CE1-CD1 3.75Å; Y408-F495 HydrophobicContact CE1-CG 4.48Å; Y408-F495 AromaticContact CE2-CD1 3.95Å; Y408-F495 HydrophobicContact CE2-CD1 3.95Å; Y408-F495 HydrophobicContact CE2-CE1 4.36Å; Y408-F495 HydrophobicContact CG-CD1 4.33Å; Y408-F495 AromaticContact CZ-CD1 3.69Å; Y408-F495 WeakPolarHBondContact OH-CA 3.27Å; Y408-V496 PolarHBondContact OH-N 2.64Å; Y408-P499 WeakPolarHBondContact O-CA 3.44Å; Y408-G500 PolarHBondContact O-N 3.01Å; Y408-G500 VanDerWaalsContact O-N 3.14Å; Y408-N503 PolarHBondContact O-ND2 3.37Å
409	L	83.4	Confident	74.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.7	175.7	-63.8	175.5	0	0	0	113.2	L405 E407 V411 N503 I504 I507 Y539	L405-L409 HydrophobicContact CB-CD1 4.17Å; L405-L409 WeakPolarHBondContact O-CB 3.23Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.45Å; L405-L409 PolarHBondContact O-N 3.45Å; E407-L409 PolarHBondContact O-N 2.95Å; L409-V411 VanDerWaalsContact C-N 3.34Å; L409-V411 HydrophobicContact CB-CG2 4.22Å; L409-V411 PolarHBondContact O-N 3.48Å; L409-N503 HydrophobicContact CD2-CB 4.18Å; L409-I504 HydrophobicContact CD1-CD1 4.06Å; L409-I504 HydrophobicContact CD2-CB 3.92Å; L409-I504 HydrophobicContact CD2-CD1 4.14Å; L409-I507 HydrophobicContact CD2-CD1 4.08Å; L409-Y539 HydrophobicContact CB-CE1 4.32Å; L409-Y539 HydrophobicContact CB-CE2 3.92Å; L409-Y539 HydrophobicContact CD1-CD1 4.02Å; L409-Y539 HydrophobicContact CD1-CE1 3.91Å; L409-Y539 HydrophobicContact CD1-CE2 4.44Å; L409-Y539 HydrophobicContact CD1-CG 4.35Å; L409-Y539 HydrophobicContact CD2-CE1 4.27Å; L409-Y539 HydrophobicContact CG-CE1 4.4Å; L409-Y539 PolarHBondContact O-OH 3.27Å; L409-Y539 VanDerWaalsContact O-OH 3.14Å
410	D	81.8	Confident	72.6	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.214	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	49.2	-179.3	-158.8	-0.1	0	0	0	114.2	E407 Y408 K412 N413 S414 P499	E407-D410 PolarHBondContact O-N 3.01Å; Y408-D410 VanDerWaalsContact C-N 3.33Å; D410-K412 PolarHBondContact O-N 3.04Å; D410-N413 VanDerWaalsContact CG-ND2 3.27Å; D410-N413 PolarHBondContact O-N 3.49Å; D410-N413 WeakPolarHBondContact OD1-CB 3.48Å; D410-N413 VanDerWaalsContact OD1-CG 3.25Å; D410-N413 PolarHBondContact OD1-N 3.22Å; D410-N413 PolarHBondContact OD1-ND2 3.1Å; D410-N413 WeakPolarHBondContact OD2-CB 3.49Å; D410-N413 PolarHBondContact OD2-ND2 2.87Å; D410-S414 WeakPolarHBondContact O-CB 3.32Å; D410-S414 PolarHBondContact O-N 3.12Å; D410-S414 PolarHBondContact O-OG 2.92Å; D410-P499 HydrophobicContact CB-CB 3.88Å
411	V	77.6	Confident	69.8	Low	6 Å²	6	63.8 Å²	63.8	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-60.2	-29.5	-176.5	178	0	0	0	0	111.8	M406 L409 R415 F535 Y539 L543	M406-V411 HydrophobicContact CB-CB 4.48Å; M406-V411 HydrophobicContact CB-CG2 4.22Å; M406-V411 HydrophobicContact CE-CG1 4.37Å; M406-V411 HydrophobicContact CG-CG2 4.15Å; M406-V411 PolarHBondContact O-N 3.02Å; L409-V411 VanDerWaalsContact C-N 3.34Å; L409-V411 HydrophobicContact CB-CG2 4.22Å; L409-V411 PolarHBondContact O-N 3.48Å; V411-R415 WeakPolarHBondContact O-CG 3.35Å; V411-R415 PolarHBondContact O-N 3.12Å; V411-F535 HydrophobicContact CG2-CE2 4.43Å; V411-F535 HydrophobicContact CG2-CZ 4.21Å; V411-Y539 HydrophobicContact CG2-CD2 3.73Å; V411-Y539 HydrophobicContact CG2-CE2 3.72Å; V411-L543 HydrophobicContact CG1-CD1 3.9Å
412	K	71.4	Confident	67.4	Low	148 Å²	148	68.8 Å²	68.8	64%	0.643	37%	0.374	S	S	*	.	H	α-helix	trans	-69.9	-46.4	-179.2	-66.2	177.1	-176.6	168.9	0	111.7	D410	D410-K412 PolarHBondContact O-N 3.04Å
413	N	70.6	Confident	64.7	Low	97 Å²	97	74 Å²	74	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-79.1	-29.2	177.7	-61.9	-28.4	0	0	0	112.5	D410 R415 S416 S417	D410-N413 VanDerWaalsContact CG-ND2 3.27Å; D410-N413 PolarHBondContact O-N 3.49Å; D410-N413 WeakPolarHBondContact OD1-CB 3.48Å; D410-N413 VanDerWaalsContact OD1-CG 3.25Å; D410-N413 PolarHBondContact OD1-N 3.22Å; D410-N413 PolarHBondContact OD1-ND2 3.1Å; D410-N413 WeakPolarHBondContact OD2-CB 3.49Å; D410-N413 PolarHBondContact OD2-ND2 2.87Å; N413-R415 VanDerWaalsContact C-N 3.31Å; N413-R415 PolarHBondContact O-N 3.1Å; N413-S416 PolarHBondContact O-N 3.28Å; N413-S416 PolarHBondContact O-OG 2.9Å; N413-S416 VanDerWaalsContact O-OG 3.04Å; N413-S417 PolarHBondContact O-N 3Å
414	S	63.7	Low	62.2	Low	9 Å²	9	78.5 Å²	78.5	6%	0.063	42%	0.418	C	S	.	.	H	α-helix	trans	-58.7	-44.7	173.5	-57	0	0	0	0	110.7	D410 S416 S417 T418	D410-S414 WeakPolarHBondContact O-CB 3.32Å; D410-S414 PolarHBondContact O-N 3.12Å; D410-S414 PolarHBondContact O-OG 2.92Å; S414-S416 PolarHBondContact O-N 2.87Å; S414-S417 PolarHBondContact O-N 3.23Å; S414-S417 PolarHBondContact O-OG 3.29Å; S414-T418 PolarHBondContact O-N 3.37Å; S414-T418 PolarHBondContact O-OG1 3.06Å; S414-T418 VanDerWaalsContact O-OG1 3.05Å
415	R	60.5	Low	59.3	Low	138 Å²	138	83.2 Å²	83.2	52%	0.521	45%	0.452	S	S	.	.	H	α-helix	trans	-62.2	-39.6	177.6	-82.6	-179.8	151.4	-165.8	-6.7	114.5	V411 N413 S417 T418 Y538 L543	V411-R415 WeakPolarHBondContact O-CG 3.35Å; V411-R415 PolarHBondContact O-N 3.12Å; N413-R415 VanDerWaalsContact C-N 3.31Å; N413-R415 PolarHBondContact O-N 3.1Å; R415-S417 PolarHBondContact O-N 3.08Å; R415-T418 PolarHBondContact O-N 2.97Å; R415-Y538 PolarHBondContact NH2-OH 2.72Å; R415-L543 HydrophobicContact CG-CD1 4.39Å; R415-L543 HydrophobicContact CG-CD2 3.82Å
416	S	55.1	Low	57	Low	82 Å²	82	94 Å²	94	57%	0.573	49%	0.494	S	S	*	.	H	α-helix	trans	-74.6	-11.8	177.8	55.9	0	0	0	0	113.5	N413 S414	N413-S416 PolarHBondContact O-N 3.28Å; N413-S416 PolarHBondContact O-OG 2.9Å; N413-S416 VanDerWaalsContact O-OG 3.04Å; S414-S416 PolarHBondContact O-N 2.87Å
417	S	49.2	Very low	54.3	Low	75 Å²	75	94.9 Å²	94.9	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-84.8	-25	172.3	77.6	0	0	0	0	113.7	N413 S414 R415	N413-S417 PolarHBondContact O-N 3Å; S414-S417 PolarHBondContact O-N 3.23Å; S414-S417 PolarHBondContact O-OG 3.29Å; R415-S417 PolarHBondContact O-N 3.08Å
418	T	44.7	Very low	51.6	Low	68 Å²	68	97.4 Å²	97.4	42%	0.417	54%	0.536	S	S	.	.	H	α-helix	trans	-84.8	-31.2	-178.7	-18.2	0	0	0	0	113	S414 R415 Q420	S414-T418 PolarHBondContact O-N 3.37Å; S414-T418 PolarHBondContact O-OG1 3.06Å; S414-T418 VanDerWaalsContact O-OG1 3.05Å; R415-T418 PolarHBondContact O-N 2.97Å; T418-Q420 PolarHBondContact O-N 3.48Å
419	E	39.6	Very low	49.4	Very low	143 Å²	143	104.3 Å²	104.3	67%	0.668	58%	0.579	S	S	*	*			trans	-80.7	108.2	169.2	-72	-168.7	179.6	0	0	110.2	S421	E419-S421 PolarHBondContact O-N 3.36Å
420	Q	40.3	Very low	47	Very low	195 Å²	195	107.5 Å²	107.5	91%	0.911	61%	0.611	S	S	*	*			trans	-70.4	72.8	159.2	-74.2	-172.6	-4.4	0	0	109.4	T418 A422	T418-Q420 PolarHBondContact O-N 3.48Å; Q420-A422 PolarHBondContact O-N 3.06Å
421	S	31.5	Very low	45	Very low	73 Å²	73	110.7 Å²	110.7	51%	0.51	64%	0.637	S	S	.	*			trans	-66.9	101.6	175	-43	0	0	0	0	109	E419 Q423	E419-S421 PolarHBondContact O-N 3.36Å; S421-Q423 PolarHBondContact O-N 2.89Å
422	A	37.9	Very low	43.1	Very low	106 Å²	106	118.4 Å²	118.4	88%	0.876	67%	0.673	S	S	*	*			trans	-68.4	67.5	162.2	0	0	0	0	0	109.9	Q420	Q420-A422 PolarHBondContact O-N 3.06Å
423	Q	31.6	Very low	41.4	Very low	160 Å²	160	119.9 Å²	119.9	75%	0.748	68%	0.679	S	S	*	*			trans	-131.9	101.9	173.3	-72.1	-164.8	-7.5	0	0	109.8	S421 S425	S421-Q423 PolarHBondContact O-N 2.89Å; Q423-S425 VanDerWaalsContact C-N 3.33Å; Q423-S425 PolarHBondContact O-N 3.47Å
424	L	37.2	Very low	40	Very low	172 Å²	172	119.2 Å²	119.2	90%	0.901	69%	0.687	S	S	*	*			trans	-59.6	94.6	164.7	-77.9	158.2	0	0	0	109.1	Y426	L424-Y426 PolarHBondContact O-N 3.29Å
425	S	25.2	Very low	39.2	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	71%	0.713	S	S	*	*			trans	-68.6	95.8	171.7	-55.9	0	0	0	0	109.5	Q423 A427	Q423-S425 VanDerWaalsContact C-N 3.33Å; Q423-S425 PolarHBondContact O-N 3.47Å; S425-A427 VanDerWaalsContact C-N 3.26Å; S425-A427 PolarHBondContact O-N 3.13Å
426	Y	40.3	Very low	38.2	Very low	229 Å²	229	124.7 Å²	124.7	90%	0.898	73%	0.728	S	S	*	*			trans	-68.9	82.6	172.7	-124.3	-90.3	0	0	0	109.7	L424	L424-Y426 PolarHBondContact O-N 3.29Å
427	A	30.2	Very low	37.7	Very low	84 Å²	84	128.8 Å²	128.8	69%	0.694	74%	0.735	S	S	*	*			trans	-117	95.9	-179.6	0	0	0	0	0	111.1	S425	S425-A427 VanDerWaalsContact C-N 3.26Å; S425-A427 PolarHBondContact O-N 3.13Å
428	S	28.4	Very low	37.4	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	74%	0.738	S	S	*	*			trans	47.3	79.6	157.7	-160.7	0	0	0	0	117.8	G430	S428-G430 PolarHBondContact O-N 2.95Å
429	T	37.2	Very low	37.2	Very low	148 Å²	148	135 Å²	135	91%	0.908	76%	0.76	S	S	*	*			trans	-70.7	77.8	161.4	51.9	0	0	0	0	110.7
430	G	34.3	Very low	37.3	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	77%	0.772	S	S	*	*			trans	-114.7	-13.5	-173.1	0	0	0	0	0	117.1	S428	S428-G430 PolarHBondContact O-N 2.95Å
431	S	38.3	Very low	37.2	Very low	107 Å²	107	138 Å²	138	75%	0.748	77%	0.768	S	S	*	*	S	Bend	trans	-141	-21.9	-170	-160.2	0	0	0	0	116.9
432	E	38.5	Very low	37.4	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-94.2	-9.2	-163.4	-62.1	-165	140.7	0	0	116.3	A434 A435	E432-A434 PolarHBondContact O-N 3.19Å; E432-A435 PolarHBondContact O-N 3.43Å; E432-A435 VanDerWaalsContact O-N 3.16Å
433	F	36.1	Very low	37.3	Very low	179 Å²	179	144.6 Å²	144.6	79%	0.785	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-68.2	-21.8	180	-145.1	-94.9	0	0	0	113.5	A435 F437	F433-A435 VanDerWaalsContact C-N 3.34Å; F433-F437 HydrophobicContact CE1-CE2 4.1Å
434	A	41.4	Very low	37.5	Very low	82 Å²	82	148.2 Å²	148.2	68%	0.678	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-74.8	-21.2	175.8	0	0	0	0	0	113.5	E432	E432-A434 PolarHBondContact O-N 3.19Å
435	A	46	Very low	37.5	Very low	75 Å²	75	144.3 Å²	144.3	62%	0.62	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-25.9	-178.1	0	0	0	0	0	112.9	E432 F433	E432-A435 PolarHBondContact O-N 3.43Å; E432-A435 VanDerWaalsContact O-N 3.16Å; F433-A435 VanDerWaalsContact C-N 3.34Å
436	F	39.8	Very low	38.1	Very low	188 Å²	188	149.4 Å²	149.4	83%	0.825	79%	0.791	S	S	*	*	S	Bend	trans	-78.4	-22.1	-172.1	-139.6	-93.1	0	0	0	114.3
437	F	45.1	Very low	37.9	Very low	167 Å²	167	146.8 Å²	146.8	73%	0.732	79%	0.787	S	S	*	*	S	Bend	trans	-102.3	-5.8	178.6	-72.6	-82	0	0	0	114.2	F433 K439	F433-F437 HydrophobicContact CE1-CE2 4.1Å; F437-K439 PolarHBondContact O-N 3.48Å; F437-K439 VanDerWaalsContact O-N 3.14Å
438	A	42	Very low	38.2	Very low	70 Å²	70	147 Å²	147	58%	0.579	78%	0.784	S	S	*	*	S	Bend	trans	-76.1	101.3	177.3	0	0	0	0	0	111	K440	A438-K440 PolarHBondContact O-N 2.9Å; A438-K440 VanDerWaalsContact O-N 3.09Å
439	K	40.9	Very low	38.9	Very low	203 Å²	203	149.2 Å²	149.2	88%	0.883	79%	0.786	S	S	*	*			trans	-47.8	118.5	172.5	-77.9	-177.3	175.3	178.2	0	110.5	F437 K441	F437-K439 PolarHBondContact O-N 3.48Å; F437-K439 VanDerWaalsContact O-N 3.14Å; K439-K441 PolarHBondContact O-N 3.36Å
440	K	41.6	Very low	39.1	Very low	210 Å²	210	150 Å²	150	91%	0.913	78%	0.777	S	S	*	*			trans	-48.1	105.3	177.8	-78.4	-178.8	173.7	176.6	0	111.6	A438	A438-K440 PolarHBondContact O-N 2.9Å; A438-K440 VanDerWaalsContact O-N 3.09Å
441	K	37.2	Very low	39.6	Very low	191 Å²	191	153.7 Å²	153.7	83%	0.83	77%	0.774	S	S	*	*			trans	-85.6	134.1	146.7	-86.7	-175.5	174.6	177.9	0	107.4	K439 Q443	K439-K441 PolarHBondContact O-N 3.36Å; K441-Q443 PolarHBondContact O-N 2.95Å
442	P	36.9	Very low	39.9	Very low	122 Å²	122	155.4 Å²	155.4	79%	0.792	77%	0.769	S	S	*	*			trans	-65.9	111.2	172	27.3	-32.1	0	0	0	108.6	R444	P442-R444 PolarHBondContact O-N 3.24Å
443	Q	35.5	Very low	40.1	Very low	197 Å²	197	154.2 Å²	154.2	92%	0.921	76%	0.763	S	S	*	*			trans	-64.7	105.5	162.1	-87	-168.5	-21.3	0	0	107.3	K441 A445	K441-Q443 PolarHBondContact O-N 2.95Å; Q443-A445 PolarHBondContact O-N 2.92Å
444	R	35.2	Very low	40.1	Very low	235 Å²	235	151.8 Å²	151.8	89%	0.887	77%	0.768	S	S	*	*			trans	-54.7	126.9	159.2	-82	-178.5	169.9	167.9	-3.8	107.1	P442 K446	P442-R444 PolarHBondContact O-N 3.24Å; R444-K446 PolarHBondContact O-N 2.82Å
445	A	38.4	Very low	40.2	Very low	90 Å²	90	150 Å²	150	74%	0.744	75%	0.751	S	S	*	*			trans	-50.8	127.6	165.5	0	0	0	0	0	108	Q443 Q447	Q443-A445 PolarHBondContact O-N 2.92Å; A445-Q447 PolarHBondContact O-N 3.36Å
446	K	36.3	Very low	40	Very low	213 Å²	213	151.7 Å²	151.7	93%	0.926	76%	0.758	S	S	*	*			trans	-68.7	86.6	172.3	-73.7	-176.3	178.6	179.2	0	107.8	R444 S448	R444-K446 PolarHBondContact O-N 2.82Å; K446-S448 PolarHBondContact O-N 3.5Å; K446-S448 VanDerWaalsContact O-N 3.13Å
447	Q	36.6	Very low	40.2	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.813	76%	0.756	S	S	*	*			trans	-58.4	116.6	161.7	-74.7	-178.6	-25	0	0	106.9	A445 L449	A445-Q447 PolarHBondContact O-N 3.36Å; Q447-L449 PolarHBondContact O-N 3.03Å; Q447-L449 VanDerWaalsContact O-N 3.08Å
448	S	36.5	Very low	40.1	Very low	89 Å²	89	145.3 Å²	145.3	62%	0.622	74%	0.742	S	S	*	*			trans	-59.1	114.4	165	-176.9	0	0	0	0	106.8	K446 F450	K446-S448 PolarHBondContact O-N 3.5Å; K446-S448 VanDerWaalsContact O-N 3.13Å; S448-F450 PolarHBondContact O-N 3.43Å; S448-F450 PolarHBondContact OG-O 3.07Å
449	L	43.6	Very low	40.5	Very low	159 Å²	159	147.9 Å²	147.9	83%	0.832	75%	0.745	S	S	*	*	S	Bend	trans	-63.3	-8.8	-178.2	-85	160.7	0	0	0	113.1	Q447	Q447-L449 PolarHBondContact O-N 3.03Å; Q447-L449 VanDerWaalsContact O-N 3.08Å
450	F	40.8	Very low	41.2	Very low	163 Å²	163	141.1 Å²	141.1	72%	0.715	72%	0.723	S	S	*	*			trans	-128.9	123.8	166.3	-60.4	-81.6	0	0	0	110	S448 F452	S448-F450 PolarHBondContact O-N 3.43Å; S448-F450 PolarHBondContact OG-O 3.07Å; F450-F452 HydrophobicContact CB-CD2 4.49Å
451	K	45.5	Very low	41.4	Very low	145 Å²	145	137.5 Å²	137.5	63%	0.63	71%	0.711	S	S	*	*			trans	-118.1	117	161.4	-92.5	-179.9	145.7	-139.3	0	107	E453	K451-E453 HydrophobicContact CB-CG 4.39Å; K451-E453 WeakPolarHBondContact CD-OE2 3.43Å; K451-E453 VanDerWaalsContact CE-OE1 3.29Å; K451-E453 WeakPolarHBondContact CE-OE1 3.47Å; K451-E453 IonicContact NZ-OE1 3.88Å; K451-E453 PolarHBondContact NZ-OE1 3.43Å; K451-E453 IonicContact NZ-OE2 3.72Å; K451-E453 PolarHBondContact NZ-OE2 3.02Å; K451-E453 PolarHBondContact O-N 3.49Å; K451-E453 VanDerWaalsContact O-N 3.11Å
452	F	43.3	Very low	42	Very low	144 Å²	144	131 Å²	131	63%	0.632	69%	0.69	S	S	*	*			trans	-83.6	32.8	-179.6	-99.3	-108	0	0	0	112.8	F450 S454 S455 A458	F450-F452 HydrophobicContact CB-CD2 4.49Å; F452-S454 PolarHBondContact O-N 3.4Å; F452-S454 VanDerWaalsContact O-N 3.11Å; F452-S455 VanDerWaalsContact CD1-CB 3.43Å; F452-S455 PolarHBondContact O-N 3.42Å; F452-A458 HydrophobicContact CD1-CB 4.18Å
453	E	42.5	Very low	42.7	Very low	142 Å²	142	126.4 Å²	126.4	66%	0.664	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-2.9	-175.6	-73.9	172.6	170.9	0	0	114	K451	K451-E453 HydrophobicContact CB-CG 4.39Å; K451-E453 WeakPolarHBondContact CD-OE2 3.43Å; K451-E453 VanDerWaalsContact CE-OE1 3.29Å; K451-E453 WeakPolarHBondContact CE-OE1 3.47Å; K451-E453 IonicContact NZ-OE1 3.88Å; K451-E453 PolarHBondContact NZ-OE1 3.43Å; K451-E453 IonicContact NZ-OE2 3.72Å; K451-E453 PolarHBondContact NZ-OE2 3.02Å; K451-E453 PolarHBondContact O-N 3.49Å; K451-E453 VanDerWaalsContact O-N 3.11Å
454	S	37.3	Very low	43.7	Very low	128 Å²	128	123.3 Å²	123.3	90%	0.895	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	16.8	177.5	-51.4	0	0	0	0	114.2	F452	F452-S454 PolarHBondContact O-N 3.4Å; F452-S454 VanDerWaalsContact O-N 3.11Å
455	S	43.3	Very low	44.9	Very low	46 Å²	46	115.8 Å²	115.8	32%	0.322	62%	0.619	S	S	.	*			trans	-89.7	119	174.6	176.4	0	0	0	0	111.5	F452 H457 A458	F452-S455 VanDerWaalsContact CD1-CB 3.43Å; F452-S455 PolarHBondContact O-N 3.42Å; S455-H457 PolarHBondContact O-N 2.94Å; S455-H457 VanDerWaalsContact O-N 3.17Å; S455-H457 PolarHBondContact OG-N 3.43Å; S455-A458 PolarHBondContact OG-N 3.31Å
456	S	42.4	Very low	46	Very low	109 Å²	109	114 Å²	114	76%	0.762	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-7	173.3	55.6	0	0	0	0	114.4
457	H	44	Very low	46.9	Very low	167 Å²	167	109.2 Å²	109.2	77%	0.773	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-3.5	-174.3	-75.2	56	0	0	0	113.7	S455 I459	S455-H457 PolarHBondContact O-N 2.94Å; S455-H457 VanDerWaalsContact O-N 3.17Å; S455-H457 PolarHBondContact OG-N 3.43Å; H457-I459 PolarHBondContact O-N 3.41Å
458	A	43.2	Very low	47.8	Very low	54 Å²	54	105.4 Å²	105.4	45%	0.446	56%	0.557	S	S	.	*			trans	-93	67.3	175.9	0	0	0	0	0	111.1	F452 S455 S460	F452-A458 HydrophobicContact CD1-CB 4.18Å; S455-A458 PolarHBondContact OG-N 3.31Å; A458-S460 PolarHBondContact O-N 3.38Å
459	I	48.7	Very low	48.8	Very low	125 Å²	125	106.5 Å²	106.5	64%	0.641	55%	0.547	S	S	*	.			trans	-59.6	107.9	163.9	-59.5	176.9	0	0	0	106.4	H457 M461 A463	H457-I459 PolarHBondContact O-N 3.41Å; I459-M461 PolarHBondContact O-N 3.08Å; I459-A463 HydrophobicContact CG2-CB 3.85Å
460	S	56.2	Low	49.1	Very low	60 Å²	60	105.1 Å²	105.1	42%	0.42	53%	0.531	S	S	.	.			trans	-50.6	140.4	175.7	177	0	0	0	0	109.2	A458 S462 A463 Y464	A458-S460 PolarHBondContact O-N 3.38Å; S460-S462 PolarHBondContact O-N 3.39Å; S460-S462 PolarHBondContact OG-N 3.31Å; S460-S462 PolarHBondContact OG-OG 2.81Å; S460-A463 WeakPolarHBondContact O-CA 3.46Å; S460-A463 WeakPolarHBondContact O-CB 3.45Å; S460-A463 PolarHBondContact O-N 3.21Å; S460-Y464 PolarHBondContact O-N 2.9Å
461	M	47	Very low	49.4	Very low	134 Å²	134	102 Å²	102	66%	0.66	52%	0.519	S	S	*	.	H	α-helix	trans	-49.5	-33.5	171	-86.1	-63.3	-61.8	0	0	111.9	I459 A463 L465	I459-M461 PolarHBondContact O-N 3.08Å; M461-A463 VanDerWaalsContact C-N 3.34Å; M461-A463 PolarHBondContact O-N 2.85Å; M461-L465 HydrophobicContact CE-CD1 4.08Å; M461-L465 HydrophobicContact CE-CG 4.32Å; M461-L465 VanDerWaalsContact O-CB 3.3Å; M461-L465 WeakPolarHBondContact O-CB 3.32Å; M461-L465 VanDerWaalsContact O-CG 3.22Å; M461-L465 WeakPolarHBondContact O-CG 3.44Å; M461-L465 PolarHBondContact O-N 3.37Å
462	S	48.6	Very low	49.4	Very low	56 Å²	56	99.9 Å²	99.9	39%	0.392	51%	0.514	S	S	.	.	H	α-helix	trans	-69.1	-26.7	175	74.7	0	0	0	0	114.4	S460 R466	S460-S462 PolarHBondContact O-N 3.39Å; S460-S462 PolarHBondContact OG-N 3.31Å; S460-S462 PolarHBondContact OG-OG 2.81Å; S462-R466 WeakPolarHBondContact O-CB 3.16Å; S462-R466 WeakPolarHBondContact O-CG 3.37Å; S462-R466 PolarHBondContact O-N 2.94Å; S462-R466 PolarHBondContact O-NE 3.18Å; S462-R466 PolarHBondContact OG-NH2 2.85Å
463	A	51.2	Low	49.5	Very low	24 Å²	24	100.3 Å²	100.3	20%	0.198	51%	0.512	C	S	.	.	H	α-helix	trans	-81.5	-43.4	175.4	0	0	0	0	0	110.8	I459 S460 M461 L465 R466 E467	I459-A463 HydrophobicContact CG2-CB 3.85Å; S460-A463 WeakPolarHBondContact O-CA 3.46Å; S460-A463 WeakPolarHBondContact O-CB 3.45Å; S460-A463 PolarHBondContact O-N 3.21Å; M461-A463 VanDerWaalsContact C-N 3.34Å; M461-A463 PolarHBondContact O-N 2.85Å; A463-L465 PolarHBondContact O-N 3.39Å; A463-R466 CarbonylContact O-C 3.59Å; A463-R466 WeakPolarHBondContact O-CA 3.29Å; A463-R466 WeakPolarHBondContact O-CB 3.49Å; A463-R466 PolarHBondContact O-N 3.27Å; A463-E467 PolarHBondContact O-N 3.31Å
464	Y	57.4	Low	49.3	Very low	133 Å²	133	98.5 Å²	98.5	52%	0.522	52%	0.515	S	S	.	.	H	α-helix	trans	-58	-47.7	172.3	178.6	-99.1	0	0	0	112	S460 R466 E467 Q468	S460-Y464 PolarHBondContact O-N 2.9Å; Y464-R466 PolarHBondContact O-N 3.11Å; Y464-R466 VanDerWaalsContact O-N 3.14Å; Y464-E467 PolarHBondContact O-N 3.01Å; Y464-Q468 WeakPolarHBondContact O-CB 3.38Å; Y464-Q468 PolarHBondContact O-N 3.21Å
465	L	61.1	Low	49.2	Very low	76 Å²	76	100.2 Å²	100.2	40%	0.398	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-2.1	174.3	-66.7	171.2	0	0	0	114.6	M461 A463 R469	M461-L465 HydrophobicContact CE-CD1 4.08Å; M461-L465 HydrophobicContact CE-CG 4.32Å; M461-L465 VanDerWaalsContact O-CB 3.3Å; M461-L465 WeakPolarHBondContact O-CB 3.32Å; M461-L465 VanDerWaalsContact O-CG 3.22Å; M461-L465 WeakPolarHBondContact O-CG 3.44Å; M461-L465 PolarHBondContact O-N 3.37Å; A463-L465 PolarHBondContact O-N 3.39Å; L465-R469 PolarHBondContact O-NE 3.46Å; L465-R469 PolarHBondContact O-NH2 3.46Å
466	R	59.6	Low	48.6	Very low	52 Å²	52	100.8 Å²	100.8	20%	0.196	51%	0.511	C	S	.	.	H	α-helix	trans	-101.2	-42.1	169	-89.8	178.8	-73.7	150.1	0.7	111.3	D326 Y329 S462 A463 Y464 Q468 R469 R470	D326-R466 VanDerWaalsContact OD1-CD 3.25Å; D326-R466 WeakPolarHBondContact OD1-CD 3.36Å; D326-R466 IonicContact OD1-NH1 3.69Å; Y329-R466 VanDerWaalsContact CE1-NH1 3.33Å; S462-R466 WeakPolarHBondContact O-CB 3.16Å; S462-R466 WeakPolarHBondContact O-CG 3.37Å; S462-R466 PolarHBondContact O-N 2.94Å; S462-R466 PolarHBondContact O-NE 3.18Å; S462-R466 PolarHBondContact OG-NH2 2.85Å; A463-R466 CarbonylContact O-C 3.59Å; A463-R466 WeakPolarHBondContact O-CA 3.29Å; A463-R466 WeakPolarHBondContact O-CB 3.49Å; A463-R466 PolarHBondContact O-N 3.27Å; Y464-R466 PolarHBondContact O-N 3.11Å; Y464-R466 VanDerWaalsContact O-N 3.14Å; R466-Q468 VanDerWaalsContact C-N 3.34Å; R466-Q468 PolarHBondContact O-N 2.77Å; R466-R469 CarbonylContact O-C 3.52Å; R466-R469 WeakPolarHBondContact O-CA 3.48Å; R466-R469 WeakPolarHBondContact O-CB 2.91Å; R466-R469 PolarHBondContact O-N 2.94Å; R466-R469 VanDerWaalsContact O-N 3.09Å; R466-R470 WeakPolarHBondContact O-CB 3.11Å; R466-R470 PolarHBondContact O-N 3.43Å
467	E	56.2	Low	48.4	Very low	114 Å²	114	97.7 Å²	97.7	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-55.2	-49.7	172.3	-154.1	75.3	-111.9	0	0	110.6	A463 Y464 R469 R470 E471	A463-E467 PolarHBondContact O-N 3.31Å; Y464-E467 PolarHBondContact O-N 3.01Å; E467-R469 VanDerWaalsContact C-N 3.26Å; E467-R469 PolarHBondContact O-N 3.02Å; E467-R470 WeakPolarHBondContact O-CA 3.47Å; E467-R470 WeakPolarHBondContact O-CB 3.34Å; E467-R470 PolarHBondContact O-N 2.75Å; E467-E471 PolarHBondContact O-N 3.19Å
468	Q	55	Low	48.2	Very low	94 Å²	94	96.8 Å²	96.8	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-34.7	176.7	-164.3	-179.5	18.6	0	0	112.4	Y464 R466 L472	Y464-Q468 WeakPolarHBondContact O-CB 3.38Å; Y464-Q468 PolarHBondContact O-N 3.21Å; R466-Q468 VanDerWaalsContact C-N 3.34Å; R466-Q468 PolarHBondContact O-N 2.77Å; Q468-L472 WeakPolarHBondContact O-CG 3.38Å; Q468-L472 PolarHBondContact O-N 3Å; Q468-L472 VanDerWaalsContact O-N 3.1Å
469	R	57.3	Low	47.9	Very low	112 Å²	112	100.7 Å²	100.7	42%	0.423	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-37.3	174.4	-135.4	-178.4	-56.6	-153.7	-3.6	111.7	L465 R466 E467 L472 Y473	L465-R469 PolarHBondContact O-NE 3.46Å; L465-R469 PolarHBondContact O-NH2 3.46Å; R466-R469 CarbonylContact O-C 3.52Å; R466-R469 WeakPolarHBondContact O-CA 3.48Å; R466-R469 WeakPolarHBondContact O-CB 2.91Å; R466-R469 PolarHBondContact O-N 2.94Å; R466-R469 VanDerWaalsContact O-N 3.09Å; E467-R469 VanDerWaalsContact C-N 3.26Å; E467-R469 PolarHBondContact O-N 3.02Å; R469-L472 WeakPolarHBondContact O-CB 3.23Å; R469-L472 PolarHBondContact O-N 3.25Å; R469-Y473 HydrophobicContact CB-CE2 4.43Å; R469-Y473 HydrophobicContact CG-CE2 3.92Å; R469-Y473 WeakPolarHBondContact O-CD2 3.48Å; R469-Y473 PolarHBondContact O-N 2.92Å
470	R	50.5	Low	47.2	Very low	130 Å²	130	102 Å²	102	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-38.9	177.2	-148.7	-179.6	-166.4	-175.8	7.9	111.3	R466 E467 Y473 S474	R466-R470 WeakPolarHBondContact O-CB 3.11Å; R466-R470 PolarHBondContact O-N 3.43Å; E467-R470 WeakPolarHBondContact O-CA 3.47Å; E467-R470 WeakPolarHBondContact O-CB 3.34Å; E467-R470 PolarHBondContact O-N 2.75Å; R470-Y473 PolarHBondContact O-N 2.98Å; R470-S474 WeakPolarHBondContact O-CB 3.12Å; R470-S474 PolarHBondContact O-N 3.18Å; R470-S474 VanDerWaalsContact O-N 3.09Å
471	E	46.6	Very low	46	Very low	97 Å²	97	103.1 Å²	103.1	45%	0.453	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-43.3	170.2	-74.4	-154.7	100.5	0	0	112.3	E467 Y473 S474 K475	E467-E471 PolarHBondContact O-N 3.19Å; E471-Y473 PolarHBondContact O-N 3.34Å; E471-S474 PolarHBondContact O-N 3.01Å; E471-K475 WeakPolarHBondContact O-CB 3.47Å; E471-K475 PolarHBondContact O-N 3.19Å; E471-K475 IonicContact OE1-NZ 2.66Å; E471-K475 PolarHBondContact OE1-NZ 2.97Å
472	L	45.3	Very low	45	Very low	101 Å²	101	99.4 Å²	99.4	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-44.3	174.9	-75.8	163.1	0	0	0	112	Q468 R469 S474	Q468-L472 WeakPolarHBondContact O-CG 3.38Å; Q468-L472 PolarHBondContact O-N 3Å; Q468-L472 VanDerWaalsContact O-N 3.1Å; R469-L472 WeakPolarHBondContact O-CB 3.23Å; R469-L472 PolarHBondContact O-N 3.25Å; L472-S474 VanDerWaalsContact C-N 3.27Å; L472-S474 PolarHBondContact O-N 3.27Å
473	Y	45.9	Very low	44.2	Very low	153 Å²	153	100.4 Å²	100.4	60%	0.6	54%	0.536	S	S	*	.	H	α-helix	trans	-68.4	-20.7	174.9	-68.2	-53.6	0	0	0	114.4	R469 R470 E471	R469-Y473 HydrophobicContact CB-CE2 4.43Å; R469-Y473 HydrophobicContact CG-CE2 3.92Å; R469-Y473 WeakPolarHBondContact O-CD2 3.48Å; R469-Y473 PolarHBondContact O-N 2.92Å; R470-Y473 PolarHBondContact O-N 2.98Å; E471-Y473 PolarHBondContact O-N 3.34Å
474	S	39.5	Very low	43.2	Very low	104 Å²	104	106 Å²	106	73%	0.727	56%	0.563	S	S	*	*	H	α-helix	trans	-99.6	-14.4	-175.1	-167.3	0	0	0	0	114.4	R470 E471 L472	R470-S474 WeakPolarHBondContact O-CB 3.12Å; R470-S474 PolarHBondContact O-N 3.18Å; R470-S474 VanDerWaalsContact O-N 3.09Å; E471-S474 PolarHBondContact O-N 3.01Å; L472-S474 VanDerWaalsContact C-N 3.27Å; L472-S474 PolarHBondContact O-N 3.27Å
475	K	33.6	Very low	42.1	Very low	163 Å²	163	106.1 Å²	106.1	71%	0.709	57%	0.573	S	S	*	*	H	α-helix	trans	-115	-18.7	-172.9	-80.9	175.2	175.7	161.8	0	116.1	E471	E471-K475 WeakPolarHBondContact O-CB 3.47Å; E471-K475 PolarHBondContact O-N 3.19Å; E471-K475 IonicContact OE1-NZ 2.66Å; E471-K475 PolarHBondContact OE1-NZ 2.97Å
476	S	31.7	Very low	40.6	Very low	59 Å²	59	107.4 Å²	107.4	41%	0.413	58%	0.58	S	S	.	*			trans	-122.8	122.7	176.4	-164.2	0	0	0	0	112.7	E478	S476-E478 WeakPolarHBondContact OG-CA 3.42Å; S476-E478 PolarHBondContact OG-N 3.33Å; S476-E478 PolarHBondContact OG-O 3.19Å
477	G	38.2	Very low	39.4	Very low	43 Å²	43	112.3 Å²	112.3	44%	0.443	61%	0.609	S	S	.	*	S	Bend	trans	-72.6	-16.9	160.5	0	0	0	0	0	112.7	R196	R196-G477 PolarHBondContact NH1-O 3.33Å
478	E	38.8	Very low	38.3	Very low	149 Å²	149	112.7 Å²	112.7	70%	0.696	61%	0.614	S	S	*	*			trans	-103.8	104	-177	-64.3	178.7	165.3	0	0	109.8	S476	S476-E478 WeakPolarHBondContact OG-CA 3.42Å; S476-E478 PolarHBondContact OG-N 3.33Å; S476-E478 PolarHBondContact OG-O 3.19Å
479	L	38.1	Very low	37.2	Very low	135 Å²	135	116.6 Å²	116.6	71%	0.707	63%	0.632	S	S	*	*			trans	-144.7	89.8	154	-80.4	-174.3	0	0	0	109.1
480	Q	32.4	Very low	36	Very low	154 Å²	154	115.1 Å²	115.1	72%	0.72	65%	0.652	S	S	*	*			trans	-58.2	129.7	151.2	-159.4	166.7	64.1	0	0	107.1	D192 G482	D192-Q480 PolarHBondContact OD2-NE2 3.39Å; Q480-G482 PolarHBondContact O-N 3.3Å
481	G	32	Very low	35.1	Very low	82 Å²	82	111.7 Å²	111.7	85%	0.845	66%	0.656	S	S	*	*			trans	-68.3	94.4	-172	0	0	0	0	0	112.7
482	G	26.7	Very low	34.9	Very low	56 Å²	56	115.8 Å²	115.8	58%	0.577	68%	0.676	S	S	*	*			trans	-68.9	151.3	170.2	0	0	0	0	0	112.2	Q480 D484	Q480-G482 PolarHBondContact O-N 3.3Å; G482-D484 PolarHBondContact O-N 2.93Å
483	A	31.3	Very low	35.2	Very low	78 Å²	78	115.3 Å²	115.3	65%	0.645	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-65.6	-7.4	-169	0	0	0	0	0	116.3	N486	A483-N486 WeakPolarHBondContact O-CB 3.34Å; A483-N486 PolarHBondContact O-ND2 3.28Å
484	D	29.5	Very low	36	Very low	140 Å²	140	116 Å²	116	75%	0.749	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-85.4	-8.9	-176.8	-73.7	-25.8	0	0	0	114.8	G482 N486 L487	G482-D484 PolarHBondContact O-N 2.93Å; D484-N486 PolarHBondContact O-N 3.33Å; D484-L487 PolarHBondContact O-N 3.09Å
485	D	34.3	Very low	37.7	Very low	137 Å²	137	114.6 Å²	114.6	73%	0.733	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-72.2	-1.8	170.4	-156.5	39.3	0	0	0	112.3	L487	D485-L487 VanDerWaalsContact C-N 3.29Å; D485-L487 PolarHBondContact O-N 3.46Å
486	N	30.6	Very low	39.6	Very low	102 Å²	102	106.9 Å²	106.9	55%	0.545	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-79.5	-0.5	174.3	-70.8	-25.1	0	0	0	114.2	A483 D484 I488 E489	A483-N486 WeakPolarHBondContact O-CB 3.34Å; A483-N486 PolarHBondContact O-ND2 3.28Å; D484-N486 PolarHBondContact O-N 3.33Å; N486-I488 PolarHBondContact O-N 3.29Å; N486-E489 PolarHBondContact O-N 2.87Å
487	L	32.9	Very low	41.9	Very low	156 Å²	156	104.2 Å²	104.2	82%	0.817	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	8.1	176.4	-76.4	166.1	0	0	0	114.8	D484 D485	D484-L487 PolarHBondContact O-N 3.09Å; D485-L487 VanDerWaalsContact C-N 3.29Å; D485-L487 PolarHBondContact O-N 3.46Å
488	I	33.7	Very low	43.9	Very low	122 Å²	122	107.2 Å²	107.2	63%	0.626	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	47.7	162.6	-39.8	179	0	0	0	110.8	N486 G490	N486-I488 PolarHBondContact O-N 3.29Å; I488-G490 PolarHBondContact O-N 3.47Å; I488-G490 VanDerWaalsContact O-N 3.15Å
489	E	32.5	Very low	45.8	Very low	175 Å²	175	102.4 Å²	102.4	82%	0.818	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	105.7	149.9	-77.1	-168.9	142.1	0	0	108.6	N486	N486-E489 PolarHBondContact O-N 2.87Å
490	G	30.9	Very low	47.9	Very low	82 Å²	82	97 Å²	97	85%	0.845	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.3	5.2	178.5	0	0	0	0	0	116.7	I488	I488-G490 PolarHBondContact O-N 3.47Å; I488-G490 VanDerWaalsContact O-N 3.15Å
491	G	32.2	Very low	50.2	Low	57 Å²	57	90.1 Å²	90.1	59%	0.588	54%	0.535	S	S	*	.			trans	-101.6	115	173.6	0	0	0	0	0	112.8
492	E	42.1	Very low	52.6	Low	183 Å²	183	92.7 Å²	92.7	86%	0.855	52%	0.52	S	S	*	.			trans	-51.5	155.5	168.9	-62.4	176.6	133.3	0	0	111.8	K494	E492-K494 PolarHBondContact O-N 3.33Å; E492-K494 VanDerWaalsContact O-N 3.07Å
493	M	52.3	Low	55.4	Low	92 Å²	92	90.2 Å²	90.2	45%	0.453	49%	0.493	S	S	.	.			trans	-53.7	120.9	170.5	-88.7	-141.8	-169	0	0	109.5	F495	M493-F495 VanDerWaalsContact O-CD2 3.23Å; M493-F495 WeakPolarHBondContact O-CD2 3.37Å; M493-F495 PolarHBondContact O-N 3.13Å
494	K	63.2	Low	58	Low	166 Å²	166	86.5 Å²	86.5	72%	0.722	46%	0.462	S	S	*	.			trans	-69.6	98	171.3	-76.9	-172.1	175.3	-176.5	0	109.2	T321 E492	T321-K494 WeakPolarHBondContact CG2-O 3.41Å; E492-K494 PolarHBondContact O-N 3.33Å; E492-K494 VanDerWaalsContact O-N 3.07Å
495	F	73.6	Confident	60.6	Low	75 Å²	75	80.9 Å²	80.9	33%	0.329	43%	0.433	S	S	.	.			trans	-62.5	136.4	171.7	-65.4	-79.7	0	0	0	111.1	E407 Y408 M493 C497 P499	E407-F495 HydrophobicContact CB-CE1 3.81Å; E407-F495 HydrophobicContact CB-CZ 4.11Å; Y408-F495 HydrophobicContact CD1-CD1 4.07Å; Y408-F495 HydrophobicContact CD2-CD1 4.27Å; Y408-F495 HydrophobicContact CD2-CE1 4.44Å; Y408-F495 HydrophobicContact CE1-CB 4.16Å; Y408-F495 AromaticContact CE1-CD1 3.75Å; Y408-F495 HydrophobicContact CE1-CD1 3.75Å; Y408-F495 HydrophobicContact CE1-CG 4.48Å; Y408-F495 AromaticContact CE2-CD1 3.95Å; Y408-F495 HydrophobicContact CE2-CD1 3.95Å; Y408-F495 HydrophobicContact CE2-CE1 4.36Å; Y408-F495 HydrophobicContact CG-CD1 4.33Å; Y408-F495 AromaticContact CZ-CD1 3.69Å; Y408-F495 WeakPolarHBondContact OH-CA 3.27Å; M493-F495 VanDerWaalsContact O-CD2 3.23Å; M493-F495 WeakPolarHBondContact O-CD2 3.37Å; M493-F495 PolarHBondContact O-N 3.13Å; F495-C497 WeakPolarHBondContact CB-O 3.47Å; F495-P499 HydrophobicContact CD1-CG 4.08Å; F495-P499 HydrophobicContact CD2-CG 4.38Å; F495-P499 HydrophobicContact CE1-CG 4.19Å; F495-P499 HydrophobicContact CE2-CG 4.47Å; F495-P499 HydrophobicContact CG-CG 4.2Å; F495-P499 HydrophobicContact CZ-CG 4.38Å
496	V	75.5	Confident	63	Low	1 Å²	1	76.6 Å²	76.6	1%	0.006	41%	0.412	C	S	.	.	S	Bend	trans	-80.7	-21.1	175.8	-162.5	0	0	0	0	111.6	T321 I324 L335 L343 L347 Y408	T321-V496 HydrophobicContact CG2-CG2 3.83Å; I324-V496 HydrophobicContact CG2-CG1 3.83Å; L335-V496 HydrophobicContact CD2-CG1 3.99Å; L335-V496 VanDerWaalsContact CD2-O 3.23Å; L335-V496 WeakPolarHBondContact CD2-O 3.42Å; L343-V496 HydrophobicContact CB-CG1 3.56Å; L343-V496 HydrophobicContact CD1-CG1 4.02Å; L343-V496 HydrophobicContact CG-CG1 4.4Å; L347-V496 HydrophobicContact CD2-CG2 4.02Å; Y408-V496 PolarHBondContact OH-N 2.64Å
497	C	78.8	Confident	65.7	Low	3 Å²	3	71.7 Å²	71.7	2%	0.02	39%	0.386	C	S	.	.	S	Bend	trans	-142	153.4	175.4	-178.7	0	0	0	0	108.5	Q340 L344 F495	Q340-C497 VanDerWaalsContact C-SG 3.53Å; L344-C497 HydrophobicContact CB-CB 4.5Å; F495-C497 WeakPolarHBondContact CB-O 3.47Å
498	K	79.6	Confident	68.3	Low	106 Å²	106	64.4 Å²	64.4	46%	0.461	35%	0.347	S	S	.	.			trans	-58	131.7	173.6	-70.4	-178.8	179.8	170.7	0	110.4	A336 N503	A336-K498 WeakPolarHBondContact O-CE 3.34Å; A336-K498 PolarHBondContact O-NZ 3.12Å; K498-N503 PolarHBondContact O-ND2 3.06Å
499	P	80.2	Confident	70.8	Confident	49 Å²	49	61.3 Å²	61.3	32%	0.318	33%	0.331	S	S	.	.			trans	-52.8	141.9	167.4	-29.1	37.7	0	0	0	111.6	E407 Y408 D410 F495	E407-P499 WeakPolarHBondContact O-CB 3.26Å; Y408-P499 WeakPolarHBondContact O-CA 3.44Å; D410-P499 HydrophobicContact CB-CB 3.88Å; F495-P499 HydrophobicContact CD1-CG 4.08Å; F495-P499 HydrophobicContact CD2-CG 4.38Å; F495-P499 HydrophobicContact CE1-CG 4.19Å; F495-P499 HydrophobicContact CE2-CG 4.47Å; F495-P499 HydrophobicContact CG-CG 4.2Å; F495-P499 HydrophobicContact CZ-CG 4.38Å
500	G	81.3	Confident	73.4	Confident	22 Å²	22	53.9 Å²	53.9	23%	0.227	30%	0.298	C	S	.	.			trans	167.3	148.9	178	0	0	0	0	0	113.7	Y408 R502 N503	Y408-G500 PolarHBondContact O-N 3.01Å; Y408-G500 VanDerWaalsContact O-N 3.14Å; G500-R502 VanDerWaalsContact C-N 3.34Å; G500-R502 PolarHBondContact O-N 2.92Å; G500-N503 PolarHBondContact N-ND2 2.69Å; G500-N503 VanDerWaalsContact O-CB 3.25Å; G500-N503 WeakPolarHBondContact O-CB 3.43Å; G500-N503 PolarHBondContact O-N 3.44Å; G500-N503 VanDerWaalsContact O-N 3.08Å; G500-N503 PolarHBondContact O-ND2 3.01Å
501	A	81.8	Confident	76.1	Confident	8 Å²	8	50 Å²	50	7%	0.066	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-62.2	-36.1	-169.2	0	0	0	0	0	114.1	N503 I504 Y539 F544 Q547	A501-N503 PolarHBondContact O-N 3.33Å; A501-N503 VanDerWaalsContact O-N 3.1Å; A501-I504 VanDerWaalsContact O-CG2 3.23Å; A501-I504 WeakPolarHBondContact O-CG2 3.46Å; A501-I504 PolarHBondContact O-N 3.38Å; A501-I504 VanDerWaalsContact O-N 3.16Å; A501-Y539 VanDerWaalsContact CA-OH 3.27Å; A501-Y539 WeakPolarHBondContact CA-OH 3.41Å; A501-Y539 WeakPolarHBondContact CB-OH 3.28Å; A501-F544 HydrophobicContact CB-CD2 4.05Å; A501-F544 HydrophobicContact CB-CE2 4.37Å; A501-Q547 VanDerWaalsContact CB-OE1 3.28Å
502	R	82.3	Confident	78.7	Confident	136 Å²	136	49 Å²	49	51%	0.513	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-65.7	-10.5	177.8	-63	-170	-174.5	-153.4	0.7	114.2	G500 I504 T505 E551	G500-R502 VanDerWaalsContact C-N 3.34Å; G500-R502 PolarHBondContact O-N 2.92Å; R502-I504 PolarHBondContact O-N 3.38Å; R502-T505 PolarHBondContact O-N 3.27Å; R502-T505 PolarHBondContact O-OG1 3.03Å; R502-E551 IonicContact CZ-OE2 2.74Å; R502-E551 IonicContact NE-OE2 3.9Å; R502-E551 IonicContact NH2-OE2 2.65Å; R502-E551 PolarHBondContact NH2-OE2 3.45Å
503	N	84.9	Confident	80.9	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.021	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-60.7	-23	171.1	-70.4	-24.4	0	0	0	112.3	L344 Y408 L409 K498 G500 A501 T505	L344-N503 HydrophobicContact CD2-CB 3.93Å; Y408-N503 PolarHBondContact O-ND2 3.37Å; L409-N503 HydrophobicContact CD2-CB 4.18Å; K498-N503 PolarHBondContact O-ND2 3.06Å; G500-N503 PolarHBondContact N-ND2 2.69Å; G500-N503 VanDerWaalsContact O-CB 3.25Å; G500-N503 WeakPolarHBondContact O-CB 3.43Å; G500-N503 PolarHBondContact O-N 3.44Å; G500-N503 VanDerWaalsContact O-N 3.08Å; G500-N503 PolarHBondContact O-ND2 3.01Å; A501-N503 PolarHBondContact O-N 3.33Å; A501-N503 VanDerWaalsContact O-N 3.1Å; N503-T505 VanDerWaalsContact C-N 3.26Å; N503-T505 PolarHBondContact O-N 2.89Å
504	I	85.5	Confident	82.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-33.9	178.9	-164.5	57.8	0	0	0	113.1	L409 A501 R502 V506 I507 F508 L536 Y539 I540 F544	L409-I504 HydrophobicContact CD1-CD1 4.06Å; L409-I504 HydrophobicContact CD2-CB 3.92Å; L409-I504 HydrophobicContact CD2-CD1 4.14Å; A501-I504 VanDerWaalsContact O-CG2 3.23Å; A501-I504 WeakPolarHBondContact O-CG2 3.46Å; A501-I504 PolarHBondContact O-N 3.38Å; A501-I504 VanDerWaalsContact O-N 3.16Å; R502-I504 PolarHBondContact O-N 3.38Å; I504-V506 VanDerWaalsContact C-N 3.33Å; I504-V506 PolarHBondContact O-N 3.15Å; I504-I507 HydrophobicContact CD1-CD1 4.26Å; I504-I507 HydrophobicContact CD1-CG1 4.11Å; I504-I507 PolarHBondContact O-N 2.98Å; I504-F508 VanDerWaalsContact O-CB 3.27Å; I504-F508 WeakPolarHBondContact O-CB 3.41Å; I504-F508 PolarHBondContact O-N 3.21Å; I504-L536 HydrophobicContact CD1-CD1 3.86Å; I504-Y539 HydrophobicContact CB-CE1 4.17Å; I504-Y539 HydrophobicContact CD1-CD1 4.34Å; I504-Y539 HydrophobicContact CD1-CE1 4.36Å; I504-Y539 HydrophobicContact CG1-CD1 4.39Å; I504-Y539 HydrophobicContact CG1-CE1 4.15Å; I504-I540 HydrophobicContact CG1-CG1 4.39Å; I504-F544 HydrophobicContact CG2-CD1 4.21Å; I504-F544 HydrophobicContact CG2-CD2 3.72Å; I504-F544 HydrophobicContact CG2-CE1 4.02Å; I504-F544 HydrophobicContact CG2-CE2 3.51Å; I504-F544 HydrophobicContact CG2-CG 4.07Å; I504-F544 HydrophobicContact CG2-CZ 3.67Å
505	T	85.3	Confident	83.6	Confident	22 Å²	22	35.5 Å²	35.5	14%	0.135	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-37.4	-169.8	67.1	0	0	0	0	112.5	R502 N503 F544 L601 D604 L605	R502-T505 PolarHBondContact O-N 3.27Å; R502-T505 PolarHBondContact O-OG1 3.03Å; N503-T505 VanDerWaalsContact C-N 3.26Å; N503-T505 PolarHBondContact O-N 2.89Å; T505-F544 HydrophobicContact CG2-CZ 4.29Å; T505-L601 HydrophobicContact CG2-CD2 3.56Å; T505-D604 WeakPolarHBondContact CB-OD2 3.41Å; T505-D604 HydrophobicContact CG2-CB 4.4Å; T505-L605 HydrophobicContact CG2-CD1 3.94Å
506	V	84.7	Confident	84.1	Confident	47 Å²	47	36.1 Å²	36.1	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-79.5	-32.9	-179.8	-176.3	0	0	0	0	112	P341 L345 I504	P341-V506 HydrophobicContact CB-CB 4.12Å; P341-V506 HydrophobicContact CB-CG2 3.77Å; P341-V506 HydrophobicContact CG-CG2 3.74Å; L345-V506 HydrophobicContact CB-CG1 3.95Å; L345-V506 HydrophobicContact CD2-CG1 3.89Å; L345-V506 HydrophobicContact CG-CG1 4.42Å; I504-V506 VanDerWaalsContact C-N 3.33Å; I504-V506 PolarHBondContact O-N 3.15Å
507	I	87.1	Confident	84.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-92	-17	-174.8	68.8	178.7	0	0	0	114.2	L344 L348 L405 L409 I504 Q509 P510 L511	L344-I507 HydrophobicContact CD2-CD1 4.38Å; L344-I507 HydrophobicContact CD2-CG2 4.02Å; L344-I507 HydrophobicContact CG-CG2 3.98Å; L348-I507 HydrophobicContact CD2-CB 3.74Å; L348-I507 HydrophobicContact CD2-CG2 4.05Å; L405-I507 HydrophobicContact CD2-CD1 3.61Å; L409-I507 HydrophobicContact CD2-CD1 4.08Å; I504-I507 HydrophobicContact CD1-CD1 4.26Å; I504-I507 HydrophobicContact CD1-CG1 4.11Å; I504-I507 PolarHBondContact O-N 2.98Å; I507-Q509 PolarHBondContact O-N 3.22Å; I507-P510 WeakPolarHBondContact O-CD 3.38Å; I507-L511 WeakPolarHBondContact O-CB 3.29Å; I507-L511 PolarHBondContact O-N 3.35Å
508	F	87.2	Confident	84.7	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-50.7	-171.6	176.4	-108.8	0	0	0	113.4	I504 L511 L512 L536 I540 L605 A607 Y608	I504-F508 VanDerWaalsContact O-CB 3.27Å; I504-F508 WeakPolarHBondContact O-CB 3.41Å; I504-F508 PolarHBondContact O-N 3.21Å; F508-L511 PolarHBondContact O-N 2.99Å; F508-L512 HydrophobicContact CE1-CD2 4.37Å; F508-L512 HydrophobicContact CZ-CD2 4.15Å; F508-L512 WeakPolarHBondContact O-CB 3.41Å; F508-L512 PolarHBondContact O-N 3.31Å; F508-L536 HydrophobicContact CD2-CD1 4.28Å; F508-L536 HydrophobicContact CD2-CD2 4.16Å; F508-L536 HydrophobicContact CE2-CD2 3.99Å; F508-L536 HydrophobicContact CE2-CG 4.37Å; F508-I540 HydrophobicContact CD2-CD1 3.58Å; F508-I540 HydrophobicContact CE2-CD1 3.43Å; F508-I540 VanDerWaalsContact CE2-CD1 3.43Å; F508-I540 HydrophobicContact CZ-CD1 4.43Å; F508-L605 HydrophobicContact CB-CG 4.45Å; F508-L605 HydrophobicContact CD1-CB 4.42Å; F508-L605 HydrophobicContact CD1-CG 4.1Å; F508-L605 HydrophobicContact CG-CG 4.12Å; F508-A607 HydrophobicContact CE1-CB 4.25Å; F508-A607 HydrophobicContact CZ-CB 3.99Å; F508-Y608 HydrophobicContact CE2-CD2 4.49Å; F508-Y608 AromaticContact CE2-CE2 3.82Å; F508-Y608 HydrophobicContact CE2-CE2 3.82Å; F508-Y608 HydrophobicContact CZ-CD2 4.09Å; F508-Y608 AromaticContact CZ-CE2 3.7Å; F508-Y608 HydrophobicContact CZ-CE2 3.7Å
509	Q	86.3	Confident	84.8	Confident	58 Å²	58	36.6 Å²	36.6	27%	0.271	18%	0.178	S	C	.	.	H	α-helix	trans	-66.1	-47.1	-177.1	-60.8	-69.9	-22.1	0	0	112.8	I507 L512 R513 D604 S606	I507-Q509 PolarHBondContact O-N 3.22Å; Q509-L512 PolarHBondContact O-N 3.11Å; Q509-R513 PolarHBondContact O-N 3.42Å; Q509-D604 PolarHBondContact NE2-O 2.86Å; Q509-S606 PolarHBondContact NE2-OG 3.1Å
510	P	87.3	Confident	84.8	Confident	19 Å²	19	41.8 Å²	41.8	12%	0.123	20%	0.2	C	C	.	.	H	α-helix	trans	-57.1	-45.3	170	-24.3	30.6	0	0	0	113.8	L345 F352 I507 L512 R513 F514	L345-P510 HydrophobicContact CD1-CB 4.23Å; L345-P510 HydrophobicContact CD1-CG 3.51Å; F352-P510 HydrophobicContact CE2-CB 4.13Å; I507-P510 WeakPolarHBondContact O-CD 3.38Å; P510-L512 PolarHBondContact O-N 3.47Å; P510-R513 PolarHBondContact O-N 3.3Å; P510-F514 PolarHBondContact O-N 3.15Å
511	L	87.8	Confident	84.5	Confident	1 Å²	1	46 Å²	46	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-40.8	-178.8	-179.7	62.6	0	0	0	111.8	L348 F352 L405 I507 F508 F514 I515 L532 L536	L348-L511 HydrophobicContact CD2-CB 4.44Å; F352-L511 HydrophobicContact CE1-CD1 4.3Å; F352-L511 HydrophobicContact CZ-CB 4.33Å; F352-L511 HydrophobicContact CZ-CD1 3.82Å; L405-L511 HydrophobicContact CD1-CD1 4.03Å; L405-L511 HydrophobicContact CD1-CD2 3.77Å; I507-L511 WeakPolarHBondContact O-CB 3.29Å; I507-L511 PolarHBondContact O-N 3.35Å; F508-L511 PolarHBondContact O-N 2.99Å; L511-F514 PolarHBondContact O-N 2.95Å; L511-I515 HydrophobicContact CD1-CD1 4.35Å; L511-I515 HydrophobicContact CG-CD1 4.02Å; L511-I515 VanDerWaalsContact O-CG1 3.29Å; L511-I515 WeakPolarHBondContact O-CG1 3.29Å; L511-I515 PolarHBondContact O-N 3.08Å; L511-L532 HydrophobicContact CD1-CD1 4.46Å; L511-L532 HydrophobicContact CD1-CD2 4Å; L511-L532 HydrophobicContact CD1-CG 4.36Å; L511-L536 HydrophobicContact CD2-CD1 3.82Å; L511-L536 HydrophobicContact CD2-CD2 3.99Å; L511-L536 HydrophobicContact CD2-CG 4.46Å; L511-L536 HydrophobicContact CG-CD2 4.23Å
512	L	86.4	Confident	83.9	Confident	36 Å²	36	46.9 Å²	46.9	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-40.8	177.2	-173.1	63.9	0	0	0	112.2	F508 Q509 P510 I515 Q516	F508-L512 HydrophobicContact CE1-CD2 4.37Å; F508-L512 HydrophobicContact CZ-CD2 4.15Å; F508-L512 WeakPolarHBondContact O-CB 3.41Å; F508-L512 PolarHBondContact O-N 3.31Å; Q509-L512 PolarHBondContact O-N 3.11Å; P510-L512 PolarHBondContact O-N 3.47Å; L512-I515 PolarHBondContact O-N 2.89Å; L512-Q516 VanDerWaalsContact O-CG 3.31Å; L512-Q516 WeakPolarHBondContact O-CG 3.34Å; L512-Q516 PolarHBondContact O-N 2.66Å
513	R	86.8	Confident	83	Confident	149 Å²	149	41.6 Å²	41.6	56%	0.562	21%	0.208	S	C	*	.	H	α-helix	trans	-62.9	-43.4	173.7	-67	-175.5	-166.9	118.2	4	111.8	Q509 P510 I515 Q516 E517	Q509-R513 PolarHBondContact O-N 3.42Å; P510-R513 PolarHBondContact O-N 3.3Å; R513-I515 PolarHBondContact O-N 3.1Å; R513-Q516 PolarHBondContact O-N 3.11Å; R513-E517 PolarHBondContact O-N 2.86Å
514	F	87.5	Confident	81.8	Confident	8 Å²	8	47 Å²	47	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-39	178.1	-176.9	-100.9	0	0	0	112.7	F352 F355 K356 I397 L401 P510 L511 E517 I518 L532	F352-F514 HydrophobicContact CB-CD2 3.62Å; F352-F514 HydrophobicContact CB-CE2 3.78Å; F352-F514 HydrophobicContact CB-CG 4.37Å; F352-F514 HydrophobicContact CD1-CB 4.11Å; F352-F514 AromaticContact CD1-CD1 3.58Å; F352-F514 HydrophobicContact CD1-CD1 3.58Å; F352-F514 AromaticContact CD1-CD2 3.45Å; F352-F514 HydrophobicContact CD1-CD2 3.45Å; F352-F514 VanDerWaalsContact CD1-CD2 3.45Å; F352-F514 AromaticContact CD1-CE1 3.75Å; F352-F514 HydrophobicContact CD1-CE1 3.75Å; F352-F514 AromaticContact CD1-CE2 3.63Å; F352-F514 HydrophobicContact CD1-CE2 3.63Å; F352-F514 AromaticContact CD1-CG 3.42Å; F352-F514 HydrophobicContact CD1-CG 3.42Å; F352-F514 VanDerWaalsContact CD1-CG 3.42Å; F352-F514 AromaticContact CD1-CZ 3.77Å; F352-F514 HydrophobicContact CD1-CZ 3.77Å; F352-F514 HydrophobicContact CD2-CB 3.86Å; F352-F514 HydrophobicContact CD2-CD2 4.03Å; F352-F514 HydrophobicContact CD2-CG 4Å; F352-F514 HydrophobicContact CE1-CB 3.9Å; F352-F514 AromaticContact CE1-CD1 3.37Å; F352-F514 HydrophobicContact CE1-CD1 3.37Å; F352-F514 HydrophobicContact CE1-CD2 4.05Å; F352-F514 AromaticContact CE1-CE1 3.81Å; F352-F514 HydrophobicContact CE1-CE1 3.81Å; F352-F514 HydrophobicContact CE1-CE2 4.43Å; F352-F514 AromaticContact CE1-CG 3.49Å; F352-F514 HydrophobicContact CE1-CG 3.49Å; F352-F514 VanDerWaalsContact CE1-CG 3.49Å; F352-F514 HydrophobicContact CE1-CZ 4.32Å; F352-F514 HydrophobicContact CE2-CB 3.64Å; F352-F514 HydrophobicContact CE2-CG 4.06Å; F352-F514 HydrophobicContact CG-CB 4.08Å; F352-F514 HydrophobicContact CG-CD1 4.32Å; F352-F514 AromaticContact CG-CD2 3.43Å; F352-F514 HydrophobicContact CG-CD2 3.43Å; F352-F514 VanDerWaalsContact CG-CD2 3.43Å; F352-F514 AromaticContact CG-CE2 3.87Å; F352-F514 HydrophobicContact CG-CE2 3.87Å; F352-F514 AromaticContact CG-CG 3.68Å; F352-F514 HydrophobicContact CG-CG 3.68Å; F352-F514 HydrophobicContact CG-CZ 4.47Å; F352-F514 HydrophobicContact CZ-CB 3.65Å; F352-F514 AromaticContact CZ-CD1 3.95Å; F352-F514 HydrophobicContact CZ-CD1 3.95Å; F352-F514 AromaticContact CZ-CG 3.8Å; F352-F514 HydrophobicContact CZ-CG 3.8Å; F355-F514 HydrophobicContact CB-CZ 4.47Å; K356-F514 HydrophobicContact CG-CE2 4.17Å; I397-F514 HydrophobicContact CG2-CE1 4.47Å; I397-F514 HydrophobicContact CG2-CZ 4.2Å; L401-F514 HydrophobicContact CD1-CD1 4.09Å; L401-F514 HydrophobicContact CD1-CE1 3.29Å; L401-F514 HydrophobicContact CD1-CZ 3.96Å; P510-F514 PolarHBondContact O-N 3.15Å; L511-F514 PolarHBondContact O-N 2.95Å; F514-E517 PolarHBondContact O-N 2.86Å; F514-I518 HydrophobicContact CD1-CD1 3.81Å; F514-I518 HydrophobicContact CE1-CD1 3.26Å; F514-I518 HydrophobicContact CE1-CG1 4.25Å; F514-I518 HydrophobicContact CZ-CD1 3.73Å; F514-I518 HydrophobicContact CZ-CG1 4.4Å; F514-I518 PolarHBondContact O-N 3.5Å; F514-I518 VanDerWaalsContact O-N 3.1Å; F514-L532 HydrophobicContact CD1-CD2 4.4Å
515	I	86.1	Confident	80.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-48.7	171.8	-73.3	164.5	0	0	0	110.8	L511 L512 R513 E517 I518 E519 L532 R533 L536	L511-I515 HydrophobicContact CD1-CD1 4.35Å; L511-I515 HydrophobicContact CG-CD1 4.02Å; L511-I515 VanDerWaalsContact O-CG1 3.29Å; L511-I515 WeakPolarHBondContact O-CG1 3.29Å; L511-I515 PolarHBondContact O-N 3.08Å; L512-I515 PolarHBondContact O-N 2.89Å; R513-I515 PolarHBondContact O-N 3.1Å; I515-E517 VanDerWaalsContact C-N 3.33Å; I515-E517 PolarHBondContact O-N 2.9Å; I515-I518 PolarHBondContact O-N 3.21Å; I515-I518 VanDerWaalsContact O-N 3.16Å; I515-E519 HydrophobicContact CG2-CG 4.42Å; I515-E519 WeakPolarHBondContact O-CG 3.43Å; I515-E519 PolarHBondContact O-N 3.07Å; I515-L532 HydrophobicContact CD1-CD2 4.4Å; I515-L532 HydrophobicContact CD1-CG 4.04Å; I515-L532 HydrophobicContact CG1-CB 4.37Å; I515-L532 HydrophobicContact CG1-CD2 3.8Å; I515-L532 HydrophobicContact CG1-CG 3.9Å; I515-R533 HydrophobicContact CG2-CB 3.88Å; I515-R533 HydrophobicContact CG2-CG 4.34Å; I515-L536 HydrophobicContact CD1-CB 4.48Å; I515-L536 HydrophobicContact CD1-CD2 3.63Å
516	Q	84.6	Confident	79.1	Confident	88 Å²	88	54 Å²	54	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-59.7	-41.7	178.7	-71.7	168.8	-1.7	0	0	112.2	L512 R513 I518 E519 M520	L512-Q516 VanDerWaalsContact O-CG 3.31Å; L512-Q516 WeakPolarHBondContact O-CG 3.34Å; L512-Q516 PolarHBondContact O-N 2.66Å; R513-Q516 PolarHBondContact O-N 3.11Å; Q516-I518 PolarHBondContact O-N 3.38Å; Q516-E519 PolarHBondContact O-N 2.67Å; Q516-M520 WeakPolarHBondContact O-CG 3.38Å; Q516-M520 PolarHBondContact O-N 3.04Å
517	E	83.3	Confident	77.8	Confident	78 Å²	78	52.8 Å²	52.8	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-40.1	175.1	-72.7	-178.8	-124.6	0	0	112.6	K356 R513 F514 I515 M520 N521	K356-E517 WeakPolarHBondContact CE-OE2 3.29Å; K356-E517 IonicContact NZ-OE1 3.85Å; K356-E517 PolarHBondContact NZ-OE1 3.14Å; K356-E517 IonicContact NZ-OE2 3.64Å; K356-E517 PolarHBondContact NZ-OE2 3.36Å; R513-E517 PolarHBondContact O-N 2.86Å; F514-E517 PolarHBondContact O-N 2.86Å; I515-E517 VanDerWaalsContact C-N 3.33Å; I515-E517 PolarHBondContact O-N 2.9Å; E517-M520 PolarHBondContact O-N 2.97Å; E517-N521 VanDerWaalsContact O-CG 3.24Å; E517-N521 PolarHBondContact O-N 3.42Å; E517-N521 VanDerWaalsContact O-N 3.16Å; E517-N521 PolarHBondContact O-ND2 3.28Å
518	I	82.6	Confident	76.3	Confident	11 Å²	11	60.2 Å²	60.2	6%	0.056	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-45.2	174.6	-70.3	172	0	0	0	110.9	Q398 F514 I515 Q516 M520 N521 M522	Q398-I518 HydrophobicContact CG-CD1 4.25Å; F514-I518 HydrophobicContact CD1-CD1 3.81Å; F514-I518 HydrophobicContact CE1-CD1 3.26Å; F514-I518 HydrophobicContact CE1-CG1 4.25Å; F514-I518 HydrophobicContact CZ-CD1 3.73Å; F514-I518 HydrophobicContact CZ-CG1 4.4Å; F514-I518 PolarHBondContact O-N 3.5Å; F514-I518 VanDerWaalsContact O-N 3.1Å; I515-I518 PolarHBondContact O-N 3.21Å; I515-I518 VanDerWaalsContact O-N 3.16Å; Q516-I518 PolarHBondContact O-N 3.38Å; I518-M520 VanDerWaalsContact C-N 3.28Å; I518-M520 PolarHBondContact O-N 3.47Å; I518-N521 PolarHBondContact O-N 3.33Å; I518-M522 HydrophobicContact CG2-CG 4.19Å; I518-M522 HydrophobicContact CG2-SD 4.46Å; I518-M522 WeakPolarHBondContact O-CG 3.23Å; I518-M522 PolarHBondContact O-N 3.05Å
519	E	82.6	Confident	75.1	Confident	30 Å²	30	67 Å²	67	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-59.3	-39	178.6	-72.9	173.5	167.6	0	0	111.9	I515 Q516 A527 C530 R533	I515-E519 HydrophobicContact CG2-CG 4.42Å; I515-E519 WeakPolarHBondContact O-CG 3.43Å; I515-E519 PolarHBondContact O-N 3.07Å; Q516-E519 PolarHBondContact O-N 2.67Å; E519-A527 HydrophobicContact CB-CB 4.11Å; E519-A527 HydrophobicContact CG-CB 4.4Å; E519-C530 HydrophobicContact CG-CB 4Å; E519-R533 WeakPolarHBondContact OE1-CD 3.5Å; E519-R533 IonicContact OE1-CZ 3.85Å; E519-R533 IonicContact OE1-NE 3.99Å; E519-R533 IonicContact OE1-NH1 2.63Å; E519-R533 PolarHBondContact OE1-NH1 2.86Å; E519-R533 IonicContact OE2-NH1 3.35Å; E519-R533 PolarHBondContact OE2-NH1 3.13Å
520	M	80.3	Confident	74.8	Confident	158 Å²	158	64.4 Å²	64.4	78%	0.778	33%	0.333	S	S	*	.	H	α-helix	trans	-65	-36.9	173.1	-70.2	-177.7	73.6	0	0	112.8	Q516 E517 I518	Q516-M520 WeakPolarHBondContact O-CG 3.38Å; Q516-M520 PolarHBondContact O-N 3.04Å; E517-M520 PolarHBondContact O-N 2.97Å; I518-M520 VanDerWaalsContact C-N 3.28Å; I518-M520 PolarHBondContact O-N 3.47Å
521	N	73.4	Confident	74.6	Confident	110 Å²	110	68.2 Å²	68.2	59%	0.588	35%	0.35	S	S	*	.	H	α-helix	trans	-78.2	-22.1	-177.9	-70.8	-31	0	0	0	114.3	E517 I518	E517-N521 VanDerWaalsContact O-CG 3.24Å; E517-N521 PolarHBondContact O-N 3.42Å; E517-N521 VanDerWaalsContact O-N 3.16Å; E517-N521 PolarHBondContact O-ND2 3.28Å; I518-N521 PolarHBondContact O-N 3.33Å
522	M	69.6	Low	74.4	Confident	27 Å²	27	68.2 Å²	68.2	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-90.3	-7	177	-56.8	-144.8	-52.5	0	0	114	A391 S394 I518 Q526	A391-M522 HydrophobicContact CB-SD 4.1Å; S394-M522 WeakPolarHBondContact CB-SD 3.3Å; I518-M522 HydrophobicContact CG2-CG 4.19Å; I518-M522 HydrophobicContact CG2-SD 4.46Å; I518-M522 WeakPolarHBondContact O-CG 3.23Å; I518-M522 PolarHBondContact O-N 3.05Å; M522-Q526 HydrophobicContact CB-CB 4.22Å; M522-Q526 HydrophobicContact CE-CB 4.31Å; M522-Q526 PolarHBondContact O-OE1 3.4Å
523	G	64.6	Low	74.4	Confident	25 Å²	25	71.2 Å²	71.2	26%	0.258	36%	0.358	S	S	.	.			trans	75.4	163.7	-178.5	0	0	0	0	0	114.5	S525 Q526 A527	G523-S525 VanDerWaalsContact C-N 3.29Å; G523-S525 PolarHBondContact O-N 3.19Å; G523-S525 VanDerWaalsContact O-N 3.17Å; G523-Q526 PolarHBondContact O-N 3.16Å; G523-A527 WeakPolarHBondContact O-CB 3.46Å; G523-A527 PolarHBondContact O-N 3.08Å
524	P	58.3	Low	74.4	Confident	117 Å²	117	68.5 Å²	68.5	76%	0.76	36%	0.358	S	S	*	.	H	α-helix	trans	-65.7	-26.2	-163.9	24.4	-34.6	0	0	0	114.6
525	S	55.7	Low	74.4	Confident	108 Å²	108	68.8 Å²	68.8	76%	0.755	36%	0.36	S	S	*	.	H	α-helix	trans	-74.4	-36.6	-178.6	-44.9	0	0	0	0	113.1	G523	G523-S525 VanDerWaalsContact C-N 3.29Å; G523-S525 PolarHBondContact O-N 3.19Å; G523-S525 VanDerWaalsContact O-N 3.17Å
526	Q	60.3	Low	74.5	Confident	62 Å²	62	69 Å²	69	29%	0.29	36%	0.361	S	S	.	.	H	α-helix	trans	-99.2	-17.4	-176.4	-68.5	174	-11.4	0	0	112.5	E389 M522 G523 K528 Q529	E389-Q526 PolarHBondContact OE2-NE2 3.1Å; M522-Q526 HydrophobicContact CB-CB 4.22Å; M522-Q526 HydrophobicContact CE-CB 4.31Å; M522-Q526 PolarHBondContact O-OE1 3.4Å; G523-Q526 PolarHBondContact O-N 3.16Å; Q526-K528 PolarHBondContact O-N 3.27Å; Q526-Q529 PolarHBondContact O-N 2.87Å
527	A	56.8	Low	74.5	Confident	21 Å²	21	67.3 Å²	67.3	17%	0.174	36%	0.357	C	S	.	.	H	α-helix	trans	-53.1	-35.4	174.7	0	0	0	0	0	113.4	E519 G523 Q529 C530	E519-A527 HydrophobicContact CB-CB 4.11Å; E519-A527 HydrophobicContact CG-CB 4.4Å; G523-A527 WeakPolarHBondContact O-CB 3.46Å; G523-A527 PolarHBondContact O-N 3.08Å; A527-Q529 PolarHBondContact O-N 3.5Å; A527-Q529 VanDerWaalsContact O-N 3.08Å; A527-C530 PolarHBondContact O-N 3.35Å
528	K	54.1	Low	74.7	Confident	156 Å²	156	68 Å²	68	68%	0.678	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.7	176.6	-63.4	-163.2	175.1	-158.5	0	114.5	Q526 D751	Q526-K528 PolarHBondContact O-N 3.27Å; K528-D751 WeakPolarHBondContact CE-OD2 3.49Å; K528-D751 IonicContact NZ-OD1 2.69Å; K528-D751 IonicContact NZ-OD2 2.73Å; K528-D751 PolarHBondContact NZ-OD2 2.9Å
529	Q	63.6	Low	75	Confident	146 Å²	146	67.5 Å²	67.5	68%	0.682	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	16.6	179.1	-60	-174.8	-2.8	0	0	113.6	Q526 A527 Q531	Q526-Q529 PolarHBondContact O-N 2.87Å; A527-Q529 PolarHBondContact O-N 3.5Å; A527-Q529 VanDerWaalsContact O-N 3.08Å; Q529-Q531 PolarHBondContact O-N 3.26Å
530	C	78.7	Confident	75.2	Confident	2 Å²	2	66 Å²	66	1%	0.014	35%	0.347	C	S	.	.			trans	-61.3	100.5	177.7	-172.7	0	0	0	0	111.7	Q398 E519 A527 L532 R533 T534	Q398-C530 PolarHBondContact OE1-SG 2.95Å; E519-C530 HydrophobicContact CG-CB 4Å; A527-C530 PolarHBondContact O-N 3.35Å; C530-L532 PolarHBondContact O-N 3.26Å; C530-R533 HydrophobicContact CB-CB 3.98Å; C530-R533 WeakPolarHBondContact O-CB 3.4Å; C530-R533 PolarHBondContact O-N 3.18Å; C530-R533 VanDerWaalsContact O-N 3.1Å; C530-T534 PolarHBondContact O-N 3.14Å; C530-T534 VanDerWaalsContact O-N 3.08Å; C530-T534 PolarHBondContact O-OG1 3.09Å
531	Q	83.1	Confident	75.4	Confident	100 Å²	100	60.8 Å²	60.8	47%	0.467	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-37.7	-177.7	-62.6	-178.9	3.3	0	0	111.5	Q529 R533 T534 F535	Q529-Q531 PolarHBondContact O-N 3.26Å; Q531-R533 VanDerWaalsContact C-N 3.33Å; Q531-R533 PolarHBondContact O-N 3.26Å; Q531-T534 PolarHBondContact O-N 3.33Å; Q531-F535 WeakPolarHBondContact O-CB 3.25Å; Q531-F535 PolarHBondContact O-N 3.37Å
532	L	85	Confident	75.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-35.3	178.6	-171.9	60.8	0	0	0	112.2	Q398 L401 L405 L511 F514 I515 C530 L536	Q398-L532 HydrophobicContact CB-CB 4.15Å; Q398-L532 HydrophobicContact CG-CB 3.91Å; Q398-L532 HydrophobicContact CG-CD2 4.47Å; L401-L532 HydrophobicContact CB-CD1 4.38Å; L401-L532 HydrophobicContact CB-CD2 4.49Å; L401-L532 HydrophobicContact CD1-CD2 4.24Å; L405-L532 HydrophobicContact CD1-CD1 3.82Å; L511-L532 HydrophobicContact CD1-CD1 4.46Å; L511-L532 HydrophobicContact CD1-CD2 4Å; L511-L532 HydrophobicContact CD1-CG 4.36Å; F514-L532 HydrophobicContact CD1-CD2 4.4Å; I515-L532 HydrophobicContact CD1-CD2 4.4Å; I515-L532 HydrophobicContact CD1-CG 4.04Å; I515-L532 HydrophobicContact CG1-CB 4.37Å; I515-L532 HydrophobicContact CG1-CD2 3.8Å; I515-L532 HydrophobicContact CG1-CG 3.9Å; C530-L532 PolarHBondContact O-N 3.26Å; L532-L536 VanDerWaalsContact O-CB 3.29Å; L532-L536 WeakPolarHBondContact O-CB 3.23Å; L532-L536 PolarHBondContact O-N 3.21Å
533	R	85.4	Confident	76.6	Confident	99 Å²	99	58.4 Å²	58.4	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-69.7	-46.7	173.1	-174.3	166.5	-177.7	152.7	0.8	111.7	I515 E519 C530 Q531 F535 L536 T537	I515-R533 HydrophobicContact CG2-CB 3.88Å; I515-R533 HydrophobicContact CG2-CG 4.34Å; E519-R533 WeakPolarHBondContact OE1-CD 3.5Å; E519-R533 IonicContact OE1-CZ 3.85Å; E519-R533 IonicContact OE1-NE 3.99Å; E519-R533 IonicContact OE1-NH1 2.63Å; E519-R533 PolarHBondContact OE1-NH1 2.86Å; E519-R533 IonicContact OE2-NH1 3.35Å; E519-R533 PolarHBondContact OE2-NH1 3.13Å; C530-R533 HydrophobicContact CB-CB 3.98Å; C530-R533 WeakPolarHBondContact O-CB 3.4Å; C530-R533 PolarHBondContact O-N 3.18Å; C530-R533 VanDerWaalsContact O-N 3.1Å; Q531-R533 VanDerWaalsContact C-N 3.33Å; Q531-R533 PolarHBondContact O-N 3.26Å; R533-F535 VanDerWaalsContact C-N 3.31Å; R533-F535 PolarHBondContact O-N 3.43Å; R533-L536 PolarHBondContact O-N 2.98Å; R533-T537 PolarHBondContact O-N 2.97Å; R533-T537 PolarHBondContact O-OG1 2.9Å
534	T	86.6	Confident	77.7	Confident	92 Å²	92	57.4 Å²	57.4	56%	0.564	30%	0.298	S	S	*	.	H	α-helix	trans	-58.6	-44.3	176.5	-56.2	0	0	0	0	111.3	C530 Q531 Y538	C530-T534 PolarHBondContact O-N 3.14Å; C530-T534 VanDerWaalsContact O-N 3.08Å; C530-T534 PolarHBondContact O-OG1 3.09Å; Q531-T534 PolarHBondContact O-N 3.33Å; T534-Y538 WeakPolarHBondContact O-CB 3.15Å; T534-Y538 PolarHBondContact O-N 3.35Å
535	F	88.6	Confident	79.1	Confident	15 Å²	15	52.1 Å²	52.1	7%	0.066	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-47	174.2	169.6	-102.7	0	0	0	112.4	Q402 L405 M406 V411 Q531 R533 T537 Y538 Y539	Q402-F535 HydrophobicContact CG-CB 4.2Å; Q402-F535 HydrophobicContact CG-CD1 4.05Å; Q402-F535 HydrophobicContact CG-CD2 3.94Å; Q402-F535 HydrophobicContact CG-CE1 4.46Å; Q402-F535 HydrophobicContact CG-CE2 4.37Å; Q402-F535 HydrophobicContact CG-CG 3.77Å; L405-F535 HydrophobicContact CB-CE1 3.93Å; L405-F535 HydrophobicContact CB-CZ 4.47Å; L405-F535 HydrophobicContact CD1-CE1 4.41Å; M406-F535 HydrophobicContact CG-CD2 4.44Å; M406-F535 HydrophobicContact CG-CE2 3.46Å; M406-F535 VanDerWaalsContact CG-CE2 3.46Å; M406-F535 HydrophobicContact CG-CZ 3.57Å; M406-F535 HydrophobicContact SD-CE2 4.2Å; V411-F535 HydrophobicContact CG2-CE2 4.43Å; V411-F535 HydrophobicContact CG2-CZ 4.21Å; Q531-F535 WeakPolarHBondContact O-CB 3.25Å; Q531-F535 PolarHBondContact O-N 3.37Å; R533-F535 VanDerWaalsContact C-N 3.31Å; R533-F535 PolarHBondContact O-N 3.43Å; F535-T537 PolarHBondContact O-N 2.85Å; F535-Y538 PolarHBondContact O-N 3.29Å; F535-Y539 VanDerWaalsContact O-CB 3.32Å; F535-Y539 WeakPolarHBondContact O-CB 3.47Å; F535-Y539 PolarHBondContact O-N 3.08Å
536	L	87	Confident	80.6	Confident	4 Å²	4	50 Å²	50	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-43.3	-179.9	-177	60.3	0	0	0	111.8	I504 F508 L511 I515 L532 R533 Y539 I540	I504-L536 HydrophobicContact CD1-CD1 3.86Å; F508-L536 HydrophobicContact CD2-CD1 4.28Å; F508-L536 HydrophobicContact CD2-CD2 4.16Å; F508-L536 HydrophobicContact CE2-CD2 3.99Å; F508-L536 HydrophobicContact CE2-CG 4.37Å; L511-L536 HydrophobicContact CD2-CD1 3.82Å; L511-L536 HydrophobicContact CD2-CD2 3.99Å; L511-L536 HydrophobicContact CD2-CG 4.46Å; L511-L536 HydrophobicContact CG-CD2 4.23Å; I515-L536 HydrophobicContact CD1-CB 4.48Å; I515-L536 HydrophobicContact CD1-CD2 3.63Å; L532-L536 VanDerWaalsContact O-CB 3.29Å; L532-L536 WeakPolarHBondContact O-CB 3.23Å; L532-L536 PolarHBondContact O-N 3.21Å; R533-L536 PolarHBondContact O-N 2.98Å; L536-Y539 PolarHBondContact O-N 3.16Å; L536-I540 HydrophobicContact CD1-CD1 3.71Å; L536-I540 HydrophobicContact CD1-CG1 4.25Å; L536-I540 HydrophobicContact CG-CD1 3.92Å; L536-I540 VanDerWaalsContact O-CG1 3.32Å; L536-I540 WeakPolarHBondContact O-CG1 3.38Å; L536-I540 PolarHBondContact O-N 3.48Å
537	T	85.6	Confident	81.9	Confident	53 Å²	53	49 Å²	49	33%	0.325	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-46.6	177.1	-55.5	0	0	0	0	111.7	R533 F535 I540 N541	R533-T537 PolarHBondContact O-N 2.97Å; R533-T537 PolarHBondContact O-OG1 2.9Å; F535-T537 PolarHBondContact O-N 2.85Å; T537-I540 PolarHBondContact O-N 2.89Å; T537-N541 WeakPolarHBondContact CG2-ND2 3.39Å; T537-N541 WeakPolarHBondContact O-CB 3.25Å; T537-N541 PolarHBondContact O-N 3.43Å
538	Y	87.4	Confident	83.5	Confident	91 Å²	91	48.2 Å²	48.2	36%	0.357	23%	0.232	S	C	.	.	H	α-helix	trans	-60.5	-46.8	174.9	174.1	-103.1	0	0	0	111.8	R415 T534 F535 I540 D542 L543	R415-Y538 PolarHBondContact NH2-OH 2.72Å; T534-Y538 WeakPolarHBondContact O-CB 3.15Å; T534-Y538 PolarHBondContact O-N 3.35Å; F535-Y538 PolarHBondContact O-N 3.29Å; Y538-I540 VanDerWaalsContact C-N 3.35Å; Y538-I540 PolarHBondContact O-N 3.04Å; Y538-D542 HydrophobicContact CD2-CB 3.97Å; Y538-D542 WeakPolarHBondContact CD2-OD2 3.17Å; Y538-D542 HydrophobicContact CE2-CB 3.8Å; Y538-D542 WeakPolarHBondContact O-CB 3.43Å; Y538-D542 PolarHBondContact O-N 3.46Å; Y538-L543 HydrophobicContact CE1-CD1 4.12Å
539	Y	87.7	Confident	85	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	22%	0.215	C	C	.	.	I	π-helix	trans	-61.2	-42.9	179.3	179.7	-95.7	0	0	0	112	L409 V411 A501 I504 F535 L536 L543 F544	L409-Y539 HydrophobicContact CB-CE1 4.32Å; L409-Y539 HydrophobicContact CB-CE2 3.92Å; L409-Y539 HydrophobicContact CD1-CD1 4.02Å; L409-Y539 HydrophobicContact CD1-CE1 3.91Å; L409-Y539 HydrophobicContact CD1-CE2 4.44Å; L409-Y539 HydrophobicContact CD1-CG 4.35Å; L409-Y539 HydrophobicContact CD2-CE1 4.27Å; L409-Y539 HydrophobicContact CG-CE1 4.4Å; L409-Y539 PolarHBondContact O-OH 3.27Å; L409-Y539 VanDerWaalsContact O-OH 3.14Å; V411-Y539 HydrophobicContact CG2-CD2 3.73Å; V411-Y539 HydrophobicContact CG2-CE2 3.72Å; A501-Y539 VanDerWaalsContact CA-OH 3.27Å; A501-Y539 WeakPolarHBondContact CA-OH 3.41Å; A501-Y539 WeakPolarHBondContact CB-OH 3.28Å; I504-Y539 HydrophobicContact CB-CE1 4.17Å; I504-Y539 HydrophobicContact CD1-CD1 4.34Å; I504-Y539 HydrophobicContact CD1-CE1 4.36Å; I504-Y539 HydrophobicContact CG1-CD1 4.39Å; I504-Y539 HydrophobicContact CG1-CE1 4.15Å; F535-Y539 VanDerWaalsContact O-CB 3.32Å; F535-Y539 WeakPolarHBondContact O-CB 3.47Å; F535-Y539 PolarHBondContact O-N 3.08Å; L536-Y539 PolarHBondContact O-N 3.16Å; Y539-L543 HydrophobicContact CD2-CB 4.25Å; Y539-L543 HydrophobicContact CD2-CD1 3.9Å; Y539-L543 HydrophobicContact CE2-CB 4.38Å; Y539-L543 HydrophobicContact CE2-CD1 4.37Å; Y539-L543 WeakPolarHBondContact O-CB 3.14Å; Y539-L543 PolarHBondContact O-N 3.02Å; Y539-F544 HydrophobicContact CD1-CB 4.43Å; Y539-F544 HydrophobicContact CE1-CB 4.02Å; Y539-F544 PolarHBondContact O-N 2.99Å
540	I	86.8	Confident	86.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-71.3	-53.6	-178.4	-66.8	168.9	0	0	0	111	I504 F508 L536 T537 Y538 L545 L605 Y608	I504-I540 HydrophobicContact CG1-CG1 4.39Å; F508-I540 HydrophobicContact CD2-CD1 3.58Å; F508-I540 HydrophobicContact CE2-CD1 3.43Å; F508-I540 VanDerWaalsContact CE2-CD1 3.43Å; F508-I540 HydrophobicContact CZ-CD1 4.43Å; L536-I540 HydrophobicContact CD1-CD1 3.71Å; L536-I540 HydrophobicContact CD1-CG1 4.25Å; L536-I540 HydrophobicContact CG-CD1 3.92Å; L536-I540 VanDerWaalsContact O-CG1 3.32Å; L536-I540 WeakPolarHBondContact O-CG1 3.38Å; L536-I540 PolarHBondContact O-N 3.48Å; T537-I540 PolarHBondContact O-N 2.89Å; Y538-I540 VanDerWaalsContact C-N 3.35Å; Y538-I540 PolarHBondContact O-N 3.04Å; I540-L545 HydrophobicContact CG2-CD1 4.09Å; I540-L545 HydrophobicContact CG2-CG 4.19Å; I540-L545 WeakPolarHBondContact O-CB 3.3Å; I540-L545 VanDerWaalsContact O-CG 3.3Å; I540-L545 WeakPolarHBondContact O-CG 3.4Å; I540-L545 PolarHBondContact O-N 2.84Å; I540-L605 HydrophobicContact CD1-CD2 4.06Å; I540-L605 HydrophobicContact CG1-CD2 4.21Å; I540-L605 HydrophobicContact CG2-CD2 3.94Å; I540-Y608 HydrophobicContact CB-CE1 4.24Å; I540-Y608 HydrophobicContact CB-CE2 4.23Å; I540-Y608 HydrophobicContact CD1-CD2 4.26Å; I540-Y608 HydrophobicContact CD1-CE2 3.5Å; I540-Y608 HydrophobicContact CG1-CE2 4.45Å; I540-Y608 HydrophobicContact CG2-CD1 3.77Å; I540-Y608 HydrophobicContact CG2-CD2 3.82Å; I540-Y608 HydrophobicContact CG2-CE1 3.71Å; I540-Y608 HydrophobicContact CG2-CE2 3.77Å; I540-Y608 HydrophobicContact CG2-CG 3.83Å
541	N	84.6	Confident	86.6	Confident	47 Å²	47	44.5 Å²	44.5	25%	0.251	22%	0.219	S	C	.	.	I	π-helix	trans	-67	-53.1	-176.2	-71.5	-26.9	0	0	0	112.2	T537 Y608 Q611	T537-N541 WeakPolarHBondContact CG2-ND2 3.39Å; T537-N541 WeakPolarHBondContact O-CB 3.25Å; T537-N541 PolarHBondContact O-N 3.43Å; N541-Y608 VanDerWaalsContact OD1-CE1 3.24Å; N541-Y608 WeakPolarHBondContact OD1-CE1 3.24Å; N541-Q611 PolarHBondContact OD1-NE2 3.14Å; N541-Q611 PolarHBondContact OD1-OE1 3.35Å
542	D	83	Confident	86.9	Confident	79 Å²	79	40.3 Å²	40.3	42%	0.422	20%	0.2	S	C	.	.	I	π-helix	trans	-90	-21.4	-166.4	-60.4	-69.3	0	0	0	113.8	Y538 N546	Y538-D542 HydrophobicContact CD2-CB 3.97Å; Y538-D542 WeakPolarHBondContact CD2-OD2 3.17Å; Y538-D542 HydrophobicContact CE2-CB 3.8Å; Y538-D542 WeakPolarHBondContact O-CB 3.43Å; Y538-D542 PolarHBondContact O-N 3.46Å; D542-N546 PolarHBondContact O-ND2 2.92Å
543	L	86	Confident	87	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.047	21%	0.212	C	C	.	.	I	π-helix	trans	-115	-61.2	-178.6	-59.6	174.2	0	0	0	112.5	V411 R415 Y538 Y539 N546 Q547	V411-L543 HydrophobicContact CG1-CD1 3.9Å; R415-L543 HydrophobicContact CG-CD1 4.39Å; R415-L543 HydrophobicContact CG-CD2 3.82Å; Y538-L543 HydrophobicContact CE1-CD1 4.12Å; Y539-L543 HydrophobicContact CD2-CB 4.25Å; Y539-L543 HydrophobicContact CD2-CD1 3.9Å; Y539-L543 HydrophobicContact CE2-CB 4.38Å; Y539-L543 HydrophobicContact CE2-CD1 4.37Å; Y539-L543 WeakPolarHBondContact O-CB 3.14Å; Y539-L543 PolarHBondContact O-N 3.02Å; L543-N546 PolarHBondContact O-N 3.14Å; L543-Q547 WeakPolarHBondContact O-CB 3.18Å; L543-Q547 PolarHBondContact O-N 2.98Å
544	F	88.3	Confident	87.2	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.013	23%	0.228	C	C	.	.	I	π-helix	trans	-64.9	-50.8	-172.7	-177.4	-106.7	0	0	0	112.7	A501 I504 T505 Y539 N546 Q547 V548 L601 L605 F612	A501-F544 HydrophobicContact CB-CD2 4.05Å; A501-F544 HydrophobicContact CB-CE2 4.37Å; I504-F544 HydrophobicContact CG2-CD1 4.21Å; I504-F544 HydrophobicContact CG2-CD2 3.72Å; I504-F544 HydrophobicContact CG2-CE1 4.02Å; I504-F544 HydrophobicContact CG2-CE2 3.51Å; I504-F544 HydrophobicContact CG2-CG 4.07Å; I504-F544 HydrophobicContact CG2-CZ 3.67Å; T505-F544 HydrophobicContact CG2-CZ 4.29Å; Y539-F544 HydrophobicContact CD1-CB 4.43Å; Y539-F544 HydrophobicContact CE1-CB 4.02Å; Y539-F544 PolarHBondContact O-N 2.99Å; F544-N546 VanDerWaalsContact C-N 3.34Å; F544-N546 PolarHBondContact O-N 3.43Å; F544-Q547 PolarHBondContact O-N 3.42Å; F544-V548 HydrophobicContact CD1-CG2 4.33Å; F544-V548 HydrophobicContact CD2-CG2 4.48Å; F544-V548 HydrophobicContact CE1-CG2 3.96Å; F544-V548 HydrophobicContact CE2-CG2 4.1Å; F544-V548 HydrophobicContact CZ-CG2 3.83Å; F544-V548 WeakPolarHBondContact O-CG2 3.32Å; F544-V548 PolarHBondContact O-N 3.46Å; F544-L601 HydrophobicContact CZ-CD2 4.23Å; F544-L605 HydrophobicContact CD1-CD2 4.16Å; F544-L605 HydrophobicContact CE1-CD2 4.09Å; F544-F612 HydrophobicContact CE1-CZ 4.38Å
545	L	87.3	Confident	87.2	Confident	6 Å²	6	45 Å²	45	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-67.3	-35	-179.1	-69.5	176.6	0	0	0	112.1	I540 V548 R549 Y608 Q611 F612 M615	I540-L545 HydrophobicContact CG2-CD1 4.09Å; I540-L545 HydrophobicContact CG2-CG 4.19Å; I540-L545 WeakPolarHBondContact O-CB 3.3Å; I540-L545 VanDerWaalsContact O-CG 3.3Å; I540-L545 WeakPolarHBondContact O-CG 3.4Å; I540-L545 PolarHBondContact O-N 2.84Å; L545-V548 PolarHBondContact O-N 3.41Å; L545-R549 VanDerWaalsContact O-CB 3.29Å; L545-R549 WeakPolarHBondContact O-CB 3.27Å; L545-R549 PolarHBondContact O-N 3.45Å; L545-Y608 HydrophobicContact CD1-CD1 4.44Å; L545-Q611 HydrophobicContact CD1-CB 4.2Å; L545-F612 HydrophobicContact CD2-CD1 4.12Å; L545-F612 HydrophobicContact CD2-CE1 3.48Å; L545-F612 VanDerWaalsContact CD2-CE1 3.48Å; L545-F612 HydrophobicContact CD2-CE2 4.01Å; L545-F612 HydrophobicContact CD2-CZ 3.42Å; L545-F612 VanDerWaalsContact CD2-CZ 3.42Å; L545-M615 HydrophobicContact CD2-SD 4.37Å
546	N	86.9	Confident	87	Confident	63 Å²	63	44.4 Å²	44.4	34%	0.337	22%	0.217	S	C	.	.	H	α-helix	trans	-66.3	-39.4	172.3	-77	-31.7	0	0	0	112.5	D542 L543 F544 R549 T550	D542-N546 PolarHBondContact O-ND2 2.92Å; L543-N546 PolarHBondContact O-N 3.14Å; F544-N546 VanDerWaalsContact C-N 3.34Å; F544-N546 PolarHBondContact O-N 3.43Å; N546-R549 PolarHBondContact O-N 3.25Å; N546-T550 WeakPolarHBondContact O-CB 3.32Å; N546-T550 PolarHBondContact O-N 3.37Å; N546-T550 PolarHBondContact O-OG1 3.49Å
547	Q	87.9	Confident	86.9	Confident	41 Å²	41	48.1 Å²	48.1	19%	0.192	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-49	173.1	-179.8	176.2	-15.1	0	0	111.2	A501 L543 F544 R549 T550 E551	A501-Q547 VanDerWaalsContact CB-OE1 3.28Å; L543-Q547 WeakPolarHBondContact O-CB 3.18Å; L543-Q547 PolarHBondContact O-N 2.98Å; F544-Q547 PolarHBondContact O-N 3.42Å; Q547-R549 VanDerWaalsContact C-N 3.33Å; Q547-R549 PolarHBondContact O-N 3.09Å; Q547-T550 PolarHBondContact O-N 2.92Å; Q547-T550 VanDerWaalsContact O-N 3.08Å; Q547-E551 HydrophobicContact CG-CG 4.41Å; Q547-E551 WeakPolarHBondContact CG-OE1 3.46Å; Q547-E551 PolarHBondContact NE2-OE1 3.45Å; Q547-E551 PolarHBondContact O-N 2.89Å
548	V	89.1	Confident	87	Confident	6 Å²	6	49.1 Å²	49.1	4%	0.036	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-42.1	177	172.5	0	0	0	0	111.3	F544 L545 T550 E551 I552 L598 L601 M615	F544-V548 HydrophobicContact CD1-CG2 4.33Å; F544-V548 HydrophobicContact CD2-CG2 4.48Å; F544-V548 HydrophobicContact CE1-CG2 3.96Å; F544-V548 HydrophobicContact CE2-CG2 4.1Å; F544-V548 HydrophobicContact CZ-CG2 3.83Å; F544-V548 WeakPolarHBondContact O-CG2 3.32Å; F544-V548 PolarHBondContact O-N 3.46Å; L545-V548 PolarHBondContact O-N 3.41Å; V548-T550 VanDerWaalsContact C-N 3.3Å; V548-T550 PolarHBondContact O-N 3.31Å; V548-E551 PolarHBondContact O-N 3.24Å; V548-I552 HydrophobicContact CG1-CD1 3.78Å; V548-I552 WeakPolarHBondContact O-CG1 3.24Å; V548-I552 PolarHBondContact O-N 3Å; V548-I552 VanDerWaalsContact O-N 3.09Å; V548-L598 HydrophobicContact CG1-CD2 3.8Å; V548-L601 HydrophobicContact CG1-CD1 3.92Å; V548-L601 HydrophobicContact CG2-CD1 4.1Å; V548-M615 HydrophobicContact CB-CE 4.39Å; V548-M615 HydrophobicContact CG1-CE 3.96Å
549	R	87	Confident	86.7	Confident	80 Å²	80	46 Å²	46	30%	0.302	24%	0.238	S	C	.	.	H	α-helix	trans	-59.2	-42.6	174.4	-168.6	177.7	-80	-103.4	4.3	110.8	L545 N546 Q547 N553 M615 D618	L545-R549 VanDerWaalsContact O-CB 3.29Å; L545-R549 WeakPolarHBondContact O-CB 3.27Å; L545-R549 PolarHBondContact O-N 3.45Å; N546-R549 PolarHBondContact O-N 3.25Å; Q547-R549 VanDerWaalsContact C-N 3.33Å; Q547-R549 PolarHBondContact O-N 3.09Å; R549-N553 VanDerWaalsContact O-CB 3.29Å; R549-N553 WeakPolarHBondContact O-CB 3.49Å; R549-N553 PolarHBondContact O-N 2.85Å; R549-N553 PolarHBondContact O-ND2 2.96Å; R549-N553 PolarHBondContact O-OD1 3.33Å; R549-N553 VanDerWaalsContact O-OD1 3.13Å; R549-M615 HydrophobicContact CB-CE 3.6Å; R549-M615 HydrophobicContact CG-CE 4.2Å; R549-D618 IonicContact CZ-OD2 3.49Å; R549-D618 IonicContact NH1-OD2 2.69Å; R549-D618 PolarHBondContact NH1-OD2 3.37Å; R549-D618 IonicContact NH2-OD2 2.98Å; R549-D618 PolarHBondContact NH2-OD2 3.28Å
550	T	88	Confident	86.2	Confident	82 Å²	82	46.9 Å²	46.9	50%	0.503	24%	0.244	S	C	.	.	H	α-helix	trans	-72.5	-41.5	-178.9	-54.4	0	0	0	0	112.8	N546 Q547 V548 K554	N546-T550 WeakPolarHBondContact O-CB 3.32Å; N546-T550 PolarHBondContact O-N 3.37Å; N546-T550 PolarHBondContact O-OG1 3.49Å; Q547-T550 PolarHBondContact O-N 2.92Å; Q547-T550 VanDerWaalsContact O-N 3.08Å; V548-T550 VanDerWaalsContact C-N 3.3Å; V548-T550 PolarHBondContact O-N 3.31Å; T550-K554 WeakPolarHBondContact O-CB 3.39Å; T550-K554 PolarHBondContact O-N 3.32Å
551	E	88.3	Confident	86	Confident	63 Å²	63	53.9 Å²	53.9	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-51.4	174.2	-76.6	179.2	-161.7	0	0	110.6	R502 Q547 V548 K554 E555	R502-E551 IonicContact CZ-OE2 2.74Å; R502-E551 IonicContact NE-OE2 3.9Å; R502-E551 IonicContact NH2-OE2 2.65Å; R502-E551 PolarHBondContact NH2-OE2 3.45Å; Q547-E551 HydrophobicContact CG-CG 4.41Å; Q547-E551 WeakPolarHBondContact CG-OE1 3.46Å; Q547-E551 PolarHBondContact NE2-OE1 3.45Å; Q547-E551 PolarHBondContact O-N 2.89Å; V548-E551 PolarHBondContact O-N 3.24Å; E551-K554 WeakPolarHBondContact O-CB 3.48Å; E551-K554 PolarHBondContact O-N 3.01Å; E551-E555 PolarHBondContact O-N 3.35Å
552	I	87.8	Confident	85.7	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-69.8	-39.6	-177.5	-67	169.2	0	0	0	112	V548 K554 E555 I556 L598 K619	V548-I552 HydrophobicContact CG1-CD1 3.78Å; V548-I552 WeakPolarHBondContact O-CG1 3.24Å; V548-I552 PolarHBondContact O-N 3Å; V548-I552 VanDerWaalsContact O-N 3.09Å; I552-K554 PolarHBondContact O-N 3.12Å; I552-E555 PolarHBondContact O-N 2.87Å; I552-I556 HydrophobicContact CG2-CD1 3.69Å; I552-I556 HydrophobicContact CG2-CG1 4.3Å; I552-I556 WeakPolarHBondContact O-CG1 3.35Å; I552-I556 PolarHBondContact O-N 2.76Å; I552-L598 HydrophobicContact CD1-CD1 3.77Å; I552-L598 HydrophobicContact CD1-CD2 3.51Å; I552-L598 HydrophobicContact CD1-CG 3.43Å; I552-L598 VanDerWaalsContact CD1-CG 3.43Å; I552-K619 HydrophobicContact CG2-CD 4.05Å; I552-K619 HydrophobicContact CG2-CG 4.01Å
553	N	87.7	Confident	85.1	Confident	47 Å²	47	53.7 Å²	53.7	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-55.3	-45.5	172.2	-73.3	-4.1	0	0	0	110.4	R549 E555 I556 E557 K619	R549-N553 VanDerWaalsContact O-CB 3.29Å; R549-N553 WeakPolarHBondContact O-CB 3.49Å; R549-N553 PolarHBondContact O-N 2.85Å; R549-N553 PolarHBondContact O-ND2 2.96Å; R549-N553 PolarHBondContact O-OD1 3.33Å; R549-N553 VanDerWaalsContact O-OD1 3.13Å; N553-E555 PolarHBondContact O-N 3.06Å; N553-I556 PolarHBondContact O-N 2.82Å; N553-E557 VanDerWaalsContact O-CB 3.27Å; N553-E557 WeakPolarHBondContact O-CB 3.4Å; N553-E557 VanDerWaalsContact O-CG 3.28Å; N553-E557 WeakPolarHBondContact O-CG 3.37Å; N553-E557 PolarHBondContact O-N 3.45Å; N553-K619 WeakPolarHBondContact OD1-CE 3.4Å; N553-K619 PolarHBondContact OD1-NZ 3.47Å
554	K	88.9	Confident	84.5	Confident	161 Å²	161	58.2 Å²	58.2	70%	0.7	32%	0.315	S	S	*	.	H	α-helix	trans	-65.2	-38.3	-179.9	-171.1	178.3	-179.1	179.5	0	112.6	T550 E551 I552 A558	T550-K554 WeakPolarHBondContact O-CB 3.39Å; T550-K554 PolarHBondContact O-N 3.32Å; E551-K554 WeakPolarHBondContact O-CB 3.48Å; E551-K554 PolarHBondContact O-N 3.01Å; I552-K554 PolarHBondContact O-N 3.12Å; K554-A558 VanDerWaalsContact O-CB 3.26Å; K554-A558 WeakPolarHBondContact O-CB 3.43Å; K554-A558 PolarHBondContact O-N 3.01Å; K554-A558 VanDerWaalsContact O-N 3.09Å
555	E	86.8	Confident	83.9	Confident	81 Å²	81	59.6 Å²	59.6	38%	0.379	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-47.2	174.2	-71.2	-175.3	164.3	0	0	112.1	E551 I552 N553 A558 V590 S594	E551-E555 PolarHBondContact O-N 3.35Å; I552-E555 PolarHBondContact O-N 2.87Å; N553-E555 PolarHBondContact O-N 3.06Å; E555-A558 PolarHBondContact O-N 3Å; E555-V590 HydrophobicContact CB-CG1 4.37Å; E555-S594 PolarHBondContact OE2-OG 2.94Å
556	I	84.6	Confident	83.5	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-68.8	-43.9	-179.4	-65.7	172.9	0	0	0	110.9	I552 N553 A558 V559 S560 V591 K619	I552-I556 HydrophobicContact CG2-CD1 3.69Å; I552-I556 HydrophobicContact CG2-CG1 4.3Å; I552-I556 WeakPolarHBondContact O-CG1 3.35Å; I552-I556 PolarHBondContact O-N 2.76Å; N553-I556 PolarHBondContact O-N 2.82Å; I556-A558 VanDerWaalsContact C-N 3.32Å; I556-A558 PolarHBondContact O-N 3.41Å; I556-V559 PolarHBondContact O-N 3.25Å; I556-S560 VanDerWaalsContact O-CB 3.24Å; I556-S560 WeakPolarHBondContact O-CB 3.33Å; I556-S560 PolarHBondContact O-N 2.69Å; I556-S560 PolarHBondContact O-OG 3.08Å; I556-V591 HydrophobicContact CD1-CG2 4.2Å; I556-V591 HydrophobicContact CG1-CG2 4.04Å; I556-V591 HydrophobicContact CG2-CG2 4.3Å; I556-K619 HydrophobicContact CD1-CB 4.05Å; I556-K619 HydrophobicContact CD1-CD 3.78Å; I556-K619 HydrophobicContact CD1-CG 3.99Å
557	E	85.6	Confident	83.2	Confident	81 Å²	81	60.8 Å²	60.8	38%	0.379	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-39.5	176.4	-77.5	-161.2	155.1	0	0	112.3	N553 V559 S560 K561	N553-E557 VanDerWaalsContact O-CB 3.27Å; N553-E557 WeakPolarHBondContact O-CB 3.4Å; N553-E557 VanDerWaalsContact O-CG 3.28Å; N553-E557 WeakPolarHBondContact O-CG 3.37Å; N553-E557 PolarHBondContact O-N 3.45Å; E557-V559 PolarHBondContact O-N 3.32Å; E557-S560 PolarHBondContact O-N 2.78Å; E557-K561 HydrophobicContact CB-CD 4.27Å; E557-K561 VanDerWaalsContact CD-CE 3.46Å; E557-K561 WeakPolarHBondContact O-CB 2.99Å; E557-K561 WeakPolarHBondContact O-CG 3.45Å; E557-K561 PolarHBondContact O-N 3.17Å; E557-K561 WeakPolarHBondContact OE1-CE 3.42Å; E557-K561 IonicContact OE1-NZ 3.69Å; E557-K561 PolarHBondContact OE1-NZ 3.12Å; E557-K561 IonicContact OE2-NZ 3.74Å; E557-K561 PolarHBondContact OE2-NZ 3.42Å
558	A	86.4	Confident	83.2	Confident	75 Å²	75	62 Å²	62	62%	0.62	33%	0.334	S	S	*	.	H	α-helix	trans	-60.9	-30.5	-178.7	0	0	0	0	0	113.2	K554 E555 I556	K554-A558 VanDerWaalsContact O-CB 3.26Å; K554-A558 WeakPolarHBondContact O-CB 3.43Å; K554-A558 PolarHBondContact O-N 3.01Å; K554-A558 VanDerWaalsContact O-N 3.09Å; E555-A558 PolarHBondContact O-N 3Å; I556-A558 VanDerWaalsContact C-N 3.32Å; I556-A558 PolarHBondContact O-N 3.41Å
559	V	82.1	Confident	83.3	Confident	24 Å²	24	65 Å²	65	15%	0.145	35%	0.349	C	S	.	.	H	α-helix	trans	-94.1	-30.7	176.2	-163.7	0	0	0	0	111.9	I556 E557 A562 Q586 V590	I556-V559 PolarHBondContact O-N 3.25Å; E557-V559 PolarHBondContact O-N 3.32Å; V559-A562 WeakPolarHBondContact O-CB 3.38Å; V559-Q586 HydrophobicContact CG1-CB 4.37Å; V559-Q586 HydrophobicContact CG1-CG 4.13Å; V559-V590 HydrophobicContact CG2-CB 4.34Å; V559-V590 HydrophobicContact CG2-CG1 4.34Å; V559-V590 HydrophobicContact CG2-CG2 4.07Å
560	S	77.9	Confident	83.4	Confident	21 Å²	21	61.4 Å²	61.4	15%	0.147	34%	0.337	C	S	.	.	H	α-helix	trans	-80.2	-27.4	-176.5	-53.7	0	0	0	0	113.7	I556 E557 P565	I556-S560 VanDerWaalsContact O-CB 3.24Å; I556-S560 WeakPolarHBondContact O-CB 3.33Å; I556-S560 PolarHBondContact O-N 2.69Å; I556-S560 PolarHBondContact O-OG 3.08Å; E557-S560 PolarHBondContact O-N 2.78Å; S560-P565 WeakPolarHBondContact O-CG 3.48Å
561	K	81.7	Confident	83.4	Confident	147 Å²	147	60.4 Å²	60.4	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	7.7	175.5	-62.3	178.4	-178.5	171.8	0	113.3	E557	E557-K561 HydrophobicContact CB-CD 4.27Å; E557-K561 VanDerWaalsContact CD-CE 3.46Å; E557-K561 WeakPolarHBondContact O-CB 2.99Å; E557-K561 WeakPolarHBondContact O-CG 3.45Å; E557-K561 PolarHBondContact O-N 3.17Å; E557-K561 WeakPolarHBondContact OE1-CE 3.42Å; E557-K561 IonicContact OE1-NZ 3.69Å; E557-K561 PolarHBondContact OE1-NZ 3.12Å; E557-K561 IonicContact OE2-NZ 3.74Å; E557-K561 PolarHBondContact OE2-NZ 3.42Å
562	A	78.6	Confident	83.3	Confident	32 Å²	32	60.2 Å²	60.2	26%	0.264	34%	0.342	S	S	.	.	S	Bend	trans	-66.3	156.7	173.3	0	0	0	0	0	111.1	V559 D564 P565 I568	V559-A562 WeakPolarHBondContact O-CB 3.38Å; A562-D564 PolarHBondContact O-N 3.21Å; A562-P565 WeakPolarHBondContact O-CD 3.42Å; A562-P565 WeakPolarHBondContact O-CG 3.47Å; A562-I568 HydrophobicContact CB-CD1 3.61Å
563	A	69.3	Low	83.3	Confident	90 Å²	90	64.8 Å²	64.8	74%	0.744	37%	0.367	S	S	*	.	S	Bend	trans	-67	132.5	168.4	0	0	0	0	0	109.5
564	D	74.8	Confident	83.3	Confident	104 Å²	104	64.5 Å²	64.5	56%	0.556	37%	0.367	S	S	*	.	S	Bend	trans	43.4	67.1	-175.4	-59.3	-15	0	0	0	115.2	A562 L566 K567	A562-D564 PolarHBondContact O-N 3.21Å; D564-L566 PolarHBondContact O-N 3.45Å; D564-K567 HydrophobicContact CB-CB 4.11Å; D564-K567 HydrophobicContact CB-CD 4.03Å; D564-K567 HydrophobicContact CB-CG 4.09Å; D564-K567 PolarHBondContact O-N 2.89Å
565	P	75.3	Confident	83.2	Confident	31 Å²	31	58.9 Å²	58.9	20%	0.201	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-56.8	-26	-176	-25.4	34.9	0	0	0	114.9	S560 A562 K567	S560-P565 WeakPolarHBondContact O-CG 3.48Å; A562-P565 WeakPolarHBondContact O-CD 3.42Å; A562-P565 WeakPolarHBondContact O-CG 3.47Å; P565-K567 VanDerWaalsContact C-N 3.29Å; P565-K567 PolarHBondContact O-N 3.06Å
566	L	78.1	Confident	83.3	Confident	17 Å²	17	62.1 Å²	62.1	9%	0.089	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-77.6	-9.7	177	-58.2	-172.6	0	0	0	114.2	D564 L585 A630 I634 A717 L721	D564-L566 PolarHBondContact O-N 3.45Å; L566-L585 HydrophobicContact CD2-CD1 3.65Å; L566-L585 WeakPolarHBondContact O-CD2 3.34Å; L566-A630 HydrophobicContact CD1-CB 3.57Å; L566-A630 HydrophobicContact CD2-CB 3.9Å; L566-A630 HydrophobicContact CG-CB 3.73Å; L566-I634 HydrophobicContact CD1-CD1 3.69Å; L566-A717 HydrophobicContact CB-CB 3.94Å; L566-L721 HydrophobicContact CD1-CD2 4.28Å; L566-L721 HydrophobicContact CD2-CD1 3.99Å; L566-L721 HydrophobicContact CD2-CD2 4.46Å
567	K	82.3	Confident	83.5	Confident	77 Å²	77	69.3 Å²	69.3	34%	0.335	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-101.1	-6.7	178.8	-59.5	-174.4	-177.7	-175.8	0	112.1	D564 P565 S713 D714 A717	D564-K567 HydrophobicContact CB-CB 4.11Å; D564-K567 HydrophobicContact CB-CD 4.03Å; D564-K567 HydrophobicContact CB-CG 4.09Å; D564-K567 PolarHBondContact O-N 2.89Å; P565-K567 VanDerWaalsContact C-N 3.29Å; P565-K567 PolarHBondContact O-N 3.06Å; K567-S713 WeakPolarHBondContact CE-OG 3.49Å; K567-S713 PolarHBondContact NZ-OG 3.22Å; K567-D714 WeakPolarHBondContact CE-OD1 3.42Å; K567-D714 IonicContact NZ-OD1 3.88Å; K567-D714 PolarHBondContact NZ-OD1 3.47Å; K567-A717 HydrophobicContact CG-CB 4.37Å
568	I	87.1	Confident	83.6	Confident	66 Å²	66	67 Å²	67	34%	0.338	38%	0.384	S	S	.	.			trans	-92.6	109.3	178	-53.6	178.8	0	0	0	110.6	A562 Q586	A562-I568 HydrophobicContact CB-CD1 3.61Å; I568-Q586 HydrophobicContact CG2-CB 3.87Å; I568-Q586 HydrophobicContact CG2-CG 4.43Å; I568-Q586 PolarHBondContact O-N 2.85Å
569	L	90.1	Very high	83.6	Confident	69 Å²	69	66.5 Å²	66.5	36%	0.361	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-96.3	152.2	-177.6	-60.1	179	0	0	0	112.9	P583 L584 L585 N720	L569-P583 HydrophobicContact CD1-CB 3.78Å; L569-P583 HydrophobicContact CD2-CB 4.04Å; L569-P583 HydrophobicContact CG-CB 4.39Å; L569-L584 WeakPolarHBondContact CA-O 3.39Å; L569-L585 HydrophobicContact CD2-CD2 4.2Å; L569-N720 HydrophobicContact CD2-CB 4.18Å
570	A	89.7	Confident	83.8	Confident	6 Å²	6	67 Å²	67	5%	0.05	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-64.2	147.9	173.9	0	0	0	0	0	112	M575 L584 V589	A570-M575 HydrophobicContact CB-CG 4.31Å; A570-L584 PolarHBondContact N-O 3.4Å; A570-V589 HydrophobicContact CB-CG2 4.05Å
571	S	89	Confident	84.1	Confident	61 Å²	61	74.2 Å²	74.2	43%	0.427	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-67.3	151.2	-178.7	73.2	0	0	0	0	112.3	D573 T574 M575	S571-D573 PolarHBondContact O-N 2.83Å; S571-D573 VanDerWaalsContact O-N 3.15Å; S571-T574 WeakPolarHBondContact O-CA 3.44Å; S571-T574 WeakPolarHBondContact O-CB 3.32Å; S571-T574 PolarHBondContact O-N 2.88Å; S571-T574 PolarHBondContact OG-N 2.83Å; S571-T574 PolarHBondContact OG-OG1 3.34Å; S571-M575 PolarHBondContact O-N 2.96Å
572	A	86.5	Confident	84.5	Confident	58 Å²	58	70.1 Å²	70.1	48%	0.479	40%	0.402	S	S	.	.	H	α-helix	trans	-56.2	-34.2	-178.3	0	0	0	0	0	113.5	M575 K576	A572-M575 HydrophobicContact CB-CE 4.45Å; A572-K576 WeakPolarHBondContact O-CG 3.27Å; A572-K576 PolarHBondContact O-N 3.34Å; A572-K576 VanDerWaalsContact O-N 3.14Å
573	D	86.6	Confident	85	Confident	109 Å²	109	69.5 Å²	69.5	58%	0.583	40%	0.395	S	S	*	.	H	α-helix	trans	-75.4	-31.5	177.9	-58.4	-40	0	0	0	112.3	S571 K576 L577	S571-D573 PolarHBondContact O-N 2.83Å; S571-D573 VanDerWaalsContact O-N 3.15Å; D573-K576 PolarHBondContact O-N 3.4Å; D573-K576 IonicContact OD1-NZ 2.72Å; D573-K576 PolarHBondContact OD1-NZ 3.14Å; D573-L577 WeakPolarHBondContact O-CB 3.27Å; D573-L577 PolarHBondContact O-N 3.26Å
574	T	87.8	Confident	86.2	Confident	41 Å²	41	65.3 Å²	65.3	25%	0.252	36%	0.36	S	S	.	.	H	α-helix	trans	-66.6	-43	172.2	-51.8	0	0	0	0	110.8	S571 K576 L577 L578 V589	S571-T574 WeakPolarHBondContact O-CA 3.44Å; S571-T574 WeakPolarHBondContact O-CB 3.32Å; S571-T574 PolarHBondContact O-N 2.88Å; S571-T574 PolarHBondContact OG-N 2.83Å; S571-T574 PolarHBondContact OG-OG1 3.34Å; T574-K576 PolarHBondContact O-N 3.31Å; T574-L577 PolarHBondContact O-N 3.31Å; T574-L578 HydrophobicContact CG2-CD1 4.07Å; T574-L578 WeakPolarHBondContact O-CG 3.38Å; T574-L578 PolarHBondContact O-N 3.37Å; T574-V589 HydrophobicContact CG2-CG1 3.83Å
575	M	87.3	Confident	87.1	Confident	44 Å²	44	60.4 Å²	60.4	22%	0.217	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-40.3	176.6	-65.8	-171.2	-72.9	0	0	112.6	A570 S571 A572 L578 G579 V580	A570-M575 HydrophobicContact CB-CG 4.31Å; S571-M575 PolarHBondContact O-N 2.96Å; A572-M575 HydrophobicContact CB-CE 4.45Å; M575-L578 PolarHBondContact O-N 3.28Å; M575-G579 PolarHBondContact O-N 3.1Å; M575-G579 VanDerWaalsContact O-N 3.12Å; M575-V580 PolarHBondContact O-N 3.1Å; M575-V580 VanDerWaalsContact O-N 3.08Å
576	K	88.8	Confident	87.8	Confident	148 Å²	148	61.6 Å²	61.6	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-61.1	-45.6	172.4	-70.4	169.9	-162	157.2	0	112.1	A572 D573 T574 L578 G579	A572-K576 WeakPolarHBondContact O-CG 3.27Å; A572-K576 PolarHBondContact O-N 3.34Å; A572-K576 VanDerWaalsContact O-N 3.14Å; D573-K576 PolarHBondContact O-N 3.4Å; D573-K576 IonicContact OD1-NZ 2.72Å; D573-K576 PolarHBondContact OD1-NZ 3.14Å; T574-K576 PolarHBondContact O-N 3.31Å; K576-L578 VanDerWaalsContact C-N 3.29Å; K576-L578 PolarHBondContact O-N 3.18Å; K576-G579 PolarHBondContact O-N 3.14Å
577	L	88.8	Confident	88.5	Confident	154 Å²	154	61 Å²	61	81%	0.806	33%	0.334	S	S	*	.	H	α-helix	trans	-61.4	-38.5	179.2	-174	71.7	0	0	0	111.9	D573 T574 G579	D573-L577 WeakPolarHBondContact O-CB 3.27Å; D573-L577 PolarHBondContact O-N 3.26Å; T574-L577 PolarHBondContact O-N 3.31Å; L577-G579 VanDerWaalsContact C-N 3.31Å
578	L	87.1	Confident	89	Confident	32 Å²	32	57.3 Å²	57.3	17%	0.168	32%	0.318	C	S	.	.	H	α-helix	trans	-80.1	-8.9	178.8	-65.1	174.2	0	0	0	113.9	T574 M575 K576 V580 L584 V589 W727	T574-L578 HydrophobicContact CG2-CD1 4.07Å; T574-L578 WeakPolarHBondContact O-CG 3.38Å; T574-L578 PolarHBondContact O-N 3.37Å; M575-L578 PolarHBondContact O-N 3.28Å; K576-L578 VanDerWaalsContact C-N 3.29Å; K576-L578 PolarHBondContact O-N 3.18Å; L578-V580 HydrophobicContact CB-CG2 3.87Å; L578-L584 HydrophobicContact CD1-CD1 4.45Å; L578-V589 HydrophobicContact CD1-CG1 3.98Å; L578-V589 HydrophobicContact CD1-CG2 4.06Å; L578-W727 HydrophobicContact CD1-CH2 4.2Å; L578-W727 HydrophobicContact CD1-CZ2 3.89Å; L578-W727 HydrophobicContact CD2-CZ2 4.19Å; L578-W727 HydrophobicContact CG-CZ2 4.48Å
579	G	85.9	Confident	89.3	Confident	65 Å²	65	54.8 Å²	54.8	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	22.3	-178.8	0	0	0	0	0	114.7	M575 K576 L577	M575-G579 PolarHBondContact O-N 3.1Å; M575-G579 VanDerWaalsContact O-N 3.12Å; K576-G579 PolarHBondContact O-N 3.14Å; L577-G579 VanDerWaalsContact C-N 3.31Å
580	V	88.1	Confident	89.4	Confident	36 Å²	36	52.8 Å²	52.8	22%	0.218	30%	0.296	C	S	.	.			trans	-101	134.9	-170.6	-172.1	0	0	0	0	111.1	M575 L578 R582 L584	M575-V580 PolarHBondContact O-N 3.1Å; M575-V580 VanDerWaalsContact O-N 3.08Å; L578-V580 HydrophobicContact CB-CG2 3.87Å; V580-R582 WeakPolarHBondContact CG1-O 3.11Å; V580-L584 HydrophobicContact CB-CD1 4.37Å; V580-L584 HydrophobicContact CG1-CD1 4.13Å; V580-L584 HydrophobicContact CG1-CD2 4.3Å; V580-L584 HydrophobicContact CG1-CG 4.14Å; V580-L584 HydrophobicContact CG2-CD1 4.08Å
581	Q	83.9	Confident	89.5	Confident	172 Å²	172	52.5 Å²	52.5	80%	0.804	29%	0.294	S	S	*	.	S	Bend	trans	-93.8	0.3	-176	-62.2	-168.2	3.9	0	0	114.9
582	R	88.9	Confident	89.8	Confident	60 Å²	60	50.2 Å²	50.2	23%	0.226	28%	0.276	C	S	.	.	S	Bend	trans	-135.6	151.5	-176.2	-74	-56.9	-177.9	-92.3	5.9	111.4	V580 L584 E723 A840 L841 Q842	V580-R582 WeakPolarHBondContact CG1-O 3.11Å; R582-L584 PolarHBondContact O-N 3.49Å; R582-E723 HydrophobicContact CB-CG 4.49Å; R582-A840 WeakPolarHBondContact CD-O 3.47Å; R582-L841 PolarHBondContact NE-O 2.99Å; R582-Q842 HydrophobicContact CG-CG 3.88Å
583	P	89.8	Confident	90	Very high	20 Å²	20	53 Å²	53	13%	0.13	28%	0.278	C	S	.	.			trans	-62.9	130	-177.2	25.7	-34.5	0	0	0	111.7	L569	L569-P583 HydrophobicContact CD1-CB 3.78Å; L569-P583 HydrophobicContact CD2-CB 4.04Å; L569-P583 HydrophobicContact CG-CB 4.39Å
584	L	93.4	Very high	90.2	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.251	C	S	.	.			trans	-106.8	150.3	171.5	-59.9	178.8	0	0	0	110	L569 A570 L578 V580 R582 V589 S724 W727	L569-L584 WeakPolarHBondContact CA-O 3.39Å; A570-L584 PolarHBondContact N-O 3.4Å; L578-L584 HydrophobicContact CD1-CD1 4.45Å; V580-L584 HydrophobicContact CB-CD1 4.37Å; V580-L584 HydrophobicContact CG1-CD1 4.13Å; V580-L584 HydrophobicContact CG1-CD2 4.3Å; V580-L584 HydrophobicContact CG1-CG 4.14Å; V580-L584 HydrophobicContact CG2-CD1 4.08Å; R582-L584 PolarHBondContact O-N 3.49Å; L584-V589 HydrophobicContact CB-CG2 4.08Å; L584-V589 HydrophobicContact CD1-CG2 4.19Å; L584-S724 WeakPolarHBondContact CA-OG 3.24Å; L584-W727 HydrophobicContact CD1-CD2 3.6Å; L584-W727 HydrophobicContact CD1-CE3 3.97Å; L584-W727 HydrophobicContact CD1-CG 3.9Å; L584-W727 HydrophobicContact CD1-CZ2 4.19Å; L584-W727 HydrophobicContact CD1-CZ3 4.41Å; L584-W727 HydrophobicContact CD2-CB 3.92Å; L584-W727 HydrophobicContact CD2-CD2 4.4Å; L584-W727 HydrophobicContact CD2-CG 4.04Å
585	L	93.7	Very high	90.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-66.3	135.9	171.8	-61.8	176.7	0	0	0	110.4	L566 L569 S587 T588 V589 N720 L721 S724	L566-L585 HydrophobicContact CD2-CD1 3.65Å; L566-L585 WeakPolarHBondContact O-CD2 3.34Å; L569-L585 HydrophobicContact CD2-CD2 4.2Å; L585-S587 PolarHBondContact O-N 2.87Å; L585-T588 PolarHBondContact O-N 3.35Å; L585-T588 VanDerWaalsContact O-N 3.15Å; L585-V589 PolarHBondContact O-N 3.1Å; L585-N720 HydrophobicContact CD2-CB 3.92Å; L585-N720 HydrophobicContact CG-CB 4.46Å; L585-L721 HydrophobicContact CD1-CB 4.38Å; L585-L721 HydrophobicContact CD1-CD1 3.9Å; L585-S724 WeakPolarHBondContact CG-OG 3.4Å; L585-S724 PolarHBondContact N-OG 3.19Å
586	Q	91.9	Very high	90.6	Very high	56 Å²	56	47.4 Å²	47.4	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-32.2	177.4	-180	60.7	36.3	0	0	111.8	V559 I568 V589 V590	V559-Q586 HydrophobicContact CG1-CB 4.37Å; V559-Q586 HydrophobicContact CG1-CG 4.13Å; I568-Q586 HydrophobicContact CG2-CB 3.87Å; I568-Q586 HydrophobicContact CG2-CG 4.43Å; I568-Q586 PolarHBondContact O-N 2.85Å; Q586-V589 PolarHBondContact O-N 3.27Å; Q586-V590 WeakPolarHBondContact O-CG2 3.47Å; Q586-V590 PolarHBondContact O-N 2.99Å; Q586-V590 VanDerWaalsContact O-N 3.1Å
587	S	91.6	Very high	90.6	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.028	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-41.9	176.5	61	0	0	0	0	112.2	L585 V590 V591 Y623	L585-S587 PolarHBondContact O-N 2.87Å; S587-V590 PolarHBondContact O-N 2.88Å; S587-V591 WeakPolarHBondContact O-CG2 3.36Å; S587-V591 PolarHBondContact O-N 2.93Å; S587-Y623 PolarHBondContact OG-OH 3.02Å
588	T	93.6	Very high	90.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-42.4	179.3	-47	0	0	0	0	111.6	L585 V591 E592 Y623 S724 M725 W727 L728	L585-T588 PolarHBondContact O-N 3.35Å; L585-T588 VanDerWaalsContact O-N 3.15Å; T588-V591 PolarHBondContact O-N 3.23Å; T588-E592 PolarHBondContact O-N 3.45Å; T588-Y623 VanDerWaalsContact CA-OH 3.29Å; T588-Y623 WeakPolarHBondContact CA-OH 3.34Å; T588-Y623 WeakPolarHBondContact CB-OH 3.48Å; T588-Y623 HydrophobicContact CG2-CE1 4.41Å; T588-Y623 PolarHBondContact N-OH 2.89Å; T588-Y623 VanDerWaalsContact N-OH 3.11Å; T588-Y623 PolarHBondContact OG1-OH 2.84Å; T588-S724 WeakPolarHBondContact CG2-O 3.44Å; T588-S724 WeakPolarHBondContact OG1-CB 3.43Å; T588-M725 HydrophobicContact CG2-CE 4.06Å; T588-M725 WeakPolarHBondContact OG1-CE 3.49Å; T588-W727 HydrophobicContact CG2-CE3 3.92Å; T588-W727 HydrophobicContact CG2-CZ3 4.03Å; T588-L728 HydrophobicContact CG2-CB 3.72Å; T588-L728 HydrophobicContact CG2-CD1 4.46Å; T588-L728 HydrophobicContact CG2-CD2 4.07Å; T588-L728 HydrophobicContact CG2-CG 4.29Å
589	V	93.2	Very high	90.6	Very high	13 Å²	13	34.8 Å²	34.8	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-67.2	-38.1	179.4	177.5	0	0	0	0	111.7	A570 T574 L578 L584 L585 Q586 K593 W727	A570-V589 HydrophobicContact CB-CG2 4.05Å; T574-V589 HydrophobicContact CG2-CG1 3.83Å; L578-V589 HydrophobicContact CD1-CG1 3.98Å; L578-V589 HydrophobicContact CD1-CG2 4.06Å; L584-V589 HydrophobicContact CB-CG2 4.08Å; L584-V589 HydrophobicContact CD1-CG2 4.19Å; L585-V589 PolarHBondContact O-N 3.1Å; Q586-V589 PolarHBondContact O-N 3.27Å; V589-K593 WeakPolarHBondContact O-CB 3.25Å; V589-K593 PolarHBondContact O-N 3.42Å; V589-W727 HydrophobicContact CG2-CH2 4.49Å; V589-W727 HydrophobicContact CG2-CZ3 4.48Å
590	V	91.7	Very high	90.7	Very high	27 Å²	27	33.9 Å²	33.9	16%	0.164	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-44.1	174.4	170.5	0	0	0	0	110.9	E555 V559 Q586 S587 K593 S594	E555-V590 HydrophobicContact CB-CG1 4.37Å; V559-V590 HydrophobicContact CG2-CB 4.34Å; V559-V590 HydrophobicContact CG2-CG1 4.34Å; V559-V590 HydrophobicContact CG2-CG2 4.07Å; Q586-V590 WeakPolarHBondContact O-CG2 3.47Å; Q586-V590 PolarHBondContact O-N 2.99Å; Q586-V590 VanDerWaalsContact O-N 3.1Å; S587-V590 PolarHBondContact O-N 2.88Å; V590-K593 PolarHBondContact O-N 3.24Å; V590-S594 PolarHBondContact O-N 3.49Å; V590-S594 PolarHBondContact O-OG 3.24Å; V590-S594 VanDerWaalsContact O-OG 3.09Å
591	V	92.9	Very high	90.7	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-43.7	177.1	169.7	0	0	0	0	112.1	I556 S587 T588 K593 S594 I595 L620 Y623	I556-V591 HydrophobicContact CD1-CG2 4.2Å; I556-V591 HydrophobicContact CG1-CG2 4.04Å; I556-V591 HydrophobicContact CG2-CG2 4.3Å; S587-V591 WeakPolarHBondContact O-CG2 3.36Å; S587-V591 PolarHBondContact O-N 2.93Å; T588-V591 PolarHBondContact O-N 3.23Å; V591-K593 VanDerWaalsContact C-N 3.34Å; V591-K593 PolarHBondContact O-N 2.96Å; V591-S594 PolarHBondContact O-N 3.4Å; V591-I595 HydrophobicContact CG1-CD1 3.8Å; V591-I595 WeakPolarHBondContact O-CD1 3.42Å; V591-I595 VanDerWaalsContact O-CG1 3.23Å; V591-I595 WeakPolarHBondContact O-CG1 3.43Å; V591-I595 PolarHBondContact O-N 3.31Å; V591-L620 HydrophobicContact CG1-CD2 4.36Å; V591-Y623 HydrophobicContact CB-CD1 4.28Å; V591-Y623 HydrophobicContact CB-CG 4.34Å; V591-Y623 HydrophobicContact CG1-CD1 3.94Å; V591-Y623 HydrophobicContact CG1-CG 4.1Å; V591-Y623 HydrophobicContact CG2-CD1 4.18Å; V591-Y623 HydrophobicContact CG2-CD2 3.72Å; V591-Y623 HydrophobicContact CG2-CE2 4.11Å; V591-Y623 HydrophobicContact CG2-CG 3.77Å
592	E	93.4	Very high	90.8	Very high	13 Å²	13	25.2 Å²	25.2	6%	0.061	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-42.3	175.8	-167.8	-102.6	-169.1	0	0	111.6	T588 I595 Q596 W727 L728 R731 F735	T588-E592 PolarHBondContact O-N 3.45Å; E592-I595 PolarHBondContact O-N 3.44Å; E592-Q596 WeakPolarHBondContact O-CB 3.43Å; E592-Q596 PolarHBondContact O-N 2.92Å; E592-W727 HydrophobicContact CB-CH2 3.69Å; E592-W727 HydrophobicContact CB-CZ3 3.7Å; E592-W727 HydrophobicContact CG-CH2 3.63Å; E592-W727 HydrophobicContact CG-CZ3 3.93Å; E592-L728 HydrophobicContact CB-CD1 4.01Å; E592-L728 HydrophobicContact CG-CD1 4.27Å; E592-R731 HydrophobicContact CG-CB 4.31Å; E592-R731 HydrophobicContact CG-CG 4.38Å; E592-R731 WeakPolarHBondContact OE1-CD 3.47Å; E592-R731 IonicContact OE1-CZ 2.61Å; E592-R731 IonicContact OE1-NE 2.96Å; E592-R731 IonicContact OE1-NH1 3.99Å; E592-R731 PolarHBondContact OE1-NH1 3.02Å; E592-F735 HydrophobicContact CG-CE2 4.5Å
593	K	91.8	Very high	90.5	Very high	117 Å²	117	27.3 Å²	27.3	51%	0.509	14%	0.138	S	C	.	.	H	α-helix	trans	-62.7	-49	174.7	-174.6	-173.6	172	-167.5	0	112.4	V589 V590 V591 I595 Q596 D597	V589-K593 WeakPolarHBondContact O-CB 3.25Å; V589-K593 PolarHBondContact O-N 3.42Å; V590-K593 PolarHBondContact O-N 3.24Å; V591-K593 VanDerWaalsContact C-N 3.34Å; V591-K593 PolarHBondContact O-N 2.96Å; K593-I595 PolarHBondContact O-N 3.16Å; K593-Q596 WeakPolarHBondContact O-CB 3.34Å; K593-Q596 PolarHBondContact O-N 2.91Å; K593-D597 PolarHBondContact O-N 2.78Å
594	S	91.6	Very high	90.2	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-31.1	179.8	-55.8	0	0	0	0	111.7	E555 V590 V591 L598	E555-S594 PolarHBondContact OE2-OG 2.94Å; V590-S594 PolarHBondContact O-N 3.49Å; V590-S594 PolarHBondContact O-OG 3.24Å; V590-S594 VanDerWaalsContact O-OG 3.09Å; V591-S594 PolarHBondContact O-N 3.4Å; S594-L598 WeakPolarHBondContact O-CG 3.44Å; S594-L598 PolarHBondContact O-N 3.12Å
595	I	91.3	Very high	89.8	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-70.3	-44.4	171.7	-67.5	165.1	0	0	0	111	V591 E592 K593 D597 L598 M599 V616 L620 L732	V591-I595 HydrophobicContact CG1-CD1 3.8Å; V591-I595 WeakPolarHBondContact O-CD1 3.42Å; V591-I595 VanDerWaalsContact O-CG1 3.23Å; V591-I595 WeakPolarHBondContact O-CG1 3.43Å; V591-I595 PolarHBondContact O-N 3.31Å; E592-I595 PolarHBondContact O-N 3.44Å; K593-I595 PolarHBondContact O-N 3.16Å; I595-D597 VanDerWaalsContact C-N 3.28Å; I595-D597 PolarHBondContact O-N 3.47Å; I595-L598 PolarHBondContact O-N 3.14Å; I595-M599 HydrophobicContact CG2-CG 4.23Å; I595-M599 WeakPolarHBondContact O-CB 3.4Å; I595-M599 WeakPolarHBondContact O-CG 3.34Å; I595-M599 PolarHBondContact O-N 3.48Å; I595-V616 HydrophobicContact CG1-CG1 4.27Å; I595-V616 HydrophobicContact CG2-CG1 3.97Å; I595-V616 HydrophobicContact CG2-CG2 4.32Å; I595-L620 HydrophobicContact CD1-CD1 4.23Å; I595-L620 HydrophobicContact CD1-CD2 3.3Å; I595-L620 HydrophobicContact CD1-CG 3.69Å; I595-L732 HydrophobicContact CD1-CD2 4.08Å; I595-L732 HydrophobicContact CG2-CD2 4.4Å
596	Q	90.4	Very high	89.1	Confident	72 Å²	72	32.2 Å²	32.2	34%	0.336	17%	0.168	S	C	.	.	H	α-helix	trans	-60.7	-38.6	175.5	-177.4	56.1	73.7	0	0	112	E592 K593 M599 S600 F735	E592-Q596 WeakPolarHBondContact O-CB 3.43Å; E592-Q596 PolarHBondContact O-N 2.92Å; K593-Q596 WeakPolarHBondContact O-CB 3.34Å; K593-Q596 PolarHBondContact O-N 2.91Å; Q596-M599 PolarHBondContact O-N 3.23Å; Q596-S600 PolarHBondContact O-N 3.4Å; Q596-F735 VanDerWaalsContact OE1-CZ 3.25Å
597	D	89.7	Confident	88.5	Confident	51 Å²	51	32.8 Å²	32.8	27%	0.273	18%	0.183	S	C	.	.	H	α-helix	trans	-65.8	-48	174.7	-73.3	-12.6	0	0	0	110.3	K593 I595 M599 S600 L601	K593-D597 PolarHBondContact O-N 2.78Å; I595-D597 VanDerWaalsContact C-N 3.28Å; I595-D597 PolarHBondContact O-N 3.47Å; D597-M599 VanDerWaalsContact C-N 3.3Å; D597-M599 PolarHBondContact O-N 3.33Å; D597-S600 PolarHBondContact O-N 2.86Å; D597-S600 VanDerWaalsContact O-N 3.13Å; D597-S600 PolarHBondContact O-OG 2.91Å; D597-L601 WeakPolarHBondContact O-CG 3.3Å; D597-L601 PolarHBondContact O-N 3.02Å
598	L	90.3	Very high	88.2	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-56	-41.5	172.4	-77.9	168.1	0	0	0	113	V548 I552 S594 I595 S600 L601 M602 F612 M615 V616	V548-L598 HydrophobicContact CG1-CD2 3.8Å; I552-L598 HydrophobicContact CD1-CD1 3.77Å; I552-L598 HydrophobicContact CD1-CD2 3.51Å; I552-L598 HydrophobicContact CD1-CG 3.43Å; I552-L598 VanDerWaalsContact CD1-CG 3.43Å; S594-L598 WeakPolarHBondContact O-CG 3.44Å; S594-L598 PolarHBondContact O-N 3.12Å; I595-L598 PolarHBondContact O-N 3.14Å; L598-S600 VanDerWaalsContact C-N 3.31Å; L598-S600 PolarHBondContact O-N 3.15Å; L598-L601 PolarHBondContact O-N 3.45Å; L598-M602 WeakPolarHBondContact O-CB 3.28Å; L598-M602 PolarHBondContact O-N 3.13Å; L598-F612 HydrophobicContact CD2-CD1 3.94Å; L598-M615 HydrophobicContact CD1-CB 4.46Å; L598-M615 HydrophobicContact CD2-CB 4.48Å; L598-M615 HydrophobicContact CD2-CE 4Å; L598-V616 HydrophobicContact CB-CG2 3.93Å; L598-V616 HydrophobicContact CD1-CG2 3.75Å; L598-V616 HydrophobicContact CG-CG2 4.47Å
599	M	85.9	Confident	87.8	Confident	16 Å²	16	35.2 Å²	35.2	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-70	-27.2	-179.9	-69.7	-70.7	-71.7	0	0	112.5	I595 Q596 D597 M602 Q603 L613 L739	I595-M599 HydrophobicContact CG2-CG 4.23Å; I595-M599 WeakPolarHBondContact O-CB 3.4Å; I595-M599 WeakPolarHBondContact O-CG 3.34Å; I595-M599 PolarHBondContact O-N 3.48Å; Q596-M599 PolarHBondContact O-N 3.23Å; D597-M599 VanDerWaalsContact C-N 3.3Å; D597-M599 PolarHBondContact O-N 3.33Å; M599-M602 HydrophobicContact CE-CE 4.04Å; M599-M602 HydrophobicContact SD-CE 4.17Å; M599-M602 HydrophobicContact SD-SD 4.15Å; M599-Q603 WeakPolarHBondContact O-CG 3.39Å; M599-Q603 PolarHBondContact O-N 3.41Å; M599-L613 HydrophobicContact SD-CD2 3.99Å; M599-L739 HydrophobicContact CE-CD1 3.93Å; M599-L739 HydrophobicContact CE-CD2 4.26Å
600	S	87.7	Confident	87.4	Confident	46 Å²	46	36.7 Å²	36.7	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-73.4	-45	170.1	67.4	0	0	0	0	111.9	Q596 D597 L598 M602 Q603 D604	Q596-S600 PolarHBondContact O-N 3.4Å; D597-S600 PolarHBondContact O-N 2.86Å; D597-S600 VanDerWaalsContact O-N 3.13Å; D597-S600 PolarHBondContact O-OG 2.91Å; L598-S600 VanDerWaalsContact C-N 3.31Å; L598-S600 PolarHBondContact O-N 3.15Å; S600-M602 PolarHBondContact O-N 3.34Å; S600-Q603 WeakPolarHBondContact O-CB 3.42Å; S600-Q603 PolarHBondContact O-N 3.33Å; S600-D604 PolarHBondContact O-N 2.92Å
601	L	87.6	Confident	87.2	Confident	16 Å²	16	38.8 Å²	38.8	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-35.2	173.7	-66.1	175.9	0	0	0	112.5	T505 F544 V548 D597 L598 Q603 D604 L605 F612	T505-L601 HydrophobicContact CG2-CD2 3.56Å; F544-L601 HydrophobicContact CZ-CD2 4.23Å; V548-L601 HydrophobicContact CG1-CD1 3.92Å; V548-L601 HydrophobicContact CG2-CD1 4.1Å; D597-L601 WeakPolarHBondContact O-CG 3.3Å; D597-L601 PolarHBondContact O-N 3.02Å; L598-L601 PolarHBondContact O-N 3.45Å; L601-Q603 VanDerWaalsContact C-N 3.3Å; L601-Q603 PolarHBondContact O-N 3.2Å; L601-D604 PolarHBondContact O-N 2.67Å; L601-L605 PolarHBondContact O-N 3.06Å; L601-F612 HydrophobicContact CB-CD1 4.3Å; L601-F612 HydrophobicContact CB-CE1 3.65Å; L601-F612 HydrophobicContact CB-CZ 3.93Å; L601-F612 HydrophobicContact CD1-CE1 4.3Å
602	M	86.6	Confident	87	Confident	10 Å²	10	38.8 Å²	38.8	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-31	174.1	-173.1	-153.1	60.1	0	0	112.8	L598 M599 S600 L605 S606 F612 L613 L739	L598-M602 WeakPolarHBondContact O-CB 3.28Å; L598-M602 PolarHBondContact O-N 3.13Å; M599-M602 HydrophobicContact CE-CE 4.04Å; M599-M602 HydrophobicContact SD-CE 4.17Å; M599-M602 HydrophobicContact SD-SD 4.15Å; S600-M602 PolarHBondContact O-N 3.34Å; M602-L605 CarbonylContact O-C 3.49Å; M602-S606 WeakPolarHBondContact O-CA 3.42Å; M602-S606 PolarHBondContact O-N 3.16Å; M602-F612 HydrophobicContact CB-CB 3.92Å; M602-F612 HydrophobicContact CB-CD2 4.11Å; M602-F612 HydrophobicContact CB-CG 4.07Å; M602-F612 HydrophobicContact CG-CB 4.03Å; M602-F612 HydrophobicContact CG-CD2 4.37Å; M602-F612 HydrophobicContact CG-CG 4.5Å; M602-L613 HydrophobicContact SD-CD1 4.31Å; M602-L613 HydrophobicContact SD-CD2 3.85Å; M602-L613 HydrophobicContact SD-CG 3.92Å; M602-L739 HydrophobicContact CE-CD1 3.65Å; M602-L739 HydrophobicContact SD-CD1 4.05Å
603	Q	83.5	Confident	86.8	Confident	104 Å²	104	38.2 Å²	38.2	49%	0.486	21%	0.208	S	C	.	.	H	α-helix	trans	-73.6	-43.4	174.9	-68.2	172.2	29.5	0	0	111	M599 S600 L601 M742	M599-Q603 WeakPolarHBondContact O-CG 3.39Å; M599-Q603 PolarHBondContact O-N 3.41Å; S600-Q603 WeakPolarHBondContact O-CB 3.42Å; S600-Q603 PolarHBondContact O-N 3.33Å; L601-Q603 VanDerWaalsContact C-N 3.3Å; L601-Q603 PolarHBondContact O-N 3.2Å; Q603-M742 HydrophobicContact CG-CE 4.31Å; Q603-M742 HydrophobicContact CG-SD 4.43Å
604	D	82.6	Confident	86.7	Confident	65 Å²	65	35.3 Å²	35.3	35%	0.348	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-47.9	177.5	-65.8	-29.3	0	0	0	111.4	T505 Q509 S600 L601	T505-D604 WeakPolarHBondContact CB-OD2 3.41Å; T505-D604 HydrophobicContact CG2-CB 4.4Å; Q509-D604 PolarHBondContact NE2-O 2.86Å; S600-D604 PolarHBondContact O-N 2.92Å; L601-D604 PolarHBondContact O-N 2.67Å
605	L	84.6	Confident	86.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	53.5	-178.9	-74.4	80.5	0	0	0	112	T505 F508 I540 F544 L601 M602 A607 Y608 F612	T505-L605 HydrophobicContact CG2-CD1 3.94Å; F508-L605 HydrophobicContact CB-CG 4.45Å; F508-L605 HydrophobicContact CD1-CB 4.42Å; F508-L605 HydrophobicContact CD1-CG 4.1Å; F508-L605 HydrophobicContact CG-CG 4.12Å; I540-L605 HydrophobicContact CD1-CD2 4.06Å; I540-L605 HydrophobicContact CG1-CD2 4.21Å; I540-L605 HydrophobicContact CG2-CD2 3.94Å; F544-L605 HydrophobicContact CD1-CD2 4.16Å; F544-L605 HydrophobicContact CE1-CD2 4.09Å; L601-L605 PolarHBondContact O-N 3.06Å; M602-L605 CarbonylContact O-C 3.49Å; L605-A607 PolarHBondContact O-N 2.95Å; L605-Y608 HydrophobicContact CB-CD2 4.39Å; L605-Y608 PolarHBondContact O-N 2.75Å; L605-F612 HydrophobicContact CB-CE2 3.81Å; L605-F612 HydrophobicContact CB-CZ 4.27Å; L605-F612 HydrophobicContact CD2-CZ 4.5Å
606	S	79.8	Confident	86.7	Confident	60 Å²	60	35.4 Å²	35.4	42%	0.42	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-50.1	-33	-175.3	60.6	0	0	0	0	116	Q509 M602 Y608 S609	Q509-S606 PolarHBondContact NE2-OG 3.1Å; M602-S606 WeakPolarHBondContact O-CA 3.42Å; M602-S606 PolarHBondContact O-N 3.16Å; S606-Y608 PolarHBondContact O-N 3.24Å; S606-S609 VanDerWaalsContact O-CB 3.29Å; S606-S609 WeakPolarHBondContact O-CB 3.46Å; S606-S609 PolarHBondContact O-N 2.81Å; S606-S609 PolarHBondContact O-OG 2.93Å
607	A	79.8	Confident	86.8	Confident	69 Å²	69	32.1 Å²	32.1	57%	0.57	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-63.1	-23.5	176.6	0	0	0	0	0	113.9	F508 L605	F508-A607 HydrophobicContact CE1-CB 4.25Å; F508-A607 HydrophobicContact CZ-CB 3.99Å; L605-A607 PolarHBondContact O-N 2.95Å
608	Y	83.8	Confident	86.8	Confident	30 Å²	30	32.3 Å²	32.3	12%	0.118	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-104	14.8	-179.6	-63.1	-89.6	0	0	0	112.2	F508 I540 N541 L545 L605 S606 N610 Q611 F612	F508-Y608 HydrophobicContact CE2-CD2 4.49Å; F508-Y608 AromaticContact CE2-CE2 3.82Å; F508-Y608 HydrophobicContact CE2-CE2 3.82Å; F508-Y608 HydrophobicContact CZ-CD2 4.09Å; F508-Y608 AromaticContact CZ-CE2 3.7Å; F508-Y608 HydrophobicContact CZ-CE2 3.7Å; I540-Y608 HydrophobicContact CB-CE1 4.24Å; I540-Y608 HydrophobicContact CB-CE2 4.23Å; I540-Y608 HydrophobicContact CD1-CD2 4.26Å; I540-Y608 HydrophobicContact CD1-CE2 3.5Å; I540-Y608 HydrophobicContact CG1-CE2 4.45Å; I540-Y608 HydrophobicContact CG2-CD1 3.77Å; I540-Y608 HydrophobicContact CG2-CD2 3.82Å; I540-Y608 HydrophobicContact CG2-CE1 3.71Å; I540-Y608 HydrophobicContact CG2-CE2 3.77Å; I540-Y608 HydrophobicContact CG2-CG 3.83Å; N541-Y608 VanDerWaalsContact OD1-CE1 3.24Å; N541-Y608 WeakPolarHBondContact OD1-CE1 3.24Å; L545-Y608 HydrophobicContact CD1-CD1 4.44Å; L605-Y608 HydrophobicContact CB-CD2 4.39Å; L605-Y608 PolarHBondContact O-N 2.75Å; S606-Y608 PolarHBondContact O-N 3.24Å; Y608-N610 VanDerWaalsContact C-N 3.28Å; Y608-N610 PolarHBondContact O-N 3.08Å; Y608-N610 VanDerWaalsContact O-N 3.14Å; Y608-Q611 PolarHBondContact O-N 3.13Å; Y608-F612 WeakPolarHBondContact O-CD2 3.4Å; Y608-F612 PolarHBondContact O-N 3.47Å
609	S	85	Confident	86.8	Confident	25 Å²	25	33.1 Å²	33.1	18%	0.175	19%	0.186	C	C	.	.	H	α-helix	trans	-56.3	-35.4	-170	58.5	0	0	0	0	114.7	S606 F612 L613	S606-S609 VanDerWaalsContact O-CB 3.29Å; S606-S609 WeakPolarHBondContact O-CB 3.46Å; S606-S609 PolarHBondContact O-N 2.81Å; S606-S609 PolarHBondContact O-OG 2.93Å; S609-F612 PolarHBondContact O-N 2.88Å; S609-L613 VanDerWaalsContact O-CG 3.3Å; S609-L613 WeakPolarHBondContact O-CG 3.09Å; S609-L613 PolarHBondContact O-N 3.03Å
610	N	85.8	Confident	87.2	Confident	44 Å²	44	32.4 Å²	32.4	24%	0.235	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-42.2	177.2	-67.1	-14.3	0	0	0	111.8	Y608 F612 L613 E614 I765	Y608-N610 VanDerWaalsContact C-N 3.28Å; Y608-N610 PolarHBondContact O-N 3.08Å; Y608-N610 VanDerWaalsContact O-N 3.14Å; N610-F612 PolarHBondContact O-N 3.01Å; N610-L613 PolarHBondContact O-N 2.98Å; N610-L613 VanDerWaalsContact O-N 3.16Å; N610-E614 WeakPolarHBondContact O-CG 3.46Å; N610-E614 PolarHBondContact O-N 3.49Å; N610-I765 HydrophobicContact CB-CD1 4.22Å
611	Q	86.9	Confident	87.5	Confident	71 Å²	71	33.5 Å²	33.5	33%	0.332	18%	0.181	S	C	.	.	H	α-helix	trans	-64.8	-39.9	179.7	-59.3	-172.3	34.7	0	0	111.6	N541 L545 Y608 E614 M615	N541-Q611 PolarHBondContact OD1-NE2 3.14Å; N541-Q611 PolarHBondContact OD1-OE1 3.35Å; L545-Q611 HydrophobicContact CD1-CB 4.2Å; Y608-Q611 PolarHBondContact O-N 3.13Å; Q611-E614 PolarHBondContact O-N 3.15Å; Q611-M615 WeakPolarHBondContact O-CG 3.42Å; Q611-M615 PolarHBondContact O-N 3.48Å
612	F	89.5	Confident	87.6	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-41.3	172.2	-71.8	-73.4	0	0	0	112.4	F544 L545 L598 L601 M602 L605 Y608 S609 N610 M615 V616	F544-F612 HydrophobicContact CE1-CZ 4.38Å; L545-F612 HydrophobicContact CD2-CD1 4.12Å; L545-F612 HydrophobicContact CD2-CE1 3.48Å; L545-F612 VanDerWaalsContact CD2-CE1 3.48Å; L545-F612 HydrophobicContact CD2-CE2 4.01Å; L545-F612 HydrophobicContact CD2-CZ 3.42Å; L545-F612 VanDerWaalsContact CD2-CZ 3.42Å; L598-F612 HydrophobicContact CD2-CD1 3.94Å; L601-F612 HydrophobicContact CB-CD1 4.3Å; L601-F612 HydrophobicContact CB-CE1 3.65Å; L601-F612 HydrophobicContact CB-CZ 3.93Å; L601-F612 HydrophobicContact CD1-CE1 4.3Å; M602-F612 HydrophobicContact CB-CB 3.92Å; M602-F612 HydrophobicContact CB-CD2 4.11Å; M602-F612 HydrophobicContact CB-CG 4.07Å; M602-F612 HydrophobicContact CG-CB 4.03Å; M602-F612 HydrophobicContact CG-CD2 4.37Å; M602-F612 HydrophobicContact CG-CG 4.5Å; L605-F612 HydrophobicContact CB-CE2 3.81Å; L605-F612 HydrophobicContact CB-CZ 4.27Å; L605-F612 HydrophobicContact CD2-CZ 4.5Å; Y608-F612 WeakPolarHBondContact O-CD2 3.4Å; Y608-F612 PolarHBondContact O-N 3.47Å; S609-F612 PolarHBondContact O-N 2.88Å; N610-F612 PolarHBondContact O-N 3.01Å; F612-M615 WeakPolarHBondContact O-CB 3.39Å; F612-M615 PolarHBondContact O-N 2.74Å; F612-V616 WeakPolarHBondContact O-CG2 3.33Å; F612-V616 PolarHBondContact O-N 3.29Å
613	L	88.8	Confident	87.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-33	177.8	-67.9	172.6	0	0	0	112.8	M599 M602 S609 N610 V616 C617 L739 I765 L769	M599-L613 HydrophobicContact SD-CD2 3.99Å; M602-L613 HydrophobicContact SD-CD1 4.31Å; M602-L613 HydrophobicContact SD-CD2 3.85Å; M602-L613 HydrophobicContact SD-CG 3.92Å; S609-L613 VanDerWaalsContact O-CG 3.3Å; S609-L613 WeakPolarHBondContact O-CG 3.09Å; S609-L613 PolarHBondContact O-N 3.03Å; N610-L613 PolarHBondContact O-N 2.98Å; N610-L613 VanDerWaalsContact O-N 3.16Å; L613-V616 PolarHBondContact O-N 3.01Å; L613-C617 PolarHBondContact O-N 2.98Å; L613-C617 PolarHBondContact O-SG 2.97Å; L613-L739 HydrophobicContact CD1-CD2 4.14Å; L613-L739 HydrophobicContact CD2-CD2 3.57Å; L613-I765 HydrophobicContact CB-CG2 3.66Å; L613-L769 HydrophobicContact CD2-CD1 3.99Å
614	E	89.9	Confident	88.4	Confident	56 Å²	56	32.8 Å²	32.8	26%	0.262	18%	0.177	S	C	.	.	H	α-helix	trans	-67.2	-39.9	169.5	-69.4	-164.3	142.3	0	0	112	N610 Q611 V616 C617 D618 I765	N610-E614 WeakPolarHBondContact O-CG 3.46Å; N610-E614 PolarHBondContact O-N 3.49Å; Q611-E614 PolarHBondContact O-N 3.15Å; E614-V616 VanDerWaalsContact C-N 3.34Å; E614-V616 PolarHBondContact O-N 2.7Å; E614-C617 WeakPolarHBondContact O-CB 3.49Å; E614-C617 PolarHBondContact O-N 3.37Å; E614-C617 VanDerWaalsContact O-N 3.12Å; E614-D618 PolarHBondContact O-N 2.91Å; E614-I765 HydrophobicContact CG-CD1 3.78Å; E614-I765 HydrophobicContact CG-CG1 4.22Å
615	M	90.4	Very high	88.8	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.034	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-42.5	171.5	-71.3	173.6	65.8	0	0	111.9	L545 V548 R549 L598 Q611 F612 C617 D618 K619	L545-M615 HydrophobicContact CD2-SD 4.37Å; V548-M615 HydrophobicContact CB-CE 4.39Å; V548-M615 HydrophobicContact CG1-CE 3.96Å; R549-M615 HydrophobicContact CB-CE 3.6Å; R549-M615 HydrophobicContact CG-CE 4.2Å; L598-M615 HydrophobicContact CD1-CB 4.46Å; L598-M615 HydrophobicContact CD2-CB 4.48Å; L598-M615 HydrophobicContact CD2-CE 4Å; Q611-M615 WeakPolarHBondContact O-CG 3.42Å; Q611-M615 PolarHBondContact O-N 3.48Å; F612-M615 WeakPolarHBondContact O-CB 3.39Å; F612-M615 PolarHBondContact O-N 2.74Å; M615-C617 VanDerWaalsContact C-N 3.35Å; M615-D618 PolarHBondContact O-N 3.13Å; M615-K619 WeakPolarHBondContact O-CG 3.49Å; M615-K619 PolarHBondContact O-N 3.02Å
616	V	91.8	Very high	89.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-42.5	172.7	173.6	0	0	0	0	110.9	I595 L598 F612 L613 E614 D618 K619 L620 L769	I595-V616 HydrophobicContact CG1-CG1 4.27Å; I595-V616 HydrophobicContact CG2-CG1 3.97Å; I595-V616 HydrophobicContact CG2-CG2 4.32Å; L598-V616 HydrophobicContact CB-CG2 3.93Å; L598-V616 HydrophobicContact CD1-CG2 3.75Å; L598-V616 HydrophobicContact CG-CG2 4.47Å; F612-V616 WeakPolarHBondContact O-CG2 3.33Å; F612-V616 PolarHBondContact O-N 3.29Å; L613-V616 PolarHBondContact O-N 3.01Å; E614-V616 VanDerWaalsContact C-N 3.34Å; E614-V616 PolarHBondContact O-N 2.7Å; V616-D618 PolarHBondContact O-N 3.11Å; V616-K619 PolarHBondContact O-N 2.75Å; V616-L620 HydrophobicContact CG1-CD1 3.81Å; V616-L620 HydrophobicContact CG1-CG 4.31Å; V616-L620 VanDerWaalsContact O-CB 3.31Å; V616-L620 WeakPolarHBondContact O-CB 3.47Å; V616-L620 VanDerWaalsContact O-CG 3.31Å; V616-L620 WeakPolarHBondContact O-CG 3.39Å; V616-L620 PolarHBondContact O-N 3Å; V616-L769 HydrophobicContact CB-CD2 4.42Å; V616-L769 HydrophobicContact CG1-CD2 3.76Å
617	C	92.1	Very high	89.7	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-45.9	174.7	-70	0	0	0	0	112.2	L613 E614 M615 K621 L769 L772	L613-C617 PolarHBondContact O-N 2.98Å; L613-C617 PolarHBondContact O-SG 2.97Å; E614-C617 WeakPolarHBondContact O-CB 3.49Å; E614-C617 PolarHBondContact O-N 3.37Å; E614-C617 VanDerWaalsContact O-N 3.12Å; M615-C617 VanDerWaalsContact C-N 3.35Å; C617-K621 WeakPolarHBondContact O-CB 3.35Å; C617-K621 WeakPolarHBondContact O-CD 3.11Å; C617-K621 VanDerWaalsContact O-CG 3.22Å; C617-K621 WeakPolarHBondContact O-CG 3.37Å; C617-K621 PolarHBondContact O-N 3.09Å; C617-L769 HydrophobicContact CB-CD2 4.44Å; C617-L769 WeakPolarHBondContact SG-CD2 3.46Å; C617-L769 VanDerWaalsContact SG-CG 3.58Å; C617-L772 HydrophobicContact CB-CD1 4.44Å
618	D	91.3	Very high	90.2	Very high	55 Å²	55	32.7 Å²	32.7	29%	0.294	16%	0.158	S	C	.	.	H	α-helix	trans	-62.9	-47	-179.7	-71.4	-13.3	0	0	0	111	R549 E614 M615 V616 K621 E622	R549-D618 IonicContact CZ-OD2 3.49Å; R549-D618 IonicContact NH1-OD2 2.69Å; R549-D618 PolarHBondContact NH1-OD2 3.37Å; R549-D618 IonicContact NH2-OD2 2.98Å; R549-D618 PolarHBondContact NH2-OD2 3.28Å; E614-D618 PolarHBondContact O-N 2.91Å; M615-D618 PolarHBondContact O-N 3.13Å; V616-D618 PolarHBondContact O-N 3.11Å; D618-K621 PolarHBondContact O-N 2.85Å; D618-E622 WeakPolarHBondContact O-CB 3.18Å; D618-E622 PolarHBondContact O-N 3.38Å
619	K	90.4	Very high	90.5	Very high	18 Å²	18	35.7 Å²	35.7	8%	0.078	18%	0.18	C	C	.	.	H	α-helix	trans	-66.1	-39.5	179.5	-66.1	-47	88.3	-169.1	0	112	I552 N553 I556 M615 V616 E622 Y623	I552-K619 HydrophobicContact CG2-CD 4.05Å; I552-K619 HydrophobicContact CG2-CG 4.01Å; N553-K619 WeakPolarHBondContact OD1-CE 3.4Å; N553-K619 PolarHBondContact OD1-NZ 3.47Å; I556-K619 HydrophobicContact CD1-CB 4.05Å; I556-K619 HydrophobicContact CD1-CD 3.78Å; I556-K619 HydrophobicContact CD1-CG 3.99Å; M615-K619 WeakPolarHBondContact O-CG 3.49Å; M615-K619 PolarHBondContact O-N 3.02Å; V616-K619 PolarHBondContact O-N 2.75Å; K619-E622 IonicContact NZ-OE2 3.62Å; K619-E622 PolarHBondContact NZ-OE2 2.82Å; K619-Y623 WeakPolarHBondContact O-CB 3.46Å; K619-Y623 PolarHBondContact O-N 3.24Å
620	L	93.4	Very high	90.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.8	-37.2	175.5	-75.8	177.4	0	0	0	112.8	V591 I595 V616 K624 L732 F736 L769 L772 F776	V591-L620 HydrophobicContact CG1-CD2 4.36Å; I595-L620 HydrophobicContact CD1-CD1 4.23Å; I595-L620 HydrophobicContact CD1-CD2 3.3Å; I595-L620 HydrophobicContact CD1-CG 3.69Å; V616-L620 HydrophobicContact CG1-CD1 3.81Å; V616-L620 HydrophobicContact CG1-CG 4.31Å; V616-L620 VanDerWaalsContact O-CB 3.31Å; V616-L620 WeakPolarHBondContact O-CB 3.47Å; V616-L620 VanDerWaalsContact O-CG 3.31Å; V616-L620 WeakPolarHBondContact O-CG 3.39Å; V616-L620 PolarHBondContact O-N 3Å; L620-K624 VanDerWaalsContact O-CB 3.3Å; L620-K624 WeakPolarHBondContact O-CB 3.41Å; L620-K624 PolarHBondContact O-N 3.04Å; L620-L732 HydrophobicContact CD1-CD1 3.94Å; L620-L732 HydrophobicContact CD1-CD2 4.02Å; L620-L732 HydrophobicContact CD2-CD1 3.71Å; L620-L732 HydrophobicContact CD2-CD2 4.2Å; L620-L732 HydrophobicContact CG-CD1 4.5Å; L620-F736 HydrophobicContact CD1-CZ 4.04Å; L620-L769 HydrophobicContact CD1-CD2 4.01Å; L620-L772 HydrophobicContact CB-CD1 3.94Å; L620-F776 HydrophobicContact CB-CE2 4.28Å; L620-F776 HydrophobicContact CD2-CE2 3.74Å; L620-F776 HydrophobicContact CD2-CZ 4Å; L620-F776 WeakPolarHBondContact O-CZ 3.28Å
621	K	93.3	Very high	91	Very high	69 Å²	69	35 Å²	35	30%	0.3	18%	0.176	S	C	.	.	H	α-helix	trans	-63	-50.3	173.4	-75.1	164.4	-171.8	169.5	0	111.3	C617 D618 Y623 K624 E625 L772	C617-K621 WeakPolarHBondContact O-CB 3.35Å; C617-K621 WeakPolarHBondContact O-CD 3.11Å; C617-K621 VanDerWaalsContact O-CG 3.22Å; C617-K621 WeakPolarHBondContact O-CG 3.37Å; C617-K621 PolarHBondContact O-N 3.09Å; D618-K621 PolarHBondContact O-N 2.85Å; K621-Y623 VanDerWaalsContact C-N 3.32Å; K621-Y623 PolarHBondContact O-N 3.35Å; K621-K624 PolarHBondContact O-N 2.88Å; K621-E625 PolarHBondContact O-N 3.24Å; K621-L772 HydrophobicContact CG-CD1 4.1Å; K621-L772 HydrophobicContact CG-CD2 3.73Å
622	E	91.1	Very high	91.1	Very high	65 Å²	65	38 Å²	38	30%	0.304	18%	0.184	S	C	.	.	H	α-helix	trans	-55.9	-47.6	177.1	-179.4	177.7	-160.5	0	0	111.2	D618 K619 K624 E625 I626	D618-E622 WeakPolarHBondContact O-CB 3.18Å; D618-E622 PolarHBondContact O-N 3.38Å; K619-E622 IonicContact NZ-OE2 3.62Å; K619-E622 PolarHBondContact NZ-OE2 2.82Å; E622-K624 PolarHBondContact O-N 2.68Å; E622-E625 PolarHBondContact O-N 3.11Å; E622-I626 HydrophobicContact CG-CD1 4.06Å; E622-I626 WeakPolarHBondContact O-CD1 3.17Å; E622-I626 WeakPolarHBondContact O-CG1 3.38Å; E622-I626 PolarHBondContact O-N 2.86Å
623	Y	92.4	Very high	91.1	Very high	1 Å²	1	41 Å²	41	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-36.5	178.7	-171	-119.1	0	0	0	113.5	S587 T588 V591 K619 K621 E625 I626 C627 M725 L728 F776	S587-Y623 PolarHBondContact OG-OH 3.02Å; T588-Y623 VanDerWaalsContact CA-OH 3.29Å; T588-Y623 WeakPolarHBondContact CA-OH 3.34Å; T588-Y623 WeakPolarHBondContact CB-OH 3.48Å; T588-Y623 HydrophobicContact CG2-CE1 4.41Å; T588-Y623 PolarHBondContact N-OH 2.89Å; T588-Y623 VanDerWaalsContact N-OH 3.11Å; T588-Y623 PolarHBondContact OG1-OH 2.84Å; V591-Y623 HydrophobicContact CB-CD1 4.28Å; V591-Y623 HydrophobicContact CB-CG 4.34Å; V591-Y623 HydrophobicContact CG1-CD1 3.94Å; V591-Y623 HydrophobicContact CG1-CG 4.1Å; V591-Y623 HydrophobicContact CG2-CD1 4.18Å; V591-Y623 HydrophobicContact CG2-CD2 3.72Å; V591-Y623 HydrophobicContact CG2-CE2 4.11Å; V591-Y623 HydrophobicContact CG2-CG 3.77Å; K619-Y623 WeakPolarHBondContact O-CB 3.46Å; K619-Y623 PolarHBondContact O-N 3.24Å; K621-Y623 VanDerWaalsContact C-N 3.32Å; K621-Y623 PolarHBondContact O-N 3.35Å; Y623-E625 VanDerWaalsContact C-N 3.34Å; Y623-E625 PolarHBondContact O-N 3.44Å; Y623-I626 PolarHBondContact O-N 3.42Å; Y623-C627 PolarHBondContact O-N 3.45Å; Y623-C627 PolarHBondContact O-SG 2.81Å; Y623-M725 HydrophobicContact CE1-CE 3.77Å; Y623-M725 HydrophobicContact CE1-SD 4.31Å; Y623-M725 WeakPolarHBondContact OH-CE 3.5Å; Y623-L728 HydrophobicContact CD1-CD2 3.92Å; Y623-L728 HydrophobicContact CE1-CD2 3.81Å; Y623-F776 AromaticContact CD1-CE1 3.84Å; Y623-F776 HydrophobicContact CD1-CE1 3.84Å; Y623-F776 HydrophobicContact CD1-CZ 4.12Å; Y623-F776 HydrophobicContact CE1-CE1 4.39Å
624	K	93.6	Very high	91.1	Very high	49 Å²	49	42.1 Å²	42.1	21%	0.213	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-41.8	173.2	-170.5	-176.9	179.1	-175.3	0	111.5	L620 K621 E622 C627 N628 L772 G775 F776 I779	L620-K624 VanDerWaalsContact O-CB 3.3Å; L620-K624 WeakPolarHBondContact O-CB 3.41Å; L620-K624 PolarHBondContact O-N 3.04Å; K621-K624 PolarHBondContact O-N 2.88Å; E622-K624 PolarHBondContact O-N 2.68Å; K624-C627 PolarHBondContact O-N 2.98Å; K624-N628 WeakPolarHBondContact O-CB 3.44Å; K624-N628 PolarHBondContact O-N 3.33Å; K624-N628 PolarHBondContact O-ND2 2.73Å; K624-L772 HydrophobicContact CD-CD2 4.2Å; K624-G775 WeakPolarHBondContact CE-O 3.48Å; K624-F776 HydrophobicContact CB-CE1 3.85Å; K624-F776 HydrophobicContact CB-CZ 3.8Å; K624-F776 HydrophobicContact CG-CE1 4.27Å; K624-F776 HydrophobicContact CG-CZ 4.47Å; K624-I779 HydrophobicContact CG-CD1 3.84Å
625	E	92.1	Very high	91.1	Very high	108 Å²	108	39.4 Å²	39.4	51%	0.505	21%	0.209	S	C	.	.	H	α-helix	trans	-68.8	-36.2	176.7	-67.6	-48.4	117.5	0	0	112.8	K621 E622 Y623 N628 T629	K621-E625 PolarHBondContact O-N 3.24Å; E622-E625 PolarHBondContact O-N 3.11Å; Y623-E625 VanDerWaalsContact C-N 3.34Å; Y623-E625 PolarHBondContact O-N 3.44Å; E625-N628 PolarHBondContact O-N 2.87Å; E625-N628 PolarHBondContact OE1-ND2 3.46Å; E625-T629 VanDerWaalsContact O-CB 3.29Å; E625-T629 WeakPolarHBondContact O-CB 3.4Å; E625-T629 PolarHBondContact O-N 2.92Å; E625-T629 PolarHBondContact O-OG1 3.13Å
626	I	90.4	Very high	90.9	Very high	46 Å²	46	42.7 Å²	42.7	24%	0.236	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-47	170.2	-69	157.8	0	0	0	110.4	E622 Y623 T629 A630	E622-I626 HydrophobicContact CG-CD1 4.06Å; E622-I626 WeakPolarHBondContact O-CD1 3.17Å; E622-I626 WeakPolarHBondContact O-CG1 3.38Å; E622-I626 PolarHBondContact O-N 2.86Å; Y623-I626 PolarHBondContact O-N 3.42Å; I626-T629 PolarHBondContact O-N 3.34Å; I626-A630 WeakPolarHBondContact O-CB 3.41Å; I626-A630 PolarHBondContact O-N 2.99Å
627	C	91.8	Very high	90	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-42.5	178.7	-64.2	0	0	0	0	112.6	Y623 K624 T629 A630 Y631 L721 M725 I779	Y623-C627 PolarHBondContact O-N 3.45Å; Y623-C627 PolarHBondContact O-SG 2.81Å; K624-C627 PolarHBondContact O-N 2.98Å; C627-T629 PolarHBondContact O-N 3.11Å; C627-A630 PolarHBondContact O-N 2.8Å; C627-Y631 WeakPolarHBondContact O-CB 3.26Å; C627-Y631 PolarHBondContact O-N 3.48Å; C627-L721 HydrophobicContact CB-CD1 4.27Å; C627-M725 HydrophobicContact CB-SD 4.08Å; C627-I779 HydrophobicContact CB-CD1 4.39Å
628	N	91.4	Very high	88.6	Confident	37 Å²	37	52.5 Å²	52.5	20%	0.198	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-42	174.1	-83.6	-34.3	0	0	0	112.3	K624 E625 R632 I779	K624-N628 WeakPolarHBondContact O-CB 3.44Å; K624-N628 PolarHBondContact O-N 3.33Å; K624-N628 PolarHBondContact O-ND2 2.73Å; E625-N628 PolarHBondContact O-N 2.87Å; E625-N628 PolarHBondContact OE1-ND2 3.46Å; N628-R632 WeakPolarHBondContact O-CB 3.41Å; N628-R632 VanDerWaalsContact O-CG 3.31Å; N628-R632 WeakPolarHBondContact O-CG 3.28Å; N628-R632 PolarHBondContact O-N 3.08Å; N628-I779 WeakPolarHBondContact OD1-CD1 3.4Å
629	T	90.2	Very high	87.5	Confident	92 Å²	92	59 Å²	59	56%	0.564	30%	0.303	S	S	*	.	H	α-helix	trans	-66.6	-43.8	178.5	-57.8	0	0	0	0	110.7	E625 I626 C627 R632 G633	E625-T629 VanDerWaalsContact O-CB 3.29Å; E625-T629 WeakPolarHBondContact O-CB 3.4Å; E625-T629 PolarHBondContact O-N 2.92Å; E625-T629 PolarHBondContact O-OG1 3.13Å; I626-T629 PolarHBondContact O-N 3.34Å; C627-T629 PolarHBondContact O-N 3.11Å; T629-R632 PolarHBondContact O-N 2.98Å; T629-G633 PolarHBondContact O-N 3.5Å
630	A	88.9	Confident	87	Confident	27 Å²	27	65 Å²	65	22%	0.223	33%	0.33	C	S	.	.	H	α-helix	trans	-68.9	-39.3	179.2	0	0	0	0	0	112.6	L566 I626 C627 G633 I634	L566-A630 HydrophobicContact CD1-CB 3.57Å; L566-A630 HydrophobicContact CD2-CB 3.9Å; L566-A630 HydrophobicContact CG-CB 3.73Å; I626-A630 WeakPolarHBondContact O-CB 3.41Å; I626-A630 PolarHBondContact O-N 2.99Å; C627-A630 PolarHBondContact O-N 2.8Å; A630-G633 PolarHBondContact O-N 3.12Å; A630-I634 PolarHBondContact O-N 3.09Å
631	Y	91.3	Very high	86.6	Confident	27 Å²	27	67.4 Å²	67.4	11%	0.106	34%	0.342	C	S	.	.	H	α-helix	trans	-57	-50.9	169.3	168.1	-95.4	0	0	0	111.3	C627 G633 I634 V635 L718 V786	C627-Y631 WeakPolarHBondContact O-CB 3.26Å; C627-Y631 PolarHBondContact O-N 3.48Å; Y631-G633 VanDerWaalsContact C-N 3.3Å; Y631-G633 PolarHBondContact O-N 3.42Å; Y631-I634 PolarHBondContact O-N 3.4Å; Y631-I634 VanDerWaalsContact O-N 3.12Å; Y631-V635 HydrophobicContact CD1-CG2 4.03Å; Y631-V635 HydrophobicContact CD2-CG1 4.31Å; Y631-V635 HydrophobicContact CE1-CG2 3.62Å; Y631-V635 HydrophobicContact CE2-CG1 3.92Å; Y631-V635 HydrophobicContact CE2-CG2 4.44Å; Y631-V635 WeakPolarHBondContact O-CG2 3.41Å; Y631-V635 PolarHBondContact O-N 2.83Å; Y631-L718 HydrophobicContact CD2-CD2 3.72Å; Y631-L718 HydrophobicContact CE2-CD2 4.24Å; Y631-V786 HydrophobicContact CE2-CG2 4.19Å; Y631-V786 WeakPolarHBondContact OH-CG2 3.31Å
632	R	90.2	Very high	86.4	Confident	136 Å²	136	64.3 Å²	64.3	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-58.5	-40.1	176.9	-79.7	173.6	-179.2	-95.1	9.2	112.8	N628 T629 I634 V635 Q636	N628-R632 WeakPolarHBondContact O-CB 3.41Å; N628-R632 VanDerWaalsContact O-CG 3.31Å; N628-R632 WeakPolarHBondContact O-CG 3.28Å; N628-R632 PolarHBondContact O-N 3.08Å; T629-R632 PolarHBondContact O-N 2.98Å; R632-I634 PolarHBondContact O-N 3.48Å; R632-V635 PolarHBondContact O-N 3.47Å; R632-Q636 VanDerWaalsContact O-CB 3.3Å; R632-Q636 WeakPolarHBondContact O-CB 3.45Å; R632-Q636 WeakPolarHBondContact O-CG 3.23Å; R632-Q636 PolarHBondContact O-N 2.76Å
633	G	88.6	Confident	86.4	Confident	64 Å²	64	62.1 Å²	62.1	66%	0.66	32%	0.319	S	S	*	.	H	α-helix	trans	-60.7	-26	177.5	0	0	0	0	0	114.1	T629 A630 Y631	T629-G633 PolarHBondContact O-N 3.5Å; A630-G633 PolarHBondContact O-N 3.12Å; Y631-G633 VanDerWaalsContact C-N 3.3Å; Y631-G633 PolarHBondContact O-N 3.42Å
634	I	89.3	Confident	86.4	Confident	22 Å²	22	62 Å²	62	11%	0.113	32%	0.319	C	S	.	.	H	α-helix	trans	-86.2	-46.9	173	-66.7	170.8	0	0	0	111.3	L566 A630 Y631 R632 Q636 L709 D714 A717 L718	L566-I634 HydrophobicContact CD1-CD1 3.69Å; A630-I634 PolarHBondContact O-N 3.09Å; Y631-I634 PolarHBondContact O-N 3.4Å; Y631-I634 VanDerWaalsContact O-N 3.12Å; R632-I634 PolarHBondContact O-N 3.48Å; I634-Q636 PolarHBondContact O-N 2.86Å; I634-L709 HydrophobicContact CG2-CD1 4.5Å; I634-L709 HydrophobicContact CG2-CD2 4.07Å; I634-L709 VanDerWaalsContact O-CD2 3.31Å; I634-L709 WeakPolarHBondContact O-CD2 3.41Å; I634-D714 HydrophobicContact CD1-CB 4.39Å; I634-D714 HydrophobicContact CG1-CB 4.24Å; I634-D714 HydrophobicContact CG2-CB 3.83Å; I634-A717 HydrophobicContact CD1-CB 3.84Å; I634-L718 HydrophobicContact CB-CD2 4.4Å; I634-L718 HydrophobicContact CB-CG 4.43Å; I634-L718 HydrophobicContact CD1-CD2 4.12Å; I634-L718 HydrophobicContact CD1-CG 3.99Å; I634-L718 HydrophobicContact CG2-CD1 3.71Å; I634-L718 HydrophobicContact CG2-CD2 4.29Å; I634-L718 HydrophobicContact CG2-CG 3.86Å
635	V	88.6	Confident	86.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-88	1.1	-168.9	-54.1	0	0	0	0	115.5	Y631 R632 L641 T642 A645 L718 V786	Y631-V635 HydrophobicContact CD1-CG2 4.03Å; Y631-V635 HydrophobicContact CD2-CG1 4.31Å; Y631-V635 HydrophobicContact CE1-CG2 3.62Å; Y631-V635 HydrophobicContact CE2-CG1 3.92Å; Y631-V635 HydrophobicContact CE2-CG2 4.44Å; Y631-V635 WeakPolarHBondContact O-CG2 3.41Å; Y631-V635 PolarHBondContact O-N 2.83Å; R632-V635 PolarHBondContact O-N 3.47Å; V635-L641 HydrophobicContact CG2-CD2 3.77Å; V635-L641 WeakPolarHBondContact O-CA 3.41Å; V635-T642 PolarHBondContact O-N 3.47Å; V635-A645 HydrophobicContact CB-CB 3.56Å; V635-A645 HydrophobicContact CG1-CB 4.05Å; V635-A645 HydrophobicContact CG2-CB 3.87Å; V635-L718 HydrophobicContact CG1-CD1 4.18Å; V635-L718 HydrophobicContact CG1-CD2 4.42Å; V635-V786 HydrophobicContact CG1-CG1 4.24Å
636	Q	86.1	Confident	86.2	Confident	75 Å²	75	56.9 Å²	56.9	35%	0.35	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.5	177.9	-63.1	-169.1	-82.9	0	0	111.9	R632 I634 K640 L641	R632-Q636 VanDerWaalsContact O-CB 3.3Å; R632-Q636 WeakPolarHBondContact O-CB 3.45Å; R632-Q636 WeakPolarHBondContact O-CG 3.23Å; R632-Q636 PolarHBondContact O-N 2.76Å; I634-Q636 PolarHBondContact O-N 2.86Å; Q636-K640 CarbonylContact C-O 3.52Å; Q636-K640 VanDerWaalsContact CA-O 3.25Å; Q636-K640 WeakPolarHBondContact CA-O 3.41Å; Q636-L641 HydrophobicContact CG-CD2 3.74Å
637	C	73.1	Confident	86.3	Confident	55 Å²	55	55.7 Å²	55.7	37%	0.372	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.2	172.5	-164.8	0	0	0	0	108.9	E639 K640	C637-E639 VanDerWaalsContact C-N 3.32Å; C637-E639 PolarHBondContact O-N 3.05Å; C637-K640 PolarHBondContact N-O 2.7Å; C637-K640 PolarHBondContact O-N 3.45Å; C637-K640 VanDerWaalsContact O-O 3.08Å
638	E	63.3	Low	86.3	Confident	155 Å²	155	55.6 Å²	55.6	72%	0.724	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	50.3	178.9	-59.4	-178.6	150.1	0	0	113.1	K640	E638-K640 PolarHBondContact O-N 3.18Å
639	E	67.3	Low	86.3	Confident	190 Å²	190	60.2 Å²	60.2	89%	0.888	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	-8.1	-176.9	-53.8	-173.4	159.5	0	0	116.5	C637	C637-E639 VanDerWaalsContact C-N 3.32Å; C637-E639 PolarHBondContact O-N 3.05Å
640	K	81.1	Confident	86.3	Confident	146 Å²	146	59.1 Å²	59.1	64%	0.635	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	153	175.8	-66.4	177.6	-175.7	171.1	0	111.6	Q636 C637 E638	Q636-K640 CarbonylContact C-O 3.52Å; Q636-K640 VanDerWaalsContact CA-O 3.25Å; Q636-K640 WeakPolarHBondContact CA-O 3.41Å; C637-K640 PolarHBondContact N-O 2.7Å; C637-K640 PolarHBondContact O-N 3.45Å; C637-K640 VanDerWaalsContact O-O 3.08Å; E638-K640 PolarHBondContact O-N 3.18Å
641	L	84.3	Confident	86.3	Confident	50 Å²	50	64.4 Å²	64.4	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	146.9	167.5	-70.6	165	0	0	0	109.4	V635 Q636 A645 K649	V635-L641 HydrophobicContact CG2-CD2 3.77Å; V635-L641 WeakPolarHBondContact O-CA 3.41Å; Q636-L641 HydrophobicContact CG-CD2 3.74Å; L641-A645 HydrophobicContact CB-CB 4.36Å; L641-A645 HydrophobicContact CD2-CB 4.09Å; L641-K649 HydrophobicContact CD1-CD 3.82Å
642	T	89.9	Confident	86.2	Confident	4 Å²	4	68.1 Å²	68.1	3%	0.025	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-58.8	158.8	163.2	57.4	0	0	0	0	110.7	V635 S644 A645 S646 E707 L709	V635-T642 PolarHBondContact O-N 3.47Å; T642-S644 VanDerWaalsContact C-N 3.31Å; T642-S644 PolarHBondContact O-N 3.24Å; T642-S644 PolarHBondContact OG1-OG 2.96Å; T642-A645 PolarHBondContact O-N 3.35Å; T642-A645 WeakPolarHBondContact OG1-CB 3.05Å; T642-S646 PolarHBondContact O-N 3.39Å; T642-E707 WeakPolarHBondContact CA-O 3.32Å; T642-E707 WeakPolarHBondContact CB-O 3.42Å; T642-L709 HydrophobicContact CG2-CD2 3.78Å; T642-L709 HydrophobicContact CG2-CG 4.05Å
643	I	90.3	Very high	86.2	Confident	18 Å²	18	62 Å²	62	9%	0.092	32%	0.321	C	S	.	.	H	α-helix	trans	-58.4	-46	-177.1	-68.8	170	0	0	0	110.7	A645 S646 W647 I703 E707 V793	I643-A645 PolarHBondContact O-N 3.16Å; I643-S646 PolarHBondContact O-N 3Å; I643-S646 PolarHBondContact O-OG 2.92Å; I643-W647 HydrophobicContact CG2-CD2 3.64Å; I643-W647 VanDerWaalsContact CG2-CE2 3.43Å; I643-W647 HydrophobicContact CG2-CE3 3.82Å; I643-W647 HydrophobicContact CG2-CG 4.36Å; I643-W647 HydrophobicContact CG2-CH2 3.73Å; I643-W647 HydrophobicContact CG2-CZ2 3.5Å; I643-W647 HydrophobicContact CG2-CZ3 3.87Å; I643-W647 PolarHBondContact O-N 3.43Å; I643-I703 HydrophobicContact CD1-CB 4.19Å; I643-I703 HydrophobicContact CD1-CD1 3.84Å; I643-I703 HydrophobicContact CD1-CG1 3.71Å; I643-I703 HydrophobicContact CD1-CG2 3.63Å; I643-E707 HydrophobicContact CD1-CB 4.15Å; I643-E707 HydrophobicContact CG1-CB 4.14Å; I643-E707 PolarHBondContact N-O 3.45Å; I643-E707 VanDerWaalsContact N-O 3.1Å; I643-V793 HydrophobicContact CB-CG1 4.37Å; I643-V793 HydrophobicContact CB-CG2 4.06Å; I643-V793 HydrophobicContact CG2-CG2 3.72Å
644	S	92.3	Very high	86.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-53.6	-47	175.7	56.5	0	0	0	0	112.9	T642 W647 A648 E790	T642-S644 VanDerWaalsContact C-N 3.31Å; T642-S644 PolarHBondContact O-N 3.24Å; T642-S644 PolarHBondContact OG1-OG 2.96Å; S644-W647 PolarHBondContact O-N 3.35Å; S644-A648 VanDerWaalsContact O-CB 3.32Å; S644-A648 WeakPolarHBondContact O-CB 3.31Å; S644-A648 PolarHBondContact O-N 3.23Å; S644-E790 WeakPolarHBondContact CB-OE2 3.48Å; S644-E790 PolarHBondContact OG-OE2 2.99Å
645	A	91.4	Very high	86.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-77.1	-23.9	-180	0	0	0	0	0	113.7	V635 L641 T642 I643 K649 V786	V635-A645 HydrophobicContact CB-CB 3.56Å; V635-A645 HydrophobicContact CG1-CB 4.05Å; V635-A645 HydrophobicContact CG2-CB 3.87Å; L641-A645 HydrophobicContact CB-CB 4.36Å; L641-A645 HydrophobicContact CD2-CB 4.09Å; T642-A645 PolarHBondContact O-N 3.35Å; T642-A645 WeakPolarHBondContact OG1-CB 3.05Å; I643-A645 PolarHBondContact O-N 3.16Å; A645-K649 VanDerWaalsContact O-CB 3.26Å; A645-K649 WeakPolarHBondContact O-CB 3.37Å; A645-K649 PolarHBondContact O-N 3.27Å; A645-V786 HydrophobicContact CB-CG2 4.1Å
646	S	91.7	Very high	86.3	Confident	48 Å²	48	67 Å²	67	34%	0.336	32%	0.324	S	S	.	.	H	α-helix	trans	-68.6	-44.8	168	81.2	0	0	0	0	111	T642 I643 K649 D650	T642-S646 PolarHBondContact O-N 3.39Å; I643-S646 PolarHBondContact O-N 3Å; I643-S646 PolarHBondContact O-OG 2.92Å; S646-K649 PolarHBondContact O-N 3.03Å; S646-D650 PolarHBondContact O-N 2.86Å; S646-D650 VanDerWaalsContact O-N 3.08Å
647	W	92.6	Very high	86.5	Confident	21 Å²	21	63.6 Å²	63.6	8%	0.08	31%	0.307	C	S	.	.	H	α-helix	trans	-70.1	-37.1	178.1	-69	-12.6	0	0	0	112.8	I643 S644 K649 D650 I653 L694 L698 L789 V793 F796	I643-W647 HydrophobicContact CG2-CD2 3.64Å; I643-W647 VanDerWaalsContact CG2-CE2 3.43Å; I643-W647 HydrophobicContact CG2-CE3 3.82Å; I643-W647 HydrophobicContact CG2-CG 4.36Å; I643-W647 HydrophobicContact CG2-CH2 3.73Å; I643-W647 HydrophobicContact CG2-CZ2 3.5Å; I643-W647 HydrophobicContact CG2-CZ3 3.87Å; I643-W647 PolarHBondContact O-N 3.43Å; S644-W647 PolarHBondContact O-N 3.35Å; W647-K649 PolarHBondContact O-N 2.95Å; W647-D650 WeakPolarHBondContact O-CB 3.31Å; W647-D650 PolarHBondContact O-N 2.91Å; W647-I653 HydrophobicContact CB-CD1 4.02Å; W647-I653 HydrophobicContact CB-CG2 4.42Å; W647-I653 HydrophobicContact CG-CD1 3.96Å; W647-L694 HydrophobicContact CD2-CD2 4.31Å; W647-L694 HydrophobicContact CE3-CD2 3.78Å; W647-L694 HydrophobicContact CZ3-CB 4.45Å; W647-L694 HydrophobicContact CZ3-CD2 3.91Å; W647-L698 HydrophobicContact CH2-CB 4.35Å; W647-L698 HydrophobicContact CZ2-CB 4.18Å; W647-L789 HydrophobicContact CB-CD1 3.83Å; W647-L789 HydrophobicContact CE3-CD2 4.23Å; W647-V793 HydrophobicContact CE3-CG2 4.04Å; W647-V793 HydrophobicContact CH2-CG2 4.3Å; W647-V793 HydrophobicContact CZ3-CG2 3.61Å; W647-F796 HydrophobicContact CH2-CD2 4.27Å; W647-F796 AromaticContact CH2-CE2 4Å; W647-F796 HydrophobicContact CH2-CE2 4Å; W647-F796 HydrophobicContact CZ3-CE2 4.22Å
648	A	91.7	Very high	87.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.7	172.8	0	0	0	0	0	114.2	S644 S654 L785 V786 L789	S644-A648 VanDerWaalsContact O-CB 3.32Å; S644-A648 WeakPolarHBondContact O-CB 3.31Å; S644-A648 PolarHBondContact O-N 3.23Å; A648-S654 PolarHBondContact O-OG 2.92Å; A648-L785 HydrophobicContact CB-CB 3.96Å; A648-V786 HydrophobicContact CB-CG2 3.58Å; A648-L789 HydrophobicContact CB-CD1 4.16Å
649	K	89.8	Confident	88.4	Confident	134 Å²	134	60.9 Å²	60.9	58%	0.583	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-27	171.3	-174.6	-174.6	172.1	-160.9	0	111.9	L641 A645 S646 W647 E651	L641-K649 HydrophobicContact CD1-CD 3.82Å; A645-K649 VanDerWaalsContact O-CB 3.26Å; A645-K649 WeakPolarHBondContact O-CB 3.37Å; A645-K649 PolarHBondContact O-N 3.27Å; S646-K649 PolarHBondContact O-N 3.03Å; W647-K649 PolarHBondContact O-N 2.95Å; K649-E651 PolarHBondContact O-N 3.49Å
650	D	91.5	Very high	89.3	Confident	69 Å²	69	52.5 Å²	52.5	37%	0.369	26%	0.26	S	S	.	.			trans	-61.9	122.1	173.3	-172.6	-60.4	0	0	0	110	S646 W647 D652 I653 S654	S646-D650 PolarHBondContact O-N 2.86Å; S646-D650 VanDerWaalsContact O-N 3.08Å; W647-D650 WeakPolarHBondContact O-CB 3.31Å; W647-D650 PolarHBondContact O-N 2.91Å; D650-D652 VanDerWaalsContact C-N 3.35Å; D650-D652 PolarHBondContact OD1-N 3.47Å; D650-I653 HydrophobicContact CB-CB 4.12Å; D650-I653 HydrophobicContact CB-CD1 3.92Å; D650-I653 HydrophobicContact CB-CG1 4.08Å; D650-I653 PolarHBondContact OD1-N 2.97Å; D650-S654 WeakPolarHBondContact O-CB 3.38Å; D650-S654 PolarHBondContact O-N 3.12Å; D650-S654 PolarHBondContact O-OG 3.31Å
651	E	88.3	Confident	89.4	Confident	138 Å²	138	46.3 Å²	46.3	65%	0.645	23%	0.234	S	C	*	.	H	α-helix	trans	-70.2	-30.6	-175.6	-69.5	-168.5	-171.6	0	0	112.8	K649 R655	K649-E651 PolarHBondContact O-N 3.49Å; E651-R655 WeakPolarHBondContact O-CB 3.29Å; E651-R655 PolarHBondContact O-N 2.84Å; E651-R655 IonicContact OE2-NH2 2.77Å
652	D	89.1	Confident	89.2	Confident	106 Å²	106	44.6 Å²	44.6	57%	0.567	23%	0.226	S	C	*	.	H	α-helix	trans	-79.8	-40	-177.5	-69	-32	0	0	0	110.7	D650 R655 L656	D650-D652 VanDerWaalsContact C-N 3.35Å; D650-D652 PolarHBondContact OD1-N 3.47Å; D652-R655 IonicContact OD1-CZ 3.26Å; D652-R655 IonicContact OD1-NH1 2.97Å; D652-R655 PolarHBondContact OD1-NH1 2.88Å; D652-R655 IonicContact OD1-NH2 3.79Å; D652-L656 VanDerWaalsContact O-CB 3.24Å; D652-L656 WeakPolarHBondContact O-CB 3.5Å; D652-L656 PolarHBondContact O-N 3.03Å
653	I	89.4	Confident	89	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-47	170.5	-59.3	174.9	0	0	0	110.3	W647 D650 L656 L657 N697	W647-I653 HydrophobicContact CB-CD1 4.02Å; W647-I653 HydrophobicContact CB-CG2 4.42Å; W647-I653 HydrophobicContact CG-CD1 3.96Å; D650-I653 HydrophobicContact CB-CB 4.12Å; D650-I653 HydrophobicContact CB-CD1 3.92Å; D650-I653 HydrophobicContact CB-CG1 4.08Å; D650-I653 PolarHBondContact OD1-N 2.97Å; I653-L656 WeakPolarHBondContact O-CB 3.42Å; I653-L656 PolarHBondContact O-N 3.08Å; I653-L657 HydrophobicContact CG2-CD1 3.85Å; I653-L657 HydrophobicContact CG2-CG 4.37Å; I653-L657 WeakPolarHBondContact O-CG 3.49Å; I653-L657 PolarHBondContact O-N 2.88Å; I653-N697 WeakPolarHBondContact CD1-ND2 3.38Å
654	S	90.4	Very high	88.6	Confident	15 Å²	15	47.6 Å²	47.6	11%	0.105	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-45.4	-179.7	-58.4	0	0	0	0	111.6	A648 D650 L656 L657 Q658	A648-S654 PolarHBondContact O-OG 2.92Å; D650-S654 WeakPolarHBondContact O-CB 3.38Å; D650-S654 PolarHBondContact O-N 3.12Å; D650-S654 PolarHBondContact O-OG 3.31Å; S654-L656 VanDerWaalsContact C-N 3.35Å; S654-L656 PolarHBondContact O-N 3.23Å; S654-L657 PolarHBondContact O-N 2.88Å; S654-Q658 WeakPolarHBondContact O-CB 3.26Å; S654-Q658 VanDerWaalsContact O-CG 3.22Å; S654-Q658 WeakPolarHBondContact O-CG 3.48Å; S654-Q658 PolarHBondContact O-N 2.78Å
655	R	89.9	Confident	87.8	Confident	135 Å²	135	49.9 Å²	49.9	51%	0.509	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-38.8	176.8	-170.4	-173	-53.8	121.3	7	111.7	E651 D652 S659	E651-R655 WeakPolarHBondContact O-CB 3.29Å; E651-R655 PolarHBondContact O-N 2.84Å; E651-R655 IonicContact OE2-NH2 2.77Å; D652-R655 IonicContact OD1-CZ 3.26Å; D652-R655 IonicContact OD1-NH1 2.97Å; D652-R655 PolarHBondContact OD1-NH1 2.88Å; D652-R655 IonicContact OD1-NH2 3.79Å; R655-S659 VanDerWaalsContact O-CB 3.26Å; R655-S659 WeakPolarHBondContact O-CB 3.45Å; R655-S659 PolarHBondContact O-N 2.9Å; R655-S659 PolarHBondContact O-OG 2.86Å
656	L	89.3	Confident	87.3	Confident	41 Å²	41	50.7 Å²	50.7	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-59.1	173.1	178.3	71.4	0	0	0	110.1	D652 I653 S654 Q658 S659 L660 K689 V693	D652-L656 VanDerWaalsContact O-CB 3.24Å; D652-L656 WeakPolarHBondContact O-CB 3.5Å; D652-L656 PolarHBondContact O-N 3.03Å; I653-L656 WeakPolarHBondContact O-CB 3.42Å; I653-L656 PolarHBondContact O-N 3.08Å; S654-L656 VanDerWaalsContact C-N 3.35Å; S654-L656 PolarHBondContact O-N 3.23Å; L656-Q658 VanDerWaalsContact C-N 3.31Å; L656-Q658 PolarHBondContact O-N 2.95Å; L656-S659 WeakPolarHBondContact O-CB 3.22Å; L656-S659 PolarHBondContact O-N 3.47Å; L656-S659 PolarHBondContact O-OG 3.21Å; L656-L660 WeakPolarHBondContact O-CG 3.33Å; L656-L660 PolarHBondContact O-N 3.25Å; L656-K689 HydrophobicContact CD1-CG 4.36Å; L656-V693 HydrophobicContact CD2-CB 3.98Å; L656-V693 HydrophobicContact CD2-CG1 3.91Å; L656-V693 HydrophobicContact CD2-CG2 3.72Å
657	L	89.2	Confident	86.3	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-41.9	-176.9	-67	171.4	0	0	0	112.2	I653 S654 S659 L660 W663 E690 L785 L789	I653-L657 HydrophobicContact CG2-CD1 3.85Å; I653-L657 HydrophobicContact CG2-CG 4.37Å; I653-L657 WeakPolarHBondContact O-CG 3.49Å; I653-L657 PolarHBondContact O-N 2.88Å; S654-L657 PolarHBondContact O-N 2.88Å; L657-S659 VanDerWaalsContact C-N 3.31Å; L657-S659 PolarHBondContact O-N 2.85Å; L657-L660 HydrophobicContact CD2-CD1 4.24Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 PolarHBondContact O-N 3.48Å; L657-W663 WeakPolarHBondContact O-CB 3.44Å; L657-E690 HydrophobicContact CD2-CB 4.46Å; L657-E690 HydrophobicContact CD2-CG 3.88Å; L657-E690 WeakPolarHBondContact CD2-OE1 3.48Å; L657-L785 HydrophobicContact CB-CD2 3.95Å; L657-L785 HydrophobicContact CD1-CD2 4Å; L657-L789 HydrophobicContact CD1-CD1 4.09Å; L657-L789 HydrophobicContact CD1-CD2 3.97Å; L657-L789 HydrophobicContact CD1-CG 4.27Å
658	Q	89.6	Confident	85	Confident	71 Å²	71	55.4 Å²	55.4	33%	0.332	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-27.1	176.9	-68.6	-179.1	-6.5	0	0	113.5	S654 L656 L660 W663 L785	S654-Q658 WeakPolarHBondContact O-CB 3.26Å; S654-Q658 VanDerWaalsContact O-CG 3.22Å; S654-Q658 WeakPolarHBondContact O-CG 3.48Å; S654-Q658 PolarHBondContact O-N 2.78Å; L656-Q658 VanDerWaalsContact C-N 3.31Å; L656-Q658 PolarHBondContact O-N 2.95Å; Q658-L660 VanDerWaalsContact C-N 3.31Å; Q658-W663 HydrophobicContact CB-CD2 4.48Å; Q658-W663 HydrophobicContact CB-CG 4.32Å; Q658-W663 HydrophobicContact CG-CD2 4.03Å; Q658-W663 HydrophobicContact CG-CG 4.38Å; Q658-W663 HydrophobicContact CG-CZ2 3.99Å; Q658-W663 VanDerWaalsContact O-CD1 3.24Å; Q658-L785 HydrophobicContact CG-CD1 4.36Å
659	S	87.8	Confident	83.4	Confident	82 Å²	82	59.8 Å²	59.8	57%	0.573	32%	0.316	S	S	*	.	H	α-helix	trans	-77.5	-14.1	173.5	75.6	0	0	0	0	113.8	R655 L656 L657	R655-S659 VanDerWaalsContact O-CB 3.26Å; R655-S659 WeakPolarHBondContact O-CB 3.45Å; R655-S659 PolarHBondContact O-N 2.9Å; R655-S659 PolarHBondContact O-OG 2.86Å; L656-S659 WeakPolarHBondContact O-CB 3.22Å; L656-S659 PolarHBondContact O-N 3.47Å; L656-S659 PolarHBondContact O-OG 3.21Å; L657-S659 VanDerWaalsContact C-N 3.31Å; L657-S659 PolarHBondContact O-N 2.85Å
660	L	86.3	Confident	81.5	Confident	14 Å²	14	61 Å²	61	7%	0.073	32%	0.317	C	S	.	.	S	Bend	trans	-72.6	154.2	-178.9	-63.1	-177.2	0	0	0	111.9	L656 L657 Q658 N662 W663 T664 A686 E690	L656-L660 WeakPolarHBondContact O-CG 3.33Å; L656-L660 PolarHBondContact O-N 3.25Å; L657-L660 HydrophobicContact CD2-CD1 4.24Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 PolarHBondContact O-N 3.48Å; Q658-L660 VanDerWaalsContact C-N 3.31Å; L660-N662 VanDerWaalsContact C-N 3.3Å; L660-N662 WeakPolarHBondContact CB-OD1 3.3Å; L660-N662 PolarHBondContact O-N 2.95Å; L660-W663 PolarHBondContact O-N 2.76Å; L660-T664 PolarHBondContact O-N 3.47Å; L660-T664 PolarHBondContact O-OG1 3.13Å; L660-A686 HydrophobicContact CB-CB 4.39Å; L660-A686 HydrophobicContact CD1-CB 4.41Å; L660-A686 HydrophobicContact CD2-CB 4.03Å; L660-E690 HydrophobicContact CD1-CB 4.12Å
661	P	81.9	Confident	79.5	Confident	16 Å²	16	67.1 Å²	67.1	10%	0.104	34%	0.344	C	S	.	.	H	α-helix	trans	-70.4	-29.1	-172	-16.6	33.2	0	0	0	112.2	T664 N665 F682 A686	P661-T664 PolarHBondContact O-N 2.68Å; P661-N665 WeakPolarHBondContact O-CB 3.39Å; P661-N665 PolarHBondContact O-N 3.03Å; P661-N665 PolarHBondContact O-ND2 3.42Å; P661-N665 VanDerWaalsContact O-ND2 3.13Å; P661-F682 HydrophobicContact CB-CD1 3.96Å; P661-F682 HydrophobicContact CB-CE1 3.92Å; P661-F682 HydrophobicContact CG-CD1 3.42Å; P661-F682 VanDerWaalsContact CG-CD1 3.42Å; P661-F682 HydrophobicContact CG-CE1 3.21Å; P661-F682 HydrophobicContact CG-CG 4.18Å; P661-F682 HydrophobicContact CG-CZ 3.81Å; P661-A686 HydrophobicContact CG-CB 4.27Å
662	N	81.4	Confident	77.5	Confident	15 Å²	15	65.3 Å²	65.3	8%	0.08	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-39.8	174	57.3	-28.5	0	0	0	112.3	L660 M666 F687 Y848 A852	L660-N662 VanDerWaalsContact C-N 3.3Å; L660-N662 WeakPolarHBondContact CB-OD1 3.3Å; L660-N662 PolarHBondContact O-N 2.95Å; N662-M666 VanDerWaalsContact O-CB 3.26Å; N662-M666 WeakPolarHBondContact O-CB 3.3Å; N662-M666 PolarHBondContact O-N 3.42Å; N662-F687 HydrophobicContact CB-CE1 4.32Å; N662-Y848 HydrophobicContact CB-CD2 4.18Å; N662-Y848 HydrophobicContact CB-CE2 4.25Å; N662-Y848 WeakPolarHBondContact ND2-CE2 3.18Å; N662-A852 HydrophobicContact CB-CB 3.91Å
663	W	86.1	Confident	75.8	Confident	21 Å²	21	66.6 Å²	66.6	8%	0.08	34%	0.339	C	S	.	.	H	α-helix	trans	-66.7	-48	173.6	-179.1	-90.3	0	0	0	111.5	L657 Q658 L660 N665 M666 A667 D781 L784 L785 Y848	L657-W663 WeakPolarHBondContact O-CB 3.44Å; Q658-W663 HydrophobicContact CB-CD2 4.48Å; Q658-W663 HydrophobicContact CB-CG 4.32Å; Q658-W663 HydrophobicContact CG-CD2 4.03Å; Q658-W663 HydrophobicContact CG-CG 4.38Å; Q658-W663 HydrophobicContact CG-CZ2 3.99Å; Q658-W663 VanDerWaalsContact O-CD1 3.24Å; L660-W663 PolarHBondContact O-N 2.76Å; W663-N665 VanDerWaalsContact C-N 3.3Å; W663-N665 PolarHBondContact O-N 2.77Å; W663-M666 HydrophobicContact CD2-CE 3.68Å; W663-M666 HydrophobicContact CE3-CE 3.7Å; W663-M666 HydrophobicContact CG-CE 4.29Å; W663-M666 HydrophobicContact CH2-CE 4.1Å; W663-M666 HydrophobicContact CZ2-CE 4.07Å; W663-M666 HydrophobicContact CZ3-CE 3.92Å; W663-M666 WeakPolarHBondContact O-CB 3.39Å; W663-M666 PolarHBondContact O-N 2.95Å; W663-M666 VanDerWaalsContact O-N 3.11Å; W663-A667 PolarHBondContact O-N 3.28Å; W663-D781 HydrophobicContact CH2-CB 3.98Å; W663-D781 HydrophobicContact CZ2-CB 3.96Å; W663-L784 HydrophobicContact CH2-CB 4.41Å; W663-L784 HydrophobicContact CH2-CD2 4.09Å; W663-L784 HydrophobicContact CH2-CG 4.46Å; W663-L784 HydrophobicContact CZ3-CB 4.43Å; W663-L784 HydrophobicContact CZ3-CD2 3.91Å; W663-L784 HydrophobicContact CZ3-CG 4.1Å; W663-L785 HydrophobicContact CE3-CD2 3.99Å; W663-L785 HydrophobicContact CH2-CD2 4.24Å; W663-L785 HydrophobicContact CH2-CG 4Å; W663-L785 HydrophobicContact CZ3-CD2 3.56Å; W663-L785 HydrophobicContact CZ3-CG 3.76Å; W663-Y848 HydrophobicContact CB-CE2 4.08Å; W663-Y848 AromaticContact CE3-CE1 3.83Å; W663-Y848 HydrophobicContact CE3-CE1 3.83Å; W663-Y848 HydrophobicContact CE3-CE2 4.05Å; W663-Y848 AromaticContact CE3-CZ 3.57Å; W663-Y848 HydrophobicContact CZ3-CE1 4.02Å
664	T	80	Confident	73.8	Confident	64 Å²	64	72.9 Å²	72.9	39%	0.393	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-38.7	179.3	-57.7	0	0	0	0	112.1	L660 P661	L660-T664 PolarHBondContact O-N 3.47Å; L660-T664 PolarHBondContact O-OG1 3.13Å; P661-T664 PolarHBondContact O-N 2.68Å
665	N	76.5	Confident	71.7	Confident	48 Å²	48	80.7 Å²	80.7	26%	0.257	40%	0.4	S	S	.	.	H	α-helix	trans	-73	-28.3	175.9	-73.7	-25.3	0	0	0	113.3	P661 W663	P661-N665 WeakPolarHBondContact O-CB 3.39Å; P661-N665 PolarHBondContact O-N 3.03Å; P661-N665 PolarHBondContact O-ND2 3.42Å; P661-N665 VanDerWaalsContact O-ND2 3.13Å; W663-N665 VanDerWaalsContact C-N 3.3Å; W663-N665 PolarHBondContact O-N 2.77Å
666	M	81	Confident	69.9	Low	16 Å²	16	81.8 Å²	81.8	8%	0.079	41%	0.405	C	S	.	.	H	α-helix	trans	-70.1	-41.9	173.1	174.2	-74.7	-60.3	0	0	110.8	N662 W663 Q668 L784 H844 K845 Y848	N662-M666 VanDerWaalsContact O-CB 3.26Å; N662-M666 WeakPolarHBondContact O-CB 3.3Å; N662-M666 PolarHBondContact O-N 3.42Å; W663-M666 HydrophobicContact CD2-CE 3.68Å; W663-M666 HydrophobicContact CE3-CE 3.7Å; W663-M666 HydrophobicContact CG-CE 4.29Å; W663-M666 HydrophobicContact CH2-CE 4.1Å; W663-M666 HydrophobicContact CZ2-CE 4.07Å; W663-M666 HydrophobicContact CZ3-CE 3.92Å; W663-M666 WeakPolarHBondContact O-CB 3.39Å; W663-M666 PolarHBondContact O-N 2.95Å; W663-M666 VanDerWaalsContact O-N 3.11Å; M666-Q668 PolarHBondContact O-N 3.15Å; M666-Q668 VanDerWaalsContact O-N 3.1Å; M666-L784 HydrophobicContact CE-CD2 3.44Å; M666-L784 VanDerWaalsContact CE-CD2 3.44Å; M666-L784 HydrophobicContact SD-CD2 3.66Å; M666-H844 PolarHBondContact O-CD2 3.42Å; M666-K845 HydrophobicContact CG-CG 4.39Å; M666-K845 HydrophobicContact SD-CG 4.02Å; M666-Y848 HydrophobicContact CB-CD2 4.18Å; M666-Y848 HydrophobicContact CB-CG 4.24Å; M666-Y848 HydrophobicContact CG-CD2 4.48Å; M666-Y848 HydrophobicContact CG-CG 4.05Å
667	A	70.8	Confident	68.1	Low	68 Å²	68	88.7 Å²	88.7	56%	0.562	44%	0.436	S	S	*	.	S	Bend	trans	-69.6	-1.7	-179.9	0	0	0	0	0	114.8	W663	W663-A667 PolarHBondContact O-N 3.28Å
668	Q	65.3	Low	66.6	Low	100 Å²	100	95 Å²	95	47%	0.467	47%	0.469	S	S	.	.	S	Bend	trans	-114.3	134.2	178.1	-67.5	-169.2	24.3	0	0	112.4	M666 R670	M666-Q668 PolarHBondContact O-N 3.15Å; M666-Q668 VanDerWaalsContact O-N 3.1Å; Q668-R670 PolarHBondContact O-N 3.25Å
669	P	57.4	Low	65.4	Low	92 Å²	92	93.8 Å²	93.8	60%	0.597	46%	0.464	S	S	*	.			trans	-59.3	135.5	173.9	-24.2	34.2	0	0	0	112.5	Q671 T672	P669-Q671 PolarHBondContact O-N 2.84Å; P669-T672 PolarHBondContact O-N 3.1Å; P669-T672 PolarHBondContact O-OG1 3.5Å
670	R	50.9	Low	64.3	Low	159 Å²	159	95.2 Å²	95.2	60%	0.6	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-50.2	-21.9	-175.8	-81.1	-175.5	171.8	-166.6	-1.5	116.1	Q668 T672 Q847	Q668-R670 PolarHBondContact O-N 3.25Å; R670-T672 PolarHBondContact O-N 2.9Å; R670-Q847 VanDerWaalsContact NH2-NE2 3.13Å
671	Q	48.3	Very low	63.5	Low	198 Å²	198	99.4 Å²	99.4	93%	0.925	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-68.6	-17.8	-177.2	-69	-178.7	-10.6	0	0	114	P669	P669-Q671 PolarHBondContact O-N 2.84Å
672	T	45.8	Very low	63.1	Low	101 Å²	101	105.2 Å²	105.2	62%	0.62	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-97	-3	-173.9	-27.9	0	0	0	0	114.1	P669 R670 Q674	P669-T672 PolarHBondContact O-N 3.1Å; P669-T672 PolarHBondContact O-OG1 3.5Å; R670-T672 PolarHBondContact O-N 2.9Å; T672-Q674 PolarHBondContact O-N 3.06Å
673	R	54.3	Low	62.8	Low	133 Å²	133	105.8 Å²	105.8	50%	0.502	51%	0.512	S	S	.	.			trans	-86.9	115.2	-167.9	-168.1	170	177.9	-175.7	-3.9	113.3	E679	R673-E679 IonicContact CZ-OE2 2.66Å; R673-E679 IonicContact NE-OE2 3.85Å; R673-E679 PolarHBondContact NE-OE2 3.46Å; R673-E679 IonicContact NH2-OE2 2.73Å; R673-E679 PolarHBondContact NH2-OE2 3.14Å
674	Q	47.8	Very low	62.5	Low	140 Å²	140	110.6 Å²	110.6	65%	0.654	53%	0.53	S	S	*	.			trans	-86.2	113.8	164	-69.9	-178.3	-10.6	0	0	109.5	T672 R676	T672-Q674 PolarHBondContact O-N 3.06Å; Q674-R676 PolarHBondContact O-N 3.11Å
675	K	47.1	Very low	62.6	Low	178 Å²	178	110.3 Å²	110.3	77%	0.774	53%	0.534	S	S	*	.			trans	-65.3	125.2	171	-96.8	-166.1	168.9	-158.4	0	110.3
676	R	52	Low	62.9	Low	159 Å²	159	108.3 Å²	108.3	60%	0.6	52%	0.524	S	S	*	.			trans	-119.7	145.9	165.8	-61.1	-176.3	-174.6	-176.9	2.9	109.4	Q674 D678 E679	Q674-R676 PolarHBondContact O-N 3.11Å; R676-D678 VanDerWaalsContact C-N 3.27Å; R676-D678 PolarHBondContact O-N 3.36Å; R676-E679 HydrophobicContact CB-CG 4.44Å; R676-E679 WeakPolarHBondContact O-CB 3.44Å; R676-E679 PolarHBondContact O-N 3.48Å; R676-E679 VanDerWaalsContact O-N 3.14Å
677	E	50.5	Low	63.2	Low	186 Å²	186	109 Å²	109	87%	0.869	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.3	-177.4	-64.5	-179.8	148.6	0	0	112.1	E679 E680	E677-E679 PolarHBondContact O-N 2.81Å; E677-E679 VanDerWaalsContact O-N 3.1Å; E677-E680 PolarHBondContact O-N 3.49Å
678	D	57.6	Low	63.9	Low	134 Å²	134	107.8 Å²	107.8	72%	0.717	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-15.5	174.9	-56.2	-52.2	0	0	0	114.2	R676 E680	R676-D678 VanDerWaalsContact C-N 3.27Å; R676-D678 PolarHBondContact O-N 3.36Å; D678-E680 VanDerWaalsContact C-N 3.3Å; D678-E680 PolarHBondContact O-N 2.83Å
679	E	63.6	Low	65	Low	46 Å²	46	107.4 Å²	107.4	22%	0.215	51%	0.513	C	S	.	.	H	α-helix	trans	-67	-29.3	177.3	-69.8	-170	177.4	0	0	112.6	R673 R676 E677 T683	R673-E679 IonicContact CZ-OE2 2.66Å; R673-E679 IonicContact NE-OE2 3.85Å; R673-E679 PolarHBondContact NE-OE2 3.46Å; R673-E679 IonicContact NH2-OE2 2.73Å; R673-E679 PolarHBondContact NH2-OE2 3.14Å; R676-E679 HydrophobicContact CB-CG 4.44Å; R676-E679 WeakPolarHBondContact O-CB 3.44Å; R676-E679 PolarHBondContact O-N 3.48Å; R676-E679 VanDerWaalsContact O-N 3.14Å; E677-E679 PolarHBondContact O-N 2.81Å; E677-E679 VanDerWaalsContact O-N 3.1Å; E679-T683 WeakPolarHBondContact O-CB 3.44Å; E679-T683 WeakPolarHBondContact O-CG2 3.43Å; E679-T683 PolarHBondContact O-N 3.08Å; E679-T683 PolarHBondContact O-OG1 2.67Å
680	E	66.6	Low	66.6	Low	111 Å²	111	103.1 Å²	103.1	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-74.8	-37.4	-172.3	-64.6	-165.9	179.1	0	0	112.8	E677 D678 T683 R684	E677-E680 PolarHBondContact O-N 3.49Å; D678-E680 VanDerWaalsContact C-N 3.3Å; D678-E680 PolarHBondContact O-N 2.83Å; E680-T683 WeakPolarHBondContact CA-OG1 3.21Å; E680-T683 PolarHBondContact O-OG1 2.96Å; E680-T683 VanDerWaalsContact O-OG1 3.11Å; E680-R684 PolarHBondContact O-N 3.05Å
681	D	69.3	Low	68.5	Low	103 Å²	103	95.7 Å²	95.7	55%	0.551	46%	0.458	S	S	*	.	H	α-helix	trans	-74.1	-36	175.5	-76.2	-9.9	0	0	0	111.3	R684 A685	D681-R684 IonicContact OD1-CZ 2.72Å; D681-R684 IonicContact OD1-NH1 2.77Å; D681-R684 PolarHBondContact OD1-NH1 2.62Å; D681-R684 IonicContact OD1-NH2 3.56Å; D681-R684 PolarHBondContact OD1-NH2 2.9Å; D681-A685 WeakPolarHBondContact O-CB 3.35Å; D681-A685 PolarHBondContact O-N 2.68Å
682	F	72.4	Confident	70.4	Confident	137 Å²	137	91.9 Å²	91.9	60%	0.601	44%	0.44	S	S	*	.	H	α-helix	trans	-69.4	-36.1	176.1	-167.6	-132.4	0	0	0	112.4	P661 A686	P661-F682 HydrophobicContact CB-CD1 3.96Å; P661-F682 HydrophobicContact CB-CE1 3.92Å; P661-F682 HydrophobicContact CG-CD1 3.42Å; P661-F682 VanDerWaalsContact CG-CD1 3.42Å; P661-F682 HydrophobicContact CG-CE1 3.21Å; P661-F682 HydrophobicContact CG-CG 4.18Å; P661-F682 HydrophobicContact CG-CZ 3.81Å; F682-A686 PolarHBondContact O-N 3.39Å; F682-A686 VanDerWaalsContact O-N 3.08Å
683	T	75.6	Confident	72.6	Confident	27 Å²	27	88.9 Å²	88.9	17%	0.166	42%	0.421	C	S	.	.	H	α-helix	trans	-71.4	-40.6	173.4	45.8	0	0	0	0	112.6	E679 E680 A685 A686 F687	E679-T683 WeakPolarHBondContact O-CB 3.44Å; E679-T683 WeakPolarHBondContact O-CG2 3.43Å; E679-T683 PolarHBondContact O-N 3.08Å; E679-T683 PolarHBondContact O-OG1 2.67Å; E680-T683 WeakPolarHBondContact CA-OG1 3.21Å; E680-T683 PolarHBondContact O-OG1 2.96Å; E680-T683 VanDerWaalsContact O-OG1 3.11Å; T683-A685 VanDerWaalsContact C-N 3.34Å; T683-A685 PolarHBondContact O-N 3.11Å; T683-A686 WeakPolarHBondContact O-CB 3.4Å; T683-A686 PolarHBondContact O-N 2.96Å; T683-A686 VanDerWaalsContact O-N 3.16Å; T683-F687 WeakPolarHBondContact O-CD1 3.39Å; T683-F687 WeakPolarHBondContact O-CD2 3.43Å; T683-F687 VanDerWaalsContact O-CG 3.28Å; T683-F687 WeakPolarHBondContact O-CG 3.45Å; T683-F687 PolarHBondContact O-N 3.19Å
684	R	79.5	Confident	74.3	Confident	122 Å²	122	82.6 Å²	82.6	46%	0.46	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-41.3	171.4	-80.9	-171.6	-101	104.1	7.1	112.5	E680 D681 A686 F687 A688	E680-R684 PolarHBondContact O-N 3.05Å; D681-R684 IonicContact OD1-CZ 2.72Å; D681-R684 IonicContact OD1-NH1 2.77Å; D681-R684 PolarHBondContact OD1-NH1 2.62Å; D681-R684 IonicContact OD1-NH2 3.56Å; D681-R684 PolarHBondContact OD1-NH2 2.9Å; R684-A686 VanDerWaalsContact C-N 3.31Å; R684-A686 PolarHBondContact O-N 3.46Å; R684-F687 PolarHBondContact O-N 3.37Å; R684-A688 PolarHBondContact O-N 3.32Å; R684-A688 VanDerWaalsContact O-N 3.12Å
685	A	81.7	Confident	76.2	Confident	59 Å²	59	78.2 Å²	78.2	49%	0.488	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-37.5	174.4	0	0	0	0	0	112.7	D681 T683 K689	D681-A685 WeakPolarHBondContact O-CB 3.35Å; D681-A685 PolarHBondContact O-N 2.68Å; T683-A685 VanDerWaalsContact C-N 3.34Å; T683-A685 PolarHBondContact O-N 3.11Å; A685-K689 WeakPolarHBondContact O-CB 3.48Å; A685-K689 PolarHBondContact O-N 3.42Å
686	A	83.6	Confident	78.1	Confident	5 Å²	5	72.5 Å²	72.5	4%	0.041	37%	0.373	C	S	.	.	H	α-helix	trans	-65.4	-42	175.7	0	0	0	0	0	112.7	L660 P661 F682 T683 R684 K689 E690	L660-A686 HydrophobicContact CB-CB 4.39Å; L660-A686 HydrophobicContact CD1-CB 4.41Å; L660-A686 HydrophobicContact CD2-CB 4.03Å; P661-A686 HydrophobicContact CG-CB 4.27Å; F682-A686 PolarHBondContact O-N 3.39Å; F682-A686 VanDerWaalsContact O-N 3.08Å; T683-A686 WeakPolarHBondContact O-CB 3.4Å; T683-A686 PolarHBondContact O-N 2.96Å; T683-A686 VanDerWaalsContact O-N 3.16Å; R684-A686 VanDerWaalsContact C-N 3.31Å; R684-A686 PolarHBondContact O-N 3.46Å; A686-K689 PolarHBondContact O-N 3.04Å; A686-E690 PolarHBondContact O-N 3.49Å
687	F	87.2	Confident	79.8	Confident	32 Å²	32	69 Å²	69	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-65.7	-38.1	177.6	-55.8	-24.4	0	0	0	112.5	N662 T683 R684 S691 A852 H856	N662-F687 HydrophobicContact CB-CE1 4.32Å; T683-F687 WeakPolarHBondContact O-CD1 3.39Å; T683-F687 WeakPolarHBondContact O-CD2 3.43Å; T683-F687 VanDerWaalsContact O-CG 3.28Å; T683-F687 WeakPolarHBondContact O-CG 3.45Å; T683-F687 PolarHBondContact O-N 3.19Å; R684-F687 PolarHBondContact O-N 3.37Å; F687-S691 WeakPolarHBondContact O-CB 3.42Å; F687-S691 PolarHBondContact O-N 3.25Å; F687-S691 PolarHBondContact O-OG 3.22Å; F687-A852 HydrophobicContact CE1-CB 3.77Å; F687-A852 HydrophobicContact CZ-CB 4.25Å; F687-H856 HydrophobicContact CB-CB 4.18Å
688	A	86.2	Confident	81.5	Confident	41 Å²	41	60.8 Å²	60.8	34%	0.339	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-45.3	172.6	0	0	0	0	0	111.4	R684 E690 S691 E692 H856	R684-A688 PolarHBondContact O-N 3.32Å; R684-A688 VanDerWaalsContact O-N 3.12Å; A688-E690 PolarHBondContact O-N 3.06Å; A688-S691 PolarHBondContact O-N 3.39Å; A688-E692 VanDerWaalsContact O-CB 3.31Å; A688-E692 WeakPolarHBondContact O-CB 3.38Å; A688-E692 PolarHBondContact O-N 3.11Å; A688-H856 WeakPolarHBondContact CA-NE2 3.25Å
689	K	88.3	Confident	82.6	Confident	93 Å²	93	56.3 Å²	56.3	40%	0.404	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-42.8	178.2	-165.5	73.7	-159.4	152.7	0	112.7	L656 A685 A686 E692 V693	L656-K689 HydrophobicContact CD1-CG 4.36Å; A685-K689 WeakPolarHBondContact O-CB 3.48Å; A685-K689 PolarHBondContact O-N 3.42Å; A686-K689 PolarHBondContact O-N 3.04Å; K689-E692 IonicContact NZ-OE2 3.46Å; K689-E692 PolarHBondContact NZ-OE2 2.98Å; K689-V693 WeakPolarHBondContact O-CG2 3.38Å; K689-V693 PolarHBondContact O-N 3.36Å
690	E	90.3	Very high	83.2	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-51.4	173.5	174.4	175	-145.9	0	0	111.2	L657 L660 A686 A688 E692 V693 L694 H788 R792	L657-E690 HydrophobicContact CD2-CB 4.46Å; L657-E690 HydrophobicContact CD2-CG 3.88Å; L657-E690 WeakPolarHBondContact CD2-OE1 3.48Å; L660-E690 HydrophobicContact CD1-CB 4.12Å; A686-E690 PolarHBondContact O-N 3.49Å; A688-E690 PolarHBondContact O-N 3.06Å; E690-E692 VanDerWaalsContact C-N 3.34Å; E690-E692 PolarHBondContact O-N 3.04Å; E690-V693 PolarHBondContact O-N 3.13Å; E690-L694 HydrophobicContact CG-CD1 3.77Å; E690-L694 HydrophobicContact CG-CG 4.3Å; E690-L694 WeakPolarHBondContact O-CG 3.45Å; E690-L694 PolarHBondContact O-N 2.96Å; E690-H788 IonicContact OE1-CD2 3.84Å; E690-H788 IonicContact OE1-CE1 2.85Å; E690-H788 IonicContact OE1-NE2 3.85Å; E690-H788 PolarHBondContact OE1-NE2 2.89Å; E690-H788 IonicContact OE2-NE2 3.21Å; E690-R792 VanDerWaalsContact CD-NE 3.32Å; E690-R792 IonicContact OE1-CZ 2.83Å; E690-R792 IonicContact OE1-NE 2.69Å; E690-R792 PolarHBondContact OE1-NE 3.22Å; E690-R792 IonicContact OE1-NH2 3.95Å; E690-R792 PolarHBondContact OE1-NH2 3.28Å; E690-R792 IonicContact OE2-CZ 3.52Å; E690-R792 IonicContact OE2-NE 2.64Å; E690-R792 IonicContact OE2-NH2 3.34Å; E690-R792 PolarHBondContact OE2-NH2 3.46Å
691	S	90.4	Very high	83.9	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-64.7	-37.8	-175.8	-59.4	0	0	0	0	112.5	F687 A688 T695	F687-S691 WeakPolarHBondContact O-CB 3.42Å; F687-S691 PolarHBondContact O-N 3.25Å; F687-S691 PolarHBondContact O-OG 3.22Å; A688-S691 PolarHBondContact O-N 3.39Å; S691-T695 VanDerWaalsContact O-CB 3.22Å; S691-T695 WeakPolarHBondContact O-CB 3.29Å; S691-T695 PolarHBondContact O-N 2.9Å; S691-T695 PolarHBondContact O-OG1 3.36Å
692	E	89.7	Confident	84.7	Confident	118 Å²	118	60.1 Å²	60.1	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-56.4	-52.8	171.8	-179.2	-170.2	-159	0	0	111	A688 K689 E690 G696	A688-E692 VanDerWaalsContact O-CB 3.31Å; A688-E692 WeakPolarHBondContact O-CB 3.38Å; A688-E692 PolarHBondContact O-N 3.11Å; K689-E692 IonicContact NZ-OE2 3.46Å; K689-E692 PolarHBondContact NZ-OE2 2.98Å; E690-E692 VanDerWaalsContact C-N 3.34Å; E690-E692 PolarHBondContact O-N 3.04Å; E692-G696 PolarHBondContact O-N 2.83Å
693	V	90.2	Very high	85.4	Confident	38 Å²	38	54.2 Å²	54.2	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-42.6	-175.3	169.6	0	0	0	0	112.1	L656 K689 E690 G696 N697	L656-V693 HydrophobicContact CD2-CB 3.98Å; L656-V693 HydrophobicContact CD2-CG1 3.91Å; L656-V693 HydrophobicContact CD2-CG2 3.72Å; K689-V693 WeakPolarHBondContact O-CG2 3.38Å; K689-V693 PolarHBondContact O-N 3.36Å; E690-V693 PolarHBondContact O-N 3.13Å; V693-G696 PolarHBondContact O-N 3.37Å; V693-N697 WeakPolarHBondContact O-CB 3.35Å; V693-N697 PolarHBondContact O-N 3.38Å; V693-N697 PolarHBondContact O-ND2 3.39Å
694	L	90.3	Very high	85.8	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-67.3	-40.9	178.5	-63	179.2	0	0	0	112.1	W647 E690 L698 L789 R792 F796	W647-L694 HydrophobicContact CD2-CD2 4.31Å; W647-L694 HydrophobicContact CE3-CD2 3.78Å; W647-L694 HydrophobicContact CZ3-CB 4.45Å; W647-L694 HydrophobicContact CZ3-CD2 3.91Å; E690-L694 HydrophobicContact CG-CD1 3.77Å; E690-L694 HydrophobicContact CG-CG 4.3Å; E690-L694 WeakPolarHBondContact O-CG 3.45Å; E690-L694 PolarHBondContact O-N 2.96Å; L694-L698 WeakPolarHBondContact O-CB 3.46Å; L694-L698 PolarHBondContact O-N 3.16Å; L694-L698 VanDerWaalsContact O-N 3.14Å; L694-L789 HydrophobicContact CD1-CD2 3.91Å; L694-L789 HydrophobicContact CD2-CD2 3.69Å; L694-L789 HydrophobicContact CG-CD2 4.47Å; L694-R792 HydrophobicContact CD1-CB 4.48Å; L694-F796 HydrophobicContact CB-CE2 4.04Å; L694-F796 HydrophobicContact CB-CZ 4.04Å
695	T	88.6	Confident	85.8	Confident	47 Å²	47	54.7 Å²	54.7	29%	0.288	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-42.2	176.1	-53.8	0	0	0	0	111.1	S691 L698 G699	S691-T695 VanDerWaalsContact O-CB 3.22Å; S691-T695 WeakPolarHBondContact O-CB 3.29Å; S691-T695 PolarHBondContact O-N 2.9Å; S691-T695 PolarHBondContact O-OG1 3.36Å; T695-L698 PolarHBondContact O-N 3.43Å; T695-G699 PolarHBondContact O-N 3.08Å
696	G	86.6	Confident	85.8	Confident	59 Å²	59	55.4 Å²	55.4	61%	0.608	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-43.1	177	0	0	0	0	0	113.4	E692 V693 G699	E692-G696 PolarHBondContact O-N 2.83Å; V693-G696 PolarHBondContact O-N 3.37Å; G696-G699 PolarHBondContact O-N 3Å
697	N	87	Confident	85.9	Confident	85 Å²	85	58.3 Å²	58.3	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-33.1	178.6	-79.6	-31.4	0	0	0	113.4	I653 V693	I653-N697 WeakPolarHBondContact CD1-ND2 3.38Å; V693-N697 WeakPolarHBondContact O-CB 3.35Å; V693-N697 PolarHBondContact O-N 3.38Å; V693-N697 PolarHBondContact O-ND2 3.39Å
698	L	86.4	Confident	86.1	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-72	-39.8	174	-176.2	61.8	0	0	0	111.8	W647 L694 T695 I703 F796 I800	W647-L698 HydrophobicContact CH2-CB 4.35Å; W647-L698 HydrophobicContact CZ2-CB 4.18Å; L694-L698 WeakPolarHBondContact O-CB 3.46Å; L694-L698 PolarHBondContact O-N 3.16Å; L694-L698 VanDerWaalsContact O-N 3.14Å; T695-L698 PolarHBondContact O-N 3.43Å; L698-I703 HydrophobicContact CD1-CD1 3.92Å; L698-I703 HydrophobicContact CD1-CG1 3.71Å; L698-I703 HydrophobicContact CD2-CD1 3.96Å; L698-I703 HydrophobicContact CD2-CG1 4.24Å; L698-F796 HydrophobicContact CD2-CB 3.83Å; L698-F796 HydrophobicContact CD2-CD1 3.78Å; L698-F796 HydrophobicContact CD2-CD2 4.04Å; L698-F796 HydrophobicContact CD2-CE1 4.26Å; L698-F796 HydrophobicContact CD2-CG 3.64Å; L698-I800 HydrophobicContact CD2-CD1 3.46Å; L698-I800 VanDerWaalsContact CD2-CD1 3.46Å
699	G	82.3	Confident	86.3	Confident	41 Å²	41	55.9 Å²	55.9	42%	0.423	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	-146.8	-175.4	0	0	0	0	0	112.2	T695 G696 K701	T695-G699 PolarHBondContact O-N 3.08Å; G696-G699 PolarHBondContact O-N 3Å; G699-K701 PolarHBondContact O-N 2.97Å
700	D	75.1	Confident	86.1	Confident	111 Å²	111	57.7 Å²	57.7	59%	0.594	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	8.4	-171	-133.5	0.9	0	0	0	114.6	K804 Y868	D700-K804 PolarHBondContact O-NZ 3.44Å; D700-K804 WeakPolarHBondContact OD1-CE 3.41Å; D700-K804 IonicContact OD1-NZ 2.88Å; D700-K804 PolarHBondContact OD1-NZ 2.87Å; D700-Y868 VanDerWaalsContact OD1-CE1 3.29Å; D700-Y868 WeakPolarHBondContact OD1-CE1 3.48Å; D700-Y868 VanDerWaalsContact OD1-CZ 3.3Å; D700-Y868 PolarHBondContact OD1-OH 3.22Å
701	K	81.2	Confident	86	Confident	152 Å²	152	61.3 Å²	61.3	66%	0.661	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-75.9	152	-173.4	-64.1	174	-175.9	168.3	0	112.4	G699	G699-K701 PolarHBondContact O-N 2.97Å
702	L	85.4	Confident	86.1	Confident	77 Å²	77	63.2 Å²	63.2	40%	0.403	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-96.2	130.7	166.8	-66.9	175.7	0	0	0	108.7	P704 I800 P801 K804	L702-P704 WeakPolarHBondContact O-CD 3.14Å; L702-I800 HydrophobicContact CD2-CB 4.31Å; L702-I800 HydrophobicContact CD2-CG2 3.61Å; L702-P801 HydrophobicContact CD2-CG 4.21Å; L702-K804 HydrophobicContact CD2-CD 4.12Å
703	I	87.3	Confident	86.1	Confident	12 Å²	12	60 Å²	60	6%	0.062	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-75.7	119.1	178.3	-61.3	-178.4	0	0	0	109.1	I643 L698 I708 V793 F796 H797	I643-I703 HydrophobicContact CD1-CB 4.19Å; I643-I703 HydrophobicContact CD1-CD1 3.84Å; I643-I703 HydrophobicContact CD1-CG1 3.71Å; I643-I703 HydrophobicContact CD1-CG2 3.63Å; L698-I703 HydrophobicContact CD1-CD1 3.92Å; L698-I703 HydrophobicContact CD1-CG1 3.71Å; L698-I703 HydrophobicContact CD2-CD1 3.96Å; L698-I703 HydrophobicContact CD2-CG1 4.24Å; I703-I708 HydrophobicContact CG2-CG2 3.48Å; I703-I708 VanDerWaalsContact CG2-CG2 3.48Å; I703-V793 HydrophobicContact CD1-CG1 4.15Å; I703-V793 HydrophobicContact CG2-CG1 4.48Å; I703-F796 HydrophobicContact CD1-CB 3.55Å; I703-F796 HydrophobicContact CD1-CG 4.46Å; I703-H797 HydrophobicContact CB-CB 4.31Å; I703-H797 HydrophobicContact CG2-CB 4.3Å; I703-H797 PolarHBondContact O-CE1 2.91Å; I703-H797 PolarHBondContact O-ND1 2.84Å
704	P	84.3	Confident	86.2	Confident	48 Å²	48	60.2 Å²	60.2	31%	0.312	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-76.7	161.8	177.4	35.2	-36.6	0	0	0	111.4	L702 N706 E707	L702-P704 WeakPolarHBondContact O-CD 3.14Å; P704-N706 WeakPolarHBondContact CB-OD1 3.27Å; P704-N706 WeakPolarHBondContact CG-OD1 3.42Å; P704-N706 PolarHBondContact O-N 3.45Å; P704-E707 VanDerWaalsContact CD-OE2 3.3Å; P704-E707 WeakPolarHBondContact CD-OE2 3.5Å; P704-E707 HydrophobicContact CG-CB 3.98Å; P704-E707 HydrophobicContact CG-CG 3.66Å; P704-E707 PolarHBondContact O-N 3.12Å
705	Q	80.5	Confident	86.3	Confident	112 Å²	112	60.2 Å²	60.2	52%	0.523	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.4	-171.6	-76.3	-169.7	9.3	0	0	115.5	R710 H797	Q705-R710 VanDerWaalsContact O-CD 3.29Å; Q705-R710 WeakPolarHBondContact O-CD 3.49Å; Q705-R710 PolarHBondContact O-NE 3.45Å; Q705-H797 VanDerWaalsContact CG-CE1 3.48Å; Q705-H797 WeakPolarHBondContact CG-CE1 3.26Å
706	N	81.5	Confident	86.6	Confident	74 Å²	74	61.6 Å²	61.6	40%	0.396	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.7	177.6	60.2	-30.9	0	0	0	113.5	P704	P704-N706 WeakPolarHBondContact CB-OD1 3.27Å; P704-N706 WeakPolarHBondContact CG-OD1 3.42Å; P704-N706 PolarHBondContact O-N 3.45Å
707	E	86.2	Confident	86.9	Confident	65 Å²	65	58.9 Å²	58.9	30%	0.304	31%	0.305	S	S	.	.	S	Bend	trans	-99.5	8	-179.6	-74.1	179.2	-169.8	0	0	113.5	T642 I643 P704	T642-E707 WeakPolarHBondContact CA-O 3.32Å; T642-E707 WeakPolarHBondContact CB-O 3.42Å; I643-E707 HydrophobicContact CD1-CB 4.15Å; I643-E707 HydrophobicContact CG1-CB 4.14Å; I643-E707 PolarHBondContact N-O 3.45Å; I643-E707 VanDerWaalsContact N-O 3.1Å; P704-E707 VanDerWaalsContact CD-OE2 3.3Å; P704-E707 WeakPolarHBondContact CD-OE2 3.5Å; P704-E707 HydrophobicContact CG-CB 3.98Å; P704-E707 HydrophobicContact CG-CG 3.66Å; P704-E707 PolarHBondContact O-N 3.12Å
708	I	89.9	Confident	87.3	Confident	9 Å²	9	54.8 Å²	54.8	5%	0.046	28%	0.284	C	S	.	.	S	Bend	trans	-123.9	152.5	-178.4	75.9	179.3	0	0	0	111.4	I703 R710 E790 V793 H797	I703-I708 HydrophobicContact CG2-CG2 3.48Å; I703-I708 VanDerWaalsContact CG2-CG2 3.48Å; I708-R710 HydrophobicContact CD1-CG 4.42Å; I708-R710 HydrophobicContact CG1-CG 3.84Å; I708-R710 PolarHBondContact O-N 3.2Å; I708-E790 WeakPolarHBondContact CA-OE1 3.49Å; I708-V793 HydrophobicContact CB-CG1 4.25Å; I708-V793 HydrophobicContact CG2-CG1 3.53Å; I708-H797 HydrophobicContact CD1-CB 4.49Å; I708-H797 HydrophobicContact CG2-CB 4.45Å
709	L	90.3	Very high	87.6	Confident	13 Å²	13	54.2 Å²	54.2	7%	0.068	28%	0.281	C	S	.	.			trans	-86	98.7	-179.9	-67.7	175.9	0	0	0	112	I634 T642 L715 L718 V786 E790 H794	I634-L709 HydrophobicContact CG2-CD1 4.5Å; I634-L709 HydrophobicContact CG2-CD2 4.07Å; I634-L709 VanDerWaalsContact O-CD2 3.31Å; I634-L709 WeakPolarHBondContact O-CD2 3.41Å; T642-L709 HydrophobicContact CG2-CD2 3.78Å; T642-L709 HydrophobicContact CG2-CG 4.05Å; L709-L715 HydrophobicContact CB-CD2 3.81Å; L709-L715 HydrophobicContact CB-CG 4.32Å; L709-L715 HydrophobicContact CD1-CD2 3.79Å; L709-L715 HydrophobicContact CG-CD2 4.47Å; L709-L718 HydrophobicContact CD1-CD1 3.86Å; L709-V786 HydrophobicContact CD1-CG1 4.03Å; L709-E790 HydrophobicContact CB-CG 3.95Å; L709-E790 HydrophobicContact CD1-CG 4.37Å; L709-E790 VanDerWaalsContact CD1-OE2 3.31Å; L709-E790 WeakPolarHBondContact CD1-OE2 3.37Å; L709-E790 HydrophobicContact CG-CG 4.44Å; L709-E790 VanDerWaalsContact CG-OE2 3.25Å; L709-E790 WeakPolarHBondContact CG-OE2 3.42Å; L709-E790 PolarHBondContact N-OE1 2.77Å; L709-H794 PolarHBondContact O-CE1 3.33Å; L709-H794 PolarHBondContact O-NE2 3.06Å
710	R	84.3	Confident	88.2	Confident	131 Å²	131	52.5 Å²	52.5	49%	0.494	26%	0.262	S	S	.	.			trans	-86.3	-27.8	-170.4	-49.1	-176.4	103.9	-180	1.7	115	Q705 I708 V712	Q705-R710 VanDerWaalsContact O-CD 3.29Å; Q705-R710 WeakPolarHBondContact O-CD 3.49Å; Q705-R710 PolarHBondContact O-NE 3.45Å; I708-R710 HydrophobicContact CD1-CG 4.42Å; I708-R710 HydrophobicContact CG1-CG 3.84Å; I708-R710 PolarHBondContact O-N 3.2Å; R710-V712 PolarHBondContact O-N 2.95Å
711	D	88.8	Confident	89.1	Confident	77 Å²	77	47.2 Å²	47.2	41%	0.412	23%	0.234	S	C	.	.			trans	-84.8	111.5	-179.5	-168.9	-2.4	0	0	0	110.2	S713 D714 L715	D711-S713 VanDerWaalsContact CG-CB 3.49Å; D711-S713 PolarHBondContact O-N 3.44Å; D711-S713 WeakPolarHBondContact OD1-CA 3.42Å; D711-S713 WeakPolarHBondContact OD1-CB 3.5Å; D711-S713 PolarHBondContact OD1-N 2.83Å; D711-S713 WeakPolarHBondContact OD2-CB 3.27Å; D711-D714 HydrophobicContact CB-CB 4.2Å; D711-D714 PolarHBondContact O-N 3.21Å; D711-L715 PolarHBondContact O-N 3.21Å; D711-L715 VanDerWaalsContact O-N 3.09Å
712	V	91.8	Very high	89.8	Confident	43 Å²	43	40 Å²	40	26%	0.261	20%	0.202	S	C	.	.	H	α-helix	trans	-58.8	-27.5	173.4	178.5	0	0	0	0	111.4	R710 D714 K716 A832 A836	R710-V712 PolarHBondContact O-N 2.95Å; V712-D714 VanDerWaalsContact C-N 3.33Å; V712-K716 WeakPolarHBondContact O-CB 3.28Å; V712-K716 PolarHBondContact O-N 3.17Å; V712-A832 WeakPolarHBondContact CG1-O 3.47Å; V712-A832 HydrophobicContact CG2-CB 4.02Å; V712-A836 HydrophobicContact CG1-CB 3.38Å
713	S	91.1	Very high	90.2	Very high	51 Å²	51	36.6 Å²	36.6	36%	0.357	18%	0.184	S	C	.	.	H	α-helix	trans	-62.9	-37.7	171.5	-163.9	0	0	0	0	112.3	K567 D711 K716 A717	K567-S713 WeakPolarHBondContact CE-OG 3.49Å; K567-S713 PolarHBondContact NZ-OG 3.22Å; D711-S713 VanDerWaalsContact CG-CB 3.49Å; D711-S713 PolarHBondContact O-N 3.44Å; D711-S713 WeakPolarHBondContact OD1-CA 3.42Å; D711-S713 WeakPolarHBondContact OD1-CB 3.5Å; D711-S713 PolarHBondContact OD1-N 2.83Å; D711-S713 WeakPolarHBondContact OD2-CB 3.27Å; S713-K716 PolarHBondContact O-N 3.03Å; S713-A717 WeakPolarHBondContact O-CB 3.41Å; S713-A717 PolarHBondContact O-N 3.03Å
714	D	91.8	Very high	90.6	Very high	43 Å²	43	36 Å²	36	23%	0.23	18%	0.181	C	C	.	.	H	α-helix	trans	-81.4	-34.9	-178.1	-66.5	-15.8	0	0	0	111.5	K567 I634 D711 V712 K716 A717 L718	K567-D714 WeakPolarHBondContact CE-OD1 3.42Å; K567-D714 IonicContact NZ-OD1 3.88Å; K567-D714 PolarHBondContact NZ-OD1 3.47Å; I634-D714 HydrophobicContact CD1-CB 4.39Å; I634-D714 HydrophobicContact CG1-CB 4.24Å; I634-D714 HydrophobicContact CG2-CB 3.83Å; D711-D714 HydrophobicContact CB-CB 4.2Å; D711-D714 PolarHBondContact O-N 3.21Å; V712-D714 VanDerWaalsContact C-N 3.33Å; D714-K716 VanDerWaalsContact C-N 3.3Å; D714-K716 PolarHBondContact O-N 2.91Å; D714-A717 WeakPolarHBondContact O-CB 3.38Å; D714-A717 PolarHBondContact O-N 3.47Å; D714-A717 VanDerWaalsContact O-N 3.17Å; D714-L718 PolarHBondContact O-N 3.41Å
715	L	93	Very high	91.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-40.9	166.7	-66.8	174.6	0	0	0	111.6	L709 D711 L718 A719 L787 E790 I833	L709-L715 HydrophobicContact CB-CD2 3.81Å; L709-L715 HydrophobicContact CB-CG 4.32Å; L709-L715 HydrophobicContact CD1-CD2 3.79Å; L709-L715 HydrophobicContact CG-CD2 4.47Å; D711-L715 PolarHBondContact O-N 3.21Å; D711-L715 VanDerWaalsContact O-N 3.09Å; L715-L718 PolarHBondContact O-N 2.95Å; L715-A719 WeakPolarHBondContact O-CB 3.43Å; L715-A719 PolarHBondContact O-N 2.99Å; L715-L787 HydrophobicContact CB-CD2 4.34Å; L715-L787 HydrophobicContact CD2-CD2 3.97Å; L715-L787 WeakPolarHBondContact O-CD2 3.5Å; L715-E790 HydrophobicContact CD2-CB 4.49Å; L715-E790 HydrophobicContact CD2-CG 4.1Å; L715-I833 HydrophobicContact CD1-CD1 4.05Å; L715-I833 HydrophobicContact CD1-CG1 3.74Å; L715-I833 HydrophobicContact CD1-CG2 4.18Å
716	K	93.8	Very high	91.8	Very high	77 Å²	77	31.1 Å²	31.1	34%	0.335	15%	0.154	S	C	.	.	H	α-helix	trans	-65.1	-38.6	172.7	-165.1	168.1	-173.9	166.2	0	112.2	V712 S713 D714 A719 N720 A836 A840	V712-K716 WeakPolarHBondContact O-CB 3.28Å; V712-K716 PolarHBondContact O-N 3.17Å; S713-K716 PolarHBondContact O-N 3.03Å; D714-K716 VanDerWaalsContact C-N 3.3Å; D714-K716 PolarHBondContact O-N 2.91Å; K716-A719 PolarHBondContact O-N 2.94Å; K716-N720 PolarHBondContact O-N 3.35Å; K716-N720 PolarHBondContact O-ND2 2.72Å; K716-N720 VanDerWaalsContact O-ND2 3.08Å; K716-A836 HydrophobicContact CB-CB 4.23Å; K716-A836 HydrophobicContact CD-CB 4.41Å; K716-A840 HydrophobicContact CG-CB 4.45Å
717	A	93.3	Very high	92.5	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-41.8	176.2	0	0	0	0	0	112.2	L566 K567 I634 S713 D714 A719 N720 L721	L566-A717 HydrophobicContact CB-CB 3.94Å; K567-A717 HydrophobicContact CG-CB 4.37Å; I634-A717 HydrophobicContact CD1-CB 3.84Å; S713-A717 WeakPolarHBondContact O-CB 3.41Å; S713-A717 PolarHBondContact O-N 3.03Å; D714-A717 WeakPolarHBondContact O-CB 3.38Å; D714-A717 PolarHBondContact O-N 3.47Å; D714-A717 VanDerWaalsContact O-N 3.17Å; A717-A719 VanDerWaalsContact C-N 3.34Å; A717-N720 PolarHBondContact O-N 2.63Å; A717-L721 WeakPolarHBondContact O-CB 3.27Å; A717-L721 PolarHBondContact O-N 3.02Å
718	L	94.2	Very high	92.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.8	-39.6	171.2	-75.2	175.7	0	0	0	112.2	Y631 I634 V635 L709 D714 L715 L721 Q722 V786 L787	Y631-L718 HydrophobicContact CD2-CD2 3.72Å; Y631-L718 HydrophobicContact CE2-CD2 4.24Å; I634-L718 HydrophobicContact CB-CD2 4.4Å; I634-L718 HydrophobicContact CB-CG 4.43Å; I634-L718 HydrophobicContact CD1-CD2 4.12Å; I634-L718 HydrophobicContact CD1-CG 3.99Å; I634-L718 HydrophobicContact CG2-CD1 3.71Å; I634-L718 HydrophobicContact CG2-CD2 4.29Å; I634-L718 HydrophobicContact CG2-CG 3.86Å; V635-L718 HydrophobicContact CG1-CD1 4.18Å; V635-L718 HydrophobicContact CG1-CD2 4.42Å; L709-L718 HydrophobicContact CD1-CD1 3.86Å; D714-L718 PolarHBondContact O-N 3.41Å; L715-L718 PolarHBondContact O-N 2.95Å; L718-L721 PolarHBondContact O-N 3.01Å; L718-Q722 WeakPolarHBondContact O-CB 3.29Å; L718-Q722 PolarHBondContact O-N 2.76Å; L718-V786 HydrophobicContact CD1-CG1 4.09Å; L718-L787 HydrophobicContact CB-CD1 4.44Å; L718-L787 HydrophobicContact CB-CD2 4Å; L718-L787 HydrophobicContact CB-CG 4.35Å; L718-L787 HydrophobicContact CD1-CD2 4.49Å
719	A	94.6	Very high	93.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.2	-42.3	176	0	0	0	0	0	112.6	L715 K716 A717 L721 Q722 E723 L787 A840 L841	L715-A719 WeakPolarHBondContact O-CB 3.43Å; L715-A719 PolarHBondContact O-N 2.99Å; K716-A719 PolarHBondContact O-N 2.94Å; A717-A719 VanDerWaalsContact C-N 3.34Å; A719-L721 VanDerWaalsContact C-N 3.33Å; A719-Q722 WeakPolarHBondContact O-CB 3.41Å; A719-Q722 PolarHBondContact O-N 3.49Å; A719-E723 PolarHBondContact O-N 2.9Å; A719-L787 HydrophobicContact CB-CD1 4Å; A719-A840 HydrophobicContact CB-CB 3.59Å; A719-L841 HydrophobicContact CB-CD1 4.45Å; A719-L841 HydrophobicContact CB-CD2 3.76Å; A719-L841 HydrophobicContact CB-CG 3.9Å
720	N	94.3	Very high	93.2	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.032	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-37.8	173.6	-62.4	-35.6	0	0	0	111.7	L569 L585 K716 A717 S724 A840	L569-N720 HydrophobicContact CD2-CB 4.18Å; L585-N720 HydrophobicContact CD2-CB 3.92Å; L585-N720 HydrophobicContact CG-CB 4.46Å; K716-N720 PolarHBondContact O-N 3.35Å; K716-N720 PolarHBondContact O-ND2 2.72Å; K716-N720 VanDerWaalsContact O-ND2 3.08Å; A717-N720 PolarHBondContact O-N 2.63Å; N720-S724 VanDerWaalsContact O-CB 3.25Å; N720-S724 WeakPolarHBondContact O-CB 2.99Å; N720-S724 PolarHBondContact O-N 2.91Å; N720-S724 PolarHBondContact O-OG 3.49Å; N720-A840 WeakPolarHBondContact OD1-CB 3.34Å
721	L	94.8	Very high	93.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-42	174.7	-177.9	62.4	0	0	0	111.2	L566 L585 C627 A717 L718 A719 S724 M725	L566-L721 HydrophobicContact CD1-CD2 4.28Å; L566-L721 HydrophobicContact CD2-CD1 3.99Å; L566-L721 HydrophobicContact CD2-CD2 4.46Å; L585-L721 HydrophobicContact CD1-CB 4.38Å; L585-L721 HydrophobicContact CD1-CD1 3.9Å; C627-L721 HydrophobicContact CB-CD1 4.27Å; A717-L721 WeakPolarHBondContact O-CB 3.27Å; A717-L721 PolarHBondContact O-N 3.02Å; L718-L721 PolarHBondContact O-N 3.01Å; A719-L721 VanDerWaalsContact C-N 3.33Å; L721-S724 PolarHBondContact O-N 3.32Å; L721-M725 HydrophobicContact CD1-CE 3.83Å; L721-M725 HydrophobicContact CD1-CG 3.66Å; L721-M725 HydrophobicContact CD1-SD 4.11Å; L721-M725 HydrophobicContact CG-CG 4.14Å; L721-M725 WeakPolarHBondContact O-CB 3.37Å; L721-M725 VanDerWaalsContact O-CG 3.27Å; L721-M725 WeakPolarHBondContact O-CG 3.33Å; L721-M725 PolarHBondContact O-N 3.22Å
722	Q	95	Very high	93.7	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-54.4	-58.7	174.7	-168.3	-68.3	-44	0	0	111.4	L718 A719 S724 M725 E726 A780 C783 L784 L841 K845	L718-Q722 WeakPolarHBondContact O-CB 3.29Å; L718-Q722 PolarHBondContact O-N 2.76Å; A719-Q722 WeakPolarHBondContact O-CB 3.41Å; A719-Q722 PolarHBondContact O-N 3.49Å; Q722-S724 VanDerWaalsContact C-N 3.26Å; Q722-S724 PolarHBondContact O-N 3.38Å; Q722-M725 PolarHBondContact O-N 3.41Å; Q722-E726 PolarHBondContact NE2-OE2 3.31Å; Q722-E726 PolarHBondContact O-N 2.66Å; Q722-E726 VanDerWaalsContact O-N 3.12Å; Q722-A780 WeakPolarHBondContact CG-O 3.3Å; Q722-C783 HydrophobicContact CB-CB 3.88Å; Q722-C783 HydrophobicContact CG-CB 4.24Å; Q722-L784 HydrophobicContact CG-CB 3.99Å; Q722-L841 HydrophobicContact CB-CD2 4.34Å; Q722-K845 VanDerWaalsContact OE1-CD 3.28Å
723	E	94.1	Very high	93.7	Very high	5 Å²	5	25.3 Å²	25.3	2%	0.023	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-38.5	-178.3	-70.4	-67.7	163.2	0	0	111.6	R582 A719 W727 L841 Q842 K845	R582-E723 HydrophobicContact CB-CG 4.49Å; A719-E723 PolarHBondContact O-N 2.9Å; E723-W727 WeakPolarHBondContact O-CB 3.47Å; E723-W727 PolarHBondContact O-N 2.95Å; E723-L841 HydrophobicContact CG-CD2 4.06Å; E723-L841 WeakPolarHBondContact OE1-CA 3.26Å; E723-Q842 WeakPolarHBondContact OE1-CG 3.29Å; E723-Q842 PolarHBondContact OE1-N 3.34Å; E723-Q842 PolarHBondContact OE2-NE2 3.06Å; E723-K845 WeakPolarHBondContact OE1-CD 3.39Å; E723-K845 IonicContact OE1-NZ 3.57Å; E723-K845 PolarHBondContact OE1-NZ 2.88Å; E723-K845 IonicContact OE2-NZ 3.84Å; E723-K845 PolarHBondContact OE2-NZ 3.41Å
724	S	95.6	Very high	93.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.5	-41.3	-177.6	-55.8	0	0	0	0	112.8	L584 L585 T588 N720 L721 Q722 L728	L584-S724 WeakPolarHBondContact CA-OG 3.24Å; L585-S724 WeakPolarHBondContact CG-OG 3.4Å; L585-S724 PolarHBondContact N-OG 3.19Å; T588-S724 WeakPolarHBondContact CG2-O 3.44Å; T588-S724 WeakPolarHBondContact OG1-CB 3.43Å; N720-S724 VanDerWaalsContact O-CB 3.25Å; N720-S724 WeakPolarHBondContact O-CB 2.99Å; N720-S724 PolarHBondContact O-N 2.91Å; N720-S724 PolarHBondContact O-OG 3.49Å; L721-S724 PolarHBondContact O-N 3.32Å; Q722-S724 VanDerWaalsContact C-N 3.26Å; Q722-S724 PolarHBondContact O-N 3.38Å; S724-L728 WeakPolarHBondContact O-CB 3.32Å; S724-L728 PolarHBondContact O-N 2.99Å
725	M	95.7	Very high	93	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-71.5	-37.6	-179.9	-67.8	-50.9	99.3	0	0	111.6	T588 Y623 C627 L721 Q722 L728 A729 F776 I779 A780	T588-M725 HydrophobicContact CG2-CE 4.06Å; T588-M725 WeakPolarHBondContact OG1-CE 3.49Å; Y623-M725 HydrophobicContact CE1-CE 3.77Å; Y623-M725 HydrophobicContact CE1-SD 4.31Å; Y623-M725 WeakPolarHBondContact OH-CE 3.5Å; C627-M725 HydrophobicContact CB-SD 4.08Å; L721-M725 HydrophobicContact CD1-CE 3.83Å; L721-M725 HydrophobicContact CD1-CG 3.66Å; L721-M725 HydrophobicContact CD1-SD 4.11Å; L721-M725 HydrophobicContact CG-CG 4.14Å; L721-M725 WeakPolarHBondContact O-CB 3.37Å; L721-M725 VanDerWaalsContact O-CG 3.27Å; L721-M725 WeakPolarHBondContact O-CG 3.33Å; L721-M725 PolarHBondContact O-N 3.22Å; Q722-M725 PolarHBondContact O-N 3.41Å; M725-L728 PolarHBondContact O-N 3.32Å; M725-A729 VanDerWaalsContact O-CB 3.28Å; M725-A729 WeakPolarHBondContact O-CB 3.37Å; M725-A729 PolarHBondContact O-N 2.92Å; M725-F776 HydrophobicContact SD-CD1 3.56Å; M725-F776 VanDerWaalsContact SD-CD1 3.56Å; M725-F776 HydrophobicContact SD-CE1 4.1Å; M725-I779 HydrophobicContact CG-CB 4.42Å; M725-I779 HydrophobicContact CG-CG2 3.94Å; M725-A780 HydrophobicContact CB-CB 4Å
726	E	94.4	Very high	92.5	Very high	57 Å²	57	26.8 Å²	26.8	27%	0.266	13%	0.127	S	C	.	.	H	α-helix	trans	-66.7	-43.6	173.5	-174.1	-177.9	165.6	0	0	111.8	Q722 L728 A729 G730 A780 K845	Q722-E726 PolarHBondContact NE2-OE2 3.31Å; Q722-E726 PolarHBondContact O-N 2.66Å; Q722-E726 VanDerWaalsContact O-N 3.12Å; E726-L728 PolarHBondContact O-N 2.97Å; E726-A729 PolarHBondContact O-N 3.48Å; E726-G730 PolarHBondContact O-N 2.92Å; E726-A780 HydrophobicContact CB-CB 3.96Å; E726-K845 IonicContact OE1-NZ 2.81Å; E726-K845 WeakPolarHBondContact OE2-CE 3.31Å; E726-K845 IonicContact OE2-NZ 2.8Å; E726-K845 PolarHBondContact OE2-NZ 2.7Å
727	W	94.9	Very high	91.9	Very high	36 Å²	36	27.5 Å²	27.5	14%	0.136	14%	0.138	C	C	.	.	H	α-helix	trans	-58.6	-46.5	174.9	175.8	85	0	0	0	111.6	L578 L584 T588 V589 E592 E723 G730 R731	L578-W727 HydrophobicContact CD1-CH2 4.2Å; L578-W727 HydrophobicContact CD1-CZ2 3.89Å; L578-W727 HydrophobicContact CD2-CZ2 4.19Å; L578-W727 HydrophobicContact CG-CZ2 4.48Å; L584-W727 HydrophobicContact CD1-CD2 3.6Å; L584-W727 HydrophobicContact CD1-CE3 3.97Å; L584-W727 HydrophobicContact CD1-CG 3.9Å; L584-W727 HydrophobicContact CD1-CZ2 4.19Å; L584-W727 HydrophobicContact CD1-CZ3 4.41Å; L584-W727 HydrophobicContact CD2-CB 3.92Å; L584-W727 HydrophobicContact CD2-CD2 4.4Å; L584-W727 HydrophobicContact CD2-CG 4.04Å; T588-W727 HydrophobicContact CG2-CE3 3.92Å; T588-W727 HydrophobicContact CG2-CZ3 4.03Å; V589-W727 HydrophobicContact CG2-CH2 4.49Å; V589-W727 HydrophobicContact CG2-CZ3 4.48Å; E592-W727 HydrophobicContact CB-CH2 3.69Å; E592-W727 HydrophobicContact CB-CZ3 3.7Å; E592-W727 HydrophobicContact CG-CH2 3.63Å; E592-W727 HydrophobicContact CG-CZ3 3.93Å; E723-W727 WeakPolarHBondContact O-CB 3.47Å; E723-W727 PolarHBondContact O-N 2.95Å; W727-G730 PolarHBondContact O-N 3.39Å; W727-R731 HydrophobicContact CD2-CG 4.27Å; W727-R731 HydrophobicContact CH2-CG 4.45Å; W727-R731 HydrophobicContact CZ2-CG 4.04Å; W727-R731 WeakPolarHBondContact O-CG 3.3Å; W727-R731 PolarHBondContact O-N 3.01Å
728	L	95.3	Very high	91	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-47	176.5	-177.5	63.4	0	0	0	111.3	T588 E592 Y623 S724 M725 E726 G730 R731 L732 F776	T588-L728 HydrophobicContact CG2-CB 3.72Å; T588-L728 HydrophobicContact CG2-CD1 4.46Å; T588-L728 HydrophobicContact CG2-CD2 4.07Å; T588-L728 HydrophobicContact CG2-CG 4.29Å; E592-L728 HydrophobicContact CB-CD1 4.01Å; E592-L728 HydrophobicContact CG-CD1 4.27Å; Y623-L728 HydrophobicContact CD1-CD2 3.92Å; Y623-L728 HydrophobicContact CE1-CD2 3.81Å; S724-L728 WeakPolarHBondContact O-CB 3.32Å; S724-L728 PolarHBondContact O-N 2.99Å; M725-L728 PolarHBondContact O-N 3.32Å; E726-L728 PolarHBondContact O-N 2.97Å; L728-G730 VanDerWaalsContact C-N 3.29Å; L728-G730 PolarHBondContact O-N 2.87Å; L728-R731 PolarHBondContact O-N 2.7Å; L728-L732 HydrophobicContact CD1-CD1 4.15Å; L728-L732 HydrophobicContact CD1-CD2 4.34Å; L728-L732 HydrophobicContact CD1-CG 3.99Å; L728-L732 HydrophobicContact CD2-CD1 4.42Å; L728-L732 HydrophobicContact CG-CD1 3.85Å; L728-L732 HydrophobicContact CG-CG 4.13Å; L728-L732 WeakPolarHBondContact O-CB 3.4Å; L728-L732 VanDerWaalsContact O-CG 3.24Å; L728-L732 WeakPolarHBondContact O-CG 3.46Å; L728-L732 PolarHBondContact O-N 3.3Å; L728-F776 HydrophobicContact CD2-CD1 4.15Å; L728-F776 HydrophobicContact CD2-CD2 4.36Å; L728-F776 HydrophobicContact CD2-CE1 4.04Å; L728-F776 HydrophobicContact CD2-CE2 4.32Å; L728-F776 HydrophobicContact CD2-CG 4.29Å; L728-F776 HydrophobicContact CD2-CZ 4.13Å
729	A	95	Very high	90	Very high	1 Å²	1	32 Å²	32	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-57.9	-41.5	176.9	0	0	0	0	0	112	M725 E726 R733 S773 F776 Q777	M725-A729 VanDerWaalsContact O-CB 3.28Å; M725-A729 WeakPolarHBondContact O-CB 3.37Å; M725-A729 PolarHBondContact O-N 2.92Å; E726-A729 PolarHBondContact O-N 3.48Å; A729-R733 VanDerWaalsContact O-CB 3.27Å; A729-R733 WeakPolarHBondContact O-CB 3.4Å; A729-R733 PolarHBondContact O-N 3.15Å; A729-S773 WeakPolarHBondContact CB-O 3.45Å; A729-S773 PolarHBondContact O-OG 3.33Å; A729-S773 VanDerWaalsContact O-OG 3.1Å; A729-F776 HydrophobicContact CB-CB 4.04Å; A729-Q777 HydrophobicContact CB-CB 4.19Å
730	G	92	Very high	88.3	Confident	28 Å²	28	35.6 Å²	35.6	29%	0.289	19%	0.185	S	C	.	.	H	α-helix	trans	-62.4	-46	174.5	0	0	0	0	0	113.1	E726 W727 L728 S734	E726-G730 PolarHBondContact O-N 2.92Å; W727-G730 PolarHBondContact O-N 3.39Å; L728-G730 VanDerWaalsContact C-N 3.29Å; L728-G730 PolarHBondContact O-N 2.87Å; G730-S734 PolarHBondContact O-N 3.19Å; G730-S734 VanDerWaalsContact O-N 3.14Å
731	R	91.8	Very high	86.2	Confident	75 Å²	75	43.3 Å²	43.3	28%	0.283	22%	0.221	S	C	.	.	H	α-helix	trans	-60.9	-53.2	175.6	-74.4	-70.5	-179.1	120.1	-8.9	111.7	E592 W727 L728 R733 S734 F735	E592-R731 HydrophobicContact CG-CB 4.31Å; E592-R731 HydrophobicContact CG-CG 4.38Å; E592-R731 WeakPolarHBondContact OE1-CD 3.47Å; E592-R731 IonicContact OE1-CZ 2.61Å; E592-R731 IonicContact OE1-NE 2.96Å; E592-R731 IonicContact OE1-NH1 3.99Å; E592-R731 PolarHBondContact OE1-NH1 3.02Å; W727-R731 HydrophobicContact CD2-CG 4.27Å; W727-R731 HydrophobicContact CH2-CG 4.45Å; W727-R731 HydrophobicContact CZ2-CG 4.04Å; W727-R731 WeakPolarHBondContact O-CG 3.3Å; W727-R731 PolarHBondContact O-N 3.01Å; L728-R731 PolarHBondContact O-N 2.7Å; R731-R733 PolarHBondContact O-N 3.03Å; R731-S734 WeakPolarHBondContact O-CB 3.43Å; R731-S734 PolarHBondContact O-N 3.36Å; R731-S734 VanDerWaalsContact O-N 3.09Å; R731-F735 HydrophobicContact CB-CD2 4.47Å; R731-F735 HydrophobicContact CB-CE2 4.01Å; R731-F735 WeakPolarHBondContact O-CD2 3.33Å; R731-F735 WeakPolarHBondContact O-CG 3.22Å; R731-F735 PolarHBondContact O-N 2.76Å
732	L	92.1	Very high	84	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-46.9	179.4	-68.9	179.5	0	0	0	112	I595 L620 L728 S734 F735 F736 F776	I595-L732 HydrophobicContact CD1-CD2 4.08Å; I595-L732 HydrophobicContact CG2-CD2 4.4Å; L620-L732 HydrophobicContact CD1-CD1 3.94Å; L620-L732 HydrophobicContact CD1-CD2 4.02Å; L620-L732 HydrophobicContact CD2-CD1 3.71Å; L620-L732 HydrophobicContact CD2-CD2 4.2Å; L620-L732 HydrophobicContact CG-CD1 4.5Å; L728-L732 HydrophobicContact CD1-CD1 4.15Å; L728-L732 HydrophobicContact CD1-CD2 4.34Å; L728-L732 HydrophobicContact CD1-CG 3.99Å; L728-L732 HydrophobicContact CD2-CD1 4.42Å; L728-L732 HydrophobicContact CG-CD1 3.85Å; L728-L732 HydrophobicContact CG-CG 4.13Å; L728-L732 WeakPolarHBondContact O-CB 3.4Å; L728-L732 VanDerWaalsContact O-CG 3.24Å; L728-L732 WeakPolarHBondContact O-CG 3.46Å; L728-L732 PolarHBondContact O-N 3.3Å; L732-S734 VanDerWaalsContact C-N 3.31Å; L732-S734 PolarHBondContact O-N 2.94Å; L732-F735 PolarHBondContact O-N 3.11Å; L732-F735 VanDerWaalsContact O-N 3.16Å; L732-F736 HydrophobicContact CB-CD2 4.29Å; L732-F736 HydrophobicContact CB-CE2 3.67Å; L732-F736 HydrophobicContact CB-CZ 4.05Å; L732-F736 HydrophobicContact CD2-CE2 4.32Å; L732-F736 HydrophobicContact CD2-CZ 3.83Å; L732-F736 HydrophobicContact CG-CE2 4.4Å; L732-F736 HydrophobicContact CG-CZ 4.39Å; L732-F736 WeakPolarHBondContact O-CD2 3.39Å; L732-F736 WeakPolarHBondContact O-CG 3.46Å; L732-F736 PolarHBondContact O-N 3.05Å; L732-F776 HydrophobicContact CD1-CD2 3.85Å; L732-F776 HydrophobicContact CD1-CE2 4Å
733	R	90.1	Very high	81.8	Confident	149 Å²	149	51.4 Å²	51.4	56%	0.562	27%	0.267	S	S	*	.	H	α-helix	trans	-57	-43.3	175.1	-178.6	168.8	58.4	-154.3	-5.9	112	A729 R731 F736 T737 S773	A729-R733 VanDerWaalsContact O-CB 3.27Å; A729-R733 WeakPolarHBondContact O-CB 3.4Å; A729-R733 PolarHBondContact O-N 3.15Å; R731-R733 PolarHBondContact O-N 3.03Å; R733-F736 PolarHBondContact O-N 3.36Å; R733-T737 WeakPolarHBondContact O-CG2 3.18Å; R733-T737 PolarHBondContact O-N 2.71Å; R733-T737 VanDerWaalsContact O-N 3.08Å; R733-T737 PolarHBondContact O-OG1 3.08Å; R733-S773 PolarHBondContact N-OG 3.27Å
734	S	86.8	Confident	79.1	Confident	63 Å²	63	56.8 Å²	56.8	44%	0.441	31%	0.305	S	S	.	.	H	α-helix	trans	-65	-38.5	176.8	-172.7	0	0	0	0	112.9	G730 R731 L732 T737 N738	G730-S734 PolarHBondContact O-N 3.19Å; G730-S734 VanDerWaalsContact O-N 3.14Å; R731-S734 WeakPolarHBondContact O-CB 3.43Å; R731-S734 PolarHBondContact O-N 3.36Å; R731-S734 VanDerWaalsContact O-N 3.09Å; L732-S734 VanDerWaalsContact C-N 3.31Å; L732-S734 PolarHBondContact O-N 2.94Å; S734-T737 PolarHBondContact O-OG1 3.29Å; S734-N738 PolarHBondContact O-ND2 3.17Å; S734-N738 VanDerWaalsContact O-ND2 3.12Å
735	F	83.4	Confident	76.2	Confident	42 Å²	42	61.3 Å²	61.3	18%	0.184	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-45.8	175.6	-64.2	-51.2	0	0	0	112.1	E592 Q596 R731 L732 T737 N738 L739	E592-F735 HydrophobicContact CG-CE2 4.5Å; Q596-F735 VanDerWaalsContact OE1-CZ 3.25Å; R731-F735 HydrophobicContact CB-CD2 4.47Å; R731-F735 HydrophobicContact CB-CE2 4.01Å; R731-F735 WeakPolarHBondContact O-CD2 3.33Å; R731-F735 WeakPolarHBondContact O-CG 3.22Å; R731-F735 PolarHBondContact O-N 2.76Å; L732-F735 PolarHBondContact O-N 3.11Å; L732-F735 VanDerWaalsContact O-N 3.16Å; F735-T737 VanDerWaalsContact C-N 3.34Å; F735-T737 PolarHBondContact O-N 2.83Å; F735-N738 PolarHBondContact O-N 2.81Å; F735-L739 PolarHBondContact O-N 2.8Å
736	F	82.1	Confident	73.1	Confident	22 Å²	22	66.5 Å²	66.5	10%	0.096	38%	0.377	C	S	.	.	H	α-helix	trans	-71	-26.8	-176.7	-55.3	-30	0	0	0	113.2	L620 L732 R733 N738 P740 L769	L620-F736 HydrophobicContact CD1-CZ 4.04Å; L732-F736 HydrophobicContact CB-CD2 4.29Å; L732-F736 HydrophobicContact CB-CE2 3.67Å; L732-F736 HydrophobicContact CB-CZ 4.05Å; L732-F736 HydrophobicContact CD2-CE2 4.32Å; L732-F736 HydrophobicContact CD2-CZ 3.83Å; L732-F736 HydrophobicContact CG-CE2 4.4Å; L732-F736 HydrophobicContact CG-CZ 4.39Å; L732-F736 WeakPolarHBondContact O-CD2 3.39Å; L732-F736 WeakPolarHBondContact O-CG 3.46Å; L732-F736 PolarHBondContact O-N 3.05Å; R733-F736 PolarHBondContact O-N 3.36Å; F736-N738 VanDerWaalsContact C-N 3.34Å; F736-P740 WeakPolarHBondContact O-CD 3.44Å; F736-L769 HydrophobicContact CD1-CB 4.25Å; F736-L769 HydrophobicContact CD1-CD1 4.2Å; F736-L769 HydrophobicContact CD2-CB 3.92Å; F736-L769 HydrophobicContact CE1-CB 4.02Å; F736-L769 HydrophobicContact CE1-CD1 3.9Å; F736-L769 HydrophobicContact CE1-CD2 4.03Å; F736-L769 HydrophobicContact CE1-CG 4.2Å; F736-L769 HydrophobicContact CE2-CB 3.65Å; F736-L769 HydrophobicContact CE2-CD2 4.4Å; F736-L769 VanDerWaalsContact CE2-O 3.25Å; F736-L769 WeakPolarHBondContact CE2-O 3.03Å; F736-L769 HydrophobicContact CG-CB 4.23Å; F736-L769 HydrophobicContact CZ-CB 3.72Å; F736-L769 HydrophobicContact CZ-CD1 4.33Å; F736-L769 HydrophobicContact CZ-CD2 3.71Å; F736-L769 HydrophobicContact CZ-CG 4.11Å
737	T	80.3	Confident	70.1	Confident	91 Å²	91	69.2 Å²	69.2	56%	0.558	40%	0.4	S	S	*	.	H	α-helix	trans	-69.8	-27.7	171.8	46.1	0	0	0	0	113.7	R733 S734 F735 P740	R733-T737 WeakPolarHBondContact O-CG2 3.18Å; R733-T737 PolarHBondContact O-N 2.71Å; R733-T737 VanDerWaalsContact O-N 3.08Å; R733-T737 PolarHBondContact O-OG1 3.08Å; S734-T737 PolarHBondContact O-OG1 3.29Å; F735-T737 VanDerWaalsContact C-N 3.34Å; F735-T737 PolarHBondContact O-N 2.83Å; T737-P740 WeakPolarHBondContact O-CD 3.24Å
738	N	75.6	Confident	66.9	Low	94 Å²	94	73 Å²	73	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-85.7	-19.7	179.7	-67	-24.8	0	0	0	112.9	S734 F735 F736 P740	S734-N738 PolarHBondContact O-ND2 3.17Å; S734-N738 VanDerWaalsContact O-ND2 3.12Å; F735-N738 PolarHBondContact O-N 2.81Å; F736-N738 VanDerWaalsContact C-N 3.34Å; N738-P740 VanDerWaalsContact C-CD 3.49Å
739	L	73	Confident	64	Low	2 Å²	2	78.1 Å²	78.1	1%	0.01	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-66.7	-30.5	-174	-169.8	54.7	0	0	0	116.6	M599 M602 L613 F735 Q741 R762 L766	M599-L739 HydrophobicContact CE-CD1 3.93Å; M599-L739 HydrophobicContact CE-CD2 4.26Å; M602-L739 HydrophobicContact CE-CD1 3.65Å; M602-L739 HydrophobicContact SD-CD1 4.05Å; L613-L739 HydrophobicContact CD1-CD2 4.14Å; L613-L739 HydrophobicContact CD2-CD2 3.57Å; F735-L739 PolarHBondContact O-N 2.8Å; L739-Q741 VanDerWaalsContact C-N 3.33Å; L739-Q741 PolarHBondContact O-N 3.25Å; L739-R762 PolarHBondContact O-NH2 3.09Å; L739-L766 HydrophobicContact CD2-CD2 3.41Å; L739-L766 VanDerWaalsContact CD2-CD2 3.41Å; L739-L766 HydrophobicContact CG-CD2 4.03Å
740	P	58	Low	61.2	Low	75 Å²	75	82.9 Å²	82.9	49%	0.487	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-66.7	-28.9	178.9	-24	35.6	0	0	0	114.3	F736 T737 N738 M742	F736-P740 WeakPolarHBondContact O-CD 3.44Å; T737-P740 WeakPolarHBondContact O-CD 3.24Å; N738-P740 VanDerWaalsContact C-CD 3.49Å; P740-M742 VanDerWaalsContact C-N 3.3Å; P740-M742 PolarHBondContact O-N 3.22Å
741	Q	50.3	Low	58.4	Low	168 Å²	168	87 Å²	87	79%	0.785	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-72.6	-22.7	-177.2	-70.1	-178.4	-17.4	0	0	113.1	L739	L739-Q741 VanDerWaalsContact C-N 3.33Å; L739-Q741 PolarHBondContact O-N 3.25Å
742	M	49.3	Very low	55.7	Low	109 Å²	109	89 Å²	89	54%	0.537	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-78.9	-19	-173.9	-73.6	-179.7	150.2	0	0	114.9	Q603 P740	Q603-M742 HydrophobicContact CG-CE 4.31Å; Q603-M742 HydrophobicContact CG-SD 4.43Å; P740-M742 VanDerWaalsContact C-N 3.3Å; P740-M742 PolarHBondContact O-N 3.22Å
743	S	47.5	Very low	53.1	Low	63 Å²	63	98 Å²	98	44%	0.441	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-99.3	9.8	-170.9	57.8	0	0	0	0	116	A745 R762	S743-A745 PolarHBondContact O-N 2.91Å; S743-R762 PolarHBondContact OG-NE 3.32Å; S743-R762 PolarHBondContact OG-NH2 2.89Å
744	S	37.6	Very low	50.6	Low	117 Å²	117	97.5 Å²	97.5	82%	0.818	60%	0.599	S	S	*	*	S	Bend	trans	-73.8	-7.3	177.6	-173.3	0	0	0	0	114.3
745	A	35	Very low	48.3	Very low	95 Å²	95	103 Å²	103	79%	0.785	62%	0.623	S	S	*	*	S	Bend	trans	-115.4	50.7	-165.7	0	0	0	0	0	113.7	S743	S743-A745 PolarHBondContact O-N 2.91Å
746	C	30.3	Very low	45.8	Very low	109 Å²	109	104.3 Å²	104.3	74%	0.736	65%	0.648	S	S	*	*			trans	-148.1	118.2	160.3	-150.4	0	0	0	0	110.4	S748	C746-S748 PolarHBondContact O-N 3.4Å
747	P	31	Very low	43.8	Very low	114 Å²	114	112.6 Å²	112.6	74%	0.74	69%	0.687	S	S	*	*			trans	-68.4	121.3	170.4	28.8	-31.5	0	0	0	108.4	T749	P747-T749 PolarHBondContact O-N 3.29Å
748	S	28.8	Very low	41.9	Very low	117 Å²	117	113.6 Å²	113.6	82%	0.818	70%	0.697	S	S	*	*			trans	-61.1	102.1	174.8	29.6	0	0	0	0	110.2	C746 A750	C746-S748 PolarHBondContact O-N 3.4Å; S748-A750 PolarHBondContact O-N 3Å
749	T	33.9	Very low	40.7	Very low	106 Å²	106	117.2 Å²	117.2	65%	0.65	71%	0.711	S	S	*	*			trans	-63.1	109.2	163.3	49.3	0	0	0	0	107.5	P747 D751	P747-T749 PolarHBondContact O-N 3.29Å; T749-D751 PolarHBondContact O-N 3.37Å
750	A	35.4	Very low	40.1	Very low	102 Å²	102	122.1 Å²	122.1	84%	0.843	73%	0.73	S	S	*	*	S	Bend	trans	-70.8	75.9	179.8	0	0	0	0	0	111.1	S748	S748-A750 PolarHBondContact O-N 3Å
751	D	34.9	Very low	40.8	Very low	115 Å²	115	121 Å²	121	62%	0.615	72%	0.723	S	S	*	*			trans	-157.1	54.2	166.3	-127.5	3.1	0	0	0	110.4	K528 T749	K528-D751 WeakPolarHBondContact CE-OD2 3.49Å; K528-D751 IonicContact NZ-OD1 2.69Å; K528-D751 IonicContact NZ-OD2 2.73Å; K528-D751 PolarHBondContact NZ-OD2 2.9Å; T749-D751 PolarHBondContact O-N 3.37Å
752	S	35.1	Very low	42.2	Very low	115 Å²	115	115.2 Å²	115.2	80%	0.804	69%	0.694	S	S	*	*			trans	-123.3	64.1	167.9	-62.5	0	0	0	0	110.1
753	Q	36.1	Very low	43.8	Very low	190 Å²	190	117.3 Å²	117.3	89%	0.888	70%	0.703	S	S	*	*			trans	-123.4	27.1	173.2	-81.9	-164.1	-20.6	0	0	113
754	V	38.4	Very low	45.6	Very low	138 Å²	138	119.4 Å²	119.4	84%	0.836	71%	0.706	S	S	*	*			trans	-143.4	82.6	168.3	-167	0	0	0	0	111.2
755	L	38.1	Very low	48	Very low	179 Å²	179	113.9 Å²	113.9	94%	0.937	67%	0.667	S	S	*	*	S	Bend	trans	-170.5	145.6	143.5	-99.7	155.5	0	0	0	107.5
756	G	30.5	Very low	50.5	Low	69 Å²	69	111.4 Å²	111.4	71%	0.711	64%	0.64	S	S	*	*			trans	-77.8	151.7	-155.2	0	0	0	0	0	116.6
757	E	40.1	Very low	53.3	Low	197 Å²	197	111 Å²	111	92%	0.921	63%	0.627	S	S	*	*	S	Bend	trans	34.9	117.3	146.9	-58.8	-175.5	153.9	0	0	119.2
758	S	41.6	Very low	56.3	Low	111 Å²	111	107 Å²	107	78%	0.776	60%	0.601	S	S	*	*			trans	89.4	37.4	167.7	-163.8	0	0	0	0	118.9	R760	S758-R760 PolarHBondContact O-N 2.95Å
759	E	48.6	Very low	59.2	Low	171 Å²	171	101.5 Å²	101.5	80%	0.799	56%	0.563	S	S	*	*			trans	-69	111.9	150.7	-75.2	-157	139	0	0	109.6
760	R	61.4	Low	62	Low	105 Å²	105	99.3 Å²	99.3	40%	0.396	55%	0.552	S	S	.	*			trans	-61	140.4	162.7	-79.8	-166.7	-178.1	103.1	6.2	108.7	S758 Q764 I765	S758-R760 PolarHBondContact O-N 2.95Å; R760-Q764 HydrophobicContact CB-CB 4.3Å; R760-I765 HydrophobicContact CB-CD1 4.24Å; R760-I765 HydrophobicContact CB-CG1 3.81Å
761	S	73.3	Confident	64.8	Low	50 Å²	50	97.1 Å²	97.1	35%	0.35	53%	0.526	S	S	.	.			trans	-62.1	145.8	172.1	75.1	0	0	0	0	109.6	E763 Q764 I765	S761-E763 PolarHBondContact O-N 3.26Å; S761-Q764 WeakPolarHBondContact O-CA 3.38Å; S761-Q764 WeakPolarHBondContact O-CB 3.38Å; S761-Q764 PolarHBondContact O-N 2.92Å; S761-Q764 WeakPolarHBondContact OG-CG 3.45Å; S761-Q764 PolarHBondContact OG-N 3.25Å; S761-I765 PolarHBondContact O-N 3.33Å; S761-I765 VanDerWaalsContact O-N 3.12Å
762	R	79.8	Confident	67.6	Low	47 Å²	47	92.2 Å²	92.2	18%	0.177	50%	0.5	C	S	.	.	H	α-helix	trans	-50.9	-35.5	177.4	-179.8	176.8	170.5	81.8	0.2	111.8	L739 S743 I765 L766	L739-R762 PolarHBondContact O-NH2 3.09Å; S743-R762 PolarHBondContact OG-NE 3.32Å; S743-R762 PolarHBondContact OG-NH2 2.89Å; R762-I765 PolarHBondContact O-N 3.41Å; R762-L766 HydrophobicContact CG-CD1 4.18Å; R762-L766 HydrophobicContact CG-CG 4.46Å; R762-L766 VanDerWaalsContact O-CG 3.27Å; R762-L766 WeakPolarHBondContact O-CG 3.48Å; R762-L766 PolarHBondContact O-N 2.79Å
763	E	81.9	Confident	70.5	Confident	154 Å²	154	87.2 Å²	87.2	72%	0.72	47%	0.465	S	S	*	.	H	α-helix	trans	-62.3	-43.7	174.5	-62.9	172.7	171.8	0	0	112.9	S761 I765 L766 Q767	S761-E763 PolarHBondContact O-N 3.26Å; E763-I765 VanDerWaalsContact C-N 3.31Å; E763-I765 PolarHBondContact O-N 3.09Å; E763-L766 PolarHBondContact O-N 3.13Å; E763-Q767 WeakPolarHBondContact O-CB 3.36Å; E763-Q767 PolarHBondContact O-N 3.11Å
764	Q	86.6	Confident	73.3	Confident	106 Å²	106	85.1 Å²	85.1	50%	0.495	45%	0.449	S	S	.	.	H	α-helix	trans	-64.4	-35.6	174.9	-69.8	166.6	-1.8	0	0	112.1	R760 S761 T768	R760-Q764 HydrophobicContact CB-CB 4.3Å; S761-Q764 WeakPolarHBondContact O-CA 3.38Å; S761-Q764 WeakPolarHBondContact O-CB 3.38Å; S761-Q764 PolarHBondContact O-N 2.92Å; S761-Q764 WeakPolarHBondContact OG-CG 3.45Å; S761-Q764 PolarHBondContact OG-N 3.25Å; Q764-T768 WeakPolarHBondContact O-CB 3.39Å; Q764-T768 PolarHBondContact O-N 3.09Å; Q764-T768 PolarHBondContact O-OG1 3.25Å
765	I	87.3	Confident	76	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-67.6	-48.4	175.6	-58.4	169.1	0	0	0	109.8	N610 L613 E614 R760 S761 R762 E763 Q767 T768 L769	N610-I765 HydrophobicContact CB-CD1 4.22Å; L613-I765 HydrophobicContact CB-CG2 3.66Å; E614-I765 HydrophobicContact CG-CD1 3.78Å; E614-I765 HydrophobicContact CG-CG1 4.22Å; R760-I765 HydrophobicContact CB-CD1 4.24Å; R760-I765 HydrophobicContact CB-CG1 3.81Å; S761-I765 PolarHBondContact O-N 3.33Å; S761-I765 VanDerWaalsContact O-N 3.12Å; R762-I765 PolarHBondContact O-N 3.41Å; E763-I765 VanDerWaalsContact C-N 3.31Å; E763-I765 PolarHBondContact O-N 3.09Å; I765-Q767 VanDerWaalsContact C-N 3.33Å; I765-Q767 PolarHBondContact O-N 2.89Å; I765-T768 WeakPolarHBondContact O-CB 3.4Å; I765-T768 PolarHBondContact O-N 2.71Å; I765-T768 VanDerWaalsContact O-N 3.16Å; I765-L769 HydrophobicContact CG2-CD1 4.34Å; I765-L769 WeakPolarHBondContact O-CG 3.15Å; I765-L769 PolarHBondContact O-N 3.33Å
766	L	87.3	Confident	78.8	Confident	42 Å²	42	70.1 Å²	70.1	22%	0.22	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-39.3	176.3	-68.7	173.6	0	0	0	112.5	L739 R762 E763 L769 S770	L739-L766 HydrophobicContact CD2-CD2 3.41Å; L739-L766 VanDerWaalsContact CD2-CD2 3.41Å; L739-L766 HydrophobicContact CG-CD2 4.03Å; R762-L766 HydrophobicContact CG-CD1 4.18Å; R762-L766 HydrophobicContact CG-CG 4.46Å; R762-L766 VanDerWaalsContact O-CG 3.27Å; R762-L766 WeakPolarHBondContact O-CG 3.48Å; R762-L766 PolarHBondContact O-N 2.79Å; E763-L766 PolarHBondContact O-N 3.13Å; L766-L769 PolarHBondContact O-N 2.7Å; L766-S770 PolarHBondContact O-N 3.27Å
767	Q	89.6	Confident	81.8	Confident	100 Å²	100	68.6 Å²	68.6	47%	0.467	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-45.9	173.3	-177.1	55.2	50	0	0	111	E763 I765 L769 S770 D771	E763-Q767 WeakPolarHBondContact O-CB 3.36Å; E763-Q767 PolarHBondContact O-N 3.11Å; I765-Q767 VanDerWaalsContact C-N 3.33Å; I765-Q767 PolarHBondContact O-N 2.89Å; Q767-L769 VanDerWaalsContact C-N 3.29Å; Q767-L769 PolarHBondContact O-N 2.73Å; Q767-S770 WeakPolarHBondContact O-CB 3.34Å; Q767-S770 PolarHBondContact O-N 3.29Å; Q767-S770 VanDerWaalsContact O-N 3.15Å; Q767-D771 VanDerWaalsContact NE2-CG 3.25Å; Q767-D771 PolarHBondContact NE2-OD1 2.99Å; Q767-D771 PolarHBondContact NE2-OD2 3.25Å; Q767-D771 VanDerWaalsContact O-CG 3.3Å; Q767-D771 PolarHBondContact O-N 3.39Å
768	T	92.7	Very high	84.4	Confident	32 Å²	32	62.9 Å²	62.9	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-58.2	-40.6	175.3	-57.1	0	0	0	0	111.8	Q764 I765 D771 L772	Q764-T768 WeakPolarHBondContact O-CB 3.39Å; Q764-T768 PolarHBondContact O-N 3.09Å; Q764-T768 PolarHBondContact O-OG1 3.25Å; I765-T768 WeakPolarHBondContact O-CB 3.4Å; I765-T768 PolarHBondContact O-N 2.71Å; I765-T768 VanDerWaalsContact O-N 3.16Å; T768-D771 PolarHBondContact O-N 3.44Å; T768-L772 HydrophobicContact CG2-CD1 4.04Å; T768-L772 WeakPolarHBondContact O-CB 3.48Å; T768-L772 WeakPolarHBondContact O-CD1 3.35Å; T768-L772 VanDerWaalsContact O-CG 3.24Å; T768-L772 WeakPolarHBondContact O-CG 3.49Å; T768-L772 PolarHBondContact O-N 2.8Å
769	L	91.3	Very high	86.9	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.8	-41.7	176.2	-71.5	172.7	0	0	0	112.2	L613 V616 C617 L620 F736 I765 L766 Q767 L772 S773	L613-L769 HydrophobicContact CD2-CD1 3.99Å; V616-L769 HydrophobicContact CB-CD2 4.42Å; V616-L769 HydrophobicContact CG1-CD2 3.76Å; C617-L769 HydrophobicContact CB-CD2 4.44Å; C617-L769 WeakPolarHBondContact SG-CD2 3.46Å; C617-L769 VanDerWaalsContact SG-CG 3.58Å; L620-L769 HydrophobicContact CD1-CD2 4.01Å; F736-L769 HydrophobicContact CD1-CB 4.25Å; F736-L769 HydrophobicContact CD1-CD1 4.2Å; F736-L769 HydrophobicContact CD2-CB 3.92Å; F736-L769 HydrophobicContact CE1-CB 4.02Å; F736-L769 HydrophobicContact CE1-CD1 3.9Å; F736-L769 HydrophobicContact CE1-CD2 4.03Å; F736-L769 HydrophobicContact CE1-CG 4.2Å; F736-L769 HydrophobicContact CE2-CB 3.65Å; F736-L769 HydrophobicContact CE2-CD2 4.4Å; F736-L769 VanDerWaalsContact CE2-O 3.25Å; F736-L769 WeakPolarHBondContact CE2-O 3.03Å; F736-L769 HydrophobicContact CG-CB 4.23Å; F736-L769 HydrophobicContact CZ-CB 3.72Å; F736-L769 HydrophobicContact CZ-CD1 4.33Å; F736-L769 HydrophobicContact CZ-CD2 3.71Å; F736-L769 HydrophobicContact CZ-CG 4.11Å; I765-L769 HydrophobicContact CG2-CD1 4.34Å; I765-L769 WeakPolarHBondContact O-CG 3.15Å; I765-L769 PolarHBondContact O-N 3.33Å; L766-L769 PolarHBondContact O-N 2.7Å; Q767-L769 VanDerWaalsContact C-N 3.29Å; Q767-L769 PolarHBondContact O-N 2.73Å; L769-L772 PolarHBondContact O-N 3.35Å; L769-S773 PolarHBondContact O-N 3.42Å
770	S	92.1	Very high	89.1	Confident	60 Å²	60	49.9 Å²	49.9	42%	0.42	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-43.1	173	-168.9	0	0	0	0	112	L766 Q767 L772 S773 R774	L766-S770 PolarHBondContact O-N 3.27Å; Q767-S770 WeakPolarHBondContact O-CB 3.34Å; Q767-S770 PolarHBondContact O-N 3.29Å; Q767-S770 VanDerWaalsContact O-N 3.15Å; S770-L772 VanDerWaalsContact C-N 3.34Å; S770-L772 PolarHBondContact O-N 3.39Å; S770-S773 WeakPolarHBondContact O-CB 3.24Å; S770-S773 PolarHBondContact O-N 3.37Å; S770-R774 PolarHBondContact O-N 3.02Å
771	D	93.9	Very high	90.7	Very high	57 Å²	57	46.5 Å²	46.5	31%	0.305	23%	0.232	S	C	.	.	H	α-helix	trans	-67.6	-32.7	177.2	-68.7	-35.7	0	0	0	112.8	Q767 T768 R774 G775	Q767-D771 VanDerWaalsContact NE2-CG 3.25Å; Q767-D771 PolarHBondContact NE2-OD1 2.99Å; Q767-D771 PolarHBondContact NE2-OD2 3.25Å; Q767-D771 VanDerWaalsContact O-CG 3.3Å; Q767-D771 PolarHBondContact O-N 3.39Å; T768-D771 PolarHBondContact O-N 3.44Å; D771-R774 IonicContact OD1-CZ 3.68Å; D771-R774 IonicContact OD1-NE 2.64Å; D771-R774 IonicContact OD1-NH2 3.72Å; D771-R774 PolarHBondContact OD1-NH2 3.17Å; D771-G775 PolarHBondContact O-N 2.73Å
772	L	94.6	Very high	91.7	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-45.8	170.7	-73.6	163.1	0	0	0	111.3	C617 L620 K621 K624 T768 L769 S770 R774 G775 F776	C617-L772 HydrophobicContact CB-CD1 4.44Å; L620-L772 HydrophobicContact CB-CD1 3.94Å; K621-L772 HydrophobicContact CG-CD1 4.1Å; K621-L772 HydrophobicContact CG-CD2 3.73Å; K624-L772 HydrophobicContact CD-CD2 4.2Å; T768-L772 HydrophobicContact CG2-CD1 4.04Å; T768-L772 WeakPolarHBondContact O-CB 3.48Å; T768-L772 WeakPolarHBondContact O-CD1 3.35Å; T768-L772 VanDerWaalsContact O-CG 3.24Å; T768-L772 WeakPolarHBondContact O-CG 3.49Å; T768-L772 PolarHBondContact O-N 2.8Å; L769-L772 PolarHBondContact O-N 3.35Å; S770-L772 VanDerWaalsContact C-N 3.34Å; S770-L772 PolarHBondContact O-N 3.39Å; L772-R774 VanDerWaalsContact C-N 3.34Å; L772-R774 PolarHBondContact O-N 3.4Å; L772-G775 CarbonylContact O-C 3.58Å; L772-G775 WeakPolarHBondContact O-CA 3.5Å; L772-G775 PolarHBondContact O-N 3.43Å; L772-F776 WeakPolarHBondContact O-CD2 3.47Å; L772-F776 PolarHBondContact O-N 2.69Å
773	S	95	Very high	92.4	Very high	10 Å²	10	47.4 Å²	47.4	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-57.4	-45.4	175.9	-172	0	0	0	0	112	A729 R733 L769 S770 F776 Q777	A729-S773 WeakPolarHBondContact CB-O 3.45Å; A729-S773 PolarHBondContact O-OG 3.33Å; A729-S773 VanDerWaalsContact O-OG 3.1Å; R733-S773 PolarHBondContact N-OG 3.27Å; L769-S773 PolarHBondContact O-N 3.42Å; S770-S773 WeakPolarHBondContact O-CB 3.24Å; S770-S773 PolarHBondContact O-N 3.37Å; S773-F776 PolarHBondContact O-N 2.82Å; S773-Q777 PolarHBondContact O-N 2.93Å
774	R	94.5	Very high	93.1	Very high	146 Å²	146	40.1 Å²	40.1	55%	0.551	19%	0.194	S	C	*	.	H	α-helix	trans	-61.5	-44.7	171.3	171.1	164.3	53.2	172.8	-2.3	111.1	S770 D771 L772 F776 Q777 D778	S770-R774 PolarHBondContact O-N 3.02Å; D771-R774 IonicContact OD1-CZ 3.68Å; D771-R774 IonicContact OD1-NE 2.64Å; D771-R774 IonicContact OD1-NH2 3.72Å; D771-R774 PolarHBondContact OD1-NH2 3.17Å; L772-R774 VanDerWaalsContact C-N 3.34Å; L772-R774 PolarHBondContact O-N 3.4Å; R774-F776 PolarHBondContact O-N 3.39Å; R774-F776 VanDerWaalsContact O-N 3.16Å; R774-Q777 CarbonylContact O-C 3.57Å; R774-Q777 WeakPolarHBondContact O-CA 3.25Å; R774-Q777 WeakPolarHBondContact O-CB 3.49Å; R774-Q777 PolarHBondContact O-N 2.87Å; R774-D778 PolarHBondContact O-N 3.14Å
775	G	95.5	Very high	93.4	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-25	177.5	0	0	0	0	0	115.9	K624 D771 L772 D778 I779	K624-G775 WeakPolarHBondContact CE-O 3.48Å; D771-G775 PolarHBondContact O-N 2.73Å; L772-G775 CarbonylContact O-C 3.58Å; L772-G775 WeakPolarHBondContact O-CA 3.5Å; L772-G775 PolarHBondContact O-N 3.43Å; G775-D778 WeakPolarHBondContact CA-OD2 3.26Å; G775-I779 WeakPolarHBondContact O-CD1 3.35Å; G775-I779 WeakPolarHBondContact O-CG1 3.41Å
776	F	96.5	Very high	93.8	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-79.7	-38.8	170	-70.5	-69.8	0	0	0	112	L620 Y623 K624 M725 L728 A729 L732 L772 S773 R774 D778 I779 A780	L620-F776 HydrophobicContact CB-CE2 4.28Å; L620-F776 HydrophobicContact CD2-CE2 3.74Å; L620-F776 HydrophobicContact CD2-CZ 4Å; L620-F776 WeakPolarHBondContact O-CZ 3.28Å; Y623-F776 AromaticContact CD1-CE1 3.84Å; Y623-F776 HydrophobicContact CD1-CE1 3.84Å; Y623-F776 HydrophobicContact CD1-CZ 4.12Å; Y623-F776 HydrophobicContact CE1-CE1 4.39Å; K624-F776 HydrophobicContact CB-CE1 3.85Å; K624-F776 HydrophobicContact CB-CZ 3.8Å; K624-F776 HydrophobicContact CG-CE1 4.27Å; K624-F776 HydrophobicContact CG-CZ 4.47Å; M725-F776 HydrophobicContact SD-CD1 3.56Å; M725-F776 VanDerWaalsContact SD-CD1 3.56Å; M725-F776 HydrophobicContact SD-CE1 4.1Å; L728-F776 HydrophobicContact CD2-CD1 4.15Å; L728-F776 HydrophobicContact CD2-CD2 4.36Å; L728-F776 HydrophobicContact CD2-CE1 4.04Å; L728-F776 HydrophobicContact CD2-CE2 4.32Å; L728-F776 HydrophobicContact CD2-CG 4.29Å; L728-F776 HydrophobicContact CD2-CZ 4.13Å; A729-F776 HydrophobicContact CB-CB 4.04Å; L732-F776 HydrophobicContact CD1-CD2 3.85Å; L732-F776 HydrophobicContact CD1-CE2 4Å; L772-F776 WeakPolarHBondContact O-CD2 3.47Å; L772-F776 PolarHBondContact O-N 2.69Å; S773-F776 PolarHBondContact O-N 2.82Å; R774-F776 PolarHBondContact O-N 3.39Å; R774-F776 VanDerWaalsContact O-N 3.16Å; F776-D778 VanDerWaalsContact C-N 3.32Å; F776-D778 PolarHBondContact O-N 2.99Å; F776-I779 PolarHBondContact O-N 2.93Å; F776-A780 PolarHBondContact O-N 2.9Å
777	Q	95.1	Very high	94.2	Very high	37 Å²	37	33 Å²	33	17%	0.173	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-44	171.3	-169.8	69	54.8	0	0	111.1	A729 S773 R774 I779 A780 D781	A729-Q777 HydrophobicContact CB-CB 4.19Å; S773-Q777 PolarHBondContact O-N 2.93Å; R774-Q777 CarbonylContact O-C 3.57Å; R774-Q777 WeakPolarHBondContact O-CA 3.25Å; R774-Q777 WeakPolarHBondContact O-CB 3.49Å; R774-Q777 PolarHBondContact O-N 2.87Å; Q777-I779 PolarHBondContact O-N 3.28Å; Q777-A780 WeakPolarHBondContact O-CA 3.37Å; Q777-A780 WeakPolarHBondContact O-CB 3.22Å; Q777-A780 PolarHBondContact O-N 3.31Å; Q777-D781 PolarHBondContact NE2-OD1 2.84Å; Q777-D781 PolarHBondContact O-N 3.4Å
778	D	94.1	Very high	94.4	Very high	78 Å²	78	28.3 Å²	28.3	42%	0.417	14%	0.137	S	C	.	.	H	α-helix	trans	-58.9	-33.6	177.8	-56.8	-29	0	0	0	112.4	R774 G775 F776 R782	R774-D778 PolarHBondContact O-N 3.14Å; G775-D778 WeakPolarHBondContact CA-OD2 3.26Å; F776-D778 VanDerWaalsContact C-N 3.32Å; F776-D778 PolarHBondContact O-N 2.99Å; D778-R782 WeakPolarHBondContact O-CB 3.21Å; D778-R782 WeakPolarHBondContact O-CG 3.5Å; D778-R782 PolarHBondContact O-N 3.31Å; D778-R782 VanDerWaalsContact O-N 3.17Å
779	I	94.9	Very high	94.5	Very high	9 Å²	9	26.8 Å²	26.8	5%	0.046	13%	0.128	C	C	.	.	H	α-helix	trans	-72.3	-43.6	174.6	-66.5	167.2	0	0	0	110.2	K624 C627 N628 M725 G775 F776 Q777 R782 C783	K624-I779 HydrophobicContact CG-CD1 3.84Å; C627-I779 HydrophobicContact CB-CD1 4.39Å; N628-I779 WeakPolarHBondContact OD1-CD1 3.4Å; M725-I779 HydrophobicContact CG-CB 4.42Å; M725-I779 HydrophobicContact CG-CG2 3.94Å; G775-I779 WeakPolarHBondContact O-CD1 3.35Å; G775-I779 WeakPolarHBondContact O-CG1 3.41Å; F776-I779 PolarHBondContact O-N 2.93Å; Q777-I779 PolarHBondContact O-N 3.28Å; I779-R782 PolarHBondContact O-N 2.95Å; I779-C783 PolarHBondContact O-N 2.92Å; I779-C783 PolarHBondContact O-SG 2.88Å
780	A	94.8	Very high	94.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-50	176.5	0	0	0	0	0	111.3	Q722 M725 E726 F776 Q777 R782 C783 L784	Q722-A780 WeakPolarHBondContact CG-O 3.3Å; M725-A780 HydrophobicContact CB-CB 4Å; E726-A780 HydrophobicContact CB-CB 3.96Å; F776-A780 PolarHBondContact O-N 2.9Å; Q777-A780 WeakPolarHBondContact O-CA 3.37Å; Q777-A780 WeakPolarHBondContact O-CB 3.22Å; Q777-A780 PolarHBondContact O-N 3.31Å; A780-R782 VanDerWaalsContact C-N 3.31Å; A780-R782 PolarHBondContact O-N 2.94Å; A780-C783 WeakPolarHBondContact O-CB 3.38Å; A780-C783 PolarHBondContact O-N 3.45Å; A780-C783 VanDerWaalsContact O-N 3.11Å; A780-L784 PolarHBondContact O-N 2.86Å
781	D	93.9	Very high	94.8	Very high	34 Å²	34	24 Å²	24	18%	0.182	11%	0.108	C	C	.	.	H	α-helix	trans	-61.8	-39.7	-178.9	-66.8	1.5	0	0	0	111.1	W663 Q777 L784 L785	W663-D781 HydrophobicContact CH2-CB 3.98Å; W663-D781 HydrophobicContact CZ2-CB 3.96Å; Q777-D781 PolarHBondContact NE2-OD1 2.84Å; Q777-D781 PolarHBondContact O-N 3.4Å; D781-L784 PolarHBondContact O-N 3.49Å; D781-L785 WeakPolarHBondContact O-CG 3.41Å; D781-L785 PolarHBondContact O-N 3.5Å
782	R	94.3	Very high	94.8	Very high	115 Å²	115	21.3 Å²	21.3	43%	0.434	9%	0.094	S	C	.	.	H	α-helix	trans	-64	-43.2	172.2	-82.6	178.5	167.2	168.1	3	113.1	D778 I779 A780 L784 L785 V786	D778-R782 WeakPolarHBondContact O-CB 3.21Å; D778-R782 WeakPolarHBondContact O-CG 3.5Å; D778-R782 PolarHBondContact O-N 3.31Å; D778-R782 VanDerWaalsContact O-N 3.17Å; I779-R782 PolarHBondContact O-N 2.95Å; A780-R782 VanDerWaalsContact C-N 3.31Å; A780-R782 PolarHBondContact O-N 2.94Å; R782-L784 VanDerWaalsContact C-N 3.29Å; R782-L784 PolarHBondContact O-N 3.25Å; R782-L785 PolarHBondContact O-N 3.33Å; R782-V786 WeakPolarHBondContact O-CG2 3.36Å; R782-V786 PolarHBondContact O-N 2.99Å
783	C	95.3	Very high	94.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-42.6	175.7	-66.5	0	0	0	0	110.8	Q722 I779 A780 V786 L787	Q722-C783 HydrophobicContact CB-CB 3.88Å; Q722-C783 HydrophobicContact CG-CB 4.24Å; I779-C783 PolarHBondContact O-N 2.92Å; I779-C783 PolarHBondContact O-SG 2.88Å; A780-C783 WeakPolarHBondContact O-CB 3.38Å; A780-C783 PolarHBondContact O-N 3.45Å; A780-C783 VanDerWaalsContact O-N 3.11Å; C783-V786 PolarHBondContact O-N 3.34Å; C783-L787 WeakPolarHBondContact O-CB 3.39Å; C783-L787 WeakPolarHBondContact O-CD1 3.24Å; C783-L787 WeakPolarHBondContact O-CG 3.29Å; C783-L787 PolarHBondContact O-N 2.72Å
784	L	94.9	Very high	94.8	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-42.8	177.2	-174.3	57.4	0	0	0	112.5	W663 M666 Q722 A780 D781 R782 L787 H788 K845 Y848 I849	W663-L784 HydrophobicContact CH2-CB 4.41Å; W663-L784 HydrophobicContact CH2-CD2 4.09Å; W663-L784 HydrophobicContact CH2-CG 4.46Å; W663-L784 HydrophobicContact CZ3-CB 4.43Å; W663-L784 HydrophobicContact CZ3-CD2 3.91Å; W663-L784 HydrophobicContact CZ3-CG 4.1Å; M666-L784 HydrophobicContact CE-CD2 3.44Å; M666-L784 VanDerWaalsContact CE-CD2 3.44Å; M666-L784 HydrophobicContact SD-CD2 3.66Å; Q722-L784 HydrophobicContact CG-CB 3.99Å; A780-L784 PolarHBondContact O-N 2.86Å; D781-L784 PolarHBondContact O-N 3.49Å; R782-L784 VanDerWaalsContact C-N 3.29Å; R782-L784 PolarHBondContact O-N 3.25Å; L784-L787 PolarHBondContact O-N 3.4Å; L784-H788 VanDerWaalsContact O-CB 3.25Å; L784-H788 WeakPolarHBondContact O-CB 3.33Å; L784-H788 PolarHBondContact O-N 2.88Å; L784-K845 HydrophobicContact CD1-CB 4.04Å; L784-K845 HydrophobicContact CD2-CG 4.39Å; L784-Y848 HydrophobicContact CD1-CD1 4.36Å; L784-Y848 HydrophobicContact CD2-CD1 4.45Å; L784-Y848 HydrophobicContact CG-CD1 4.25Å; L784-Y848 HydrophobicContact CG-CE1 4.48Å; L784-I849 HydrophobicContact CD1-CD1 4.02Å; L784-I849 HydrophobicContact CD1-CG1 4.19Å
785	L	94.4	Very high	94.8	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-63.2	-41.5	174.9	-73.3	174.4	0	0	0	112.4	A648 L657 Q658 W663 D781 R782 H788 L789	A648-L785 HydrophobicContact CB-CB 3.96Å; L657-L785 HydrophobicContact CB-CD2 3.95Å; L657-L785 HydrophobicContact CD1-CD2 4Å; Q658-L785 HydrophobicContact CG-CD1 4.36Å; W663-L785 HydrophobicContact CE3-CD2 3.99Å; W663-L785 HydrophobicContact CH2-CD2 4.24Å; W663-L785 HydrophobicContact CH2-CG 4Å; W663-L785 HydrophobicContact CZ3-CD2 3.56Å; W663-L785 HydrophobicContact CZ3-CG 3.76Å; D781-L785 WeakPolarHBondContact O-CG 3.41Å; D781-L785 PolarHBondContact O-N 3.5Å; R782-L785 PolarHBondContact O-N 3.33Å; L785-H788 PolarHBondContact O-N 3.35Å; L785-L789 VanDerWaalsContact O-CB 3.3Å; L785-L789 WeakPolarHBondContact O-CB 3.38Å; L785-L789 VanDerWaalsContact O-CG 3.22Å; L785-L789 WeakPolarHBondContact O-CG 3.29Å; L785-L789 PolarHBondContact O-N 2.97Å
786	V	95.4	Very high	94.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.7	-49.5	175.1	169.5	0	0	0	0	110.9	Y631 V635 A645 A648 L709 L718 R782 C783 H788 L789 E790	Y631-V786 HydrophobicContact CE2-CG2 4.19Å; Y631-V786 WeakPolarHBondContact OH-CG2 3.31Å; V635-V786 HydrophobicContact CG1-CG1 4.24Å; A645-V786 HydrophobicContact CB-CG2 4.1Å; A648-V786 HydrophobicContact CB-CG2 3.58Å; L709-V786 HydrophobicContact CD1-CG1 4.03Å; L718-V786 HydrophobicContact CD1-CG1 4.09Å; R782-V786 WeakPolarHBondContact O-CG2 3.36Å; R782-V786 PolarHBondContact O-N 2.99Å; C783-V786 PolarHBondContact O-N 3.34Å; V786-H788 VanDerWaalsContact C-N 3.32Å; V786-H788 PolarHBondContact O-N 3.49Å; V786-L789 PolarHBondContact O-N 3.23Å; V786-E790 WeakPolarHBondContact O-CB 3.31Å; V786-E790 PolarHBondContact O-N 3.31Å
787	L	95.5	Very high	94.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.3	-43.2	179.5	-70.5	167.8	0	0	0	112	L715 L718 A719 C783 L784 E790 V791 M837 L841 I849	L715-L787 HydrophobicContact CB-CD2 4.34Å; L715-L787 HydrophobicContact CD2-CD2 3.97Å; L715-L787 WeakPolarHBondContact O-CD2 3.5Å; L718-L787 HydrophobicContact CB-CD1 4.44Å; L718-L787 HydrophobicContact CB-CD2 4Å; L718-L787 HydrophobicContact CB-CG 4.35Å; L718-L787 HydrophobicContact CD1-CD2 4.49Å; A719-L787 HydrophobicContact CB-CD1 4Å; C783-L787 WeakPolarHBondContact O-CB 3.39Å; C783-L787 WeakPolarHBondContact O-CD1 3.24Å; C783-L787 WeakPolarHBondContact O-CG 3.29Å; C783-L787 PolarHBondContact O-N 2.72Å; L784-L787 PolarHBondContact O-N 3.4Å; L787-E790 PolarHBondContact O-N 2.97Å; L787-V791 PolarHBondContact O-N 2.89Å; L787-M837 HydrophobicContact CB-CE 3.91Å; L787-M837 HydrophobicContact CD2-CE 3.63Å; L787-M837 HydrophobicContact CG-CE 4.31Å; L787-L841 HydrophobicContact CD1-CD1 4.45Å; L787-I849 HydrophobicContact CB-CD1 3.98Å
788	H	94.3	Very high	94.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.7	-42.5	176.3	179.2	84.1	0	0	0	113.5	E690 L784 L785 V786 R792 Y848 I849	E690-H788 IonicContact OE1-CD2 3.84Å; E690-H788 IonicContact OE1-CE1 2.85Å; E690-H788 IonicContact OE1-NE2 3.85Å; E690-H788 PolarHBondContact OE1-NE2 2.89Å; E690-H788 IonicContact OE2-NE2 3.21Å; L784-H788 VanDerWaalsContact O-CB 3.25Å; L784-H788 WeakPolarHBondContact O-CB 3.33Å; L784-H788 PolarHBondContact O-N 2.88Å; L785-H788 PolarHBondContact O-N 3.35Å; V786-H788 VanDerWaalsContact C-N 3.32Å; V786-H788 PolarHBondContact O-N 3.49Å; H788-R792 PolarHBondContact CE1-NH1 3.31Å; H788-R792 VanDerWaalsContact CE1-NH1 3.29Å; H788-R792 PolarHBondContact CE1-NH2 3.19Å; H788-R792 PolarHBondContact ND1-NH1 2.9Å; H788-R792 PolarHBondContact NE2-NE 3.47Å; H788-R792 PolarHBondContact NE2-NH2 2.95Å; H788-R792 VanDerWaalsContact O-CD 3.26Å; H788-R792 WeakPolarHBondContact O-CD 3.31Å; H788-R792 WeakPolarHBondContact O-CG 3.5Å; H788-R792 PolarHBondContact O-NH1 3.13Å; H788-R792 VanDerWaalsContact O-NH1 3.1Å; H788-Y848 HydrophobicContact CB-CD1 4.31Å; H788-Y848 HydrophobicContact CB-CE1 3.73Å; H788-Y848 AromaticContact CD2-CE1 3.9Å; H788-Y848 AromaticContact CD2-CZ 3.95Å; H788-Y848 AromaticContact CE1-CE1 3.54Å; H788-Y848 AromaticContact CE1-CE2 3.95Å; H788-Y848 AromaticContact CE1-CZ 3.42Å; H788-Y848 VanDerWaalsContact CE1-CZ 3.42Å; H788-Y848 PolarHBondContact CE1-O 2.93Å; H788-Y848 VanDerWaalsContact CE1-O 3.27Å; H788-Y848 AromaticContact CG-CE1 3.36Å; H788-Y848 AromaticContact CG-CZ 3.86Å; H788-Y848 AromaticContact ND1-CD1 3.5Å; H788-Y848 WeakPolarHBondContact ND1-CD1 3.38Å; H788-Y848 AromaticContact ND1-CE1 3.14Å; H788-Y848 WeakPolarHBondContact ND1-CE1 3.36Å; H788-Y848 AromaticContact ND1-CZ 3.57Å; H788-Y848 PolarHBondContact ND1-O 3.35Å; H788-Y848 VanDerWaalsContact ND1-O 3.11Å; H788-Y848 AromaticContact NE2-CE1 3.99Å; H788-Y848 AromaticContact NE2-CZ 3.68Å; H788-Y848 PolarHBondContact NE2-OH 3.23Å; H788-I849 HydrophobicContact CB-CG1 4.26Å
789	L	94.3	Very high	94.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-77.1	-30	178.7	-70	170.4	0	0	0	112.7	W647 A648 L657 L694 L785 V786 R792 V793	W647-L789 HydrophobicContact CB-CD1 3.83Å; W647-L789 HydrophobicContact CE3-CD2 4.23Å; A648-L789 HydrophobicContact CB-CD1 4.16Å; L657-L789 HydrophobicContact CD1-CD1 4.09Å; L657-L789 HydrophobicContact CD1-CD2 3.97Å; L657-L789 HydrophobicContact CD1-CG 4.27Å; L694-L789 HydrophobicContact CD1-CD2 3.91Å; L694-L789 HydrophobicContact CD2-CD2 3.69Å; L694-L789 HydrophobicContact CG-CD2 4.47Å; L785-L789 VanDerWaalsContact O-CB 3.3Å; L785-L789 WeakPolarHBondContact O-CB 3.38Å; L785-L789 VanDerWaalsContact O-CG 3.22Å; L785-L789 WeakPolarHBondContact O-CG 3.29Å; L785-L789 PolarHBondContact O-N 2.97Å; V786-L789 PolarHBondContact O-N 3.23Å; L789-R792 WeakPolarHBondContact O-CB 3.49Å; L789-R792 PolarHBondContact O-N 3.36Å; L789-V793 WeakPolarHBondContact O-CB 3.19Å; L789-V793 WeakPolarHBondContact O-CG2 3.49Å; L789-V793 PolarHBondContact O-N 2.69Å
790	E	94.9	Very high	94.1	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	5%	0.045	C	C	.	.	H	α-helix	trans	-64.1	-45.9	178.8	-165.1	69	-128.8	0	0	111.6	S644 I708 L709 L715 V786 L787 R792 V793 H794	S644-E790 WeakPolarHBondContact CB-OE2 3.48Å; S644-E790 PolarHBondContact OG-OE2 2.99Å; I708-E790 WeakPolarHBondContact CA-OE1 3.49Å; L709-E790 HydrophobicContact CB-CG 3.95Å; L709-E790 HydrophobicContact CD1-CG 4.37Å; L709-E790 VanDerWaalsContact CD1-OE2 3.31Å; L709-E790 WeakPolarHBondContact CD1-OE2 3.37Å; L709-E790 HydrophobicContact CG-CG 4.44Å; L709-E790 VanDerWaalsContact CG-OE2 3.25Å; L709-E790 WeakPolarHBondContact CG-OE2 3.42Å; L709-E790 PolarHBondContact N-OE1 2.77Å; L715-E790 HydrophobicContact CD2-CB 4.49Å; L715-E790 HydrophobicContact CD2-CG 4.1Å; V786-E790 WeakPolarHBondContact O-CB 3.31Å; V786-E790 PolarHBondContact O-N 3.31Å; L787-E790 PolarHBondContact O-N 2.97Å; E790-R792 PolarHBondContact O-N 3.06Å; E790-R792 VanDerWaalsContact O-N 3.14Å; E790-V793 CarbonylContact O-C 3.57Å; E790-V793 WeakPolarHBondContact O-CA 3.44Å; E790-V793 WeakPolarHBondContact O-CB 3.22Å; E790-V793 PolarHBondContact O-N 3.08Å; E790-H794 PolarHBondContact O-CD2 3.29Å; E790-H794 PolarHBondContact O-N 2.87Å; E790-H794 IonicContact OE1-CD2 2.69Å; E790-H794 PolarHBondContact OE1-CD2 3.27Å; E790-H794 VanDerWaalsContact OE1-CD2 3.24Å; E790-H794 IonicContact OE1-NE2 3.61Å; E790-H794 PolarHBondContact OE1-NE2 2.72Å
791	V	95.1	Very high	93.8	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-57.6	-33.4	176.7	179.8	0	0	0	0	111.4	L787 C795 I833 M837 I849 F850 L854	L787-V791 PolarHBondContact O-N 2.89Å; V791-C795 PolarHBondContact O-N 2.88Å; V791-C795 VanDerWaalsContact O-N 3.14Å; V791-C795 PolarHBondContact O-SG 2.72Å; V791-I833 HydrophobicContact CG2-CG2 4.05Å; V791-M837 HydrophobicContact CG2-CE 4.07Å; V791-I849 HydrophobicContact CB-CG2 4.43Å; V791-I849 HydrophobicContact CG2-CG2 3.76Å; V791-F850 HydrophobicContact CG1-CD1 4.42Å; V791-F850 HydrophobicContact CG1-CE1 4.17Å; V791-F850 HydrophobicContact CG2-CE1 4.24Å; V791-F850 HydrophobicContact CG2-CZ 4.39Å; V791-L854 HydrophobicContact CG1-CD1 3.88Å; V791-L854 HydrophobicContact CG1-CD2 3.64Å; V791-L854 HydrophobicContact CG1-CG 4.44Å
792	R	94.3	Very high	93.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-74.8	-42.3	176.3	-62.5	161.9	162	48.6	12.8	112	E690 L694 H788 L789 E790 H794 C795 F796 I849 A852 L857	E690-R792 VanDerWaalsContact CD-NE 3.32Å; E690-R792 IonicContact OE1-CZ 2.83Å; E690-R792 IonicContact OE1-NE 2.69Å; E690-R792 PolarHBondContact OE1-NE 3.22Å; E690-R792 IonicContact OE1-NH2 3.95Å; E690-R792 PolarHBondContact OE1-NH2 3.28Å; E690-R792 IonicContact OE2-CZ 3.52Å; E690-R792 IonicContact OE2-NE 2.64Å; E690-R792 IonicContact OE2-NH2 3.34Å; E690-R792 PolarHBondContact OE2-NH2 3.46Å; L694-R792 HydrophobicContact CD1-CB 4.48Å; H788-R792 PolarHBondContact CE1-NH1 3.31Å; H788-R792 VanDerWaalsContact CE1-NH1 3.29Å; H788-R792 PolarHBondContact CE1-NH2 3.19Å; H788-R792 PolarHBondContact ND1-NH1 2.9Å; H788-R792 PolarHBondContact NE2-NE 3.47Å; H788-R792 PolarHBondContact NE2-NH2 2.95Å; H788-R792 VanDerWaalsContact O-CD 3.26Å; H788-R792 WeakPolarHBondContact O-CD 3.31Å; H788-R792 WeakPolarHBondContact O-CG 3.5Å; H788-R792 PolarHBondContact O-NH1 3.13Å; H788-R792 VanDerWaalsContact O-NH1 3.1Å; L789-R792 WeakPolarHBondContact O-CB 3.49Å; L789-R792 PolarHBondContact O-N 3.36Å; E790-R792 PolarHBondContact O-N 3.06Å; E790-R792 VanDerWaalsContact O-N 3.14Å; R792-H794 VanDerWaalsContact C-N 3.32Å; R792-H794 PolarHBondContact O-N 3.42Å; R792-C795 WeakPolarHBondContact O-CB 3.31Å; R792-C795 PolarHBondContact O-N 3.44Å; R792-F796 WeakPolarHBondContact O-CD2 3.42Å; R792-F796 PolarHBondContact O-N 3.33Å; R792-I849 PolarHBondContact NH1-O 2.98Å; R792-A852 PolarHBondContact NH2-O 2.99Å; R792-L857 HydrophobicContact CB-CD2 3.5Å; R792-L857 VanDerWaalsContact CB-CD2 3.5Å; R792-L857 HydrophobicContact CG-CD2 3.58Å
793	V	94.1	Very high	92.9	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-60.3	-40.2	172.9	163.7	0	0	0	0	111.3	I643 W647 I703 I708 L789 E790 F796 H797	I643-V793 HydrophobicContact CB-CG1 4.37Å; I643-V793 HydrophobicContact CB-CG2 4.06Å; I643-V793 HydrophobicContact CG2-CG2 3.72Å; W647-V793 HydrophobicContact CE3-CG2 4.04Å; W647-V793 HydrophobicContact CH2-CG2 4.3Å; W647-V793 HydrophobicContact CZ3-CG2 3.61Å; I703-V793 HydrophobicContact CD1-CG1 4.15Å; I703-V793 HydrophobicContact CG2-CG1 4.48Å; I708-V793 HydrophobicContact CB-CG1 4.25Å; I708-V793 HydrophobicContact CG2-CG1 3.53Å; L789-V793 WeakPolarHBondContact O-CB 3.19Å; L789-V793 WeakPolarHBondContact O-CG2 3.49Å; L789-V793 PolarHBondContact O-N 2.69Å; E790-V793 CarbonylContact O-C 3.57Å; E790-V793 WeakPolarHBondContact O-CA 3.44Å; E790-V793 WeakPolarHBondContact O-CB 3.22Å; E790-V793 PolarHBondContact O-N 3.08Å; V793-F796 PolarHBondContact O-N 2.85Å; V793-H797 WeakPolarHBondContact O-CB 3.37Å; V793-H797 PolarHBondContact O-N 2.99Å
794	H	94	Very high	92.4	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.009	4%	0.036	C	C	.	.	H	α-helix	trans	-63.6	-43.2	173	-78.3	-133.4	0	0	0	111.3	L709 E790 R792 F796 H797 Y798 D829	L709-H794 PolarHBondContact O-CE1 3.33Å; L709-H794 PolarHBondContact O-NE2 3.06Å; E790-H794 PolarHBondContact O-CD2 3.29Å; E790-H794 PolarHBondContact O-N 2.87Å; E790-H794 IonicContact OE1-CD2 2.69Å; E790-H794 PolarHBondContact OE1-CD2 3.27Å; E790-H794 VanDerWaalsContact OE1-CD2 3.24Å; E790-H794 IonicContact OE1-NE2 3.61Å; E790-H794 PolarHBondContact OE1-NE2 2.72Å; R792-H794 VanDerWaalsContact C-N 3.32Å; R792-H794 PolarHBondContact O-N 3.42Å; H794-F796 PolarHBondContact O-N 3.48Å; H794-H797 PolarHBondContact O-N 3.21Å; H794-Y798 VanDerWaalsContact O-CD2 3.27Å; H794-Y798 WeakPolarHBondContact O-CD2 3.49Å; H794-Y798 PolarHBondContact O-N 3.39Å; H794-D829 IonicContact CE1-OD1 3.69Å; H794-D829 IonicContact CE1-OD2 3.29Å; H794-D829 IonicContact CG-OD2 3.56Å; H794-D829 IonicContact ND1-OD1 2.66Å; H794-D829 IonicContact ND1-OD2 2.89Å; H794-D829 PolarHBondContact ND1-OD2 2.84Å
795	C	94.3	Very high	91.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-57.7	-46.9	172.3	-67.7	0	0	0	0	112.1	V791 R792 H797 L799 I858 I861	V791-C795 PolarHBondContact O-N 2.88Å; V791-C795 VanDerWaalsContact O-N 3.14Å; V791-C795 PolarHBondContact O-SG 2.72Å; R792-C795 WeakPolarHBondContact O-CB 3.31Å; R792-C795 PolarHBondContact O-N 3.44Å; C795-H797 PolarHBondContact O-N 3.24Å; C795-L799 HydrophobicContact CB-CD1 4.35Å; C795-L799 WeakPolarHBondContact O-CB 3.47Å; C795-L799 VanDerWaalsContact O-CG 3.24Å; C795-L799 WeakPolarHBondContact O-CG 3.33Å; C795-L799 PolarHBondContact O-N 2.87Å; C795-I858 HydrophobicContact CB-CG1 4.23Å; C795-I861 HydrophobicContact CB-CD1 4.21Å
796	F	93.8	Very high	91	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.009	8%	0.077	C	C	.	.	H	α-helix	trans	-60.9	-43.6	174.2	-70.4	-57.4	0	0	0	112.4	W647 L694 L698 I703 R792 V793 H794 Y798 I800 L857 I861	W647-F796 HydrophobicContact CH2-CD2 4.27Å; W647-F796 AromaticContact CH2-CE2 4Å; W647-F796 HydrophobicContact CH2-CE2 4Å; W647-F796 HydrophobicContact CZ3-CE2 4.22Å; L694-F796 HydrophobicContact CB-CE2 4.04Å; L694-F796 HydrophobicContact CB-CZ 4.04Å; L698-F796 HydrophobicContact CD2-CB 3.83Å; L698-F796 HydrophobicContact CD2-CD1 3.78Å; L698-F796 HydrophobicContact CD2-CD2 4.04Å; L698-F796 HydrophobicContact CD2-CE1 4.26Å; L698-F796 HydrophobicContact CD2-CG 3.64Å; I703-F796 HydrophobicContact CD1-CB 3.55Å; I703-F796 HydrophobicContact CD1-CG 4.46Å; R792-F796 WeakPolarHBondContact O-CD2 3.42Å; R792-F796 PolarHBondContact O-N 3.33Å; V793-F796 PolarHBondContact O-N 2.85Å; H794-F796 PolarHBondContact O-N 3.48Å; F796-Y798 PolarHBondContact O-N 3.24Å; F796-I800 HydrophobicContact CB-CD1 3.91Å; F796-I800 HydrophobicContact CB-CG1 4.47Å; F796-I800 HydrophobicContact CD1-CD1 3.8Å; F796-I800 HydrophobicContact CD1-CG1 4.32Å; F796-I800 HydrophobicContact CG-CD1 4.25Å; F796-I800 WeakPolarHBondContact O-CB 3.34Å; F796-I800 VanDerWaalsContact O-CG1 3.3Å; F796-I800 WeakPolarHBondContact O-CG1 3.27Å; F796-I800 PolarHBondContact O-N 3.5Å; F796-I800 VanDerWaalsContact O-N 3.09Å; F796-L857 HydrophobicContact CE1-CD1 4.06Å; F796-L857 HydrophobicContact CE2-CD1 4.47Å; F796-L857 HydrophobicContact CE2-CD2 4.32Å; F796-L857 HydrophobicContact CZ-CD1 3.73Å; F796-L857 HydrophobicContact CZ-CD2 4.35Å; F796-I861 HydrophobicContact CD1-CD1 3.41Å; F796-I861 VanDerWaalsContact CD1-CD1 3.41Å; F796-I861 HydrophobicContact CD1-CG1 3.72Å; F796-I861 HydrophobicContact CE1-CD1 3.64Å; F796-I861 HydrophobicContact CE1-CG1 3.64Å; F796-I861 HydrophobicContact CG-CD1 4.15Å
797	H	93.1	Very high	90.2	Very high	16 Å²	16	20.2 Å²	20.2	7%	0.074	11%	0.105	C	C	.	.	H	α-helix	trans	-59.7	-42.4	-179.3	179	66.5	0	0	0	112.8	I703 Q705 I708 V793 H794 C795 P801	I703-H797 HydrophobicContact CB-CB 4.31Å; I703-H797 HydrophobicContact CG2-CB 4.3Å; I703-H797 PolarHBondContact O-CE1 2.91Å; I703-H797 PolarHBondContact O-ND1 2.84Å; Q705-H797 VanDerWaalsContact CG-CE1 3.48Å; Q705-H797 WeakPolarHBondContact CG-CE1 3.26Å; I708-H797 HydrophobicContact CD1-CB 4.49Å; I708-H797 HydrophobicContact CG2-CB 4.45Å; V793-H797 WeakPolarHBondContact O-CB 3.37Å; V793-H797 PolarHBondContact O-N 2.99Å; H794-H797 PolarHBondContact O-N 3.21Å; C795-H797 PolarHBondContact O-N 3.24Å; H797-P801 WeakPolarHBondContact O-CD 3.45Å; H797-P801 WeakPolarHBondContact O-CG 3.33Å
798	Y	92.6	Very high	89.5	Confident	31 Å²	31	20.3 Å²	20.3	12%	0.122	11%	0.105	C	C	.	.	H	α-helix	trans	-89	-32.1	-178.7	-69.7	-73.4	0	0	0	113.9	H794 F796 L822 K825 L826 D829	H794-Y798 VanDerWaalsContact O-CD2 3.27Å; H794-Y798 WeakPolarHBondContact O-CD2 3.49Å; H794-Y798 PolarHBondContact O-N 3.39Å; F796-Y798 PolarHBondContact O-N 3.24Å; Y798-L822 HydrophobicContact CD1-CD2 4.33Å; Y798-K825 HydrophobicContact CD1-CB 4.13Å; Y798-K825 HydrophobicContact CE1-CB 3.76Å; Y798-K825 HydrophobicContact CE1-CD 4.38Å; Y798-L826 HydrophobicContact CD2-CB 4.09Å; Y798-L826 HydrophobicContact CD2-CD1 3.62Å; Y798-L826 HydrophobicContact CD2-CG 4.44Å; Y798-L826 HydrophobicContact CE2-CD1 4.46Å; Y798-L826 HydrophobicContact CG-CB 4Å; Y798-L826 HydrophobicContact CG-CD1 4.23Å; Y798-D829 HydrophobicContact CE2-CB 4.36Å
799	L	92.1	Very high	88.5	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-93.5	-26.6	-172.9	-58.2	177	0	0	0	114.9	C795 L802 T803 L826 I858 I861 L862 L887	C795-L799 HydrophobicContact CB-CD1 4.35Å; C795-L799 WeakPolarHBondContact O-CB 3.47Å; C795-L799 VanDerWaalsContact O-CG 3.24Å; C795-L799 WeakPolarHBondContact O-CG 3.33Å; C795-L799 PolarHBondContact O-N 2.87Å; L799-L802 HydrophobicContact CD2-CD2 4.09Å; L799-L802 WeakPolarHBondContact O-CB 3.32Å; L799-L802 PolarHBondContact O-N 3.01Å; L799-T803 PolarHBondContact O-N 3.17Å; L799-L826 HydrophobicContact CD1-CD2 4.02Å; L799-L826 HydrophobicContact CD2-CD2 3.72Å; L799-L826 HydrophobicContact CG-CD2 3.74Å; L799-I858 HydrophobicContact CD1-CB 4.27Å; L799-I858 HydrophobicContact CD1-CG1 4.03Å; L799-I858 HydrophobicContact CD1-CG2 3.78Å; L799-I861 HydrophobicContact CB-CG2 3.69Å; L799-I861 HydrophobicContact CD1-CD1 4.46Å; L799-I861 HydrophobicContact CD1-CG2 4.49Å; L799-L862 HydrophobicContact CD2-CD2 4.32Å; L799-L887 HydrophobicContact CD2-CD1 4.08Å
800	I	90.7	Very high	87.1	Confident	19 Å²	19	28.8 Å²	28.8	10%	0.097	15%	0.154	C	C	.	.	H	α-helix	trans	-67.8	-43.6	174.6	-60	174.1	0	0	0	111.2	L698 L702 F796 L802 T803 K804 I861	L698-I800 HydrophobicContact CD2-CD1 3.46Å; L698-I800 VanDerWaalsContact CD2-CD1 3.46Å; L702-I800 HydrophobicContact CD2-CB 4.31Å; L702-I800 HydrophobicContact CD2-CG2 3.61Å; F796-I800 HydrophobicContact CB-CD1 3.91Å; F796-I800 HydrophobicContact CB-CG1 4.47Å; F796-I800 HydrophobicContact CD1-CD1 3.8Å; F796-I800 HydrophobicContact CD1-CG1 4.32Å; F796-I800 HydrophobicContact CG-CD1 4.25Å; F796-I800 WeakPolarHBondContact O-CB 3.34Å; F796-I800 VanDerWaalsContact O-CG1 3.3Å; F796-I800 WeakPolarHBondContact O-CG1 3.27Å; F796-I800 PolarHBondContact O-N 3.5Å; F796-I800 VanDerWaalsContact O-N 3.09Å; I800-L802 VanDerWaalsContact C-N 3.29Å; I800-L802 PolarHBondContact O-N 3.34Å; I800-T803 PolarHBondContact O-N 3.08Å; I800-T803 PolarHBondContact O-OG1 2.68Å; I800-T803 VanDerWaalsContact O-OG1 3.07Å; I800-K804 HydrophobicContact CG2-CD 3.74Å; I800-K804 HydrophobicContact CG2-CG 4.28Å; I800-K804 PolarHBondContact O-N 3.2Å; I800-I861 HydrophobicContact CG1-CG2 4.24Å
801	P	89.3	Confident	85.4	Confident	21 Å²	21	29.6 Å²	29.6	14%	0.136	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-33.9	173.3	-21.5	33	0	0	0	113.1	L702 H797 T803 K804 Q805 G806 L822	L702-P801 HydrophobicContact CD2-CG 4.21Å; H797-P801 WeakPolarHBondContact O-CD 3.45Å; H797-P801 WeakPolarHBondContact O-CG 3.33Å; P801-T803 PolarHBondContact O-N 3.09Å; P801-K804 PolarHBondContact O-N 2.86Å; P801-Q805 WeakPolarHBondContact O-CA 3.32Å; P801-Q805 VanDerWaalsContact O-CB 3.3Å; P801-Q805 WeakPolarHBondContact O-CB 3.4Å; P801-Q805 PolarHBondContact O-N 3.38Å; P801-G806 PolarHBondContact O-N 3.17Å; P801-L822 HydrophobicContact CB-CD1 4.01Å
802	L	87.5	Confident	83.4	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-53.9	-38.9	176.3	-175.9	73.5	0	0	0	112	L799 I800 G806 Y808 D820 L822 V823 L862 M880	L799-L802 HydrophobicContact CD2-CD2 4.09Å; L799-L802 WeakPolarHBondContact O-CB 3.32Å; L799-L802 PolarHBondContact O-N 3.01Å; I800-L802 VanDerWaalsContact C-N 3.29Å; I800-L802 PolarHBondContact O-N 3.34Å; L802-G806 WeakPolarHBondContact O-CA 3.42Å; L802-G806 PolarHBondContact O-N 3.37Å; L802-Y808 VanDerWaalsContact CD1-OH 3.29Å; L802-Y808 WeakPolarHBondContact CD1-OH 3.26Å; L802-D820 HydrophobicContact CD1-CB 3.53Å; L802-D820 WeakPolarHBondContact CD1-OD1 3.33Å; L802-L822 HydrophobicContact CB-CD1 4.43Å; L802-V823 HydrophobicContact CD1-CG2 4.18Å; L802-V823 HydrophobicContact CD2-CG2 3.82Å; L802-L862 HydrophobicContact CD2-CD2 3.97Å; L802-M880 HydrophobicContact CD2-CE 4.41Å
803	T	82.1	Confident	81.4	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-93.4	-33.2	-175.7	59.1	0	0	0	0	112.9	L799 I800 P801 L862 F869	L799-T803 PolarHBondContact O-N 3.17Å; I800-T803 PolarHBondContact O-N 3.08Å; I800-T803 PolarHBondContact O-OG1 2.68Å; I800-T803 VanDerWaalsContact O-OG1 3.07Å; P801-T803 PolarHBondContact O-N 3.09Å; T803-L862 HydrophobicContact CG2-CD2 4.46Å; T803-F869 HydrophobicContact CG2-CE2 4.42Å; T803-F869 HydrophobicContact CG2-CZ 4Å; T803-F869 WeakPolarHBondContact O-CD1 3.2Å; T803-F869 WeakPolarHBondContact O-CE1 3.44Å
804	K	84.2	Confident	79.3	Confident	59 Å²	59	46 Å²	46	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-83.2	-28.8	177.9	-72.2	-175.6	175.1	167.7	0	114.9	D700 L702 I800 P801 Y868	D700-K804 PolarHBondContact O-NZ 3.44Å; D700-K804 WeakPolarHBondContact OD1-CE 3.41Å; D700-K804 IonicContact OD1-NZ 2.88Å; D700-K804 PolarHBondContact OD1-NZ 2.87Å; L702-K804 HydrophobicContact CD2-CD 4.12Å; I800-K804 HydrophobicContact CG2-CD 3.74Å; I800-K804 HydrophobicContact CG2-CG 4.28Å; I800-K804 PolarHBondContact O-N 3.2Å; P801-K804 PolarHBondContact O-N 2.86Å; K804-Y868 HydrophobicContact CD-CD1 4.38Å; K804-Y868 HydrophobicContact CD-CE1 4.45Å; K804-Y868 HydrophobicContact CD-CG 4.45Å; K804-Y868 HydrophobicContact CG-CD1 4.01Å; K804-Y868 HydrophobicContact CG-CD2 3.89Å; K804-Y868 HydrophobicContact CG-CE2 4.42Å; K804-Y868 HydrophobicContact CG-CG 3.67Å
805	Q	82.5	Confident	77.2	Confident	136 Å²	136	53.9 Å²	53.9	64%	0.636	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-17.3	-172.4	-54.7	179.4	-4.2	0	0	113.6	P801	P801-Q805 WeakPolarHBondContact O-CA 3.32Å; P801-Q805 VanDerWaalsContact O-CB 3.3Å; P801-Q805 WeakPolarHBondContact O-CB 3.4Å; P801-Q805 PolarHBondContact O-N 3.38Å
806	G	77.6	Confident	75.4	Confident	24 Å²	24	55.1 Å²	55.1	25%	0.247	31%	0.309	C	S	.	.			trans	-68.5	137.4	-178.8	0	0	0	0	0	113.8	P801 L802	P801-G806 PolarHBondContact O-N 3.17Å; L802-G806 WeakPolarHBondContact O-CA 3.42Å; L802-G806 PolarHBondContact O-N 3.37Å
807	N	77.6	Confident	73.8	Confident	108 Å²	108	59.1 Å²	59.1	58%	0.578	33%	0.329	S	S	*	.			trans	-92.6	107.3	174.9	-176.1	6.6	0	0	0	111.1	A809	N807-A809 PolarHBondContact OD1-N 3.47Å; N807-A809 VanDerWaalsContact OD1-N 3.11Å
808	Y	81.6	Confident	72.8	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.008	35%	0.354	C	S	.	.			trans	-110.9	7.4	176.5	-69	-97.5	0	0	0	113	L802 F869 S873 G876 K879 M880 N883	L802-Y808 VanDerWaalsContact CD1-OH 3.29Å; L802-Y808 WeakPolarHBondContact CD1-OH 3.26Å; Y808-F869 AromaticContact CD2-CD1 3.97Å; Y808-F869 HydrophobicContact CD2-CD1 3.97Å; Y808-F869 AromaticContact CD2-CE1 3.27Å; Y808-F869 HydrophobicContact CD2-CE1 3.27Å; Y808-F869 AromaticContact CD2-CZ 3.81Å; Y808-F869 HydrophobicContact CD2-CZ 3.81Å; Y808-F869 AromaticContact CE2-CE1 3.53Å; Y808-F869 HydrophobicContact CE2-CE1 3.53Å; Y808-F869 AromaticContact CE2-CZ 3.78Å; Y808-F869 HydrophobicContact CE2-CZ 3.78Å; Y808-F869 HydrophobicContact CG-CE1 4.13Å; Y808-F869 HydrophobicContact CG-CZ 4.45Å; Y808-S873 PolarHBondContact O-N 3Å; Y808-S873 PolarHBondContact O-OG 3.36Å; Y808-G876 WeakPolarHBondContact CD1-O 3.45Å; Y808-K879 HydrophobicContact CE1-CB 4.36Å; Y808-K879 HydrophobicContact CE1-CD 4.28Å; Y808-K879 HydrophobicContact CE1-CG 4.33Å; Y808-M880 HydrophobicContact CE1-CB 4.17Å; Y808-M880 HydrophobicContact CE1-CE 3.98Å; Y808-M880 HydrophobicContact CE2-CE 4.29Å; Y808-N883 PolarHBondContact OH-ND2 3.4Å
809	A	73.5	Confident	72.3	Confident	39 Å²	39	67.6 Å²	67.6	32%	0.322	37%	0.369	S	S	.	.	S	Bend	trans	-90.4	-31.1	-172.1	0	0	0	0	0	114.1	N807 R871	N807-A809 PolarHBondContact OD1-N 3.47Å; N807-A809 VanDerWaalsContact OD1-N 3.11Å; A809-R871 HydrophobicContact CB-CB 3.86Å
810	I	64.2	Low	72.1	Confident	138 Å²	138	68.4 Å²	68.4	71%	0.708	37%	0.374	S	S	*	.			trans	-136.1	96.5	-176.9	-51.4	177.3	0	0	0	109
811	V	59.9	Low	72	Confident	18 Å²	18	71.5 Å²	71.5	11%	0.109	40%	0.395	C	S	.	.			trans	-130.8	77.1	-173.1	167.6	0	0	0	0	106	S816 S875	V811-S816 VanDerWaalsContact CG1-CB 3.47Å; V811-S816 WeakPolarHBondContact CG1-OG 3.44Å; V811-S875 VanDerWaalsContact CB-OG 3.31Å; V811-S875 WeakPolarHBondContact CB-OG 3.32Å; V811-S875 WeakPolarHBondContact CG1-OG 3.3Å; V811-S875 WeakPolarHBondContact O-CB 3.41Å; V811-S875 PolarHBondContact O-OG 3.26Å
812	A	51.8	Low	72	Confident	86 Å²	86	72.7 Å²	72.7	71%	0.711	40%	0.4	S	S	*	.			trans	-129.1	-1.5	-170.6	0	0	0	0	0	114.6
813	N	52.9	Low	72.3	Confident	123 Å²	123	72.7 Å²	72.7	66%	0.658	40%	0.4	S	S	*	.	S	Bend	trans	-100	158.9	174.7	-72	4.6	0	0	0	110.7	E815 S816	N813-E815 VanDerWaalsContact C-N 3.29Å; N813-E815 PolarHBondContact O-N 3.01Å; N813-S816 WeakPolarHBondContact O-CB 3.39Å; N813-S816 PolarHBondContact O-N 2.89Å; N813-S816 PolarHBondContact O-OG 3.49Å
814	V	50.7	Low	72.8	Confident	136 Å²	136	75.1 Å²	75.1	82%	0.824	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-63	-32.3	-174	-179.2	0	0	0	0	113.1	S816	V814-S816 PolarHBondContact O-N 2.96Å
815	E	50.1	Low	73.2	Confident	168 Å²	168	78 Å²	78	79%	0.785	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-64.4	-3.2	173.6	-60.4	175.7	151.2	0	0	114.1	N813	N813-E815 VanDerWaalsContact C-N 3.29Å; N813-E815 PolarHBondContact O-N 3.01Å
816	S	55.3	Low	73.7	Confident	26 Å²	26	71.5 Å²	71.5	18%	0.182	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-92.3	5.2	-176.2	80.8	0	0	0	0	114.2	V811 N813 V814	V811-S816 VanDerWaalsContact CG1-CB 3.47Å; V811-S816 WeakPolarHBondContact CG1-OG 3.44Å; N813-S816 WeakPolarHBondContact O-CB 3.39Å; N813-S816 PolarHBondContact O-N 2.89Å; N813-S816 PolarHBondContact O-OG 3.49Å; V814-S816 PolarHBondContact O-N 2.96Å
817	M	60.7	Low	74.5	Confident	87 Å²	87	71.4 Å²	71.4	43%	0.429	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-83.8	-18.1	172.4	-73.8	-78.1	97.9	0	0	114	R882	M817-R882 PolarHBondContact O-NH1 3.2Å; M817-R882 PolarHBondContact SD-NH1 3.02Å; M817-R882 PolarHBondContact SD-NH2 3.24Å; M817-R882 VanDerWaalsContact SD-NH2 3.39Å
818	D	73.1	Confident	75.3	Confident	111 Å²	111	73.5 Å²	73.5	59%	0.594	39%	0.394	S	S	*	.	S	Bend	trans	-78.2	157.5	-172.9	-67.3	-30.2	0	0	0	113.7	K879	D818-K879 WeakPolarHBondContact O-CE 3.49Å
819	Y	82.1	Confident	76	Confident	113 Å²	113	74.7 Å²	74.7	44%	0.443	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-61.6	153.7	174.2	-54.1	-68.3	0	0	0	111.6	R882 V886	Y819-R882 HydrophobicContact CD1-CB 4.27Å; Y819-R882 HydrophobicContact CE1-CB 4.1Å; Y819-V886 HydrophobicContact CD1-CB 4.21Å; Y819-V886 HydrophobicContact CD1-CG2 3.77Å; Y819-V886 HydrophobicContact CE1-CB 4.11Å; Y819-V886 HydrophobicContact CE1-CG2 3.24Å; Y819-V886 HydrophobicContact CE2-CG2 4.24Å; Y819-V886 HydrophobicContact CG-CG2 4.46Å; Y819-V886 VanDerWaalsContact CZ-CG2 3.5Å
820	D	86.8	Confident	76.9	Confident	18 Å²	18	72.9 Å²	72.9	10%	0.096	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-67.7	132.4	175.5	-158.1	-84.8	0	0	0	112.2	L802 L822 V823 V824 K879 N883	L802-D820 HydrophobicContact CD1-CB 3.53Å; L802-D820 WeakPolarHBondContact CD1-OD1 3.33Å; D820-L822 PolarHBondContact O-N 2.92Å; D820-L822 VanDerWaalsContact O-N 3.11Å; D820-L822 PolarHBondContact OD1-N 3.25Å; D820-L822 VanDerWaalsContact OD1-N 3.08Å; D820-V823 HydrophobicContact CB-CB 4.36Å; D820-V823 HydrophobicContact CB-CG2 4.12Å; D820-V823 WeakPolarHBondContact O-CB 3.48Å; D820-V823 PolarHBondContact O-N 2.91Å; D820-V824 PolarHBondContact O-N 2.99Å; D820-K879 IonicContact OD2-NZ 3.39Å; D820-K879 PolarHBondContact OD2-NZ 2.7Å; D820-N883 PolarHBondContact N-OD1 2.89Å
821	P	88.6	Confident	78.4	Confident	83 Å²	83	68.1 Å²	68.1	54%	0.539	37%	0.365	S	S	.	.	H	α-helix	trans	-57.1	-27	179.6	-27.7	35.8	0	0	0	114.6	K825	P821-K825 WeakPolarHBondContact O-CB 3.35Å; P821-K825 VanDerWaalsContact O-CG 3.24Å; P821-K825 WeakPolarHBondContact O-CG 3.4Å; P821-K825 PolarHBondContact O-N 3.27Å; P821-K825 VanDerWaalsContact O-N 3.08Å
822	L	90.3	Very high	80.1	Confident	47 Å²	47	69 Å²	69	25%	0.246	37%	0.374	C	S	.	.	H	α-helix	trans	-71.7	-36.9	174.9	-65.2	175.4	0	0	0	112.1	Y798 P801 L802 D820 K825 L826	Y798-L822 HydrophobicContact CD1-CD2 4.33Å; P801-L822 HydrophobicContact CB-CD1 4.01Å; L802-L822 HydrophobicContact CB-CD1 4.43Å; D820-L822 PolarHBondContact O-N 2.92Å; D820-L822 VanDerWaalsContact O-N 3.11Å; D820-L822 PolarHBondContact OD1-N 3.25Å; D820-L822 VanDerWaalsContact OD1-N 3.08Å; L822-K825 PolarHBondContact O-N 2.91Å; L822-L826 WeakPolarHBondContact O-CB 3.48Å; L822-L826 PolarHBondContact O-N 3.1Å
823	V	92.6	Very high	82.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-68.8	-41.4	176.1	171	0	0	0	0	110.8	L802 D820 K825 L826 N827 N883 V886 L887	L802-V823 HydrophobicContact CD1-CG2 4.18Å; L802-V823 HydrophobicContact CD2-CG2 3.82Å; D820-V823 HydrophobicContact CB-CB 4.36Å; D820-V823 HydrophobicContact CB-CG2 4.12Å; D820-V823 WeakPolarHBondContact O-CB 3.48Å; D820-V823 PolarHBondContact O-N 2.91Å; V823-K825 VanDerWaalsContact C-N 3.31Å; V823-K825 PolarHBondContact O-N 3.49Å; V823-L826 PolarHBondContact O-N 3.42Å; V823-N827 PolarHBondContact O-N 3.28Å; V823-N883 HydrophobicContact CG1-CB 4.4Å; V823-N883 HydrophobicContact CG2-CB 4.02Å; V823-V886 HydrophobicContact CG1-CG1 4.21Å; V823-L887 HydrophobicContact CG1-CD1 4.49Å; V823-L887 HydrophobicContact CG1-CD2 3.94Å; V823-L887 HydrophobicContact CG1-CG 3.9Å
824	V	92.1	Very high	84.1	Confident	56 Å²	56	61.8 Å²	61.8	34%	0.339	32%	0.322	S	S	.	.	H	α-helix	trans	-64.6	-36.2	174.5	178.9	0	0	0	0	111.7	D820 K828	D820-V824 PolarHBondContact O-N 2.99Å; V824-K828 WeakPolarHBondContact O-CG 3.28Å; V824-K828 PolarHBondContact O-N 3.48Å
825	K	92.8	Very high	86.2	Confident	118 Å²	118	62.4 Å²	62.4	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-50.3	173.6	-77.1	170.6	-178.8	179.6	0	111.4	Y798 P821 L822 V823 N827 K828 D829	Y798-K825 HydrophobicContact CD1-CB 4.13Å; Y798-K825 HydrophobicContact CE1-CB 3.76Å; Y798-K825 HydrophobicContact CE1-CD 4.38Å; P821-K825 WeakPolarHBondContact O-CB 3.35Å; P821-K825 VanDerWaalsContact O-CG 3.24Å; P821-K825 WeakPolarHBondContact O-CG 3.4Å; P821-K825 PolarHBondContact O-N 3.27Å; P821-K825 VanDerWaalsContact O-N 3.08Å; L822-K825 PolarHBondContact O-N 2.91Å; V823-K825 VanDerWaalsContact C-N 3.31Å; V823-K825 PolarHBondContact O-N 3.49Å; K825-N827 VanDerWaalsContact C-N 3.34Å; K825-N827 PolarHBondContact O-N 3.14Å; K825-K828 PolarHBondContact O-N 3.48Å; K825-D829 VanDerWaalsContact O-CB 3.22Å; K825-D829 WeakPolarHBondContact O-CB 3.35Å; K825-D829 PolarHBondContact O-N 3.05Å
826	L	94.4	Very high	88.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-45.5	178.1	-179.1	64	0	0	0	112	Y798 L799 L822 V823 K828 D829 I830 L887	Y798-L826 HydrophobicContact CD2-CB 4.09Å; Y798-L826 HydrophobicContact CD2-CD1 3.62Å; Y798-L826 HydrophobicContact CD2-CG 4.44Å; Y798-L826 HydrophobicContact CE2-CD1 4.46Å; Y798-L826 HydrophobicContact CG-CB 4Å; Y798-L826 HydrophobicContact CG-CD1 4.23Å; L799-L826 HydrophobicContact CD1-CD2 4.02Å; L799-L826 HydrophobicContact CD2-CD2 3.72Å; L799-L826 HydrophobicContact CG-CD2 3.74Å; L822-L826 WeakPolarHBondContact O-CB 3.48Å; L822-L826 PolarHBondContact O-N 3.1Å; V823-L826 PolarHBondContact O-N 3.42Å; L826-K828 PolarHBondContact O-N 2.79Å; L826-D829 PolarHBondContact O-N 2.77Å; L826-I830 HydrophobicContact CD1-CD1 3.7Å; L826-I830 HydrophobicContact CD1-CG1 3.81Å; L826-I830 HydrophobicContact CD2-CD1 4.36Å; L826-I830 HydrophobicContact CG-CD1 3.73Å; L826-I830 HydrophobicContact CG-CG1 4.18Å; L826-I830 WeakPolarHBondContact O-CB 3.33Å; L826-I830 WeakPolarHBondContact O-CG1 3.14Å; L826-I830 PolarHBondContact O-N 2.85Å; L826-L887 HydrophobicContact CD2-CD2 3.79Å; L826-L887 HydrophobicContact CG-CD2 4.45Å
827	N	94.6	Very high	90	Very high	22 Å²	22	53.5 Å²	53.5	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-43.4	177.6	-88.2	15.3	0	0	0	112.9	V823 K825 D829 S831 V886 L887 N890	V823-N827 PolarHBondContact O-N 3.28Å; K825-N827 VanDerWaalsContact C-N 3.34Å; K825-N827 PolarHBondContact O-N 3.14Å; N827-D829 VanDerWaalsContact C-N 3.32Å; N827-S831 VanDerWaalsContact O-CB 3.31Å; N827-S831 WeakPolarHBondContact O-CB 3.32Å; N827-S831 PolarHBondContact O-N 3.22Å; N827-S831 PolarHBondContact O-OG 2.89Å; N827-V886 WeakPolarHBondContact ND2-CG1 3.31Å; N827-V886 PolarHBondContact ND2-O 3.24Å; N827-L887 WeakPolarHBondContact OD1-CD2 3.19Å; N827-N890 HydrophobicContact CB-CB 4.43Å; N827-N890 WeakPolarHBondContact ND2-CB 3.38Å
828	K	94.1	Very high	91.5	Very high	152 Å²	152	50.7 Å²	50.7	66%	0.661	27%	0.266	S	S	*	.	H	α-helix	trans	-65.1	-39.9	177.8	-74.6	-178.6	177.1	-172.5	0	111.8	V824 K825 L826 A832	V824-K828 WeakPolarHBondContact O-CG 3.28Å; V824-K828 PolarHBondContact O-N 3.48Å; K825-K828 PolarHBondContact O-N 3.48Å; L826-K828 PolarHBondContact O-N 2.79Å; K828-A832 WeakPolarHBondContact O-CB 3.45Å; K828-A832 PolarHBondContact O-N 3.35Å
829	D	94.5	Very high	92.3	Very high	27 Å²	27	48 Å²	48	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-68.2	-53.7	-179	179.5	69.8	0	0	0	111.3	H794 Y798 K825 L826 N827 S831 A832 I833	H794-D829 IonicContact CE1-OD1 3.69Å; H794-D829 IonicContact CE1-OD2 3.29Å; H794-D829 IonicContact CG-OD2 3.56Å; H794-D829 IonicContact ND1-OD1 2.66Å; H794-D829 IonicContact ND1-OD2 2.89Å; H794-D829 PolarHBondContact ND1-OD2 2.84Å; Y798-D829 HydrophobicContact CE2-CB 4.36Å; K825-D829 VanDerWaalsContact O-CB 3.22Å; K825-D829 WeakPolarHBondContact O-CB 3.35Å; K825-D829 PolarHBondContact O-N 3.05Å; L826-D829 PolarHBondContact O-N 2.77Å; N827-D829 VanDerWaalsContact C-N 3.32Å; D829-S831 VanDerWaalsContact C-N 3.28Å; D829-S831 PolarHBondContact O-N 2.93Å; D829-A832 PolarHBondContact O-N 3.32Å; D829-A832 VanDerWaalsContact O-N 3.1Å; D829-I833 VanDerWaalsContact O-CG1 3.26Å; D829-I833 WeakPolarHBondContact O-CG1 3.35Å; D829-I833 PolarHBondContact O-N 2.78Å
830	I	94.4	Very high	92.8	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-53.9	-43.8	171.9	-67.3	178.4	0	0	0	111	L826 A832 I833 E834 F850 L891 I894	L826-I830 HydrophobicContact CD1-CD1 3.7Å; L826-I830 HydrophobicContact CD1-CG1 3.81Å; L826-I830 HydrophobicContact CD2-CD1 4.36Å; L826-I830 HydrophobicContact CG-CD1 3.73Å; L826-I830 HydrophobicContact CG-CG1 4.18Å; L826-I830 WeakPolarHBondContact O-CB 3.33Å; L826-I830 WeakPolarHBondContact O-CG1 3.14Å; L826-I830 PolarHBondContact O-N 2.85Å; I830-A832 PolarHBondContact O-N 2.98Å; I830-I833 PolarHBondContact O-N 2.91Å; I830-E834 VanDerWaalsContact O-CB 3.31Å; I830-E834 WeakPolarHBondContact O-CB 3.31Å; I830-E834 PolarHBondContact O-N 3.12Å; I830-F850 HydrophobicContact CG2-CE1 4.12Å; I830-L891 HydrophobicContact CG2-CD2 4.29Å; I830-I894 HydrophobicContact CG2-CD1 3.58Å
831	S	94.9	Very high	93	Very high	39 Å²	39	41.8 Å²	41.8	27%	0.273	23%	0.233	S	C	.	.	H	α-helix	trans	-66.7	-35	-180	-52.6	0	0	0	0	113	N827 D829 E834 E835 N890	N827-S831 VanDerWaalsContact O-CB 3.31Å; N827-S831 WeakPolarHBondContact O-CB 3.32Å; N827-S831 PolarHBondContact O-N 3.22Å; N827-S831 PolarHBondContact O-OG 2.89Å; D829-S831 VanDerWaalsContact C-N 3.28Å; D829-S831 PolarHBondContact O-N 2.93Å; S831-E834 PolarHBondContact O-N 3.25Å; S831-E835 PolarHBondContact O-N 3.01Å; S831-E835 VanDerWaalsContact O-N 3.08Å; S831-N890 PolarHBondContact OG-ND2 3.04Å
832	A	95.1	Very high	93.1	Very high	35 Å²	35	41.3 Å²	41.3	29%	0.289	22%	0.224	S	C	.	.	H	α-helix	trans	-71.9	-36.7	175.9	0	0	0	0	0	111.8	V712 K828 D829 I830 A836	V712-A832 WeakPolarHBondContact CG1-O 3.47Å; V712-A832 HydrophobicContact CG2-CB 4.02Å; K828-A832 WeakPolarHBondContact O-CB 3.45Å; K828-A832 PolarHBondContact O-N 3.35Å; D829-A832 PolarHBondContact O-N 3.32Å; D829-A832 VanDerWaalsContact O-N 3.1Å; I830-A832 PolarHBondContact O-N 2.98Å; A832-A836 WeakPolarHBondContact O-CB 3.29Å; A832-A836 PolarHBondContact O-N 3.32Å
833	I	94.8	Very high	93	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-41.3	173.2	-62.7	169.9	0	0	0	110.4	L715 V791 D829 I830 A836 M837 F850	L715-I833 HydrophobicContact CD1-CD1 4.05Å; L715-I833 HydrophobicContact CD1-CG1 3.74Å; L715-I833 HydrophobicContact CD1-CG2 4.18Å; V791-I833 HydrophobicContact CG2-CG2 4.05Å; D829-I833 VanDerWaalsContact O-CG1 3.26Å; D829-I833 WeakPolarHBondContact O-CG1 3.35Å; D829-I833 PolarHBondContact O-N 2.78Å; I830-I833 PolarHBondContact O-N 2.91Å; I833-A836 PolarHBondContact O-N 3.27Å; I833-M837 HydrophobicContact CG2-CE 3.27Å; I833-M837 HydrophobicContact CG2-CG 4.22Å; I833-M837 HydrophobicContact CG2-SD 3.65Å; I833-M837 WeakPolarHBondContact O-CB 3.35Å; I833-M837 VanDerWaalsContact O-CG 3.31Å; I833-M837 WeakPolarHBondContact O-CG 3.4Å; I833-M837 PolarHBondContact O-N 3.5Å; I833-F850 HydrophobicContact CG2-CZ 4.22Å
834	E	94.5	Very high	92.7	Very high	58 Å²	58	45.5 Å²	45.5	27%	0.271	24%	0.242	S	C	.	.	H	α-helix	trans	-58.2	-54.6	175.5	-176.6	-82.4	139.8	0	0	112.2	I830 S831 A836 M837 G838 F846 F850 I894	I830-E834 VanDerWaalsContact O-CB 3.31Å; I830-E834 WeakPolarHBondContact O-CB 3.31Å; I830-E834 PolarHBondContact O-N 3.12Å; S831-E834 PolarHBondContact O-N 3.25Å; E834-A836 PolarHBondContact O-N 3.21Å; E834-M837 PolarHBondContact O-N 3.02Å; E834-G838 PolarHBondContact O-N 3.39Å; E834-F846 HydrophobicContact CG-CE2 3.87Å; E834-F846 HydrophobicContact CG-CZ 3.7Å; E834-F846 WeakPolarHBondContact OE1-CZ 3.21Å; E834-F850 HydrophobicContact CB-CE1 4.29Å; E834-F850 HydrophobicContact CB-CE2 4.46Å; E834-F850 HydrophobicContact CB-CZ 3.95Å; E834-F850 HydrophobicContact CG-CZ 4.49Å; E834-I894 HydrophobicContact CB-CD1 4.15Å; E834-I894 HydrophobicContact CB-CG1 4.44Å; E834-I894 HydrophobicContact CB-CG2 4.48Å; E834-I894 HydrophobicContact CG-CB 4.3Å; E834-I894 HydrophobicContact CG-CD1 4.16Å; E834-I894 HydrophobicContact CG-CG1 3.92Å; E834-I894 HydrophobicContact CG-CG2 3.66Å
835	E	94.1	Very high	92.7	Very high	149 Å²	149	42.9 Å²	42.9	70%	0.696	23%	0.226	S	C	*	.	H	α-helix	trans	-55.6	-41.5	178.7	-173.6	-173.5	164.4	0	0	111.5	S831 A839	S831-E835 PolarHBondContact O-N 3.01Å; S831-E835 VanDerWaalsContact O-N 3.08Å; E835-A839 WeakPolarHBondContact O-CB 3.22Å; E835-A839 PolarHBondContact O-N 3.18Å
836	A	92.6	Very high	92.6	Very high	7 Å²	7	38 Å²	38	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-69	-44.2	179.6	0	0	0	0	0	113.3	V712 K716 A832 I833 E834	V712-A836 HydrophobicContact CG1-CB 3.38Å; K716-A836 HydrophobicContact CB-CB 4.23Å; K716-A836 HydrophobicContact CD-CB 4.41Å; A832-A836 WeakPolarHBondContact O-CB 3.29Å; A832-A836 PolarHBondContact O-N 3.32Å; I833-A836 PolarHBondContact O-N 3.27Å; E834-A836 PolarHBondContact O-N 3.21Å
837	M	92.8	Very high	92.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-72.3	-41.2	179	-72.3	178	-179.2	0	0	112	L787 V791 I833 E834 A839 A840 L841 F846 I849 F850	L787-M837 HydrophobicContact CB-CE 3.91Å; L787-M837 HydrophobicContact CD2-CE 3.63Å; L787-M837 HydrophobicContact CG-CE 4.31Å; V791-M837 HydrophobicContact CG2-CE 4.07Å; I833-M837 HydrophobicContact CG2-CE 3.27Å; I833-M837 HydrophobicContact CG2-CG 4.22Å; I833-M837 HydrophobicContact CG2-SD 3.65Å; I833-M837 WeakPolarHBondContact O-CB 3.35Å; I833-M837 VanDerWaalsContact O-CG 3.31Å; I833-M837 WeakPolarHBondContact O-CG 3.4Å; I833-M837 PolarHBondContact O-N 3.5Å; E834-M837 PolarHBondContact O-N 3.02Å; M837-A839 VanDerWaalsContact C-N 3.27Å; M837-A839 PolarHBondContact O-N 2.86Å; M837-A840 PolarHBondContact O-N 3.28Å; M837-L841 HydrophobicContact CB-CD1 4.33Å; M837-L841 PolarHBondContact O-N 3.4Å; M837-F846 HydrophobicContact CB-CD2 4.38Å; M837-I849 HydrophobicContact CE-CD1 4.48Å; M837-I849 HydrophobicContact CE-CG2 4.46Å; M837-I849 HydrophobicContact SD-CD1 3.82Å; M837-I849 HydrophobicContact SD-CG2 3.88Å; M837-F850 HydrophobicContact CB-CE2 4.24Å; M837-F850 HydrophobicContact SD-CE2 3.63Å; M837-F850 HydrophobicContact SD-CZ 3.74Å
838	G	91.5	Very high	92.1	Very high	28 Å²	28	39.3 Å²	39.3	29%	0.289	21%	0.21	S	C	.	.	H	α-helix	trans	-63.1	-32.4	178	0	0	0	0	0	113	E834 A840	E834-G838 PolarHBondContact O-N 3.39Å; G838-A840 VanDerWaalsContact C-N 3.33Å
839	A	91.1	Very high	92	Very high	53 Å²	53	32.1 Å²	32.1	44%	0.438	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.6	173.5	0	0	0	0	0	114.3	E835 M837	E835-A839 WeakPolarHBondContact O-CB 3.22Å; E835-A839 PolarHBondContact O-N 3.18Å; M837-A839 VanDerWaalsContact C-N 3.27Å; M837-A839 PolarHBondContact O-N 2.86Å
840	A	91.9	Very high	91.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-48.1	-174.7	0	0	0	0	0	113.3	R582 K716 A719 N720 M837 G838	R582-A840 WeakPolarHBondContact CD-O 3.47Å; K716-A840 HydrophobicContact CG-CB 4.45Å; A719-A840 HydrophobicContact CB-CB 3.59Å; N720-A840 WeakPolarHBondContact OD1-CB 3.34Å; M837-A840 PolarHBondContact O-N 3.28Å; G838-A840 VanDerWaalsContact C-N 3.33Å
841	L	92.4	Very high	91.1	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.19	C	C	.	.	S	Bend	trans	-91.3	154.4	-169	-62	179	0	0	0	114.2	R582 A719 Q722 E723 L787 M837 K845 I849	R582-L841 PolarHBondContact NE-O 2.99Å; A719-L841 HydrophobicContact CB-CD1 4.45Å; A719-L841 HydrophobicContact CB-CD2 3.76Å; A719-L841 HydrophobicContact CB-CG 3.9Å; Q722-L841 HydrophobicContact CB-CD2 4.34Å; E723-L841 HydrophobicContact CG-CD2 4.06Å; E723-L841 WeakPolarHBondContact OE1-CA 3.26Å; L787-L841 HydrophobicContact CD1-CD1 4.45Å; M837-L841 HydrophobicContact CB-CD1 4.33Å; M837-L841 PolarHBondContact O-N 3.4Å; L841-K845 HydrophobicContact CB-CB 4.42Å; L841-K845 HydrophobicContact CD1-CB 4.48Å; L841-I849 HydrophobicContact CD1-CD1 3.46Å; L841-I849 VanDerWaalsContact CD1-CD1 3.46Å
842	Q	90.4	Very high	90.4	Very high	74 Å²	74	33.2 Å²	33.2	35%	0.346	18%	0.18	S	C	.	.			trans	-66.7	147.9	167	-69	179.6	58.2	0	0	111.9	R582 E723 H844 K845 F846	R582-Q842 HydrophobicContact CG-CG 3.88Å; E723-Q842 WeakPolarHBondContact OE1-CG 3.29Å; E723-Q842 PolarHBondContact OE1-N 3.34Å; E723-Q842 PolarHBondContact OE2-NE2 3.06Å; Q842-H844 VanDerWaalsContact C-N 3.3Å; Q842-H844 PolarHBondContact O-N 3.36Å; Q842-H844 VanDerWaalsContact O-N 3.13Å; Q842-H844 PolarHBondContact OE1-CE1 2.89Å; Q842-H844 VanDerWaalsContact OE1-CE1 3.29Å; Q842-K845 HydrophobicContact CB-CD 4.48Å; Q842-K845 PolarHBondContact O-N 3.01Å; Q842-F846 PolarHBondContact O-N 3.37Å; Q842-F846 VanDerWaalsContact O-N 3.13Å
843	Q	87.7	Confident	89.7	Confident	95 Å²	95	31.7 Å²	31.7	44%	0.444	17%	0.167	S	C	.	.	H	α-helix	trans	-55	-39.2	-169.5	-168	65.5	37	0	0	114.2	K845 F846 Q847	Q843-K845 VanDerWaalsContact C-N 3.33Å; Q843-K845 PolarHBondContact O-N 3.49Å; Q843-F846 PolarHBondContact O-N 2.92Å; Q843-Q847 VanDerWaalsContact O-CG 3.3Å; Q843-Q847 WeakPolarHBondContact O-CG 3.41Å; Q843-Q847 PolarHBondContact O-N 3.38Å
844	H	86.9	Confident	89.5	Confident	39 Å²	39	31.6 Å²	31.6	18%	0.181	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-29.6	-178	55.9	-94.1	0	0	0	112.8	M666 Q842 Y848	M666-H844 PolarHBondContact O-CD2 3.42Å; Q842-H844 VanDerWaalsContact C-N 3.3Å; Q842-H844 PolarHBondContact O-N 3.36Å; Q842-H844 VanDerWaalsContact O-N 3.13Å; Q842-H844 PolarHBondContact OE1-CE1 2.89Å; Q842-H844 VanDerWaalsContact OE1-CE1 3.29Å; H844-Y848 PolarHBondContact O-N 3.36Å
845	K	90.7	Very high	89.4	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-76.1	-40.3	174.5	-54.1	178.3	-170.1	165.3	0	111.4	M666 Q722 E723 E726 L784 L841 Q842 Q843 Q847 Y848 I849	M666-K845 HydrophobicContact CG-CG 4.39Å; M666-K845 HydrophobicContact SD-CG 4.02Å; Q722-K845 VanDerWaalsContact OE1-CD 3.28Å; E723-K845 WeakPolarHBondContact OE1-CD 3.39Å; E723-K845 IonicContact OE1-NZ 3.57Å; E723-K845 PolarHBondContact OE1-NZ 2.88Å; E723-K845 IonicContact OE2-NZ 3.84Å; E723-K845 PolarHBondContact OE2-NZ 3.41Å; E726-K845 IonicContact OE1-NZ 2.81Å; E726-K845 WeakPolarHBondContact OE2-CE 3.31Å; E726-K845 IonicContact OE2-NZ 2.8Å; E726-K845 PolarHBondContact OE2-NZ 2.7Å; L784-K845 HydrophobicContact CD1-CB 4.04Å; L784-K845 HydrophobicContact CD2-CG 4.39Å; L841-K845 HydrophobicContact CB-CB 4.42Å; L841-K845 HydrophobicContact CD1-CB 4.48Å; Q842-K845 HydrophobicContact CB-CD 4.48Å; Q842-K845 PolarHBondContact O-N 3.01Å; Q843-K845 VanDerWaalsContact C-N 3.33Å; Q843-K845 PolarHBondContact O-N 3.49Å; K845-Q847 VanDerWaalsContact C-N 3.33Å; K845-Q847 PolarHBondContact O-N 3.04Å; K845-Y848 WeakPolarHBondContact O-CB 3.47Å; K845-Y848 PolarHBondContact O-N 3.23Å; K845-Y848 VanDerWaalsContact O-N 3.14Å; K845-I849 WeakPolarHBondContact O-CG1 3.36Å; K845-I849 PolarHBondContact O-N 3.22Å; K845-I849 VanDerWaalsContact O-N 3.08Å
846	F	90.1	Very high	89.3	Confident	15 Å²	15	23.5 Å²	23.5	7%	0.066	13%	0.129	C	C	.	.	H	α-helix	trans	-57.8	-45.5	171.2	177.7	-85.4	0	0	0	111.3	E834 M837 Q842 Q843 Y848 I849 F850 I894	E834-F846 HydrophobicContact CG-CE2 3.87Å; E834-F846 HydrophobicContact CG-CZ 3.7Å; E834-F846 WeakPolarHBondContact OE1-CZ 3.21Å; M837-F846 HydrophobicContact CB-CD2 4.38Å; Q842-F846 PolarHBondContact O-N 3.37Å; Q842-F846 VanDerWaalsContact O-N 3.13Å; Q843-F846 PolarHBondContact O-N 2.92Å; F846-Y848 VanDerWaalsContact C-N 3.34Å; F846-Y848 PolarHBondContact O-N 3.25Å; F846-I849 PolarHBondContact O-N 3.08Å; F846-F850 HydrophobicContact CD1-CD2 4.38Å; F846-F850 AromaticContact CD2-CD2 3.97Å; F846-F850 HydrophobicContact CD2-CD2 3.97Å; F846-F850 AromaticContact CD2-CE2 3.98Å; F846-F850 HydrophobicContact CD2-CE2 3.98Å; F846-F850 HydrophobicContact CE1-CD2 4.22Å; F846-F850 AromaticContact CE2-CD2 3.8Å; F846-F850 HydrophobicContact CE2-CD2 3.8Å; F846-F850 AromaticContact CE2-CE2 3.74Å; F846-F850 HydrophobicContact CE2-CE2 3.74Å; F846-F850 HydrophobicContact CG-CD2 4.27Å; F846-F850 AromaticContact CZ-CD2 3.95Å; F846-F850 HydrophobicContact CZ-CD2 3.95Å; F846-F850 HydrophobicContact CZ-CE2 4.26Å; F846-F850 PolarHBondContact O-N 2.84Å; F846-F850 VanDerWaalsContact O-N 3.09Å; F846-I894 HydrophobicContact CZ-CG2 4.25Å
847	Q	88.4	Confident	89.3	Confident	46 Å²	46	23.2 Å²	23.2	22%	0.215	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-40.4	173	-70.8	-177.5	-68	0	0	112.5	R670 Q843 K845 I849 F850 E851 A852	R670-Q847 VanDerWaalsContact NH2-NE2 3.13Å; Q843-Q847 VanDerWaalsContact O-CG 3.3Å; Q843-Q847 WeakPolarHBondContact O-CG 3.41Å; Q843-Q847 PolarHBondContact O-N 3.38Å; K845-Q847 VanDerWaalsContact C-N 3.33Å; K845-Q847 PolarHBondContact O-N 3.04Å; Q847-I849 VanDerWaalsContact C-N 3.28Å; Q847-I849 PolarHBondContact O-N 2.97Å; Q847-F850 PolarHBondContact O-N 2.93Å; Q847-E851 HydrophobicContact CB-CB 4.21Å; Q847-E851 VanDerWaalsContact CD-OE2 3.28Å; Q847-E851 WeakPolarHBondContact CG-OE2 3.46Å; Q847-E851 PolarHBondContact NE2-OE2 3.18Å; Q847-E851 WeakPolarHBondContact O-CA 3.32Å; Q847-E851 WeakPolarHBondContact O-CB 3.4Å; Q847-E851 PolarHBondContact O-N 3.26Å; Q847-A852 PolarHBondContact O-N 3.45Å; Q847-A852 VanDerWaalsContact O-N 3.11Å
848	Y	90.2	Very high	89.3	Confident	5 Å²	5	23.2 Å²	23.2	2%	0.02	13%	0.127	C	C	.	.	H	α-helix	trans	-58.7	-39.8	175.5	175.5	-99.4	0	0	0	112.3	N662 W663 M666 L784 H788 H844 K845 F846 A852	N662-Y848 HydrophobicContact CB-CD2 4.18Å; N662-Y848 HydrophobicContact CB-CE2 4.25Å; N662-Y848 WeakPolarHBondContact ND2-CE2 3.18Å; W663-Y848 HydrophobicContact CB-CE2 4.08Å; W663-Y848 AromaticContact CE3-CE1 3.83Å; W663-Y848 HydrophobicContact CE3-CE1 3.83Å; W663-Y848 HydrophobicContact CE3-CE2 4.05Å; W663-Y848 AromaticContact CE3-CZ 3.57Å; W663-Y848 HydrophobicContact CZ3-CE1 4.02Å; M666-Y848 HydrophobicContact CB-CD2 4.18Å; M666-Y848 HydrophobicContact CB-CG 4.24Å; M666-Y848 HydrophobicContact CG-CD2 4.48Å; M666-Y848 HydrophobicContact CG-CG 4.05Å; L784-Y848 HydrophobicContact CD1-CD1 4.36Å; L784-Y848 HydrophobicContact CD2-CD1 4.45Å; L784-Y848 HydrophobicContact CG-CD1 4.25Å; L784-Y848 HydrophobicContact CG-CE1 4.48Å; H788-Y848 HydrophobicContact CB-CD1 4.31Å; H788-Y848 HydrophobicContact CB-CE1 3.73Å; H788-Y848 AromaticContact CD2-CE1 3.9Å; H788-Y848 AromaticContact CD2-CZ 3.95Å; H788-Y848 AromaticContact CE1-CE1 3.54Å; H788-Y848 AromaticContact CE1-CE2 3.95Å; H788-Y848 AromaticContact CE1-CZ 3.42Å; H788-Y848 VanDerWaalsContact CE1-CZ 3.42Å; H788-Y848 PolarHBondContact CE1-O 2.93Å; H788-Y848 VanDerWaalsContact CE1-O 3.27Å; H788-Y848 AromaticContact CG-CE1 3.36Å; H788-Y848 AromaticContact CG-CZ 3.86Å; H788-Y848 AromaticContact ND1-CD1 3.5Å; H788-Y848 WeakPolarHBondContact ND1-CD1 3.38Å; H788-Y848 AromaticContact ND1-CE1 3.14Å; H788-Y848 WeakPolarHBondContact ND1-CE1 3.36Å; H788-Y848 AromaticContact ND1-CZ 3.57Å; H788-Y848 PolarHBondContact ND1-O 3.35Å; H788-Y848 VanDerWaalsContact ND1-O 3.11Å; H788-Y848 AromaticContact NE2-CE1 3.99Å; H788-Y848 AromaticContact NE2-CZ 3.68Å; H788-Y848 PolarHBondContact NE2-OH 3.23Å; H844-Y848 PolarHBondContact O-N 3.36Å; K845-Y848 WeakPolarHBondContact O-CB 3.47Å; K845-Y848 PolarHBondContact O-N 3.23Å; K845-Y848 VanDerWaalsContact O-N 3.14Å; F846-Y848 VanDerWaalsContact C-N 3.34Å; F846-Y848 PolarHBondContact O-N 3.25Å; Y848-A852 VanDerWaalsContact O-CB 3.27Å; Y848-A852 WeakPolarHBondContact O-CB 3.45Å
849	I	92.1	Very high	89.4	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-70	-49.2	179.2	-64.8	166.7	0	0	0	112.2	L784 L787 H788 V791 R792 M837 L841 K845 F846 Q847	L784-I849 HydrophobicContact CD1-CD1 4.02Å; L784-I849 HydrophobicContact CD1-CG1 4.19Å; L787-I849 HydrophobicContact CB-CD1 3.98Å; H788-I849 HydrophobicContact CB-CG1 4.26Å; V791-I849 HydrophobicContact CB-CG2 4.43Å; V791-I849 HydrophobicContact CG2-CG2 3.76Å; R792-I849 PolarHBondContact NH1-O 2.98Å; M837-I849 HydrophobicContact CE-CD1 4.48Å; M837-I849 HydrophobicContact CE-CG2 4.46Å; M837-I849 HydrophobicContact SD-CD1 3.82Å; M837-I849 HydrophobicContact SD-CG2 3.88Å; L841-I849 HydrophobicContact CD1-CD1 3.46Å; L841-I849 VanDerWaalsContact CD1-CD1 3.46Å; K845-I849 WeakPolarHBondContact O-CG1 3.36Å; K845-I849 PolarHBondContact O-N 3.22Å; K845-I849 VanDerWaalsContact O-N 3.08Å; F846-I849 PolarHBondContact O-N 3.08Å; Q847-I849 VanDerWaalsContact C-N 3.28Å; Q847-I849 PolarHBondContact O-N 2.97Å
850	F	89.4	Confident	89.5	Confident	1 Å²	1	20.6 Å²	20.6	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-101.8	-37.2	-168.9	-67.5	-77.9	0	0	0	115.4	V791 I830 I833 E834 M837 F846 Q847 L854 I894 T895	V791-F850 HydrophobicContact CG1-CD1 4.42Å; V791-F850 HydrophobicContact CG1-CE1 4.17Å; V791-F850 HydrophobicContact CG2-CE1 4.24Å; V791-F850 HydrophobicContact CG2-CZ 4.39Å; I830-F850 HydrophobicContact CG2-CE1 4.12Å; I833-F850 HydrophobicContact CG2-CZ 4.22Å; E834-F850 HydrophobicContact CB-CE1 4.29Å; E834-F850 HydrophobicContact CB-CE2 4.46Å; E834-F850 HydrophobicContact CB-CZ 3.95Å; E834-F850 HydrophobicContact CG-CZ 4.49Å; M837-F850 HydrophobicContact CB-CE2 4.24Å; M837-F850 HydrophobicContact SD-CE2 3.63Å; M837-F850 HydrophobicContact SD-CZ 3.74Å; F846-F850 HydrophobicContact CD1-CD2 4.38Å; F846-F850 AromaticContact CD2-CD2 3.97Å; F846-F850 HydrophobicContact CD2-CD2 3.97Å; F846-F850 AromaticContact CD2-CE2 3.98Å; F846-F850 HydrophobicContact CD2-CE2 3.98Å; F846-F850 HydrophobicContact CE1-CD2 4.22Å; F846-F850 AromaticContact CE2-CD2 3.8Å; F846-F850 HydrophobicContact CE2-CD2 3.8Å; F846-F850 AromaticContact CE2-CE2 3.74Å; F846-F850 HydrophobicContact CE2-CE2 3.74Å; F846-F850 HydrophobicContact CG-CD2 4.27Å; F846-F850 AromaticContact CZ-CD2 3.95Å; F846-F850 HydrophobicContact CZ-CD2 3.95Å; F846-F850 HydrophobicContact CZ-CE2 4.26Å; F846-F850 PolarHBondContact O-N 2.84Å; F846-F850 VanDerWaalsContact O-N 3.09Å; Q847-F850 PolarHBondContact O-N 2.93Å; F850-L854 HydrophobicContact CD1-CD2 3.99Å; F850-L854 WeakPolarHBondContact O-CB 3.5Å; F850-I894 HydrophobicContact CB-CG2 4.03Å; F850-I894 HydrophobicContact CD1-CG2 3.94Å; F850-I894 HydrophobicContact CG-CG2 3.92Å; F850-T895 HydrophobicContact CB-CG2 4.38Å
851	E	82.1	Confident	89.5	Confident	81 Å²	81	21.1 Å²	21.1	38%	0.379	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-29	-176.2	-167.4	-175.9	145.6	0	0	111.8	Q847 G853 T895	Q847-E851 HydrophobicContact CB-CB 4.21Å; Q847-E851 VanDerWaalsContact CD-OE2 3.28Å; Q847-E851 WeakPolarHBondContact CG-OE2 3.46Å; Q847-E851 PolarHBondContact NE2-OE2 3.18Å; Q847-E851 WeakPolarHBondContact O-CA 3.32Å; Q847-E851 WeakPolarHBondContact O-CB 3.4Å; Q847-E851 PolarHBondContact O-N 3.26Å; E851-G853 PolarHBondContact O-N 3.4Å; E851-T895 HydrophobicContact CB-CG2 4.28Å
852	A	78.5	Confident	89.5	Confident	8 Å²	8	21.1 Å²	21.1	7%	0.066	10%	0.103	C	C	.	.	S	Bend	trans	-80.9	99.5	177.5	0	0	0	0	0	111	N662 F687 R792 Q847 Y848 L854	N662-A852 HydrophobicContact CB-CB 3.91Å; F687-A852 HydrophobicContact CE1-CB 3.77Å; F687-A852 HydrophobicContact CZ-CB 4.25Å; R792-A852 PolarHBondContact NH2-O 2.99Å; Q847-A852 PolarHBondContact O-N 3.45Å; Q847-A852 VanDerWaalsContact O-N 3.11Å; Y848-A852 VanDerWaalsContact O-CB 3.27Å; Y848-A852 WeakPolarHBondContact O-CB 3.45Å; A852-L854 VanDerWaalsContact C-N 3.3Å; A852-L854 PolarHBondContact O-N 2.98Å; A852-L854 VanDerWaalsContact O-N 3.13Å
853	G	81.8	Confident	89.6	Confident	3 Å²	3	17.7 Å²	17.7	3%	0.031	9%	0.087	C	C	.	.	S	Bend	trans	74.7	-2.2	162.7	0	0	0	0	0	117.8	E851 H856 L857	E851-G853 PolarHBondContact O-N 3.4Å; G853-H856 WeakPolarHBondContact O-CB 3.26Å; G853-H856 PolarHBondContact O-N 3.16Å; G853-L857 PolarHBondContact O-N 3.19Å
854	L	90.9	Very high	89.6	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.6	-45.5	-178.3	-176.2	58.9	0	0	0	112.6	V791 F850 A852 H856 L857 I858 L891	V791-L854 HydrophobicContact CG1-CD1 3.88Å; V791-L854 HydrophobicContact CG1-CD2 3.64Å; V791-L854 HydrophobicContact CG1-CG 4.44Å; F850-L854 HydrophobicContact CD1-CD2 3.99Å; F850-L854 WeakPolarHBondContact O-CB 3.5Å; A852-L854 VanDerWaalsContact C-N 3.3Å; A852-L854 PolarHBondContact O-N 2.98Å; A852-L854 VanDerWaalsContact O-N 3.13Å; L854-H856 VanDerWaalsContact C-N 3.3Å; L854-H856 PolarHBondContact O-N 3.24Å; L854-L857 PolarHBondContact O-N 3.47Å; L854-I858 WeakPolarHBondContact O-CG1 3.5Å; L854-I858 PolarHBondContact O-N 2.94Å; L854-L891 HydrophobicContact CD2-CD1 4.43Å; L854-L891 HydrophobicContact CD2-CD2 3.72Å; L854-L891 HydrophobicContact CG-CD1 4.19Å; L854-L891 HydrophobicContact CG-CD2 4.36Å
855	G	91.3	Very high	89.7	Confident	1 Å²	1	13.5 Å²	13.5	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-60.7	-38.4	174.3	0	0	0	0	0	112.8	S859	G855-S859 WeakPolarHBondContact O-CB 3.35Å; G855-S859 PolarHBondContact O-N 3.09Å
856	H	91.9	Very high	89.5	Confident	35 Å²	35	13.5 Å²	13.5	16%	0.162	7%	0.07	C	C	.	.	H	α-helix	trans	-64.8	-43.9	174.7	-172.5	77.1	0	0	0	112.2	F687 A688 G853 L854 S859 C860 D901	F687-H856 HydrophobicContact CB-CB 4.18Å; A688-H856 WeakPolarHBondContact CA-NE2 3.25Å; G853-H856 WeakPolarHBondContact O-CB 3.26Å; G853-H856 PolarHBondContact O-N 3.16Å; L854-H856 VanDerWaalsContact C-N 3.3Å; L854-H856 PolarHBondContact O-N 3.24Å; H856-S859 WeakPolarHBondContact O-CB 3.41Å; H856-S859 PolarHBondContact O-N 2.86Å; H856-C860 PolarHBondContact NE2-SG 2.99Å; H856-C860 PolarHBondContact O-N 3.46Å; H856-C860 PolarHBondContact O-SG 3.26Å; H856-D901 HydrophobicContact CB-CB 4.27Å; H856-D901 IonicContact CE1-OD1 3.24Å; H856-D901 IonicContact CG-OD1 3.21Å; H856-D901 IonicContact ND1-OD1 2.7Å; H856-D901 PolarHBondContact ND1-OD1 2.81Å
857	L	93.1	Very high	89.4	Confident	1 Å²	1	16 Å²	16	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-46.8	176.1	178.2	64.1	0	0	0	111.9	R792 F796 G853 L854 S859 C860 I861	R792-L857 HydrophobicContact CB-CD2 3.5Å; R792-L857 VanDerWaalsContact CB-CD2 3.5Å; R792-L857 HydrophobicContact CG-CD2 3.58Å; F796-L857 HydrophobicContact CE1-CD1 4.06Å; F796-L857 HydrophobicContact CE2-CD1 4.47Å; F796-L857 HydrophobicContact CE2-CD2 4.32Å; F796-L857 HydrophobicContact CZ-CD1 3.73Å; F796-L857 HydrophobicContact CZ-CD2 4.35Å; G853-L857 PolarHBondContact O-N 3.19Å; L854-L857 PolarHBondContact O-N 3.47Å; L857-S859 VanDerWaalsContact C-N 3.28Å; L857-S859 PolarHBondContact O-N 3.49Å; L857-C860 PolarHBondContact O-N 2.91Å; L857-I861 HydrophobicContact CD1-CD1 4.13Å; L857-I861 HydrophobicContact CD1-CG1 4.25Å; L857-I861 HydrophobicContact CD2-CD1 4.44Å; L857-I861 HydrophobicContact CG-CD1 3.86Å; L857-I861 HydrophobicContact CG-CG1 4.42Å; L857-I861 VanDerWaalsContact O-CG1 3.31Å; L857-I861 WeakPolarHBondContact O-CG1 3.32Å; L857-I861 PolarHBondContact O-N 2.92Å
858	I	93.8	Very high	89.4	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-60.2	-41.4	177	-67.6	-179.4	0	0	0	110.6	C795 L799 L854 I861 L862 L887 L891 L902	C795-I858 HydrophobicContact CB-CG1 4.23Å; L799-I858 HydrophobicContact CD1-CB 4.27Å; L799-I858 HydrophobicContact CD1-CG1 4.03Å; L799-I858 HydrophobicContact CD1-CG2 3.78Å; L854-I858 WeakPolarHBondContact O-CG1 3.5Å; L854-I858 PolarHBondContact O-N 2.94Å; I858-I861 PolarHBondContact O-N 2.63Å; I858-L862 HydrophobicContact CG2-CD1 3.78Å; I858-L862 HydrophobicContact CG2-CG 4.4Å; I858-L862 WeakPolarHBondContact O-CB 3.45Å; I858-L862 VanDerWaalsContact O-CG 3.3Å; I858-L862 WeakPolarHBondContact O-CG 3.44Å; I858-L862 PolarHBondContact O-N 3.4Å; I858-L887 HydrophobicContact CG2-CD1 4.03Å; I858-L891 HydrophobicContact CD1-CD1 3.8Å; I858-L902 HydrophobicContact CB-CD2 3.95Å; I858-L902 HydrophobicContact CG2-CD2 3.54Å
859	S	93.4	Very high	89.2	Confident	2 Å²	2	17.4 Å²	17.4	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-56.9	-52.7	174.1	-168.4	0	0	0	0	111.4	G855 H856 L857 I861 L862 I863 D901 A905	G855-S859 WeakPolarHBondContact O-CB 3.35Å; G855-S859 PolarHBondContact O-N 3.09Å; H856-S859 WeakPolarHBondContact O-CB 3.41Å; H856-S859 PolarHBondContact O-N 2.86Å; L857-S859 VanDerWaalsContact C-N 3.28Å; L857-S859 PolarHBondContact O-N 3.49Å; S859-I861 PolarHBondContact O-N 3.34Å; S859-L862 PolarHBondContact O-N 3.31Å; S859-I863 VanDerWaalsContact O-CG1 3.32Å; S859-I863 WeakPolarHBondContact O-CG1 3.42Å; S859-I863 PolarHBondContact O-N 2.94Å; S859-D901 VanDerWaalsContact CB-O 3.26Å; S859-D901 WeakPolarHBondContact CB-O 3.23Å; S859-D901 PolarHBondContact OG-O 3.17Å; S859-A905 WeakPolarHBondContact OG-CB 3.09Å
860	C	92.1	Very high	88.7	Confident	24 Å²	24	26.3 Å²	26.3	16%	0.162	12%	0.124	C	C	.	.	H	α-helix	trans	-58.9	-42.4	177.3	-76.7	0	0	0	0	113.4	H856 L857 N864	H856-C860 PolarHBondContact NE2-SG 2.99Å; H856-C860 PolarHBondContact O-N 3.46Å; H856-C860 PolarHBondContact O-SG 3.26Å; L857-C860 PolarHBondContact O-N 2.91Å; C860-N864 VanDerWaalsContact O-CB 3.26Å; C860-N864 WeakPolarHBondContact O-CB 3.5Å; C860-N864 PolarHBondContact O-N 3.44Å; C860-N864 PolarHBondContact O-ND2 3.47Å
861	I	91.7	Very high	88.4	Confident	10 Å²	10	32.6 Å²	32.6	5%	0.051	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-44.5	176.8	-65.1	162.4	0	0	0	110.6	C795 F796 L799 I800 L857 I858 S859 G865	C795-I861 HydrophobicContact CB-CD1 4.21Å; F796-I861 HydrophobicContact CD1-CD1 3.41Å; F796-I861 VanDerWaalsContact CD1-CD1 3.41Å; F796-I861 HydrophobicContact CD1-CG1 3.72Å; F796-I861 HydrophobicContact CE1-CD1 3.64Å; F796-I861 HydrophobicContact CE1-CG1 3.64Å; F796-I861 HydrophobicContact CG-CD1 4.15Å; L799-I861 HydrophobicContact CB-CG2 3.69Å; L799-I861 HydrophobicContact CD1-CD1 4.46Å; L799-I861 HydrophobicContact CD1-CG2 4.49Å; I800-I861 HydrophobicContact CG1-CG2 4.24Å; L857-I861 HydrophobicContact CD1-CD1 4.13Å; L857-I861 HydrophobicContact CD1-CG1 4.25Å; L857-I861 HydrophobicContact CD2-CD1 4.44Å; L857-I861 HydrophobicContact CG-CD1 3.86Å; L857-I861 HydrophobicContact CG-CG1 4.42Å; L857-I861 VanDerWaalsContact O-CG1 3.31Å; L857-I861 WeakPolarHBondContact O-CG1 3.32Å; L857-I861 PolarHBondContact O-N 2.92Å; I858-I861 PolarHBondContact O-N 2.63Å; S859-I861 PolarHBondContact O-N 3.34Å; I861-G865 PolarHBondContact O-N 3.1Å
862	L	92.4	Very high	88.6	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-72.8	-38.1	-176.5	-68.8	174.9	0	0	0	112.6	L799 L802 T803 I858 S859 G865 M880 I884 L887 Y909	L799-L862 HydrophobicContact CD2-CD2 4.32Å; L802-L862 HydrophobicContact CD2-CD2 3.97Å; T803-L862 HydrophobicContact CG2-CD2 4.46Å; I858-L862 HydrophobicContact CG2-CD1 3.78Å; I858-L862 HydrophobicContact CG2-CG 4.4Å; I858-L862 WeakPolarHBondContact O-CB 3.45Å; I858-L862 VanDerWaalsContact O-CG 3.3Å; I858-L862 WeakPolarHBondContact O-CG 3.44Å; I858-L862 PolarHBondContact O-N 3.4Å; S859-L862 PolarHBondContact O-N 3.31Å; L862-G865 PolarHBondContact O-N 2.97Å; L862-M880 HydrophobicContact CD2-SD 4.37Å; L862-I884 HydrophobicContact CD1-CG1 3.79Å; L862-L887 HydrophobicContact CD1-CD1 3.87Å; L862-Y909 WeakPolarHBondContact O-CE2 3.22Å; L862-Y909 PolarHBondContact O-OH 3.38Å
863	I	92.3	Very high	89	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-69.3	-51	176.7	-63.6	167.8	0	0	0	110.3	S859 G865 A866 F904 A905 Y908 Y930 E934	S859-I863 VanDerWaalsContact O-CG1 3.32Å; S859-I863 WeakPolarHBondContact O-CG1 3.42Å; S859-I863 PolarHBondContact O-N 2.94Å; I863-G865 PolarHBondContact O-N 3.04Å; I863-A866 VanDerWaalsContact O-CB 3.29Å; I863-A866 WeakPolarHBondContact O-CB 3.46Å; I863-A866 PolarHBondContact O-N 3.01Å; I863-A866 VanDerWaalsContact O-N 3.07Å; I863-F904 HydrophobicContact CD1-CD1 3.94Å; I863-F904 HydrophobicContact CD1-CE1 4.1Å; I863-A905 HydrophobicContact CD1-CB 4.24Å; I863-A905 HydrophobicContact CG1-CB 4.08Å; I863-Y908 HydrophobicContact CB-CD1 4.4Å; I863-Y908 HydrophobicContact CG1-CD1 4.19Å; I863-Y908 HydrophobicContact CG1-CG 4.13Å; I863-Y908 HydrophobicContact CG2-CD1 3.99Å; I863-Y908 HydrophobicContact CG2-CD2 3.91Å; I863-Y908 HydrophobicContact CG2-CE1 3.95Å; I863-Y908 HydrophobicContact CG2-CE2 3.87Å; I863-Y908 HydrophobicContact CG2-CG 3.96Å; I863-Y930 HydrophobicContact CD1-CE1 4.38Å; I863-E934 HydrophobicContact CG2-CB 4.24Å; I863-E934 HydrophobicContact CG2-CG 3.72Å; I863-E934 VanDerWaalsContact CG2-OE1 3.23Å; I863-E934 WeakPolarHBondContact CG2-OE1 3.33Å
864	N	89.5	Confident	89.2	Confident	46 Å²	46	35.9 Å²	35.9	25%	0.246	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-27.2	175.8	-75.1	-61.1	0	0	0	112.5	C860 A866 Q867	C860-N864 VanDerWaalsContact O-CB 3.26Å; C860-N864 WeakPolarHBondContact O-CB 3.5Å; C860-N864 PolarHBondContact O-N 3.44Å; C860-N864 PolarHBondContact O-ND2 3.47Å; N864-A866 PolarHBondContact O-N 3.27Å; N864-A866 VanDerWaalsContact O-N 3.16Å; N864-Q867 WeakPolarHBondContact O-CG 3.44Å; N864-Q867 PolarHBondContact O-N 3.33Å; N864-Q867 PolarHBondContact O-NE2 2.97Å
865	G	87.7	Confident	88.9	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.01	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-54.9	-27.1	173.3	0	0	0	0	0	114.8	I861 L862 I863 Q867 Y868	I861-G865 PolarHBondContact O-N 3.1Å; L862-G865 PolarHBondContact O-N 2.97Å; I863-G865 PolarHBondContact O-N 3.04Å; G865-Q867 PolarHBondContact O-N 2.83Å; G865-Q867 VanDerWaalsContact O-N 3.15Å; G865-Y868 WeakPolarHBondContact O-CD2 3.23Å; G865-Y868 PolarHBondContact O-N 3.47Å; G865-Y868 VanDerWaalsContact O-N 3.1Å
866	A	87.2	Confident	88.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-62.2	-24.5	-175.8	0	0	0	0	0	114.3	I863 N864 Y868 Y908 L941	I863-A866 VanDerWaalsContact O-CB 3.29Å; I863-A866 WeakPolarHBondContact O-CB 3.46Å; I863-A866 PolarHBondContact O-N 3.01Å; I863-A866 VanDerWaalsContact O-N 3.07Å; N864-A866 PolarHBondContact O-N 3.27Å; N864-A866 VanDerWaalsContact O-N 3.16Å; A866-Y868 VanDerWaalsContact C-N 3.28Å; A866-Y868 PolarHBondContact O-N 2.8Å; A866-Y908 HydrophobicContact CB-CE1 3.72Å; A866-L941 HydrophobicContact CB-CD2 4.25Å
867	Q	87.9	Confident	88.5	Confident	69 Å²	69	36 Å²	36	32%	0.322	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-62.7	-36	176.2	75.8	-166.7	-72.6	0	0	112.1	N864 G865 N937 R944	N864-Q867 WeakPolarHBondContact O-CG 3.44Å; N864-Q867 PolarHBondContact O-N 3.33Å; N864-Q867 PolarHBondContact O-NE2 2.97Å; G865-Q867 PolarHBondContact O-N 2.83Å; G865-Q867 VanDerWaalsContact O-N 3.15Å; Q867-N937 HydrophobicContact CB-CB 4.49Å; Q867-R944 PolarHBondContact O-NH1 2.91Å; Q867-R944 PolarHBondContact O-NH2 3.29Å
868	Y	87.8	Confident	88.2	Confident	74 Å²	74	39.9 Å²	39.9	29%	0.29	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-20	-173.6	-53.5	-68.6	0	0	0	114	D700 K804 G865 A866 K870	D700-Y868 VanDerWaalsContact OD1-CE1 3.29Å; D700-Y868 WeakPolarHBondContact OD1-CE1 3.48Å; D700-Y868 VanDerWaalsContact OD1-CZ 3.3Å; D700-Y868 PolarHBondContact OD1-OH 3.22Å; K804-Y868 HydrophobicContact CD-CD1 4.38Å; K804-Y868 HydrophobicContact CD-CE1 4.45Å; K804-Y868 HydrophobicContact CD-CG 4.45Å; K804-Y868 HydrophobicContact CG-CD1 4.01Å; K804-Y868 HydrophobicContact CG-CD2 3.89Å; K804-Y868 HydrophobicContact CG-CE2 4.42Å; K804-Y868 HydrophobicContact CG-CG 3.67Å; G865-Y868 WeakPolarHBondContact O-CD2 3.23Å; G865-Y868 PolarHBondContact O-N 3.47Å; G865-Y868 VanDerWaalsContact O-N 3.1Å; A866-Y868 VanDerWaalsContact C-N 3.28Å; A866-Y868 PolarHBondContact O-N 2.8Å; Y868-K870 PolarHBondContact O-N 3.06Å
869	F	86.1	Confident	88	Confident	5 Å²	5	41.5 Å²	41.5	2%	0.022	19%	0.192	C	C	.	.			trans	-64.6	124.3	177.2	-71.2	-49.3	0	0	0	111.4	T803 Y808 M880 Y909 L941 R944	T803-F869 HydrophobicContact CG2-CE2 4.42Å; T803-F869 HydrophobicContact CG2-CZ 4Å; T803-F869 WeakPolarHBondContact O-CD1 3.2Å; T803-F869 WeakPolarHBondContact O-CE1 3.44Å; Y808-F869 AromaticContact CD2-CD1 3.97Å; Y808-F869 HydrophobicContact CD2-CD1 3.97Å; Y808-F869 AromaticContact CD2-CE1 3.27Å; Y808-F869 HydrophobicContact CD2-CE1 3.27Å; Y808-F869 AromaticContact CD2-CZ 3.81Å; Y808-F869 HydrophobicContact CD2-CZ 3.81Å; Y808-F869 AromaticContact CE2-CE1 3.53Å; Y808-F869 HydrophobicContact CE2-CE1 3.53Å; Y808-F869 AromaticContact CE2-CZ 3.78Å; Y808-F869 HydrophobicContact CE2-CZ 3.78Å; Y808-F869 HydrophobicContact CG-CE1 4.13Å; Y808-F869 HydrophobicContact CG-CZ 4.45Å; F869-M880 HydrophobicContact CE2-CE 3.92Å; F869-M880 HydrophobicContact CZ-CE 3.55Å; F869-Y909 HydrophobicContact CE2-CE1 4.01Å; F869-L941 HydrophobicContact CB-CD1 3.59Å; F869-L941 HydrophobicContact CB-CD2 4.19Å; F869-L941 HydrophobicContact CD2-CD2 4.16Å; F869-L941 WeakPolarHBondContact O-CD1 3.38Å; F869-R944 PolarHBondContact O-NH1 2.96Å; F869-R944 VanDerWaalsContact O-NH1 3.11Å; F869-R944 PolarHBondContact O-NH2 3.42Å
870	K	81.7	Confident	87.8	Confident	187 Å²	187	41.4 Å²	41.4	81%	0.813	19%	0.192	S	C	*	.	S	Bend	trans	-69.2	-44.5	175.7	-68.1	-177	179	178.5	0	111.9	Y868 R944	Y868-K870 PolarHBondContact O-N 3.06Å; K870-R944 WeakPolarHBondContact O-CB 3.44Å
871	R	83.3	Confident	87.8	Confident	134 Å²	134	41 Å²	41	51%	0.506	19%	0.189	S	C	.	.			trans	-152	149	174.8	-68.6	-164.7	167.4	166.4	0.4	109.7	A809 R944 S945	A809-R871 HydrophobicContact CB-CB 3.86Å; R871-R944 WeakPolarHBondContact CD-O 3.33Å; R871-R944 WeakPolarHBondContact CG-O 3.43Å; R871-R944 PolarHBondContact NE-O 3.41Å; R871-S945 WeakPolarHBondContact CA-OG 3.48Å
872	I	86.8	Confident	87.7	Confident	15 Å²	15	44.9 Å²	44.9	8%	0.077	20%	0.203	C	C	.	.			trans	-126.5	138.1	172.9	-164.3	167.4	0	0	0	110.1	I877 Y909 L912 L941 S945	I872-I877 HydrophobicContact CD1-CG1 3.74Å; I872-I877 HydrophobicContact CG1-CG1 3.92Å; I872-Y909 HydrophobicContact CD1-CD1 4.23Å; I872-Y909 HydrophobicContact CD1-CE1 4.35Å; I872-L912 HydrophobicContact CD1-CD1 4.31Å; I872-L941 HydrophobicContact CB-CD1 4.31Å; I872-L941 HydrophobicContact CB-CD2 4.37Å; I872-L941 HydrophobicContact CB-CG 4.44Å; I872-L941 HydrophobicContact CG2-CD1 4.07Å; I872-L941 HydrophobicContact CG2-CD2 3.94Å; I872-L941 HydrophobicContact CG2-CG 3.78Å; I872-S945 PolarHBondContact N-OG 3.45Å; I872-S945 WeakPolarHBondContact O-CB 3.11Å
873	S	87.5	Confident	87.6	Confident	26 Å²	26	44.9 Å²	44.9	18%	0.182	20%	0.203	C	C	.	.			trans	-104	162.7	175.7	58.5	0	0	0	0	110.9	Y808 S875 G876 I877	Y808-S873 PolarHBondContact O-N 3Å; Y808-S873 PolarHBondContact O-OG 3.36Å; S873-S875 VanDerWaalsContact C-N 3.28Å; S873-S875 PolarHBondContact O-N 3.06Å; S873-G876 CarbonylContact O-C 3.48Å; S873-G876 VanDerWaalsContact O-CA 3.26Å; S873-G876 WeakPolarHBondContact O-CA 3.39Å; S873-G876 PolarHBondContact O-N 3.03Å; S873-G876 PolarHBondContact OG-N 3.44Å; S873-G876 VanDerWaalsContact OG-N 3.12Å; S873-I877 PolarHBondContact O-N 3.41Å
874	E	85.6	Confident	87.7	Confident	119 Å²	119	44.8 Å²	44.8	56%	0.556	20%	0.202	S	C	*	.	H	α-helix	trans	-56.4	-41.9	177.1	-167.6	-158.8	138.3	0	0	112.2	G876 I877 K878 Y913	E874-G876 VanDerWaalsContact C-N 3.33Å; E874-I877 PolarHBondContact O-N 2.92Å; E874-K878 WeakPolarHBondContact O-CG 3.38Å; E874-K878 PolarHBondContact O-N 3.2Å; E874-K878 WeakPolarHBondContact OE1-CE 3.19Å; E874-K878 IonicContact OE1-NZ 3.87Å; E874-K878 PolarHBondContact OE1-NZ 3.4Å; E874-Y913 HydrophobicContact CG-CD1 3.97Å; E874-Y913 HydrophobicContact CG-CE1 3.76Å
875	S	83.6	Confident	87.8	Confident	31 Å²	31	47.4 Å²	47.4	22%	0.217	21%	0.211	C	C	.	.	H	α-helix	trans	-70	-29.7	173.9	49.5	0	0	0	0	112.4	V811 S873 K878 K879	V811-S875 VanDerWaalsContact CB-OG 3.31Å; V811-S875 WeakPolarHBondContact CB-OG 3.32Å; V811-S875 WeakPolarHBondContact CG1-OG 3.3Å; V811-S875 WeakPolarHBondContact O-CB 3.41Å; V811-S875 PolarHBondContact O-OG 3.26Å; S873-S875 VanDerWaalsContact C-N 3.28Å; S873-S875 PolarHBondContact O-N 3.06Å; S875-K878 PolarHBondContact O-N 2.69Å; S875-K879 PolarHBondContact O-N 3.31Å
876	G	86	Confident	88.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-44	166.9	0	0	0	0	0	113.5	Y808 S873 E874 K878 K879 M880	Y808-G876 WeakPolarHBondContact CD1-O 3.45Å; S873-G876 CarbonylContact O-C 3.48Å; S873-G876 VanDerWaalsContact O-CA 3.26Å; S873-G876 WeakPolarHBondContact O-CA 3.39Å; S873-G876 PolarHBondContact O-N 3.03Å; S873-G876 PolarHBondContact OG-N 3.44Å; S873-G876 VanDerWaalsContact OG-N 3.12Å; E874-G876 VanDerWaalsContact C-N 3.33Å; G876-K878 VanDerWaalsContact C-N 3.35Å; G876-K879 PolarHBondContact O-N 3.09Å; G876-M880 PolarHBondContact O-N 2.88Å
877	I	88.6	Confident	88.4	Confident	7 Å²	7	48.2 Å²	48.2	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-46.7	173.7	-60	167.6	0	0	0	109.6	I872 S873 E874 K879 M880 C881 Y909 L912 Y913	I872-I877 HydrophobicContact CD1-CG1 3.74Å; I872-I877 HydrophobicContact CG1-CG1 3.92Å; S873-I877 PolarHBondContact O-N 3.41Å; E874-I877 PolarHBondContact O-N 2.92Å; I877-K879 VanDerWaalsContact C-N 3.34Å; I877-K879 PolarHBondContact O-N 2.95Å; I877-M880 PolarHBondContact O-N 3.35Å; I877-C881 PolarHBondContact O-N 3.48Å; I877-C881 PolarHBondContact O-SG 3.01Å; I877-Y909 VanDerWaalsContact CG2-O 3.23Å; I877-Y909 WeakPolarHBondContact CG2-O 3.43Å; I877-L912 HydrophobicContact CD1-CB 3.74Å; I877-L912 WeakPolarHBondContact CD1-O 3.31Å; I877-L912 HydrophobicContact CG1-CB 4.32Å; I877-Y913 HydrophobicContact CB-CE1 3.85Å; I877-Y913 HydrophobicContact CD1-CD1 3.95Å; I877-Y913 HydrophobicContact CD1-CE1 4.12Å; I877-Y913 HydrophobicContact CG2-CD1 4.31Å; I877-Y913 HydrophobicContact CG2-CD2 4.4Å; I877-Y913 HydrophobicContact CG2-CE1 3.71Å; I877-Y913 HydrophobicContact CG2-CE2 3.81Å; I877-Y913 VanDerWaalsContact CG2-CZ 3.42Å
878	K	88.4	Confident	88.6	Confident	84 Å²	84	45.6 Å²	45.6	37%	0.365	20%	0.204	S	C	.	.	H	α-helix	trans	-57.6	-43	175.6	-70.3	172	177.1	167.9	0	112.2	E874 S875 G876 C881 R882 Y913	E874-K878 WeakPolarHBondContact O-CG 3.38Å; E874-K878 PolarHBondContact O-N 3.2Å; E874-K878 WeakPolarHBondContact OE1-CE 3.19Å; E874-K878 IonicContact OE1-NZ 3.87Å; E874-K878 PolarHBondContact OE1-NZ 3.4Å; S875-K878 PolarHBondContact O-N 2.69Å; G876-K878 VanDerWaalsContact C-N 3.35Å; K878-C881 PolarHBondContact O-N 3.27Å; K878-R882 VanDerWaalsContact O-CG 3.32Å; K878-R882 WeakPolarHBondContact O-CG 3.47Å; K878-R882 PolarHBondContact O-N 3.09Å; K878-R882 VanDerWaalsContact O-N 3.08Å; K878-Y913 HydrophobicContact CG-CE1 4.42Å; K878-Y913 WeakPolarHBondContact CG-OH 3.49Å
879	K	87.8	Confident	88.8	Confident	35 Å²	35	46.8 Å²	46.8	15%	0.152	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-44.4	175.4	-172.6	-179.7	174.2	-165.2	0	111.8	Y808 D818 D820 S875 G876 I877 R882 N883	Y808-K879 HydrophobicContact CE1-CB 4.36Å; Y808-K879 HydrophobicContact CE1-CD 4.28Å; Y808-K879 HydrophobicContact CE1-CG 4.33Å; D818-K879 WeakPolarHBondContact O-CE 3.49Å; D820-K879 IonicContact OD2-NZ 3.39Å; D820-K879 PolarHBondContact OD2-NZ 2.7Å; S875-K879 PolarHBondContact O-N 3.31Å; G876-K879 PolarHBondContact O-N 3.09Å; I877-K879 VanDerWaalsContact C-N 3.34Å; I877-K879 PolarHBondContact O-N 2.95Å; K879-R882 PolarHBondContact O-N 3.13Å; K879-N883 VanDerWaalsContact O-CG 3.29Å; K879-N883 PolarHBondContact O-N 3.41Å
880	M	89.9	Confident	89.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177.6	-174.5	57	80.8	0	0	112.1	L802 Y808 L862 F869 G876 I877 R882 N883 I884 Y909	L802-M880 HydrophobicContact CD2-CE 4.41Å; Y808-M880 HydrophobicContact CE1-CB 4.17Å; Y808-M880 HydrophobicContact CE1-CE 3.98Å; Y808-M880 HydrophobicContact CE2-CE 4.29Å; L862-M880 HydrophobicContact CD2-SD 4.37Å; F869-M880 HydrophobicContact CE2-CE 3.92Å; F869-M880 HydrophobicContact CZ-CE 3.55Å; G876-M880 PolarHBondContact O-N 2.88Å; I877-M880 PolarHBondContact O-N 3.35Å; M880-R882 VanDerWaalsContact C-N 3.31Å; M880-R882 PolarHBondContact O-N 2.9Å; M880-N883 WeakPolarHBondContact O-CB 3.25Å; M880-N883 PolarHBondContact O-N 3.4Å; M880-N883 HydrophobicContact SD-CB 4.47Å; M880-I884 HydrophobicContact CG-CD1 3.92Å; M880-I884 WeakPolarHBondContact O-CG1 3.31Å; M880-I884 PolarHBondContact O-N 3.19Å; M880-I884 HydrophobicContact SD-CD1 4.34Å; M880-I884 HydrophobicContact SD-CG1 4.38Å; M880-Y909 HydrophobicContact CB-CD1 4.25Å; M880-Y909 HydrophobicContact CB-CG 4.42Å; M880-Y909 HydrophobicContact CG-CD1 3.75Å; M880-Y909 HydrophobicContact CG-CD2 3.79Å; M880-Y909 HydrophobicContact CG-CE1 3.87Å; M880-Y909 HydrophobicContact CG-CE2 3.91Å; M880-Y909 HydrophobicContact CG-CG 3.73Å
881	C	91.8	Very high	89.6	Confident	15 Å²	15	38.8 Å²	38.8	10%	0.101	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-37.3	177.1	-62.7	0	0	0	0	112.2	I877 K878 F885 R906	I877-C881 PolarHBondContact O-N 3.48Å; I877-C881 PolarHBondContact O-SG 3.01Å; K878-C881 PolarHBondContact O-N 3.27Å; C881-F885 WeakPolarHBondContact O-CB 3.35Å; C881-F885 PolarHBondContact O-N 3.14Å; C881-R906 HydrophobicContact CB-CG 4.08Å
882	R	90	Very high	89.9	Confident	92 Å²	92	34.4 Å²	34.4	35%	0.347	17%	0.167	S	C	.	.	H	α-helix	trans	-65.7	-42.9	172.3	-73.3	174.1	-173.8	-178	3.6	112.5	M817 Y819 K878 K879 M880 F885 V886	M817-R882 PolarHBondContact O-NH1 3.2Å; M817-R882 PolarHBondContact SD-NH1 3.02Å; M817-R882 PolarHBondContact SD-NH2 3.24Å; M817-R882 VanDerWaalsContact SD-NH2 3.39Å; Y819-R882 HydrophobicContact CD1-CB 4.27Å; Y819-R882 HydrophobicContact CE1-CB 4.1Å; K878-R882 VanDerWaalsContact O-CG 3.32Å; K878-R882 WeakPolarHBondContact O-CG 3.47Å; K878-R882 PolarHBondContact O-N 3.09Å; K878-R882 VanDerWaalsContact O-N 3.08Å; K879-R882 PolarHBondContact O-N 3.13Å; M880-R882 VanDerWaalsContact C-N 3.31Å; M880-R882 PolarHBondContact O-N 2.9Å; R882-F885 PolarHBondContact O-N 2.95Å; R882-V886 PolarHBondContact O-N 3.21Å
883	N	91.3	Very high	90.1	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-50.1	174.7	-73	-17.7	0	0	0	110.9	Y808 D820 V823 K879 M880 F885 V886 L887	Y808-N883 PolarHBondContact OH-ND2 3.4Å; D820-N883 PolarHBondContact N-OD1 2.89Å; V823-N883 HydrophobicContact CG1-CB 4.4Å; V823-N883 HydrophobicContact CG2-CB 4.02Å; K879-N883 VanDerWaalsContact O-CG 3.29Å; K879-N883 PolarHBondContact O-N 3.41Å; M880-N883 WeakPolarHBondContact O-CB 3.25Å; M880-N883 PolarHBondContact O-N 3.4Å; M880-N883 HydrophobicContact SD-CB 4.47Å; N883-F885 VanDerWaalsContact C-N 3.32Å; N883-F885 PolarHBondContact O-N 3.49Å; N883-V886 PolarHBondContact O-N 3.19Å; N883-L887 WeakPolarHBondContact O-CG 3.16Å; N883-L887 PolarHBondContact O-N 2.8Å
884	I	93.1	Very high	90.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-41.7	176.8	-66.2	162	0	0	0	111.2	L862 M880 L887 Q888 L902 A905 R906 Y909	L862-I884 HydrophobicContact CD1-CG1 3.79Å; M880-I884 HydrophobicContact CG-CD1 3.92Å; M880-I884 WeakPolarHBondContact O-CG1 3.31Å; M880-I884 PolarHBondContact O-N 3.19Å; M880-I884 HydrophobicContact SD-CD1 4.34Å; M880-I884 HydrophobicContact SD-CG1 4.38Å; I884-L887 PolarHBondContact O-N 3.06Å; I884-Q888 WeakPolarHBondContact O-CB 3.45Å; I884-Q888 PolarHBondContact O-N 2.48Å; I884-L902 HydrophobicContact CG2-CB 4.34Å; I884-L902 VanDerWaalsContact CG2-O 3.23Å; I884-L902 WeakPolarHBondContact CG2-O 3.25Å; I884-A905 HydrophobicContact CD1-CB 4.37Å; I884-A905 HydrophobicContact CG2-CB 4.47Å; I884-R906 HydrophobicContact CG2-CB 3.97Å; I884-Y909 HydrophobicContact CD1-CD2 3.72Å; I884-Y909 HydrophobicContact CD1-CE2 4.29Å
885	F	92.8	Very high	90.1	Very high	100 Å²	100	33 Å²	33	44%	0.439	16%	0.162	S	C	.	.	H	α-helix	trans	-62.4	-41.8	176.2	-177	-93.8	0	0	0	113.2	C881 R882 N883 Q888 Q889	C881-F885 WeakPolarHBondContact O-CB 3.35Å; C881-F885 PolarHBondContact O-N 3.14Å; R882-F885 PolarHBondContact O-N 2.95Å; N883-F885 VanDerWaalsContact C-N 3.32Å; N883-F885 PolarHBondContact O-N 3.49Å; F885-Q888 PolarHBondContact O-N 2.91Å; F885-Q889 WeakPolarHBondContact O-CB 3.27Å; F885-Q889 PolarHBondContact O-N 3.28Å
886	V	92.4	Very high	90.2	Very high	16 Å²	16	39.4 Å²	39.4	10%	0.097	19%	0.19	C	C	.	.	H	α-helix	trans	-72.2	-31.5	178	154.4	0	0	0	0	113	Y819 V823 N827 R882 N883 N890	Y819-V886 HydrophobicContact CD1-CB 4.21Å; Y819-V886 HydrophobicContact CD1-CG2 3.77Å; Y819-V886 HydrophobicContact CE1-CB 4.11Å; Y819-V886 HydrophobicContact CE1-CG2 3.24Å; Y819-V886 HydrophobicContact CE2-CG2 4.24Å; Y819-V886 HydrophobicContact CG-CG2 4.46Å; Y819-V886 VanDerWaalsContact CZ-CG2 3.5Å; V823-V886 HydrophobicContact CG1-CG1 4.21Å; N827-V886 WeakPolarHBondContact ND2-CG1 3.31Å; N827-V886 PolarHBondContact ND2-O 3.24Å; R882-V886 PolarHBondContact O-N 3.21Å; N883-V886 PolarHBondContact O-N 3.19Å; V886-N890 WeakPolarHBondContact O-CB 3.33Å; V886-N890 PolarHBondContact O-N 3.25Å
887	L	93.5	Very high	90.1	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-47	168.3	-67.2	168.6	0	0	0	110.8	L799 V823 L826 N827 I858 L862 N883 I884 Q889 N890 L891	L799-L887 HydrophobicContact CD2-CD1 4.08Å; V823-L887 HydrophobicContact CG1-CD1 4.49Å; V823-L887 HydrophobicContact CG1-CD2 3.94Å; V823-L887 HydrophobicContact CG1-CG 3.9Å; L826-L887 HydrophobicContact CD2-CD2 3.79Å; L826-L887 HydrophobicContact CG-CD2 4.45Å; N827-L887 WeakPolarHBondContact OD1-CD2 3.19Å; I858-L887 HydrophobicContact CG2-CD1 4.03Å; L862-L887 HydrophobicContact CD1-CD1 3.87Å; N883-L887 WeakPolarHBondContact O-CG 3.16Å; N883-L887 PolarHBondContact O-N 2.8Å; I884-L887 PolarHBondContact O-N 3.06Å; L887-Q889 PolarHBondContact O-N 3.08Å; L887-N890 PolarHBondContact O-N 3.17Å; L887-L891 PolarHBondContact O-N 3.04Å
888	Q	93.3	Very high	89.7	Confident	14 Å²	14	50.4 Å²	50.4	7%	0.065	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-43.6	179	-169.7	-171	30.5	0	0	112.2	I884 F885 N890 L891 T892 E899 L902 D903	I884-Q888 WeakPolarHBondContact O-CB 3.45Å; I884-Q888 PolarHBondContact O-N 2.48Å; F885-Q888 PolarHBondContact O-N 2.91Å; Q888-N890 VanDerWaalsContact C-N 3.32Å; Q888-N890 PolarHBondContact O-N 2.69Å; Q888-L891 PolarHBondContact O-N 3.46Å; Q888-T892 WeakPolarHBondContact O-CB 3.38Å; Q888-T892 PolarHBondContact O-N 3.26Å; Q888-T892 PolarHBondContact O-OG1 3.35Å; Q888-E899 HydrophobicContact CG-CB 4.08Å; Q888-E899 PolarHBondContact NE2-O 3.12Å; Q888-L902 HydrophobicContact CB-CB 3.93Å; Q888-L902 HydrophobicContact CB-CD1 3.83Å; Q888-L902 HydrophobicContact CG-CB 3.92Å; Q888-L902 HydrophobicContact CG-CD1 4.2Å; Q888-D903 PolarHBondContact NE2-OD1 3.29Å; Q888-D903 PolarHBondContact NE2-OD2 3.31Å; Q888-D903 PolarHBondContact OE1-OD1 2.65Å
889	Q	91.8	Very high	89.6	Confident	100 Å²	100	47.2 Å²	47.2	47%	0.467	23%	0.226	S	C	.	.	H	α-helix	trans	-62.8	-40.2	177.8	-172.6	178	25.4	0	0	111.4	F885 L887 N893	F885-Q889 WeakPolarHBondContact O-CB 3.27Å; F885-Q889 PolarHBondContact O-N 3.28Å; L887-Q889 PolarHBondContact O-N 3.08Å; Q889-N893 WeakPolarHBondContact O-CB 3.44Å; Q889-N893 PolarHBondContact O-N 3.1Å; Q889-N893 VanDerWaalsContact O-N 3.13Å; Q889-N893 PolarHBondContact O-ND2 3.03Å; Q889-N893 PolarHBondContact O-OD1 3.46Å
890	N	93.3	Very high	89.5	Confident	21 Å²	21	48.3 Å²	48.3	11%	0.112	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-50.4	177.1	-177.6	-119.7	0	0	0	111.8	N827 S831 V886 L887 Q888 T892 N893 I894	N827-N890 HydrophobicContact CB-CB 4.43Å; N827-N890 WeakPolarHBondContact ND2-CB 3.38Å; S831-N890 PolarHBondContact OG-ND2 3.04Å; V886-N890 WeakPolarHBondContact O-CB 3.33Å; V886-N890 PolarHBondContact O-N 3.25Å; L887-N890 PolarHBondContact O-N 3.17Å; Q888-N890 VanDerWaalsContact C-N 3.32Å; Q888-N890 PolarHBondContact O-N 2.69Å; N890-T892 PolarHBondContact O-N 2.76Å; N890-N893 WeakPolarHBondContact O-CB 3.3Å; N890-N893 PolarHBondContact O-N 3.05Å; N890-I894 WeakPolarHBondContact O-CG1 3.23Å; N890-I894 PolarHBondContact O-N 2.86Å
891	L	91.3	Very high	89.4	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-40.8	177.4	-72	-170.1	0	0	0	112.9	I830 L854 I858 L887 Q888 N893 I894 T895 E899 L902	I830-L891 HydrophobicContact CG2-CD2 4.29Å; L854-L891 HydrophobicContact CD2-CD1 4.43Å; L854-L891 HydrophobicContact CD2-CD2 3.72Å; L854-L891 HydrophobicContact CG-CD1 4.19Å; L854-L891 HydrophobicContact CG-CD2 4.36Å; I858-L891 HydrophobicContact CD1-CD1 3.8Å; L887-L891 PolarHBondContact O-N 3.04Å; Q888-L891 PolarHBondContact O-N 3.46Å; L891-N893 PolarHBondContact O-N 3.3Å; L891-I894 WeakPolarHBondContact O-CA 3.25Å; L891-I894 WeakPolarHBondContact O-CB 3.19Å; L891-I894 PolarHBondContact O-N 3.32Å; L891-T895 PolarHBondContact O-N 2.94Å; L891-T895 PolarHBondContact O-OG1 3.39Å; L891-T895 VanDerWaalsContact O-OG1 3.11Å; L891-E899 HydrophobicContact CB-CG 3.73Å; L891-L902 HydrophobicContact CD1-CD1 4.15Å
892	T	90.3	Very high	89.4	Confident	42 Å²	42	49.5 Å²	49.5	26%	0.258	25%	0.247	S	C	.	.	H	α-helix	trans	-59.4	-36.1	176.2	-59.5	0	0	0	0	111.8	Q888 N890 I894 M896 S897	Q888-T892 WeakPolarHBondContact O-CB 3.38Å; Q888-T892 PolarHBondContact O-N 3.26Å; Q888-T892 PolarHBondContact O-OG1 3.35Å; N890-T892 PolarHBondContact O-N 2.76Å; T892-I894 VanDerWaalsContact C-N 3.32Å; T892-M896 VanDerWaalsContact O-CA 3.24Å; T892-M896 WeakPolarHBondContact O-CA 3.35Å; T892-M896 PolarHBondContact O-N 3.35Å; T892-S897 WeakPolarHBondContact CA-O 3.26Å; T892-S897 WeakPolarHBondContact CG2-O 3.47Å
893	N	90.7	Very high	89.4	Confident	100 Å²	100	46 Å²	46	54%	0.535	24%	0.235	S	C	.	.	H	α-helix	trans	-71.3	-25.9	175	-69.5	-13.4	0	0	0	112.9	Q889 N890 L891 M896	Q889-N893 WeakPolarHBondContact O-CB 3.44Å; Q889-N893 PolarHBondContact O-N 3.1Å; Q889-N893 VanDerWaalsContact O-N 3.13Å; Q889-N893 PolarHBondContact O-ND2 3.03Å; Q889-N893 PolarHBondContact O-OD1 3.46Å; N890-N893 WeakPolarHBondContact O-CB 3.3Å; N890-N893 PolarHBondContact O-N 3.05Å; L891-N893 PolarHBondContact O-N 3.3Å; N893-M896 WeakPolarHBondContact O-CE 3.45Å
894	I	88.6	Confident	89.3	Confident	15 Å²	15	49.3 Å²	49.3	8%	0.077	25%	0.249	C	C	.	.	H	α-helix	trans	-85.4	-49.2	-179.4	-69.4	174.7	0	0	0	111	I830 E834 F846 F850 N890 L891 T892 M896	I830-I894 HydrophobicContact CG2-CD1 3.58Å; E834-I894 HydrophobicContact CB-CD1 4.15Å; E834-I894 HydrophobicContact CB-CG1 4.44Å; E834-I894 HydrophobicContact CB-CG2 4.48Å; E834-I894 HydrophobicContact CG-CB 4.3Å; E834-I894 HydrophobicContact CG-CD1 4.16Å; E834-I894 HydrophobicContact CG-CG1 3.92Å; E834-I894 HydrophobicContact CG-CG2 3.66Å; F846-I894 HydrophobicContact CZ-CG2 4.25Å; F850-I894 HydrophobicContact CB-CG2 4.03Å; F850-I894 HydrophobicContact CD1-CG2 3.94Å; F850-I894 HydrophobicContact CG-CG2 3.92Å; N890-I894 WeakPolarHBondContact O-CG1 3.23Å; N890-I894 PolarHBondContact O-N 2.86Å; L891-I894 WeakPolarHBondContact O-CA 3.25Å; L891-I894 WeakPolarHBondContact O-CB 3.19Å; L891-I894 PolarHBondContact O-N 3.32Å; T892-I894 VanDerWaalsContact C-N 3.32Å; I894-M896 VanDerWaalsContact C-N 3.31Å
895	T	84.9	Confident	89.3	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.104	25%	0.249	C	C	.	.	H	α-helix	trans	-79.2	-16.4	-178.9	63.1	0	0	0	0	112.4	F850 E851 L891 S897 E899	F850-T895 HydrophobicContact CB-CG2 4.38Å; E851-T895 HydrophobicContact CB-CG2 4.28Å; L891-T895 PolarHBondContact O-N 2.94Å; L891-T895 PolarHBondContact O-OG1 3.39Å; L891-T895 VanDerWaalsContact O-OG1 3.11Å; T895-S897 PolarHBondContact O-N 3.1Å; T895-S897 VanDerWaalsContact O-N 3.15Å; T895-S897 PolarHBondContact OG1-N 3.47Å; T895-S897 PolarHBondContact OG1-O 3.34Å; T895-E899 WeakPolarHBondContact CG2-OE1 3.26Å; T895-E899 PolarHBondContact OG1-OE1 3.14Å
896	M	84.4	Confident	89.4	Confident	164 Å²	164	46 Å²	46	81%	0.808	23%	0.234	S	C	*	.	S	Bend	trans	53.6	25	-168.5	-60.4	-68.7	175.5	0	0	112.5	T892 N893 I894	T892-M896 VanDerWaalsContact O-CA 3.24Å; T892-M896 WeakPolarHBondContact O-CA 3.35Å; T892-M896 PolarHBondContact O-N 3.35Å; N893-M896 WeakPolarHBondContact O-CE 3.45Å; I894-M896 VanDerWaalsContact C-N 3.31Å
897	S	83.9	Confident	89.4	Confident	55 Å²	55	48.7 Å²	48.7	39%	0.385	25%	0.246	S	C	.	.	S	Bend	trans	-131.8	154.9	-176.2	-170.4	0	0	0	0	110.1	T892 T895 E899	T892-S897 WeakPolarHBondContact CA-O 3.26Å; T892-S897 WeakPolarHBondContact CG2-O 3.47Å; T895-S897 PolarHBondContact O-N 3.1Å; T895-S897 VanDerWaalsContact O-N 3.15Å; T895-S897 PolarHBondContact OG1-N 3.47Å; T895-S897 PolarHBondContact OG1-O 3.34Å; S897-E899 PolarHBondContact O-N 3.01Å
898	R	81.3	Confident	89.4	Confident	184 Å²	184	48.6 Å²	48.6	69%	0.694	25%	0.245	S	C	*	.			trans	-82.5	112.4	-179.4	-178.5	-179.2	174	176.5	-1	110.7	A900 D903	R898-A900 PolarHBondContact O-N 3.23Å; R898-D903 IonicContact CZ-OD2 3.94Å; R898-D903 IonicContact NE-OD2 3.66Å; R898-D903 PolarHBondContact NE-OD2 3.32Å; R898-D903 IonicContact NH2-OD2 3.31Å; R898-D903 PolarHBondContact NH2-OD2 2.92Å
899	E	86.1	Confident	89.4	Confident	16 Å²	16	47.9 Å²	47.9	8%	0.075	24%	0.242	C	C	.	.			trans	-72	85.4	174.9	-58.6	-56.6	137.9	0	0	112	Q888 L891 T895 S897 L902	Q888-E899 HydrophobicContact CG-CB 4.08Å; Q888-E899 PolarHBondContact NE2-O 3.12Å; L891-E899 HydrophobicContact CB-CG 3.73Å; T895-E899 WeakPolarHBondContact CG2-OE1 3.26Å; T895-E899 PolarHBondContact OG1-OE1 3.14Å; S897-E899 PolarHBondContact O-N 3.01Å; E899-L902 HydrophobicContact CB-CD1 4.18Å; E899-L902 HydrophobicContact CB-CG 4.48Å; E899-L902 PolarHBondContact O-N 3.46Å
900	A	84.8	Confident	89.3	Confident	58 Å²	58	47 Å²	47	48%	0.479	24%	0.237	S	C	.	.	H	α-helix	trans	-68.7	-31.7	-177.5	0	0	0	0	0	113.5	R898 L902 D903 F904	R898-A900 PolarHBondContact O-N 3.23Å; A900-L902 PolarHBondContact O-N 2.72Å; A900-D903 WeakPolarHBondContact O-CB 3.46Å; A900-D903 PolarHBondContact O-N 3.39Å; A900-D903 VanDerWaalsContact O-N 3.08Å; A900-F904 PolarHBondContact O-N 3.08Å
901	D	87.6	Confident	89.2	Confident	40 Å²	40	46.5 Å²	46.5	21%	0.214	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-27.2	177.3	-67.1	-85.9	0	0	0	113	H856 S859 F904 A905	H856-D901 HydrophobicContact CB-CB 4.27Å; H856-D901 IonicContact CE1-OD1 3.24Å; H856-D901 IonicContact CG-OD1 3.21Å; H856-D901 IonicContact ND1-OD1 2.7Å; H856-D901 PolarHBondContact ND1-OD1 2.81Å; S859-D901 VanDerWaalsContact CB-O 3.26Å; S859-D901 WeakPolarHBondContact CB-O 3.23Å; S859-D901 PolarHBondContact OG-O 3.17Å; D901-F904 WeakPolarHBondContact O-CB 3.48Å; D901-F904 PolarHBondContact O-N 3.37Å; D901-A905 PolarHBondContact O-N 2.85Å; D901-A905 VanDerWaalsContact O-N 3.09Å
902	L	91.1	Very high	89.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-81.9	-25.5	176.6	-65.4	177.9	0	0	0	113	I858 I884 Q888 L891 E899 A900 F904 R906	I858-L902 HydrophobicContact CB-CD2 3.95Å; I858-L902 HydrophobicContact CG2-CD2 3.54Å; I884-L902 HydrophobicContact CG2-CB 4.34Å; I884-L902 VanDerWaalsContact CG2-O 3.23Å; I884-L902 WeakPolarHBondContact CG2-O 3.25Å; Q888-L902 HydrophobicContact CB-CB 3.93Å; Q888-L902 HydrophobicContact CB-CD1 3.83Å; Q888-L902 HydrophobicContact CG-CB 3.92Å; Q888-L902 HydrophobicContact CG-CD1 4.2Å; L891-L902 HydrophobicContact CD1-CD1 4.15Å; E899-L902 HydrophobicContact CB-CD1 4.18Å; E899-L902 HydrophobicContact CB-CG 4.48Å; E899-L902 PolarHBondContact O-N 3.46Å; A900-L902 PolarHBondContact O-N 2.72Å; L902-F904 VanDerWaalsContact C-N 3.26Å; L902-R906 PolarHBondContact O-N 3.22Å
903	D	90.1	Very high	89	Confident	19 Å²	19	49.5 Å²	49.5	10%	0.102	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-36.6	164.9	-71.9	-32.4	0	0	0	110.4	Q888 R898 A900 R906 Q907	Q888-D903 PolarHBondContact NE2-OD1 3.29Å; Q888-D903 PolarHBondContact NE2-OD2 3.31Å; Q888-D903 PolarHBondContact OE1-OD1 2.65Å; R898-D903 IonicContact CZ-OD2 3.94Å; R898-D903 IonicContact NE-OD2 3.66Å; R898-D903 PolarHBondContact NE-OD2 3.32Å; R898-D903 IonicContact NH2-OD2 3.31Å; R898-D903 PolarHBondContact NH2-OD2 2.92Å; A900-D903 WeakPolarHBondContact O-CB 3.46Å; A900-D903 PolarHBondContact O-N 3.39Å; A900-D903 VanDerWaalsContact O-N 3.08Å; D903-R906 PolarHBondContact O-N 3.09Å; D903-R906 IonicContact OD1-CZ 3.92Å; D903-R906 IonicContact OD1-NH1 2.65Å; D903-R906 PolarHBondContact OD1-NH1 3.14Å; D903-R906 IonicContact OD1-NH2 2.81Å; D903-Q907 VanDerWaalsContact O-CG 3.27Å; D903-Q907 WeakPolarHBondContact O-CG 3.41Å; D903-Q907 PolarHBondContact O-N 3.12Å; D903-Q907 PolarHBondContact O-NE2 3.43Å
904	F	90.4	Very high	88.8	Confident	70 Å²	70	47.2 Å²	47.2	31%	0.307	23%	0.23	S	C	.	.	H	α-helix	trans	-65.7	-44.3	176.1	-173.7	-106.5	0	0	0	112.2	I863 A900 D901 L902 R906 Q907 Y908 R929 Y930	I863-F904 HydrophobicContact CD1-CD1 3.94Å; I863-F904 HydrophobicContact CD1-CE1 4.1Å; A900-F904 PolarHBondContact O-N 3.08Å; D901-F904 WeakPolarHBondContact O-CB 3.48Å; D901-F904 PolarHBondContact O-N 3.37Å; L902-F904 VanDerWaalsContact C-N 3.26Å; F904-R906 VanDerWaalsContact C-N 3.35Å; F904-R906 PolarHBondContact O-N 2.98Å; F904-Q907 PolarHBondContact O-N 3.45Å; F904-Y908 PolarHBondContact O-N 3.18Å; F904-Y908 VanDerWaalsContact O-N 3.13Å; F904-R929 HydrophobicContact CE2-CB 4.42Å; F904-R929 WeakPolarHBondContact CZ-O 3.47Å; F904-Y930 HydrophobicContact CD1-CD1 4.44Å; F904-Y930 AromaticContact CD1-CE1 3.85Å; F904-Y930 HydrophobicContact CD1-CE1 3.85Å; F904-Y930 HydrophobicContact CD2-CE1 4.02Å; F904-Y930 AromaticContact CE1-CD1 3.56Å; F904-Y930 HydrophobicContact CE1-CD1 3.56Å; F904-Y930 AromaticContact CE1-CE1 3.37Å; F904-Y930 HydrophobicContact CE1-CE1 3.37Å; F904-Y930 HydrophobicContact CE2-CD1 4.06Å; F904-Y930 AromaticContact CE2-CE1 3.56Å; F904-Y930 HydrophobicContact CE2-CE1 3.56Å; F904-Y930 AromaticContact CE2-CZ 3.98Å; F904-Y930 HydrophobicContact CG-CE1 4.16Å; F904-Y930 AromaticContact CZ-CD1 3.33Å; F904-Y930 HydrophobicContact CZ-CD1 3.33Å; F904-Y930 AromaticContact CZ-CE1 3.21Å; F904-Y930 HydrophobicContact CZ-CE1 3.21Å; F904-Y930 HydrophobicContact CZ-CG 4.25Å; F904-Y930 PolarHBondContact O-OH 3.3Å; F904-Y930 VanDerWaalsContact O-OH 3.09Å
905	A	93.4	Very high	88.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-38.6	171.4	0	0	0	0	0	113.2	S859 I863 I884 D901 Y908 Y909	S859-A905 WeakPolarHBondContact OG-CB 3.09Å; I863-A905 HydrophobicContact CD1-CB 4.24Å; I863-A905 HydrophobicContact CG1-CB 4.08Å; I884-A905 HydrophobicContact CD1-CB 4.37Å; I884-A905 HydrophobicContact CG2-CB 4.47Å; D901-A905 PolarHBondContact O-N 2.85Å; D901-A905 VanDerWaalsContact O-N 3.09Å; A905-Y908 WeakPolarHBondContact O-CB 3.44Å; A905-Y908 PolarHBondContact O-N 3.48Å; A905-Y909 WeakPolarHBondContact O-CD2 3.14Å; A905-Y909 PolarHBondContact O-N 2.9Å
906	R	94	Very high	88.6	Confident	31 Å²	31	48.7 Å²	48.7	12%	0.117	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-47.6	176.8	-168.4	-175.9	-58.3	108.1	15.1	111.1	C881 I884 L902 D903 F904 Y908 Y909 E910	C881-R906 HydrophobicContact CB-CG 4.08Å; I884-R906 HydrophobicContact CG2-CB 3.97Å; L902-R906 PolarHBondContact O-N 3.22Å; D903-R906 PolarHBondContact O-N 3.09Å; D903-R906 IonicContact OD1-CZ 3.92Å; D903-R906 IonicContact OD1-NH1 2.65Å; D903-R906 PolarHBondContact OD1-NH1 3.14Å; D903-R906 IonicContact OD1-NH2 2.81Å; F904-R906 VanDerWaalsContact C-N 3.35Å; F904-R906 PolarHBondContact O-N 2.98Å; R906-Y908 PolarHBondContact O-N 2.92Å; R906-Y909 PolarHBondContact O-N 2.94Å; R906-E910 VanDerWaalsContact CD-OE1 3.32Å; R906-E910 WeakPolarHBondContact CD-OE1 3.23Å; R906-E910 HydrophobicContact CG-CG 4.32Å; R906-E910 WeakPolarHBondContact CG-OE1 3.14Å; R906-E910 WeakPolarHBondContact O-CG 3.43Å; R906-E910 PolarHBondContact O-N 3.18Å
907	Q	92.4	Very high	88.7	Confident	72 Å²	72	44.4 Å²	44.4	34%	0.336	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-31.8	178.8	-72.7	171	47.7	0	0	112.7	D903 F904 E910 M911 Y930	D903-Q907 VanDerWaalsContact O-CG 3.27Å; D903-Q907 WeakPolarHBondContact O-CG 3.41Å; D903-Q907 PolarHBondContact O-N 3.12Å; D903-Q907 PolarHBondContact O-NE2 3.43Å; F904-Q907 PolarHBondContact O-N 3.45Å; Q907-E910 PolarHBondContact O-N 2.99Å; Q907-M911 PolarHBondContact O-N 3.38Å; Q907-Y930 WeakPolarHBondContact CB-OH 3.38Å
908	Y	93.7	Very high	88.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-41.6	174.5	177	-95.4	0	0	0	112.1	I863 A866 F904 A905 R906 M911 Y930 E934 A938	I863-Y908 HydrophobicContact CB-CD1 4.4Å; I863-Y908 HydrophobicContact CG1-CD1 4.19Å; I863-Y908 HydrophobicContact CG1-CG 4.13Å; I863-Y908 HydrophobicContact CG2-CD1 3.99Å; I863-Y908 HydrophobicContact CG2-CD2 3.91Å; I863-Y908 HydrophobicContact CG2-CE1 3.95Å; I863-Y908 HydrophobicContact CG2-CE2 3.87Å; I863-Y908 HydrophobicContact CG2-CG 3.96Å; A866-Y908 HydrophobicContact CB-CE1 3.72Å; F904-Y908 PolarHBondContact O-N 3.18Å; F904-Y908 VanDerWaalsContact O-N 3.13Å; A905-Y908 WeakPolarHBondContact O-CB 3.44Å; A905-Y908 PolarHBondContact O-N 3.48Å; R906-Y908 PolarHBondContact O-N 2.92Å; Y908-M911 HydrophobicContact CD2-CE 3.99Å; Y908-M911 HydrophobicContact CE2-CE 4.09Å; Y908-M911 WeakPolarHBondContact O-CB 3.3Å; Y908-Y930 WeakPolarHBondContact CA-OH 3.39Å; Y908-Y930 AromaticContact CD2-CD1 3.8Å; Y908-Y930 HydrophobicContact CD2-CD1 3.8Å; Y908-Y930 HydrophobicContact CD2-CD2 4.05Å; Y908-Y930 AromaticContact CD2-CE1 3.88Å; Y908-Y930 HydrophobicContact CD2-CE1 3.88Å; Y908-Y930 HydrophobicContact CD2-CE2 4.12Å; Y908-Y930 AromaticContact CD2-CG 3.93Å; Y908-Y930 HydrophobicContact CD2-CG 3.93Å; Y908-Y930 HydrophobicContact CG-CE1 4.22Å; Y908-Y930 PolarHBondContact N-OH 2.98Å; Y908-E934 HydrophobicContact CE2-CB 4.04Å; Y908-E934 PolarHBondContact OH-O 3.16Å; Y908-E934 VanDerWaalsContact OH-O 3.08Å; Y908-A938 HydrophobicContact CE2-CB 4.12Å; Y908-A938 PolarHBondContact OH-N 3.22Å
909	Y	92.1	Very high	89.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-75.8	-34.3	175.5	-78.8	-81.8	0	0	0	112.6	L862 F869 I872 I877 M880 I884 A905 R906 M911 L912	L862-Y909 WeakPolarHBondContact O-CE2 3.22Å; L862-Y909 PolarHBondContact O-OH 3.38Å; F869-Y909 HydrophobicContact CE2-CE1 4.01Å; I872-Y909 HydrophobicContact CD1-CD1 4.23Å; I872-Y909 HydrophobicContact CD1-CE1 4.35Å; I877-Y909 VanDerWaalsContact CG2-O 3.23Å; I877-Y909 WeakPolarHBondContact CG2-O 3.43Å; M880-Y909 HydrophobicContact CB-CD1 4.25Å; M880-Y909 HydrophobicContact CB-CG 4.42Å; M880-Y909 HydrophobicContact CG-CD1 3.75Å; M880-Y909 HydrophobicContact CG-CD2 3.79Å; M880-Y909 HydrophobicContact CG-CE1 3.87Å; M880-Y909 HydrophobicContact CG-CE2 3.91Å; M880-Y909 HydrophobicContact CG-CG 3.73Å; I884-Y909 HydrophobicContact CD1-CD2 3.72Å; I884-Y909 HydrophobicContact CD1-CE2 4.29Å; A905-Y909 WeakPolarHBondContact O-CD2 3.14Å; A905-Y909 PolarHBondContact O-N 2.9Å; R906-Y909 PolarHBondContact O-N 2.94Å; Y909-M911 VanDerWaalsContact C-N 3.27Å; Y909-M911 PolarHBondContact O-N 2.92Å; Y909-L912 HydrophobicContact CD1-CD1 3.81Å; Y909-L912 HydrophobicContact CE1-CD1 4.31Å; Y909-L912 VanDerWaalsContact O-CB 3.3Å; Y909-L912 WeakPolarHBondContact O-CB 3.36Å; Y909-L912 PolarHBondContact O-N 3.3Å; Y909-L912 VanDerWaalsContact O-N 3.08Å
910	E	91.8	Very high	89.1	Confident	80 Å²	80	37.5 Å²	37.5	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-63.3	-31.7	173.4	-69.8	169.8	169.6	0	0	112.3	R906 Q907 L912 Y913	R906-E910 VanDerWaalsContact CD-OE1 3.32Å; R906-E910 WeakPolarHBondContact CD-OE1 3.23Å; R906-E910 HydrophobicContact CG-CG 4.32Å; R906-E910 WeakPolarHBondContact CG-OE1 3.14Å; R906-E910 WeakPolarHBondContact O-CG 3.43Å; R906-E910 PolarHBondContact O-N 3.18Å; Q907-E910 PolarHBondContact O-N 2.99Å; E910-L912 PolarHBondContact O-N 3.27Å; E910-L912 VanDerWaalsContact O-N 3.15Å; E910-Y913 HydrophobicContact CB-CD2 4.36Å; E910-Y913 HydrophobicContact CB-CE2 4.36Å; E910-Y913 HydrophobicContact CG-CE2 4.26Å; E910-Y913 WeakPolarHBondContact O-CD2 3.36Å; E910-Y913 PolarHBondContact O-N 2.95Å; E910-Y913 VanDerWaalsContact O-N 3.12Å
911	M	90.2	Very high	89.2	Confident	11 Å²	11	39.5 Å²	39.5	5%	0.054	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.8	-26.4	172.4	-176.7	179.3	61	0	0	112.8	Q907 Y908 Y909 Y913 N914 L919 L922 Y930 Y935 A938	Q907-M911 PolarHBondContact O-N 3.38Å; Y908-M911 HydrophobicContact CD2-CE 3.99Å; Y908-M911 HydrophobicContact CE2-CE 4.09Å; Y908-M911 WeakPolarHBondContact O-CB 3.3Å; Y909-M911 VanDerWaalsContact C-N 3.27Å; Y909-M911 PolarHBondContact O-N 2.92Å; M911-Y913 PolarHBondContact O-N 3.25Å; M911-N914 PolarHBondContact O-N 3.12Å; M911-N914 PolarHBondContact O-ND2 3.31Å; M911-L919 HydrophobicContact CE-CD1 4.07Å; M911-L919 HydrophobicContact CG-CD1 3.78Å; M911-L919 HydrophobicContact CG-CG 3.85Å; M911-L919 HydrophobicContact SD-CD1 3.97Å; M911-L919 HydrophobicContact SD-CD2 4.21Å; M911-L919 HydrophobicContact SD-CG 3.86Å; M911-L922 HydrophobicContact CG-CD2 4.11Å; M911-Y930 HydrophobicContact CE-CD2 4.34Å; M911-Y930 HydrophobicContact CE-CE2 4.41Å; M911-Y930 HydrophobicContact SD-CE2 4.44Å; M911-Y935 HydrophobicContact CE-CD1 4.12Å; M911-Y935 HydrophobicContact CE-CE1 4.14Å; M911-Y935 HydrophobicContact SD-CD1 4.18Å; M911-Y935 HydrophobicContact SD-CE1 3.75Å; M911-A938 HydrophobicContact CE-CB 3.88Å
912	L	88.6	Confident	89.2	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.031	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-75.8	-2.6	179.3	-54.8	173.9	0	0	0	114	I872 I877 Y909 E910 N914 A938 L941 L942	I872-L912 HydrophobicContact CD1-CD1 4.31Å; I877-L912 HydrophobicContact CD1-CB 3.74Å; I877-L912 WeakPolarHBondContact CD1-O 3.31Å; I877-L912 HydrophobicContact CG1-CB 4.32Å; Y909-L912 HydrophobicContact CD1-CD1 3.81Å; Y909-L912 HydrophobicContact CE1-CD1 4.31Å; Y909-L912 VanDerWaalsContact O-CB 3.3Å; Y909-L912 WeakPolarHBondContact O-CB 3.36Å; Y909-L912 PolarHBondContact O-N 3.3Å; Y909-L912 VanDerWaalsContact O-N 3.08Å; E910-L912 PolarHBondContact O-N 3.27Å; E910-L912 VanDerWaalsContact O-N 3.15Å; L912-N914 VanDerWaalsContact C-N 3.25Å; L912-A938 HydrophobicContact CD2-CB 3.91Å; L912-L941 HydrophobicContact CD1-CD2 4Å; L912-L942 HydrophobicContact CB-CD2 4.1Å; L912-L942 HydrophobicContact CD2-CD1 4.31Å; L912-L942 HydrophobicContact CD2-CD2 4.09Å; L912-L942 HydrophobicContact CD2-CG 3.92Å; L912-L942 WeakPolarHBondContact O-CD2 3.34Å
913	Y	88.3	Confident	88.9	Confident	102 Å²	102	39.7 Å²	39.7	40%	0.4	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-71.6	-22	166.7	-68.2	-58.9	0	0	0	112.6	E874 I877 K878 E910 M911	E874-Y913 HydrophobicContact CG-CD1 3.97Å; E874-Y913 HydrophobicContact CG-CE1 3.76Å; I877-Y913 HydrophobicContact CB-CE1 3.85Å; I877-Y913 HydrophobicContact CD1-CD1 3.95Å; I877-Y913 HydrophobicContact CD1-CE1 4.12Å; I877-Y913 HydrophobicContact CG2-CD1 4.31Å; I877-Y913 HydrophobicContact CG2-CD2 4.4Å; I877-Y913 HydrophobicContact CG2-CE1 3.71Å; I877-Y913 HydrophobicContact CG2-CE2 3.81Å; I877-Y913 VanDerWaalsContact CG2-CZ 3.42Å; K878-Y913 HydrophobicContact CG-CE1 4.42Å; K878-Y913 WeakPolarHBondContact CG-OH 3.49Å; E910-Y913 HydrophobicContact CB-CD2 4.36Å; E910-Y913 HydrophobicContact CB-CE2 4.36Å; E910-Y913 HydrophobicContact CG-CE2 4.26Å; E910-Y913 WeakPolarHBondContact O-CD2 3.36Å; E910-Y913 PolarHBondContact O-N 2.95Å; E910-Y913 VanDerWaalsContact O-N 3.12Å; M911-Y913 PolarHBondContact O-N 3.25Å
914	N	88.1	Confident	88.7	Confident	52 Å²	52	41.5 Å²	41.5	28%	0.278	21%	0.205	S	C	.	.	S	Bend	trans	-81.6	154.5	-179.4	-53.1	-69.4	0	0	0	111.3	M911 L912 E918	M911-N914 PolarHBondContact O-N 3.12Å; M911-N914 PolarHBondContact O-ND2 3.31Å; L912-N914 VanDerWaalsContact C-N 3.25Å; N914-E918 HydrophobicContact CB-CB 3.95Å
915	T	84.9	Confident	88.4	Confident	58 Å²	58	44.6 Å²	44.6	36%	0.356	23%	0.225	S	C	.	.			trans	-68.3	160.3	167.2	63.5	0	0	0	0	111.3	D917 E918 L919	T915-D917 PolarHBondContact O-N 3.4Å; T915-D917 VanDerWaalsContact O-N 3.16Å; T915-E918 VanDerWaalsContact CB-OE2 3.29Å; T915-E918 WeakPolarHBondContact CB-OE2 3.43Å; T915-E918 WeakPolarHBondContact CG2-OE2 3.46Å; T915-E918 PolarHBondContact N-OE2 3.23Å; T915-E918 PolarHBondContact O-N 3.17Å; T915-E918 VanDerWaalsContact OG1-CG 3.26Å; T915-E918 WeakPolarHBondContact OG1-CG 3.49Å; T915-E918 PolarHBondContact OG1-N 3.33Å; T915-E918 PolarHBondContact OG1-OE2 2.92Å; T915-L919 WeakPolarHBondContact O-CB 3.27Å; T915-L919 PolarHBondContact O-N 3.48Å
916	P	83.9	Confident	87.9	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-55.4	-33	179.6	-29.4	36.5	0	0	0	114.7	L920 L939 L942	P916-L920 WeakPolarHBondContact O-CG 3.26Å; P916-L920 PolarHBondContact O-N 3.16Å; P916-L939 HydrophobicContact CB-CD2 4Å; P916-L942 HydrophobicContact CG-CB 4.18Å; P916-L942 HydrophobicContact CG-CD1 4.43Å
917	D	85.2	Confident	87.4	Confident	74 Å²	74	48.6 Å²	48.6	40%	0.396	25%	0.247	S	C	.	.	H	α-helix	trans	-81.7	-36.7	-179	-53.4	-51.1	0	0	0	111.7	T915 L919 L920 N921 R958	T915-D917 PolarHBondContact O-N 3.4Å; T915-D917 VanDerWaalsContact O-N 3.16Å; D917-L919 VanDerWaalsContact C-N 3.31Å; D917-L919 PolarHBondContact O-N 3.33Å; D917-L920 PolarHBondContact O-N 3.15Å; D917-N921 PolarHBondContact O-N 2.88Å; D917-N921 VanDerWaalsContact O-N 3.08Å; D917-N921 PolarHBondContact O-ND2 3.47Å; D917-R958 IonicContact OD1-CZ 2.66Å; D917-R958 IonicContact OD1-NE 2.85Å; D917-R958 PolarHBondContact OD1-NE 3.08Å; D917-R958 IonicContact OD1-NH2 2.67Å; D917-R958 PolarHBondContact OD1-NH2 3.38Å; D917-R958 IonicContact OD2-CZ 3.43Å; D917-R958 IonicContact OD2-NE 2.75Å; D917-R958 IonicContact OD2-NH2 3.65Å; D917-R958 PolarHBondContact OD2-NH2 3.38Å
918	E	87.6	Confident	87	Confident	100 Å²	100	46.6 Å²	46.6	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-36.4	170	-71.6	162.9	153.7	0	0	111.9	N914 T915 N921 L922	N914-E918 HydrophobicContact CB-CB 3.95Å; T915-E918 VanDerWaalsContact CB-OE2 3.29Å; T915-E918 WeakPolarHBondContact CB-OE2 3.43Å; T915-E918 WeakPolarHBondContact CG2-OE2 3.46Å; T915-E918 PolarHBondContact N-OE2 3.23Å; T915-E918 PolarHBondContact O-N 3.17Å; T915-E918 VanDerWaalsContact OG1-CG 3.26Å; T915-E918 WeakPolarHBondContact OG1-CG 3.49Å; T915-E918 PolarHBondContact OG1-N 3.33Å; T915-E918 PolarHBondContact OG1-OE2 2.92Å; E918-N921 PolarHBondContact O-N 3.48Å; E918-L922 WeakPolarHBondContact O-CB 3.24Å; E918-L922 PolarHBondContact O-N 3.09Å
919	L	86.6	Confident	86.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-43.3	174	-170.9	159.5	0	0	0	111.2	M911 T915 D917 L922 V923 Y935 L939 L942	M911-L919 HydrophobicContact CE-CD1 4.07Å; M911-L919 HydrophobicContact CG-CD1 3.78Å; M911-L919 HydrophobicContact CG-CG 3.85Å; M911-L919 HydrophobicContact SD-CD1 3.97Å; M911-L919 HydrophobicContact SD-CD2 4.21Å; M911-L919 HydrophobicContact SD-CG 3.86Å; T915-L919 WeakPolarHBondContact O-CB 3.27Å; T915-L919 PolarHBondContact O-N 3.48Å; D917-L919 VanDerWaalsContact C-N 3.31Å; D917-L919 PolarHBondContact O-N 3.33Å; L919-L922 WeakPolarHBondContact O-CB 3.18Å; L919-L922 PolarHBondContact O-N 2.93Å; L919-V923 HydrophobicContact CD2-CG2 4.35Å; L919-V923 WeakPolarHBondContact O-CG2 3.3Å; L919-V923 PolarHBondContact O-N 3.03Å; L919-Y935 HydrophobicContact CD2-CD1 4.23Å; L919-L939 HydrophobicContact CD1-CD2 4.28Å; L919-L939 HydrophobicContact CD2-CD2 4.04Å; L919-L939 HydrophobicContact CD2-CG 4.31Å; L919-L942 HydrophobicContact CD1-CD1 3.67Å
920	L	86.4	Confident	86.4	Confident	11 Å²	11	51.6 Å²	51.6	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-42.8	175.6	-68.8	173.8	0	0	0	111.6	P916 D917 L922 V923 V924 L939 R958 L962 I965	P916-L920 WeakPolarHBondContact O-CG 3.26Å; P916-L920 PolarHBondContact O-N 3.16Å; D917-L920 PolarHBondContact O-N 3.15Å; L920-L922 VanDerWaalsContact C-N 3.34Å; L920-L922 PolarHBondContact O-N 3.43Å; L920-V923 PolarHBondContact O-N 3.49Å; L920-V924 PolarHBondContact O-N 3.19Å; L920-L939 HydrophobicContact CD2-CD1 4.15Å; L920-R958 HydrophobicContact CD1-CB 4.18Å; L920-R958 HydrophobicContact CD1-CG 4.17Å; L920-L962 HydrophobicContact CD2-CB 3.79Å; L920-L962 HydrophobicContact CD2-CD1 4.01Å; L920-L962 HydrophobicContact CD2-CG 4.5Å; L920-I965 HydrophobicContact CB-CD1 4.22Å; L920-I965 HydrophobicContact CD2-CD1 4.29Å
921	N	87.6	Confident	86.3	Confident	100 Å²	100	51.5 Å²	51.5	54%	0.535	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-41.2	174.7	-65.3	-22.4	0	0	0	111.7	D917 E918 V923 V924 D925	D917-N921 PolarHBondContact O-N 2.88Å; D917-N921 VanDerWaalsContact O-N 3.08Å; D917-N921 PolarHBondContact O-ND2 3.47Å; E918-N921 PolarHBondContact O-N 3.48Å; N921-V923 VanDerWaalsContact C-N 3.27Å; N921-V923 PolarHBondContact O-N 2.62Å; N921-V924 WeakPolarHBondContact O-CA 3.37Å; N921-V924 WeakPolarHBondContact O-CB 3.37Å; N921-V924 PolarHBondContact O-N 2.83Å; N921-D925 PolarHBondContact O-N 3.44Å
922	L	86.4	Confident	86.2	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-37	176.5	-166.8	74.5	0	0	0	112.5	M911 E918 L919 L920 Q926	M911-L922 HydrophobicContact CG-CD2 4.11Å; E918-L922 WeakPolarHBondContact O-CB 3.24Å; E918-L922 PolarHBondContact O-N 3.09Å; L919-L922 WeakPolarHBondContact O-CB 3.18Å; L919-L922 PolarHBondContact O-N 2.93Å; L920-L922 VanDerWaalsContact C-N 3.34Å; L920-L922 PolarHBondContact O-N 3.43Å; L922-Q926 VanDerWaalsContact CD1-CD 3.45Å; L922-Q926 HydrophobicContact CD1-CG 4.1Å; L922-Q926 HydrophobicContact CG-CG 4.43Å; L922-Q926 VanDerWaalsContact O-CB 3.32Å; L922-Q926 WeakPolarHBondContact O-CB 3.42Å; L922-Q926 PolarHBondContact O-N 3.31Å
923	V	85.8	Confident	86.2	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-29.4	176.2	-179.5	0	0	0	0	112	L919 L920 N921 G927 V928 Y935 I965	L919-V923 HydrophobicContact CD2-CG2 4.35Å; L919-V923 WeakPolarHBondContact O-CG2 3.3Å; L919-V923 PolarHBondContact O-N 3.03Å; L920-V923 PolarHBondContact O-N 3.49Å; N921-V923 VanDerWaalsContact C-N 3.27Å; N921-V923 PolarHBondContact O-N 2.62Å; V923-G927 CarbonylContact O-C 3.42Å; V923-G927 WeakPolarHBondContact O-CA 3.48Å; V923-G927 PolarHBondContact O-N 3.44Å; V923-G927 VanDerWaalsContact O-N 3.12Å; V923-V928 HydrophobicContact CG1-CG2 4.17Å; V923-Y935 HydrophobicContact CG2-CD1 4.01Å; V923-Y935 HydrophobicContact CG2-CE1 3.4Å; V923-Y935 VanDerWaalsContact CG2-CE1 3.4Å; V923-Y935 HydrophobicContact CG2-CE2 4.5Å; V923-I965 HydrophobicContact CB-CG2 4.36Å; V923-I965 HydrophobicContact CG1-CG2 3.84Å
924	V	86	Confident	86.3	Confident	58 Å²	58	55.3 Å²	55.3	35%	0.352	29%	0.288	S	S	.	.	H	α-helix	trans	-69.6	-47.4	171.4	176.6	0	0	0	0	110.7	L920 N921 I965 Q969	L920-V924 PolarHBondContact O-N 3.19Å; N921-V924 WeakPolarHBondContact O-CA 3.37Å; N921-V924 WeakPolarHBondContact O-CB 3.37Å; N921-V924 PolarHBondContact O-N 2.83Å; V924-I965 HydrophobicContact CG2-CB 4.48Å; V924-I965 HydrophobicContact CG2-CD1 3.79Å; V924-I965 HydrophobicContact CG2-CG1 3.88Å; V924-I965 HydrophobicContact CG2-CG2 3.72Å; V924-Q969 PolarHBondContact O-NE2 2.93Å
925	D	84.4	Confident	86.5	Confident	134 Å²	134	53 Å²	53	72%	0.717	28%	0.275	S	S	*	.	H	α-helix	trans	-76.8	-40.3	-172.9	-68.6	-22.1	0	0	0	113.4	N921	N921-D925 PolarHBondContact O-N 3.44Å
926	Q	82.4	Confident	86.7	Confident	107 Å²	107	52 Å²	52	50%	0.5	27%	0.267	S	S	.	.	H	α-helix	trans	-100.8	-6.9	-176.9	-56.4	-173.5	-11.4	0	0	113.4	L922	L922-Q926 VanDerWaalsContact CD1-CD 3.45Å; L922-Q926 HydrophobicContact CD1-CG 4.1Å; L922-Q926 HydrophobicContact CG-CG 4.43Å; L922-Q926 VanDerWaalsContact O-CB 3.32Å; L922-Q926 WeakPolarHBondContact O-CB 3.42Å; L922-Q926 PolarHBondContact O-N 3.31Å
927	G	82.8	Confident	87	Confident	8 Å²	8	52.6 Å²	52.6	8%	0.082	27%	0.27	C	S	.	.			trans	74.7	172.5	-176.1	0	0	0	0	0	114.4	V923 R929	V923-G927 CarbonylContact O-C 3.42Å; V923-G927 WeakPolarHBondContact O-CA 3.48Å; V923-G927 PolarHBondContact O-N 3.44Å; V923-G927 VanDerWaalsContact O-N 3.12Å; G927-R929 PolarHBondContact O-N 3.29Å
928	V	84.8	Confident	87.2	Confident	31 Å²	31	49.1 Å²	49.1	19%	0.188	25%	0.252	C	S	.	.			trans	-69.1	116.2	180	-177.8	0	0	0	0	110.2	V923 Y930 Y935 I966 Q969 K973	V923-V928 HydrophobicContact CG1-CG2 4.17Å; V928-Y930 VanDerWaalsContact CG1-O 3.28Å; V928-Y930 WeakPolarHBondContact CG1-O 3.29Å; V928-Y935 HydrophobicContact CG1-CE2 4.1Å; V928-I966 HydrophobicContact CG2-CB 4.35Å; V928-I966 HydrophobicContact CG2-CG1 3.96Å; V928-I966 HydrophobicContact CG2-CG2 4.42Å; V928-Q969 HydrophobicContact CG2-CB 3.67Å; V928-Q969 HydrophobicContact CG2-CG 4.17Å; V928-K973 PolarHBondContact O-NZ 2.93Å
929	R	85.2	Confident	87.3	Confident	96 Å²	96	44.7 Å²	44.7	36%	0.362	23%	0.231	S	C	.	.			trans	-108.5	-41.3	176.5	-65	-161.6	-82.1	150.2	-11	113.1	F904 G927 Y935	F904-R929 HydrophobicContact CE2-CB 4.42Å; F904-R929 WeakPolarHBondContact CZ-O 3.47Å; G927-R929 PolarHBondContact O-N 3.29Å; R929-Y935 PolarHBondContact N-OH 3.41Å
930	Y	88.5	Confident	87.4	Confident	8 Å²	8	45.8 Å²	45.8	3%	0.031	24%	0.239	C	C	.	.	S	Bend	trans	-98.7	169.8	176.2	-54.9	-76.8	0	0	0	111.5	I863 F904 Q907 Y908 M911 V928 Y935	I863-Y930 HydrophobicContact CD1-CE1 4.38Å; F904-Y930 HydrophobicContact CD1-CD1 4.44Å; F904-Y930 AromaticContact CD1-CE1 3.85Å; F904-Y930 HydrophobicContact CD1-CE1 3.85Å; F904-Y930 HydrophobicContact CD2-CE1 4.02Å; F904-Y930 AromaticContact CE1-CD1 3.56Å; F904-Y930 HydrophobicContact CE1-CD1 3.56Å; F904-Y930 AromaticContact CE1-CE1 3.37Å; F904-Y930 HydrophobicContact CE1-CE1 3.37Å; F904-Y930 HydrophobicContact CE2-CD1 4.06Å; F904-Y930 AromaticContact CE2-CE1 3.56Å; F904-Y930 HydrophobicContact CE2-CE1 3.56Å; F904-Y930 AromaticContact CE2-CZ 3.98Å; F904-Y930 HydrophobicContact CG-CE1 4.16Å; F904-Y930 AromaticContact CZ-CD1 3.33Å; F904-Y930 HydrophobicContact CZ-CD1 3.33Å; F904-Y930 AromaticContact CZ-CE1 3.21Å; F904-Y930 HydrophobicContact CZ-CE1 3.21Å; F904-Y930 HydrophobicContact CZ-CG 4.25Å; F904-Y930 PolarHBondContact O-OH 3.3Å; F904-Y930 VanDerWaalsContact O-OH 3.09Å; Q907-Y930 WeakPolarHBondContact CB-OH 3.38Å; Y908-Y930 WeakPolarHBondContact CA-OH 3.39Å; Y908-Y930 AromaticContact CD2-CD1 3.8Å; Y908-Y930 HydrophobicContact CD2-CD1 3.8Å; Y908-Y930 HydrophobicContact CD2-CD2 4.05Å; Y908-Y930 AromaticContact CD2-CE1 3.88Å; Y908-Y930 HydrophobicContact CD2-CE1 3.88Å; Y908-Y930 HydrophobicContact CD2-CE2 4.12Å; Y908-Y930 AromaticContact CD2-CG 3.93Å; Y908-Y930 HydrophobicContact CD2-CG 3.93Å; Y908-Y930 HydrophobicContact CG-CE1 4.22Å; Y908-Y930 PolarHBondContact N-OH 2.98Å; M911-Y930 HydrophobicContact CE-CD2 4.34Å; M911-Y930 HydrophobicContact CE-CE2 4.41Å; M911-Y930 HydrophobicContact SD-CE2 4.44Å; V928-Y930 VanDerWaalsContact CG1-O 3.28Å; V928-Y930 WeakPolarHBondContact CG1-O 3.29Å; Y930-Y935 AromaticContact CD2-CE1 3.78Å; Y930-Y935 HydrophobicContact CD2-CE1 3.78Å; Y930-Y935 HydrophobicContact CD2-CE2 4.39Å; Y930-Y935 AromaticContact CD2-CZ 3.7Å; Y930-Y935 PolarHBondContact N-OH 2.88Å; Y930-Y935 WeakPolarHBondContact O-CE2 3.34Å
931	T	88.3	Confident	87.4	Confident	79 Å²	79	45.2 Å²	45.2	49%	0.485	24%	0.236	S	C	.	.			trans	-71	160.5	172.5	65.3	0	0	0	0	111.7	L933 E934 Y935	T931-L933 VanDerWaalsContact C-N 3.27Å; T931-L933 PolarHBondContact O-N 3.4Å; T931-E934 WeakPolarHBondContact CB-OE2 3.32Å; T931-E934 WeakPolarHBondContact CG2-OE2 3.38Å; T931-E934 PolarHBondContact N-OE2 2.89Å; T931-E934 PolarHBondContact O-N 3.24Å; T931-E934 WeakPolarHBondContact OG1-CG 3.45Å; T931-E934 PolarHBondContact OG1-N 3.49Å; T931-E934 PolarHBondContact OG1-OE2 3.43Å; T931-Y935 VanDerWaalsContact O-CD2 3.27Å; T931-Y935 WeakPolarHBondContact O-CD2 3.11Å; T931-Y935 PolarHBondContact O-N 3.28Å; T931-Y935 VanDerWaalsContact O-N 3.1Å
932	E	87.9	Confident	87.4	Confident	77 Å²	77	40.8 Å²	40.8	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-54.8	-43.6	175.9	-172.4	-169.9	152.6	0	0	111.7	E934 Y935 I936 K963 I966	E932-E934 PolarHBondContact O-N 3.07Å; E932-Y935 PolarHBondContact O-N 2.88Å; E932-I936 HydrophobicContact CG-CD1 3.87Å; E932-I936 HydrophobicContact CG-CG1 4.48Å; E932-I936 VanDerWaalsContact O-CG1 3.23Å; E932-I936 WeakPolarHBondContact O-CG1 3.23Å; E932-I936 PolarHBondContact O-N 2.89Å; E932-K963 WeakPolarHBondContact OE1-CE 3.46Å; E932-K963 WeakPolarHBondContact OE1-CG 3.4Å; E932-K963 IonicContact OE1-NZ 2.68Å; E932-K963 PolarHBondContact OE1-NZ 3.47Å; E932-I966 HydrophobicContact CB-CD1 4.02Å; E932-I966 HydrophobicContact CG-CD1 3.94Å
933	L	89	Confident	87.3	Confident	101 Å²	101	40.3 Å²	40.3	53%	0.529	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-39.9	-179.4	-176.9	60.9	0	0	0	112.3	T931 I936 N937	T931-L933 VanDerWaalsContact C-N 3.27Å; T931-L933 PolarHBondContact O-N 3.4Å; L933-I936 PolarHBondContact O-N 2.73Å; L933-N937 WeakPolarHBondContact O-CB 3.24Å; L933-N937 PolarHBondContact O-N 3.27Å; L933-N937 PolarHBondContact O-ND2 3.08Å
934	E	90.9	Very high	87.3	Confident	20 Å²	20	44.3 Å²	44.3	9%	0.093	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-43	176.9	-68.9	164.7	139.4	0	0	111.4	I863 Y908 T931 E932 I936 N937 A938	I863-E934 HydrophobicContact CG2-CB 4.24Å; I863-E934 HydrophobicContact CG2-CG 3.72Å; I863-E934 VanDerWaalsContact CG2-OE1 3.23Å; I863-E934 WeakPolarHBondContact CG2-OE1 3.33Å; Y908-E934 HydrophobicContact CE2-CB 4.04Å; Y908-E934 PolarHBondContact OH-O 3.16Å; Y908-E934 VanDerWaalsContact OH-O 3.08Å; T931-E934 WeakPolarHBondContact CB-OE2 3.32Å; T931-E934 WeakPolarHBondContact CG2-OE2 3.38Å; T931-E934 PolarHBondContact N-OE2 2.89Å; T931-E934 PolarHBondContact O-N 3.24Å; T931-E934 WeakPolarHBondContact OG1-CG 3.45Å; T931-E934 PolarHBondContact OG1-N 3.49Å; T931-E934 PolarHBondContact OG1-OE2 3.43Å; E932-E934 PolarHBondContact O-N 3.07Å; E934-I936 PolarHBondContact O-N 3.19Å; E934-N937 PolarHBondContact O-N 2.93Å; E934-A938 WeakPolarHBondContact O-CB 3.46Å; E934-A938 PolarHBondContact O-N 3.39Å
935	Y	90.9	Very high	87.1	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-38.5	173.3	-74.9	-65.2	0	0	0	112.8	M911 L919 V923 V928 R929 Y930 T931 E932 N937 A938 L939 L962 I966	M911-Y935 HydrophobicContact CE-CD1 4.12Å; M911-Y935 HydrophobicContact CE-CE1 4.14Å; M911-Y935 HydrophobicContact SD-CD1 4.18Å; M911-Y935 HydrophobicContact SD-CE1 3.75Å; L919-Y935 HydrophobicContact CD2-CD1 4.23Å; V923-Y935 HydrophobicContact CG2-CD1 4.01Å; V923-Y935 HydrophobicContact CG2-CE1 3.4Å; V923-Y935 VanDerWaalsContact CG2-CE1 3.4Å; V923-Y935 HydrophobicContact CG2-CE2 4.5Å; V928-Y935 HydrophobicContact CG1-CE2 4.1Å; R929-Y935 PolarHBondContact N-OH 3.41Å; Y930-Y935 AromaticContact CD2-CE1 3.78Å; Y930-Y935 HydrophobicContact CD2-CE1 3.78Å; Y930-Y935 HydrophobicContact CD2-CE2 4.39Å; Y930-Y935 AromaticContact CD2-CZ 3.7Å; Y930-Y935 PolarHBondContact N-OH 2.88Å; Y930-Y935 WeakPolarHBondContact O-CE2 3.34Å; T931-Y935 VanDerWaalsContact O-CD2 3.27Å; T931-Y935 WeakPolarHBondContact O-CD2 3.11Å; T931-Y935 PolarHBondContact O-N 3.28Å; T931-Y935 VanDerWaalsContact O-N 3.1Å; E932-Y935 PolarHBondContact O-N 2.88Å; Y935-N937 VanDerWaalsContact C-N 3.33Å; Y935-A938 PolarHBondContact O-N 2.99Å; Y935-L939 PolarHBondContact O-N 2.9Å; Y935-L962 HydrophobicContact CG-CD1 4.24Å; Y935-I966 HydrophobicContact CD2-CD1 4.27Å
936	I	90	Very high	86.8	Confident	36 Å²	36	39 Å²	39	19%	0.185	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-43.3	172.8	-70.7	168.1	0	0	0	110.6	E932 L933 E934 S940 L959 L962	E932-I936 HydrophobicContact CG-CD1 3.87Å; E932-I936 HydrophobicContact CG-CG1 4.48Å; E932-I936 VanDerWaalsContact O-CG1 3.23Å; E932-I936 WeakPolarHBondContact O-CG1 3.23Å; E932-I936 PolarHBondContact O-N 2.89Å; L933-I936 PolarHBondContact O-N 2.73Å; E934-I936 PolarHBondContact O-N 3.19Å; I936-S940 VanDerWaalsContact O-CB 3.23Å; I936-S940 WeakPolarHBondContact O-CB 3.45Å; I936-S940 PolarHBondContact O-N 2.95Å; I936-S940 PolarHBondContact O-OG 3.36Å; I936-L959 HydrophobicContact CB-CD2 4.34Å; I936-L959 HydrophobicContact CG1-CD2 4.11Å; I936-L959 HydrophobicContact CG2-CD2 4.14Å; I936-L962 HydrophobicContact CG1-CD2 3.98Å
937	N	90.5	Very high	85.7	Confident	18 Å²	18	39.8 Å²	39.8	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-42.9	177.7	-74.7	-26.2	0	0	0	111.9	Q867 L933 E934 Y935 S940 L941	Q867-N937 HydrophobicContact CB-CB 4.49Å; L933-N937 WeakPolarHBondContact O-CB 3.24Å; L933-N937 PolarHBondContact O-N 3.27Å; L933-N937 PolarHBondContact O-ND2 3.08Å; E934-N937 PolarHBondContact O-N 2.93Å; Y935-N937 VanDerWaalsContact C-N 3.33Å; N937-S940 PolarHBondContact O-N 2.65Å; N937-L941 WeakPolarHBondContact O-CB 3.29Å; N937-L941 PolarHBondContact O-N 3.33Å
938	A	89.9	Confident	84.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-52.3	175.1	0	0	0	0	0	112.2	Y908 M911 L912 E934 Y935 S940 L941 L942	Y908-A938 HydrophobicContact CE2-CB 4.12Å; Y908-A938 PolarHBondContact OH-N 3.22Å; M911-A938 HydrophobicContact CE-CB 3.88Å; L912-A938 HydrophobicContact CD2-CB 3.91Å; E934-A938 WeakPolarHBondContact O-CB 3.46Å; E934-A938 PolarHBondContact O-N 3.39Å; Y935-A938 PolarHBondContact O-N 2.99Å; A938-S940 VanDerWaalsContact C-N 3.3Å; A938-S940 PolarHBondContact O-N 3.01Å; A938-L941 PolarHBondContact O-N 3.26Å; A938-L941 VanDerWaalsContact O-N 3.16Å; A938-L942 PolarHBondContact O-N 2.91Å
939	L	88.2	Confident	83.3	Confident	7 Å²	7	44 Å²	44	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-39.7	177.5	-75	176.1	0	0	0	112.1	P916 L919 L920 Y935 L942 H943 L959 L962	P916-L939 HydrophobicContact CB-CD2 4Å; L919-L939 HydrophobicContact CD1-CD2 4.28Å; L919-L939 HydrophobicContact CD2-CD2 4.04Å; L919-L939 HydrophobicContact CD2-CG 4.31Å; L920-L939 HydrophobicContact CD2-CD1 4.15Å; Y935-L939 PolarHBondContact O-N 2.9Å; L939-L942 PolarHBondContact O-N 3.39Å; L939-H943 WeakPolarHBondContact O-CB 3.4Å; L939-H943 PolarHBondContact O-N 3.35Å; L939-L959 HydrophobicContact CB-CD2 4.23Å; L939-L959 HydrophobicContact CD1-CD2 4.11Å; L939-L962 HydrophobicContact CD1-CB 4.25Å; L939-L962 HydrophobicContact CD1-CD2 3.84Å; L939-L962 HydrophobicContact CD1-CG 4.48Å
940	S	88.6	Confident	81.9	Confident	23 Å²	23	41.6 Å²	41.6	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-69.4	-32.4	177.2	-58.4	0	0	0	0	112.4	I936 N937 A938 R944 Q955	I936-S940 VanDerWaalsContact O-CB 3.23Å; I936-S940 WeakPolarHBondContact O-CB 3.45Å; I936-S940 PolarHBondContact O-N 2.95Å; I936-S940 PolarHBondContact O-OG 3.36Å; N937-S940 PolarHBondContact O-N 2.65Å; A938-S940 VanDerWaalsContact C-N 3.3Å; A938-S940 PolarHBondContact O-N 3.01Å; S940-R944 WeakPolarHBondContact O-CB 3.38Å; S940-R944 WeakPolarHBondContact O-CG 3.44Å; S940-R944 PolarHBondContact O-N 3.19Å; S940-R944 VanDerWaalsContact O-N 3.15Å; S940-R944 PolarHBondContact O-NE 2.89Å; S940-Q955 PolarHBondContact OG-NE2 3.31Å
941	L	88.1	Confident	80.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-43.8	171.5	-179.4	55.5	0	0	0	111.9	A866 F869 I872 L912 N937 A938 R944 S945	A866-L941 HydrophobicContact CB-CD2 4.25Å; F869-L941 HydrophobicContact CB-CD1 3.59Å; F869-L941 HydrophobicContact CB-CD2 4.19Å; F869-L941 HydrophobicContact CD2-CD2 4.16Å; F869-L941 WeakPolarHBondContact O-CD1 3.38Å; I872-L941 HydrophobicContact CB-CD1 4.31Å; I872-L941 HydrophobicContact CB-CD2 4.37Å; I872-L941 HydrophobicContact CB-CG 4.44Å; I872-L941 HydrophobicContact CG2-CD1 4.07Å; I872-L941 HydrophobicContact CG2-CD2 3.94Å; I872-L941 HydrophobicContact CG2-CG 3.78Å; L912-L941 HydrophobicContact CD1-CD2 4Å; N937-L941 WeakPolarHBondContact O-CB 3.29Å; N937-L941 PolarHBondContact O-N 3.33Å; A938-L941 PolarHBondContact O-N 3.26Å; A938-L941 VanDerWaalsContact O-N 3.16Å; L941-R944 PolarHBondContact O-N 2.57Å; L941-S945 VanDerWaalsContact O-CB 3.31Å; L941-S945 WeakPolarHBondContact O-CB 3.18Å; L941-S945 PolarHBondContact O-N 2.92Å; L941-S945 VanDerWaalsContact O-N 3.12Å; L941-S945 PolarHBondContact O-OG 2.97Å
942	L	86.6	Confident	80.2	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-49.3	175.2	-71.7	175.7	0	0	0	111.6	L912 P916 L919 A938 L939 R944 S945 Q946	L912-L942 HydrophobicContact CB-CD2 4.1Å; L912-L942 HydrophobicContact CD2-CD1 4.31Å; L912-L942 HydrophobicContact CD2-CD2 4.09Å; L912-L942 HydrophobicContact CD2-CG 3.92Å; L912-L942 WeakPolarHBondContact O-CD2 3.34Å; P916-L942 HydrophobicContact CG-CB 4.18Å; P916-L942 HydrophobicContact CG-CD1 4.43Å; L919-L942 HydrophobicContact CD1-CD1 3.67Å; A938-L942 PolarHBondContact O-N 2.91Å; L939-L942 PolarHBondContact O-N 3.39Å; L942-R944 PolarHBondContact O-N 3.05Å; L942-S945 PolarHBondContact O-N 3.25Å; L942-Q946 WeakPolarHBondContact O-CG 3.29Å; L942-Q946 PolarHBondContact O-N 3.05Å
943	H	84.3	Confident	79.7	Confident	31 Å²	31	49 Å²	49	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-43.6	178.6	177.9	71.1	0	0	0	112.3	L939 S945 V949 M952 Q955	L939-H943 WeakPolarHBondContact O-CB 3.4Å; L939-H943 PolarHBondContact O-N 3.35Å; H943-S945 PolarHBondContact O-N 3.39Å; H943-V949 PolarHBondContact CE1-O 3.08Å; H943-V949 PolarHBondContact ND1-O 3.11Å; H943-M952 WeakPolarHBondContact NE2-CE 3.29Å; H943-Q955 HydrophobicContact CB-CG 4.43Å; H943-Q955 PolarHBondContact CD2-OE1 2.76Å
944	R	85	Confident	79.4	Confident	85 Å²	85	47 Å²	47	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-28.6	175.2	-74.7	177	-68.5	176.4	6.3	113.2	Q867 F869 K870 R871 S940 L941 L942	Q867-R944 PolarHBondContact O-NH1 2.91Å; Q867-R944 PolarHBondContact O-NH2 3.29Å; F869-R944 PolarHBondContact O-NH1 2.96Å; F869-R944 VanDerWaalsContact O-NH1 3.11Å; F869-R944 PolarHBondContact O-NH2 3.42Å; K870-R944 WeakPolarHBondContact O-CB 3.44Å; R871-R944 WeakPolarHBondContact CD-O 3.33Å; R871-R944 WeakPolarHBondContact CG-O 3.43Å; R871-R944 PolarHBondContact NE-O 3.41Å; S940-R944 WeakPolarHBondContact O-CB 3.38Å; S940-R944 WeakPolarHBondContact O-CG 3.44Å; S940-R944 PolarHBondContact O-N 3.19Å; S940-R944 VanDerWaalsContact O-N 3.15Å; S940-R944 PolarHBondContact O-NE 2.89Å; L941-R944 PolarHBondContact O-N 2.57Å; L942-R944 PolarHBondContact O-N 3.05Å
945	S	83.5	Confident	79	Confident	23 Å²	23	47.2 Å²	47.2	16%	0.161	29%	0.288	C	S	.	.	H	α-helix	trans	-93.3	-29.1	-170	-55.8	0	0	0	0	114.4	R871 I872 L941 L942 H943	R871-S945 WeakPolarHBondContact CA-OG 3.48Å; I872-S945 PolarHBondContact N-OG 3.45Å; I872-S945 WeakPolarHBondContact O-CB 3.11Å; L941-S945 VanDerWaalsContact O-CB 3.31Å; L941-S945 WeakPolarHBondContact O-CB 3.18Å; L941-S945 PolarHBondContact O-N 2.92Å; L941-S945 VanDerWaalsContact O-N 3.12Å; L941-S945 PolarHBondContact O-OG 2.97Å; L942-S945 PolarHBondContact O-N 3.25Å; H943-S945 PolarHBondContact O-N 3.39Å
946	Q	77.4	Confident	78.7	Confident	58 Å²	58	51.6 Å²	51.6	27%	0.271	31%	0.312	S	S	.	.	S	Bend	trans	-82.6	127.9	-179.4	-67.7	176.5	-16.6	0	0	111.6	L942 V949	L942-Q946 WeakPolarHBondContact O-CG 3.29Å; L942-Q946 PolarHBondContact O-N 3.05Å; Q946-V949 HydrophobicContact CB-CB 4.25Å; Q946-V949 HydrophobicContact CB-CG2 3.63Å
947	T	60.1	Low	78.5	Confident	124 Å²	124	54.3 Å²	54.3	76%	0.761	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	116.8	175.8	49.4	0	0	0	0	110.9
948	G	60.6	Low	78.3	Confident	83 Å²	83	55.2 Å²	55.2	86%	0.856	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	9.8	173.3	0	0	0	0	0	116.2	G950	G948-G950 PolarHBondContact O-N 2.96Å
949	V	54.9	Low	78.2	Confident	45 Å²	45	56.5 Å²	56.5	27%	0.273	34%	0.339	S	S	.	.			trans	-97.4	80.8	-174.3	-176.3	0	0	0	0	112.6	H943 Q946 R958	H943-V949 PolarHBondContact CE1-O 3.08Å; H943-V949 PolarHBondContact ND1-O 3.11Å; Q946-V949 HydrophobicContact CB-CB 4.25Å; Q946-V949 HydrophobicContact CB-CG2 3.63Å; V949-R958 VanDerWaalsContact CG1-NH1 3.33Å
950	G	57.4	Low	78.1	Confident	44 Å²	44	62 Å²	62	45%	0.454	36%	0.364	S	S	.	.			trans	67.9	154.1	156.1	0	0	0	0	0	118.4	G948	G948-G950 PolarHBondContact O-N 2.96Å
951	D	65.5	Low	78.1	Confident	134 Å²	134	65.5 Å²	65.5	72%	0.717	37%	0.374	S	S	*	.			trans	-64.1	164.6	170.7	-71.4	-42.1	0	0	0	112	S953 T954	D951-S953 PolarHBondContact O-N 3.18Å; D951-T954 PolarHBondContact O-N 2.86Å
952	M	74.6	Confident	78.2	Confident	104 Å²	104	65.5 Å²	65.5	51%	0.512	37%	0.374	S	S	.	.	H	α-helix	trans	-48.9	-28.3	172.8	-73.3	-67.4	95.7	0	0	114	H943 T954 Q955 N956	H943-M952 WeakPolarHBondContact NE2-CE 3.29Å; M952-T954 VanDerWaalsContact C-N 3.34Å; M952-T954 PolarHBondContact O-N 2.94Å; M952-Q955 PolarHBondContact O-N 3.24Å; M952-N956 WeakPolarHBondContact O-CB 3.45Å; M952-N956 VanDerWaalsContact O-CG 3.26Å; M952-N956 PolarHBondContact O-N 2.64Å; M952-N956 PolarHBondContact O-ND2 3.37Å
953	S	77.8	Confident	78.3	Confident	83 Å²	83	69.9 Å²	69.9	58%	0.58	39%	0.392	S	S	*	.	H	α-helix	trans	-54.1	-47.4	172.2	-171.4	0	0	0	0	112.3	D951 Q955 N956 V957	D951-S953 PolarHBondContact O-N 3.18Å; S953-Q955 PolarHBondContact O-N 3.08Å; S953-N956 PolarHBondContact O-N 2.79Å; S953-V957 WeakPolarHBondContact O-CG2 3.41Å; S953-V957 PolarHBondContact O-N 3.21Å
954	T	81.4	Confident	78.5	Confident	57 Å²	57	72.1 Å²	72.1	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-67.2	-37.2	-179.9	-50.7	0	0	0	0	112.1	D951 M952 R958	D951-T954 PolarHBondContact O-N 2.86Å; M952-T954 VanDerWaalsContact C-N 3.34Å; M952-T954 PolarHBondContact O-N 2.94Å; T954-R958 WeakPolarHBondContact O-CG 3.37Å; T954-R958 PolarHBondContact O-N 3.47Å; T954-R958 VanDerWaalsContact O-N 3.16Å
955	Q	83	Confident	78.6	Confident	25 Å²	25	68.2 Å²	68.2	12%	0.117	39%	0.389	C	S	.	.	H	α-helix	trans	-65.4	-45.4	173.9	-171.6	-177.8	-2	0	0	110.9	S940 H943 M952 S953 V957 R958 L959	S940-Q955 PolarHBondContact OG-NE2 3.31Å; H943-Q955 HydrophobicContact CB-CG 4.43Å; H943-Q955 PolarHBondContact CD2-OE1 2.76Å; M952-Q955 PolarHBondContact O-N 3.24Å; S953-Q955 PolarHBondContact O-N 3.08Å; Q955-V957 PolarHBondContact O-N 3.27Å; Q955-R958 PolarHBondContact O-N 3.35Å; Q955-L959 HydrophobicContact CG-CD1 4.09Å; Q955-L959 HydrophobicContact CG-CG 4.36Å; Q955-L959 WeakPolarHBondContact O-CG 3.48Å; Q955-L959 PolarHBondContact O-N 2.84Å
956	N	84.3	Confident	78.7	Confident	96 Å²	96	68.3 Å²	68.3	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-41.6	178.9	-72	-25.8	0	0	0	112.4	M952 S953 L959 Q960	M952-N956 WeakPolarHBondContact O-CB 3.45Å; M952-N956 VanDerWaalsContact O-CG 3.26Å; M952-N956 PolarHBondContact O-N 2.64Å; M952-N956 PolarHBondContact O-ND2 3.37Å; S953-N956 PolarHBondContact O-N 2.79Å; N956-L959 PolarHBondContact O-N 2.68Å; N956-Q960 WeakPolarHBondContact O-CB 3.44Å; N956-Q960 PolarHBondContact O-N 3.29Å
957	V	86.6	Confident	79.2	Confident	94 Å²	94	69.8 Å²	69.8	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-60.8	-44.7	174.3	171	0	0	0	0	111.4	S953 Q955 Q960 R961	S953-V957 WeakPolarHBondContact O-CG2 3.41Å; S953-V957 PolarHBondContact O-N 3.21Å; Q955-V957 PolarHBondContact O-N 3.27Å; V957-Q960 PolarHBondContact O-N 2.75Å; V957-R961 WeakPolarHBondContact O-CB 3.3Å; V957-R961 PolarHBondContact O-N 3.4Å
958	R	86.1	Confident	80.4	Confident	36 Å²	36	68.1 Å²	68.1	14%	0.136	39%	0.386	C	S	.	.	H	α-helix	trans	-64	-40.2	176.5	-73.9	172.8	173.5	150.1	-4.3	112.6	D917 L920 V949 T954 Q955 R961 L962	D917-R958 IonicContact OD1-CZ 2.66Å; D917-R958 IonicContact OD1-NE 2.85Å; D917-R958 PolarHBondContact OD1-NE 3.08Å; D917-R958 IonicContact OD1-NH2 2.67Å; D917-R958 PolarHBondContact OD1-NH2 3.38Å; D917-R958 IonicContact OD2-CZ 3.43Å; D917-R958 IonicContact OD2-NE 2.75Å; D917-R958 IonicContact OD2-NH2 3.65Å; D917-R958 PolarHBondContact OD2-NH2 3.38Å; L920-R958 HydrophobicContact CD1-CB 4.18Å; L920-R958 HydrophobicContact CD1-CG 4.17Å; V949-R958 VanDerWaalsContact CG1-NH1 3.33Å; T954-R958 WeakPolarHBondContact O-CG 3.37Å; T954-R958 PolarHBondContact O-N 3.47Å; T954-R958 VanDerWaalsContact O-N 3.16Å; Q955-R958 PolarHBondContact O-N 3.35Å; R958-R961 PolarHBondContact O-N 3.4Å; R958-L962 PolarHBondContact O-N 2.94Å
959	L	87.5	Confident	81.5	Confident	27 Å²	27	65.6 Å²	65.6	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-37.2	176.1	-68.3	174.6	0	0	0	112.2	I936 L939 Q955 N956 K963	I936-L959 HydrophobicContact CB-CD2 4.34Å; I936-L959 HydrophobicContact CG1-CD2 4.11Å; I936-L959 HydrophobicContact CG2-CD2 4.14Å; L939-L959 HydrophobicContact CB-CD2 4.23Å; L939-L959 HydrophobicContact CD1-CD2 4.11Å; Q955-L959 HydrophobicContact CG-CD1 4.09Å; Q955-L959 HydrophobicContact CG-CG 4.36Å; Q955-L959 WeakPolarHBondContact O-CG 3.48Å; Q955-L959 PolarHBondContact O-N 2.84Å; N956-L959 PolarHBondContact O-N 2.68Å; L959-K963 PolarHBondContact O-N 2.88Å
960	Q	87.7	Confident	82.8	Confident	123 Å²	123	66 Å²	66	58%	0.575	36%	0.36	S	S	*	.	H	α-helix	trans	-66.8	-44.1	173.2	-176.6	170	-16.3	0	0	111.1	N956 V957 L962 K963 E964	N956-Q960 WeakPolarHBondContact O-CB 3.44Å; N956-Q960 PolarHBondContact O-N 3.29Å; V957-Q960 PolarHBondContact O-N 2.75Å; Q960-L962 VanDerWaalsContact C-N 3.31Å; Q960-L962 PolarHBondContact O-N 3.38Å; Q960-K963 WeakPolarHBondContact O-CB 3.47Å; Q960-K963 PolarHBondContact O-N 3.44Å; Q960-K963 VanDerWaalsContact O-N 3.12Å; Q960-E964 PolarHBondContact O-N 3.4Å; Q960-E964 VanDerWaalsContact O-N 3.09Å
961	R	88.1	Confident	83.9	Confident	96 Å²	96	66.9 Å²	66.9	36%	0.362	36%	0.363	S	S	.	.	H	α-helix	trans	-63.6	-35.2	176.9	-171.9	61.4	-168.5	142	11.5	112.6	V957 R958 E964 I965 E968	V957-R961 WeakPolarHBondContact O-CB 3.3Å; V957-R961 PolarHBondContact O-N 3.4Å; R958-R961 PolarHBondContact O-N 3.4Å; R961-E964 VanDerWaalsContact CD-OE2 3.25Å; R961-E964 WeakPolarHBondContact CD-OE2 3.43Å; R961-E964 IonicContact CZ-OE2 3.21Å; R961-E964 IonicContact NE-OE2 3.81Å; R961-E964 IonicContact NH1-OE2 2.57Å; R961-E964 PolarHBondContact NH1-OE2 3.15Å; R961-E964 PolarHBondContact O-N 3.1Å; R961-I965 HydrophobicContact CG-CD1 3.95Å; R961-I965 HydrophobicContact CG-CG1 4.5Å; R961-I965 WeakPolarHBondContact O-CD1 3.29Å; R961-I965 VanDerWaalsContact O-CG1 3.26Å; R961-I965 WeakPolarHBondContact O-CG1 3.21Å; R961-I965 PolarHBondContact O-N 3.02Å; R961-E968 IonicContact CZ-OE1 3.85Å; R961-E968 IonicContact NH1-OE1 3.61Å; R961-E968 PolarHBondContact NH1-OE1 3.16Å; R961-E968 IonicContact NH2-OE1 2.88Å; R961-E968 PolarHBondContact NH2-OE1 2.92Å; R961-E968 IonicContact NH2-OE2 3.68Å; R961-E968 PolarHBondContact NH2-OE2 3.44Å
962	L	89.3	Confident	84.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-57.7	-46.8	171.1	176.4	67.2	0	0	0	111.8	L920 Y935 I936 L939 R958 Q960 I965 I966	L920-L962 HydrophobicContact CD2-CB 3.79Å; L920-L962 HydrophobicContact CD2-CD1 4.01Å; L920-L962 HydrophobicContact CD2-CG 4.5Å; Y935-L962 HydrophobicContact CG-CD1 4.24Å; I936-L962 HydrophobicContact CG1-CD2 3.98Å; L939-L962 HydrophobicContact CD1-CB 4.25Å; L939-L962 HydrophobicContact CD1-CD2 3.84Å; L939-L962 HydrophobicContact CD1-CG 4.48Å; R958-L962 PolarHBondContact O-N 2.94Å; Q960-L962 VanDerWaalsContact C-N 3.31Å; Q960-L962 PolarHBondContact O-N 3.38Å; L962-I965 PolarHBondContact O-N 3.16Å; L962-I966 HydrophobicContact CD1-CD1 3.85Å; L962-I966 HydrophobicContact CD1-CG1 4.24Å; L962-I966 HydrophobicContact CD2-CD1 4.45Å; L962-I966 HydrophobicContact CG-CD1 3.84Å; L962-I966 WeakPolarHBondContact O-CG1 3.38Å; L962-I966 PolarHBondContact O-N 3.22Å
963	K	88.2	Confident	84.9	Confident	99 Å²	99	65.1 Å²	65.1	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-43.6	179	-69.7	171.7	-178.2	-85.5	0	111.6	E932 L959 Q960 I966 C967	E932-K963 WeakPolarHBondContact OE1-CE 3.46Å; E932-K963 WeakPolarHBondContact OE1-CG 3.4Å; E932-K963 IonicContact OE1-NZ 2.68Å; E932-K963 PolarHBondContact OE1-NZ 3.47Å; L959-K963 PolarHBondContact O-N 2.88Å; Q960-K963 WeakPolarHBondContact O-CB 3.47Å; Q960-K963 PolarHBondContact O-N 3.44Å; Q960-K963 VanDerWaalsContact O-N 3.12Å; K963-I966 PolarHBondContact O-N 3.31Å; K963-C967 PolarHBondContact O-N 2.96Å; K963-C967 PolarHBondContact O-SG 2.66Å; K963-C967 VanDerWaalsContact O-SG 3.4Å
964	E	88.6	Confident	84.9	Confident	78 Å²	78	65.8 Å²	65.8	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-51.3	174	-68	168.2	-169.5	0	0	111.3	Q960 R961 I966 C967 E968	Q960-E964 PolarHBondContact O-N 3.4Å; Q960-E964 VanDerWaalsContact O-N 3.09Å; R961-E964 VanDerWaalsContact CD-OE2 3.25Å; R961-E964 WeakPolarHBondContact CD-OE2 3.43Å; R961-E964 IonicContact CZ-OE2 3.21Å; R961-E964 IonicContact NE-OE2 3.81Å; R961-E964 IonicContact NH1-OE2 2.57Å; R961-E964 PolarHBondContact NH1-OE2 3.15Å; R961-E964 PolarHBondContact O-N 3.1Å; E964-I966 VanDerWaalsContact C-N 3.34Å; E964-I966 PolarHBondContact O-N 3.2Å; E964-C967 PolarHBondContact O-N 2.88Å; E964-E968 WeakPolarHBondContact O-CB 3.31Å; E964-E968 VanDerWaalsContact O-CG 3.29Å; E964-E968 WeakPolarHBondContact O-CG 3.41Å; E964-E968 PolarHBondContact O-N 2.79Å
965	I	87.9	Confident	84.6	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-59.4	-42.3	178.7	-68.4	162.4	0	0	0	111.6	L920 V923 V924 R961 L962 E968 Q969	L920-I965 HydrophobicContact CB-CD1 4.22Å; L920-I965 HydrophobicContact CD2-CD1 4.29Å; V923-I965 HydrophobicContact CB-CG2 4.36Å; V923-I965 HydrophobicContact CG1-CG2 3.84Å; V924-I965 HydrophobicContact CG2-CB 4.48Å; V924-I965 HydrophobicContact CG2-CD1 3.79Å; V924-I965 HydrophobicContact CG2-CG1 3.88Å; V924-I965 HydrophobicContact CG2-CG2 3.72Å; R961-I965 HydrophobicContact CG-CD1 3.95Å; R961-I965 HydrophobicContact CG-CG1 4.5Å; R961-I965 WeakPolarHBondContact O-CD1 3.29Å; R961-I965 VanDerWaalsContact O-CG1 3.26Å; R961-I965 WeakPolarHBondContact O-CG1 3.21Å; R961-I965 PolarHBondContact O-N 3.02Å; L962-I965 PolarHBondContact O-N 3.16Å; I965-E968 PolarHBondContact O-N 3.07Å; I965-Q969 HydrophobicContact CG2-CG 4.29Å; I965-Q969 VanDerWaalsContact O-CB 3.31Å; I965-Q969 WeakPolarHBondContact O-CB 3.44Å; I965-Q969 WeakPolarHBondContact O-CG 3.33Å; I965-Q969 PolarHBondContact O-N 2.98Å
966	I	86.6	Confident	84.2	Confident	25 Å²	25	67.7 Å²	67.7	13%	0.128	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-42.1	177.9	-70.6	170.7	0	0	0	110.8	V928 E932 Y935 L962 K963 E964 Q969 A970	V928-I966 HydrophobicContact CG2-CB 4.35Å; V928-I966 HydrophobicContact CG2-CG1 3.96Å; V928-I966 HydrophobicContact CG2-CG2 4.42Å; E932-I966 HydrophobicContact CB-CD1 4.02Å; E932-I966 HydrophobicContact CG-CD1 3.94Å; Y935-I966 HydrophobicContact CD2-CD1 4.27Å; L962-I966 HydrophobicContact CD1-CD1 3.85Å; L962-I966 HydrophobicContact CD1-CG1 4.24Å; L962-I966 HydrophobicContact CD2-CD1 4.45Å; L962-I966 HydrophobicContact CG-CD1 3.84Å; L962-I966 WeakPolarHBondContact O-CG1 3.38Å; L962-I966 PolarHBondContact O-N 3.22Å; K963-I966 PolarHBondContact O-N 3.31Å; E964-I966 VanDerWaalsContact C-N 3.34Å; E964-I966 PolarHBondContact O-N 3.2Å; I966-Q969 PolarHBondContact O-N 3.29Å; I966-A970 VanDerWaalsContact O-CB 3.29Å; I966-A970 WeakPolarHBondContact O-CB 3.37Å; I966-A970 PolarHBondContact O-N 3.48Å
967	C	86.3	Confident	83.6	Confident	88 Å²	88	69.4 Å²	69.4	60%	0.595	37%	0.365	S	S	*	.	H	α-helix	trans	-65	-44.3	174.9	-72.3	0	0	0	0	112.6	K963 E964 A970 A971	K963-C967 PolarHBondContact O-N 2.96Å; K963-C967 PolarHBondContact O-SG 2.66Å; K963-C967 VanDerWaalsContact O-SG 3.4Å; E964-C967 PolarHBondContact O-N 2.88Å; C967-A970 PolarHBondContact O-N 3.31Å; C967-A971 WeakPolarHBondContact O-CB 3.48Å; C967-A971 PolarHBondContact O-N 2.72Å
968	E	86.3	Confident	82.8	Confident	89 Å²	89	68.5 Å²	68.5	42%	0.416	36%	0.357	S	S	.	.	H	α-helix	trans	-56.4	-50	174.4	-72.4	167.7	-159.7	0	0	110.3	R961 E964 I965 A971 I972	R961-E968 IonicContact CZ-OE1 3.85Å; R961-E968 IonicContact NH1-OE1 3.61Å; R961-E968 PolarHBondContact NH1-OE1 3.16Å; R961-E968 IonicContact NH2-OE1 2.88Å; R961-E968 PolarHBondContact NH2-OE1 2.92Å; R961-E968 IonicContact NH2-OE2 3.68Å; R961-E968 PolarHBondContact NH2-OE2 3.44Å; E964-E968 WeakPolarHBondContact O-CB 3.31Å; E964-E968 VanDerWaalsContact O-CG 3.29Å; E964-E968 WeakPolarHBondContact O-CG 3.41Å; E964-E968 PolarHBondContact O-N 2.79Å; I965-E968 PolarHBondContact O-N 3.07Å; E968-A971 PolarHBondContact O-N 3.21Å; E968-I972 VanDerWaalsContact O-CG1 3.29Å; E968-I972 WeakPolarHBondContact O-CG1 3.26Å; E968-I972 PolarHBondContact O-N 3.32Å
969	Q	83.8	Confident	81.9	Confident	30 Å²	30	73.8 Å²	73.8	14%	0.14	38%	0.381	C	S	.	.	H	α-helix	trans	-66.8	-36.1	179.1	-72.1	-72.9	-17.3	0	0	113.3	V924 V928 I965 I966 I972 K973	V924-Q969 PolarHBondContact O-NE2 2.93Å; V928-Q969 HydrophobicContact CG2-CB 3.67Å; V928-Q969 HydrophobicContact CG2-CG 4.17Å; I965-Q969 HydrophobicContact CG2-CG 4.29Å; I965-Q969 VanDerWaalsContact O-CB 3.31Å; I965-Q969 WeakPolarHBondContact O-CB 3.44Å; I965-Q969 WeakPolarHBondContact O-CG 3.33Å; I965-Q969 PolarHBondContact O-N 2.98Å; I966-Q969 PolarHBondContact O-N 3.29Å; Q969-I972 PolarHBondContact O-N 2.85Å; Q969-K973 WeakPolarHBondContact O-CG 3.46Å; Q969-K973 PolarHBondContact O-N 2.93Å
970	A	81.6	Confident	80.4	Confident	54 Å²	54	80.3 Å²	80.3	45%	0.446	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-42.7	173.9	0	0	0	0	0	111.4	I966 C967 I972 K973 Q974	I966-A970 VanDerWaalsContact O-CB 3.29Å; I966-A970 WeakPolarHBondContact O-CB 3.37Å; I966-A970 PolarHBondContact O-N 3.48Å; C967-A970 PolarHBondContact O-N 3.31Å; A970-I972 VanDerWaalsContact C-N 3.35Å; A970-I972 PolarHBondContact O-N 3.12Å; A970-K973 PolarHBondContact O-N 2.77Å; A970-Q974 WeakPolarHBondContact O-CB 3.39Å; A970-Q974 PolarHBondContact O-N 2.91Å
971	A	81.4	Confident	78.9	Confident	62 Å²	62	79.6 Å²	79.6	51%	0.512	41%	0.407	S	S	.	.	H	α-helix	trans	-63.3	-38.9	174.5	0	0	0	0	0	112.1	C967 E968 Q974 A975	C967-A971 WeakPolarHBondContact O-CB 3.48Å; C967-A971 PolarHBondContact O-N 2.72Å; E968-A971 PolarHBondContact O-N 3.21Å; A971-Q974 PolarHBondContact O-N 3.46Å; A971-A975 VanDerWaalsContact O-CB 3.3Å; A971-A975 WeakPolarHBondContact O-CB 3.45Å; A971-A975 PolarHBondContact O-N 3.44Å
972	I	81.6	Confident	77.3	Confident	91 Å²	91	80.6 Å²	80.6	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-44.3	174.3	-67.3	162.5	0	0	0	111.3	E968 Q969 A970 Q974 A975 T976	E968-I972 VanDerWaalsContact O-CG1 3.29Å; E968-I972 WeakPolarHBondContact O-CG1 3.26Å; E968-I972 PolarHBondContact O-N 3.32Å; Q969-I972 PolarHBondContact O-N 2.85Å; A970-I972 VanDerWaalsContact C-N 3.35Å; A970-I972 PolarHBondContact O-N 3.12Å; I972-Q974 VanDerWaalsContact C-N 3.35Å; I972-Q974 PolarHBondContact O-N 2.82Å; I972-A975 PolarHBondContact O-N 3.01Å; I972-T976 WeakPolarHBondContact O-CB 3.3Å; I972-T976 WeakPolarHBondContact O-CG2 3.42Å; I972-T976 PolarHBondContact O-N 3.26Å; I972-T976 PolarHBondContact O-OG1 3.12Å
973	K	78.6	Confident	75.5	Confident	110 Å²	110	86.4 Å²	86.4	48%	0.478	46%	0.459	S	S	.	.	H	α-helix	trans	-62.3	-39.6	175.1	-77.1	-178	-178.8	178.7	0	111.9	V928 Q969 A970 T976 K977	V928-K973 PolarHBondContact O-NZ 2.93Å; Q969-K973 WeakPolarHBondContact O-CG 3.46Å; Q969-K973 PolarHBondContact O-N 2.93Å; A970-K973 PolarHBondContact O-N 2.77Å; K973-T976 WeakPolarHBondContact CA-OG1 3.36Å; K973-T976 PolarHBondContact O-OG1 3.41Å; K973-K977 WeakPolarHBondContact O-CB 3.44Å; K973-K977 PolarHBondContact O-N 3.15Å; K973-K977 VanDerWaalsContact O-N 3.08Å
974	Q	77.3	Confident	73.2	Confident	97 Å²	97	90.5 Å²	90.5	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-68	-49.9	176.4	-174.8	56.1	37.1	0	0	111.3	A970 A971 I972 T976 K977 D978	A970-Q974 WeakPolarHBondContact O-CB 3.39Å; A970-Q974 PolarHBondContact O-N 2.91Å; A971-Q974 PolarHBondContact O-N 3.46Å; I972-Q974 VanDerWaalsContact C-N 3.35Å; I972-Q974 PolarHBondContact O-N 2.82Å; Q974-T976 VanDerWaalsContact C-N 3.26Å; Q974-T976 PolarHBondContact O-N 3.03Å; Q974-K977 WeakPolarHBondContact O-CA 3.4Å; Q974-K977 WeakPolarHBondContact O-CB 3.31Å; Q974-K977 PolarHBondContact O-N 3.4Å; Q974-D978 PolarHBondContact NE2-OD1 3.27Å; Q974-D978 PolarHBondContact NE2-OD2 3.11Å; Q974-D978 PolarHBondContact O-N 2.65Å
975	A	76.4	Confident	72.4	Confident	48 Å²	48	91.1 Å²	91.1	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-30.5	178.5	0	0	0	0	0	113.6	A971 I972 K979	A971-A975 VanDerWaalsContact O-CB 3.3Å; A971-A975 WeakPolarHBondContact O-CB 3.45Å; A971-A975 PolarHBondContact O-N 3.44Å; I972-A975 PolarHBondContact O-N 3.01Å; A975-K979 WeakPolarHBondContact O-CB 3.45Å; A975-K979 VanDerWaalsContact O-CG 3.28Å; A975-K979 WeakPolarHBondContact O-CG 3.12Å; A975-K979 PolarHBondContact O-N 3.3Å; A975-K979 VanDerWaalsContact O-N 3.13Å
976	T	74.2	Confident	71.6	Confident	74 Å²	74	95.7 Å²	95.7	45%	0.454	52%	0.524	S	S	.	.	H	α-helix	trans	-77.1	-31.9	173.7	46.7	0	0	0	0	112.7	I972 K973 Q974 K980	I972-T976 WeakPolarHBondContact O-CB 3.3Å; I972-T976 WeakPolarHBondContact O-CG2 3.42Å; I972-T976 PolarHBondContact O-N 3.26Å; I972-T976 PolarHBondContact O-OG1 3.12Å; K973-T976 WeakPolarHBondContact CA-OG1 3.36Å; K973-T976 PolarHBondContact O-OG1 3.41Å; Q974-T976 VanDerWaalsContact C-N 3.26Å; Q974-T976 PolarHBondContact O-N 3.03Å; T976-K980 PolarHBondContact O-N 3.27Å; T976-K980 VanDerWaalsContact O-N 3.14Å
977	K	71.8	Confident	70.7	Confident	132 Å²	132	99.6 Å²	99.6	57%	0.574	55%	0.546	S	S	*	.	H	α-helix	trans	-67.3	-45.7	171.1	-167.5	176.2	-177.8	179.8	0	111.5	K973 Q974 K979 K980 I981	K973-K977 WeakPolarHBondContact O-CB 3.44Å; K973-K977 PolarHBondContact O-N 3.15Å; K973-K977 VanDerWaalsContact O-N 3.08Å; Q974-K977 WeakPolarHBondContact O-CA 3.4Å; Q974-K977 WeakPolarHBondContact O-CB 3.31Å; Q974-K977 PolarHBondContact O-N 3.4Å; K977-K979 PolarHBondContact O-N 3.12Å; K977-K980 WeakPolarHBondContact O-CB 3.48Å; K977-K980 PolarHBondContact O-N 3.01Å; K977-K980 VanDerWaalsContact O-N 3.12Å; K977-I981 HydrophobicContact CG-CD1 4.2Å; K977-I981 WeakPolarHBondContact O-CG1 3.04Å; K977-I981 PolarHBondContact O-N 3.44Å
978	D	69.8	Low	69.8	Low	75 Å²	75	100.3 Å²	100.3	40%	0.401	54%	0.543	S	S	.	.	H	α-helix	trans	-65.8	-36.8	179.2	-63.9	-29.4	0	0	0	112.1	Q974 I981 T982	Q974-D978 PolarHBondContact NE2-OD1 3.27Å; Q974-D978 PolarHBondContact NE2-OD2 3.11Å; Q974-D978 PolarHBondContact O-N 2.65Å; D978-I981 PolarHBondContact O-N 2.86Å; D978-T982 PolarHBondContact O-N 3.27Å; D978-T982 VanDerWaalsContact O-N 3.09Å; D978-T982 PolarHBondContact O-OG1 2.6Å
979	K	66.3	Low	68.8	Low	147 Å²	147	101 Å²	101	64%	0.639	55%	0.551	S	S	*	*	H	α-helix	trans	-62.2	-41.7	169.5	-79.6	176.7	179.3	-178.8	0	112.9	A975 K977 I981 T982 T983	A975-K979 WeakPolarHBondContact O-CB 3.45Å; A975-K979 VanDerWaalsContact O-CG 3.28Å; A975-K979 WeakPolarHBondContact O-CG 3.12Å; A975-K979 PolarHBondContact O-N 3.3Å; A975-K979 VanDerWaalsContact O-N 3.13Å; K977-K979 PolarHBondContact O-N 3.12Å; K979-I981 VanDerWaalsContact C-N 3.32Å; K979-I981 PolarHBondContact O-N 2.95Å; K979-T982 WeakPolarHBondContact CA-OG1 3.37Å; K979-T982 PolarHBondContact O-N 3.02Å; K979-T982 PolarHBondContact O-OG1 3.27Å; K979-T983 PolarHBondContact O-N 3.11Å; K979-T983 PolarHBondContact O-OG1 2.8Å
980	K	56.5	Low	67.8	Low	164 Å²	164	105.7 Å²	105.7	71%	0.713	58%	0.578	S	S	*	*	H	α-helix	trans	-63.3	-38.1	175.3	-80	-176.2	173.5	-174.9	0	112	T976 K977 T982 T983	T976-K980 PolarHBondContact O-N 3.27Å; T976-K980 VanDerWaalsContact O-N 3.14Å; K977-K980 WeakPolarHBondContact O-CB 3.48Å; K977-K980 PolarHBondContact O-N 3.01Å; K977-K980 VanDerWaalsContact O-N 3.12Å; K980-T982 VanDerWaalsContact C-N 3.29Å; K980-T982 PolarHBondContact O-N 3Å; K980-T983 PolarHBondContact O-N 3.36Å
981	I	57.2	Low	66.8	Low	109 Å²	109	109.4 Å²	109.4	56%	0.559	59%	0.588	S	S	*	*	H	α-helix	trans	-69.5	-25	177.2	-65.1	163.3	0	0	0	112.3	K977 D978 K979	K977-I981 HydrophobicContact CG-CD1 4.2Å; K977-I981 WeakPolarHBondContact O-CG1 3.04Å; K977-I981 PolarHBondContact O-N 3.44Å; D978-I981 PolarHBondContact O-N 2.86Å; K979-I981 VanDerWaalsContact C-N 3.32Å; K979-I981 PolarHBondContact O-N 2.95Å
982	T	54.6	Low	65.7	Low	117 Å²	117	113.1 Å²	113.1	72%	0.718	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	2	175.3	33.5	0	0	0	0	114.6	D978 K979 K980	D978-T982 PolarHBondContact O-N 3.27Å; D978-T982 VanDerWaalsContact O-N 3.09Å; D978-T982 PolarHBondContact O-OG1 2.6Å; K979-T982 WeakPolarHBondContact CA-OG1 3.37Å; K979-T982 PolarHBondContact O-N 3.02Å; K979-T982 PolarHBondContact O-OG1 3.27Å; K980-T982 VanDerWaalsContact C-N 3.29Å; K980-T982 PolarHBondContact O-N 3Å
983	T	50.7	Low	64.4	Low	121 Å²	121	114.9 Å²	114.9	74%	0.742	60%	0.604	S	S	*	*			trans	-114.5	12.9	177.2	-34.7	0	0	0	0	112.6	K979 K980	K979-T983 PolarHBondContact O-N 3.11Å; K979-T983 PolarHBondContact O-OG1 2.8Å; K980-T983 PolarHBondContact O-N 3.36Å
984	V	39	Very low	63.1	Low	185 Å²	185	115.4 Å²	115.4	100%	1.121	62%	0.616	S	S	*	*			trans	-120.8	0	170.9	-179.8	0	0	0	0	107.8

Retrieved 984 of 984 residues in 1385.2 ms (Link to these results)

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