A0A077ZMS6_TRITR Loading...

Eukaryotic translation initiation factor 3 subunit C

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A077ZMS6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 865 aa.

						>A0A077ZMS6_TRITR|A0A077ZMS6
MSKFFRALSESESETESSDEEQIQPARTAYQRPMPAFVLSDSEDDQKRVVRPEKDRRFEELRDLIKQIRNLRKIKDMSKILTTFEDLCRVFQKAKAVIDREGGVTPRFFLRSLTELEDFVNENWDDRKDRKTLSKNNARGLATLRQKLRKYMRDFETELTDYRREPDSDGHSTEEEERKLASESARESSDEEREIESRKVRRSVNRESDESDWEMSSSSESELEDLTGKKMEELRRFFLKSSTKEDDDRAKKKMDRKKRREDKERPAEGKREDADGEWQQVTMGALATEEAPKMFEKDAEITAQAVSDKLREIISARRRKGADRFLTVEMVRELRKIAEAREMNPALLGNILFSLISSYFDCNPKSADCLLFKSWLGAMDALRDLIQLLLDNPDVLCSIEISDEQQNVTDPQLPWKLRGCVLSVLERLDDEFTKILQDADCHSTDYVEKLKGEKTICAIINLLVQYMESRDSTDEELCRAYTRKVGHLYYKFDPASVPMDVENFDSDKVNAPCSYKEMRTLCQFIYVHDTTHLLRTRAVLCQVYHLAIHDRWYEGRDILLMSHLQTHIERSDIPTQILFNRAVCQLGLCAFRQGLIREALNALSDLQNGGRAKELLAQGAVMRTQDRTVEQEKLERQRRVPYHMHINLELTECVYLLCAMLLEIPMMASKEFEVRRRMISRSFHYQLKQSERQYLIGPPENTREHVMAASKALLVGDWRACRDFLINKKMNSKVWNLFQNSERVKQMIIRHVKEESLKTYLVTYSCVYDSISLDRLGSMFELEPRTVHTIVSKMIIEGDFPASFDEPSACVVINHVEPKRLHTLALQITEKLNVLAENVEQLIDPRTTGNRGYSNYLAAQRGQNY
					

Structure Viewer

Loading PAE data...

(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	43.4	Very low	38	Very low	132 Å²	132	144.6 Å²	144.6	65%	0.65	75%	0.753	S	S	*	*				0	45.9	0	-66.6	-156.4	-83	0	0	111.4	Q565	M1-Q565 HydrophobicContact SD-CG 4.44Å; M1-Q565 PolarHBondContact SD-NE2 3.09Å
2	S	33.4	Very low	37.7	Very low	95 Å²	95	149.5 Å²	149.5	66%	0.664	77%	0.769	S	S	*	*			trans	-124.3	112.3	-162.8	58.4	0	0	0	0	112.1
3	K	40.2	Very low	37	Very low	199 Å²	199	146.3 Å²	146.3	87%	0.865	77%	0.768	S	S	*	*			trans	163.4	5.1	148.6	-93.8	172.9	-178.6	-177.2	0	116.9
4	F	42.5	Very low	36.8	Very low	111 Å²	111	148.4 Å²	148.4	49%	0.487	77%	0.772	S	S	.	*			trans	-88.6	-21.8	-160.9	-78.7	-70.8	0	0	0	117.8	R6 E569	F4-R6 PolarHBondContact O-N 3.15Å; F4-E569 VanDerWaalsContact CB-OE1 3.23Å; F4-E569 WeakPolarHBondContact CB-OE1 3.48Å; F4-E569 WeakPolarHBondContact CD1-OE1 3.26Å
5	F	46.2	Very low	36.6	Very low	127 Å²	127	146.5 Å²	146.5	56%	0.557	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	14.1	-162.7	-75.6	-76.8	0	0	0	119.3
6	R	38.8	Very low	36.5	Very low	248 Å²	248	148.3 Å²	148.3	94%	0.936	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-1.2	-167.7	-142.7	176.1	-178.2	166.3	-2	117.3	F4	F4-R6 PolarHBondContact O-N 3.15Å
7	A	38	Very low	36.4	Very low	91 Å²	91	146.4 Å²	146.4	75%	0.752	77%	0.774	S	S	*	*			trans	-110.6	-4.2	-163.7	0	0	0	0	0	118	S9	A7-S9 PolarHBondContact O-N 3.08Å
8	L	39	Very low	36.3	Very low	181 Å²	181	143.4 Å²	143.4	95%	0.948	77%	0.767	S	S	*	*			trans	-93.8	42.4	-168.6	-80.2	156.5	0	0	0	115.3
9	S	31.3	Very low	36.3	Very low	114 Å²	114	143 Å²	143	80%	0.797	77%	0.765	S	S	*	*			trans	-141.3	25.6	-176.9	-175.3	0	0	0	0	115.5	A7	A7-S9 PolarHBondContact O-N 3.08Å
10	E	34.1	Very low	36.1	Very low	184 Å²	184	144 Å²	144	86%	0.86	77%	0.765	S	S	*	*	S	Bend	trans	-134.2	114.6	173	-72.1	-176.9	171	0	0	111
11	S	30.9	Very low	36	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	77%	0.773	S	S	*	*			trans	59.2	107.9	140.1	-177.8	0	0	0	0	118.5
12	E	34.6	Very low	35.4	Very low	203 Å²	203	148 Å²	148	95%	0.949	78%	0.778	S	S	*	*				-157.3	112.2	126.6	-69.8	-154.7	157.7	0	0	109.6
13	S	28.6	Very low	35.5	Very low	108 Å²	108	151.3 Å²	151.3	76%	0.755	79%	0.786	S	S	*	*			trans	-140.8	86.8	174.4	60.3	0	0	0	0	109.1
14	E	34.7	Very low	35.1	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.822	79%	0.785	S	S	*	*			trans	-151.2	112.7	162.2	-70	-157.8	166.3	0	0	108.2
15	T	34	Very low	34.5	Very low	119 Å²	119	151.5 Å²	151.5	73%	0.73	80%	0.804	S	S	*	*				83.3	136	110.5	63	0	0	0	0	113.1
16	E	34.9	Very low	34	Very low	175 Å²	175	150.5 Å²	150.5	82%	0.818	82%	0.819	S	S	*	*			cis	-169.1	159.4	46.5	-72.7	-172.7	150.8	0	0	112.3
17	S	33.9	Very low	33.4	Very low	116 Å²	116	150.1 Å²	150.1	81%	0.811	82%	0.817	S	S	*	*			trans	76.1	135.1	132.5	-173.8	0	0	0	0	120
18	S	34.1	Very low	33.2	Very low	93 Å²	93	152.7 Å²	152.7	65%	0.65	82%	0.824	S	S	*	*			cis	-168.5	168.8	-1.9	-162	0	0	0	0	110.8
19	D	36.5	Very low	33	Very low	136 Å²	136	148.4 Å²	148.4	73%	0.727	81%	0.814	S	S	*	*			trans	87.1	92.6	156.3	-54.4	-18.2	0	0	0	118
20	E	32.5	Very low	33.3	Very low	162 Å²	162	154.4 Å²	154.4	76%	0.757	82%	0.821	S	S	*	*				57.4	114.7	83.3	-68.3	-159.8	147.8	0	0	113.6
21	E	35.3	Very low	33.4	Very low	200 Å²	200	154.7 Å²	154.7	94%	0.935	82%	0.823	S	S	*	*				-144.8	144.1	85.8	-81.8	-179.3	158.4	0	0	114.6
22	Q	29.5	Very low	33.6	Very low	160 Å²	160	160.6 Å²	160.6	75%	0.748	83%	0.828	S	S	*	*			trans	-90.7	141.1	-172.9	-61.4	168.3	-2.1	0	0	113.5
23	I	34.9	Very low	33.7	Very low	165 Å²	165	157.2 Å²	157.2	85%	0.846	82%	0.824	S	S	*	*			trans	-142.3	99.9	140.6	-54.4	-178.7	0	0	0	111
24	Q	31.8	Very low	34.1	Very low	180 Å²	180	160.4 Å²	160.4	84%	0.841	83%	0.829	S	S	*	*			trans	40.6	122	143.9	-63.1	-179.9	7.7	0	0	122.3
25	P	30.5	Very low	34.2	Very low	135 Å²	135	157.2 Å²	157.2	88%	0.877	82%	0.823	S	S	*	*			trans	-101.9	144.9	172.1	36.9	-28.2	0	0	0	113.6
26	A	35.5	Very low	34.2	Very low	105 Å²	105	156.4 Å²	156.4	87%	0.868	83%	0.829	S	S	*	*			trans	-128.1	125.2	166.8	0	0	0	0	0	111.1
27	R	27.3	Very low	34.2	Very low	240 Å²	240	156.7 Å²	156.7	91%	0.906	83%	0.828	S	S	*	*			trans	-61.9	148	-176.8	-66.6	167.1	161.5	172.3	-6.1	113.4
28	T	33.9	Very low	34.4	Very low	145 Å²	145	157.2 Å²	157.2	89%	0.89	83%	0.826	S	S	*	*				-176.5	132.7	124.7	28.4	0	0	0	0	114.9
29	A	34.9	Very low	34.4	Very low	91 Å²	91	160.1 Å²	160.1	75%	0.752	83%	0.833	S	S	*	*			trans	67.7	110.2	145.5	0	0	0	0	0	121.6	Q31	A29-Q31 PolarHBondContact O-N 3.46Å
30	Y	37.1	Very low	34.1	Very low	240 Å²	240	159 Å²	159	94%	0.941	84%	0.836	S	S	*	*			trans	-49.3	125.7	159.3	-68.3	-96.1	0	0	0	112.8
31	Q	36.8	Very low	34.2	Very low	191 Å²	191	158 Å²	158	89%	0.893	84%	0.836	S	S	*	*			trans	-126.8	136.9	157.3	-75.9	-169.2	-14.2	0	0	109.8	A29	A29-Q31 PolarHBondContact O-N 3.46Å
32	R	34.9	Very low	34.1	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	83%	0.828	S	S	*	*			trans	-55.5	150.5	-174.9	-71.2	172.5	171.1	176	-4.1	112.8	M34	R32-M34 PolarHBondContact O-N 2.69Å
33	P	37.1	Very low	34.8	Very low	132 Å²	132	154.2 Å²	154.2	86%	0.857	83%	0.83	S	S	*	*			trans	-72.1	115.3	174.8	29.8	-30.2	0	0	0	109.8
34	M	35.9	Very low	34.9	Very low	175 Å²	175	152.9 Å²	152.9	86%	0.862	83%	0.825	S	S	*	*			trans	-74.7	146.6	163	-84.7	-72.4	-144.1	0	0	109.5	R32	R32-M34 PolarHBondContact O-N 2.69Å
35	P	37.4	Very low	35.3	Very low	108 Å²	108	152.5 Å²	152.5	70%	0.701	83%	0.829	S	S	*	*			trans	-69.9	140.3	-173.5	30.2	-32.7	0	0	0	110.8	F37	P35-F37 PolarHBondContact O-N 3.12Å
36	A	33.9	Very low	35.9	Very low	103 Å²	103	154.3 Å²	154.3	85%	0.851	83%	0.825	S	S	*	*			trans	-61.3	104.1	173.8	0	0	0	0	0	109.8	V38	A36-V38 PolarHBondContact O-N 2.72Å
37	F	34.4	Very low	36.5	Very low	181 Å²	181	158.8 Å²	158.8	79%	0.794	83%	0.825	S	S	*	*			trans	-73.5	121	169.7	-149.6	-95.4	0	0	0	108.1	P35 L39	P35-F37 PolarHBondContact O-N 3.12Å; F37-L39 PolarHBondContact O-N 3.46Å
38	V	37.6	Very low	37.4	Very low	127 Å²	127	159.2 Å²	159.2	77%	0.77	83%	0.827	S	S	*	*			trans	-69.3	107.1	171.6	174.6	0	0	0	0	107.3	A36 S40	A36-V38 PolarHBondContact O-N 2.72Å; V38-S40 PolarHBondContact O-N 3.04Å
39	L	34.7	Very low	38.7	Very low	153 Å²	153	157.8 Å²	157.8	80%	0.801	82%	0.818	S	S	*	*			trans	-83.1	93.7	170.4	-75.9	166.3	0	0	0	108.8	F37	F37-L39 PolarHBondContact O-N 3.46Å
40	S	31	Very low	40.3	Very low	113 Å²	113	160.4 Å²	160.4	79%	0.79	82%	0.824	S	S	*	*			trans	-99.9	97	149.8	170.5	0	0	0	0	105.5	V38	V38-S40 PolarHBondContact O-N 3.04Å
41	D	33.7	Very low	42.1	Very low	141 Å²	141	155.3 Å²	155.3	75%	0.754	80%	0.803	S	S	*	*			trans	-145.3	108.9	163.6	-150.7	4.5	0	0	0	109
42	S	34	Very low	44.2	Very low	109 Å²	109	150 Å²	150	76%	0.762	79%	0.785	S	S	*	*			trans	-110.8	99.6	170.7	69.1	0	0	0	0	106.3
43	E	42.7	Very low	46.3	Very low	171 Å²	171	143.8 Å²	143.8	80%	0.799	77%	0.766	S	S	*	*			trans	-175.9	96.9	162.1	-107.5	172.4	-157.9	0	0	106.8
44	D	38.1	Very low	48.5	Very low	137 Å²	137	140.9 Å²	140.9	73%	0.733	74%	0.74	S	S	*	*			trans	173.2	80.5	145.2	-91.4	-24	0	0	0	111.7
45	D	40.9	Very low	50.8	Low	173 Å²	173	135.9 Å²	135.9	93%	0.925	72%	0.717	S	S	*	*			trans	-106.2	69.7	156.2	-89.9	-33.6	0	0	0	108.9	K47	D45-K47 PolarHBondContact O-N 3.43Å
46	Q	42	Very low	53.1	Low	172 Å²	172	138 Å²	138	80%	0.804	71%	0.711	S	S	*	*			trans	-78.5	107.1	167	-69.9	-172.9	5.9	0	0	109.5	R48	Q46-R48 PolarHBondContact O-N 2.94Å
47	K	48.5	Very low	55.5	Low	200 Å²	200	135.8 Å²	135.8	87%	0.87	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-49.6	120.6	175.5	-74.5	177	177.2	175.5	0	111.3	D45 V49	D45-K47 PolarHBondContact O-N 3.43Å; K47-V49 PolarHBondContact O-N 2.9Å
48	R	46.5	Very low	58	Low	249 Å²	249	128.5 Å²	128.5	94%	0.94	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-57.2	118	172.2	-86.4	-179.4	171.1	-171.4	-1.4	111.1	Q46	Q46-R48 PolarHBondContact O-N 2.94Å
49	V	60.2	Low	60.4	Low	115 Å²	115	125.6 Å²	125.6	70%	0.697	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-89.5	121.2	170.4	-179.9	0	0	0	0	109.3	K47 R51	K47-V49 PolarHBondContact O-N 2.9Å; V49-R51 HydrophobicContact CG1-CG 4.31Å; V49-R51 PolarHBondContact O-N 3.01Å
50	V	69.4	Low	63	Low	145 Å²	145	121.3 Å²	121.3	88%	0.879	60%	0.602	S	S	*	*			trans	-77.7	107.9	172	-179.2	0	0	0	0	108.2
51	R	73.5	Confident	65.8	Low	134 Å²	134	115.9 Å²	115.9	51%	0.506	57%	0.565	S	S	.	*			trans	-89.8	145.7	176.9	-60.6	-175.1	-173.6	-159.2	4.3	110.9	V49 E59	V49-R51 HydrophobicContact CG1-CG 4.31Å; V49-R51 PolarHBondContact O-N 3.01Å; R51-E59 IonicContact CZ-OE1 2.7Å; R51-E59 IonicContact CZ-OE2 3.97Å; R51-E59 IonicContact NE-OE2 3.2Å; R51-E59 IonicContact NH1-OE1 3.59Å; R51-E59 PolarHBondContact NH1-OE1 2.85Å; R51-E59 IonicContact NH1-OE2 3.57Å; R51-E59 PolarHBondContact NH1-OE2 3.46Å; R51-E59 IonicContact NH2-OE1 2.79Å
52	P	81.9	Confident	68.5	Low	80 Å²	80	113.4 Å²	113.4	52%	0.519	55%	0.545	S	S	.	.			trans	-53.4	148.3	173.2	-22.4	31.6	0	0	0	111.6	K54 D55 R56	P52-K54 PolarHBondContact O-N 3.42Å; P52-D55 HydrophobicContact CB-CB 4.47Å; P52-D55 WeakPolarHBondContact CD-OD2 3.33Å; P52-D55 WeakPolarHBondContact CG-OD2 3.49Å; P52-D55 PolarHBondContact O-N 3.13Å; P52-D55 VanDerWaalsContact O-N 3.12Å; P52-R56 PolarHBondContact O-N 2.7Å
53	E	80	Confident	71.2	Confident	101 Å²	101	111.2 Å²	111.2	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-57.7	-39.3	-177.9	-173.1	171.7	-163.7	0	0	111.6	R56 R57 V97	E53-R56 PolarHBondContact O-N 3.21Å; E53-R57 HydrophobicContact CG-CG 4.42Å; E53-R57 VanDerWaalsContact O-CG 3.28Å; E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 2.68Å; E53-R57 IonicContact OE1-NE 2.78Å; E53-R57 IonicContact OE1-NH2 3.93Å; E53-R57 PolarHBondContact OE1-NH2 3.1Å; E53-V97 HydrophobicContact CG-CG2 4.3Å
54	K	82.5	Confident	73.5	Confident	71 Å²	71	104.1 Å²	104.1	31%	0.309	49%	0.492	S	S	.	.	H	α-helix	trans	-56.2	-52.8	174.2	-178.9	-170.9	-177.9	171.3	0	112.5	P52 R56 R57 F58 V97 E101	P52-K54 PolarHBondContact O-N 3.42Å; K54-R56 VanDerWaalsContact C-N 3.34Å; K54-R56 PolarHBondContact O-N 3.25Å; K54-R57 PolarHBondContact O-N 3.05Å; K54-F58 HydrophobicContact CD-CD2 4.45Å; K54-F58 HydrophobicContact CD-CE2 4.07Å; K54-F58 HydrophobicContact CG-CD2 3.74Å; K54-F58 HydrophobicContact CG-CE2 3.59Å; K54-F58 HydrophobicContact CG-CG 4.48Å; K54-F58 HydrophobicContact CG-CZ 4.18Å; K54-F58 WeakPolarHBondContact O-CB 3.42Å; K54-F58 WeakPolarHBondContact O-CG 3.37Å; K54-F58 PolarHBondContact O-N 3.31Å; K54-V97 HydrophobicContact CB-CG1 4.03Å; K54-V97 HydrophobicContact CG-CG1 4.41Å; K54-E101 VanDerWaalsContact CD-OE2 3.23Å; K54-E101 WeakPolarHBondContact CD-OE2 3.43Å; K54-E101 WeakPolarHBondContact CE-OE2 3.32Å; K54-E101 IonicContact NZ-OE1 3.48Å; K54-E101 IonicContact NZ-OE2 3.53Å; K54-E101 PolarHBondContact NZ-OE2 3.47Å
55	D	84.3	Confident	76.1	Confident	71 Å²	71	98.2 Å²	98.2	38%	0.38	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-41	-176.2	-67	-17.4	0	0	0	111	P52 R57 F58 E59	P52-D55 HydrophobicContact CB-CB 4.47Å; P52-D55 WeakPolarHBondContact CD-OD2 3.33Å; P52-D55 WeakPolarHBondContact CG-OD2 3.49Å; P52-D55 PolarHBondContact O-N 3.13Å; P52-D55 VanDerWaalsContact O-N 3.12Å; D55-R57 PolarHBondContact O-N 2.89Å; D55-F58 PolarHBondContact O-N 2.93Å; D55-E59 WeakPolarHBondContact O-CB 3.43Å; D55-E59 PolarHBondContact O-N 3.31Å
56	R	84.8	Confident	78.4	Confident	153 Å²	153	93.8 Å²	93.8	58%	0.577	43%	0.432	S	S	*	.	H	α-helix	trans	-60.5	-44.3	175.1	-176.2	-179	167.1	171.3	3.1	112	P52 E53 K54 E60	P52-R56 PolarHBondContact O-N 2.7Å; E53-R56 PolarHBondContact O-N 3.21Å; K54-R56 VanDerWaalsContact C-N 3.34Å; K54-R56 PolarHBondContact O-N 3.25Å; R56-E60 IonicContact NE-OE1 3.27Å; R56-E60 PolarHBondContact NE-OE1 3.27Å; R56-E60 IonicContact NH2-OE1 2.89Å; R56-E60 WeakPolarHBondContact O-CB 3.45Å; R56-E60 WeakPolarHBondContact O-CG 3.32Å; R56-E60 PolarHBondContact O-N 3.47Å
57	R	84.3	Confident	80.7	Confident	55 Å²	55	90.3 Å²	90.3	21%	0.208	42%	0.416	C	S	.	.	H	α-helix	trans	-69	-40.1	177.8	-62.5	-57.1	179.1	162.8	4.7	112.3	E53 K54 D55 E59 E60 L61 A94 V97	E53-R57 HydrophobicContact CG-CG 4.42Å; E53-R57 VanDerWaalsContact O-CG 3.28Å; E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 2.68Å; E53-R57 IonicContact OE1-NE 2.78Å; E53-R57 IonicContact OE1-NH2 3.93Å; E53-R57 PolarHBondContact OE1-NH2 3.1Å; K54-R57 PolarHBondContact O-N 3.05Å; D55-R57 PolarHBondContact O-N 2.89Å; R57-E59 VanDerWaalsContact C-N 3.33Å; R57-E60 PolarHBondContact O-N 2.88Å; R57-L61 WeakPolarHBondContact O-CG 3.05Å; R57-L61 PolarHBondContact O-N 3.22Å; R57-A94 HydrophobicContact CB-CB 4.16Å; R57-V97 HydrophobicContact CG-CG2 4.41Å
58	F	88	Confident	82.7	Confident	29 Å²	29	81.5 Å²	81.5	13%	0.127	38%	0.379	C	S	.	.	H	α-helix	trans	-71.2	-28.6	178.1	-72.6	-11.7	0	0	0	112.7	K54 D55 L61 R62 I98 P106 F108	K54-F58 HydrophobicContact CD-CD2 4.45Å; K54-F58 HydrophobicContact CD-CE2 4.07Å; K54-F58 HydrophobicContact CG-CD2 3.74Å; K54-F58 HydrophobicContact CG-CE2 3.59Å; K54-F58 HydrophobicContact CG-CG 4.48Å; K54-F58 HydrophobicContact CG-CZ 4.18Å; K54-F58 WeakPolarHBondContact O-CB 3.42Å; K54-F58 WeakPolarHBondContact O-CG 3.37Å; K54-F58 PolarHBondContact O-N 3.31Å; D55-F58 PolarHBondContact O-N 2.93Å; F58-L61 HydrophobicContact CD1-CD1 4.21Å; F58-R62 WeakPolarHBondContact O-CB 3.48Å; F58-R62 VanDerWaalsContact O-CG 3.3Å; F58-R62 WeakPolarHBondContact O-CG 3.39Å; F58-R62 PolarHBondContact O-N 3.38Å; F58-R62 PolarHBondContact O-NE 3.21Å; F58-I98 HydrophobicContact CE1-CD1 4.22Å; F58-I98 HydrophobicContact CE1-CG1 3.92Å; F58-I98 HydrophobicContact CZ-CG1 4.15Å; F58-P106 HydrophobicContact CE1-CG 3.91Å; F58-P106 HydrophobicContact CZ-CG 3.97Å; F58-F108 HydrophobicContact CD1-CZ 4.4Å; F58-F108 HydrophobicContact CG-CZ 4.48Å
59	E	87.9	Confident	84.8	Confident	65 Å²	65	74.1 Å²	74.1	30%	0.304	35%	0.351	S	S	.	.	H	α-helix	trans	-71.6	-46.7	170.4	-170.4	169.8	-151.1	0	0	111.5	R51 D55 R57 L61 R62 D63	R51-E59 IonicContact CZ-OE1 2.7Å; R51-E59 IonicContact CZ-OE2 3.97Å; R51-E59 IonicContact NE-OE2 3.2Å; R51-E59 IonicContact NH1-OE1 3.59Å; R51-E59 PolarHBondContact NH1-OE1 2.85Å; R51-E59 IonicContact NH1-OE2 3.57Å; R51-E59 PolarHBondContact NH1-OE2 3.46Å; R51-E59 IonicContact NH2-OE1 2.79Å; D55-E59 WeakPolarHBondContact O-CB 3.43Å; D55-E59 PolarHBondContact O-N 3.31Å; R57-E59 VanDerWaalsContact C-N 3.33Å; E59-L61 VanDerWaalsContact C-N 3.26Å; E59-L61 PolarHBondContact O-N 3.46Å; E59-R62 PolarHBondContact O-N 3.42Å; E59-D63 PolarHBondContact O-N 2.94Å
60	E	89.1	Confident	86.1	Confident	63 Å²	63	72.9 Å²	72.9	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-54.9	-41.3	172	-75.6	173.6	-165.7	0	0	111.4	R56 R57 L64 V90	R56-E60 IonicContact NE-OE1 3.27Å; R56-E60 PolarHBondContact NE-OE1 3.27Å; R56-E60 IonicContact NH2-OE1 2.89Å; R56-E60 WeakPolarHBondContact O-CB 3.45Å; R56-E60 WeakPolarHBondContact O-CG 3.32Å; R56-E60 PolarHBondContact O-N 3.47Å; R57-E60 PolarHBondContact O-N 2.88Å; E60-L64 WeakPolarHBondContact O-CG 3.32Å; E60-L64 PolarHBondContact O-N 3.21Å; E60-L64 VanDerWaalsContact O-N 3.17Å; E60-V90 HydrophobicContact CB-CG1 4.1Å
61	L	89.6	Confident	87	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.3	-44.5	173.6	-76.1	173.2	0	0	0	112.6	R57 F58 E59 D63 L64 I65 V90 F91 A94 F108 F109	R57-L61 WeakPolarHBondContact O-CG 3.05Å; R57-L61 PolarHBondContact O-N 3.22Å; F58-L61 HydrophobicContact CD1-CD1 4.21Å; E59-L61 VanDerWaalsContact C-N 3.26Å; E59-L61 PolarHBondContact O-N 3.46Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 3.11Å; L61-L64 PolarHBondContact O-N 3.17Å; L61-I65 VanDerWaalsContact O-CG1 3.24Å; L61-I65 WeakPolarHBondContact O-CG1 3.32Å; L61-I65 PolarHBondContact O-N 3.13Å; L61-V90 HydrophobicContact CD2-CB 4.17Å; L61-V90 HydrophobicContact CD2-CG1 3.78Å; L61-V90 HydrophobicContact CG-CG1 3.91Å; L61-F91 HydrophobicContact CD1-CD2 4.21Å; L61-F91 HydrophobicContact CD2-CB 4.15Å; L61-F91 HydrophobicContact CD2-CD2 4.46Å; L61-A94 HydrophobicContact CD1-CB 3.93Å; L61-F108 HydrophobicContact CB-CE2 4.18Å; L61-F109 HydrophobicContact CD2-CE2 4.5Å
62	R	90.9	Very high	87.6	Confident	89 Å²	89	64.4 Å²	64.4	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-37.6	178.9	-82.6	-173.5	-89.2	-154.8	-1.6	111.9	F58 E59 I65 K66 F108 E176	F58-R62 WeakPolarHBondContact O-CB 3.48Å; F58-R62 VanDerWaalsContact O-CG 3.3Å; F58-R62 WeakPolarHBondContact O-CG 3.39Å; F58-R62 PolarHBondContact O-N 3.38Å; F58-R62 PolarHBondContact O-NE 3.21Å; E59-R62 PolarHBondContact O-N 3.42Å; R62-I65 PolarHBondContact O-N 3.11Å; R62-K66 WeakPolarHBondContact O-CG 3.48Å; R62-K66 PolarHBondContact O-N 2.93Å; R62-F108 HydrophobicContact CG-CD2 4.3Å; R62-F108 HydrophobicContact CG-CE2 4.11Å; R62-F108 HydrophobicContact CG-CZ 4.46Å; R62-E176 IonicContact NH1-OE1 3.94Å; R62-E176 IonicContact NH1-OE2 2.73Å
63	D	91	Very high	87.8	Confident	63 Å²	63	68.7 Å²	68.7	34%	0.337	31%	0.305	S	S	.	.	H	α-helix	trans	-70.6	-39.4	178.4	-70.9	-20.9	0	0	0	112.1	E59 L61 I65 K66 Q67	E59-D63 PolarHBondContact O-N 2.94Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 3.11Å; D63-I65 VanDerWaalsContact C-N 3.32Å; D63-I65 PolarHBondContact O-N 3.28Å; D63-K66 PolarHBondContact O-N 2.93Å; D63-K66 IonicContact OD1-NZ 2.7Å; D63-K66 PolarHBondContact OD1-NZ 3.32Å; D63-Q67 WeakPolarHBondContact O-CG 3.02Å; D63-Q67 PolarHBondContact O-N 3.45Å
64	L	90.8	Very high	88	Confident	22 Å²	22	70 Å²	70	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-37.7	170.6	-72	174.8	0	0	0	112	E60 L61 Q67 I68 D86 L87 V90	E60-L64 WeakPolarHBondContact O-CG 3.32Å; E60-L64 PolarHBondContact O-N 3.21Å; E60-L64 VanDerWaalsContact O-N 3.17Å; L61-L64 PolarHBondContact O-N 3.17Å; L64-Q67 PolarHBondContact O-N 2.83Å; L64-I68 WeakPolarHBondContact O-CG1 3.49Å; L64-I68 PolarHBondContact O-N 3.01Å; L64-D86 HydrophobicContact CD1-CB 4.5Å; L64-D86 HydrophobicContact CD2-CB 4.47Å; L64-L87 HydrophobicContact CB-CB 4.47Å; L64-L87 HydrophobicContact CB-CD1 4.31Å; L64-L87 HydrophobicContact CD1-CB 4.3Å; L64-V90 HydrophobicContact CD1-CB 4.06Å; L64-V90 HydrophobicContact CD1-CG2 3.71Å
65	I	91.2	Very high	88	Confident	12 Å²	12	71 Å²	71	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-65.9	-40.8	174.6	-68.4	166.4	0	0	0	111.1	L61 R62 D63 I68 R69 L87 F108	L61-I65 VanDerWaalsContact O-CG1 3.24Å; L61-I65 WeakPolarHBondContact O-CG1 3.32Å; L61-I65 PolarHBondContact O-N 3.13Å; R62-I65 PolarHBondContact O-N 3.11Å; D63-I65 VanDerWaalsContact C-N 3.32Å; D63-I65 PolarHBondContact O-N 3.28Å; I65-I68 PolarHBondContact O-N 3.15Å; I65-R69 PolarHBondContact O-N 3.19Å; I65-L87 HydrophobicContact CG1-CD1 3.67Å; I65-F108 HydrophobicContact CD1-CD2 3.56Å; I65-F108 HydrophobicContact CD1-CE2 3.85Å
66	K	89.8	Confident	88.1	Confident	80 Å²	80	68.9 Å²	68.9	35%	0.348	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-43.2	172.7	-72.8	175.8	-166.3	162.2	0	111.4	R62 D63 I68 R69 N70 L180	R62-K66 WeakPolarHBondContact O-CG 3.48Å; R62-K66 PolarHBondContact O-N 2.93Å; D63-K66 PolarHBondContact O-N 2.93Å; D63-K66 IonicContact OD1-NZ 2.7Å; D63-K66 PolarHBondContact OD1-NZ 3.32Å; K66-I68 PolarHBondContact O-N 3.39Å; K66-R69 PolarHBondContact O-N 2.94Å; K66-N70 PolarHBondContact O-N 2.97Å; K66-L180 HydrophobicContact CD-CD2 4.44Å; K66-L180 VanDerWaalsContact CE-CD2 3.46Å; K66-L180 VanDerWaalsContact NZ-CD2 3.34Å
67	Q	89.7	Confident	88.2	Confident	99 Å²	99	61.7 Å²	61.7	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-44.6	175.1	-72.2	176.6	18.3	0	0	111.2	D63 L64 R69 N70 L71	D63-Q67 WeakPolarHBondContact O-CG 3.02Å; D63-Q67 PolarHBondContact O-N 3.45Å; L64-Q67 PolarHBondContact O-N 2.83Å; Q67-R69 PolarHBondContact O-N 3.32Å; Q67-N70 PolarHBondContact O-N 3.31Å; Q67-L71 WeakPolarHBondContact O-CB 3.48Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.95Å
68	I	90.8	Very high	88.4	Confident	16 Å²	16	61 Å²	61	8%	0.082	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175.4	-70.9	167.2	0	0	0	111.1	L64 I65 K66 N70 L71 R72 T83 L87 L116	L64-I68 WeakPolarHBondContact O-CG1 3.49Å; L64-I68 PolarHBondContact O-N 3.01Å; I65-I68 PolarHBondContact O-N 3.15Å; K66-I68 PolarHBondContact O-N 3.39Å; I68-N70 PolarHBondContact O-N 3.35Å; I68-L71 PolarHBondContact O-N 2.64Å; I68-R72 WeakPolarHBondContact O-CB 3.47Å; I68-R72 PolarHBondContact O-N 3.09Å; I68-T83 WeakPolarHBondContact CG1-OG1 3.36Å; I68-L87 HydrophobicContact CD1-CB 4.4Å; I68-L87 HydrophobicContact CD1-CD1 3.77Å; I68-L116 HydrophobicContact CG2-CD1 4.16Å
69	R	90.2	Very high	88.4	Confident	94 Å²	94	64.9 Å²	64.9	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-40.1	176.1	-76.9	-179.2	174.5	164.4	-1.6	112.4	I65 K66 Q67 R72 K73 E115	I65-R69 PolarHBondContact O-N 3.19Å; K66-R69 PolarHBondContact O-N 2.94Å; Q67-R69 PolarHBondContact O-N 3.32Å; R69-R72 WeakPolarHBondContact O-CB 3.29Å; R69-R72 PolarHBondContact O-N 3.37Å; R69-K73 PolarHBondContact O-N 3.12Å; R69-E115 IonicContact CZ-OE1 2.75Å; R69-E115 IonicContact NE-OE1 2.87Å; R69-E115 IonicContact NE-OE2 3.22Å; R69-E115 IonicContact NH2-OE1 3.2Å; R69-E115 PolarHBondContact NH2-OE1 3.27Å; R69-E115 IonicContact NH2-OE2 2.78Å
70	N	88.3	Confident	88.6	Confident	89 Å²	89	61.8 Å²	61.8	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-68.4	-43	175.9	-74.8	-11.9	0	0	0	111.8	K66 Q67 I68 R72 K73 I74	K66-N70 PolarHBondContact O-N 2.97Å; Q67-N70 PolarHBondContact O-N 3.31Å; I68-N70 PolarHBondContact O-N 3.35Å; N70-R72 VanDerWaalsContact C-N 3.28Å; N70-R72 PolarHBondContact O-N 3.12Å; N70-K73 WeakPolarHBondContact O-CB 3.44Å; N70-K73 PolarHBondContact O-N 3.04Å; N70-K73 VanDerWaalsContact O-N 3.16Å; N70-I74 PolarHBondContact O-N 3.17Å
71	L	87.6	Confident	88.6	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-31.4	175.7	-68	171.4	0	0	0	112.1	Q67 I68 K73 I74 K75 D76 K79 I80 T83	Q67-L71 WeakPolarHBondContact O-CB 3.48Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.95Å; I68-L71 PolarHBondContact O-N 2.64Å; L71-K73 VanDerWaalsContact C-N 3.35Å; L71-I74 PolarHBondContact O-N 3.41Å; L71-K75 PolarHBondContact O-N 2.75Å; L71-D76 HydrophobicContact CD2-CB 4.49Å; L71-D76 PolarHBondContact O-N 3.13Å; L71-K79 HydrophobicContact CD1-CB 3.79Å; L71-K79 HydrophobicContact CD2-CB 3.79Å; L71-K79 HydrophobicContact CD2-CD 3.86Å; L71-K79 HydrophobicContact CD2-CG 4.5Å; L71-K79 HydrophobicContact CG-CB 4.4Å; L71-I80 HydrophobicContact CB-CD1 4.34Å; L71-I80 HydrophobicContact CB-CG1 3.6Å; L71-T83 HydrophobicContact CD1-CG2 3.63Å
72	R	86.5	Confident	88.7	Confident	76 Å²	76	63.2 Å²	63.2	29%	0.287	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-43	171.6	-165.3	175.8	77.4	-161.5	-0.6	111.4	I68 R69 N70 I74 K75 E115 F119	I68-R72 WeakPolarHBondContact O-CB 3.47Å; I68-R72 PolarHBondContact O-N 3.09Å; R69-R72 WeakPolarHBondContact O-CB 3.29Å; R69-R72 PolarHBondContact O-N 3.37Å; N70-R72 VanDerWaalsContact C-N 3.28Å; N70-R72 PolarHBondContact O-N 3.12Å; R72-I74 VanDerWaalsContact C-N 3.34Å; R72-I74 PolarHBondContact O-N 3.19Å; R72-K75 PolarHBondContact O-N 2.77Å; R72-E115 IonicContact CZ-OE2 3.64Å; R72-E115 IonicContact NH1-OE2 3.54Å; R72-E115 PolarHBondContact NH1-OE2 3.43Å; R72-E115 IonicContact NH2-OE2 3.68Å; R72-E115 PolarHBondContact NH2-OE2 3.23Å; R72-F119 HydrophobicContact CB-CZ 4.45Å; R72-F119 HydrophobicContact CG-CD1 3.78Å; R72-F119 HydrophobicContact CG-CD2 3.49Å; R72-F119 VanDerWaalsContact CG-CD2 3.49Å; R72-F119 HydrophobicContact CG-CE1 3.7Å; R72-F119 HydrophobicContact CG-CE2 3.39Å; R72-F119 HydrophobicContact CG-CG 3.67Å; R72-F119 HydrophobicContact CG-CZ 3.48Å; R72-F119 VanDerWaalsContact CG-CZ 3.48Å
73	K	86.4	Confident	88.7	Confident	170 Å²	170	59.5 Å²	59.5	74%	0.739	29%	0.285	S	S	*	.	H	α-helix	trans	-63.1	-37.6	176.2	-66.9	175	-178.1	176.6	0	112.3	R69 N70 L71 K75	R69-K73 PolarHBondContact O-N 3.12Å; N70-K73 WeakPolarHBondContact O-CB 3.44Å; N70-K73 PolarHBondContact O-N 3.04Å; N70-K73 VanDerWaalsContact O-N 3.16Å; L71-K73 VanDerWaalsContact C-N 3.35Å; K73-K75 VanDerWaalsContact C-N 3.34Å
74	I	84.2	Confident	88.8	Confident	130 Å²	130	56.7 Å²	56.7	67%	0.667	27%	0.27	S	S	*	.	H	α-helix	trans	-83.7	-8.7	-179.3	-57.8	169.8	0	0	0	112.2	N70 L71 R72 D76	N70-I74 PolarHBondContact O-N 3.17Å; L71-I74 PolarHBondContact O-N 3.41Å; R72-I74 VanDerWaalsContact C-N 3.34Å; R72-I74 PolarHBondContact O-N 3.19Å; I74-D76 VanDerWaalsContact C-N 3.26Å; I74-D76 PolarHBondContact O-N 3.2Å
75	K	82.8	Confident	88.8	Confident	91 Å²	91	58.2 Å²	58.2	40%	0.396	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	32.6	-174.7	-66.1	-170.9	171.3	-173.1	0	114.1	L71 R72 K73 M77 F119 D129	L71-K75 PolarHBondContact O-N 2.75Å; R72-K75 PolarHBondContact O-N 2.77Å; K73-K75 VanDerWaalsContact C-N 3.34Å; K75-M77 HydrophobicContact CB-CE 4.15Å; K75-M77 HydrophobicContact CG-CE 4.46Å; K75-M77 PolarHBondContact O-N 3.08Å; K75-F119 HydrophobicContact CG-CZ 4.43Å; K75-D129 IonicContact NZ-OD2 2.91Å; K75-D129 PolarHBondContact NZ-OD2 3.19Å
76	D	86.9	Confident	88.8	Confident	27 Å²	27	60.3 Å²	60.3	14%	0.144	29%	0.287	C	S	.	.			trans	-87.1	82.2	176.2	-167.2	-13.1	0	0	0	111.9	L71 I74 S78 K79 I80 N137	L71-D76 HydrophobicContact CD2-CB 4.49Å; L71-D76 PolarHBondContact O-N 3.13Å; I74-D76 VanDerWaalsContact C-N 3.26Å; I74-D76 PolarHBondContact O-N 3.2Å; D76-S78 PolarHBondContact O-N 3.26Å; D76-S78 PolarHBondContact OD1-N 3.13Å; D76-S78 PolarHBondContact OD1-OG 3.39Å; D76-K79 HydrophobicContact CB-CB 4.49Å; D76-K79 PolarHBondContact O-N 3.13Å; D76-K79 PolarHBondContact OD1-N 2.86Å; D76-K79 WeakPolarHBondContact OD2-CD 3.13Å; D76-K79 WeakPolarHBondContact OD2-CE 3.17Å; D76-K79 WeakPolarHBondContact OD2-CG 3.05Å; D76-K79 IonicContact OD2-NZ 2.95Å; D76-I80 WeakPolarHBondContact O-CG1 3.35Å; D76-I80 PolarHBondContact O-N 2.98Å; D76-N137 PolarHBondContact OD1-OD1 2.85Å
77	M	87.4	Confident	88.9	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-26.7	-175	-54	-63	165.9	0	0	113.7	K75 I80 L81 F119 N123 L133 N137 L141	K75-M77 HydrophobicContact CB-CE 4.15Å; K75-M77 HydrophobicContact CG-CE 4.46Å; K75-M77 PolarHBondContact O-N 3.08Å; M77-I80 HydrophobicContact SD-CD1 4.21Å; M77-L81 PolarHBondContact O-N 2.94Å; M77-F119 HydrophobicContact CE-CE1 3.66Å; M77-F119 HydrophobicContact CE-CZ 3.75Å; M77-F119 HydrophobicContact SD-CE1 3.95Å; M77-N123 HydrophobicContact CE-CB 4.44Å; M77-L133 HydrophobicContact CE-CD2 4.43Å; M77-L133 HydrophobicContact CG-CD2 3.9Å; M77-N137 HydrophobicContact CB-CB 4.04Å; M77-N137 WeakPolarHBondContact CB-O 3.31Å; M77-N137 HydrophobicContact CG-CB 4.27Å; M77-L141 HydrophobicContact CB-CB 4.07Å; M77-L141 HydrophobicContact CE-CD1 4.18Å; M77-L141 HydrophobicContact CG-CB 4.04Å; M77-L141 HydrophobicContact CG-CD1 4.01Å; M77-L141 HydrophobicContact CG-CG 4.34Å; M77-L141 HydrophobicContact SD-CD1 3.98Å; M77-L141 HydrophobicContact SD-CG 4.28Å
78	S	86.8	Confident	88.8	Confident	40 Å²	40	52.8 Å²	52.8	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-70.6	-43.5	179.6	71.7	0	0	0	0	111.8	D76 L81 T82 N137	D76-S78 PolarHBondContact O-N 3.26Å; D76-S78 PolarHBondContact OD1-N 3.13Å; D76-S78 PolarHBondContact OD1-OG 3.39Å; S78-L81 WeakPolarHBondContact O-CB 3.48Å; S78-L81 PolarHBondContact O-N 2.93Å; S78-T82 PolarHBondContact O-N 3.49Å; S78-N137 WeakPolarHBondContact CB-OD1 3.38Å; S78-N137 PolarHBondContact N-OD1 2.89Å; S78-N137 PolarHBondContact OG-OD1 3.19Å
79	K	88.7	Confident	88.7	Confident	112 Å²	112	58.2 Å²	58.2	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-72.8	-34.5	175.6	-68	-175.9	-170.7	168	0	112.3	L71 D76 L81 T82 T83	L71-K79 HydrophobicContact CD1-CB 3.79Å; L71-K79 HydrophobicContact CD2-CB 3.79Å; L71-K79 HydrophobicContact CD2-CD 3.86Å; L71-K79 HydrophobicContact CD2-CG 4.5Å; L71-K79 HydrophobicContact CG-CB 4.4Å; D76-K79 HydrophobicContact CB-CB 4.49Å; D76-K79 PolarHBondContact O-N 3.13Å; D76-K79 PolarHBondContact OD1-N 2.86Å; D76-K79 WeakPolarHBondContact OD2-CD 3.13Å; D76-K79 WeakPolarHBondContact OD2-CE 3.17Å; D76-K79 WeakPolarHBondContact OD2-CG 3.05Å; D76-K79 IonicContact OD2-NZ 2.95Å; K79-L81 PolarHBondContact O-N 3.42Å; K79-T82 WeakPolarHBondContact CA-OG1 3.4Å; K79-T82 PolarHBondContact O-N 3.12Å; K79-T82 PolarHBondContact O-OG1 3.32Å; K79-T83 PolarHBondContact O-N 3.27Å; K79-T83 PolarHBondContact O-OG1 2.78Å
80	I	91	Very high	88.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-41.6	174	-65.3	170.5	0	0	0	110.2	L71 D76 M77 T83 F84 L116 F119 L144	L71-I80 HydrophobicContact CB-CD1 4.34Å; L71-I80 HydrophobicContact CB-CG1 3.6Å; D76-I80 WeakPolarHBondContact O-CG1 3.35Å; D76-I80 PolarHBondContact O-N 2.98Å; M77-I80 HydrophobicContact SD-CD1 4.21Å; I80-T83 WeakPolarHBondContact CA-OG1 3.2Å; I80-T83 PolarHBondContact O-N 3.04Å; I80-T83 PolarHBondContact O-OG1 3.43Å; I80-F84 WeakPolarHBondContact O-CB 3.3Å; I80-F84 PolarHBondContact O-N 3.06Å; I80-L116 HydrophobicContact CG2-CD1 3.85Å; I80-F119 HydrophobicContact CD1-CE1 4.11Å; I80-L144 HydrophobicContact CB-CD2 4.26Å; I80-L144 HydrophobicContact CG2-CD1 4.38Å; I80-L144 HydrophobicContact CG2-CD2 3.53Å
81	L	90.6	Very high	88.6	Confident	22 Å²	22	51 Å²	51	12%	0.115	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-46.1	175.7	177.8	65.8	0	0	0	112.3	M77 S78 K79 F84 E85 T143 L144 K147	M77-L81 PolarHBondContact O-N 2.94Å; S78-L81 WeakPolarHBondContact O-CB 3.48Å; S78-L81 PolarHBondContact O-N 2.93Å; K79-L81 PolarHBondContact O-N 3.42Å; L81-F84 PolarHBondContact O-N 2.68Å; L81-E85 WeakPolarHBondContact O-CG 3.36Å; L81-E85 PolarHBondContact O-N 3.42Å; L81-T143 HydrophobicContact CD1-CG2 4.22Å; L81-T143 HydrophobicContact CD2-CG2 3.98Å; L81-L144 HydrophobicContact CD1-CB 4.16Å; L81-L144 HydrophobicContact CD1-CD1 4.26Å; L81-K147 HydrophobicContact CD1-CD 4.08Å
82	T	91.6	Very high	88.5	Confident	71 Å²	71	56.2 Å²	56.2	44%	0.436	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-43.7	179	55.2	0	0	0	0	111.7	S78 K79 F84 E85 D86	S78-T82 PolarHBondContact O-N 3.49Å; K79-T82 WeakPolarHBondContact CA-OG1 3.4Å; K79-T82 PolarHBondContact O-N 3.12Å; K79-T82 PolarHBondContact O-OG1 3.32Å; T82-F84 VanDerWaalsContact C-N 3.32Å; T82-F84 PolarHBondContact O-N 3.14Å; T82-E85 PolarHBondContact O-N 2.97Å; T82-D86 PolarHBondContact O-N 3.18Å
83	T	90.4	Very high	88.4	Confident	11 Å²	11	58.6 Å²	58.6	7%	0.067	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-32.3	176.9	52.7	0	0	0	0	112.5	I68 L71 K79 I80 D86 L87	I68-T83 WeakPolarHBondContact CG1-OG1 3.36Å; L71-T83 HydrophobicContact CD1-CG2 3.63Å; K79-T83 PolarHBondContact O-N 3.27Å; K79-T83 PolarHBondContact O-OG1 2.78Å; I80-T83 WeakPolarHBondContact CA-OG1 3.2Å; I80-T83 PolarHBondContact O-N 3.04Å; I80-T83 PolarHBondContact O-OG1 3.43Å; T83-D86 PolarHBondContact O-N 3.34Å; T83-L87 VanDerWaalsContact O-CB 3.23Å; T83-L87 WeakPolarHBondContact O-CB 3.18Å; T83-L87 PolarHBondContact O-N 3.46Å
84	F	92.3	Very high	88.3	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-67.7	-40.8	174.1	177.9	-103	0	0	0	111.2	I80 L81 T82 L87 C88 L113 L116 L144 K147 L148 Y151	I80-F84 WeakPolarHBondContact O-CB 3.3Å; I80-F84 PolarHBondContact O-N 3.06Å; L81-F84 PolarHBondContact O-N 2.68Å; T82-F84 VanDerWaalsContact C-N 3.32Å; T82-F84 PolarHBondContact O-N 3.14Å; F84-L87 HydrophobicContact CD2-CD2 4.45Å; F84-L87 PolarHBondContact O-N 3.11Å; F84-C88 PolarHBondContact O-N 3.45Å; F84-C88 PolarHBondContact O-SG 2.87Å; F84-L113 HydrophobicContact CE2-CD2 3.86Å; F84-L116 HydrophobicContact CD2-CD2 3.57Å; F84-L116 HydrophobicContact CE2-CD2 4.06Å; F84-L116 HydrophobicContact CG-CD2 4.31Å; F84-L144 HydrophobicContact CB-CD1 3.98Å; F84-L144 HydrophobicContact CD1-CD1 4Å; F84-L144 HydrophobicContact CG-CD1 3.97Å; F84-K147 HydrophobicContact CE1-CB 4.24Å; F84-L148 HydrophobicContact CD2-CD1 4.29Å; F84-L148 HydrophobicContact CE1-CD1 4.46Å; F84-L148 HydrophobicContact CE2-CD1 3.46Å; F84-L148 VanDerWaalsContact CE2-CD1 3.46Å; F84-L148 HydrophobicContact CZ-CD1 3.57Å; F84-Y151 HydrophobicContact CZ-CD1 4.09Å; F84-Y151 HydrophobicContact CZ-CG 4.25Å
85	E	91.7	Very high	88.2	Confident	53 Å²	53	49.6 Å²	49.6	25%	0.248	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-40.9	173.2	-71.6	175.6	-165.2	0	0	112.4	L81 T82 C88 R89 K147	L81-E85 WeakPolarHBondContact O-CG 3.36Å; L81-E85 PolarHBondContact O-N 3.42Å; T82-E85 PolarHBondContact O-N 2.97Å; E85-C88 PolarHBondContact O-N 3.47Å; E85-R89 WeakPolarHBondContact O-CG 3.49Å; E85-R89 PolarHBondContact O-N 3.34Å; E85-R89 IonicContact OE2-NH2 3.57Å; E85-K147 VanDerWaalsContact CD-NZ 3.35Å; E85-K147 IonicContact OE1-NZ 3.99Å; E85-K147 PolarHBondContact OE1-NZ 2.96Å
86	D	91.1	Very high	88	Confident	56 Å²	56	47.9 Å²	47.9	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-65.9	-40.4	175.2	-68.5	-27	0	0	0	111.2	L64 T82 T83 C88 R89 V90	L64-D86 HydrophobicContact CD1-CB 4.5Å; L64-D86 HydrophobicContact CD2-CB 4.47Å; T82-D86 PolarHBondContact O-N 3.18Å; T83-D86 PolarHBondContact O-N 3.34Å; D86-C88 PolarHBondContact O-N 2.87Å; D86-R89 PolarHBondContact O-N 3.1Å; D86-R89 VanDerWaalsContact O-N 3.13Å; D86-R89 IonicContact OD1-CZ 2.75Å; D86-R89 IonicContact OD1-NH1 3.46Å; D86-R89 PolarHBondContact OD1-NH1 3.36Å; D86-R89 IonicContact OD1-NH2 3.58Å; D86-R89 PolarHBondContact OD1-NH2 3.16Å; D86-V90 WeakPolarHBondContact O-CG2 3.22Å; D86-V90 PolarHBondContact O-N 3.4Å
87	L	91.1	Very high	87.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-41.8	173.8	177.8	138.9	0	0	0	111.6	L64 I65 I68 T83 F84 R89 V90 F91 F109	L64-L87 HydrophobicContact CB-CB 4.47Å; L64-L87 HydrophobicContact CB-CD1 4.31Å; L64-L87 HydrophobicContact CD1-CB 4.3Å; I65-L87 HydrophobicContact CG1-CD1 3.67Å; I68-L87 HydrophobicContact CD1-CB 4.4Å; I68-L87 HydrophobicContact CD1-CD1 3.77Å; T83-L87 VanDerWaalsContact O-CB 3.23Å; T83-L87 WeakPolarHBondContact O-CB 3.18Å; T83-L87 PolarHBondContact O-N 3.46Å; F84-L87 HydrophobicContact CD2-CD2 4.45Å; F84-L87 PolarHBondContact O-N 3.11Å; L87-R89 PolarHBondContact O-N 2.94Å; L87-V90 PolarHBondContact O-N 2.95Å; L87-F91 WeakPolarHBondContact O-CB 3.44Å; L87-F91 PolarHBondContact O-N 3.08Å; L87-F109 HydrophobicContact CD1-CE2 4.42Å; L87-F109 HydrophobicContact CD2-CD2 4.36Å; L87-F109 HydrophobicContact CD2-CE2 3.39Å; L87-F109 HydrophobicContact CD2-CZ 3.92Å; L87-F109 HydrophobicContact CG-CE2 3.96Å
88	C	88.5	Confident	87.1	Confident	19 Å²	19	47.8 Å²	47.8	13%	0.128	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-40.8	172.1	-68.3	0	0	0	0	112.2	F84 E85 D86 Q92 Y151	F84-C88 PolarHBondContact O-N 3.45Å; F84-C88 PolarHBondContact O-SG 2.87Å; E85-C88 PolarHBondContact O-N 3.47Å; D86-C88 PolarHBondContact O-N 2.87Å; C88-Q92 WeakPolarHBondContact O-CG 3.27Å; C88-Q92 PolarHBondContact O-N 2.97Å; C88-Y151 HydrophobicContact CB-CE2 4.37Å
89	R	89.2	Confident	86.7	Confident	131 Å²	131	50.6 Å²	50.6	49%	0.494	25%	0.25	S	S	.	.	H	α-helix	trans	-68.4	-41.7	178	-70.4	-174.3	-135.1	131.8	9.6	112.3	E85 D86 L87 Q92 K93	E85-R89 WeakPolarHBondContact O-CG 3.49Å; E85-R89 PolarHBondContact O-N 3.34Å; E85-R89 IonicContact OE2-NH2 3.57Å; D86-R89 PolarHBondContact O-N 3.1Å; D86-R89 VanDerWaalsContact O-N 3.13Å; D86-R89 IonicContact OD1-CZ 2.75Å; D86-R89 IonicContact OD1-NH1 3.46Å; D86-R89 PolarHBondContact OD1-NH1 3.36Å; D86-R89 IonicContact OD1-NH2 3.58Å; D86-R89 PolarHBondContact OD1-NH2 3.16Å; L87-R89 PolarHBondContact O-N 2.94Å; R89-Q92 PolarHBondContact O-N 3.39Å; R89-K93 PolarHBondContact O-N 2.85Å
90	V	88	Confident	86	Confident	22 Å²	22	54.3 Å²	54.3	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-68	-40.2	176.5	175.5	0	0	0	0	110.3	E60 L61 L64 D86 L87 Q92 K93 A94	E60-V90 HydrophobicContact CB-CG1 4.1Å; L61-V90 HydrophobicContact CD2-CB 4.17Å; L61-V90 HydrophobicContact CD2-CG1 3.78Å; L61-V90 HydrophobicContact CG-CG1 3.91Å; L64-V90 HydrophobicContact CD1-CB 4.06Å; L64-V90 HydrophobicContact CD1-CG2 3.71Å; D86-V90 WeakPolarHBondContact O-CG2 3.22Å; D86-V90 PolarHBondContact O-N 3.4Å; L87-V90 PolarHBondContact O-N 2.95Å; V90-Q92 PolarHBondContact O-N 3.43Å; V90-K93 WeakPolarHBondContact O-CB 3.43Å; V90-K93 PolarHBondContact O-N 2.8Å; V90-K93 VanDerWaalsContact O-N 3.12Å; V90-A94 WeakPolarHBondContact O-CB 3.31Å; V90-A94 PolarHBondContact O-N 3.26Å
91	F	88	Confident	84.8	Confident	8 Å²	8	60 Å²	60	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-40.1	175.5	-171.6	-93.1	0	0	0	112	L61 L87 K93 A94 K95 I98 T105 F109 Y151 F155	L61-F91 HydrophobicContact CD1-CD2 4.21Å; L61-F91 HydrophobicContact CD2-CB 4.15Å; L61-F91 HydrophobicContact CD2-CD2 4.46Å; L87-F91 WeakPolarHBondContact O-CB 3.44Å; L87-F91 PolarHBondContact O-N 3.08Å; F91-K93 VanDerWaalsContact C-N 3.28Å; F91-K93 PolarHBondContact O-N 3.31Å; F91-A94 CarbonylContact O-C 3.25Å; F91-A94 PolarHBondContact O-N 3.19Å; F91-A94 VanDerWaalsContact O-N 3.15Å; F91-K95 WeakPolarHBondContact O-CB 3.49Å; F91-K95 PolarHBondContact O-N 3.46Å; F91-I98 HydrophobicContact CE2-CD1 3.89Å; F91-I98 HydrophobicContact CZ-CD1 4.17Å; F91-T105 HydrophobicContact CE2-CG2 4.19Å; F91-T105 HydrophobicContact CZ-CG2 3.88Å; F91-F109 HydrophobicContact CB-CE2 3.97Å; F91-F109 HydrophobicContact CB-CZ 3.97Å; F91-F109 HydrophobicContact CD1-CE1 4.32Å; F91-F109 HydrophobicContact CD1-CZ 4.07Å; F91-F109 AromaticContact CD2-CD1 3.96Å; F91-F109 HydrophobicContact CD2-CD1 3.96Å; F91-F109 AromaticContact CD2-CD2 3.7Å; F91-F109 HydrophobicContact CD2-CD2 3.7Å; F91-F109 AromaticContact CD2-CE1 3.69Å; F91-F109 HydrophobicContact CD2-CE1 3.69Å; F91-F109 AromaticContact CD2-CE2 3.38Å; F91-F109 HydrophobicContact CD2-CE2 3.38Å; F91-F109 AromaticContact CD2-CG 3.96Å; F91-F109 HydrophobicContact CD2-CG 3.96Å; F91-F109 AromaticContact CD2-CZ 3.39Å; F91-F109 HydrophobicContact CD2-CZ 3.39Å; F91-F109 HydrophobicContact CE1-CE1 4.24Å; F91-F109 HydrophobicContact CE1-CZ 4.45Å; F91-F109 AromaticContact CE2-CD1 3.59Å; F91-F109 HydrophobicContact CE2-CD1 3.59Å; F91-F109 HydrophobicContact CE2-CD2 4.08Å; F91-F109 AromaticContact CE2-CE1 3.59Å; F91-F109 HydrophobicContact CE2-CE1 3.59Å; F91-F109 HydrophobicContact CE2-CE2 4.05Å; F91-F109 AromaticContact CE2-CG 3.84Å; F91-F109 HydrophobicContact CE2-CG 3.84Å; F91-F109 AromaticContact CE2-CZ 3.83Å; F91-F109 HydrophobicContact CE2-CZ 3.83Å; F91-F109 HydrophobicContact CG-CE1 4.05Å; F91-F109 AromaticContact CG-CE2 3.79Å; F91-F109 HydrophobicContact CG-CE2 3.79Å; F91-F109 AromaticContact CG-CZ 3.52Å; F91-F109 HydrophobicContact CG-CZ 3.52Å; F91-F109 HydrophobicContact CZ-CD1 4.12Å; F91-F109 AromaticContact CZ-CE1 3.88Å; F91-F109 HydrophobicContact CZ-CE1 3.88Å; F91-F109 HydrophobicContact CZ-CZ 4.34Å; F91-Y151 VanDerWaalsContact CD1-OH 3.3Å; F91-Y151 WeakPolarHBondContact CD1-OH 3.35Å; F91-F155 HydrophobicContact CD1-CZ 4.43Å; F91-F155 HydrophobicContact CE1-CE1 4.08Å; F91-F155 AromaticContact CE1-CZ 3.69Å; F91-F155 HydrophobicContact CE1-CZ 3.69Å; F91-F155 HydrophobicContact CZ-CE1 4.16Å; F91-F155 HydrophobicContact CZ-CZ 4.16Å
92	Q	86	Confident	83.5	Confident	134 Å²	134	61.7 Å²	61.7	63%	0.626	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-36.6	173	-77.9	177.5	-6.6	0	0	112.8	C88 R89 V90 K95	C88-Q92 WeakPolarHBondContact O-CG 3.27Å; C88-Q92 PolarHBondContact O-N 2.97Å; R89-Q92 PolarHBondContact O-N 3.39Å; V90-Q92 PolarHBondContact O-N 3.43Å; Q92-K95 WeakPolarHBondContact O-CB 3.45Å
93	K	84.4	Confident	82.3	Confident	127 Å²	127	60.2 Å²	60.2	55%	0.552	31%	0.309	S	S	*	.	H	α-helix	trans	-71.6	-38.2	173.6	-66.1	176.7	-176	177.6	0	112	R89 V90 F91 K95	R89-K93 PolarHBondContact O-N 2.85Å; V90-K93 WeakPolarHBondContact O-CB 3.43Å; V90-K93 PolarHBondContact O-N 2.8Å; V90-K93 VanDerWaalsContact O-N 3.12Å; F91-K93 VanDerWaalsContact C-N 3.28Å; F91-K93 PolarHBondContact O-N 3.31Å; K93-K95 VanDerWaalsContact C-N 3.3Å
94	A	83.9	Confident	81.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-70	-26.6	176.1	0	0	0	0	0	112.2	R57 L61 V90 F91 A96 V97 I98	R57-A94 HydrophobicContact CB-CB 4.16Å; L61-A94 HydrophobicContact CD1-CB 3.93Å; V90-A94 WeakPolarHBondContact O-CB 3.31Å; V90-A94 PolarHBondContact O-N 3.26Å; F91-A94 CarbonylContact O-C 3.25Å; F91-A94 PolarHBondContact O-N 3.19Å; F91-A94 VanDerWaalsContact O-N 3.15Å; A94-A96 VanDerWaalsContact C-N 3.25Å; A94-A96 PolarHBondContact O-N 2.92Å; A94-V97 CarbonylContact O-C 3.5Å; A94-V97 WeakPolarHBondContact O-CA 3.27Å; A94-V97 WeakPolarHBondContact O-CB 3.47Å; A94-V97 PolarHBondContact O-N 3.04Å; A94-I98 HydrophobicContact CB-CD1 4.24Å; A94-I98 WeakPolarHBondContact O-CG1 3.47Å; A94-I98 PolarHBondContact O-N 3.17Å
95	K	81.3	Confident	80.7	Confident	111 Å²	111	65.9 Å²	65.9	48%	0.483	34%	0.344	S	S	.	.	H	α-helix	trans	-56.6	-39.6	178.1	-167.6	175	-179.4	174.5	0	111.7	F91 Q92 K93 V97 I98 D99	F91-K95 WeakPolarHBondContact O-CB 3.49Å; F91-K95 PolarHBondContact O-N 3.46Å; Q92-K95 WeakPolarHBondContact O-CB 3.45Å; K93-K95 VanDerWaalsContact C-N 3.3Å; K95-V97 PolarHBondContact O-N 3.26Å; K95-I98 PolarHBondContact O-N 2.8Å; K95-D99 VanDerWaalsContact O-CB 3.29Å; K95-D99 WeakPolarHBondContact O-CB 3.29Å; K95-D99 PolarHBondContact O-N 3.36Å
96	A	79.2	Confident	80	Confident	55 Å²	55	64.2 Å²	64.2	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-25.3	174	0	0	0	0	0	113.9	A94 R100	A94-A96 VanDerWaalsContact C-N 3.25Å; A94-A96 PolarHBondContact O-N 2.92Å; A96-R100 WeakPolarHBondContact O-CG 3.21Å
97	V	78.6	Confident	79.6	Confident	13 Å²	13	67.5 Å²	67.5	8%	0.079	35%	0.346	C	S	.	.	H	α-helix	trans	-87.7	-39.5	175	-175.7	0	0	0	0	110.9	E53 K54 R57 A94 K95 R100 E101	E53-V97 HydrophobicContact CG-CG2 4.3Å; K54-V97 HydrophobicContact CB-CG1 4.03Å; K54-V97 HydrophobicContact CG-CG1 4.41Å; R57-V97 HydrophobicContact CG-CG2 4.41Å; A94-V97 CarbonylContact O-C 3.5Å; A94-V97 WeakPolarHBondContact O-CA 3.27Å; A94-V97 WeakPolarHBondContact O-CB 3.47Å; A94-V97 PolarHBondContact O-N 3.04Å; K95-V97 PolarHBondContact O-N 3.26Å; V97-R100 PolarHBondContact O-N 3.25Å; V97-E101 PolarHBondContact O-N 3.26Å
98	I	76.9	Confident	79.4	Confident	12 Å²	12	70.3 Å²	70.3	6%	0.062	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-42.5	177.7	-63.4	162.8	0	0	0	110.8	F58 F91 A94 K95 R100 E101 G102 G103 P106	F58-I98 HydrophobicContact CE1-CD1 4.22Å; F58-I98 HydrophobicContact CE1-CG1 3.92Å; F58-I98 HydrophobicContact CZ-CG1 4.15Å; F91-I98 HydrophobicContact CE2-CD1 3.89Å; F91-I98 HydrophobicContact CZ-CD1 4.17Å; A94-I98 HydrophobicContact CB-CD1 4.24Å; A94-I98 WeakPolarHBondContact O-CG1 3.47Å; A94-I98 PolarHBondContact O-N 3.17Å; K95-I98 PolarHBondContact O-N 2.8Å; I98-R100 PolarHBondContact O-N 3.28Å; I98-E101 PolarHBondContact O-N 3.02Å; I98-E101 VanDerWaalsContact O-N 3.14Å; I98-G102 PolarHBondContact O-N 3.34Å; I98-G103 PolarHBondContact O-N 3.29Å; I98-G103 VanDerWaalsContact O-N 3.08Å; I98-P106 HydrophobicContact CD1-CG 4.2Å
99	D	77.6	Confident	79.3	Confident	99 Å²	99	69.4 Å²	69.4	53%	0.529	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.9	177.9	-68.8	-13.9	0	0	0	111.7	K95	K95-D99 VanDerWaalsContact O-CB 3.29Å; K95-D99 WeakPolarHBondContact O-CB 3.29Å; K95-D99 PolarHBondContact O-N 3.36Å
100	R	74	Confident	79.1	Confident	191 Å²	191	63.6 Å²	63.6	72%	0.721	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-26.9	175.8	-74.5	179.7	-165.7	157.2	4.8	113.8	A96 V97 I98	A96-R100 WeakPolarHBondContact O-CG 3.21Å; V97-R100 PolarHBondContact O-N 3.25Å; I98-R100 PolarHBondContact O-N 3.28Å
101	E	65.3	Low	79.1	Confident	119 Å²	119	66.1 Å²	66.1	56%	0.556	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	10	-171.2	-71.2	-162	171.9	0	0	114.7	K54 V97 I98	K54-E101 VanDerWaalsContact CD-OE2 3.23Å; K54-E101 WeakPolarHBondContact CD-OE2 3.43Å; K54-E101 WeakPolarHBondContact CE-OE2 3.32Å; K54-E101 IonicContact NZ-OE1 3.48Å; K54-E101 IonicContact NZ-OE2 3.53Å; K54-E101 PolarHBondContact NZ-OE2 3.47Å; V97-E101 PolarHBondContact O-N 3.26Å; I98-E101 PolarHBondContact O-N 3.02Å; I98-E101 VanDerWaalsContact O-N 3.14Å
102	G	64.9	Low	78.9	Confident	58 Å²	58	66.3 Å²	66.3	60%	0.598	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	122	13.4	172.4	0	0	0	0	0	115.1	I98 V104	I98-G102 PolarHBondContact O-N 3.34Å; G102-V104 PolarHBondContact O-N 3.29Å
103	G	66.4	Low	79.1	Confident	39 Å²	39	60 Å²	60	40%	0.402	31%	0.311	S	S	.	.	S	Bend	trans	66.5	6	166.2	0	0	0	0	0	115.6	I98 T105	I98-G103 PolarHBondContact O-N 3.29Å; I98-G103 VanDerWaalsContact O-N 3.08Å; G103-T105 PolarHBondContact O-N 3.24Å
104	V	73.2	Confident	79.2	Confident	120 Å²	120	54.6 Å²	54.6	73%	0.727	29%	0.289	S	S	*	.			trans	-81.7	114.3	178.6	-174.6	0	0	0	0	109.1	G102	G102-V104 PolarHBondContact O-N 3.29Å
105	T	74.8	Confident	79.4	Confident	15 Å²	15	56.7 Å²	56.7	9%	0.092	30%	0.299	C	S	.	.			trans	-61.2	128.9	174.8	-51.9	0	0	0	0	110.4	F91 G103 R107 F109 L110 F155 E158	F91-T105 HydrophobicContact CE2-CG2 4.19Å; F91-T105 HydrophobicContact CZ-CG2 3.88Å; G103-T105 PolarHBondContact O-N 3.24Å; T105-R107 PolarHBondContact O-N 3.25Å; T105-F109 HydrophobicContact CG2-CD1 4.1Å; T105-L110 HydrophobicContact CG2-CD2 4.24Å; T105-L110 HydrophobicContact CG2-CG 4.3Å; T105-F155 HydrophobicContact CG2-CD1 4.45Å; T105-F155 HydrophobicContact CG2-CE1 4.2Å; T105-E158 WeakPolarHBondContact CB-OE2 3.4Å; T105-E158 VanDerWaalsContact OG1-CD 3.26Å; T105-E158 PolarHBondContact OG1-OE1 3.47Å; T105-E158 PolarHBondContact OG1-OE2 2.83Å
106	P	78.4	Confident	79.7	Confident	18 Å²	18	51.6 Å²	51.6	12%	0.117	28%	0.277	C	S	.	.			trans	-59.7	129.7	-176.5	-24.4	32.3	0	0	0	113.3	F58 I98 F108 F109 L110	F58-P106 HydrophobicContact CE1-CG 3.91Å; F58-P106 HydrophobicContact CZ-CG 3.97Å; I98-P106 HydrophobicContact CD1-CG 4.2Å; P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 HydrophobicContact CB-CD1 3.68Å; P106-F108 HydrophobicContact CB-CE1 3.31Å; P106-F108 HydrophobicContact CB-CG 4.45Å; P106-F108 HydrophobicContact CB-CZ 3.8Å; P106-F108 HydrophobicContact CG-CE1 4.14Å; P106-F108 HydrophobicContact CG-CZ 4.32Å; P106-F108 PolarHBondContact O-N 3.4Å; P106-F109 HydrophobicContact CB-CB 4.49Å; P106-F109 VanDerWaalsContact O-CB 3.31Å; P106-F109 WeakPolarHBondContact O-CB 3.44Å; P106-F109 PolarHBondContact O-N 2.81Å; P106-L110 PolarHBondContact O-N 2.92Å
107	R	81.4	Confident	80.2	Confident	125 Å²	125	50.7 Å²	50.7	47%	0.472	26%	0.263	S	S	.	.	H	α-helix	trans	-55.7	-35.3	-179.3	-81.2	-170	166	-172.9	-2.2	113.8	T105 F109 L110 R111 Y162 E165 D167	T105-R107 PolarHBondContact O-N 3.25Å; R107-F109 VanDerWaalsContact C-N 3.26Å; R107-F109 PolarHBondContact O-N 3.16Å; R107-L110 PolarHBondContact O-N 3.43Å; R107-R111 PolarHBondContact O-N 3.26Å; R107-Y162 HydrophobicContact CB-CE2 4.16Å; R107-Y162 HydrophobicContact CG-CD2 4.32Å; R107-Y162 HydrophobicContact CG-CE2 4.17Å; R107-E165 IonicContact NH2-OE2 3.92Å; R107-E165 PolarHBondContact NH2-OE2 3.46Å; R107-D167 IonicContact CZ-OD1 3.7Å; R107-D167 IonicContact NH1-OD1 2.85Å; R107-D167 PolarHBondContact NH1-OD1 3.46Å
108	F	86.8	Confident	80.6	Confident	60 Å²	60	53.6 Å²	53.6	26%	0.263	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-30	177.5	69.9	-98	0	0	0	112.9	F58 L61 R62 I65 P106 S112	F58-F108 HydrophobicContact CD1-CZ 4.4Å; F58-F108 HydrophobicContact CG-CZ 4.48Å; L61-F108 HydrophobicContact CB-CE2 4.18Å; R62-F108 HydrophobicContact CG-CD2 4.3Å; R62-F108 HydrophobicContact CG-CE2 4.11Å; R62-F108 HydrophobicContact CG-CZ 4.46Å; I65-F108 HydrophobicContact CD1-CD2 3.56Å; I65-F108 HydrophobicContact CD1-CE2 3.85Å; P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 HydrophobicContact CB-CD1 3.68Å; P106-F108 HydrophobicContact CB-CE1 3.31Å; P106-F108 HydrophobicContact CB-CG 4.45Å; P106-F108 HydrophobicContact CB-CZ 3.8Å; P106-F108 HydrophobicContact CG-CE1 4.14Å; P106-F108 HydrophobicContact CG-CZ 4.32Å; P106-F108 PolarHBondContact O-N 3.4Å; F108-S112 PolarHBondContact O-N 2.92Å; F108-S112 VanDerWaalsContact O-N 3.14Å
109	F	87.1	Confident	81.1	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-71.9	-45.8	176	-176.1	-101.3	0	0	0	110.4	L61 L87 F91 T105 P106 R107 R111 S112 L113 Y151 F155	L61-F109 HydrophobicContact CD2-CE2 4.5Å; L87-F109 HydrophobicContact CD1-CE2 4.42Å; L87-F109 HydrophobicContact CD2-CD2 4.36Å; L87-F109 HydrophobicContact CD2-CE2 3.39Å; L87-F109 HydrophobicContact CD2-CZ 3.92Å; L87-F109 HydrophobicContact CG-CE2 3.96Å; F91-F109 HydrophobicContact CB-CE2 3.97Å; F91-F109 HydrophobicContact CB-CZ 3.97Å; F91-F109 HydrophobicContact CD1-CE1 4.32Å; F91-F109 HydrophobicContact CD1-CZ 4.07Å; F91-F109 AromaticContact CD2-CD1 3.96Å; F91-F109 HydrophobicContact CD2-CD1 3.96Å; F91-F109 AromaticContact CD2-CD2 3.7Å; F91-F109 HydrophobicContact CD2-CD2 3.7Å; F91-F109 AromaticContact CD2-CE1 3.69Å; F91-F109 HydrophobicContact CD2-CE1 3.69Å; F91-F109 AromaticContact CD2-CE2 3.38Å; F91-F109 HydrophobicContact CD2-CE2 3.38Å; F91-F109 AromaticContact CD2-CG 3.96Å; F91-F109 HydrophobicContact CD2-CG 3.96Å; F91-F109 AromaticContact CD2-CZ 3.39Å; F91-F109 HydrophobicContact CD2-CZ 3.39Å; F91-F109 HydrophobicContact CE1-CE1 4.24Å; F91-F109 HydrophobicContact CE1-CZ 4.45Å; F91-F109 AromaticContact CE2-CD1 3.59Å; F91-F109 HydrophobicContact CE2-CD1 3.59Å; F91-F109 HydrophobicContact CE2-CD2 4.08Å; F91-F109 AromaticContact CE2-CE1 3.59Å; F91-F109 HydrophobicContact CE2-CE1 3.59Å; F91-F109 HydrophobicContact CE2-CE2 4.05Å; F91-F109 AromaticContact CE2-CG 3.84Å; F91-F109 HydrophobicContact CE2-CG 3.84Å; F91-F109 AromaticContact CE2-CZ 3.83Å; F91-F109 HydrophobicContact CE2-CZ 3.83Å; F91-F109 HydrophobicContact CG-CE1 4.05Å; F91-F109 AromaticContact CG-CE2 3.79Å; F91-F109 HydrophobicContact CG-CE2 3.79Å; F91-F109 AromaticContact CG-CZ 3.52Å; F91-F109 HydrophobicContact CG-CZ 3.52Å; F91-F109 HydrophobicContact CZ-CD1 4.12Å; F91-F109 AromaticContact CZ-CE1 3.88Å; F91-F109 HydrophobicContact CZ-CE1 3.88Å; F91-F109 HydrophobicContact CZ-CZ 4.34Å; T105-F109 HydrophobicContact CG2-CD1 4.1Å; P106-F109 HydrophobicContact CB-CB 4.49Å; P106-F109 VanDerWaalsContact O-CB 3.31Å; P106-F109 WeakPolarHBondContact O-CB 3.44Å; P106-F109 PolarHBondContact O-N 2.81Å; R107-F109 VanDerWaalsContact C-N 3.26Å; R107-F109 PolarHBondContact O-N 3.16Å; F109-R111 VanDerWaalsContact C-N 3.33Å; F109-R111 PolarHBondContact O-N 3.25Å; F109-S112 PolarHBondContact O-N 3.36Å; F109-S112 VanDerWaalsContact O-N 3.11Å; F109-S112 PolarHBondContact O-OG 3.27Å; F109-L113 HydrophobicContact CD1-CD1 3.93Å; F109-L113 HydrophobicContact CD1-CG 4.43Å; F109-L113 HydrophobicContact CE1-CD1 3.52Å; F109-L113 HydrophobicContact CE1-CG 4.18Å; F109-L113 HydrophobicContact CZ-CD1 4.19Å; F109-L113 PolarHBondContact O-N 2.89Å; F109-Y151 HydrophobicContact CE1-CE1 4.29Å; F109-Y151 AromaticContact CZ-CE1 4Å; F109-Y151 HydrophobicContact CZ-CE1 4Å; F109-F155 HydrophobicContact CE1-CZ 4.29Å
110	L	85.8	Confident	81.6	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-58	-44.2	174.6	-65.1	174.4	0	0	0	111.6	T105 P106 R107 S112 L113 T114 E158 L159 Y162	T105-L110 HydrophobicContact CG2-CD2 4.24Å; T105-L110 HydrophobicContact CG2-CG 4.3Å; P106-L110 PolarHBondContact O-N 2.92Å; R107-L110 PolarHBondContact O-N 3.43Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 3.46Å; L110-L113 VanDerWaalsContact O-N 3.15Å; L110-T114 PolarHBondContact O-N 2.85Å; L110-T114 PolarHBondContact O-OG1 3.14Å; L110-E158 HydrophobicContact CD1-CB 4.22Å; L110-E158 HydrophobicContact CD2-CB 4.15Å; L110-L159 HydrophobicContact CD2-CD2 4.44Å; L110-L159 HydrophobicContact CD2-CG 4.35Å; L110-Y162 HydrophobicContact CB-CD1 4.31Å; L110-Y162 HydrophobicContact CB-CD2 4.36Å; L110-Y162 HydrophobicContact CB-CG 4.09Å
111	R	86.7	Confident	82.2	Confident	74 Å²	74	42.2 Å²	42.2	28%	0.279	23%	0.231	S	C	.	.	H	α-helix	trans	-57.2	-44	174	-166.3	-175.6	-65	-175.9	2.2	112.3	R107 F109 L113 T114 E115 Y162 D167	R107-R111 PolarHBondContact O-N 3.26Å; F109-R111 VanDerWaalsContact C-N 3.33Å; F109-R111 PolarHBondContact O-N 3.25Å; R111-L113 VanDerWaalsContact C-N 3.31Å; R111-L113 PolarHBondContact O-N 3.21Å; R111-T114 PolarHBondContact O-N 3.2Å; R111-T114 PolarHBondContact O-OG1 3.26Å; R111-E115 HydrophobicContact CG-CG 4.43Å; R111-E115 WeakPolarHBondContact CG-OE1 3.47Å; R111-E115 VanDerWaalsContact O-CB 3.27Å; R111-E115 WeakPolarHBondContact O-CB 3.34Å; R111-E115 WeakPolarHBondContact O-CG 3.3Å; R111-E115 PolarHBondContact O-N 3.5Å; R111-Y162 HydrophobicContact CB-CE1 3.95Å; R111-Y162 HydrophobicContact CG-CE1 4.29Å; R111-Y162 PolarHBondContact NE-OH 3.28Å; R111-D167 IonicContact NH2-OD2 3.9Å; R111-D167 PolarHBondContact NH2-OD2 3.47Å
112	S	85	Confident	83.2	Confident	12 Å²	12	42.6 Å²	42.6	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-34.1	179.1	77.1	0	0	0	0	112.7	F108 F109 L110 L116	F108-S112 PolarHBondContact O-N 2.92Å; F108-S112 VanDerWaalsContact O-N 3.14Å; F109-S112 PolarHBondContact O-N 3.36Å; F109-S112 VanDerWaalsContact O-N 3.11Å; F109-S112 PolarHBondContact O-OG 3.27Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 3.47Å; S112-L116 WeakPolarHBondContact O-CB 3.42Å; S112-L116 PolarHBondContact O-N 2.8Å
113	L	88.6	Confident	84.2	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-72.1	-42.5	177	-71	179.5	0	0	0	112.1	F84 F109 L110 R111 L116 E117 L148 Y151 F155 L159	F84-L113 HydrophobicContact CE2-CD2 3.86Å; F109-L113 HydrophobicContact CD1-CD1 3.93Å; F109-L113 HydrophobicContact CD1-CG 4.43Å; F109-L113 HydrophobicContact CE1-CD1 3.52Å; F109-L113 HydrophobicContact CE1-CG 4.18Å; F109-L113 HydrophobicContact CZ-CD1 4.19Å; F109-L113 PolarHBondContact O-N 2.89Å; L110-L113 PolarHBondContact O-N 3.46Å; L110-L113 VanDerWaalsContact O-N 3.15Å; R111-L113 VanDerWaalsContact C-N 3.31Å; R111-L113 PolarHBondContact O-N 3.21Å; L113-L116 PolarHBondContact O-N 3.06Å; L113-E117 WeakPolarHBondContact O-CB 3.4Å; L113-E117 PolarHBondContact O-N 3.14Å; L113-L148 HydrophobicContact CD2-CD1 4.23Å; L113-Y151 HydrophobicContact CD1-CD1 4.47Å; L113-Y151 HydrophobicContact CD1-CE1 4.42Å; L113-Y151 HydrophobicContact CD2-CD1 4.29Å; L113-F155 HydrophobicContact CD1-CD2 4.35Å; L113-L159 HydrophobicContact CB-CD2 4.46Å
114	T	87.1	Confident	85	Confident	13 Å²	13	41.2 Å²	41.2	8%	0.08	20%	0.198	C	C	.	.	H	α-helix	trans	-65.4	-46.7	175.1	52.3	0	0	0	0	111.3	L110 R111 L116 E117 D118 L159 Y162	L110-T114 PolarHBondContact O-N 2.85Å; L110-T114 PolarHBondContact O-OG1 3.14Å; R111-T114 PolarHBondContact O-N 3.2Å; R111-T114 PolarHBondContact O-OG1 3.26Å; T114-L116 VanDerWaalsContact C-N 3.26Å; T114-L116 PolarHBondContact O-N 2.81Å; T114-E117 PolarHBondContact O-N 3.47Å; T114-E117 VanDerWaalsContact O-N 3.11Å; T114-D118 VanDerWaalsContact O-CG 3.25Å; T114-D118 PolarHBondContact O-N 3.48Å; T114-L159 HydrophobicContact CG2-CD2 3.46Å; T114-L159 VanDerWaalsContact CG2-CD2 3.46Å; T114-Y162 HydrophobicContact CG2-CD1 4.36Å
115	E	87.5	Confident	85.5	Confident	45 Å²	45	41.4 Å²	41.4	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-35.4	176.8	-81.4	-174.1	-137.9	0	0	112.5	R69 R72 R111 F119	R69-E115 IonicContact CZ-OE1 2.75Å; R69-E115 IonicContact NE-OE1 2.87Å; R69-E115 IonicContact NE-OE2 3.22Å; R69-E115 IonicContact NH2-OE1 3.2Å; R69-E115 PolarHBondContact NH2-OE1 3.27Å; R69-E115 IonicContact NH2-OE2 2.78Å; R72-E115 IonicContact CZ-OE2 3.64Å; R72-E115 IonicContact NH1-OE2 3.54Å; R72-E115 PolarHBondContact NH1-OE2 3.43Å; R72-E115 IonicContact NH2-OE2 3.68Å; R72-E115 PolarHBondContact NH2-OE2 3.23Å; R111-E115 HydrophobicContact CG-CG 4.43Å; R111-E115 WeakPolarHBondContact CG-OE1 3.47Å; R111-E115 VanDerWaalsContact O-CB 3.27Å; R111-E115 WeakPolarHBondContact O-CB 3.34Å; R111-E115 WeakPolarHBondContact O-CG 3.3Å; R111-E115 PolarHBondContact O-N 3.5Å; E115-F119 WeakPolarHBondContact O-CB 3.22Å; E115-F119 PolarHBondContact O-N 3.23Å
116	L	88.1	Confident	85.7	Confident	4 Å²	4	45 Å²	45	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-75.9	-34.6	176.8	-171.8	63.5	0	0	0	111.6	I68 I80 F84 S112 L113 T114 V120 L148	I68-L116 HydrophobicContact CG2-CD1 4.16Å; I80-L116 HydrophobicContact CG2-CD1 3.85Å; F84-L116 HydrophobicContact CD2-CD2 3.57Å; F84-L116 HydrophobicContact CE2-CD2 4.06Å; F84-L116 HydrophobicContact CG-CD2 4.31Å; S112-L116 WeakPolarHBondContact O-CB 3.42Å; S112-L116 PolarHBondContact O-N 2.8Å; L113-L116 PolarHBondContact O-N 3.06Å; T114-L116 VanDerWaalsContact C-N 3.26Å; T114-L116 PolarHBondContact O-N 2.81Å; L116-V120 HydrophobicContact CD1-CG2 4.41Å; L116-V120 HydrophobicContact CG-CG2 4.49Å; L116-V120 WeakPolarHBondContact O-CB 3.49Å; L116-V120 WeakPolarHBondContact O-CG2 3.47Å; L116-V120 PolarHBondContact O-N 2.95Å; L116-L148 HydrophobicContact CD2-CD1 3.92Å; L116-L148 HydrophobicContact CG-CD1 4.35Å; L116-L148 HydrophobicContact CG-CD2 4.18Å
117	E	89.4	Confident	85.7	Confident	35 Å²	35	54 Å²	54	16%	0.164	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-49.2	174.7	-167.9	-170.9	-166.3	0	0	111.2	L113 T114 F119 V120 N121 L148 M152 R163	L113-E117 WeakPolarHBondContact O-CB 3.4Å; L113-E117 PolarHBondContact O-N 3.14Å; T114-E117 PolarHBondContact O-N 3.47Å; T114-E117 VanDerWaalsContact O-N 3.11Å; E117-F119 VanDerWaalsContact C-N 3.34Å; E117-F119 PolarHBondContact O-N 3.01Å; E117-V120 PolarHBondContact O-N 2.97Å; E117-N121 WeakPolarHBondContact O-CB 3.24Å; E117-N121 PolarHBondContact O-N 3.46Å; E117-N121 PolarHBondContact O-ND2 3.09Å; E117-L148 HydrophobicContact CB-CD2 4.04Å; E117-L148 HydrophobicContact CG-CD2 4.41Å; E117-M152 HydrophobicContact CB-CE 3.9Å; E117-M152 HydrophobicContact CB-SD 3.73Å; E117-M152 VanDerWaalsContact CD-CE 3.47Å; E117-M152 VanDerWaalsContact CD-SD 3.59Å; E117-M152 HydrophobicContact CG-CE 4.07Å; E117-M152 HydrophobicContact CG-SD 3.73Å; E117-M152 WeakPolarHBondContact OE2-CE 3.32Å; E117-R163 IonicContact OE2-CZ 3.46Å; E117-R163 IonicContact OE2-NH1 3.65Å; E117-R163 IonicContact OE2-NH2 3.55Å; E117-R163 PolarHBondContact OE2-NH2 2.81Å
118	D	88.3	Confident	85.3	Confident	74 Å²	74	56.5 Å²	56.5	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-46	-179.2	-62.6	-20.5	0	0	0	109.8	T114 V120 N121 E122 R163	T114-D118 VanDerWaalsContact O-CG 3.25Å; T114-D118 PolarHBondContact O-N 3.48Å; D118-V120 PolarHBondContact O-N 2.84Å; D118-N121 PolarHBondContact O-N 2.62Å; D118-E122 WeakPolarHBondContact O-CB 3.36Å; D118-E122 VanDerWaalsContact O-CG 3.32Å; D118-E122 WeakPolarHBondContact O-CG 3.29Å; D118-E122 PolarHBondContact O-N 3.29Å; D118-R163 IonicContact OD1-NH2 2.69Å
119	F	87.1	Confident	84.5	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.096	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-39.9	175.9	-179.2	-104.3	0	0	0	113.5	R72 K75 M77 I80 E115 E117 N123	R72-F119 HydrophobicContact CB-CZ 4.45Å; R72-F119 HydrophobicContact CG-CD1 3.78Å; R72-F119 HydrophobicContact CG-CD2 3.49Å; R72-F119 VanDerWaalsContact CG-CD2 3.49Å; R72-F119 HydrophobicContact CG-CE1 3.7Å; R72-F119 HydrophobicContact CG-CE2 3.39Å; R72-F119 HydrophobicContact CG-CG 3.67Å; R72-F119 HydrophobicContact CG-CZ 3.48Å; R72-F119 VanDerWaalsContact CG-CZ 3.48Å; K75-F119 HydrophobicContact CG-CZ 4.43Å; M77-F119 HydrophobicContact CE-CE1 3.66Å; M77-F119 HydrophobicContact CE-CZ 3.75Å; M77-F119 HydrophobicContact SD-CE1 3.95Å; I80-F119 HydrophobicContact CD1-CE1 4.11Å; E115-F119 WeakPolarHBondContact O-CB 3.22Å; E115-F119 PolarHBondContact O-N 3.23Å; E117-F119 VanDerWaalsContact C-N 3.34Å; E117-F119 PolarHBondContact O-N 3.01Å; F119-N123 WeakPolarHBondContact CD1-ND2 3.3Å; F119-N123 WeakPolarHBondContact CD2-ND2 3.35Å; F119-N123 WeakPolarHBondContact CE1-ND2 3.43Å; F119-N123 WeakPolarHBondContact CE2-ND2 3.43Å; F119-N123 WeakPolarHBondContact CZ-ND2 3.12Å; F119-N123 PolarHBondContact O-N 3.12Å; F119-N123 VanDerWaalsContact O-N 3.08Å; F119-N123 PolarHBondContact O-ND2 2.83Å
120	V	87.7	Confident	83.8	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-71.5	-35.5	179.2	170.4	0	0	0	0	111.1	L116 E117 D118 W124 L144 R145 L148	L116-V120 HydrophobicContact CD1-CG2 4.41Å; L116-V120 HydrophobicContact CG-CG2 4.49Å; L116-V120 WeakPolarHBondContact O-CB 3.49Å; L116-V120 WeakPolarHBondContact O-CG2 3.47Å; L116-V120 PolarHBondContact O-N 2.95Å; E117-V120 PolarHBondContact O-N 2.97Å; D118-V120 PolarHBondContact O-N 2.84Å; V120-W124 VanDerWaalsContact O-CB 3.24Å; V120-W124 WeakPolarHBondContact O-CB 3.34Å; V120-W124 PolarHBondContact O-N 3.36Å; V120-W124 VanDerWaalsContact O-N 3.12Å; V120-L144 HydrophobicContact CG2-CD2 3.66Å; V120-L144 HydrophobicContact CG2-CG 4.05Å; V120-R145 HydrophobicContact CG1-CB 3.61Å; V120-R145 HydrophobicContact CG1-CG 3.94Å; V120-L148 HydrophobicContact CB-CD2 4.44Å; V120-L148 HydrophobicContact CG2-CD2 4.35Å
121	N	87.3	Confident	83.3	Confident	39 Å²	39	69 Å²	69	21%	0.209	31%	0.312	C	S	.	.	H	α-helix	trans	-70.5	-44.1	175.1	-72.1	-31.1	0	0	0	111.1	E117 D118 N123 W124 D125 R149	E117-N121 WeakPolarHBondContact O-CB 3.24Å; E117-N121 PolarHBondContact O-N 3.46Å; E117-N121 PolarHBondContact O-ND2 3.09Å; D118-N121 PolarHBondContact O-N 2.62Å; N121-N123 PolarHBondContact O-N 3.28Å; N121-W124 WeakPolarHBondContact O-CB 3.45Å; N121-W124 PolarHBondContact O-N 2.9Å; N121-D125 PolarHBondContact O-N 3.12Å; N121-R149 PolarHBondContact OD1-NH2 2.84Å
122	E	86.4	Confident	82.9	Confident	126 Å²	126	70.8 Å²	70.8	59%	0.589	33%	0.331	S	S	*	.	H	α-helix	trans	-55.9	-52	174.7	-76.4	177.1	172.9	0	0	112	D118 W124 D125 D126	D118-E122 WeakPolarHBondContact O-CB 3.36Å; D118-E122 VanDerWaalsContact O-CG 3.32Å; D118-E122 WeakPolarHBondContact O-CG 3.29Å; D118-E122 PolarHBondContact O-N 3.29Å; E122-W124 PolarHBondContact O-N 2.83Å; E122-D125 PolarHBondContact O-N 2.76Å; E122-D126 PolarHBondContact O-N 3.39Å; E122-D126 VanDerWaalsContact O-N 3.1Å
123	N	84.5	Confident	82.3	Confident	8 Å²	8	71.6 Å²	71.6	4%	0.043	34%	0.335	C	S	.	.	H	α-helix	trans	-69.5	-16.9	178.2	-68.6	-69.5	0	0	0	113.4	M77 F119 N121 L141	M77-N123 HydrophobicContact CE-CB 4.44Å; F119-N123 WeakPolarHBondContact CD1-ND2 3.3Å; F119-N123 WeakPolarHBondContact CD2-ND2 3.35Å; F119-N123 WeakPolarHBondContact CE1-ND2 3.43Å; F119-N123 WeakPolarHBondContact CE2-ND2 3.43Å; F119-N123 WeakPolarHBondContact CZ-ND2 3.12Å; F119-N123 PolarHBondContact O-N 3.12Å; F119-N123 VanDerWaalsContact O-N 3.08Å; F119-N123 PolarHBondContact O-ND2 2.83Å; N121-N123 PolarHBondContact O-N 3.28Å; N123-L141 HydrophobicContact CB-CD1 3.89Å
124	W	83.7	Confident	82	Confident	60 Å²	60	74.9 Å²	74.9	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-82.5	-38.1	175.3	-170.9	-93.5	0	0	0	112.1	V120 N121 E122 R130 L141 A142 R145	V120-W124 VanDerWaalsContact O-CB 3.24Å; V120-W124 WeakPolarHBondContact O-CB 3.34Å; V120-W124 PolarHBondContact O-N 3.36Å; V120-W124 VanDerWaalsContact O-N 3.12Å; N121-W124 WeakPolarHBondContact O-CB 3.45Å; N121-W124 PolarHBondContact O-N 2.9Å; E122-W124 PolarHBondContact O-N 2.83Å; W124-R130 VanDerWaalsContact CZ2-NH1 3.35Å; W124-L141 HydrophobicContact CD2-CD2 4.46Å; W124-L141 HydrophobicContact CE3-CD2 3.31Å; W124-L141 HydrophobicContact CZ3-CD2 3.78Å; W124-A142 HydrophobicContact CH2-CB 4.33Å; W124-A142 HydrophobicContact CZ3-CB 4.1Å; W124-R145 VanDerWaalsContact CE2-NH1 3.33Å
125	D	84.2	Confident	81.8	Confident	124 Å²	124	82.6 Å²	82.6	66%	0.663	39%	0.39	S	S	*	.	H	α-helix	trans	-74.8	-31	-179.4	-67.2	-19.7	0	0	0	111.3	N121 E122 R127	N121-D125 PolarHBondContact O-N 3.12Å; E122-D125 PolarHBondContact O-N 2.76Å; D125-R127 PolarHBondContact O-N 3.24Å
126	D	79.7	Confident	81.7	Confident	91 Å²	91	85.6 Å²	85.6	49%	0.487	41%	0.407	S	S	.	.			trans	-71.9	88	172.6	-86.1	-28.4	0	0	0	113	E122 K128 D129 R130	E122-D126 PolarHBondContact O-N 3.39Å; E122-D126 VanDerWaalsContact O-N 3.1Å; D126-K128 PolarHBondContact O-N 3.38Å; D126-D129 HydrophobicContact CB-CB 4.14Å; D126-D129 PolarHBondContact O-N 3.4Å; D126-R130 PolarHBondContact O-N 2.76Å; D126-R130 VanDerWaalsContact O-N 3.12Å
127	R	76.8	Confident	81.6	Confident	206 Å²	206	86.6 Å²	86.6	78%	0.777	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.1	178.9	-159.5	177.5	-174	-167.2	3.1	113.7	D125	D125-R127 PolarHBondContact O-N 3.24Å
128	K	74.2	Confident	81.5	Confident	179 Å²	179	86.8 Å²	86.8	78%	0.778	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-49	177.2	-68.5	-179	-178	174.9	0	111.3	D126 R130 K131	D126-K128 PolarHBondContact O-N 3.38Å; K128-R130 VanDerWaalsContact C-N 3.28Å; K128-R130 PolarHBondContact O-N 3.49Å; K128-K131 PolarHBondContact O-N 3.43Å; K128-K131 VanDerWaalsContact O-N 3.09Å
129	D	69.6	Low	81.5	Confident	44 Å²	44	92.1 Å²	92.1	24%	0.235	44%	0.435	C	S	.	.	H	α-helix	trans	-66.4	-31.2	179.4	-84.3	16.1	0	0	0	112.1	K75 D126 K131 T132 L133	K75-D129 IonicContact NZ-OD2 2.91Å; K75-D129 PolarHBondContact NZ-OD2 3.19Å; D126-D129 HydrophobicContact CB-CB 4.14Å; D126-D129 PolarHBondContact O-N 3.4Å; D129-K131 PolarHBondContact O-N 3.23Å; D129-K131 VanDerWaalsContact O-N 3.13Å; D129-T132 WeakPolarHBondContact CA-OG1 3.04Å; D129-T132 PolarHBondContact O-N 3.36Å; D129-T132 VanDerWaalsContact O-N 3.16Å; D129-T132 PolarHBondContact O-OG1 3.26Å; D129-L133 WeakPolarHBondContact O-CD1 3.23Å; D129-L133 WeakPolarHBondContact O-CG 3.34Å; D129-L133 PolarHBondContact O-N 3.36Å
130	R	72.2	Confident	81.5	Confident	115 Å²	115	91.3 Å²	91.3	43%	0.434	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-25.2	173.2	-120.6	-175.6	83.8	-177.7	7.1	114.5	W124 D126 K128	W124-R130 VanDerWaalsContact CZ2-NH1 3.35Å; D126-R130 PolarHBondContact O-N 2.76Å; D126-R130 VanDerWaalsContact O-N 3.12Å; K128-R130 VanDerWaalsContact C-N 3.28Å; K128-R130 PolarHBondContact O-N 3.49Å
131	K	75.9	Confident	81.5	Confident	172 Å²	172	91.3 Å²	91.3	75%	0.748	43%	0.433	S	S	*	.	H	α-helix	trans	-90.3	-19.6	179.2	-68.4	-176.2	179.4	-176.5	0	113.3	K128 D129	K128-K131 PolarHBondContact O-N 3.43Å; K128-K131 VanDerWaalsContact O-N 3.09Å; D129-K131 PolarHBondContact O-N 3.23Å; D129-K131 VanDerWaalsContact O-N 3.13Å
132	T	78.2	Confident	81.6	Confident	112 Å²	112	91.4 Å²	91.4	69%	0.687	44%	0.439	S	S	*	.	H	α-helix	trans	-87.6	-17.1	179.7	57.5	0	0	0	0	112.6	D129	D129-T132 WeakPolarHBondContact CA-OG1 3.04Å; D129-T132 PolarHBondContact O-N 3.36Å; D129-T132 VanDerWaalsContact O-N 3.16Å; D129-T132 PolarHBondContact O-OG1 3.26Å
133	L	72.3	Confident	81.9	Confident	30 Å²	30	87.9 Å²	87.9	16%	0.157	43%	0.426	C	S	.	.	S	Bend	trans	-68.4	136.9	176.8	-73.8	154.4	0	0	0	112.4	M77 D129 N137 L141	M77-L133 HydrophobicContact CE-CD2 4.43Å; M77-L133 HydrophobicContact CG-CD2 3.9Å; D129-L133 WeakPolarHBondContact O-CD1 3.23Å; D129-L133 WeakPolarHBondContact O-CG 3.34Å; D129-L133 PolarHBondContact O-N 3.36Å; L133-N137 HydrophobicContact CB-CB 4.15Å; L133-N137 HydrophobicContact CD2-CB 3.67Å; L133-L141 HydrophobicContact CD1-CD1 3.77Å
134	S	81.6	Confident	82.2	Confident	70 Å²	70	87.5 Å²	87.5	49%	0.49	42%	0.424	S	S	.	.			trans	-51.3	150.7	168.1	166.9	0	0	0	0	111.6	N136 N137 A138	S134-N136 PolarHBondContact O-N 2.58Å; S134-N136 VanDerWaalsContact O-N 3.12Å; S134-N137 CarbonylContact O-C 3.57Å; S134-N137 WeakPolarHBondContact O-CA 3.42Å; S134-N137 PolarHBondContact O-N 2.99Å; S134-A138 PolarHBondContact O-N 3.03Å
135	K	83.9	Confident	82.5	Confident	176 Å²	176	87.5 Å²	87.5	77%	0.765	42%	0.424	S	S	*	.	H	α-helix	trans	-50.2	-39.7	177.1	-84.6	-177	179	174.7	0	112.9	R139	K135-R139 PolarHBondContact O-N 3.34Å; K135-R139 VanDerWaalsContact O-N 3.12Å
136	N	85.8	Confident	82.8	Confident	107 Å²	107	87.3 Å²	87.3	57%	0.572	42%	0.42	S	S	*	.	H	α-helix	trans	-68.5	-39.2	177.8	-75.2	-1	0	0	0	111.6	S134 G140	S134-N136 PolarHBondContact O-N 2.58Å; S134-N136 VanDerWaalsContact O-N 3.12Å; N136-G140 PolarHBondContact O-N 3.07Å
137	N	85.6	Confident	83.3	Confident	26 Å²	26	86.8 Å²	86.8	14%	0.139	41%	0.413	C	S	.	.	H	α-helix	trans	-73	-35.7	178.1	-71	-4.5	0	0	0	112.3	D76 M77 S78 L133 S134 G140 L141	D76-N137 PolarHBondContact OD1-OD1 2.85Å; M77-N137 HydrophobicContact CB-CB 4.04Å; M77-N137 WeakPolarHBondContact CB-O 3.31Å; M77-N137 HydrophobicContact CG-CB 4.27Å; S78-N137 WeakPolarHBondContact CB-OD1 3.38Å; S78-N137 PolarHBondContact N-OD1 2.89Å; S78-N137 PolarHBondContact OG-OD1 3.19Å; L133-N137 HydrophobicContact CB-CB 4.15Å; L133-N137 HydrophobicContact CD2-CB 3.67Å; S134-N137 CarbonylContact O-C 3.57Å; S134-N137 WeakPolarHBondContact O-CA 3.42Å; S134-N137 PolarHBondContact O-N 2.99Å; N137-G140 PolarHBondContact O-N 3Å; N137-L141 VanDerWaalsContact O-CB 3.29Å; N137-L141 WeakPolarHBondContact O-CB 3.43Å; N137-L141 PolarHBondContact O-N 3.42Å
138	A	86.3	Confident	83.9	Confident	38 Å²	38	77.2 Å²	77.2	31%	0.314	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-41.7	174.5	0	0	0	0	0	112.1	S134 A142	S134-A138 PolarHBondContact O-N 3.03Å; A138-A142 PolarHBondContact O-N 3.48Å
139	R	87.7	Confident	84.5	Confident	186 Å²	186	73.9 Å²	73.9	70%	0.702	36%	0.36	S	S	*	.	H	α-helix	trans	-67.7	-41.5	172.5	-75.6	-177.6	177.4	173.1	-1.8	112.1	K135 A142 T143	K135-R139 PolarHBondContact O-N 3.34Å; K135-R139 VanDerWaalsContact O-N 3.12Å; R139-A142 PolarHBondContact O-N 2.95Å; R139-T143 WeakPolarHBondContact O-CB 3.45Å; R139-T143 PolarHBondContact O-N 3.44Å; R139-T143 PolarHBondContact O-OG1 3.25Å
140	G	88.3	Confident	85.4	Confident	6 Å²	6	77.3 Å²	77.3	6%	0.062	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-49.1	175.1	0	0	0	0	0	111.5	N136 N137 T143 L144	N136-G140 PolarHBondContact O-N 3.07Å; N137-G140 PolarHBondContact O-N 3Å; G140-T143 PolarHBondContact O-N 3.4Å; G140-L144 WeakPolarHBondContact O-CB 3.44Å; G140-L144 PolarHBondContact O-N 2.84Å
141	L	88.6	Confident	86.1	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-63.7	-45.3	-179.6	-165.3	163.2	0	0	0	112.3	M77 N123 W124 L133 N137 T143 L144 R145	M77-L141 HydrophobicContact CB-CB 4.07Å; M77-L141 HydrophobicContact CE-CD1 4.18Å; M77-L141 HydrophobicContact CG-CB 4.04Å; M77-L141 HydrophobicContact CG-CD1 4.01Å; M77-L141 HydrophobicContact CG-CG 4.34Å; M77-L141 HydrophobicContact SD-CD1 3.98Å; M77-L141 HydrophobicContact SD-CG 4.28Å; N123-L141 HydrophobicContact CB-CD1 3.89Å; W124-L141 HydrophobicContact CD2-CD2 4.46Å; W124-L141 HydrophobicContact CE3-CD2 3.31Å; W124-L141 HydrophobicContact CZ3-CD2 3.78Å; L133-L141 HydrophobicContact CD1-CD1 3.77Å; N137-L141 VanDerWaalsContact O-CB 3.29Å; N137-L141 WeakPolarHBondContact O-CB 3.43Å; N137-L141 PolarHBondContact O-N 3.42Å; L141-T143 VanDerWaalsContact C-N 3.33Å; L141-T143 PolarHBondContact O-N 3.48Å; L141-L144 PolarHBondContact O-N 3.38Å; L141-R145 WeakPolarHBondContact O-CB 3.39Å; L141-R145 PolarHBondContact O-N 2.9Å
142	A	89.3	Confident	86.4	Confident	41 Å²	41	66 Å²	66	34%	0.339	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-41.2	176.9	0	0	0	0	0	112.4	W124 A138 R139 Q146	W124-A142 HydrophobicContact CH2-CB 4.33Å; W124-A142 HydrophobicContact CZ3-CB 4.1Å; A138-A142 PolarHBondContact O-N 3.48Å; R139-A142 PolarHBondContact O-N 2.95Å; A142-Q146 PolarHBondContact O-N 3.13Å
143	T	91.4	Very high	86.7	Confident	53 Å²	53	67.9 Å²	67.9	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-70.9	-41.1	178.6	-48.7	0	0	0	0	111.2	L81 R139 G140 L141 Q146 K147	L81-T143 HydrophobicContact CD1-CG2 4.22Å; L81-T143 HydrophobicContact CD2-CG2 3.98Å; R139-T143 WeakPolarHBondContact O-CB 3.45Å; R139-T143 PolarHBondContact O-N 3.44Å; R139-T143 PolarHBondContact O-OG1 3.25Å; G140-T143 PolarHBondContact O-N 3.4Å; L141-T143 VanDerWaalsContact C-N 3.33Å; L141-T143 PolarHBondContact O-N 3.48Å; T143-Q146 PolarHBondContact O-N 2.84Å; T143-K147 HydrophobicContact CG2-CD 4.44Å; T143-K147 HydrophobicContact CG2-CG 4.48Å; T143-K147 WeakPolarHBondContact O-CG 3.49Å; T143-K147 PolarHBondContact O-N 3.04Å
144	L	90.8	Very high	87.1	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-47.5	176.5	-179.5	63.8	0	0	0	110.8	I80 L81 F84 V120 G140 L141 Q146 K147 L148	I80-L144 HydrophobicContact CB-CD2 4.26Å; I80-L144 HydrophobicContact CG2-CD1 4.38Å; I80-L144 HydrophobicContact CG2-CD2 3.53Å; L81-L144 HydrophobicContact CD1-CB 4.16Å; L81-L144 HydrophobicContact CD1-CD1 4.26Å; F84-L144 HydrophobicContact CB-CD1 3.98Å; F84-L144 HydrophobicContact CD1-CD1 4Å; F84-L144 HydrophobicContact CG-CD1 3.97Å; V120-L144 HydrophobicContact CG2-CD2 3.66Å; V120-L144 HydrophobicContact CG2-CG 4.05Å; G140-L144 WeakPolarHBondContact O-CB 3.44Å; G140-L144 PolarHBondContact O-N 2.84Å; L141-L144 PolarHBondContact O-N 3.38Å; L144-Q146 VanDerWaalsContact C-N 3.32Å; L144-Q146 PolarHBondContact O-N 3.5Å; L144-K147 PolarHBondContact O-N 2.89Å; L144-L148 WeakPolarHBondContact O-CB 3.43Å; L144-L148 PolarHBondContact O-N 3.35Å
145	R	90.2	Very high	86.9	Confident	59 Å²	59	69.8 Å²	69.8	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-58.3	-42.1	176.1	-174.5	173.1	173.8	-113.2	7.6	112.6	V120 W124 L141 R149	V120-R145 HydrophobicContact CG1-CB 3.61Å; V120-R145 HydrophobicContact CG1-CG 3.94Å; W124-R145 VanDerWaalsContact CE2-NH1 3.33Å; L141-R145 WeakPolarHBondContact O-CB 3.39Å; L141-R145 PolarHBondContact O-N 2.9Å; R145-R149 VanDerWaalsContact NE-NH2 3.15Å; R145-R149 WeakPolarHBondContact O-CB 3.37Å; R145-R149 VanDerWaalsContact O-CG 3.29Å; R145-R149 WeakPolarHBondContact O-CG 3.39Å; R145-R149 PolarHBondContact O-N 3.47Å; R145-R149 VanDerWaalsContact O-N 3.17Å
146	Q	90	Very high	86.6	Confident	121 Å²	121	67.4 Å²	67.4	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-69.6	-40.4	178.8	-168.8	-177.6	8.5	0	0	112.2	A142 T143 L144 K150	A142-Q146 PolarHBondContact O-N 3.13Å; T143-Q146 PolarHBondContact O-N 2.84Å; L144-Q146 VanDerWaalsContact C-N 3.32Å; L144-Q146 PolarHBondContact O-N 3.5Å; Q146-K150 WeakPolarHBondContact O-CG 3.2Å; Q146-K150 PolarHBondContact O-N 3.31Å
147	K	90.5	Very high	86.1	Confident	80 Å²	80	67.1 Å²	67.1	35%	0.348	32%	0.318	S	S	.	.	H	α-helix	trans	-70.5	-43.2	178.1	-73	-166.1	179.9	-173.8	0	112	L81 F84 E85 T143 L144 R149 K150 Y151	L81-K147 HydrophobicContact CD1-CD 4.08Å; F84-K147 HydrophobicContact CE1-CB 4.24Å; E85-K147 VanDerWaalsContact CD-NZ 3.35Å; E85-K147 IonicContact OE1-NZ 3.99Å; E85-K147 PolarHBondContact OE1-NZ 2.96Å; T143-K147 HydrophobicContact CG2-CD 4.44Å; T143-K147 HydrophobicContact CG2-CG 4.48Å; T143-K147 WeakPolarHBondContact O-CG 3.49Å; T143-K147 PolarHBondContact O-N 3.04Å; L144-K147 PolarHBondContact O-N 2.89Å; K147-R149 PolarHBondContact O-N 3.32Å; K147-K150 WeakPolarHBondContact O-CB 3.38Å; K147-K150 PolarHBondContact O-N 3.45Å; K147-K150 VanDerWaalsContact O-N 3.13Å; K147-Y151 PolarHBondContact O-N 3.35Å
148	L	89.3	Confident	85.6	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-47.6	178.1	-168.1	69.4	0	0	0	111.1	F84 L113 L116 E117 V120 L144 K150 Y151 M152	F84-L148 HydrophobicContact CD2-CD1 4.29Å; F84-L148 HydrophobicContact CE1-CD1 4.46Å; F84-L148 HydrophobicContact CE2-CD1 3.46Å; F84-L148 VanDerWaalsContact CE2-CD1 3.46Å; F84-L148 HydrophobicContact CZ-CD1 3.57Å; L113-L148 HydrophobicContact CD2-CD1 4.23Å; L116-L148 HydrophobicContact CD2-CD1 3.92Å; L116-L148 HydrophobicContact CG-CD1 4.35Å; L116-L148 HydrophobicContact CG-CD2 4.18Å; E117-L148 HydrophobicContact CB-CD2 4.04Å; E117-L148 HydrophobicContact CG-CD2 4.41Å; V120-L148 HydrophobicContact CB-CD2 4.44Å; V120-L148 HydrophobicContact CG2-CD2 4.35Å; L144-L148 WeakPolarHBondContact O-CB 3.43Å; L144-L148 PolarHBondContact O-N 3.35Å; L148-K150 VanDerWaalsContact C-N 3.26Å; L148-K150 PolarHBondContact O-N 2.83Å; L148-Y151 PolarHBondContact O-N 2.83Å; L148-Y151 VanDerWaalsContact O-N 3.13Å; L148-M152 HydrophobicContact CD1-CG 4.46Å; L148-M152 HydrophobicContact CD1-SD 4.37Å; L148-M152 HydrophobicContact CD2-SD 4.35Å; L148-M152 HydrophobicContact CG-CG 4.32Å; L148-M152 HydrophobicContact CG-SD 3.88Å; L148-M152 WeakPolarHBondContact O-CB 3.36Å; L148-M152 VanDerWaalsContact O-CG 3.3Å; L148-M152 WeakPolarHBondContact O-CG 3.21Å; L148-M152 PolarHBondContact O-N 3.25Å
149	R	87.8	Confident	85.1	Confident	110 Å²	110	67.4 Å²	67.4	42%	0.415	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-24.7	175.4	-71.5	177.5	-174.9	-146.8	-9.8	114.6	N121 R145 K147 R153	N121-R149 PolarHBondContact OD1-NH2 2.84Å; R145-R149 VanDerWaalsContact NE-NH2 3.15Å; R145-R149 WeakPolarHBondContact O-CB 3.37Å; R145-R149 VanDerWaalsContact O-CG 3.29Å; R145-R149 WeakPolarHBondContact O-CG 3.39Å; R145-R149 PolarHBondContact O-N 3.47Å; R145-R149 VanDerWaalsContact O-N 3.17Å; K147-R149 PolarHBondContact O-N 3.32Å; R149-R153 PolarHBondContact O-NE 3.46Å
150	K	88.4	Confident	84.5	Confident	116 Å²	116	61.9 Å²	61.9	50%	0.504	30%	0.3	S	S	.	.	H	α-helix	trans	-74.8	-45.1	172.1	-80.9	177.9	176.4	-171.8	0	110.3	Q146 K147 L148	Q146-K150 WeakPolarHBondContact O-CG 3.2Å; Q146-K150 PolarHBondContact O-N 3.31Å; K147-K150 WeakPolarHBondContact O-CB 3.38Å; K147-K150 PolarHBondContact O-N 3.45Å; K147-K150 VanDerWaalsContact O-N 3.13Å; L148-K150 VanDerWaalsContact C-N 3.26Å; L148-K150 PolarHBondContact O-N 2.83Å
151	Y	86.4	Confident	83.8	Confident	33 Å²	33	66 Å²	66	13%	0.129	32%	0.32	C	S	.	.	H	α-helix	trans	-71.2	-38.1	-176.8	-161.7	-110.6	0	0	0	113	F84 C88 F91 F109 L113 K147 L148 R153 D154 F155	F84-Y151 HydrophobicContact CZ-CD1 4.09Å; F84-Y151 HydrophobicContact CZ-CG 4.25Å; C88-Y151 HydrophobicContact CB-CE2 4.37Å; F91-Y151 VanDerWaalsContact CD1-OH 3.3Å; F91-Y151 WeakPolarHBondContact CD1-OH 3.35Å; F109-Y151 HydrophobicContact CE1-CE1 4.29Å; F109-Y151 AromaticContact CZ-CE1 4Å; F109-Y151 HydrophobicContact CZ-CE1 4Å; L113-Y151 HydrophobicContact CD1-CD1 4.47Å; L113-Y151 HydrophobicContact CD1-CE1 4.42Å; L113-Y151 HydrophobicContact CD2-CD1 4.29Å; K147-Y151 PolarHBondContact O-N 3.35Å; L148-Y151 PolarHBondContact O-N 2.83Å; L148-Y151 VanDerWaalsContact O-N 3.13Å; Y151-R153 PolarHBondContact O-N 2.99Å; Y151-D154 WeakPolarHBondContact O-CB 3.23Å; Y151-D154 PolarHBondContact O-N 3.15Å; Y151-D154 VanDerWaalsContact O-N 3.12Å; Y151-F155 HydrophobicContact CD1-CD2 4.35Å; Y151-F155 AromaticContact CD1-CE2 3.92Å; Y151-F155 HydrophobicContact CD1-CE2 3.92Å; Y151-F155 HydrophobicContact CE1-CD2 4.25Å; Y151-F155 AromaticContact CE1-CE2 3.45Å; Y151-F155 HydrophobicContact CE1-CE2 3.45Å; Y151-F155 VanDerWaalsContact CE1-CE2 3.45Å; Y151-F155 HydrophobicContact CE1-CZ 4.22Å; Y151-F155 HydrophobicContact CE2-CE2 4.29Å; Y151-F155 AromaticContact CZ-CE2 3.66Å; Y151-F155 WeakPolarHBondContact O-CD2 3.4Å
152	M	82.1	Confident	83	Confident	16 Å²	16	66.9 Å²	66.9	8%	0.079	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-67.2	-22	179.9	-69.8	-178.1	78.5	0	0	113.8	E117 L148 D154 F155 E156 L159	E117-M152 HydrophobicContact CB-CE 3.9Å; E117-M152 HydrophobicContact CB-SD 3.73Å; E117-M152 VanDerWaalsContact CD-CE 3.47Å; E117-M152 VanDerWaalsContact CD-SD 3.59Å; E117-M152 HydrophobicContact CG-CE 4.07Å; E117-M152 HydrophobicContact CG-SD 3.73Å; E117-M152 WeakPolarHBondContact OE2-CE 3.32Å; L148-M152 HydrophobicContact CD1-CG 4.46Å; L148-M152 HydrophobicContact CD1-SD 4.37Å; L148-M152 HydrophobicContact CD2-SD 4.35Å; L148-M152 HydrophobicContact CG-CG 4.32Å; L148-M152 HydrophobicContact CG-SD 3.88Å; L148-M152 WeakPolarHBondContact O-CB 3.36Å; L148-M152 VanDerWaalsContact O-CG 3.3Å; L148-M152 WeakPolarHBondContact O-CG 3.21Å; L148-M152 PolarHBondContact O-N 3.25Å; M152-D154 PolarHBondContact O-N 2.75Å; M152-F155 CarbonylContact O-C 3.47Å; M152-F155 PolarHBondContact O-N 3.12Å; M152-F155 VanDerWaalsContact O-N 3.11Å; M152-E156 PolarHBondContact O-N 3.3Å; M152-E156 VanDerWaalsContact O-N 3.17Å; M152-L159 HydrophobicContact CB-CD1 3.93Å; M152-L159 HydrophobicContact CE-CD1 3.59Å; M152-L159 HydrophobicContact CE-CD2 3.95Å; M152-L159 HydrophobicContact CE-CG 4.41Å; M152-L159 HydrophobicContact CG-CD1 4.12Å
153	R	83.8	Confident	82.2	Confident	152 Å²	152	71.2 Å²	71.2	57%	0.574	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-64	-26.7	173.4	-81.8	-176.5	-80.4	154.8	-11.9	112.6	R149 Y151 F155	R149-R153 PolarHBondContact O-NE 3.46Å; Y151-R153 PolarHBondContact O-N 2.99Å; R153-F155 PolarHBondContact O-N 3.47Å
154	D	80.6	Confident	81.2	Confident	120 Å²	120	78.3 Å²	78.3	64%	0.642	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-74.4	-17.6	177.5	-56.9	-23.7	0	0	0	111.9	Y151 M152	Y151-D154 WeakPolarHBondContact O-CB 3.23Å; Y151-D154 PolarHBondContact O-N 3.15Å; Y151-D154 VanDerWaalsContact O-N 3.12Å; M152-D154 PolarHBondContact O-N 2.75Å
155	F	78.8	Confident	80	Confident	20 Å²	20	84.4 Å²	84.4	9%	0.088	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-119.7	16.8	-177.1	-59	-81.5	0	0	0	112.8	F91 T105 F109 L113 Y151 M152 R153 T157 E158 L159	F91-F155 HydrophobicContact CD1-CZ 4.43Å; F91-F155 HydrophobicContact CE1-CE1 4.08Å; F91-F155 AromaticContact CE1-CZ 3.69Å; F91-F155 HydrophobicContact CE1-CZ 3.69Å; F91-F155 HydrophobicContact CZ-CE1 4.16Å; F91-F155 HydrophobicContact CZ-CZ 4.16Å; T105-F155 HydrophobicContact CG2-CD1 4.45Å; T105-F155 HydrophobicContact CG2-CE1 4.2Å; F109-F155 HydrophobicContact CE1-CZ 4.29Å; L113-F155 HydrophobicContact CD1-CD2 4.35Å; Y151-F155 HydrophobicContact CD1-CD2 4.35Å; Y151-F155 AromaticContact CD1-CE2 3.92Å; Y151-F155 HydrophobicContact CD1-CE2 3.92Å; Y151-F155 HydrophobicContact CE1-CD2 4.25Å; Y151-F155 AromaticContact CE1-CE2 3.45Å; Y151-F155 HydrophobicContact CE1-CE2 3.45Å; Y151-F155 VanDerWaalsContact CE1-CE2 3.45Å; Y151-F155 HydrophobicContact CE1-CZ 4.22Å; Y151-F155 HydrophobicContact CE2-CE2 4.29Å; Y151-F155 AromaticContact CZ-CE2 3.66Å; Y151-F155 WeakPolarHBondContact O-CD2 3.4Å; M152-F155 CarbonylContact O-C 3.47Å; M152-F155 PolarHBondContact O-N 3.12Å; M152-F155 VanDerWaalsContact O-N 3.11Å; R153-F155 PolarHBondContact O-N 3.47Å; F155-T157 VanDerWaalsContact C-N 3.28Å; F155-T157 PolarHBondContact O-N 3.42Å; F155-E158 PolarHBondContact O-N 2.88Å; F155-E158 VanDerWaalsContact O-N 3.13Å; F155-L159 HydrophobicContact CB-CD1 3.76Å; F155-L159 HydrophobicContact CB-CG 4.12Å; F155-L159 WeakPolarHBondContact O-CB 3.34Å; F155-L159 WeakPolarHBondContact O-CD1 3.42Å; F155-L159 WeakPolarHBondContact O-CG 3.42Å; F155-L159 PolarHBondContact O-N 3.46Å
156	E	76.6	Confident	78.5	Confident	126 Å²	126	86 Å²	86	59%	0.589	40%	0.398	S	S	*	.	H	α-helix	trans	-59.5	-38.5	-167.5	-157	165.5	-157.7	0	0	112.2	M152 T160	M152-E156 PolarHBondContact O-N 3.3Å; M152-E156 VanDerWaalsContact O-N 3.17Å; E156-T160 WeakPolarHBondContact O-CG2 3.47Å; E156-T160 PolarHBondContact O-N 2.99Å; E156-T160 PolarHBondContact O-OG1 2.93Å; E156-T160 VanDerWaalsContact O-OG1 3.12Å
157	T	76.4	Confident	76.7	Confident	100 Å²	100	83 Å²	83	61%	0.613	39%	0.386	S	S	*	.	H	α-helix	trans	-65.7	-49.5	174.9	51.6	0	0	0	0	112.3	F155 L159 T160 D161	F155-T157 VanDerWaalsContact C-N 3.28Å; F155-T157 PolarHBondContact O-N 3.42Å; T157-L159 VanDerWaalsContact C-N 3.33Å; T157-L159 PolarHBondContact O-N 3.17Å; T157-T160 WeakPolarHBondContact CA-OG1 3.48Å; T157-T160 PolarHBondContact O-N 3.04Å; T157-T160 PolarHBondContact O-OG1 2.95Å; T157-D161 PolarHBondContact O-N 3.27Å
158	E	75.4	Confident	74.2	Confident	63 Å²	63	83.8 Å²	83.8	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-67	-34.4	-178.8	-61.4	179.1	-176.9	0	0	112.4	T105 L110 F155 D161 Y162	T105-E158 WeakPolarHBondContact CB-OE2 3.4Å; T105-E158 VanDerWaalsContact OG1-CD 3.26Å; T105-E158 PolarHBondContact OG1-OE1 3.47Å; T105-E158 PolarHBondContact OG1-OE2 2.83Å; L110-E158 HydrophobicContact CD1-CB 4.22Å; L110-E158 HydrophobicContact CD2-CB 4.15Å; F155-E158 PolarHBondContact O-N 2.88Å; F155-E158 VanDerWaalsContact O-N 3.13Å; E158-D161 PolarHBondContact O-N 2.84Å; E158-Y162 WeakPolarHBondContact O-CB 3.38Å; E158-Y162 PolarHBondContact O-N 2.85Å
159	L	74.8	Confident	71.7	Confident	8 Å²	8	92.2 Å²	92.2	4%	0.042	45%	0.447	C	S	.	.	H	α-helix	trans	-69.4	-38	174.3	-78.7	159.6	0	0	0	111.6	L110 L113 T114 M152 F155 T157 D161 R163	L110-L159 HydrophobicContact CD2-CD2 4.44Å; L110-L159 HydrophobicContact CD2-CG 4.35Å; L113-L159 HydrophobicContact CB-CD2 4.46Å; T114-L159 HydrophobicContact CG2-CD2 3.46Å; T114-L159 VanDerWaalsContact CG2-CD2 3.46Å; M152-L159 HydrophobicContact CB-CD1 3.93Å; M152-L159 HydrophobicContact CE-CD1 3.59Å; M152-L159 HydrophobicContact CE-CD2 3.95Å; M152-L159 HydrophobicContact CE-CG 4.41Å; M152-L159 HydrophobicContact CG-CD1 4.12Å; F155-L159 HydrophobicContact CB-CD1 3.76Å; F155-L159 HydrophobicContact CB-CG 4.12Å; F155-L159 WeakPolarHBondContact O-CB 3.34Å; F155-L159 WeakPolarHBondContact O-CD1 3.42Å; F155-L159 WeakPolarHBondContact O-CG 3.42Å; F155-L159 PolarHBondContact O-N 3.46Å; T157-L159 VanDerWaalsContact C-N 3.33Å; T157-L159 PolarHBondContact O-N 3.17Å; L159-D161 VanDerWaalsContact C-N 3.35Å; L159-R163 WeakPolarHBondContact O-CB 3.37Å; L159-R163 WeakPolarHBondContact O-CG 3.42Å; L159-R163 PolarHBondContact O-N 3.33Å
160	T	74.1	Confident	69.2	Low	70 Å²	70	89.7 Å²	89.7	43%	0.429	46%	0.455	S	S	.	.	H	α-helix	trans	-67.5	-36.6	173.9	51.1	0	0	0	0	112.3	E156 T157 R163 R164	E156-T160 WeakPolarHBondContact O-CG2 3.47Å; E156-T160 PolarHBondContact O-N 2.99Å; E156-T160 PolarHBondContact O-OG1 2.93Å; E156-T160 VanDerWaalsContact O-OG1 3.12Å; T157-T160 WeakPolarHBondContact CA-OG1 3.48Å; T157-T160 PolarHBondContact O-N 3.04Å; T157-T160 PolarHBondContact O-OG1 2.95Å; T160-R163 PolarHBondContact O-N 3.46Å; T160-R164 WeakPolarHBondContact O-CG 3.48Å; T160-R164 PolarHBondContact O-N 2.89Å; T160-R164 VanDerWaalsContact O-N 3.09Å
161	D	74.4	Confident	66.5	Low	91 Å²	91	93 Å²	93	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-69.3	-41.6	175.6	-66.5	-24.2	0	0	0	111	T157 E158 L159 R163 R164 E165	T157-D161 PolarHBondContact O-N 3.27Å; E158-D161 PolarHBondContact O-N 2.84Å; L159-D161 VanDerWaalsContact C-N 3.35Å; D161-R163 VanDerWaalsContact C-N 3.34Å; D161-R163 PolarHBondContact O-N 2.98Å; D161-R164 PolarHBondContact O-N 3.36Å; D161-R164 VanDerWaalsContact O-N 3.15Å; D161-E165 PolarHBondContact O-N 3.24Å; D161-E165 VanDerWaalsContact O-N 3.08Å
162	Y	71.7	Confident	64	Low	22 Å²	22	95.2 Å²	95.2	9%	0.086	49%	0.492	C	S	.	.	H	α-helix	trans	-64.4	-35.6	174.6	-167.8	-105.2	0	0	0	113	R107 L110 R111 T114 E158 R164 E165 D167	R107-Y162 HydrophobicContact CB-CE2 4.16Å; R107-Y162 HydrophobicContact CG-CD2 4.32Å; R107-Y162 HydrophobicContact CG-CE2 4.17Å; L110-Y162 HydrophobicContact CB-CD1 4.31Å; L110-Y162 HydrophobicContact CB-CD2 4.36Å; L110-Y162 HydrophobicContact CB-CG 4.09Å; R111-Y162 HydrophobicContact CB-CE1 3.95Å; R111-Y162 HydrophobicContact CG-CE1 4.29Å; R111-Y162 PolarHBondContact NE-OH 3.28Å; T114-Y162 HydrophobicContact CG2-CD1 4.36Å; E158-Y162 WeakPolarHBondContact O-CB 3.38Å; E158-Y162 PolarHBondContact O-N 2.85Å; Y162-R164 VanDerWaalsContact C-N 3.33Å; Y162-E165 CarbonylContact O-C 3.58Å; Y162-E165 VanDerWaalsContact O-C 3.25Å; Y162-D167 PolarHBondContact OH-OD2 2.74Å
163	R	72.6	Confident	61.8	Low	131 Å²	131	98.2 Å²	98.2	49%	0.494	51%	0.511	S	S	.	.	H	α-helix	trans	-72	-24.8	174.2	-80.6	-176.2	169.2	154.2	2.5	113.3	E117 D118 L159 T160 D161	E117-R163 IonicContact OE2-CZ 3.46Å; E117-R163 IonicContact OE2-NH1 3.65Å; E117-R163 IonicContact OE2-NH2 3.55Å; E117-R163 PolarHBondContact OE2-NH2 2.81Å; D118-R163 IonicContact OD1-NH2 2.69Å; L159-R163 WeakPolarHBondContact O-CB 3.37Å; L159-R163 WeakPolarHBondContact O-CG 3.42Å; L159-R163 PolarHBondContact O-N 3.33Å; T160-R163 PolarHBondContact O-N 3.46Å; D161-R163 VanDerWaalsContact C-N 3.34Å; D161-R163 PolarHBondContact O-N 2.98Å
164	R	70.9	Confident	59.5	Low	203 Å²	203	98.3 Å²	98.3	77%	0.766	52%	0.518	S	S	*	.	H	α-helix	trans	-77.8	-36	175.3	-81.3	178.5	172.4	165.5	-1.5	112.3	T160 D161 Y162 P166	T160-R164 WeakPolarHBondContact O-CG 3.48Å; T160-R164 PolarHBondContact O-N 2.89Å; T160-R164 VanDerWaalsContact O-N 3.09Å; D161-R164 PolarHBondContact O-N 3.36Å; D161-R164 VanDerWaalsContact O-N 3.15Å; Y162-R164 VanDerWaalsContact C-N 3.33Å; R164-P166 VanDerWaalsContact O-CD 3.32Å; R164-P166 WeakPolarHBondContact O-CD 3.17Å
165	E	65.5	Low	57.5	Low	128 Å²	128	99.2 Å²	99.2	60%	0.598	52%	0.518	S	S	*	.	S	Bend	trans	-117.8	73.8	174.6	-69.7	-179.1	-177.9	0	0	110.8	R107 D161 Y162 D167	R107-E165 IonicContact NH2-OE2 3.92Å; R107-E165 PolarHBondContact NH2-OE2 3.46Å; D161-E165 PolarHBondContact O-N 3.24Å; D161-E165 VanDerWaalsContact O-N 3.08Å; Y162-E165 CarbonylContact O-C 3.58Å; Y162-E165 VanDerWaalsContact O-C 3.25Å; E165-D167 PolarHBondContact O-N 3.03Å
166	P	59.3	Low	55.8	Low	92 Å²	92	103.2 Å²	103.2	60%	0.597	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-62.9	124.1	166.3	26.2	-29.7	0	0	0	107.8	R164 S168	R164-P166 VanDerWaalsContact O-CD 3.32Å; R164-P166 WeakPolarHBondContact O-CD 3.17Å; P166-S168 PolarHBondContact O-N 3.25Å; P166-S168 VanDerWaalsContact O-N 3.13Å
167	D	52	Low	54.2	Low	58 Å²	58	104.2 Å²	104.2	31%	0.31	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-50.3	123.2	176.9	-65.2	-51.8	0	0	0	109.1	R107 R111 Y162 E165	R107-D167 IonicContact CZ-OD1 3.7Å; R107-D167 IonicContact NH1-OD1 2.85Å; R107-D167 PolarHBondContact NH1-OD1 3.46Å; R111-D167 IonicContact NH2-OD2 3.9Å; R111-D167 PolarHBondContact NH2-OD2 3.47Å; Y162-D167 PolarHBondContact OH-OD2 2.74Å; E165-D167 PolarHBondContact O-N 3.03Å
168	S	38.3	Very low	52.8	Low	97 Å²	97	108.2 Å²	108.2	68%	0.678	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-59.3	139	165.1	67.8	0	0	0	0	108.5	P166 G170	P166-S168 PolarHBondContact O-N 3.25Å; P166-S168 VanDerWaalsContact O-N 3.13Å; S168-G170 PolarHBondContact O-N 3.14Å
169	D	36.7	Very low	51.4	Low	181 Å²	181	111.8 Å²	111.8	97%	0.968	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	39.9	-179.3	-73.4	-41.2	0	0	0	115.8
170	G	34.1	Very low	50.1	Low	56 Å²	56	114.8 Å²	114.8	58%	0.577	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	-1.5	-165.9	0	0	0	0	0	118.2	S168	S168-G170 PolarHBondContact O-N 3.14Å
171	H	31.6	Very low	48.7	Very low	186 Å²	186	114.1 Å²	114.1	86%	0.861	58%	0.578	S	S	*	*	S	Bend	trans	-138.8	8.5	-175	-96.9	-57.2	0	0	0	119.2
172	S	35.2	Very low	47.4	Very low	80 Å²	80	112.1 Å²	112.1	56%	0.559	57%	0.571	S	S	*	*	S	Bend	trans	-98.9	90.9	160.4	53.9	0	0	0	0	109.1	E174	S172-E174 PolarHBondContact O-N 2.97Å
173	T	34.9	Very low	46	Very low	79 Å²	79	116.7 Å²	116.7	49%	0.485	59%	0.593	S	S	.	*			trans	20.9	95.9	160.2	21.9	0	0	0	0	115	E175 E176	T173-E175 PolarHBondContact O-N 3.37Å; T173-E176 PolarHBondContact O-N 3.46Å
174	E	35.4	Very low	44.6	Very low	154 Å²	154	113.9 Å²	113.9	72%	0.72	59%	0.594	S	S	*	*	H	α-helix	trans	-51.6	-13	165.7	-67	-173.5	150.3	0	0	113	S172 R178	S172-E174 PolarHBondContact O-N 2.97Å; E174-R178 WeakPolarHBondContact O-CB 3.28Å; E174-R178 VanDerWaalsContact O-CG 3.27Å; E174-R178 WeakPolarHBondContact O-CG 3.14Å; E174-R178 PolarHBondContact O-N 3.17Å
175	E	39.6	Very low	43.3	Very low	138 Å²	138	106.7 Å²	106.7	65%	0.645	58%	0.578	S	S	*	*	H	α-helix	trans	-74	-29.5	171.3	-70.3	-169.7	143.2	0	0	114.7	T173 K179	T173-E175 PolarHBondContact O-N 3.37Å; E175-K179 WeakPolarHBondContact O-CG 3.4Å; E175-K179 PolarHBondContact O-N 3.01Å
176	E	43.2	Very low	42.4	Very low	105 Å²	105	109.2 Å²	109.2	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-78.6	-38.1	-178.9	-73.7	-150.3	165.5	0	0	112.1	R62 T173 K179 L180	R62-E176 IonicContact NH1-OE1 3.94Å; R62-E176 IonicContact NH1-OE2 2.73Å; T173-E176 PolarHBondContact O-N 3.46Å; E176-K179 PolarHBondContact O-N 3.38Å; E176-L180 WeakPolarHBondContact O-CG 3.18Å; E176-L180 PolarHBondContact O-N 3.45Å
177	E	41.4	Very low	41.5	Very low	146 Å²	146	113 Å²	113	68%	0.682	59%	0.592	S	S	*	*	H	α-helix	trans	-71.9	-34.3	176.3	-69	-166.2	156.4	0	0	112.3	L180 A181	E177-L180 PolarHBondContact O-N 3.1Å; E177-A181 WeakPolarHBondContact O-CB 3.42Å; E177-A181 PolarHBondContact O-N 3.37Å
178	R	46.8	Very low	40.9	Very low	184 Å²	184	113.2 Å²	113.2	69%	0.694	60%	0.598	S	S	*	*	H	α-helix	trans	-66	-36.1	174.2	-77.1	-179.4	-177.7	-157.9	4.6	112.7	E174 S182	E174-R178 WeakPolarHBondContact O-CB 3.28Å; E174-R178 VanDerWaalsContact O-CG 3.27Å; E174-R178 WeakPolarHBondContact O-CG 3.14Å; E174-R178 PolarHBondContact O-N 3.17Å; R178-S182 WeakPolarHBondContact O-CB 3.48Å; R178-S182 PolarHBondContact O-N 3.26Å
179	K	47.8	Very low	41.1	Very low	138 Å²	138	110.7 Å²	110.7	60%	0.6	58%	0.58	S	S	*	*	H	α-helix	trans	-67.9	-44.4	176.4	-79.2	179.4	178.9	175.7	0	111.9	E175 E176 S182 E183	E175-K179 WeakPolarHBondContact O-CG 3.4Å; E175-K179 PolarHBondContact O-N 3.01Å; E176-K179 PolarHBondContact O-N 3.38Å; K179-S182 PolarHBondContact O-N 3.28Å; K179-S182 VanDerWaalsContact O-N 3.14Å; K179-S182 PolarHBondContact O-OG 3.12Å; K179-E183 PolarHBondContact O-N 3.23Å
180	L	46.1	Very low	41.3	Very low	71 Å²	71	109 Å²	109	37%	0.372	57%	0.571	S	S	.	*	H	α-helix	trans	-68.8	-35.9	179.2	-70.2	165.8	0	0	0	113.2	K66 E176 E177 S182 S184	K66-L180 HydrophobicContact CD-CD2 4.44Å; K66-L180 VanDerWaalsContact CE-CD2 3.46Å; K66-L180 VanDerWaalsContact NZ-CD2 3.34Å; E176-L180 WeakPolarHBondContact O-CG 3.18Å; E176-L180 PolarHBondContact O-N 3.45Å; E177-L180 PolarHBondContact O-N 3.1Å; L180-S182 VanDerWaalsContact C-N 3.32Å; L180-S184 WeakPolarHBondContact O-CB 3.21Å; L180-S184 PolarHBondContact O-N 3.18Å; L180-S184 VanDerWaalsContact O-N 3.09Å; L180-S184 PolarHBondContact O-OG 2.61Å
181	A	44.6	Very low	41.5	Very low	57 Å²	57	114.7 Å²	114.7	47%	0.471	58%	0.583	S	S	.	*	H	α-helix	trans	-67.4	-35	171.2	0	0	0	0	0	111.5	E177 S184 A185	E177-A181 WeakPolarHBondContact O-CB 3.42Å; E177-A181 PolarHBondContact O-N 3.37Å; A181-S184 PolarHBondContact O-OG 2.61Å; A181-A185 WeakPolarHBondContact O-CB 3.39Å; A181-A185 PolarHBondContact O-N 2.69Å
182	S	47.6	Very low	41.8	Very low	49 Å²	49	113.1 Å²	113.1	34%	0.343	58%	0.576	S	S	.	*	H	α-helix	trans	-72.2	-32.8	177.1	86.3	0	0	0	0	113.5	R178 K179 L180 R186	R178-S182 WeakPolarHBondContact O-CB 3.48Å; R178-S182 PolarHBondContact O-N 3.26Å; K179-S182 PolarHBondContact O-N 3.28Å; K179-S182 VanDerWaalsContact O-N 3.14Å; K179-S182 PolarHBondContact O-OG 3.12Å; L180-S182 VanDerWaalsContact C-N 3.32Å; S182-R186 WeakPolarHBondContact O-CB 3.32Å; S182-R186 WeakPolarHBondContact O-CD 3.41Å; S182-R186 WeakPolarHBondContact O-CG 3.17Å; S182-R186 PolarHBondContact O-N 3.34Å
183	E	42.6	Very low	41.8	Very low	117 Å²	117	119.8 Å²	119.8	55%	0.547	59%	0.589	S	S	.	*	H	α-helix	trans	-77.5	-43	178.5	-75	178	170.2	0	0	111.6	K179 A185 R186 E187	K179-E183 PolarHBondContact O-N 3.23Å; E183-A185 VanDerWaalsContact C-N 3.35Å; E183-A185 PolarHBondContact O-N 3.32Å; E183-R186 PolarHBondContact O-N 3.29Å; E183-R186 VanDerWaalsContact O-N 3.14Å; E183-E187 PolarHBondContact O-N 3.5Å; E183-E187 VanDerWaalsContact O-N 3.17Å
184	S	42.5	Very low	41.7	Very low	72 Å²	72	125.2 Å²	125.2	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-69.3	-30.8	175.8	56.1	0	0	0	0	113.4	L180 A181 R186 S188	L180-S184 WeakPolarHBondContact O-CB 3.21Å; L180-S184 PolarHBondContact O-N 3.18Å; L180-S184 VanDerWaalsContact O-N 3.09Å; L180-S184 PolarHBondContact O-OG 2.61Å; A181-S184 PolarHBondContact O-OG 2.61Å; S184-R186 VanDerWaalsContact C-N 3.31Å; S184-S188 PolarHBondContact O-N 3.43Å; S184-S188 PolarHBondContact O-OG 3.11Å
185	A	44.7	Very low	41.7	Very low	53 Å²	53	125 Å²	125	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-73	-22.7	172.1	0	0	0	0	0	112.8	A181 E183 S189	A181-A185 WeakPolarHBondContact O-CB 3.39Å; A181-A185 PolarHBondContact O-N 2.69Å; E183-A185 VanDerWaalsContact C-N 3.35Å; E183-A185 PolarHBondContact O-N 3.32Å; A185-S189 WeakPolarHBondContact O-CB 3.44Å; A185-S189 PolarHBondContact O-N 3.13Å; A185-S189 PolarHBondContact O-OG 3Å
186	R	46	Very low	41.4	Very low	181 Å²	181	127.5 Å²	127.5	68%	0.683	62%	0.623	S	S	*	*	H	α-helix	trans	-81.9	-36	177.9	-81.8	172.8	177.6	-173.5	-1.2	112.9	S182 E183 S184 S189	S182-R186 WeakPolarHBondContact O-CB 3.32Å; S182-R186 WeakPolarHBondContact O-CD 3.41Å; S182-R186 WeakPolarHBondContact O-CG 3.17Å; S182-R186 PolarHBondContact O-N 3.34Å; E183-R186 PolarHBondContact O-N 3.29Å; E183-R186 VanDerWaalsContact O-N 3.14Å; S184-R186 VanDerWaalsContact C-N 3.31Å; R186-S189 PolarHBondContact O-OG 3.42Å
187	E	41	Very low	40.9	Very low	170 Å²	170	128.2 Å²	128.2	79%	0.794	64%	0.639	S	S	*	*	H	α-helix	trans	-80.8	-21.6	178.5	-70.5	-176.2	165.6	0	0	113.5	E183	E183-E187 PolarHBondContact O-N 3.5Å; E183-E187 VanDerWaalsContact O-N 3.17Å
188	S	38.6	Very low	40.4	Very low	64 Å²	64	133.2 Å²	133.2	45%	0.448	65%	0.652	S	S	.	*	H	α-helix	trans	-91.7	-19.3	175.4	54	0	0	0	0	113.9	S184 D190	S184-S188 PolarHBondContact O-N 3.43Å; S184-S188 PolarHBondContact O-OG 3.11Å; S188-D190 PolarHBondContact O-N 2.87Å
189	S	42.4	Very low	39.7	Very low	44 Å²	44	134 Å²	134	31%	0.308	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-14	-174.6	63.7	0	0	0	0	115.7	A185 R186	A185-S189 WeakPolarHBondContact O-CB 3.44Å; A185-S189 PolarHBondContact O-N 3.13Å; A185-S189 PolarHBondContact O-OG 3Å; R186-S189 PolarHBondContact O-OG 3.42Å
190	D	41.3	Very low	38.8	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-10.8	-174.7	-76.7	-19.6	0	0	0	114.5	S188	S188-D190 PolarHBondContact O-N 2.87Å
191	E	37.6	Very low	38.1	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-10.6	173.1	-69.3	-169.3	162.5	0	0	114.4
192	E	37.8	Very low	37.3	Very low	154 Å²	154	149.5 Å²	149.5	72%	0.72	71%	0.713	S	S	*	*	S	Bend	trans	-105.2	12.6	-176	-69.8	-170.6	157	0	0	115.3
193	R	37.1	Very low	36.3	Very low	219 Å²	219	153 Å²	153	83%	0.826	74%	0.737	S	S	*	*	S	Bend	trans	-110.3	11.2	-179.4	-74.1	-174.9	176.3	179.7	2.7	117.3
194	E	32.9	Very low	36	Very low	194 Å²	194	153.7 Å²	153.7	91%	0.907	75%	0.749	S	S	*	*	S	Bend	trans	-105	4.8	165.7	-80	-158.5	154.3	0	0	115.1
195	I	33.9	Very low	35.3	Very low	149 Å²	149	156.4 Å²	156.4	76%	0.764	76%	0.758	S	S	*	*	S	Bend	trans	-122.3	44.3	-179	-42.5	179.4	0	0	0	111.4
196	E	33.7	Very low	34.7	Very low	191 Å²	191	163.1 Å²	163.1	89%	0.893	77%	0.772	S	S	*	*	S	Bend	trans	-156.1	53.8	171.3	-115.4	170.5	-146.7	0	0	113.2
197	S	32.5	Very low	34	Very low	120 Å²	120	162 Å²	162	84%	0.839	77%	0.774	S	S	*	*	S	Bend	trans	-156.1	44.4	156.4	57.8	0	0	0	0	112.3
198	R	31.6	Very low	33.7	Very low	251 Å²	251	158.9 Å²	158.9	95%	0.947	77%	0.771	S	S	*	*			trans	-156.3	60.7	167.5	-116.6	175.3	-175.5	175.5	1.5	111.5
199	K	30.7	Very low	33.5	Very low	201 Å²	201	161.6 Å²	161.6	87%	0.874	78%	0.781	S	S	*	*			trans	-149.9	87.7	164.9	-95.4	-176.6	-179.3	170	0	109.8
200	V	30.5	Very low	33.2	Very low	134 Å²	134	167.3 Å²	167.3	81%	0.812	80%	0.802	S	S	*	*			trans	-159.4	136.7	134.6	-162.4	0	0	0	0	107.5
201	R	30.3	Very low	32.8	Very low	228 Å²	228	165.3 Å²	165.3	86%	0.86	80%	0.8	S	S	*	*	S	Bend	trans	84.9	114.5	169.2	-51.1	-170.9	173.7	-177.8	-3.7	113.3
202	R	27.9	Very low	32.8	Very low	229 Å²	229	162.4 Å²	162.4	86%	0.864	79%	0.79	S	S	*	*			cis	-155.3	125.7	21.2	-101	159.6	167.3	161	-6.3	108.4
203	S	27.9	Very low	33	Very low	123 Å²	123	163.7 Å²	163.7	86%	0.86	79%	0.788	S	S	*	*			trans	-102.6	103.4	143.5	54.3	0	0	0	0	106.1
204	V	35.5	Very low	32.8	Very low	131 Å²	131	160 Å²	160	79%	0.794	78%	0.78	S	S	*	*			trans	-136.3	124.7	157.5	-174.5	0	0	0	0	106.9
205	N	28.2	Very low	32.8	Very low	128 Å²	128	157.7 Å²	157.7	68%	0.684	77%	0.772	S	S	*	*			trans	-69.7	169.4	-178.8	-164	16	0	0	0	111.9
206	R	31.5	Very low	32.7	Very low	194 Å²	194	156 Å²	156	73%	0.732	77%	0.772	S	S	*	*			trans	82.7	107.5	159.8	-69.5	-179.3	163.4	142.9	-2.8	116.8
207	E	31.6	Very low	32.7	Very low	159 Å²	159	151.6 Å²	151.6	74%	0.743	76%	0.763	S	S	*	*				84	126.6	81	-81.5	171.3	175.8	0	0	111.5
208	S	34.3	Very low	32.8	Very low	104 Å²	104	151.1 Å²	151.1	73%	0.727	76%	0.76	S	S	*	*			trans	59.5	147.4	157.2	-83.8	0	0	0	0	117.2
209	D	34.9	Very low	32.8	Very low	121 Å²	121	143.4 Å²	143.4	65%	0.647	74%	0.744	S	S	*	*			cis	-170.2	160.6	1.8	-111.3	-33.3	0	0	0	106.1
210	E	36.5	Very low	33	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.762	74%	0.742	S	S	*	*			trans	56.7	100.6	140.1	-64.3	-178.7	169.3	0	0	118.8
211	S	33	Very low	33.3	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	74%	0.737	S	S	*	*				77.3	132.1	96.2	68.2	0	0	0	0	114.9
212	D	36.2	Very low	33.7	Very low	115 Å²	115	138.2 Å²	138.2	62%	0.615	74%	0.735	S	S	*	*				140.6	141.5	113	-140.4	3.3	0	0	0	114.5
213	W	43.1	Very low	34	Very low	181 Å²	181	136 Å²	136	69%	0.686	74%	0.739	S	S	*	*			trans	79.1	98.1	168.9	-49.7	99	0	0	0	118.8
214	E	32.1	Very low	34.5	Very low	141 Å²	141	138.2 Å²	138.2	66%	0.659	74%	0.736	S	S	*	*				81	137.6	88.5	-80.5	-162.5	174.2	0	0	112.8
215	M	32.2	Very low	34.6	Very low	146 Å²	146	137 Å²	137	72%	0.719	73%	0.726	S	S	*	*			cis	-173.9	151.9	19.7	-113.6	-83.4	-157.2	0	0	109.2
216	S	33.8	Very low	35.1	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	73%	0.73	S	S	*	*			trans	69.6	141.5	147.2	-122.4	0	0	0	0	119.4
217	S	33.7	Very low	36	Very low	99 Å²	99	133.4 Å²	133.4	69%	0.692	72%	0.723	S	S	*	*			cis	-169.4	127.3	3.1	110	0	0	0	0	104.8
218	S	33.1	Very low	37.2	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	71%	0.71	S	S	*	*				103.5	142.5	85.9	-164.2	0	0	0	0	112.8
219	S	32.8	Very low	38.5	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	71%	0.711	S	S	*	*			trans	72.8	98.1	-177.7	-80.2	0	0	0	0	116.3
220	E	34.4	Very low	39.4	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	71%	0.713	S	S	*	*				73.1	123.5	81.5	-74.2	170.2	159.7	0	0	109.9
221	S	37.5	Very low	40.2	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	70%	0.698	S	S	*	*			cis	-176.4	121.5	10.8	37.1	0	0	0	0	107.3
222	E	38.1	Very low	41.6	Very low	179 Å²	179	129.4 Å²	129.4	84%	0.836	69%	0.686	S	S	*	*				48.4	84.9	129.9	-57.2	-175.4	173.8	0	0	119
223	L	32.9	Very low	42.9	Very low	181 Å²	181	129.7 Å²	129.7	95%	0.948	68%	0.683	S	S	*	*				-171.2	67.3	113.2	-97.8	159.2	0	0	0	106.6
224	E	39.6	Very low	43.9	Very low	171 Å²	171	126 Å²	126	80%	0.799	68%	0.677	S	S	*	*			trans	-77.7	127.2	-177.2	-80.3	-180	162.7	0	0	111.9
225	D	38.2	Very low	45.4	Very low	106 Å²	106	126.2 Å²	126.2	57%	0.567	67%	0.671	S	S	*	*				77.7	64.4	128.1	-60	-22.1	0	0	0	119.7	T227	D225-T227 VanDerWaalsContact C-N 3.33Å; D225-T227 PolarHBondContact OD1-OG1 2.93Å
226	L	38.2	Very low	46.7	Very low	150 Å²	150	127.9 Å²	127.9	79%	0.785	67%	0.67	S	S	*	*			trans	-102.6	54.5	135.3	-79.7	153.3	0	0	0	109.7
227	T	49.2	Very low	47.8	Very low	95 Å²	95	131.4 Å²	131.4	58%	0.583	67%	0.671	S	S	*	*			trans	-88.1	123.7	176.6	45.9	0	0	0	0	110.7	D225 K229	D225-T227 VanDerWaalsContact C-N 3.33Å; D225-T227 PolarHBondContact OD1-OG1 2.93Å; T227-K229 PolarHBondContact O-N 3.31Å
228	G	56.7	Low	48.8	Very low	44 Å²	44	134.7 Å²	134.7	45%	0.454	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	52.2	-85.4	157.6	0	0	0	0	0	116	E232	G228-E232 WeakPolarHBondContact O-CB 3.49Å; G228-E232 PolarHBondContact O-N 2.87Å
229	K	63.4	Low	49.3	Very low	174 Å²	174	135 Å²	135	76%	0.757	67%	0.666	S	S	*	*	H	α-helix	trans	-70.7	-39.2	-158.7	-69.5	176.3	177.3	173.9	0	115.5	T227 E232 E233	T227-K229 PolarHBondContact O-N 3.31Å; K229-E232 CarbonylContact O-C 3.56Å; K229-E232 PolarHBondContact O-N 3.23Å; K229-E233 WeakPolarHBondContact O-CB 3.33Å; K229-E233 VanDerWaalsContact O-CG 3.3Å; K229-E233 WeakPolarHBondContact O-CG 3.4Å; K229-E233 PolarHBondContact O-N 3.31Å
230	K	53.3	Low	49.5	Very low	160 Å²	160	141.1 Å²	141.1	70%	0.696	68%	0.681	S	S	*	*	H	α-helix	trans	-76.6	-35.5	177.8	-87.9	-179.1	179.1	169.8	0	113	E232 E233 L234	K230-E232 VanDerWaalsContact C-N 3.26Å; K230-E233 PolarHBondContact O-N 3.3Å; K230-L234 WeakPolarHBondContact O-CB 3.47Å; K230-L234 PolarHBondContact O-N 3.23Å
231	M	52.8	Low	49.9	Very low	89 Å²	89	136.1 Å²	136.1	44%	0.438	67%	0.665	S	S	.	*	H	α-helix	trans	-69.2	-31.4	172.2	-165.1	173.3	-161	0	0	110.6	R235	M231-R235 WeakPolarHBondContact O-CB 3.45Å; M231-R235 WeakPolarHBondContact O-CG 3.46Å; M231-R235 PolarHBondContact O-N 2.85Å
232	E	62.1	Low	49.8	Very low	100 Å²	100	136.6 Å²	136.6	47%	0.467	67%	0.668	S	S	.	*	H	α-helix	trans	-77.7	-30.9	175.5	-156.3	140.2	-140	0	0	112.4	G228 K229 K230 R236	G228-E232 WeakPolarHBondContact O-CB 3.49Å; G228-E232 PolarHBondContact O-N 2.87Å; K229-E232 CarbonylContact O-C 3.56Å; K229-E232 PolarHBondContact O-N 3.23Å; K230-E232 VanDerWaalsContact C-N 3.26Å; E232-R236 VanDerWaalsContact O-CB 3.22Å; E232-R236 WeakPolarHBondContact O-CB 3.45Å; E232-R236 WeakPolarHBondContact O-CD 3.33Å; E232-R236 WeakPolarHBondContact O-CG 3.18Å; E232-R236 PolarHBondContact O-N 3.18Å
233	E	64.1	Low	50.1	Low	120 Å²	120	131.3 Å²	131.3	56%	0.561	65%	0.648	S	S	*	*	H	α-helix	trans	-69.2	-41.3	167.3	-79.1	173.6	177.4	0	0	112	K229 K230 R236 F237	K229-E233 WeakPolarHBondContact O-CB 3.33Å; K229-E233 VanDerWaalsContact O-CG 3.3Å; K229-E233 WeakPolarHBondContact O-CG 3.4Å; K229-E233 PolarHBondContact O-N 3.31Å; K230-E233 PolarHBondContact O-N 3.3Å; E233-R236 PolarHBondContact O-N 2.95Å; E233-F237 PolarHBondContact O-N 3.44Å
234	L	64.5	Low	51	Low	105 Å²	105	131.1 Å²	131.1	55%	0.55	64%	0.64	S	S	.	*	H	α-helix	trans	-66.3	-38.7	171.5	-89.1	153.8	0	0	0	112	K230 F237 F238	K230-L234 WeakPolarHBondContact O-CB 3.47Å; K230-L234 PolarHBondContact O-N 3.23Å; L234-F237 PolarHBondContact O-N 3.37Å; L234-F238 HydrophobicContact CD2-CD2 4.29Å; L234-F238 HydrophobicContact CD2-CE2 4.12Å; L234-F238 WeakPolarHBondContact O-CD2 3.44Å; L234-F238 PolarHBondContact O-N 2.86Å
235	R	62.3	Low	51.8	Low	144 Å²	144	130.2 Å²	130.2	54%	0.543	64%	0.636	S	S	.	*	H	α-helix	trans	-67.5	-36.7	172.8	-79.1	173.1	175.1	-177.8	0	111.7	M231 F237 F238 L239	M231-R235 WeakPolarHBondContact O-CB 3.45Å; M231-R235 WeakPolarHBondContact O-CG 3.46Å; M231-R235 PolarHBondContact O-N 2.85Å; R235-F237 VanDerWaalsContact C-N 3.29Å; R235-F237 PolarHBondContact O-N 2.84Å; R235-F238 PolarHBondContact O-N 3.15Å; R235-L239 WeakPolarHBondContact O-CA 3.39Å; R235-L239 WeakPolarHBondContact O-CB 3.25Å; R235-L239 PolarHBondContact O-N 3.23Å
236	R	59.9	Low	52.6	Low	182 Å²	182	129.4 Å²	129.4	69%	0.687	63%	0.632	S	S	*	*	H	α-helix	trans	-66.9	-28.1	173.9	-79.3	169.6	-178.5	-166.6	-0.3	112.9	E232 E233	E232-R236 VanDerWaalsContact O-CB 3.22Å; E232-R236 WeakPolarHBondContact O-CB 3.45Å; E232-R236 WeakPolarHBondContact O-CD 3.33Å; E232-R236 WeakPolarHBondContact O-CG 3.18Å; E232-R236 PolarHBondContact O-N 3.18Å; E233-R236 PolarHBondContact O-N 2.95Å
237	F	57	Low	53.9	Low	186 Å²	186	127.6 Å²	127.6	82%	0.816	62%	0.623	S	S	*	*	H	α-helix	trans	-82.6	-32.5	175.8	-113.6	-86.5	0	0	0	113.7	E233 L234 R235	E233-F237 PolarHBondContact O-N 3.44Å; L234-F237 PolarHBondContact O-N 3.37Å; R235-F237 VanDerWaalsContact C-N 3.29Å; R235-F237 PolarHBondContact O-N 2.84Å
238	F	54.4	Low	55	Low	168 Å²	168	128 Å²	128	74%	0.737	62%	0.621	S	S	*	*	H	α-helix	trans	-105.2	-19.8	-174.3	-79.3	-85	0	0	0	115.5	L234 R235	L234-F238 HydrophobicContact CD2-CD2 4.29Å; L234-F238 HydrophobicContact CD2-CE2 4.12Å; L234-F238 WeakPolarHBondContact O-CD2 3.44Å; L234-F238 PolarHBondContact O-N 2.86Å; R235-F238 PolarHBondContact O-N 3.15Å
239	L	43.3	Very low	55.9	Low	117 Å²	117	134.7 Å²	134.7	61%	0.613	63%	0.633	S	S	*	*	S	Bend	trans	-113.3	117.3	169.3	-86.2	111.9	0	0	0	109.3	R235 S241	R235-L239 WeakPolarHBondContact O-CA 3.39Å; R235-L239 WeakPolarHBondContact O-CB 3.25Å; R235-L239 PolarHBondContact O-N 3.23Å; L239-S241 PolarHBondContact O-N 3.32Å
240	K	38.5	Very low	56.3	Low	218 Å²	218	128.8 Å²	128.8	95%	0.948	62%	0.616	S	S	*	*			trans	-59.1	80.5	156.5	-95.1	175.1	171.1	174.3	0	107.9	S242	K240-S242 PolarHBondContact O-N 2.84Å
241	S	41.7	Very low	57.4	Low	69 Å²	69	128 Å²	128	48%	0.483	61%	0.613	S	S	.	*			trans	-74.9	109	165.7	60.1	0	0	0	0	106.9	L239 T243	L239-S241 PolarHBondContact O-N 3.32Å; S241-T243 PolarHBondContact O-N 3.45Å
242	S	35.9	Very low	58.6	Low	110 Å²	110	131.5 Å²	131.5	77%	0.769	63%	0.626	S	S	*	*			trans	-61.1	84.2	168.4	55.7	0	0	0	0	109.5	K240	K240-S242 PolarHBondContact O-N 2.84Å
243	T	44.5	Very low	59.2	Low	68 Å²	68	134.7 Å²	134.7	42%	0.417	64%	0.638	S	S	.	*			trans	-78.5	133.5	164.9	37.5	0	0	0	0	108	S241 E245 D246	S241-T243 PolarHBondContact O-N 3.45Å; T243-E245 PolarHBondContact O-N 2.86Å; T243-D246 PolarHBondContact O-N 3.45Å
244	K	51.5	Low	59.5	Low	178 Å²	178	135.8 Å²	135.8	77%	0.774	65%	0.645	S	S	*	*	H	α-helix	trans	-42.4	-27.9	175.8	-110.4	173.6	173.6	173.4	0	114.3	D246 D247 D248	K244-D246 VanDerWaalsContact C-N 3.33Å; K244-D246 PolarHBondContact O-N 3.22Å; K244-D247 PolarHBondContact O-N 2.83Å; K244-D248 PolarHBondContact O-N 3.23Å
245	E	55.5	Low	60.1	Low	151 Å²	151	135.5 Å²	135.5	71%	0.706	64%	0.644	S	S	*	*	H	α-helix	trans	-66.5	-28.4	177	-61.9	-171.1	159.8	0	0	114.1	T243 R249	T243-E245 PolarHBondContact O-N 2.86Å; E245-R249 WeakPolarHBondContact O-CB 3.46Å; E245-R249 PolarHBondContact O-N 3.16Å
246	D	56.5	Low	60.8	Low	90 Å²	90	137.5 Å²	137.5	48%	0.481	65%	0.651	S	S	.	*	H	α-helix	trans	-78.8	-36	176.2	-78.4	-30.7	0	0	0	111.9	T243 K244 R249 A250	T243-D246 PolarHBondContact O-N 3.45Å; K244-D246 VanDerWaalsContact C-N 3.33Å; K244-D246 PolarHBondContact O-N 3.22Å; D246-R249 PolarHBondContact O-N 2.83Å; D246-A250 WeakPolarHBondContact O-CB 3.41Å; D246-A250 PolarHBondContact O-N 3.25Å
247	D	64.4	Low	61.5	Low	112 Å²	112	135.4 Å²	135.4	60%	0.599	65%	0.647	S	S	*	*	H	α-helix	trans	-64.2	-42.1	169.6	-85.5	-17.1	0	0	0	110.6	K244 R249 A250 K251	K244-D247 PolarHBondContact O-N 2.83Å; D247-R249 VanDerWaalsContact C-N 3.34Å; D247-R249 PolarHBondContact O-N 3.31Å; D247-A250 PolarHBondContact O-N 3.46Å; D247-K251 VanDerWaalsContact O-CB 3.32Å; D247-K251 WeakPolarHBondContact O-CB 3.34Å; D247-K251 PolarHBondContact O-N 2.92Å
248	D	73.4	Confident	62.3	Low	102 Å²	102	133 Å²	133	55%	0.545	64%	0.637	S	S	.	*	H	α-helix	trans	-66.3	-34.9	175.2	-75.7	-25.7	0	0	0	112.1	K244 K252	K244-D248 PolarHBondContact O-N 3.23Å; D248-K252 WeakPolarHBondContact O-CB 3.34Å; D248-K252 PolarHBondContact O-N 2.65Å
249	R	74.1	Confident	63	Low	186 Å²	186	133.8 Å²	133.8	70%	0.702	63%	0.634	S	S	*	*	H	α-helix	trans	-69.4	-39.3	172.3	-98.1	-178.7	171.3	-171.3	-0.4	112.6	E245 D246 D247 K252 K253	E245-R249 WeakPolarHBondContact O-CB 3.46Å; E245-R249 PolarHBondContact O-N 3.16Å; D246-R249 PolarHBondContact O-N 2.83Å; D247-R249 VanDerWaalsContact C-N 3.34Å; D247-R249 PolarHBondContact O-N 3.31Å; R249-K252 PolarHBondContact O-N 2.8Å; R249-K253 WeakPolarHBondContact O-CB 3.3Å; R249-K253 PolarHBondContact O-N 2.82Å
250	A	72	Confident	64.2	Low	50 Å²	50	136.5 Å²	136.5	41%	0.413	64%	0.637	S	S	.	*	H	α-helix	trans	-65.1	-43.4	175.1	0	0	0	0	0	110.4	D246 D247 K253 M254	D246-A250 WeakPolarHBondContact O-CB 3.41Å; D246-A250 PolarHBondContact O-N 3.25Å; D247-A250 PolarHBondContact O-N 3.46Å; A250-K253 PolarHBondContact O-N 2.83Å; A250-M254 WeakPolarHBondContact O-CB 3.47Å; A250-M254 PolarHBondContact O-N 3.29Å
251	K	76.6	Confident	65.3	Low	144 Å²	144	131.4 Å²	131.4	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-63	-44.1	174.2	-139.3	172.2	-172.4	176.5	0	111.8	D247 K253 M254 D255	D247-K251 VanDerWaalsContact O-CB 3.32Å; D247-K251 WeakPolarHBondContact O-CB 3.34Å; D247-K251 PolarHBondContact O-N 2.92Å; K251-K253 PolarHBondContact O-N 2.75Å; K251-M254 PolarHBondContact O-N 3.47Å; K251-D255 WeakPolarHBondContact O-CB 3.32Å; K251-D255 PolarHBondContact O-N 3.01Å
252	K	77.8	Confident	66.3	Low	162 Å²	162	133.5 Å²	133.5	70%	0.704	62%	0.622	S	S	*	*	H	α-helix	trans	-62.9	-37.1	172.8	-112.8	174.1	177.9	168.4	0	112.8	D248 R249 R256	D248-K252 WeakPolarHBondContact O-CB 3.34Å; D248-K252 PolarHBondContact O-N 2.65Å; R249-K252 PolarHBondContact O-N 2.8Å; K252-R256 WeakPolarHBondContact O-CB 3.1Å; K252-R256 PolarHBondContact O-N 3.44Å
253	K	75.7	Confident	67.3	Low	166 Å²	166	136.5 Å²	136.5	72%	0.722	62%	0.621	S	S	*	*	H	α-helix	trans	-67.3	-42	174.3	-97.9	-175	172.4	-176.8	0	110.9	R249 A250 K251 R256 K257	R249-K253 WeakPolarHBondContact O-CB 3.3Å; R249-K253 PolarHBondContact O-N 2.82Å; A250-K253 PolarHBondContact O-N 2.83Å; K251-K253 PolarHBondContact O-N 2.75Å; K253-R256 PolarHBondContact O-N 3.08Å; K253-K257 PolarHBondContact O-N 2.63Å
254	M	70.4	Confident	67.5	Low	143 Å²	143	140.9 Å²	140.9	70%	0.704	64%	0.637	S	S	*	*	H	α-helix	trans	-65.3	-45.6	177	-135.2	-166.5	-81	0	0	111.2	A250 K251 R256 K257 K258	A250-M254 WeakPolarHBondContact O-CB 3.47Å; A250-M254 PolarHBondContact O-N 3.29Å; K251-M254 PolarHBondContact O-N 3.47Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 2.89Å; M254-K257 PolarHBondContact O-N 3.45Å; M254-K258 WeakPolarHBondContact O-CB 3.39Å; M254-K258 PolarHBondContact O-N 2.79Å
255	D	76.1	Confident	67.1	Low	99 Å²	99	142.3 Å²	142.3	53%	0.529	64%	0.638	S	S	.	*	H	α-helix	trans	-62.7	-34.5	173.6	-87.2	-12.1	0	0	0	112.4	K251 R259	K251-D255 WeakPolarHBondContact O-CB 3.32Å; K251-D255 PolarHBondContact O-N 3.01Å; D255-R259 VanDerWaalsContact O-CB 3.25Å; D255-R259 WeakPolarHBondContact O-CB 3.39Å; D255-R259 WeakPolarHBondContact O-CG 3.48Å; D255-R259 PolarHBondContact O-N 3.34Å
256	R	77.1	Confident	66.4	Low	186 Å²	186	141 Å²	141	70%	0.702	64%	0.642	S	S	*	*	H	α-helix	trans	-74.6	-30.9	176.4	-161.4	176.6	-175.1	-171.8	1.1	112.3	K252 K253 M254 R260	K252-R256 WeakPolarHBondContact O-CB 3.1Å; K252-R256 PolarHBondContact O-N 3.44Å; K253-R256 PolarHBondContact O-N 3.08Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 2.89Å; R256-R260 PolarHBondContact O-N 3.45Å; R256-R260 VanDerWaalsContact O-N 3.13Å
257	K	74.5	Confident	65.6	Low	138 Å²	138	141.4 Å²	141.4	60%	0.6	66%	0.658	S	S	*	*	H	α-helix	trans	-70.3	-46.6	171.4	-168.3	178.3	177.5	-175	0	110.2	K253 M254 R259 R260 E261	K253-K257 PolarHBondContact O-N 2.63Å; M254-K257 PolarHBondContact O-N 3.45Å; K257-R259 PolarHBondContact O-N 3.02Å; K257-R260 WeakPolarHBondContact O-CA 3.45Å; K257-R260 WeakPolarHBondContact O-CB 3.17Å; K257-R260 PolarHBondContact O-N 3.32Å; K257-E261 WeakPolarHBondContact CE-OE1 3.21Å; K257-E261 PolarHBondContact O-N 2.83Å
258	K	73.3	Confident	63.9	Low	137 Å²	137	145.7 Å²	145.7	60%	0.596	67%	0.674	S	S	*	*	H	α-helix	trans	-60.7	-43.1	175	-143.8	174.5	-173.6	179.4	0	112.4	M254 R260 E261 D262	M254-K258 WeakPolarHBondContact O-CB 3.39Å; M254-K258 PolarHBondContact O-N 2.79Å; K258-R260 VanDerWaalsContact C-N 3.28Å; K258-R260 PolarHBondContact O-N 2.86Å; K258-E261 PolarHBondContact O-N 2.94Å; K258-D262 WeakPolarHBondContact O-CB 3.22Å; K258-D262 PolarHBondContact O-N 3.07Å
259	R	71	Confident	62.1	Low	183 Å²	183	144.1 Å²	144.1	69%	0.691	68%	0.682	S	S	*	*	H	α-helix	trans	-67	-21.8	172.2	-80.6	-177.9	127.6	-150	0.3	114.6	D255 K257 K263	D255-R259 VanDerWaalsContact O-CB 3.25Å; D255-R259 WeakPolarHBondContact O-CB 3.39Å; D255-R259 WeakPolarHBondContact O-CG 3.48Å; D255-R259 PolarHBondContact O-N 3.34Å; K257-R259 PolarHBondContact O-N 3.02Å; R259-K263 WeakPolarHBondContact O-CB 3.48Å; R259-K263 WeakPolarHBondContact O-CG 3.4Å; R259-K263 PolarHBondContact O-N 3.44Å
260	R	68.2	Low	60.3	Low	174 Å²	174	143.9 Å²	143.9	66%	0.657	69%	0.686	S	S	*	*	H	α-helix	trans	-79.2	-44	172.5	-92	-177.4	164.4	-175.2	-6.1	110.3	R256 K257 K258 D262 K263 E264	R256-R260 PolarHBondContact O-N 3.45Å; R256-R260 VanDerWaalsContact O-N 3.13Å; K257-R260 WeakPolarHBondContact O-CA 3.45Å; K257-R260 WeakPolarHBondContact O-CB 3.17Å; K257-R260 PolarHBondContact O-N 3.32Å; K258-R260 VanDerWaalsContact C-N 3.28Å; K258-R260 PolarHBondContact O-N 2.86Å; R260-D262 VanDerWaalsContact C-N 3.3Å; R260-D262 PolarHBondContact O-N 2.84Å; R260-K263 PolarHBondContact O-N 3.05Å; R260-K263 VanDerWaalsContact O-N 3.11Å; R260-E264 PolarHBondContact O-N 2.91Å; R260-E264 VanDerWaalsContact O-N 3.1Å
261	E	60.7	Low	58.5	Low	111 Å²	111	150.9 Å²	150.9	52%	0.519	70%	0.702	S	S	.	*	H	α-helix	trans	-62.3	-35.8	173.9	-71.4	168	-172.7	0	0	111.8	K257 K258	K257-E261 WeakPolarHBondContact CE-OE1 3.21Å; K257-E261 PolarHBondContact O-N 2.83Å; K258-E261 PolarHBondContact O-N 2.94Å
262	D	63.8	Low	56.5	Low	113 Å²	113	151 Å²	151	60%	0.604	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-23.4	173.8	-73.3	-25.6	0	0	0	113.8	K258 R260	K258-D262 WeakPolarHBondContact O-CB 3.22Å; K258-D262 PolarHBondContact O-N 3.07Å; R260-D262 VanDerWaalsContact C-N 3.3Å; R260-D262 PolarHBondContact O-N 2.84Å
263	K	56.9	Low	54.6	Low	174 Å²	174	150.9 Å²	150.9	76%	0.757	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-16.1	178.4	-92.3	-176.1	171.7	-172.8	0	114.1	R259 R260 R265	R259-K263 WeakPolarHBondContact O-CB 3.48Å; R259-K263 WeakPolarHBondContact O-CG 3.4Å; R259-K263 PolarHBondContact O-N 3.44Å; R260-K263 PolarHBondContact O-N 3.05Å; R260-K263 VanDerWaalsContact O-N 3.11Å; K263-R265 PolarHBondContact O-N 2.98Å
264	E	48.6	Very low	52.8	Low	160 Å²	160	146.8 Å²	146.8	75%	0.748	71%	0.709	S	S	*	*	S	Bend	trans	-85.1	10.2	175.4	-75.2	-177.1	179.2	0	0	113.3	R260 P266	R260-E264 PolarHBondContact O-N 2.91Å; R260-E264 VanDerWaalsContact O-N 3.1Å; E264-P266 VanDerWaalsContact O-CD 3.31Å; E264-P266 WeakPolarHBondContact O-CD 3.44Å
265	R	43.1	Very low	51.1	Low	208 Å²	208	148.1 Å²	148.1	79%	0.785	72%	0.719	S	S	*	*	S	Bend	trans	-95.7	99.5	161.9	-68.1	-176.2	174.8	-156.6	-1.6	109.4	K263 A267	K263-R265 PolarHBondContact O-N 2.98Å; R265-A267 PolarHBondContact O-N 3.48Å
266	P	40.4	Very low	49.4	Very low	122 Å²	122	146 Å²	146	79%	0.792	72%	0.721	S	S	*	*			trans	-80.4	111.3	176.4	-0.8	21.2	0	0	0	109.2	E264	E264-P266 VanDerWaalsContact O-CD 3.31Å; E264-P266 WeakPolarHBondContact O-CD 3.44Å
267	A	38.9	Very low	47.2	Very low	99 Å²	99	147 Å²	147	82%	0.818	73%	0.733	S	S	*	*			trans	20	104.9	146.3	0	0	0	0	0	118.6	R265	R265-A267 PolarHBondContact O-N 3.48Å
268	E	30.3	Very low	45.7	Very low	203 Å²	203	152.4 Å²	152.4	95%	0.949	75%	0.75	S	S	*	*			trans	-73.4	134	146.1	-71.9	179.4	155.6	0	0	109.6
269	G	34.1	Very low	44.4	Very low	69 Å²	69	154.6 Å²	154.6	71%	0.711	76%	0.762	S	S	*	*			trans	147.3	89.5	161.7	0	0	0	0	0	116.2
270	K	36	Very low	43.1	Very low	180 Å²	180	154.9 Å²	154.9	78%	0.783	77%	0.772	S	S	*	*			trans	176.9	110	130.6	-97.3	169.5	-176.2	179.5	0	113.8
271	R	35.3	Very low	42.2	Very low	197 Å²	197	153.1 Å²	153.1	74%	0.743	78%	0.78	S	S	*	*			trans	77.4	137.5	132.6	-61.6	178.1	179.8	-172.8	-4.9	117.5
272	E	33.9	Very low	41.1	Very low	147 Å²	147	153.6 Å²	153.6	69%	0.687	79%	0.791	S	S	*	*			cis	-167.1	160.7	0.2	-110.6	156.7	-162.5	0	0	105.8
273	D	37.7	Very low	39.6	Very low	160 Å²	160	157 Å²	157	86%	0.856	81%	0.805	S	S	*	*			trans	80	130.7	168.8	-45.4	-28.7	0	0	0	118.1
274	A	37.8	Very low	38.4	Very low	80 Å²	80	152.6 Å²	152.6	66%	0.661	81%	0.809	S	S	*	*			cis	-166.8	146.9	-11	0	0	0	0	0	107.6
275	D	36.5	Very low	37.8	Very low	170 Å²	170	149.1 Å²	149.1	91%	0.909	81%	0.807	S	S	*	*			trans	75.3	100.6	153.4	-53.6	-25.7	0	0	0	121.8
276	G	39.5	Very low	37.5	Very low	55 Å²	55	146.7 Å²	146.7	57%	0.567	81%	0.81	S	S	*	*			trans	164.7	95.3	159.3	0	0	0	0	0	111	W278	G276-W278 PolarHBondContact O-N 3.21Å; G276-W278 VanDerWaalsContact O-N 3.1Å
277	E	31.1	Very low	37.3	Very low	208 Å²	208	145.8 Å²	145.8	97%	0.972	81%	0.812	S	S	*	*			trans	-51	108	-177.7	-73.2	175.5	135.6	0	0	113.4
278	W	42.2	Very low	37.2	Very low	251 Å²	251	146.2 Å²	146.2	95%	0.951	81%	0.805	S	S	*	*			trans	-95.4	118.2	171.6	-72.1	93	0	0	0	111	G276	G276-W278 PolarHBondContact O-N 3.21Å; G276-W278 VanDerWaalsContact O-N 3.1Å
279	Q	46.9	Very low	37.9	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	80%	0.803	S	S	*	*			trans	-67.1	137.8	168.5	-76.8	178.2	-16.4	0	0	111.3	V281	Q279-V281 PolarHBondContact O-N 3.24Å
280	Q	44	Very low	38.3	Very low	190 Å²	190	149 Å²	149	89%	0.888	80%	0.799	S	S	*	*			trans	-69.8	104.2	-178.3	-172.1	175.4	13.2	0	0	111.5	T282	Q280-T282 PolarHBondContact O-N 2.82Å
281	V	47.9	Very low	39.1	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	78%	0.78	S	S	*	*			trans	-76.1	106.4	171.2	-174.9	0	0	0	0	108.6	Q279 M283	Q279-V281 PolarHBondContact O-N 3.24Å; V281-M283 PolarHBondContact O-N 3.2Å
282	T	39.4	Very low	40.1	Very low	122 Å²	122	136 Å²	136	75%	0.748	76%	0.762	S	S	*	*			trans	-48.5	124.3	168.8	38.6	0	0	0	0	111	Q280 G284	Q280-T282 PolarHBondContact O-N 2.82Å; T282-G284 PolarHBondContact O-N 2.87Å; T282-G284 VanDerWaalsContact O-N 3.15Å
283	M	30.7	Very low	41.1	Very low	184 Å²	184	135 Å²	135	91%	0.906	76%	0.756	S	S	*	*			trans	9.7	92.6	156.5	-69.4	-76.4	-77.1	0	0	113.8	V281 A285	V281-M283 PolarHBondContact O-N 3.2Å; M283-A285 VanDerWaalsContact C-N 3.3Å; M283-A285 PolarHBondContact O-N 2.9Å
284	G	32.9	Very low	42	Very low	82 Å²	82	129 Å²	129	85%	0.845	72%	0.723	S	S	*	*			trans	-59	99.3	164.7	0	0	0	0	0	108	T282	T282-G284 PolarHBondContact O-N 2.87Å; T282-G284 VanDerWaalsContact O-N 3.15Å
285	A	34.7	Very low	43.1	Very low	86 Å²	86	127 Å²	127	71%	0.711	70%	0.699	S	S	*	*			trans	-45.7	148.1	173.5	0	0	0	0	0	109.7	M283 A287	M283-A285 VanDerWaalsContact C-N 3.3Å; M283-A285 PolarHBondContact O-N 2.9Å; A285-A287 PolarHBondContact O-N 2.79Å; A285-A287 VanDerWaalsContact O-N 3.16Å
286	L	37	Very low	44.3	Very low	158 Å²	158	126.7 Å²	126.7	83%	0.827	69%	0.693	S	S	*	*			trans	-31	126.1	169.2	-78.1	89.2	0	0	0	109.1	T288	L286-T288 PolarHBondContact O-N 3.05Å
287	A	37	Very low	45.1	Very low	102 Å²	102	133 Å²	133	84%	0.843	70%	0.704	S	S	*	*			trans	-55.7	92.3	164.8	0	0	0	0	0	106.6	A285 E289	A285-A287 PolarHBondContact O-N 2.79Å; A285-A287 VanDerWaalsContact O-N 3.16Å; A287-E289 PolarHBondContact O-N 2.77Å
288	T	37.2	Very low	46.2	Very low	109 Å²	109	130.6 Å²	130.6	67%	0.669	70%	0.698	S	S	*	*			trans	-51.2	122.8	170.8	41.7	0	0	0	0	105.3	L286 E290	L286-T288 PolarHBondContact O-N 3.05Å; T288-E290 VanDerWaalsContact C-N 3.27Å; T288-E290 PolarHBondContact O-N 3.46Å
289	E	43.9	Very low	47.1	Very low	195 Å²	195	120.7 Å²	120.7	91%	0.911	67%	0.67	S	S	*	*			trans	-49.7	100.8	167.1	-66.7	179.1	159.7	0	0	106.7	A287 A291	A287-E289 PolarHBondContact O-N 2.77Å; E289-A291 PolarHBondContact O-N 2.84Å; E289-A291 VanDerWaalsContact O-N 3.08Å
290	E	42.8	Very low	47.6	Very low	136 Å²	136	120.2 Å²	120.2	64%	0.636	67%	0.668	S	S	*	*			trans	-66.1	116.6	-177.4	-72.5	-168.4	131	0	0	106.2	T288 K293	T288-E290 VanDerWaalsContact C-N 3.27Å; T288-E290 PolarHBondContact O-N 3.46Å; E290-K293 IonicContact OE1-NZ 3.88Å; E290-K293 PolarHBondContact OE1-NZ 3.2Å; E290-K293 IonicContact OE2-NZ 2.6Å; E290-K293 PolarHBondContact OE2-NZ 2.75Å
291	A	54	Low	48.6	Very low	46 Å²	46	112.2 Å²	112.2	38%	0.38	63%	0.631	S	S	.	*			trans	-45.2	144.6	175.6	0	0	0	0	0	110.8	E289 K293 E333	E289-A291 PolarHBondContact O-N 2.84Å; E289-A291 VanDerWaalsContact O-N 3.08Å; A291-K293 PolarHBondContact O-N 3.06Å; A291-E333 HydrophobicContact CB-CG 4.38Å
292	P	55.1	Low	49.6	Very low	57 Å²	57	109.1 Å²	109.1	37%	0.37	61%	0.612	S	S	.	*			trans	-53.4	111.8	-177	19.9	-31.3	0	0	0	110.6	M294	P292-M294 PolarHBondContact O-N 3.27Å; P292-M294 VanDerWaalsContact O-N 3.07Å
293	K	55.8	Low	51	Low	127 Å²	127	104.5 Å²	104.5	55%	0.552	59%	0.586	S	S	*	*			trans	-72.1	101.4	180	-72	172	177.5	161.4	0	108.8	E290 A291	E290-K293 IonicContact OE1-NZ 3.88Å; E290-K293 PolarHBondContact OE1-NZ 3.2Å; E290-K293 IonicContact OE2-NZ 2.6Å; E290-K293 PolarHBondContact OE2-NZ 2.75Å; A291-K293 PolarHBondContact O-N 3.06Å
294	M	56.5	Low	53.2	Low	33 Å²	33	101.2 Å²	101.2	16%	0.163	57%	0.569	C	S	.	*			trans	-74.5	-22.6	-174.3	-71.2	-68.7	-76.4	0	0	114.7	P292 I313 M330 L334	P292-M294 PolarHBondContact O-N 3.27Å; P292-M294 VanDerWaalsContact O-N 3.07Å; M294-I313 HydrophobicContact CE-CD1 3.64Å; M294-I313 HydrophobicContact CE-CG1 4.29Å; M294-M330 HydrophobicContact CE-CB 4.13Å; M294-M330 HydrophobicContact CE-CE 3.62Å; M294-M330 HydrophobicContact CE-CG 4.45Å; M294-M330 HydrophobicContact SD-CB 4.13Å; M294-M330 HydrophobicContact SD-CE 3.44Å; M294-M330 WeakPolarHBondContact SD-CE 3.29Å; M294-M330 HydrophobicContact SD-CG 3.92Å; M294-L334 HydrophobicContact CE-CD1 4.47Å; M294-L334 HydrophobicContact CE-CD2 4.25Å; M294-L334 HydrophobicContact CE-CG 4.18Å
295	F	59.4	Low	55.3	Low	37 Å²	37	98.8 Å²	98.8	16%	0.162	54%	0.541	C	S	.	.	S	Bend	trans	-123.1	140.3	177.3	-65.7	-84.8	0	0	0	108.9	A299 I301 V306 K309 L334 I337	F295-A299 HydrophobicContact CB-CB 4.48Å; F295-A299 HydrophobicContact CD1-CB 4.38Å; F295-I301 HydrophobicContact CB-CD1 4.23Å; F295-I301 HydrophobicContact CD1-CB 4.26Å; F295-I301 HydrophobicContact CD1-CD1 4.36Å; F295-I301 HydrophobicContact CD1-CG1 4.05Å; F295-I301 HydrophobicContact CD2-CD1 3.74Å; F295-I301 HydrophobicContact CD2-CG1 4.31Å; F295-I301 HydrophobicContact CE1-CB 4.07Å; F295-I301 HydrophobicContact CE1-CG1 4.36Å; F295-I301 HydrophobicContact CE2-CD1 4.16Å; F295-I301 HydrophobicContact CG-CD1 3.85Å; F295-I301 HydrophobicContact CG-CG1 4.03Å; F295-I301 HydrophobicContact CZ-CB 4.21Å; F295-I301 HydrophobicContact CZ-CG2 4.46Å; F295-V306 HydrophobicContact CZ-CG2 4.08Å; F295-K309 HydrophobicContact CE1-CG 3.95Å; F295-K309 HydrophobicContact CZ-CB 4.48Å; F295-K309 HydrophobicContact CZ-CG 3.91Å; F295-L334 HydrophobicContact CE2-CD2 3.83Å; F295-L334 HydrophobicContact CZ-CD2 4.21Å; F295-I337 HydrophobicContact CD2-CD1 3.86Å; F295-I337 HydrophobicContact CE2-CD1 3.93Å; F295-I337 HydrophobicContact CE2-CG2 4.2Å
296	E	62.1	Low	57.4	Low	165 Å²	165	94.7 Å²	94.7	77%	0.771	51%	0.507	S	S	*	.			trans	-60.7	146.3	164.5	-64.4	-177.7	171.3	0	0	108.3	D298 A299	E296-D298 PolarHBondContact O-N 3.34Å; E296-A299 PolarHBondContact O-N 2.84Å
297	K	56.8	Low	59.3	Low	187 Å²	187	88 Å²	88	81%	0.813	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-17.6	-172.8	-70.7	-179.2	177.4	179.3	0	113.8
298	D	53.6	Low	61.5	Low	157 Å²	157	87 Å²	87	84%	0.84	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	6.6	-173.6	-52.7	-38.2	0	0	0	113.9	E296	E296-D298 PolarHBondContact O-N 3.34Å
299	A	61	Low	63.6	Low	43 Å²	43	84.8 Å²	84.8	36%	0.355	44%	0.435	S	S	.	.			trans	-79.4	125.2	178.6	0	0	0	0	0	111.9	F295 E296 I301	F295-A299 HydrophobicContact CB-CB 4.48Å; F295-A299 HydrophobicContact CD1-CB 4.38Å; E296-A299 PolarHBondContact O-N 2.84Å; A299-I301 WeakPolarHBondContact O-CG1 3Å; A299-I301 PolarHBondContact O-N 2.75Å
300	E	58	Low	65.5	Low	173 Å²	173	75.6 Å²	75.6	81%	0.808	39%	0.392	S	S	*	.			trans	-64.7	94.8	172.2	-67.9	-179.5	-178.4	0	0	110.3	T302	E300-T302 VanDerWaalsContact C-N 3.3Å; E300-T302 PolarHBondContact O-N 2.88Å
301	I	64.7	Low	67.4	Low	21 Å²	21	76.5 Å²	76.5	11%	0.108	39%	0.39	C	S	.	.			trans	-74.9	87.2	174.9	-0.9	165.8	0	0	0	109.6	F295 A299 V306 I337 R341	F295-I301 HydrophobicContact CB-CD1 4.23Å; F295-I301 HydrophobicContact CD1-CB 4.26Å; F295-I301 HydrophobicContact CD1-CD1 4.36Å; F295-I301 HydrophobicContact CD1-CG1 4.05Å; F295-I301 HydrophobicContact CD2-CD1 3.74Å; F295-I301 HydrophobicContact CD2-CG1 4.31Å; F295-I301 HydrophobicContact CE1-CB 4.07Å; F295-I301 HydrophobicContact CE1-CG1 4.36Å; F295-I301 HydrophobicContact CE2-CD1 4.16Å; F295-I301 HydrophobicContact CG-CD1 3.85Å; F295-I301 HydrophobicContact CG-CG1 4.03Å; F295-I301 HydrophobicContact CZ-CB 4.21Å; F295-I301 HydrophobicContact CZ-CG2 4.46Å; A299-I301 WeakPolarHBondContact O-CG1 3Å; A299-I301 PolarHBondContact O-N 2.75Å; I301-V306 HydrophobicContact CG2-CG2 3.61Å; I301-I337 HydrophobicContact CD1-CG2 3.73Å; I301-I337 HydrophobicContact CG2-CG2 3.91Å; I301-R341 VanDerWaalsContact CB-NH1 3.28Å; I301-R341 VanDerWaalsContact CG1-NH2 3.31Å; I301-R341 VanDerWaalsContact CG2-NH1 3.33Å; I301-R341 PolarHBondContact O-NH1 3.09Å
302	T	69.5	Low	68.9	Low	71 Å²	71	79.5 Å²	79.5	44%	0.436	40%	0.396	S	S	.	.			trans	-83.5	156.1	170.1	-56.4	0	0	0	0	109.9	E300 Q304 A305 V306	E300-T302 VanDerWaalsContact C-N 3.3Å; E300-T302 PolarHBondContact O-N 2.88Å; T302-Q304 HydrophobicContact CG2-CB 4.47Å; T302-Q304 PolarHBondContact O-N 3.16Å; T302-Q304 VanDerWaalsContact O-N 3.12Å; T302-A305 WeakPolarHBondContact O-CB 3.5Å; T302-A305 PolarHBondContact O-N 3.22Å; T302-V306 PolarHBondContact O-N 3.37Å; T302-V306 VanDerWaalsContact O-N 3.13Å
303	A	68.5	Low	70.3	Confident	25 Å²	25	77.2 Å²	77.2	21%	0.207	38%	0.38	C	S	.	.	H	α-helix	trans	-52.2	-36	177.1	0	0	0	0	0	113	S307 M343 L347	A303-S307 PolarHBondContact O-N 2.84Å; A303-M343 HydrophobicContact CB-SD 4.34Å; A303-L347 HydrophobicContact CB-CD2 4.36Å
304	Q	76.5	Confident	71.6	Confident	116 Å²	116	74.6 Å²	74.6	54%	0.542	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-46.9	173	-70.6	176.8	-11.3	0	0	112.3	T302 V306 S307 D308 T409	T302-Q304 HydrophobicContact CG2-CB 4.47Å; T302-Q304 PolarHBondContact O-N 3.16Å; T302-Q304 VanDerWaalsContact O-N 3.12Å; Q304-V306 VanDerWaalsContact C-N 3.28Å; Q304-V306 PolarHBondContact O-N 2.95Å; Q304-S307 CarbonylContact O-C 3.55Å; Q304-S307 PolarHBondContact O-N 3.35Å; Q304-S307 PolarHBondContact O-OG 2.73Å; Q304-D308 PolarHBondContact O-N 2.91Å; Q304-T409 HydrophobicContact CG-CG2 3.84Å
305	A	78	Confident	72.8	Confident	30 Å²	30	76.1 Å²	76.1	25%	0.248	39%	0.386	C	S	.	.	H	α-helix	trans	-60.1	-37.6	179	0	0	0	0	0	112.2	T302 K309	T302-A305 WeakPolarHBondContact O-CB 3.5Å; T302-A305 PolarHBondContact O-N 3.22Å; A305-K309 WeakPolarHBondContact O-CB 3.21Å; A305-K309 WeakPolarHBondContact O-CG 3.45Å; A305-K309 PolarHBondContact O-N 3.01Å
306	V	78.1	Confident	73.8	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-72	-37.9	174.8	176.4	0	0	0	0	111.7	F295 I301 T302 Q304 D308 K309 L310 M343 L347 I351	F295-V306 HydrophobicContact CZ-CG2 4.08Å; I301-V306 HydrophobicContact CG2-CG2 3.61Å; T302-V306 PolarHBondContact O-N 3.37Å; T302-V306 VanDerWaalsContact O-N 3.13Å; Q304-V306 VanDerWaalsContact C-N 3.28Å; Q304-V306 PolarHBondContact O-N 2.95Å; V306-D308 VanDerWaalsContact C-N 3.32Å; V306-D308 PolarHBondContact O-N 3.49Å; V306-K309 PolarHBondContact O-N 3.36Å; V306-L310 VanDerWaalsContact O-CB 3.29Å; V306-L310 WeakPolarHBondContact O-CB 3.36Å; V306-L310 PolarHBondContact O-N 3.05Å; V306-M343 HydrophobicContact CB-CE 3.66Å; V306-M343 HydrophobicContact CG1-CE 3.89Å; V306-M343 HydrophobicContact CG2-CE 3.4Å; V306-M343 VanDerWaalsContact CG2-CE 3.4Å; V306-L347 HydrophobicContact CB-CD2 4.12Å; V306-L347 HydrophobicContact CG1-CD2 4Å; V306-L347 HydrophobicContact CG1-CG 4.46Å; V306-I351 HydrophobicContact CG1-CD1 3.98Å
307	S	78	Confident	74.2	Confident	18 Å²	18	70 Å²	70	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-37.5	173.9	79.4	0	0	0	0	112.5	A303 Q304 L310 R311	A303-S307 PolarHBondContact O-N 2.84Å; Q304-S307 CarbonylContact O-C 3.55Å; Q304-S307 PolarHBondContact O-N 3.35Å; Q304-S307 PolarHBondContact O-OG 2.73Å; S307-L310 PolarHBondContact O-N 3.21Å; S307-R311 WeakPolarHBondContact O-CB 3.44Å; S307-R311 PolarHBondContact O-N 3.23Å
308	D	83.1	Confident	74.9	Confident	81 Å²	81	70.3 Å²	70.3	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-72.5	-41.4	177.4	-70.6	-27.4	0	0	0	111.2	Q304 V306 L310 R311 E312	Q304-D308 PolarHBondContact O-N 2.91Å; V306-D308 VanDerWaalsContact C-N 3.32Å; V306-D308 PolarHBondContact O-N 3.49Å; D308-L310 VanDerWaalsContact C-N 3.32Å; D308-L310 PolarHBondContact O-N 3.33Å; D308-R311 PolarHBondContact O-N 3.23Å; D308-R311 IonicContact OD1-CZ 3.92Å; D308-R311 IonicContact OD1-NH1 3.97Å; D308-R311 PolarHBondContact OD1-NH1 2.67Å; D308-R311 IonicContact OD1-NH2 2.62Å; D308-E312 WeakPolarHBondContact O-CB 3.22Å; D308-E312 PolarHBondContact O-N 3.2Å
309	K	80.3	Confident	76	Confident	63 Å²	63	70.7 Å²	70.7	27%	0.274	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-38.5	171	-77.3	-57.7	-173.9	-174.8	0	112.5	F295 A305 V306 E312 I313 L334	F295-K309 HydrophobicContact CE1-CG 3.95Å; F295-K309 HydrophobicContact CZ-CB 4.48Å; F295-K309 HydrophobicContact CZ-CG 3.91Å; A305-K309 WeakPolarHBondContact O-CB 3.21Å; A305-K309 WeakPolarHBondContact O-CG 3.45Å; A305-K309 PolarHBondContact O-N 3.01Å; V306-K309 PolarHBondContact O-N 3.36Å; K309-E312 WeakPolarHBondContact CD-OE2 3.41Å; K309-E312 IonicContact NZ-OE1 3.39Å; K309-E312 IonicContact NZ-OE2 2.76Å; K309-E312 PolarHBondContact NZ-OE2 2.69Å; K309-E312 WeakPolarHBondContact O-CB 3.34Å; K309-E312 PolarHBondContact O-N 2.92Å; K309-I313 WeakPolarHBondContact O-CG1 3.22Å; K309-I313 PolarHBondContact O-N 3.29Å; K309-L334 HydrophobicContact CB-CD1 4.47Å; K309-L334 HydrophobicContact CB-CD2 4.42Å
310	L	83.3	Confident	76.6	Confident	2 Å²	2	79.3 Å²	79.3	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-44.8	173.4	-177.1	63.6	0	0	0	110.9	V306 S307 D308 E312 I313 I314 N350 I351	V306-L310 VanDerWaalsContact O-CB 3.29Å; V306-L310 WeakPolarHBondContact O-CB 3.36Å; V306-L310 PolarHBondContact O-N 3.05Å; S307-L310 PolarHBondContact O-N 3.21Å; D308-L310 VanDerWaalsContact C-N 3.32Å; D308-L310 PolarHBondContact O-N 3.33Å; L310-E312 VanDerWaalsContact C-N 3.33Å; L310-E312 PolarHBondContact O-N 3.32Å; L310-I313 PolarHBondContact O-N 3Å; L310-I314 HydrophobicContact CD1-CD1 4.28Å; L310-I314 HydrophobicContact CG-CD1 3.89Å; L310-I314 VanDerWaalsContact O-CG1 3.23Å; L310-I314 WeakPolarHBondContact O-CG1 3.36Å; L310-I314 PolarHBondContact O-N 3.46Å; L310-N350 HydrophobicContact CD2-CB 4.37Å; L310-I351 HydrophobicContact CD1-CG1 4.46Å; L310-I351 HydrophobicContact CD2-CG1 4.03Å
311	R	84.3	Confident	77.3	Confident	155 Å²	155	75 Å²	75	59%	0.585	38%	0.379	S	S	*	.	H	α-helix	trans	-62.9	-38.9	176.3	-160.9	-176.1	-61.7	120.2	4	111.9	S307 D308 I314 S315	S307-R311 WeakPolarHBondContact O-CB 3.44Å; S307-R311 PolarHBondContact O-N 3.23Å; D308-R311 PolarHBondContact O-N 3.23Å; D308-R311 IonicContact OD1-CZ 3.92Å; D308-R311 IonicContact OD1-NH1 3.97Å; D308-R311 PolarHBondContact OD1-NH1 2.67Å; D308-R311 IonicContact OD1-NH2 2.62Å; R311-I314 PolarHBondContact O-N 3.36Å; R311-S315 WeakPolarHBondContact O-CB 3.46Å; R311-S315 PolarHBondContact O-N 3.04Å
312	E	85.4	Confident	77.6	Confident	108 Å²	108	75.5 Å²	75.5	51%	0.505	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-50.2	173.9	-171	-173.7	165.4	0	0	110.8	D308 K309 L310 I314 S315 A316	D308-E312 WeakPolarHBondContact O-CB 3.22Å; D308-E312 PolarHBondContact O-N 3.2Å; K309-E312 WeakPolarHBondContact CD-OE2 3.41Å; K309-E312 IonicContact NZ-OE1 3.39Å; K309-E312 IonicContact NZ-OE2 2.76Å; K309-E312 PolarHBondContact NZ-OE2 2.69Å; K309-E312 WeakPolarHBondContact O-CB 3.34Å; K309-E312 PolarHBondContact O-N 2.92Å; L310-E312 VanDerWaalsContact C-N 3.33Å; L310-E312 PolarHBondContact O-N 3.32Å; E312-I314 PolarHBondContact O-N 3.14Å; E312-S315 PolarHBondContact O-N 3.11Å; E312-S315 VanDerWaalsContact O-N 3.15Å; E312-S315 PolarHBondContact O-OG 3.06Å; E312-A316 PolarHBondContact O-N 3.26Å; E312-A316 VanDerWaalsContact O-N 3.11Å
313	I	83.2	Confident	78	Confident	9 Å²	9	76.1 Å²	76.1	5%	0.046	39%	0.387	C	S	.	.	H	α-helix	trans	-62.4	-44.2	177.8	-65.3	168.5	0	0	0	111.1	M294 K309 L310 S315 A316 R317 M330 V331 L334	M294-I313 HydrophobicContact CE-CD1 3.64Å; M294-I313 HydrophobicContact CE-CG1 4.29Å; K309-I313 WeakPolarHBondContact O-CG1 3.22Å; K309-I313 PolarHBondContact O-N 3.29Å; L310-I313 PolarHBondContact O-N 3Å; I313-S315 PolarHBondContact O-N 3.15Å; I313-A316 PolarHBondContact O-N 3.47Å; I313-A316 VanDerWaalsContact O-N 3.14Å; I313-R317 WeakPolarHBondContact O-CB 3.27Å; I313-R317 PolarHBondContact O-N 2.82Å; I313-M330 HydrophobicContact CD1-CB 4.12Å; I313-M330 HydrophobicContact CG1-CE 4.32Å; I313-V331 HydrophobicContact CD1-CG2 4.36Å; I313-V331 HydrophobicContact CG2-CG2 3.83Å; I313-L334 HydrophobicContact CD1-CD1 3.28Å; I313-L334 HydrophobicContact CD1-CG 4.12Å
314	I	82.7	Confident	78.5	Confident	72 Å²	72	79.3 Å²	79.3	37%	0.369	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-34.8	177	-67.2	165.5	0	0	0	111	L310 R311 E312 R317	L310-I314 HydrophobicContact CD1-CD1 4.28Å; L310-I314 HydrophobicContact CG-CD1 3.89Å; L310-I314 VanDerWaalsContact O-CG1 3.23Å; L310-I314 WeakPolarHBondContact O-CG1 3.36Å; L310-I314 PolarHBondContact O-N 3.46Å; R311-I314 PolarHBondContact O-N 3.36Å; E312-I314 PolarHBondContact O-N 3.14Å; I314-R317 WeakPolarHBondContact O-CB 3.33Å; I314-R317 PolarHBondContact O-N 3.14Å
315	S	82	Confident	78.7	Confident	66 Å²	66	78.8 Å²	78.8	46%	0.462	39%	0.389	S	S	.	.	H	α-helix	trans	-73.8	-25.6	177.4	82.2	0	0	0	0	114.1	R311 E312 I313 R319	R311-S315 WeakPolarHBondContact O-CB 3.46Å; R311-S315 PolarHBondContact O-N 3.04Å; E312-S315 PolarHBondContact O-N 3.11Å; E312-S315 VanDerWaalsContact O-N 3.15Å; E312-S315 PolarHBondContact O-OG 3.06Å; I313-S315 PolarHBondContact O-N 3.15Å; S315-R319 PolarHBondContact O-NE 2.83Å
316	A	80.9	Confident	78.9	Confident	34 Å²	34	81.1 Å²	81.1	28%	0.281	40%	0.398	S	S	.	.	H	α-helix	trans	-82.3	-29.1	174.5	0	0	0	0	0	111.7	E312 I313 R318 R319	E312-A316 PolarHBondContact O-N 3.26Å; E312-A316 VanDerWaalsContact O-N 3.11Å; I313-A316 PolarHBondContact O-N 3.47Å; I313-A316 VanDerWaalsContact O-N 3.14Å; A316-R318 PolarHBondContact O-N 3.36Å; A316-R319 PolarHBondContact O-N 3.3Å
317	R	69.7	Low	79	Confident	39 Å²	39	81.7 Å²	81.7	15%	0.147	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	121.3	177.1	-170.1	169.8	166	-135.1	-35.7	109.7	I313 I314 S354 S357 D361	I313-R317 WeakPolarHBondContact O-CB 3.27Å; I313-R317 PolarHBondContact O-N 2.82Å; I314-R317 WeakPolarHBondContact O-CB 3.33Å; I314-R317 PolarHBondContact O-N 3.14Å; R317-S354 PolarHBondContact NH1-O 3.08Å; R317-S357 VanDerWaalsContact CZ-CB 3.4Å; R317-S357 VanDerWaalsContact NH1-CB 3.33Å; R317-S357 PolarHBondContact NH2-O 3.42Å; R317-D361 WeakPolarHBondContact CG-OD2 3.46Å; R317-D361 IonicContact CZ-OD2 3.64Å; R317-D361 IonicContact NE-OD2 3.29Å; R317-D361 PolarHBondContact NE-OD2 3.48Å; R317-D361 IonicContact NH2-OD2 3.09Å; R317-D361 PolarHBondContact NH2-OD2 3.36Å
318	R	71.2	Confident	79.3	Confident	194 Å²	194	81.1 Å²	81.1	73%	0.732	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	1	-175.9	-53.1	175.4	170.7	-119.5	-11.2	117.6	A316 D361	A316-R318 PolarHBondContact O-N 3.36Å; R318-D361 IonicContact CZ-OD1 3.21Å; R318-D361 IonicContact NE-OD1 3.37Å; R318-D361 IonicContact NE-OD2 2.69Å; R318-D361 IonicContact NH2-OD1 2.86Å; R318-D361 PolarHBondContact NH2-OD1 2.99Å; R318-D361 IonicContact NH2-OD2 3.68Å
319	R	77.9	Confident	79.4	Confident	164 Å²	164	81.3 Å²	81.3	62%	0.619	40%	0.395	S	S	*	.			trans	-68.1	141.1	169.2	-64.4	-174.6	-171.1	-179	2.2	110.3	S315 A316 G321 A322	S315-R319 PolarHBondContact O-NE 2.83Å; A316-R319 PolarHBondContact O-N 3.3Å; R319-G321 PolarHBondContact O-N 3.47Å; R319-A322 HydrophobicContact CB-CB 4.37Å; R319-A322 PolarHBondContact O-N 3.45Å
320	K	72.6	Confident	79.5	Confident	225 Å²	225	81.1 Å²	81.1	98%	0.978	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.1	-173.1	-167.9	175.5	178.7	-178.5	0	114.5
321	G	73.8	Confident	79.6	Confident	82 Å²	82	81.2 Å²	81.2	85%	0.845	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	9.6	178.6	0	0	0	0	0	115.6	R319	R319-G321 PolarHBondContact O-N 3.47Å
322	A	71.9	Confident	79.7	Confident	32 Å²	32	78.5 Å²	78.5	26%	0.264	39%	0.386	S	S	.	.			trans	-79.9	130.4	176.1	0	0	0	0	0	110.4	R319 R324	R319-A322 HydrophobicContact CB-CB 4.37Å; R319-A322 PolarHBondContact O-N 3.45Å; A322-R324 PolarHBondContact O-N 2.92Å
323	D	77.6	Confident	79.5	Confident	83 Å²	83	75.3 Å²	75.3	44%	0.444	37%	0.371	S	S	.	.			trans	-72.2	119.5	169.9	-174.2	-5.2	0	0	0	109.7	F325 L326 T327	D323-F325 PolarHBondContact OD1-N 2.79Å; D323-L326 HydrophobicContact CB-CB 4.05Å; D323-L326 HydrophobicContact CB-CD1 3.83Å; D323-L326 HydrophobicContact CB-CG 4.04Å; D323-L326 WeakPolarHBondContact OD2-CD1 3.41Å; D323-L326 WeakPolarHBondContact OD2-CG 3.46Å; D323-T327 WeakPolarHBondContact O-CG2 3.47Å; D323-T327 PolarHBondContact O-N 3.21Å
324	R	77.9	Confident	79.5	Confident	92 Å²	92	74.9 Å²	74.9	35%	0.347	37%	0.369	S	S	.	.	H	α-helix	trans	-73.5	-35.2	-173.9	-64.8	155.7	177.7	-129.7	1.4	111.3	A322 T327 V328 D361 N363 P364	A322-R324 PolarHBondContact O-N 2.92Å; R324-T327 PolarHBondContact O-N 2.99Å; R324-T327 PolarHBondContact O-OG1 3.13Å; R324-V328 PolarHBondContact O-N 3.3Å; R324-D361 WeakPolarHBondContact CD-O 3.24Å; R324-D361 PolarHBondContact NH1-O 2.95Å; R324-N363 VanDerWaalsContact NH1-C 3.3Å; R324-P364 VanDerWaalsContact NH1-CB 3.33Å; R324-P364 VanDerWaalsContact NH1-CD 3.28Å
325	F	81.2	Confident	79.4	Confident	105 Å²	105	73.9 Å²	73.9	46%	0.461	36%	0.36	S	S	.	.	H	α-helix	trans	-69.5	-41.1	178.4	-69.9	-76.7	0	0	0	110.9	D323 T327 V328 E329 L371	D323-F325 PolarHBondContact OD1-N 2.79Å; F325-T327 VanDerWaalsContact C-N 3.29Å; F325-T327 PolarHBondContact O-N 3.5Å; F325-V328 WeakPolarHBondContact O-CB 3.35Å; F325-V328 PolarHBondContact O-N 2.92Å; F325-E329 PolarHBondContact O-N 3.03Å; F325-L371 HydrophobicContact CZ-CD1 4.18Å
326	L	82.9	Confident	79.5	Confident	80 Å²	80	76.2 Å²	76.2	42%	0.419	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-39.5	172.2	-72.1	177.9	0	0	0	111.9	D323 V328 E329 M330	D323-L326 HydrophobicContact CB-CB 4.05Å; D323-L326 HydrophobicContact CB-CD1 3.83Å; D323-L326 HydrophobicContact CB-CG 4.04Å; D323-L326 WeakPolarHBondContact OD2-CD1 3.41Å; D323-L326 WeakPolarHBondContact OD2-CG 3.46Å; L326-V328 VanDerWaalsContact C-N 3.28Å; L326-V328 PolarHBondContact O-N 2.93Å; L326-E329 PolarHBondContact O-N 3.35Å; L326-M330 WeakPolarHBondContact O-CB 3.32Å; L326-M330 WeakPolarHBondContact O-CG 3.38Å; L326-M330 PolarHBondContact O-N 3.36Å
327	T	80.4	Confident	79.5	Confident	12 Å²	12	76.4 Å²	76.4	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-35.8	175.4	61.9	0	0	0	0	113	D323 R324 F325 V331	D323-T327 WeakPolarHBondContact O-CG2 3.47Å; D323-T327 PolarHBondContact O-N 3.21Å; R324-T327 PolarHBondContact O-N 2.99Å; R324-T327 PolarHBondContact O-OG1 3.13Å; F325-T327 VanDerWaalsContact C-N 3.29Å; F325-T327 PolarHBondContact O-N 3.5Å; T327-V331 VanDerWaalsContact O-CG2 3.24Å; T327-V331 WeakPolarHBondContact O-CG2 3.4Å; T327-V331 PolarHBondContact O-N 2.91Å; T327-V331 VanDerWaalsContact O-N 3.14Å
328	V	83.4	Confident	80	Confident	5 Å²	5	74.5 Å²	74.5	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-66.9	-43.6	175.2	174.3	0	0	0	0	110.7	R324 F325 L326 V331 R332 L355 Y359	R324-V328 PolarHBondContact O-N 3.3Å; F325-V328 WeakPolarHBondContact O-CB 3.35Å; F325-V328 PolarHBondContact O-N 2.92Å; L326-V328 VanDerWaalsContact C-N 3.28Å; L326-V328 PolarHBondContact O-N 2.93Å; V328-V331 PolarHBondContact O-N 2.71Å; V328-R332 WeakPolarHBondContact O-CG 3.45Å; V328-R332 PolarHBondContact O-N 3.06Å; V328-L355 HydrophobicContact CG1-CD1 4.22Å; V328-Y359 HydrophobicContact CG1-CD1 3.93Å; V328-Y359 HydrophobicContact CG1-CE1 3.44Å; V328-Y359 VanDerWaalsContact CG1-CE1 3.44Å; V328-Y359 HydrophobicContact CG2-CD1 4.23Å
329	E	84.9	Confident	80.4	Confident	85 Å²	85	69.3 Å²	69.3	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-43.8	178.4	-69.5	-178.9	172.7	0	0	112.2	F325 L326 V331 R332 E333	F325-E329 PolarHBondContact O-N 3.03Å; L326-E329 PolarHBondContact O-N 3.35Å; E329-V331 VanDerWaalsContact C-N 3.29Å; E329-V331 PolarHBondContact O-N 2.87Å; E329-R332 PolarHBondContact O-N 3.15Å; E329-R332 VanDerWaalsContact O-N 3.16Å; E329-E333 PolarHBondContact O-N 3.36Å
330	M	83.1	Confident	80.4	Confident	60 Å²	60	65.7 Å²	65.7	30%	0.296	34%	0.34	S	S	.	.	H	α-helix	trans	-58	-41.3	174.8	-69.6	173.6	81.8	0	0	111.7	M294 I313 L326 E333 L334	M294-M330 HydrophobicContact CE-CB 4.13Å; M294-M330 HydrophobicContact CE-CE 3.62Å; M294-M330 HydrophobicContact CE-CG 4.45Å; M294-M330 HydrophobicContact SD-CB 4.13Å; M294-M330 HydrophobicContact SD-CE 3.44Å; M294-M330 WeakPolarHBondContact SD-CE 3.29Å; M294-M330 HydrophobicContact SD-CG 3.92Å; I313-M330 HydrophobicContact CD1-CB 4.12Å; I313-M330 HydrophobicContact CG1-CE 4.32Å; L326-M330 WeakPolarHBondContact O-CB 3.32Å; L326-M330 WeakPolarHBondContact O-CG 3.38Å; L326-M330 PolarHBondContact O-N 3.36Å; M330-E333 PolarHBondContact O-N 3.08Å; M330-L334 WeakPolarHBondContact O-CG 3.45Å; M330-L334 PolarHBondContact O-N 3.26Å
331	V	84.8	Confident	80.1	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-72	-35.9	177.4	179.1	0	0	0	0	111.8	I313 T327 V328 E329 L334 R335 I351 L355	I313-V331 HydrophobicContact CD1-CG2 4.36Å; I313-V331 HydrophobicContact CG2-CG2 3.83Å; T327-V331 VanDerWaalsContact O-CG2 3.24Å; T327-V331 WeakPolarHBondContact O-CG2 3.4Å; T327-V331 PolarHBondContact O-N 2.91Å; T327-V331 VanDerWaalsContact O-N 3.14Å; V328-V331 PolarHBondContact O-N 2.71Å; E329-V331 VanDerWaalsContact C-N 3.29Å; E329-V331 PolarHBondContact O-N 2.87Å; V331-L334 PolarHBondContact O-N 3.41Å; V331-R335 PolarHBondContact O-N 3.27Å; V331-I351 HydrophobicContact CG1-CG2 4.07Å; V331-L355 HydrophobicContact CB-CD1 4.13Å; V331-L355 HydrophobicContact CG1-CB 3.67Å; V331-L355 HydrophobicContact CG1-CD1 3.88Å; V331-L355 HydrophobicContact CG1-CG 4.32Å
332	R	85.4	Confident	79.8	Confident	98 Å²	98	65.8 Å²	65.8	37%	0.37	32%	0.317	S	S	.	.	H	α-helix	trans	-63.9	-41	173.1	-74.6	176.2	-177.4	160.5	-5.9	112.1	V328 E329 R335 K336 L355 Y359	V328-R332 WeakPolarHBondContact O-CG 3.45Å; V328-R332 PolarHBondContact O-N 3.06Å; E329-R332 PolarHBondContact O-N 3.15Å; E329-R332 VanDerWaalsContact O-N 3.16Å; R332-R335 WeakPolarHBondContact O-CB 3.05Å; R332-R335 PolarHBondContact O-N 3.23Å; R332-K336 PolarHBondContact O-N 3.27Å; R332-L355 HydrophobicContact CG-CD1 3.91Å; R332-Y359 VanDerWaalsContact CZ-OH 3.28Å; R332-Y359 PolarHBondContact NE-OH 2.94Å; R332-Y359 VanDerWaalsContact NH2-CE1 3.34Å; R332-Y359 PolarHBondContact NH2-OH 3.42Å
333	E	81.5	Confident	79.5	Confident	41 Å²	41	65.4 Å²	65.4	19%	0.192	31%	0.31	C	S	.	.	H	α-helix	trans	-66.4	-40.4	174.8	-70.6	-56.1	137.9	0	0	111.3	A291 E329 M330 R335 K336 I337	A291-E333 HydrophobicContact CB-CG 4.38Å; E329-E333 PolarHBondContact O-N 3.36Å; M330-E333 PolarHBondContact O-N 3.08Å; E333-R335 VanDerWaalsContact C-N 3.29Å; E333-R335 PolarHBondContact O-N 3.45Å; E333-K336 PolarHBondContact O-N 2.93Å; E333-K336 IonicContact OE1-NZ 2.97Å; E333-K336 PolarHBondContact OE1-NZ 2.75Å; E333-K336 IonicContact OE2-NZ 3.95Å; E333-I337 WeakPolarHBondContact O-CD1 3.35Å; E333-I337 VanDerWaalsContact O-CG1 3.27Å; E333-I337 WeakPolarHBondContact O-CG1 3.4Å; E333-I337 PolarHBondContact O-N 3.2Å
334	L	83	Confident	79.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-38.4	171.4	-77.1	-172.9	0	0	0	112.7	M294 F295 K309 I313 M330 V331 I337 A338	M294-L334 HydrophobicContact CE-CD1 4.47Å; M294-L334 HydrophobicContact CE-CD2 4.25Å; M294-L334 HydrophobicContact CE-CG 4.18Å; F295-L334 HydrophobicContact CE2-CD2 3.83Å; F295-L334 HydrophobicContact CZ-CD2 4.21Å; K309-L334 HydrophobicContact CB-CD1 4.47Å; K309-L334 HydrophobicContact CB-CD2 4.42Å; I313-L334 HydrophobicContact CD1-CD1 3.28Å; I313-L334 HydrophobicContact CD1-CG 4.12Å; M330-L334 WeakPolarHBondContact O-CG 3.45Å; M330-L334 PolarHBondContact O-N 3.26Å; V331-L334 PolarHBondContact O-N 3.41Å; L334-I337 PolarHBondContact O-N 2.73Å; L334-A338 WeakPolarHBondContact O-CB 3.33Å; L334-A338 PolarHBondContact O-N 3.45Å
335	R	81.9	Confident	78.9	Confident	51 Å²	51	61.1 Å²	61.1	19%	0.192	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-49.7	173.8	177.9	-175.6	166.5	-179.6	-3.5	111.1	V331 R332 E333 I337 A338 E339 I351 D384	V331-R335 PolarHBondContact O-N 3.27Å; R332-R335 WeakPolarHBondContact O-CB 3.05Å; R332-R335 PolarHBondContact O-N 3.23Å; E333-R335 VanDerWaalsContact C-N 3.29Å; E333-R335 PolarHBondContact O-N 3.45Å; R335-I337 VanDerWaalsContact C-N 3.29Å; R335-I337 PolarHBondContact O-N 3.48Å; R335-A338 PolarHBondContact O-N 3.13Å; R335-A338 VanDerWaalsContact O-N 3.15Å; R335-E339 HydrophobicContact CG-CG 4.38Å; R335-E339 IonicContact CZ-OE1 3.89Å; R335-E339 VanDerWaalsContact CZ-OE1 3.28Å; R335-E339 IonicContact NE-OE1 3.33Å; R335-E339 PolarHBondContact NE-OE1 3.16Å; R335-E339 IonicContact NH2-OE1 3.61Å; R335-E339 PolarHBondContact NH2-OE1 3.27Å; R335-E339 WeakPolarHBondContact O-CG 3.45Å; R335-E339 PolarHBondContact O-N 2.71Å; R335-I351 HydrophobicContact CB-CG2 3.98Å; R335-D384 IonicContact CZ-OD2 3.27Å; R335-D384 IonicContact NH1-OD2 2.58Å; R335-D384 PolarHBondContact NH1-OD2 3.36Å; R335-D384 IonicContact NH2-OD2 2.95Å; R335-D384 PolarHBondContact NH2-OD2 2.91Å
336	K	84.6	Confident	78.5	Confident	116 Å²	116	56.1 Å²	56.1	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-41.6	177.6	-69.4	176.1	-173.5	168.4	0	112	R332 E333 A338 A340	R332-K336 PolarHBondContact O-N 3.27Å; E333-K336 PolarHBondContact O-N 2.93Å; E333-K336 IonicContact OE1-NZ 2.97Å; E333-K336 PolarHBondContact OE1-NZ 2.75Å; E333-K336 IonicContact OE2-NZ 3.95Å; K336-A338 VanDerWaalsContact C-N 3.35Å; K336-A340 VanDerWaalsContact O-CB 3.22Å; K336-A340 WeakPolarHBondContact O-CB 3.45Å; K336-A340 PolarHBondContact O-N 2.71Å
337	I	81.1	Confident	78.1	Confident	37 Å²	37	52.4 Å²	52.4	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-38.8	178.1	-68.1	160.8	0	0	0	111.3	F295 I301 E333 L334 R335	F295-I337 HydrophobicContact CD2-CD1 3.86Å; F295-I337 HydrophobicContact CE2-CD1 3.93Å; F295-I337 HydrophobicContact CE2-CG2 4.2Å; I301-I337 HydrophobicContact CD1-CG2 3.73Å; I301-I337 HydrophobicContact CG2-CG2 3.91Å; E333-I337 WeakPolarHBondContact O-CD1 3.35Å; E333-I337 VanDerWaalsContact O-CG1 3.27Å; E333-I337 WeakPolarHBondContact O-CG1 3.4Å; E333-I337 PolarHBondContact O-N 3.2Å; L334-I337 PolarHBondContact O-N 2.73Å; R335-I337 VanDerWaalsContact C-N 3.29Å; R335-I337 PolarHBondContact O-N 3.48Å
338	A	79.1	Confident	78.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71.8	-39.3	178.1	0	0	0	0	0	112.5	L334 R335 K336 R341 E342 M343 L348 I351	L334-A338 WeakPolarHBondContact O-CB 3.33Å; L334-A338 PolarHBondContact O-N 3.45Å; R335-A338 PolarHBondContact O-N 3.13Å; R335-A338 VanDerWaalsContact O-N 3.15Å; K336-A338 VanDerWaalsContact C-N 3.35Å; A338-R341 PolarHBondContact O-N 3.36Å; A338-E342 PolarHBondContact O-N 2.94Å; A338-M343 HydrophobicContact CB-CE 4.1Å; A338-M343 PolarHBondContact O-N 3.39Å; A338-L348 HydrophobicContact CB-CD2 3.52Å; A338-I351 HydrophobicContact CB-CD1 3.74Å
339	E	79.2	Confident	78.1	Confident	85 Å²	85	52.6 Å²	52.6	40%	0.397	26%	0.255	S	S	.	.	H	α-helix	trans	-66.4	-43.5	174.8	-74.5	175.3	173.9	0	0	111.4	R335 R341 E342 L348	R335-E339 HydrophobicContact CG-CG 4.38Å; R335-E339 IonicContact CZ-OE1 3.89Å; R335-E339 VanDerWaalsContact CZ-OE1 3.28Å; R335-E339 IonicContact NE-OE1 3.33Å; R335-E339 PolarHBondContact NE-OE1 3.16Å; R335-E339 IonicContact NH2-OE1 3.61Å; R335-E339 PolarHBondContact NH2-OE1 3.27Å; R335-E339 WeakPolarHBondContact O-CG 3.45Å; R335-E339 PolarHBondContact O-N 2.71Å; E339-R341 PolarHBondContact O-N 2.93Å; E339-R341 VanDerWaalsContact O-N 3.08Å; E339-E342 PolarHBondContact O-N 2.91Å; E339-L348 HydrophobicContact CG-CD2 4.1Å
340	A	78.7	Confident	78	Confident	87 Å²	87	49.9 Å²	49.9	72%	0.719	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.9	179.7	0	0	0	0	0	114	K336	K336-A340 VanDerWaalsContact O-CB 3.22Å; K336-A340 WeakPolarHBondContact O-CB 3.45Å; K336-A340 PolarHBondContact O-N 2.71Å
341	R	65.5	Low	78	Confident	123 Å²	123	47 Å²	47	46%	0.464	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	8	-178.5	-69.1	-177.6	178.2	-143.3	-4.8	113.6	I301 A338 E339 M343	I301-R341 VanDerWaalsContact CB-NH1 3.28Å; I301-R341 VanDerWaalsContact CG1-NH2 3.31Å; I301-R341 VanDerWaalsContact CG2-NH1 3.33Å; I301-R341 PolarHBondContact O-NH1 3.09Å; A338-R341 PolarHBondContact O-N 3.36Å; E339-R341 PolarHBondContact O-N 2.93Å; E339-R341 VanDerWaalsContact O-N 3.08Å; R341-M343 HydrophobicContact CB-CG 3.79Å; R341-M343 PolarHBondContact O-N 2.92Å
342	E	67.8	Low	78.1	Confident	186 Å²	186	47 Å²	47	87%	0.869	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	45.4	-178.7	-63.2	-178.8	172.5	0	0	112.8	A338 E339	A338-E342 PolarHBondContact O-N 2.94Å; E339-E342 PolarHBondContact O-N 2.91Å
343	M	66	Low	78.1	Confident	25 Å²	25	43 Å²	43	12%	0.123	21%	0.214	C	C	.	.			trans	-75.7	160.3	-175.7	-63.3	-136.8	-67.1	0	0	113	A303 V306 A338 R341 L347	A303-M343 HydrophobicContact CB-SD 4.34Å; V306-M343 HydrophobicContact CB-CE 3.66Å; V306-M343 HydrophobicContact CG1-CE 3.89Å; V306-M343 HydrophobicContact CG2-CE 3.4Å; V306-M343 VanDerWaalsContact CG2-CE 3.4Å; A338-M343 HydrophobicContact CB-CE 4.1Å; A338-M343 PolarHBondContact O-N 3.39Å; R341-M343 HydrophobicContact CB-CG 3.79Å; R341-M343 PolarHBondContact O-N 2.92Å; M343-L347 HydrophobicContact CB-CD2 4.4Å; M343-L347 HydrophobicContact CE-CD2 3.43Å; M343-L347 VanDerWaalsContact CE-CD2 3.43Å; M343-L347 HydrophobicContact SD-CD2 4.39Å
344	N	70.1	Confident	78.3	Confident	46 Å²	46	41.4 Å²	41.4	25%	0.246	21%	0.208	C	C	.	.			trans	-37.4	129.9	-176.4	-69.2	-12.1	0	0	0	113	A346 L347 L348 V408 W415	N344-A346 PolarHBondContact O-N 3.22Å; N344-A346 VanDerWaalsContact O-N 3.14Å; N344-L347 HydrophobicContact CB-CB 4.3Å; N344-L347 WeakPolarHBondContact O-CA 3.5Å; N344-L347 WeakPolarHBondContact O-CB 3.26Å; N344-L347 PolarHBondContact O-N 3.01Å; N344-L348 PolarHBondContact O-N 3.48Å; N344-L348 VanDerWaalsContact O-N 3.17Å; N344-V408 PolarHBondContact ND2-O 2.88Å; N344-W415 HydrophobicContact CB-CH2 4.2Å; N344-W415 HydrophobicContact CB-CZ3 4.35Å; N344-W415 WeakPolarHBondContact ND2-CH2 3.26Å
345	P	73	Confident	78.5	Confident	39 Å²	39	41.5 Å²	41.5	25%	0.253	21%	0.209	S	C	.	.	H	α-helix	trans	-60.7	-29.6	-177.8	23.8	-33.6	0	0	0	112.2	L348 G349 V395	P345-L348 PolarHBondContact O-N 3.43Å; P345-G349 PolarHBondContact O-N 3.08Å; P345-V395 HydrophobicContact CG-CG2 4.5Å
346	A	72	Confident	78.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-42.6	172.2	0	0	0	0	0	112.4	N344 G349 N350 W415 L417	N344-A346 PolarHBondContact O-N 3.22Å; N344-A346 VanDerWaalsContact O-N 3.14Å; A346-G349 PolarHBondContact O-N 2.85Å; A346-N350 PolarHBondContact O-N 3.33Å; A346-W415 HydrophobicContact CB-CB 4.23Å; A346-W415 HydrophobicContact CB-CD2 4.04Å; A346-W415 HydrophobicContact CB-CE3 3.5Å; A346-W415 VanDerWaalsContact CB-CE3 3.5Å; A346-W415 HydrophobicContact CB-CG 4.36Å; A346-W415 HydrophobicContact CB-CZ3 4.22Å; A346-L417 HydrophobicContact CB-CD2 4.05Å; A346-L417 HydrophobicContact CB-CG 4.38Å; A346-L417 VanDerWaalsContact O-CD2 3.23Å; A346-L417 WeakPolarHBondContact O-CD2 3.46Å
347	L	75.8	Confident	78.8	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-67.5	-41.7	178.5	-176.3	65.6	0	0	0	111.1	A303 V306 M343 N344 N350 I351 V408	A303-L347 HydrophobicContact CB-CD2 4.36Å; V306-L347 HydrophobicContact CB-CD2 4.12Å; V306-L347 HydrophobicContact CG1-CD2 4Å; V306-L347 HydrophobicContact CG1-CG 4.46Å; M343-L347 HydrophobicContact CB-CD2 4.4Å; M343-L347 HydrophobicContact CE-CD2 3.43Å; M343-L347 VanDerWaalsContact CE-CD2 3.43Å; M343-L347 HydrophobicContact SD-CD2 4.39Å; N344-L347 HydrophobicContact CB-CB 4.3Å; N344-L347 WeakPolarHBondContact O-CA 3.5Å; N344-L347 WeakPolarHBondContact O-CB 3.26Å; N344-L347 PolarHBondContact O-N 3.01Å; L347-N350 PolarHBondContact O-N 2.64Å; L347-I351 HydrophobicContact CG-CD1 4.19Å; L347-I351 VanDerWaalsContact O-CG1 3.28Å; L347-I351 WeakPolarHBondContact O-CG1 3.33Å; L347-I351 PolarHBondContact O-N 3.49Å; L347-V408 HydrophobicContact CB-CG1 3.79Å; L347-V408 HydrophobicContact CD1-CG1 3.62Å; L347-V408 HydrophobicContact CG-CG1 4.3Å
348	L	81.8	Confident	79	Confident	20 Å²	20	33.6 Å²	33.6	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-45.3	173.1	-71.9	172.6	0	0	0	111.6	A338 E339 N344 P345 N350 I351 L352 L388	A338-L348 HydrophobicContact CB-CD2 3.52Å; E339-L348 HydrophobicContact CG-CD2 4.1Å; N344-L348 PolarHBondContact O-N 3.48Å; N344-L348 VanDerWaalsContact O-N 3.17Å; P345-L348 PolarHBondContact O-N 3.43Å; L348-N350 VanDerWaalsContact C-N 3.34Å; L348-N350 PolarHBondContact O-N 3.43Å; L348-I351 PolarHBondContact O-N 2.84Å; L348-L352 WeakPolarHBondContact O-CG 3.46Å; L348-L352 PolarHBondContact O-N 3.31Å; L348-L388 HydrophobicContact CB-CD1 4.26Å
349	G	81.2	Confident	79.3	Confident	2 Å²	2	34 Å²	34	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-43.3	174.6	0	0	0	0	0	112.8	P345 A346 L352 F353	P345-G349 PolarHBondContact O-N 3.08Å; A346-G349 PolarHBondContact O-N 2.85Å; G349-L352 PolarHBondContact O-N 3.25Å; G349-F353 VanDerWaalsContact O-CD2 3.24Å; G349-F353 WeakPolarHBondContact O-CD2 3.49Å; G349-F353 PolarHBondContact O-N 3.47Å
350	N	82	Confident	79.6	Confident	27 Å²	27	32 Å²	32	14%	0.144	17%	0.171	C	C	.	.	H	α-helix	trans	-66.8	-38.6	177.4	-165.5	21.6	0	0	0	112.9	L310 A346 L347 L348 L352 S354 Q406 L417	L310-N350 HydrophobicContact CD2-CB 4.37Å; A346-N350 PolarHBondContact O-N 3.33Å; L347-N350 PolarHBondContact O-N 2.64Å; L348-N350 VanDerWaalsContact C-N 3.34Å; L348-N350 PolarHBondContact O-N 3.43Å; N350-L352 VanDerWaalsContact C-N 3.34Å; N350-S354 WeakPolarHBondContact O-CB 3.44Å; N350-S354 PolarHBondContact O-N 2.9Å; N350-S354 PolarHBondContact O-OG 3.38Å; N350-Q406 PolarHBondContact ND2-NE2 2.93Å; N350-L417 HydrophobicContact CB-CD2 4.24Å
351	I	84.8	Confident	79.7	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-43	173.2	-67.9	165.6	0	0	0	110	V306 L310 V331 R335 A338 L347 L348 S354 L355	V306-I351 HydrophobicContact CG1-CD1 3.98Å; L310-I351 HydrophobicContact CD1-CG1 4.46Å; L310-I351 HydrophobicContact CD2-CG1 4.03Å; V331-I351 HydrophobicContact CG1-CG2 4.07Å; R335-I351 HydrophobicContact CB-CG2 3.98Å; A338-I351 HydrophobicContact CB-CD1 3.74Å; L347-I351 HydrophobicContact CG-CD1 4.19Å; L347-I351 VanDerWaalsContact O-CG1 3.28Å; L347-I351 WeakPolarHBondContact O-CG1 3.33Å; L347-I351 PolarHBondContact O-N 3.49Å; L348-I351 PolarHBondContact O-N 2.84Å; I351-S354 CarbonylContact O-C 3.51Å; I351-S354 WeakPolarHBondContact O-CB 3.46Å; I351-S354 PolarHBondContact O-N 2.72Å; I351-L355 WeakPolarHBondContact O-CB 3.34Å; I351-L355 PolarHBondContact O-N 3.16Å
352	L	86.3	Confident	80.3	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-66.7	-42.7	178.4	-72.8	171.2	0	0	0	112.6	L348 G349 N350 S354 L355 I356 A381 D384 L385 L388	L348-L352 WeakPolarHBondContact O-CG 3.46Å; L348-L352 PolarHBondContact O-N 3.31Å; G349-L352 PolarHBondContact O-N 3.25Å; N350-L352 VanDerWaalsContact C-N 3.34Å; L352-S354 VanDerWaalsContact C-N 3.27Å; L352-S354 PolarHBondContact O-N 3.4Å; L352-L355 HydrophobicContact CD2-CD2 4.32Å; L352-L355 WeakPolarHBondContact O-CB 3.23Å; L352-L355 PolarHBondContact O-N 3.41Å; L352-I356 VanDerWaalsContact O-CG1 3.32Å; L352-I356 WeakPolarHBondContact O-CG1 3.48Å; L352-I356 PolarHBondContact O-N 2.78Å; L352-A381 HydrophobicContact CD2-CB 4.25Å; L352-D384 HydrophobicContact CD1-CB 4.43Å; L352-L385 HydrophobicContact CB-CB 4.2Å; L352-L385 HydrophobicContact CB-CD1 4.08Å; L352-L385 HydrophobicContact CD1-CB 3.96Å; L352-L385 HydrophobicContact CD1-CD1 4.21Å; L352-L388 HydrophobicContact CD1-CD1 3.45Å; L352-L388 VanDerWaalsContact CD1-CD1 3.45Å
353	F	85.9	Confident	80.6	Confident	13 Å²	13	17 Å²	17	6%	0.057	9%	0.094	C	C	.	.	H	α-helix	trans	-58.3	-42.5	171.4	-84.7	-64	0	0	0	111.7	G349 S357 L385 V421 V424	G349-F353 VanDerWaalsContact O-CD2 3.24Å; G349-F353 WeakPolarHBondContact O-CD2 3.49Å; G349-F353 PolarHBondContact O-N 3.47Å; F353-S357 VanDerWaalsContact O-CB 3.3Å; F353-S357 WeakPolarHBondContact O-CB 3.44Å; F353-S357 PolarHBondContact O-N 3.2Å; F353-S357 PolarHBondContact O-OG 3.03Å; F353-L385 HydrophobicContact CD1-CD2 4Å; F353-L385 HydrophobicContact CD2-CD1 4.37Å; F353-L385 HydrophobicContact CD2-CD2 4.25Å; F353-L385 HydrophobicContact CE1-CD2 3.77Å; F353-L385 HydrophobicContact CE2-CD1 4.2Å; F353-L385 HydrophobicContact CE2-CD2 4.03Å; F353-L385 HydrophobicContact CG-CD2 4.24Å; F353-L385 HydrophobicContact CZ-CD2 3.79Å; F353-V421 HydrophobicContact CE1-CG2 4.42Å; F353-V421 HydrophobicContact CZ-CG2 3.85Å; F353-V424 HydrophobicContact CD1-CG2 4.17Å; F353-V424 HydrophobicContact CE1-CG2 4.09Å
354	S	84.9	Confident	80.8	Confident	9 Å²	9	20.1 Å²	20.1	6%	0.063	12%	0.116	C	C	.	.	H	α-helix	trans	-66.5	-37.4	177.2	-62.8	0	0	0	0	112.2	R317 N350 I351 L352 S357 S358	R317-S354 PolarHBondContact NH1-O 3.08Å; N350-S354 WeakPolarHBondContact O-CB 3.44Å; N350-S354 PolarHBondContact O-N 2.9Å; N350-S354 PolarHBondContact O-OG 3.38Å; I351-S354 CarbonylContact O-C 3.51Å; I351-S354 WeakPolarHBondContact O-CB 3.46Å; I351-S354 PolarHBondContact O-N 2.72Å; L352-S354 VanDerWaalsContact C-N 3.27Å; L352-S354 PolarHBondContact O-N 3.4Å; S354-S357 PolarHBondContact O-N 2.95Å; S354-S358 WeakPolarHBondContact O-CB 3.48Å; S354-S358 PolarHBondContact O-N 3.12Å
355	L	87.5	Confident	80.8	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-51	175.8	-179.4	60.4	0	0	0	111	V328 V331 R332 I351 L352 S357 S358 Y359 A381	V328-L355 HydrophobicContact CG1-CD1 4.22Å; V331-L355 HydrophobicContact CB-CD1 4.13Å; V331-L355 HydrophobicContact CG1-CB 3.67Å; V331-L355 HydrophobicContact CG1-CD1 3.88Å; V331-L355 HydrophobicContact CG1-CG 4.32Å; R332-L355 HydrophobicContact CG-CD1 3.91Å; I351-L355 WeakPolarHBondContact O-CB 3.34Å; I351-L355 PolarHBondContact O-N 3.16Å; L352-L355 HydrophobicContact CD2-CD2 4.32Å; L352-L355 WeakPolarHBondContact O-CB 3.23Å; L352-L355 PolarHBondContact O-N 3.41Å; L355-S357 PolarHBondContact O-N 3.26Å; L355-S358 WeakPolarHBondContact CA-OG 3.19Å; L355-S358 PolarHBondContact O-N 3.11Å; L355-S358 VanDerWaalsContact O-N 3.08Å; L355-S358 PolarHBondContact O-OG 2.93Å; L355-Y359 HydrophobicContact CD1-CD2 4.28Å; L355-Y359 HydrophobicContact CD1-CE2 3.71Å; L355-Y359 HydrophobicContact CD2-CE2 4.17Å; L355-Y359 HydrophobicContact CG-CD2 4.11Å; L355-Y359 HydrophobicContact CG-CE2 3.59Å; L355-Y359 WeakPolarHBondContact O-CD2 3.44Å; L355-Y359 PolarHBondContact O-N 3.15Å; L355-A381 HydrophobicContact CD2-CB 3.8Å; L355-A381 HydrophobicContact CG-CB 4.32Å
356	I	86.8	Confident	80.5	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.6	-43.5	176.8	-63.4	163.5	0	0	0	110.3	L352 S358 Y359 F360 A381 L382 L385 V424	L352-I356 VanDerWaalsContact O-CG1 3.32Å; L352-I356 WeakPolarHBondContact O-CG1 3.48Å; L352-I356 PolarHBondContact O-N 2.78Å; I356-S358 VanDerWaalsContact C-N 3.33Å; I356-S358 PolarHBondContact O-N 3.2Å; I356-Y359 WeakPolarHBondContact O-CB 3.34Å; I356-Y359 PolarHBondContact O-N 2.74Å; I356-F360 HydrophobicContact CG2-CD2 4.18Å; I356-F360 HydrophobicContact CG2-CE2 3.61Å; I356-F360 HydrophobicContact CG2-CZ 4.15Å; I356-F360 WeakPolarHBondContact O-CD2 3.28Å; I356-F360 PolarHBondContact O-N 2.73Å; I356-A381 HydrophobicContact CG1-CB 3.94Å; I356-L382 HydrophobicContact CD1-CB 4.02Å; I356-L382 HydrophobicContact CD1-CD1 4.17Å; I356-L385 HydrophobicContact CD1-CD2 4.09Å; I356-V424 HydrophobicContact CB-CG1 4.39Å; I356-V424 HydrophobicContact CD1-CG1 4.05Å; I356-V424 HydrophobicContact CG2-CG1 3.46Å; I356-V424 VanDerWaalsContact CG2-CG1 3.46Å
357	S	86	Confident	80	Confident	37 Å²	37	29.5 Å²	29.5	26%	0.259	17%	0.174	S	C	.	.	H	α-helix	trans	-68.3	-32.9	179.6	-51.5	0	0	0	0	112.3	R317 F353 S354 L355 F360 D361	R317-S357 VanDerWaalsContact CZ-CB 3.4Å; R317-S357 VanDerWaalsContact NH1-CB 3.33Å; R317-S357 PolarHBondContact NH2-O 3.42Å; F353-S357 VanDerWaalsContact O-CB 3.3Å; F353-S357 WeakPolarHBondContact O-CB 3.44Å; F353-S357 PolarHBondContact O-N 3.2Å; F353-S357 PolarHBondContact O-OG 3.03Å; S354-S357 PolarHBondContact O-N 2.95Å; L355-S357 PolarHBondContact O-N 3.26Å; S357-F360 PolarHBondContact O-N 3.27Å; S357-D361 PolarHBondContact O-N 2.72Å
358	S	84.7	Confident	79.8	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-35.8	172.7	72.3	0	0	0	0	112.6	S354 L355 I356 F360 D361 C362	S354-S358 WeakPolarHBondContact O-CB 3.48Å; S354-S358 PolarHBondContact O-N 3.12Å; L355-S358 WeakPolarHBondContact CA-OG 3.19Å; L355-S358 PolarHBondContact O-N 3.11Å; L355-S358 VanDerWaalsContact O-N 3.08Å; L355-S358 PolarHBondContact O-OG 2.93Å; I356-S358 VanDerWaalsContact C-N 3.33Å; I356-S358 PolarHBondContact O-N 3.2Å; S358-F360 VanDerWaalsContact C-N 3.34Å; S358-F360 PolarHBondContact O-N 3.19Å; S358-D361 PolarHBondContact O-N 2.94Å; S358-C362 PolarHBondContact O-N 2.87Å
359	Y	85.9	Confident	79.4	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-39.1	173	-74.2	-64.6	0	0	0	112.4	V328 R332 L355 I356 D361 C362 L370 G377 A378 A381	V328-Y359 HydrophobicContact CG1-CD1 3.93Å; V328-Y359 HydrophobicContact CG1-CE1 3.44Å; V328-Y359 VanDerWaalsContact CG1-CE1 3.44Å; V328-Y359 HydrophobicContact CG2-CD1 4.23Å; R332-Y359 VanDerWaalsContact CZ-OH 3.28Å; R332-Y359 PolarHBondContact NE-OH 2.94Å; R332-Y359 VanDerWaalsContact NH2-CE1 3.34Å; R332-Y359 PolarHBondContact NH2-OH 3.42Å; L355-Y359 HydrophobicContact CD1-CD2 4.28Å; L355-Y359 HydrophobicContact CD1-CE2 3.71Å; L355-Y359 HydrophobicContact CD2-CE2 4.17Å; L355-Y359 HydrophobicContact CG-CD2 4.11Å; L355-Y359 HydrophobicContact CG-CE2 3.59Å; L355-Y359 WeakPolarHBondContact O-CD2 3.44Å; L355-Y359 PolarHBondContact O-N 3.15Å; I356-Y359 WeakPolarHBondContact O-CB 3.34Å; I356-Y359 PolarHBondContact O-N 2.74Å; Y359-D361 VanDerWaalsContact C-N 3.29Å; Y359-D361 PolarHBondContact O-N 3.02Å; Y359-C362 WeakPolarHBondContact O-CB 3.45Å; Y359-C362 PolarHBondContact O-N 3.01Å; Y359-L370 VanDerWaalsContact O-CD1 3.26Å; Y359-L370 WeakPolarHBondContact O-CD1 3.35Å; Y359-G377 VanDerWaalsContact CE2-C 3.49Å; Y359-G377 WeakPolarHBondContact CE2-O 3.34Å; Y359-A378 HydrophobicContact CD2-CB 3.7Å; Y359-A378 HydrophobicContact CE2-CB 4.38Å; Y359-A378 HydrophobicContact CG-CB 3.94Å; Y359-A381 HydrophobicContact CE2-CB 4.48Å
360	F	84.2	Confident	79.3	Confident	43 Å²	43	33.8 Å²	33.8	19%	0.189	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-35.6	174.5	-68.1	-50.9	0	0	0	112.4	I356 S357 S358 C362 V424 R427 L428 E431	I356-F360 HydrophobicContact CG2-CD2 4.18Å; I356-F360 HydrophobicContact CG2-CE2 3.61Å; I356-F360 HydrophobicContact CG2-CZ 4.15Å; I356-F360 WeakPolarHBondContact O-CD2 3.28Å; I356-F360 PolarHBondContact O-N 2.73Å; S357-F360 PolarHBondContact O-N 3.27Å; S358-F360 VanDerWaalsContact C-N 3.34Å; S358-F360 PolarHBondContact O-N 3.19Å; F360-C362 PolarHBondContact O-N 3.45Å; F360-V424 HydrophobicContact CE2-CG1 4.47Å; F360-R427 HydrophobicContact CD1-CG 4.35Å; F360-R427 HydrophobicContact CE1-CB 4.42Å; F360-R427 HydrophobicContact CE1-CG 3.74Å; F360-R427 HydrophobicContact CE2-CB 4.41Å; F360-R427 HydrophobicContact CE2-CG 4.1Å; F360-R427 HydrophobicContact CZ-CB 3.86Å; F360-R427 HydrophobicContact CZ-CG 3.58Å; F360-L428 HydrophobicContact CE1-CD2 3.56Å; F360-L428 HydrophobicContact CE1-CG 4.05Å; F360-L428 HydrophobicContact CZ-CD2 3.63Å; F360-L428 HydrophobicContact CZ-CG 3.67Å; F360-E431 HydrophobicContact CD1-CG 4.33Å; F360-E431 HydrophobicContact CE1-CG 4.08Å
361	D	81.7	Confident	79.4	Confident	23 Å²	23	37.8 Å²	37.8	12%	0.123	22%	0.219	C	C	.	.	H	α-helix	trans	-74.8	-10.7	179.2	-67.5	-31.6	0	0	0	113.3	R317 R318 R324 S357 S358 Y359 N363	R317-D361 WeakPolarHBondContact CG-OD2 3.46Å; R317-D361 IonicContact CZ-OD2 3.64Å; R317-D361 IonicContact NE-OD2 3.29Å; R317-D361 PolarHBondContact NE-OD2 3.48Å; R317-D361 IonicContact NH2-OD2 3.09Å; R317-D361 PolarHBondContact NH2-OD2 3.36Å; R318-D361 IonicContact CZ-OD1 3.21Å; R318-D361 IonicContact NE-OD1 3.37Å; R318-D361 IonicContact NE-OD2 2.69Å; R318-D361 IonicContact NH2-OD1 2.86Å; R318-D361 PolarHBondContact NH2-OD1 2.99Å; R318-D361 IonicContact NH2-OD2 3.68Å; R324-D361 WeakPolarHBondContact CD-O 3.24Å; R324-D361 PolarHBondContact NH1-O 2.95Å; S357-D361 PolarHBondContact O-N 2.72Å; S358-D361 PolarHBondContact O-N 2.94Å; Y359-D361 VanDerWaalsContact C-N 3.29Å; Y359-D361 PolarHBondContact O-N 3.02Å; D361-N363 PolarHBondContact O-N 3.22Å; D361-N363 VanDerWaalsContact O-N 3.16Å
362	C	78.2	Confident	79.3	Confident	16 Å²	16	40.6 Å²	40.6	11%	0.108	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.3	172.9	-70.4	0	0	0	0	111.9	S358 Y359 F360 L370	S358-C362 PolarHBondContact O-N 2.87Å; Y359-C362 WeakPolarHBondContact O-CB 3.45Å; Y359-C362 PolarHBondContact O-N 3.01Å; F360-C362 PolarHBondContact O-N 3.45Å; C362-L370 HydrophobicContact CB-CD1 4.32Å
363	N	74.7	Confident	79.2	Confident	41 Å²	41	49.2 Å²	49.2	22%	0.219	27%	0.269	C	S	.	.			trans	-99.9	119.4	175.3	-160.8	-21	0	0	0	111.8	R324 D361 K365 D368 C369	R324-N363 VanDerWaalsContact NH1-C 3.3Å; D361-N363 PolarHBondContact O-N 3.22Å; D361-N363 VanDerWaalsContact O-N 3.16Å; N363-K365 VanDerWaalsContact C-N 3.31Å; N363-K365 PolarHBondContact O-N 2.96Å; N363-K365 PolarHBondContact OD1-N 3.19Å; N363-K365 VanDerWaalsContact OD1-N 3.13Å; N363-K365 PolarHBondContact OD1-O 2.75Å; N363-D368 VanDerWaalsContact ND2-C 3.33Å; N363-D368 VanDerWaalsContact ND2-CB 3.33Å; N363-D368 WeakPolarHBondContact ND2-CB 3.33Å; N363-D368 PolarHBondContact ND2-O 3.17Å; N363-C369 PolarHBondContact ND2-O 3.23Å
364	P	69.6	Low	79.2	Confident	90 Å²	90	49.2 Å²	49.2	58%	0.584	27%	0.27	S	S	*	.	S	Bend	trans	-70.9	-24.7	178.1	23.2	-31.5	0	0	0	113.9	R324	R324-P364 VanDerWaalsContact NH1-CB 3.33Å; R324-P364 VanDerWaalsContact NH1-CD 3.28Å
365	K	70.7	Confident	79.4	Confident	132 Å²	132	48.8 Å²	48.8	57%	0.574	27%	0.267	S	S	*	.			trans	-106.3	114.3	-173.3	-72	170.1	174.7	177.6	0	108.8	N363 A367 D368	N363-K365 VanDerWaalsContact C-N 3.31Å; N363-K365 PolarHBondContact O-N 2.96Å; N363-K365 PolarHBondContact OD1-N 3.19Å; N363-K365 VanDerWaalsContact OD1-N 3.13Å; N363-K365 PolarHBondContact OD1-O 2.75Å; K365-A367 PolarHBondContact O-N 3.39Å; K365-D368 HydrophobicContact CB-CB 4.12Å; K365-D368 WeakPolarHBondContact CD-OD2 3.39Å; K365-D368 IonicContact NZ-OD2 3.8Å; K365-D368 PolarHBondContact O-N 3.31Å
366	S	65.1	Low	79.4	Confident	96 Å²	96	51.9 Å²	51.9	67%	0.671	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-19.5	177.3	-50.8	0	0	0	0	114.3	K434	S366-K434 PolarHBondContact O-NZ 3.24Å
367	A	62.4	Low	79.4	Confident	55 Å²	55	52.5 Å²	52.5	46%	0.455	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-23.6	179.5	0	0	0	0	0	113.6	K365	K365-A367 PolarHBondContact O-N 3.39Å
368	D	71	Confident	79.5	Confident	71 Å²	71	50.8 Å²	50.8	38%	0.38	28%	0.278	S	S	.	.	S	Bend	trans	-90.2	144.1	-175.7	-65.1	-3.9	0	0	0	109.1	N363 K365	N363-D368 VanDerWaalsContact ND2-C 3.33Å; N363-D368 VanDerWaalsContact ND2-CB 3.33Å; N363-D368 WeakPolarHBondContact ND2-CB 3.33Å; N363-D368 PolarHBondContact ND2-O 3.17Å; K365-D368 HydrophobicContact CB-CB 4.12Å; K365-D368 WeakPolarHBondContact CD-OD2 3.39Å; K365-D368 IonicContact NZ-OD2 3.8Å; K365-D368 PolarHBondContact O-N 3.31Å
369	C	73	Confident	79.6	Confident	37 Å²	37	50.7 Å²	50.7	25%	0.25	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65	147.8	179.9	67.8	0	0	0	0	112.5	N363 K434 I435 D438	N363-C369 PolarHBondContact ND2-O 3.23Å; C369-K434 HydrophobicContact CB-CB 4.19Å; C369-I435 HydrophobicContact CB-CG1 3.97Å; C369-D438 WeakPolarHBondContact CB-OD2 3.37Å; C369-D438 PolarHBondContact SG-OD2 3.05Å; C369-D438 VanDerWaalsContact SG-OD2 3.36Å
370	L	80.2	Confident	79.8	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.026	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.7	143.9	166.5	-173.3	61.9	0	0	0	110.4	Y359 C362 F372 W375 I435	Y359-L370 VanDerWaalsContact O-CD1 3.26Å; Y359-L370 WeakPolarHBondContact O-CD1 3.35Å; C362-L370 HydrophobicContact CB-CD1 4.32Å; L370-F372 PolarHBondContact O-N 3Å; L370-W375 HydrophobicContact CD2-CB 3.79Å; L370-W375 HydrophobicContact CD2-CG 4.47Å; L370-W375 HydrophobicContact CG-CB 4.23Å; L370-I435 WeakPolarHBondContact O-CD1 3.25Å; L370-I435 VanDerWaalsContact O-CG1 3.32Å; L370-I435 WeakPolarHBondContact O-CG1 3.27Å
371	L	82.9	Confident	79.9	Confident	110 Å²	110	51.2 Å²	51.2	58%	0.576	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-59.4	132.7	171.5	-70.7	168.3	0	0	0	109.7	F325 K373 S374 W375	F325-L371 HydrophobicContact CZ-CD1 4.18Å; L371-K373 PolarHBondContact O-N 3.37Å; L371-K373 VanDerWaalsContact O-N 3.09Å; L371-S374 WeakPolarHBondContact O-CA 3.44Å; L371-S374 WeakPolarHBondContact O-CB 3.42Å; L371-S374 PolarHBondContact O-N 3.18Å; L371-W375 PolarHBondContact O-N 3.32Å
372	F	83.2	Confident	80.3	Confident	59 Å²	59	50.1 Å²	50.1	26%	0.259	28%	0.277	S	S	.	.	H	α-helix	trans	-54.9	-35.4	-175.9	-176.9	-111.9	0	0	0	113.2	L370 W375 L376 I435 K449	L370-F372 PolarHBondContact O-N 3Å; F372-W375 HydrophobicContact CD2-CE3 4.19Å; F372-W375 AromaticContact CE2-CE3 4Å; F372-W375 HydrophobicContact CE2-CE3 4Å; F372-W375 HydrophobicContact CE2-CZ3 4.1Å; F372-W375 PolarHBondContact O-N 3.18Å; F372-L376 HydrophobicContact CZ-CD1 4.41Å; F372-L376 PolarHBondContact O-N 3.45Å; F372-I435 HydrophobicContact CD2-CG2 4.33Å; F372-K449 HydrophobicContact CD2-CB 4.43Å; F372-K449 HydrophobicContact CD2-CG 3.99Å; F372-K449 HydrophobicContact CE2-CB 4.31Å; F372-K449 HydrophobicContact CE2-CG 4.28Å; F372-K449 HydrophobicContact CG-CG 4.17Å
373	K	85.3	Confident	80.8	Confident	184 Å²	184	52.4 Å²	52.4	80%	0.8	28%	0.284	S	S	*	.	H	α-helix	trans	-64.4	-43	174.8	-66.5	-175.1	179.3	-179.8	0	112.9	L371 W375 L376 G377	L371-K373 PolarHBondContact O-N 3.37Å; L371-K373 VanDerWaalsContact O-N 3.09Å; K373-W375 VanDerWaalsContact C-N 3.34Å; K373-L376 PolarHBondContact O-N 2.97Å; K373-G377 PolarHBondContact O-N 2.71Å; K373-G377 VanDerWaalsContact O-N 3.08Å
374	S	85.1	Confident	81.4	Confident	13 Å²	13	52.3 Å²	52.3	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-37.3	176.8	-57.6	0	0	0	0	111.1	L371 G377 A378	L371-S374 WeakPolarHBondContact O-CA 3.44Å; L371-S374 WeakPolarHBondContact O-CB 3.42Å; L371-S374 PolarHBondContact O-N 3.18Å; S374-G377 PolarHBondContact O-N 2.88Å; S374-A378 WeakPolarHBondContact O-CB 3.45Å; S374-A378 PolarHBondContact O-N 3.43Å
375	W	89.3	Confident	82.2	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-44.9	174.2	-176.5	87.1	0	0	0	111.8	L370 L371 F372 K373 G377 A378 M379 L428 F432 I435 I456	L370-W375 HydrophobicContact CD2-CB 3.79Å; L370-W375 HydrophobicContact CD2-CG 4.47Å; L370-W375 HydrophobicContact CG-CB 4.23Å; L371-W375 PolarHBondContact O-N 3.32Å; F372-W375 HydrophobicContact CD2-CE3 4.19Å; F372-W375 AromaticContact CE2-CE3 4Å; F372-W375 HydrophobicContact CE2-CE3 4Å; F372-W375 HydrophobicContact CE2-CZ3 4.1Å; F372-W375 PolarHBondContact O-N 3.18Å; K373-W375 VanDerWaalsContact C-N 3.34Å; W375-G377 VanDerWaalsContact C-N 3.34Å; W375-G377 PolarHBondContact O-N 3.32Å; W375-A378 WeakPolarHBondContact O-CB 3.32Å; W375-A378 PolarHBondContact O-N 2.9Å; W375-A378 VanDerWaalsContact O-N 3.16Å; W375-M379 HydrophobicContact CD2-CG 3.89Å; W375-M379 HydrophobicContact CE3-CG 4.01Å; W375-M379 HydrophobicContact CH2-CE 4.04Å; W375-M379 HydrophobicContact CH2-CG 3.76Å; W375-M379 HydrophobicContact CH2-SD 4.27Å; W375-M379 HydrophobicContact CZ2-CE 3.97Å; W375-M379 HydrophobicContact CZ2-CG 3.6Å; W375-M379 HydrophobicContact CZ2-SD 3.75Å; W375-M379 HydrophobicContact CZ3-CG 3.96Å; W375-M379 VanDerWaalsContact O-CG 3.29Å; W375-M379 WeakPolarHBondContact O-CG 3.31Å; W375-M379 PolarHBondContact O-N 2.9Å; W375-L428 PolarHBondContact NE1-O 3.06Å; W375-F432 AromaticContact CH2-CD2 3.68Å; W375-F432 HydrophobicContact CH2-CD2 3.68Å; W375-F432 HydrophobicContact CH2-CE2 4.09Å; W375-F432 HydrophobicContact CH2-CG 4.37Å; W375-F432 HydrophobicContact CZ2-CB 3.78Å; W375-F432 AromaticContact CZ2-CD2 3.58Å; W375-F432 HydrophobicContact CZ2-CD2 3.58Å; W375-F432 HydrophobicContact CZ2-CE2 4.42Å; W375-F432 AromaticContact CZ2-CG 3.91Å; W375-F432 HydrophobicContact CZ2-CG 3.91Å; W375-F432 HydrophobicContact CZ3-CD2 4.25Å; W375-I435 HydrophobicContact CB-CD1 3.75Å; W375-I435 HydrophobicContact CD2-CD1 4.27Å; W375-I435 HydrophobicContact CG-CD1 3.67Å; W375-I456 HydrophobicContact CH2-CD1 3.68Å; W375-I456 HydrophobicContact CH2-CG1 3.6Å; W375-I456 HydrophobicContact CZ2-CD1 3.46Å; W375-I456 VanDerWaalsContact CZ2-CD1 3.46Å; W375-I456 HydrophobicContact CZ2-CG1 3.55Å
376	L	88.1	Confident	82.8	Confident	67 Å²	67	41.7 Å²	41.7	35%	0.351	23%	0.228	S	C	.	.	H	α-helix	trans	-59.7	-45	175.4	-156.9	86.6	0	0	0	111.5	F372 K373 A378 M379 D380	F372-L376 HydrophobicContact CZ-CD1 4.41Å; F372-L376 PolarHBondContact O-N 3.45Å; K373-L376 PolarHBondContact O-N 2.97Å; L376-A378 VanDerWaalsContact C-N 3.3Å; L376-A378 PolarHBondContact O-N 3.39Å; L376-M379 WeakPolarHBondContact O-CB 3.49Å; L376-M379 PolarHBondContact O-N 3.29Å; L376-M379 VanDerWaalsContact O-N 3.15Å; L376-D380 PolarHBondContact O-N 3.41Å
377	G	86.5	Confident	83.8	Confident	14 Å²	14	41.3 Å²	41.3	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-63.8	-31.8	176.1	0	0	0	0	0	113.9	Y359 K373 S374 W375 A381	Y359-G377 VanDerWaalsContact CE2-C 3.49Å; Y359-G377 WeakPolarHBondContact CE2-O 3.34Å; K373-G377 PolarHBondContact O-N 2.71Å; K373-G377 VanDerWaalsContact O-N 3.08Å; S374-G377 PolarHBondContact O-N 2.88Å; W375-G377 VanDerWaalsContact C-N 3.34Å; W375-G377 PolarHBondContact O-N 3.32Å; G377-A381 WeakPolarHBondContact O-CB 3.36Å; G377-A381 PolarHBondContact O-N 2.9Å
378	A	88.3	Confident	84.7	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-72.1	-37.1	172.7	0	0	0	0	0	112	Y359 S374 W375 L376 A381 L382 L428	Y359-A378 HydrophobicContact CD2-CB 3.7Å; Y359-A378 HydrophobicContact CE2-CB 4.38Å; Y359-A378 HydrophobicContact CG-CB 3.94Å; S374-A378 WeakPolarHBondContact O-CB 3.45Å; S374-A378 PolarHBondContact O-N 3.43Å; W375-A378 WeakPolarHBondContact O-CB 3.32Å; W375-A378 PolarHBondContact O-N 2.9Å; W375-A378 VanDerWaalsContact O-N 3.16Å; L376-A378 VanDerWaalsContact C-N 3.3Å; L376-A378 PolarHBondContact O-N 3.39Å; A378-A381 PolarHBondContact O-N 2.98Å; A378-L382 PolarHBondContact O-N 2.93Å; A378-L428 HydrophobicContact CB-CD2 3.84Å
379	M	87.3	Confident	85.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-40.8	176.8	-72.9	-65.1	-73	0	0	112.4	W375 L376 L382 R383 L428 T455 I456 I459	W375-M379 HydrophobicContact CD2-CG 3.89Å; W375-M379 HydrophobicContact CE3-CG 4.01Å; W375-M379 HydrophobicContact CH2-CE 4.04Å; W375-M379 HydrophobicContact CH2-CG 3.76Å; W375-M379 HydrophobicContact CH2-SD 4.27Å; W375-M379 HydrophobicContact CZ2-CE 3.97Å; W375-M379 HydrophobicContact CZ2-CG 3.6Å; W375-M379 HydrophobicContact CZ2-SD 3.75Å; W375-M379 HydrophobicContact CZ3-CG 3.96Å; W375-M379 VanDerWaalsContact O-CG 3.29Å; W375-M379 WeakPolarHBondContact O-CG 3.31Å; W375-M379 PolarHBondContact O-N 2.9Å; L376-M379 WeakPolarHBondContact O-CB 3.49Å; L376-M379 PolarHBondContact O-N 3.29Å; L376-M379 VanDerWaalsContact O-N 3.15Å; M379-L382 PolarHBondContact O-N 3.28Å; M379-R383 PolarHBondContact O-N 2.92Å; M379-L428 HydrophobicContact SD-CB 4.12Å; M379-L428 HydrophobicContact SD-CD1 3.79Å; M379-L428 HydrophobicContact SD-CG 4.35Å; M379-T455 HydrophobicContact CB-CG2 4.37Å; M379-T455 HydrophobicContact CE-CG2 4.1Å; M379-I456 HydrophobicContact CE-CB 4.14Å; M379-I456 HydrophobicContact CE-CG1 3.47Å; M379-I456 VanDerWaalsContact CE-CG1 3.47Å; M379-I459 HydrophobicContact CB-CD1 4.37Å; M379-I459 HydrophobicContact CE-CD1 3.37Å; M379-I459 HydrophobicContact SD-CD1 4.34Å
380	D	89.3	Confident	85.5	Confident	60 Å²	60	39 Å²	39	32%	0.321	19%	0.193	S	C	.	.	H	α-helix	trans	-65.3	-43	174	-69.2	-33.6	0	0	0	110.8	L376 L382 R383 D384	L376-D380 PolarHBondContact O-N 3.41Å; D380-L382 VanDerWaalsContact C-N 3.29Å; D380-L382 PolarHBondContact O-N 3.31Å; D380-R383 WeakPolarHBondContact O-CB 3.3Å; D380-R383 PolarHBondContact O-N 3.29Å; D380-R383 IonicContact OD1-CZ 3.95Å; D380-R383 IonicContact OD1-NH1 3.28Å; D380-R383 PolarHBondContact OD1-NH1 3.45Å; D380-R383 IonicContact OD1-NH2 3.26Å; D380-D384 PolarHBondContact O-N 3.26Å
381	A	87.3	Confident	85.6	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-35.7	173.3	0	0	0	0	0	113.2	L352 L355 I356 Y359 G377 A378 L385	L352-A381 HydrophobicContact CD2-CB 4.25Å; L355-A381 HydrophobicContact CD2-CB 3.8Å; L355-A381 HydrophobicContact CG-CB 4.32Å; I356-A381 HydrophobicContact CG1-CB 3.94Å; Y359-A381 HydrophobicContact CE2-CB 4.48Å; G377-A381 WeakPolarHBondContact O-CB 3.36Å; G377-A381 PolarHBondContact O-N 2.9Å; A378-A381 PolarHBondContact O-N 2.98Å; A381-L385 WeakPolarHBondContact O-CB 3.45Å; A381-L385 PolarHBondContact O-N 2.93Å
382	L	88.3	Confident	85.1	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-70.4	-40.2	174.6	179.3	62.4	0	0	0	112	I356 A378 M379 D380 D384 L385 I386 V421 V424 L425 L428 I459	I356-L382 HydrophobicContact CD1-CB 4.02Å; I356-L382 HydrophobicContact CD1-CD1 4.17Å; A378-L382 PolarHBondContact O-N 2.93Å; M379-L382 PolarHBondContact O-N 3.28Å; D380-L382 VanDerWaalsContact C-N 3.29Å; D380-L382 PolarHBondContact O-N 3.31Å; L382-D384 VanDerWaalsContact C-N 3.33Å; L382-L385 HydrophobicContact CD1-CD2 4.25Å; L382-L385 WeakPolarHBondContact O-CB 3.29Å; L382-L385 PolarHBondContact O-N 3.39Å; L382-I386 HydrophobicContact CD1-CD1 4.08Å; L382-I386 HydrophobicContact CD1-CG1 4.26Å; L382-I386 HydrophobicContact CG-CD1 3.93Å; L382-I386 WeakPolarHBondContact O-CG1 3.41Å; L382-I386 PolarHBondContact O-N 3.19Å; L382-V421 HydrophobicContact CD1-CG1 3.81Å; L382-V424 HydrophobicContact CD1-CG1 4.28Å; L382-L425 HydrophobicContact CD2-CB 4.23Å; L382-L425 HydrophobicContact CD2-CD1 3.88Å; L382-L428 HydrophobicContact CB-CD1 4.2Å; L382-L428 HydrophobicContact CD2-CD1 3.57Å; L382-L428 HydrophobicContact CG-CD1 4.46Å; L382-I459 HydrophobicContact CD2-CG2 3.81Å; L382-I459 HydrophobicContact CG-CG2 4.21Å
383	R	90	Very high	84.3	Confident	65 Å²	65	43.6 Å²	43.6	25%	0.245	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-48	174.7	-176	-172.4	-64.4	128.4	3.5	110.4	M379 D380 L385 I386 Q387 I459 L462	M379-R383 PolarHBondContact O-N 2.92Å; D380-R383 WeakPolarHBondContact O-CB 3.3Å; D380-R383 PolarHBondContact O-N 3.29Å; D380-R383 IonicContact OD1-CZ 3.95Å; D380-R383 IonicContact OD1-NH1 3.28Å; D380-R383 PolarHBondContact OD1-NH1 3.45Å; D380-R383 IonicContact OD1-NH2 3.26Å; R383-L385 VanDerWaalsContact C-N 3.29Å; R383-L385 PolarHBondContact O-N 3.3Å; R383-I386 PolarHBondContact O-N 3.27Å; R383-Q387 WeakPolarHBondContact O-CG 3.29Å; R383-Q387 PolarHBondContact O-N 3.43Å; R383-I459 HydrophobicContact CB-CD1 4.19Å; R383-I459 HydrophobicContact CB-CG1 4.21Å; R383-L462 HydrophobicContact CG-CD1 4.35Å
384	D	86.5	Confident	83.4	Confident	38 Å²	38	40.6 Å²	40.6	20%	0.203	22%	0.218	C	C	.	.	H	α-helix	trans	-62.1	-40	178.9	-61.3	-17	0	0	0	110.8	R335 L352 D380 L382 Q387 L388	R335-D384 IonicContact CZ-OD2 3.27Å; R335-D384 IonicContact NH1-OD2 2.58Å; R335-D384 PolarHBondContact NH1-OD2 3.36Å; R335-D384 IonicContact NH2-OD2 2.95Å; R335-D384 PolarHBondContact NH2-OD2 2.91Å; L352-D384 HydrophobicContact CD1-CB 4.43Å; D380-D384 PolarHBondContact O-N 3.26Å; L382-D384 VanDerWaalsContact C-N 3.33Å; D384-Q387 PolarHBondContact O-N 3.03Å; D384-L388 WeakPolarHBondContact O-CB 3.32Å; D384-L388 VanDerWaalsContact O-CG 3.28Å; D384-L388 WeakPolarHBondContact O-CG 3.37Å; D384-L388 PolarHBondContact O-N 3.14Å
385	L	85.6	Confident	82.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-45.9	175	178.4	63.5	0	0	0	111.9	L352 F353 I356 A381 L382 R383 L388 L389	L352-L385 HydrophobicContact CB-CB 4.2Å; L352-L385 HydrophobicContact CB-CD1 4.08Å; L352-L385 HydrophobicContact CD1-CB 3.96Å; L352-L385 HydrophobicContact CD1-CD1 4.21Å; F353-L385 HydrophobicContact CD1-CD2 4Å; F353-L385 HydrophobicContact CD2-CD1 4.37Å; F353-L385 HydrophobicContact CD2-CD2 4.25Å; F353-L385 HydrophobicContact CE1-CD2 3.77Å; F353-L385 HydrophobicContact CE2-CD1 4.2Å; F353-L385 HydrophobicContact CE2-CD2 4.03Å; F353-L385 HydrophobicContact CG-CD2 4.24Å; F353-L385 HydrophobicContact CZ-CD2 3.79Å; I356-L385 HydrophobicContact CD1-CD2 4.09Å; A381-L385 WeakPolarHBondContact O-CB 3.45Å; A381-L385 PolarHBondContact O-N 2.93Å; L382-L385 HydrophobicContact CD1-CD2 4.25Å; L382-L385 WeakPolarHBondContact O-CB 3.29Å; L382-L385 PolarHBondContact O-N 3.39Å; R383-L385 VanDerWaalsContact C-N 3.29Å; R383-L385 PolarHBondContact O-N 3.3Å; L385-L388 PolarHBondContact O-N 2.92Å; L385-L389 HydrophobicContact CD1-CD1 4.08Å; L385-L389 HydrophobicContact CD1-CG 4.34Å; L385-L389 HydrophobicContact CG-CD1 4.03Å; L385-L389 WeakPolarHBondContact O-CB 3.49Å; L385-L389 WeakPolarHBondContact O-CG 3.48Å; L385-L389 PolarHBondContact O-N 3.33Å
386	I	84.5	Confident	81.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-40	179.8	-66.8	163.5	0	0	0	110.8	L382 R383 L389 L390 V421 I459 L462 L463	L382-I386 HydrophobicContact CD1-CD1 4.08Å; L382-I386 HydrophobicContact CD1-CG1 4.26Å; L382-I386 HydrophobicContact CG-CD1 3.93Å; L382-I386 WeakPolarHBondContact O-CG1 3.41Å; L382-I386 PolarHBondContact O-N 3.19Å; R383-I386 PolarHBondContact O-N 3.27Å; I386-L389 PolarHBondContact O-N 3.01Å; I386-L390 HydrophobicContact CG2-CD1 4.02Å; I386-L390 HydrophobicContact CG2-CG 4.41Å; I386-L390 WeakPolarHBondContact O-CG 3.48Å; I386-L390 PolarHBondContact O-N 3.42Å; I386-V421 HydrophobicContact CD1-CG1 4.23Å; I386-V421 HydrophobicContact CG1-CG1 3.84Å; I386-I459 HydrophobicContact CD1-CG2 3.7Å; I386-L462 HydrophobicContact CG2-CB 3.92Å; I386-L463 HydrophobicContact CD1-CB 4.37Å; I386-L463 HydrophobicContact CD1-CD1 4.48Å
387	Q	85.8	Confident	79.7	Confident	87 Å²	87	42.3 Å²	42.3	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-46.9	175.9	-73.9	178.8	-17.6	0	0	111.6	R383 D384 L389 L390 D391	R383-Q387 WeakPolarHBondContact O-CG 3.29Å; R383-Q387 PolarHBondContact O-N 3.43Å; D384-Q387 PolarHBondContact O-N 3.03Å; Q387-L389 PolarHBondContact O-N 2.96Å; Q387-L390 PolarHBondContact O-N 2.95Å; Q387-L390 VanDerWaalsContact O-N 3.12Å; Q387-D391 PolarHBondContact O-N 3.35Å
388	L	82.1	Confident	78.5	Confident	48 Å²	48	43.1 Å²	43.1	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-59.8	-33.4	175.5	-73.7	172.6	0	0	0	113	L348 L352 D384 L385 N392	L348-L388 HydrophobicContact CB-CD1 4.26Å; L352-L388 HydrophobicContact CD1-CD1 3.45Å; L352-L388 VanDerWaalsContact CD1-CD1 3.45Å; D384-L388 WeakPolarHBondContact O-CB 3.32Å; D384-L388 VanDerWaalsContact O-CG 3.28Å; D384-L388 WeakPolarHBondContact O-CG 3.37Å; D384-L388 PolarHBondContact O-N 3.14Å; L385-L388 PolarHBondContact O-N 2.92Å; L388-N392 WeakPolarHBondContact O-CB 3.35Å; L388-N392 PolarHBondContact O-N 3.43Å; L388-N392 PolarHBondContact O-ND2 3.17Å
389	L	80.1	Confident	77.2	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-78.8	-27.9	177.8	-70.9	172.7	0	0	0	113.3	L385 I386 Q387 N392 V395 C397 V421 Y466	L385-L389 HydrophobicContact CD1-CD1 4.08Å; L385-L389 HydrophobicContact CD1-CG 4.34Å; L385-L389 HydrophobicContact CG-CD1 4.03Å; L385-L389 WeakPolarHBondContact O-CB 3.49Å; L385-L389 WeakPolarHBondContact O-CG 3.48Å; L385-L389 PolarHBondContact O-N 3.33Å; I386-L389 PolarHBondContact O-N 3.01Å; Q387-L389 PolarHBondContact O-N 2.96Å; L389-N392 CarbonylContact O-C 3.5Å; L389-V395 HydrophobicContact CD2-CB 4.18Å; L389-V395 HydrophobicContact CD2-CG1 3.97Å; L389-C397 WeakPolarHBondContact CD2-SG 3.23Å; L389-V421 HydrophobicContact CD1-CG2 3.64Å; L389-Y466 HydrophobicContact CB-CD2 4.09Å; L389-Y466 HydrophobicContact CB-CE2 3.48Å; L389-Y466 VanDerWaalsContact CB-CE2 3.48Å; L389-Y466 HydrophobicContact CD1-CE2 4.47Å; L389-Y466 HydrophobicContact CG-CE2 4.47Å
390	L	80.9	Confident	75.7	Confident	61 Å²	61	55.7 Å²	55.7	32%	0.319	29%	0.292	S	S	.	.	H	α-helix	trans	-71.3	-39.9	171	-77.7	167.4	0	0	0	111.3	I386 Q387 N392 L462 Y466	I386-L390 HydrophobicContact CG2-CD1 4.02Å; I386-L390 HydrophobicContact CG2-CG 4.41Å; I386-L390 WeakPolarHBondContact O-CG 3.48Å; I386-L390 PolarHBondContact O-N 3.42Å; Q387-L390 PolarHBondContact O-N 2.95Å; Q387-L390 VanDerWaalsContact O-N 3.12Å; L390-N392 VanDerWaalsContact C-N 3.28Å; L390-N392 PolarHBondContact O-N 2.9Å; L390-L462 HydrophobicContact CD1-CD2 4.47Å; L390-Y466 HydrophobicContact CD2-CD2 4.08Å; L390-Y466 HydrophobicContact CD2-CG 4.46Å; L390-Y466 HydrophobicContact CG-CD2 4.23Å
391	D	81.6	Confident	74.2	Confident	122 Å²	122	53.4 Å²	53.4	65%	0.652	28%	0.28	S	S	*	.	H	α-helix	trans	-70.1	-26.3	178.8	-66.2	-22.1	0	0	0	112.3	Q387 P393	Q387-D391 PolarHBondContact O-N 3.35Å; D391-P393 WeakPolarHBondContact O-CD 3.37Å
392	N	71.3	Confident	72.8	Confident	54 Å²	54	55.4 Å²	55.4	29%	0.289	29%	0.294	S	S	.	.			trans	-121.8	89.3	-177.1	-60.3	-78.3	0	0	0	111.8	L388 L389 L390 D394 V395 R470	L388-N392 WeakPolarHBondContact O-CB 3.35Å; L388-N392 PolarHBondContact O-N 3.43Å; L388-N392 PolarHBondContact O-ND2 3.17Å; L389-N392 CarbonylContact O-C 3.5Å; L390-N392 VanDerWaalsContact C-N 3.28Å; L390-N392 PolarHBondContact O-N 2.9Å; N392-D394 PolarHBondContact O-N 3.43Å; N392-V395 HydrophobicContact CB-CG2 3.98Å; N392-R470 PolarHBondContact O-NH2 3.17Å
393	P	67.7	Low	71.3	Confident	93 Å²	93	60.3 Å²	60.3	60%	0.604	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.7	179.7	26	-33.9	0	0	0	113.5	D391 V395 R470	D391-P393 WeakPolarHBondContact O-CD 3.37Å; P393-V395 PolarHBondContact O-N 2.89Å; P393-R470 PolarHBondContact O-NH2 3.48Å
394	D	65.4	Low	69.4	Low	121 Å²	121	66.1 Å²	66.1	65%	0.647	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-6.8	-175.3	-60.2	-23.7	0	0	0	114.6	N392 L396	N392-D394 PolarHBondContact O-N 3.43Å; D394-L396 PolarHBondContact O-N 3.33Å
395	V	64.8	Low	67.8	Low	3 Å²	3	69 Å²	69	2%	0.018	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	94.1	-175.4	-175.6	0	0	0	0	111.3	P345 L389 N392 P393 C397 W415 L417 R470	P345-V395 HydrophobicContact CG-CG2 4.5Å; L389-V395 HydrophobicContact CD2-CB 4.18Å; L389-V395 HydrophobicContact CD2-CG1 3.97Å; N392-V395 HydrophobicContact CB-CG2 3.98Å; P393-V395 PolarHBondContact O-N 2.89Å; V395-C397 PolarHBondContact O-N 3.32Å; V395-W415 CarbonylContact C-O 3.59Å; V395-W415 WeakPolarHBondContact CA-O 3.43Å; V395-W415 HydrophobicContact CB-CB 4.3Å; V395-W415 HydrophobicContact CG1-CB 4.3Å; V395-W415 HydrophobicContact CG2-CB 3.98Å; V395-W415 HydrophobicContact CG2-CG 4.39Å; V395-L417 HydrophobicContact CG1-CB 4.46Å; V395-L417 HydrophobicContact CG1-CD1 3.41Å; V395-L417 VanDerWaalsContact CG1-CD1 3.41Å; V395-L417 HydrophobicContact CG1-CG 3.75Å; V395-R470 PolarHBondContact O-NH1 3.14Å; V395-R470 PolarHBondContact O-NH2 3.05Å
396	L	61.8	Low	66.5	Low	88 Å²	88	71.1 Å²	71.1	46%	0.461	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	110.4	177.3	-63.4	174.9	0	0	0	111.2	D394 I401 W415 K416 L417	D394-L396 PolarHBondContact O-N 3.33Å; L396-I401 HydrophobicContact CB-CD1 4.41Å; L396-I401 WeakPolarHBondContact O-CD1 3.5Å; L396-W415 PolarHBondContact N-O 2.73Å; L396-K416 HydrophobicContact CB-CG 4.32Å; L396-K416 CarbonylContact O-C 3.58Å; L396-K416 WeakPolarHBondContact O-CA 3.33Å; L396-L417 PolarHBondContact O-N 3.26Å
397	C	59.5	Low	65.3	Low	25 Å²	25	71.9 Å²	71.9	17%	0.169	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.6	171.9	-65.8	0	0	0	0	108.6	L389 V395 L417	L389-C397 WeakPolarHBondContact CD2-SG 3.23Å; V395-C397 PolarHBondContact O-N 3.32Å; C397-L417 WeakPolarHBondContact CA-O 3.44Å
398	S	59.7	Low	64	Low	32 Å²	32	68.4 Å²	68.4	22%	0.224	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.6	173.1	175.2	0	0	0	0	110.7	E400 L417	S398-E400 VanDerWaalsContact C-N 3.25Å; S398-E400 PolarHBondContact OG-N 3.43Å; S398-L417 PolarHBondContact N-O 3.3Å
399	I	61.1	Low	62.8	Low	92 Å²	92	68.7 Å²	68.7	47%	0.472	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-30.4	173.6	-57.6	175.4	0	0	0	110.7	I401 C420	I399-I401 PolarHBondContact O-N 2.85Å; I399-C420 HydrophobicContact CD1-CB 3.61Å; I399-C420 HydrophobicContact CG1-CB 3.43Å; I399-C420 VanDerWaalsContact CG1-CB 3.43Å
400	E	56.2	Low	61.7	Low	171 Å²	171	72.1 Å²	72.1	80%	0.799	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.2	-173.9	-59.8	-174.8	165.1	0	0	113.1	S398 S402	S398-E400 VanDerWaalsContact C-N 3.25Å; S398-E400 PolarHBondContact OG-N 3.43Å; E400-S402 PolarHBondContact O-N 2.93Å
401	I	58.8	Low	60.8	Low	12 Å²	12	74.3 Å²	74.3	6%	0.062	40%	0.401	C	S	.	.	S	Bend	trans	-78.8	109.5	177.2	-60.9	167.5	0	0	0	107.6	L396 I399 Q405 K416	L396-I401 HydrophobicContact CB-CD1 4.41Å; L396-I401 WeakPolarHBondContact O-CD1 3.5Å; I399-I401 PolarHBondContact O-N 2.85Å; I401-Q405 HydrophobicContact CG2-CB 3.73Å; I401-K416 HydrophobicContact CD1-CB 3.93Å; I401-K416 HydrophobicContact CD1-CD 4.29Å; I401-K416 HydrophobicContact CD1-CG 3.94Å; I401-K416 HydrophobicContact CG1-CD 4.42Å; I401-K416 HydrophobicContact CG2-CB 3.87Å; I401-K416 HydrophobicContact CG2-CD 4.36Å
402	S	56.4	Low	59.4	Low	44 Å²	44	77.6 Å²	77.6	31%	0.308	41%	0.412	S	S	.	.			trans	-64.8	160	174.2	64.8	0	0	0	0	111.6	E400 E404 Q405 Q406	E400-S402 PolarHBondContact O-N 2.93Å; S402-E404 PolarHBondContact O-N 3.41Å; S402-Q405 PolarHBondContact O-N 3.22Å; S402-Q405 WeakPolarHBondContact OG-CG 3.37Å; S402-Q406 PolarHBondContact O-N 2.93Å
403	D	56.9	Low	58.7	Low	104 Å²	104	79.8 Å²	79.8	56%	0.556	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.5	177	-66	-31.1	0	0	0	112.5	Q406 R418	D403-Q406 WeakPolarHBondContact O-CB 3.43Å; D403-R418 WeakPolarHBondContact OD1-CD 3.49Å; D403-R418 IonicContact OD1-CZ 2.89Å; D403-R418 IonicContact OD1-NE 2.63Å; D403-R418 IonicContact OD1-NH1 3.89Å; D403-R418 PolarHBondContact OD1-NH1 3.06Å; D403-R418 IonicContact OD2-CZ 3.84Å; D403-R418 IonicContact OD2-NH1 3.49Å; D403-R418 PolarHBondContact OD2-NH1 3.21Å
404	E	50.1	Low	58.3	Low	187 Å²	187	78.8 Å²	78.8	87%	0.874	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.6	178.1	-60.8	-180	170.7	0	0	113.2	S402 Q406	S402-E404 PolarHBondContact O-N 3.41Å; E404-Q406 VanDerWaalsContact C-N 3.34Å
405	Q	54.1	Low	58.2	Low	98 Å²	98	74.8 Å²	74.8	46%	0.458	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.4	176.6	-66.6	179.3	6.5	0	0	112.2	I401 S402 N407 K416	I401-Q405 HydrophobicContact CG2-CB 3.73Å; S402-Q405 PolarHBondContact O-N 3.22Å; S402-Q405 WeakPolarHBondContact OG-CG 3.37Å; Q405-N407 PolarHBondContact O-N 2.91Å; Q405-K416 VanDerWaalsContact O-CB 3.28Å; Q405-K416 WeakPolarHBondContact O-CB 3.5Å
406	Q	58.6	Low	58.1	Low	45 Å²	45	77.7 Å²	77.7	21%	0.21	41%	0.405	C	S	.	.			trans	-73.3	98.6	178.9	-163.5	-170.7	-6.1	0	0	109.5	N350 S402 D403 E404 V408 K416	N350-Q406 PolarHBondContact ND2-NE2 2.93Å; S402-Q406 PolarHBondContact O-N 2.93Å; D403-Q406 WeakPolarHBondContact O-CB 3.43Å; E404-Q406 VanDerWaalsContact C-N 3.34Å; Q406-V408 HydrophobicContact CG-CG2 3.66Å; Q406-V408 PolarHBondContact O-N 3.17Å; Q406-K416 WeakPolarHBondContact CA-O 3.47Å; Q406-K416 VanDerWaalsContact CG-O 3.23Å; Q406-K416 WeakPolarHBondContact CG-O 3.49Å
407	N	57.7	Low	58.2	Low	16 Å²	16	73.5 Å²	73.5	9%	0.086	38%	0.383	C	S	.	.			trans	-92.1	100.2	177.1	-173.4	32.1	0	0	0	110.1	Q405 D410 L413 K416	Q405-N407 PolarHBondContact O-N 2.91Å; N407-D410 PolarHBondContact ND2-O 2.78Å; N407-D410 WeakPolarHBondContact OD1-CB 3.28Å; N407-D410 PolarHBondContact OD1-N 3.01Å; N407-L413 HydrophobicContact CB-CB 4.5Å; N407-L413 WeakPolarHBondContact ND2-CB 3.38Å; N407-L413 PolarHBondContact ND2-O 3.2Å; N407-K416 PolarHBondContact N-O 2.97Å
408	V	60.5	Low	58.2	Low	13 Å²	13	77.8 Å²	77.8	8%	0.079	40%	0.396	C	S	.	.	S	Bend	trans	-104.7	-19	179	-171.3	0	0	0	0	111.7	N344 L347 Q406	N344-V408 PolarHBondContact ND2-O 2.88Å; L347-V408 HydrophobicContact CB-CG1 3.79Å; L347-V408 HydrophobicContact CD1-CG1 3.62Å; L347-V408 HydrophobicContact CG-CG1 4.3Å; Q406-V408 HydrophobicContact CG-CG2 3.66Å; Q406-V408 PolarHBondContact O-N 3.17Å
409	T	56.4	Low	58.6	Low	54 Å²	54	77 Å²	77	33%	0.331	39%	0.392	S	S	.	.	S	Bend	trans	-108.9	-32.1	-168.9	35.2	0	0	0	0	114.1	Q304 P411	Q304-T409 HydrophobicContact CG-CG2 3.84Å; T409-P411 WeakPolarHBondContact O-CD 3.42Å
410	D	57.1	Low	59.2	Low	80 Å²	80	73.3 Å²	73.3	43%	0.428	38%	0.375	S	S	.	.			trans	-101.6	116.4	-169	-61.2	-17.2	0	0	0	112	N407 Q412	N407-D410 PolarHBondContact ND2-O 2.78Å; N407-D410 WeakPolarHBondContact OD1-CB 3.28Å; N407-D410 PolarHBondContact OD1-N 3.01Å; D410-Q412 PolarHBondContact O-N 2.75Å
411	P	60.5	Low	60.4	Low	107 Å²	107	65.5 Å²	65.5	70%	0.695	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-2.4	179	25.7	-32.7	0	0	0	114.8	T409 W415	T409-P411 WeakPolarHBondContact O-CD 3.42Å; P411-W415 HydrophobicContact CB-CH2 4.32Å; P411-W415 HydrophobicContact CB-CZ2 4.19Å
412	Q	52.8	Low	61.6	Low	190 Å²	190	65.1 Å²	65.1	89%	0.888	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-18.5	-175.9	-66.5	-168.9	-11.1	0	0	114.7	D410	D410-Q412 PolarHBondContact O-N 2.75Å
413	L	56.8	Low	63	Low	101 Å²	101	65.2 Å²	65.2	53%	0.529	34%	0.337	S	S	.	.	S	Bend	trans	-110.2	146.3	-179	-72.3	158.3	0	0	0	108.6	N407 W415	N407-L413 HydrophobicContact CB-CB 4.5Å; N407-L413 WeakPolarHBondContact ND2-CB 3.38Å; N407-L413 PolarHBondContact ND2-O 3.2Å; L413-W415 PolarHBondContact O-N 2.87Å
414	P	60.1	Low	64.5	Low	72 Å²	72	61.1 Å²	61.1	47%	0.468	32%	0.316	S	S	.	.			trans	-54.9	133.5	-177.8	23	-33.5	0	0	0	110.2	K416	P414-K416 PolarHBondContact O-N 3.05Å
415	W	62.6	Low	66.3	Low	37 Å²	37	52.5 Å²	52.5	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	111.5	-179.9	-60.5	109.3	0	0	0	108.5	N344 A346 V395 L396 P411 L413	N344-W415 HydrophobicContact CB-CH2 4.2Å; N344-W415 HydrophobicContact CB-CZ3 4.35Å; N344-W415 WeakPolarHBondContact ND2-CH2 3.26Å; A346-W415 HydrophobicContact CB-CB 4.23Å; A346-W415 HydrophobicContact CB-CD2 4.04Å; A346-W415 HydrophobicContact CB-CE3 3.5Å; A346-W415 VanDerWaalsContact CB-CE3 3.5Å; A346-W415 HydrophobicContact CB-CG 4.36Å; A346-W415 HydrophobicContact CB-CZ3 4.22Å; V395-W415 CarbonylContact C-O 3.59Å; V395-W415 WeakPolarHBondContact CA-O 3.43Å; V395-W415 HydrophobicContact CB-CB 4.3Å; V395-W415 HydrophobicContact CG1-CB 4.3Å; V395-W415 HydrophobicContact CG2-CB 3.98Å; V395-W415 HydrophobicContact CG2-CG 4.39Å; L396-W415 PolarHBondContact N-O 2.73Å; P411-W415 HydrophobicContact CB-CH2 4.32Å; P411-W415 HydrophobicContact CB-CZ2 4.19Å; L413-W415 PolarHBondContact O-N 2.87Å
416	K	63.3	Low	68	Low	63 Å²	63	49.7 Å²	49.7	27%	0.274	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.6	-177.7	-82.2	-174.2	-178.6	-173.3	0	107.9	L396 I401 Q405 Q406 N407 P414	L396-K416 HydrophobicContact CB-CG 4.32Å; L396-K416 CarbonylContact O-C 3.58Å; L396-K416 WeakPolarHBondContact O-CA 3.33Å; I401-K416 HydrophobicContact CD1-CB 3.93Å; I401-K416 HydrophobicContact CD1-CD 4.29Å; I401-K416 HydrophobicContact CD1-CG 3.94Å; I401-K416 HydrophobicContact CG1-CD 4.42Å; I401-K416 HydrophobicContact CG2-CB 3.87Å; I401-K416 HydrophobicContact CG2-CD 4.36Å; Q405-K416 VanDerWaalsContact O-CB 3.28Å; Q405-K416 WeakPolarHBondContact O-CB 3.5Å; Q406-K416 WeakPolarHBondContact CA-O 3.47Å; Q406-K416 VanDerWaalsContact CG-O 3.23Å; Q406-K416 WeakPolarHBondContact CG-O 3.49Å; N407-K416 PolarHBondContact N-O 2.97Å; P414-K416 PolarHBondContact O-N 3.05Å
417	L	62.4	Low	69.4	Low	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.2	177.3	-72.5	-179.6	0	0	0	110.4	A346 N350 V395 L396 C397 S398 G419	A346-L417 HydrophobicContact CB-CD2 4.05Å; A346-L417 HydrophobicContact CB-CG 4.38Å; A346-L417 VanDerWaalsContact O-CD2 3.23Å; A346-L417 WeakPolarHBondContact O-CD2 3.46Å; N350-L417 HydrophobicContact CB-CD2 4.24Å; V395-L417 HydrophobicContact CG1-CB 4.46Å; V395-L417 HydrophobicContact CG1-CD1 3.41Å; V395-L417 VanDerWaalsContact CG1-CD1 3.41Å; V395-L417 HydrophobicContact CG1-CG 3.75Å; L396-L417 PolarHBondContact O-N 3.26Å; C397-L417 WeakPolarHBondContact CA-O 3.44Å; S398-L417 PolarHBondContact N-O 3.3Å; L417-G419 PolarHBondContact O-N 2.94Å
418	R	61.1	Low	70.9	Confident	115 Å²	115	51.5 Å²	51.5	43%	0.434	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.8	167.4	-176	179.5	-179.8	149.5	4	108.8	D403	D403-R418 WeakPolarHBondContact OD1-CD 3.49Å; D403-R418 IonicContact OD1-CZ 2.89Å; D403-R418 IonicContact OD1-NE 2.63Å; D403-R418 IonicContact OD1-NH1 3.89Å; D403-R418 PolarHBondContact OD1-NH1 3.06Å; D403-R418 IonicContact OD2-CZ 3.84Å; D403-R418 IonicContact OD2-NH1 3.49Å; D403-R418 PolarHBondContact OD2-NH1 3.21Å
419	G	66.2	Low	72.2	Confident	14 Å²	14	51.6 Å²	51.6	14%	0.144	27%	0.267	C	S	.	.			trans	162.4	128.3	175.1	0	0	0	0	0	111.9	L417	L417-G419 PolarHBondContact O-N 2.94Å
420	C	75.3	Confident	73.7	Confident	16 Å²	16	52 Å²	52	11%	0.108	27%	0.267	C	S	.	.			trans	-94.1	113.9	170.7	-165	0	0	0	0	109.7	I399 L422 S423 V424	I399-C420 HydrophobicContact CD1-CB 3.61Å; I399-C420 HydrophobicContact CG1-CB 3.43Å; I399-C420 VanDerWaalsContact CG1-CB 3.43Å; C420-L422 PolarHBondContact O-N 3.4Å; C420-S423 PolarHBondContact O-N 3.22Å; C420-V424 WeakPolarHBondContact O-CG2 3.42Å; C420-V424 PolarHBondContact O-N 3.13Å
421	V	81.5	Confident	75.1	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.036	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-36	174.3	-172	0	0	0	0	110.4	F353 L382 I386 L389 V424 L425 L463	F353-V421 HydrophobicContact CE1-CG2 4.42Å; F353-V421 HydrophobicContact CZ-CG2 3.85Å; L382-V421 HydrophobicContact CD1-CG1 3.81Å; I386-V421 HydrophobicContact CD1-CG1 4.23Å; I386-V421 HydrophobicContact CG1-CG1 3.84Å; L389-V421 HydrophobicContact CD1-CG2 3.64Å; V421-V424 PolarHBondContact O-N 3.47Å; V421-L425 PolarHBondContact O-N 3.36Å; V421-L463 HydrophobicContact CB-CD1 4.06Å; V421-L463 HydrophobicContact CG1-CD1 3.6Å
422	L	84	Confident	76.5	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-50.7	178	175.8	66.7	0	0	0	111.8	C420 V424 L425 E426 L463 E476 R479 A480	C420-L422 PolarHBondContact O-N 3.4Å; L422-V424 PolarHBondContact O-N 2.95Å; L422-L425 WeakPolarHBondContact O-CB 2.91Å; L422-L425 PolarHBondContact O-N 3.27Å; L422-L425 VanDerWaalsContact O-N 3.1Å; L422-E426 HydrophobicContact CD1-CG 4.22Å; L422-E426 HydrophobicContact CG-CG 4.37Å; L422-E426 WeakPolarHBondContact O-CG 3.37Å; L422-E426 PolarHBondContact O-N 2.89Å; L422-L463 HydrophobicContact CD1-CD2 4.16Å; L422-E476 HydrophobicContact CD2-CB 4.18Å; L422-E476 HydrophobicContact CD2-CG 4.28Å; L422-R479 HydrophobicContact CD2-CB 3.73Å; L422-A480 HydrophobicContact CD1-CB 4.04Å
423	S	85.8	Confident	78.2	Confident	45 Å²	45	36.9 Å²	36.9	32%	0.315	19%	0.188	S	C	.	.	H	α-helix	trans	-62.3	-32.8	179.7	-56.7	0	0	0	0	112.9	C420 R427	C420-S423 PolarHBondContact O-N 3.22Å; S423-R427 WeakPolarHBondContact O-CB 3.49Å; S423-R427 PolarHBondContact O-N 2.97Å
424	V	87.3	Confident	79.6	Confident	19 Å²	19	33.9 Å²	33.9	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-67.1	-44.3	174.2	173.4	0	0	0	0	110.9	F353 I356 F360 L382 C420 V421 L422 R427 L428	F353-V424 HydrophobicContact CD1-CG2 4.17Å; F353-V424 HydrophobicContact CE1-CG2 4.09Å; I356-V424 HydrophobicContact CB-CG1 4.39Å; I356-V424 HydrophobicContact CD1-CG1 4.05Å; I356-V424 HydrophobicContact CG2-CG1 3.46Å; I356-V424 VanDerWaalsContact CG2-CG1 3.46Å; F360-V424 HydrophobicContact CE2-CG1 4.47Å; L382-V424 HydrophobicContact CD1-CG1 4.28Å; C420-V424 WeakPolarHBondContact O-CG2 3.42Å; C420-V424 PolarHBondContact O-N 3.13Å; V421-V424 PolarHBondContact O-N 3.47Å; L422-V424 PolarHBondContact O-N 2.95Å; V424-R427 PolarHBondContact O-N 3.37Å; V424-L428 HydrophobicContact CG1-CD1 4.18Å; V424-L428 WeakPolarHBondContact O-CG 3.46Å; V424-L428 PolarHBondContact O-N 3.13Å
425	L	88.5	Confident	80.9	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-45	175.8	179.2	65.4	0	0	0	111.8	L382 V421 L422 R427 L428 D429 I459 I460 L463	L382-L425 HydrophobicContact CD2-CB 4.23Å; L382-L425 HydrophobicContact CD2-CD1 3.88Å; V421-L425 PolarHBondContact O-N 3.36Å; L422-L425 WeakPolarHBondContact O-CB 2.91Å; L422-L425 PolarHBondContact O-N 3.27Å; L422-L425 VanDerWaalsContact O-N 3.1Å; L425-R427 PolarHBondContact O-N 3.48Å; L425-L428 PolarHBondContact O-N 2.89Å; L425-L428 VanDerWaalsContact O-N 3.17Å; L425-D429 WeakPolarHBondContact O-CB 3.42Å; L425-D429 PolarHBondContact O-N 2.94Å; L425-I459 HydrophobicContact CD1-CG2 3.91Å; L425-I460 HydrophobicContact CD1-CG1 4.47Å; L425-I460 HydrophobicContact CD2-CG1 3.94Å; L425-L463 HydrophobicContact CB-CD2 4.43Å; L425-L463 HydrophobicContact CD2-CB 4.36Å; L425-L463 HydrophobicContact CD2-CD2 3.28Å; L425-L463 HydrophobicContact CD2-CG 4.4Å; L425-L463 HydrophobicContact CG-CD2 4.49Å
426	E	88.7	Confident	82.1	Confident	39 Å²	39	29 Å²	29	18%	0.182	14%	0.143	C	C	.	.	H	α-helix	trans	-56.8	-42.5	175.7	-71.6	-173.3	140.5	0	0	111	L422 D429 D430 R483	L422-E426 HydrophobicContact CD1-CG 4.22Å; L422-E426 HydrophobicContact CG-CG 4.37Å; L422-E426 WeakPolarHBondContact O-CG 3.37Å; L422-E426 PolarHBondContact O-N 2.89Å; E426-D429 PolarHBondContact O-N 3.49Å; E426-D430 PolarHBondContact O-N 3.32Å; E426-R483 HydrophobicContact CG-CG 4.29Å; E426-R483 IonicContact OE1-NE 3.21Å
427	R	87.9	Confident	83.1	Confident	97 Å²	97	28.5 Å²	28.5	37%	0.366	14%	0.141	S	C	.	.	H	α-helix	trans	-67.9	-40.9	177.1	-173.5	62.2	-172.2	-168.7	1.2	112.5	F360 S423 V424 L425 D429 D430 E431	F360-R427 HydrophobicContact CD1-CG 4.35Å; F360-R427 HydrophobicContact CE1-CB 4.42Å; F360-R427 HydrophobicContact CE1-CG 3.74Å; F360-R427 HydrophobicContact CE2-CB 4.41Å; F360-R427 HydrophobicContact CE2-CG 4.1Å; F360-R427 HydrophobicContact CZ-CB 3.86Å; F360-R427 HydrophobicContact CZ-CG 3.58Å; S423-R427 WeakPolarHBondContact O-CB 3.49Å; S423-R427 PolarHBondContact O-N 2.97Å; V424-R427 PolarHBondContact O-N 3.37Å; L425-R427 PolarHBondContact O-N 3.48Å; R427-D429 VanDerWaalsContact C-N 3.3Å; R427-D429 PolarHBondContact O-N 3.06Å; R427-D430 PolarHBondContact O-N 2.91Å; R427-E431 IonicContact CZ-OE1 2.87Å; R427-E431 IonicContact NE-OE1 2.78Å; R427-E431 PolarHBondContact NE-OE1 3.39Å; R427-E431 IonicContact NH2-OE1 3.75Å; R427-E431 PolarHBondContact NH2-OE1 3.21Å; R427-E431 WeakPolarHBondContact O-CG 3.44Å; R427-E431 PolarHBondContact O-N 3.35Å
428	L	89	Confident	84.2	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-35.5	176.6	-76	169	0	0	0	112.4	F360 W375 A378 M379 L382 V424 L425 E431 F432	F360-L428 HydrophobicContact CE1-CD2 3.56Å; F360-L428 HydrophobicContact CE1-CG 4.05Å; F360-L428 HydrophobicContact CZ-CD2 3.63Å; F360-L428 HydrophobicContact CZ-CG 3.67Å; W375-L428 PolarHBondContact NE1-O 3.06Å; A378-L428 HydrophobicContact CB-CD2 3.84Å; M379-L428 HydrophobicContact SD-CB 4.12Å; M379-L428 HydrophobicContact SD-CD1 3.79Å; M379-L428 HydrophobicContact SD-CG 4.35Å; L382-L428 HydrophobicContact CB-CD1 4.2Å; L382-L428 HydrophobicContact CD2-CD1 3.57Å; L382-L428 HydrophobicContact CG-CD1 4.46Å; V424-L428 HydrophobicContact CG1-CD1 4.18Å; V424-L428 WeakPolarHBondContact O-CG 3.46Å; V424-L428 PolarHBondContact O-N 3.13Å; L425-L428 PolarHBondContact O-N 2.89Å; L425-L428 VanDerWaalsContact O-N 3.17Å; L428-E431 PolarHBondContact O-N 2.92Å; L428-F432 WeakPolarHBondContact O-CB 3.47Å; L428-F432 PolarHBondContact O-N 3.23Å
429	D	88.9	Confident	85.4	Confident	15 Å²	15	28.4 Å²	28.4	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-42.7	175.1	-173.2	40	0	0	0	111.9	L425 E426 R427 F432 T433 R483 H487	L425-D429 WeakPolarHBondContact O-CB 3.42Å; L425-D429 PolarHBondContact O-N 2.94Å; E426-D429 PolarHBondContact O-N 3.49Å; R427-D429 VanDerWaalsContact C-N 3.3Å; R427-D429 PolarHBondContact O-N 3.06Å; D429-F432 WeakPolarHBondContact O-CB 3.24Å; D429-F432 PolarHBondContact O-N 3.37Å; D429-T433 PolarHBondContact O-N 3.12Å; D429-T433 PolarHBondContact O-OG1 3.29Å; D429-R483 WeakPolarHBondContact OD2-CD 3.47Å; D429-R483 IonicContact OD2-CZ 3.95Å; D429-R483 IonicContact OD2-NH1 2.75Å; D429-R483 PolarHBondContact OD2-NH1 3.29Å; D429-H487 IonicContact OD1-CD2 2.73Å; D429-H487 IonicContact OD1-CE1 3.79Å; D429-H487 PolarHBondContact OD1-CE1 3.17Å; D429-H487 IonicContact OD1-NE2 2.89Å; D429-H487 PolarHBondContact OD1-NE2 2.83Å; D429-H487 IonicContact OD2-NE2 2.88Å
430	D	87.7	Confident	86.4	Confident	62 Å²	62	32.3 Å²	32.3	33%	0.332	17%	0.169	S	C	.	.	H	α-helix	trans	-64.2	-41.1	174.6	-65.2	-9.5	0	0	0	111.3	E426 R427 T433 K434 R483	E426-D430 PolarHBondContact O-N 3.32Å; R427-D430 PolarHBondContact O-N 2.91Å; D430-T433 PolarHBondContact O-N 3.07Å; D430-K434 WeakPolarHBondContact O-CG 3.28Å; D430-K434 PolarHBondContact O-N 3.03Å; D430-K434 VanDerWaalsContact O-N 3.13Å; D430-R483 IonicContact OD1-CZ 3.14Å; D430-R483 IonicContact OD1-NH1 2.7Å; D430-R483 PolarHBondContact OD1-NH1 3.05Å; D430-R483 IonicContact OD1-NH2 2.99Å; D430-R483 PolarHBondContact OD1-NH2 2.97Å; D430-R483 IonicContact OD2-NH2 3.2Å
431	E	87.2	Confident	86.8	Confident	13 Å²	13	33.5 Å²	33.5	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-37.2	174.1	-68.5	-55.5	147.5	0	0	112.3	F360 R427 L428 T433 K434 I435	F360-E431 HydrophobicContact CD1-CG 4.33Å; F360-E431 HydrophobicContact CE1-CG 4.08Å; R427-E431 IonicContact CZ-OE1 2.87Å; R427-E431 IonicContact NE-OE1 2.78Å; R427-E431 PolarHBondContact NE-OE1 3.39Å; R427-E431 IonicContact NH2-OE1 3.75Å; R427-E431 PolarHBondContact NH2-OE1 3.21Å; R427-E431 WeakPolarHBondContact O-CG 3.44Å; R427-E431 PolarHBondContact O-N 3.35Å; L428-E431 PolarHBondContact O-N 2.92Å; E431-T433 VanDerWaalsContact C-N 3.32Å; E431-T433 PolarHBondContact O-N 2.94Å; E431-K434 WeakPolarHBondContact O-CB 3.34Å; E431-K434 PolarHBondContact O-N 3.3Å; E431-K434 IonicContact OE1-NZ 2.61Å; E431-K434 PolarHBondContact OE1-NZ 2.72Å; E431-K434 IonicContact OE2-NZ 3.62Å; E431-I435 VanDerWaalsContact O-CG1 3.31Å; E431-I435 WeakPolarHBondContact O-CG1 3.36Å; E431-I435 PolarHBondContact O-N 3.06Å
432	F	89.5	Confident	87	Confident	5 Å²	5	40.5 Å²	40.5	2%	0.022	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-42.4	173.6	179	-112.1	0	0	0	111.6	W375 L428 D429 K434 I435 L436 E453 I456	W375-F432 AromaticContact CH2-CD2 3.68Å; W375-F432 HydrophobicContact CH2-CD2 3.68Å; W375-F432 HydrophobicContact CH2-CE2 4.09Å; W375-F432 HydrophobicContact CH2-CG 4.37Å; W375-F432 HydrophobicContact CZ2-CB 3.78Å; W375-F432 AromaticContact CZ2-CD2 3.58Å; W375-F432 HydrophobicContact CZ2-CD2 3.58Å; W375-F432 HydrophobicContact CZ2-CE2 4.42Å; W375-F432 AromaticContact CZ2-CG 3.91Å; W375-F432 HydrophobicContact CZ2-CG 3.91Å; W375-F432 HydrophobicContact CZ3-CD2 4.25Å; L428-F432 WeakPolarHBondContact O-CB 3.47Å; L428-F432 PolarHBondContact O-N 3.23Å; D429-F432 WeakPolarHBondContact O-CB 3.24Å; D429-F432 PolarHBondContact O-N 3.37Å; F432-K434 VanDerWaalsContact C-N 3.3Å; F432-K434 PolarHBondContact O-N 3.03Å; F432-I435 WeakPolarHBondContact O-CB 3.15Å; F432-I435 PolarHBondContact O-N 3.44Å; F432-L436 HydrophobicContact CD1-CD1 4.06Å; F432-L436 HydrophobicContact CE1-CD1 3.46Å; F432-L436 VanDerWaalsContact CE1-CD1 3.46Å; F432-L436 HydrophobicContact CE1-CG 4.27Å; F432-L436 HydrophobicContact CE2-CD1 4.25Å; F432-L436 HydrophobicContact CE2-CD2 4.48Å; F432-L436 HydrophobicContact CE2-CG 4.28Å; F432-L436 HydrophobicContact CZ-CD1 3.58Å; F432-L436 HydrophobicContact CZ-CD2 4.38Å; F432-L436 HydrophobicContact CZ-CG 4.09Å; F432-L436 WeakPolarHBondContact O-CG 3.23Å; F432-L436 PolarHBondContact O-N 3.06Å; F432-E453 HydrophobicContact CE1-CB 4.22Å; F432-E453 HydrophobicContact CE1-CG 4.25Å; F432-E453 HydrophobicContact CZ-CB 3.91Å; F432-E453 HydrophobicContact CZ-CG 4.44Å; F432-I456 HydrophobicContact CB-CD1 3.79Å; F432-I456 HydrophobicContact CD1-CD1 3.24Å; F432-I456 HydrophobicContact CD2-CD1 3.75Å; F432-I456 HydrophobicContact CE1-CD1 3.61Å; F432-I456 HydrophobicContact CE2-CD1 4.08Å; F432-I456 HydrophobicContact CG-CD1 3.3Å; F432-I456 HydrophobicContact CZ-CD1 4.01Å
433	T	87.7	Confident	87.3	Confident	43 Å²	43	42.4 Å²	42.4	26%	0.264	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-42.3	175.5	-57.4	0	0	0	0	111	D429 D430 E431 L436 Q437 P641	D429-T433 PolarHBondContact O-N 3.12Å; D429-T433 PolarHBondContact O-OG1 3.29Å; D430-T433 PolarHBondContact O-N 3.07Å; E431-T433 VanDerWaalsContact C-N 3.32Å; E431-T433 PolarHBondContact O-N 2.94Å; T433-L436 PolarHBondContact O-N 3.02Å; T433-Q437 VanDerWaalsContact O-CG 3.31Å; T433-Q437 WeakPolarHBondContact O-CG 3.43Å; T433-Q437 PolarHBondContact O-N 2.9Å; T433-P641 HydrophobicContact CG2-CG 3.89Å
434	K	86.8	Confident	87.4	Confident	38 Å²	38	45.6 Å²	45.6	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-42.9	174.7	-65.9	178.1	-160.9	167.2	0	112.8	S366 C369 D430 E431 F432 L436 Q437 D438	S366-K434 PolarHBondContact O-NZ 3.24Å; C369-K434 HydrophobicContact CB-CB 4.19Å; D430-K434 WeakPolarHBondContact O-CG 3.28Å; D430-K434 PolarHBondContact O-N 3.03Å; D430-K434 VanDerWaalsContact O-N 3.13Å; E431-K434 WeakPolarHBondContact O-CB 3.34Å; E431-K434 PolarHBondContact O-N 3.3Å; E431-K434 IonicContact OE1-NZ 2.61Å; E431-K434 PolarHBondContact OE1-NZ 2.72Å; E431-K434 IonicContact OE2-NZ 3.62Å; F432-K434 VanDerWaalsContact C-N 3.3Å; F432-K434 PolarHBondContact O-N 3.03Å; K434-L436 PolarHBondContact O-N 3.45Å; K434-Q437 WeakPolarHBondContact O-CB 3.18Å; K434-Q437 PolarHBondContact O-N 3.12Å; K434-D438 PolarHBondContact O-N 3.26Å
435	I	87.5	Confident	87.5	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-56.6	-39.3	176.5	-69.8	166.8	0	0	0	110.8	C369 L370 F372 W375 E431 F432 A439 K449	C369-I435 HydrophobicContact CB-CG1 3.97Å; L370-I435 WeakPolarHBondContact O-CD1 3.25Å; L370-I435 VanDerWaalsContact O-CG1 3.32Å; L370-I435 WeakPolarHBondContact O-CG1 3.27Å; F372-I435 HydrophobicContact CD2-CG2 4.33Å; W375-I435 HydrophobicContact CB-CD1 3.75Å; W375-I435 HydrophobicContact CD2-CD1 4.27Å; W375-I435 HydrophobicContact CG-CD1 3.67Å; E431-I435 VanDerWaalsContact O-CG1 3.31Å; E431-I435 WeakPolarHBondContact O-CG1 3.36Å; E431-I435 PolarHBondContact O-N 3.06Å; F432-I435 WeakPolarHBondContact O-CB 3.15Å; F432-I435 PolarHBondContact O-N 3.44Å; I435-A439 WeakPolarHBondContact O-CB 3.5Å; I435-A439 PolarHBondContact O-N 3.24Å; I435-K449 HydrophobicContact CG2-CB 4.4Å; I435-K449 HydrophobicContact CG2-CD 3.8Å; I435-K449 HydrophobicContact CG2-CG 4.08Å
436	L	87.2	Confident	87.6	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-78.6	-24	177.4	-65.6	-177.8	0	0	0	113.9	F432 T433 K434 Y446 K449 L450 P641 H643	F432-L436 HydrophobicContact CD1-CD1 4.06Å; F432-L436 HydrophobicContact CE1-CD1 3.46Å; F432-L436 VanDerWaalsContact CE1-CD1 3.46Å; F432-L436 HydrophobicContact CE1-CG 4.27Å; F432-L436 HydrophobicContact CE2-CD1 4.25Å; F432-L436 HydrophobicContact CE2-CD2 4.48Å; F432-L436 HydrophobicContact CE2-CG 4.28Å; F432-L436 HydrophobicContact CZ-CD1 3.58Å; F432-L436 HydrophobicContact CZ-CD2 4.38Å; F432-L436 HydrophobicContact CZ-CG 4.09Å; F432-L436 WeakPolarHBondContact O-CG 3.23Å; F432-L436 PolarHBondContact O-N 3.06Å; T433-L436 PolarHBondContact O-N 3.02Å; K434-L436 PolarHBondContact O-N 3.45Å; L436-Y446 HydrophobicContact CB-CE2 4.32Å; L436-Y446 HydrophobicContact CD2-CE2 4.15Å; L436-Y446 WeakPolarHBondContact O-CE2 3.46Å; L436-K449 HydrophobicContact CD2-CB 3.95Å; L436-L450 HydrophobicContact CD1-CD1 4.38Å; L436-P641 HydrophobicContact CB-CB 4.03Å; L436-P641 HydrophobicContact CB-CG 4.26Å; L436-P641 HydrophobicContact CD1-CB 4.24Å; L436-P641 HydrophobicContact CD1-CG 4.5Å; L436-H643 VanDerWaalsContact CD1-CE1 3.46Å; L436-H643 WeakPolarHBondContact CD1-CE1 3.49Å
437	Q	86	Confident	87.6	Confident	53 Å²	53	50.2 Å²	50.2	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-72.6	-36.4	172.9	-74.4	170.4	-4.4	0	0	111.9	T433 K434 Q637 R639	T433-Q437 VanDerWaalsContact O-CG 3.31Å; T433-Q437 WeakPolarHBondContact O-CG 3.43Å; T433-Q437 PolarHBondContact O-N 2.9Å; K434-Q437 WeakPolarHBondContact O-CB 3.18Å; K434-Q437 PolarHBondContact O-N 3.12Å; Q437-Q637 PolarHBondContact NE2-O 3.16Å; Q437-R639 PolarHBondContact NE2-O 3.36Å
438	D	84.6	Confident	87.6	Confident	102 Å²	102	50.9 Å²	50.9	55%	0.545	28%	0.275	S	S	.	.	H	α-helix	trans	-83.6	-20.1	-179	-75.4	-15.4	0	0	0	113.3	C369 K434	C369-D438 WeakPolarHBondContact CB-OD2 3.37Å; C369-D438 PolarHBondContact SG-OD2 3.05Å; C369-D438 VanDerWaalsContact SG-OD2 3.36Å; K434-D438 PolarHBondContact O-N 3.26Å
439	A	85.3	Confident	87.5	Confident	11 Å²	11	52.4 Å²	52.4	9%	0.091	28%	0.282	C	S	.	.	S	Bend	trans	-72.9	137	177.4	0	0	0	0	0	112.3	I435 C441 Y446 K449	I435-A439 WeakPolarHBondContact O-CB 3.5Å; I435-A439 PolarHBondContact O-N 3.24Å; A439-C441 PolarHBondContact O-N 3.29Å; A439-Y446 HydrophobicContact CB-CD2 3.81Å; A439-Y446 HydrophobicContact CB-CE2 4.48Å; A439-K449 HydrophobicContact CB-CD 3.7Å
440	D	87.6	Confident	87.5	Confident	97 Å²	97	53.9 Å²	53.9	52%	0.519	29%	0.289	S	S	.	.			trans	-66.4	121.9	174.1	176.9	25.7	0	0	0	111	H442 S443 Y446	D440-H442 PolarHBondContact O-N 3.24Å; D440-H442 PolarHBondContact OD1-N 2.89Å; D440-S443 PolarHBondContact O-N 3.46Å; D440-Y446 WeakPolarHBondContact O-CB 3.5Å
441	C	84.1	Confident	87.5	Confident	41 Å²	41	57.5 Å²	57.5	28%	0.277	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-22	-174.2	54.9	0	0	0	0	114.3	A439 Y642	A439-C441 PolarHBondContact O-N 3.29Å; C441-Y642 HydrophobicContact CB-CD1 3.72Å; C441-Y642 HydrophobicContact CB-CD2 3.57Å; C441-Y642 HydrophobicContact CB-CE1 4.16Å; C441-Y642 HydrophobicContact CB-CE2 4.02Å; C441-Y642 HydrophobicContact CB-CG 3.4Å
442	H	85.9	Confident	87.4	Confident	152 Å²	152	57 Å²	57	70%	0.704	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-7.3	179.1	-61.2	-54.6	0	0	0	113.3	D440	D440-H442 PolarHBondContact O-N 3.24Å; D440-H442 PolarHBondContact OD1-N 2.89Å
443	S	89.6	Confident	87.3	Confident	45 Å²	45	57.7 Å²	57.7	32%	0.315	30%	0.304	S	S	.	.	S	Bend	trans	-84.1	150	179.3	-178	0	0	0	0	112	D440 D445 Y446	D440-S443 PolarHBondContact O-N 3.46Å; S443-D445 PolarHBondContact O-N 3.44Å; S443-D445 PolarHBondContact OG-N 3.08Å; S443-Y446 WeakPolarHBondContact O-CB 3.22Å; S443-Y446 PolarHBondContact O-N 3.11Å
444	T	89.3	Confident	87.3	Confident	112 Å²	112	63.9 Å²	63.9	69%	0.687	33%	0.327	S	S	*	.	H	α-helix	trans	-63.1	-23	171.8	53.3	0	0	0	0	112.5	Y446 V447 E448	T444-Y446 PolarHBondContact O-N 3.06Å; T444-V447 PolarHBondContact O-N 3.26Å; T444-V447 VanDerWaalsContact O-N 3.11Å; T444-E448 PolarHBondContact O-N 2.95Å
445	D	88.3	Confident	87.3	Confident	62 Å²	62	63.5 Å²	63.5	33%	0.332	33%	0.328	S	S	.	.	H	α-helix	trans	-58.9	-34	174.8	-175.3	37.3	0	0	0	111.9	S443 V447 E448 K449	S443-D445 PolarHBondContact O-N 3.44Å; S443-D445 PolarHBondContact OG-N 3.08Å; D445-V447 VanDerWaalsContact C-N 3.32Å; D445-V447 PolarHBondContact O-N 3.03Å; D445-E448 PolarHBondContact O-N 2.92Å; D445-K449 WeakPolarHBondContact O-CG 3.44Å; D445-K449 PolarHBondContact O-N 3.34Å; D445-K449 WeakPolarHBondContact OD1-CE 3.24Å; D445-K449 IonicContact OD1-NZ 3.83Å; D445-K449 VanDerWaalsContact OD2-CE 3.26Å; D445-K449 WeakPolarHBondContact OD2-CE 3.49Å; D445-K449 IonicContact OD2-NZ 3.15Å; D445-K449 PolarHBondContact OD2-NZ 3.02Å
446	Y	90.5	Very high	87.4	Confident	10 Å²	10	63.5 Å²	63.5	4%	0.039	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-41.7	175.5	-167.7	-89.3	0	0	0	111.9	L436 A439 D440 S443 T444 K449 L450 Y642 H643	L436-Y446 HydrophobicContact CB-CE2 4.32Å; L436-Y446 HydrophobicContact CD2-CE2 4.15Å; L436-Y446 WeakPolarHBondContact O-CE2 3.46Å; A439-Y446 HydrophobicContact CB-CD2 3.81Å; A439-Y446 HydrophobicContact CB-CE2 4.48Å; D440-Y446 WeakPolarHBondContact O-CB 3.5Å; S443-Y446 WeakPolarHBondContact O-CB 3.22Å; S443-Y446 PolarHBondContact O-N 3.11Å; T444-Y446 PolarHBondContact O-N 3.06Å; Y446-K449 PolarHBondContact O-N 2.74Å; Y446-L450 VanDerWaalsContact O-CB 3.29Å; Y446-L450 WeakPolarHBondContact O-CB 3.44Å; Y446-L450 PolarHBondContact O-N 3.37Å; Y446-Y642 PolarHBondContact OH-N 2.97Å; Y446-Y642 VanDerWaalsContact OH-N 3.08Å; Y446-H643 HydrophobicContact CE1-CB 4.31Å; Y446-H643 AromaticContact CZ-ND1 3.97Å; Y446-H643 PolarHBondContact OH-N 3.24Å; Y446-H643 VanDerWaalsContact OH-N 3.13Å; Y446-H643 PolarHBondContact OH-ND1 2.88Å
447	V	89.4	Confident	87.4	Confident	90 Å²	90	64.6 Å²	64.6	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-68.6	-36.8	179.8	-177.7	0	0	0	0	110.9	T444 D445 L450 K451	T444-V447 PolarHBondContact O-N 3.26Å; T444-V447 VanDerWaalsContact O-N 3.11Å; D445-V447 VanDerWaalsContact C-N 3.32Å; D445-V447 PolarHBondContact O-N 3.03Å; V447-L450 PolarHBondContact O-N 3.45Å; V447-K451 PolarHBondContact O-N 3.01Å
448	E	87.7	Confident	87.5	Confident	110 Å²	110	64.2 Å²	64.2	51%	0.514	34%	0.342	S	S	.	.	H	α-helix	trans	-65.9	-45.8	175.1	-67.9	-169.2	170	0	0	112	T444 D445 L450 K451	T444-E448 PolarHBondContact O-N 2.95Å; D445-E448 PolarHBondContact O-N 2.92Å; E448-L450 VanDerWaalsContact C-N 3.3Å; E448-L450 PolarHBondContact O-N 2.82Å; E448-K451 WeakPolarHBondContact O-CB 3.37Å; E448-K451 PolarHBondContact O-N 3.02Å
449	K	87.9	Confident	87.7	Confident	33 Å²	33	59.4 Å²	59.4	14%	0.143	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-39.2	174.7	-72.3	167.6	174.3	168.4	0	111.9	F372 I435 L436 A439 D445 Y446 K451 G452	F372-K449 HydrophobicContact CD2-CB 4.43Å; F372-K449 HydrophobicContact CD2-CG 3.99Å; F372-K449 HydrophobicContact CE2-CB 4.31Å; F372-K449 HydrophobicContact CE2-CG 4.28Å; F372-K449 HydrophobicContact CG-CG 4.17Å; I435-K449 HydrophobicContact CG2-CB 4.4Å; I435-K449 HydrophobicContact CG2-CD 3.8Å; I435-K449 HydrophobicContact CG2-CG 4.08Å; L436-K449 HydrophobicContact CD2-CB 3.95Å; A439-K449 HydrophobicContact CB-CD 3.7Å; D445-K449 WeakPolarHBondContact O-CG 3.44Å; D445-K449 PolarHBondContact O-N 3.34Å; D445-K449 WeakPolarHBondContact OD1-CE 3.24Å; D445-K449 IonicContact OD1-NZ 3.83Å; D445-K449 VanDerWaalsContact OD2-CE 3.26Å; D445-K449 WeakPolarHBondContact OD2-CE 3.49Å; D445-K449 IonicContact OD2-NZ 3.15Å; D445-K449 PolarHBondContact OD2-NZ 3.02Å; Y446-K449 PolarHBondContact O-N 2.74Å; K449-K451 PolarHBondContact O-N 3.37Å; K449-G452 PolarHBondContact O-N 3.3Å
450	L	88.7	Confident	87.8	Confident	46 Å²	46	59.2 Å²	59.2	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-25.5	178	-167.2	66.4	0	0	0	113.1	L436 Y446 V447 E448 G452 E453 H643	L436-L450 HydrophobicContact CD1-CD1 4.38Å; Y446-L450 VanDerWaalsContact O-CB 3.29Å; Y446-L450 WeakPolarHBondContact O-CB 3.44Å; Y446-L450 PolarHBondContact O-N 3.37Å; V447-L450 PolarHBondContact O-N 3.45Å; E448-L450 VanDerWaalsContact C-N 3.3Å; E448-L450 PolarHBondContact O-N 2.82Å; L450-G452 PolarHBondContact O-N 3.26Å; L450-G452 VanDerWaalsContact O-N 3.14Å; L450-E453 VanDerWaalsContact CD1-OE2 3.28Å; L450-E453 WeakPolarHBondContact CD1-OE2 3.38Å; L450-E453 WeakPolarHBondContact O-CB 3.47Å; L450-E453 PolarHBondContact O-N 3.26Å; L450-H643 HydrophobicContact CD1-CB 4.32Å; L450-H643 HydrophobicContact CD2-CB 4.4Å
451	K	87.5	Confident	87.8	Confident	139 Å²	139	57.7 Å²	57.7	60%	0.604	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.4	172.6	-67.2	174.3	-177	171.4	0	112.3	V447 E448 K449 E453 K454	V447-K451 PolarHBondContact O-N 3.01Å; E448-K451 WeakPolarHBondContact O-CB 3.37Å; E448-K451 PolarHBondContact O-N 3.02Å; K449-K451 PolarHBondContact O-N 3.37Å; K451-E453 PolarHBondContact O-N 3.13Å; K451-K454 PolarHBondContact O-N 3.28Å
452	G	85.6	Confident	87.9	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-23.6	174.3	0	0	0	0	0	113.9	K449 L450 K454 T455 I456	K449-G452 PolarHBondContact O-N 3.3Å; L450-G452 PolarHBondContact O-N 3.26Å; L450-G452 VanDerWaalsContact O-N 3.14Å; G452-K454 VanDerWaalsContact C-N 3.32Å; G452-K454 PolarHBondContact O-N 3.08Å; G452-T455 VanDerWaalsContact O-CB 3.27Å; G452-T455 WeakPolarHBondContact O-CB 3.37Å; G452-T455 PolarHBondContact O-N 3.48Å; G452-T455 VanDerWaalsContact O-N 3.12Å; G452-I456 PolarHBondContact O-N 2.71Å; G452-I456 VanDerWaalsContact O-N 3.07Å
453	E	86.7	Confident	87.9	Confident	19 Å²	19	50.6 Å²	50.6	9%	0.089	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-37.9	179.1	-160.9	-162	138.4	0	0	112.3	F432 L450 K451 T455 I456 C457 Y490 K491	F432-E453 HydrophobicContact CE1-CB 4.22Å; F432-E453 HydrophobicContact CE1-CG 4.25Å; F432-E453 HydrophobicContact CZ-CB 3.91Å; F432-E453 HydrophobicContact CZ-CG 4.44Å; L450-E453 VanDerWaalsContact CD1-OE2 3.28Å; L450-E453 WeakPolarHBondContact CD1-OE2 3.38Å; L450-E453 WeakPolarHBondContact O-CB 3.47Å; L450-E453 PolarHBondContact O-N 3.26Å; K451-E453 PolarHBondContact O-N 3.13Å; E453-T455 VanDerWaalsContact C-N 3.28Å; E453-T455 PolarHBondContact O-N 3.32Å; E453-I456 PolarHBondContact O-N 2.96Å; E453-C457 PolarHBondContact O-N 2.78Å; E453-C457 PolarHBondContact O-SG 3.08Å; E453-C457 VanDerWaalsContact O-SG 3.35Å; E453-Y490 VanDerWaalsContact CD-OH 3.31Å; E453-Y490 PolarHBondContact OE1-OH 3.11Å; E453-K491 WeakPolarHBondContact OE1-CE 3.45Å; E453-K491 IonicContact OE1-NZ 3.45Å; E453-K491 PolarHBondContact OE1-NZ 3.08Å
454	K	87.1	Confident	87.6	Confident	173 Å²	173	48.7 Å²	48.7	75%	0.752	26%	0.256	S	S	*	.	H	α-helix	trans	-61.5	-40.3	175.5	-66.9	-175.1	178.9	-176.2	0	111.5	K451 G452 C457 A458	K451-K454 PolarHBondContact O-N 3.28Å; G452-K454 VanDerWaalsContact C-N 3.32Å; G452-K454 PolarHBondContact O-N 3.08Å; K454-C457 PolarHBondContact O-N 2.99Å; K454-A458 WeakPolarHBondContact O-CB 3.45Å; K454-A458 PolarHBondContact O-N 3.34Å
455	T	87	Confident	87.4	Confident	30 Å²	30	48.5 Å²	48.5	18%	0.184	25%	0.247	C	C	.	.	H	α-helix	trans	-63.1	-43.4	176.8	-53.5	0	0	0	0	110.8	M379 G452 E453 A458 I459	M379-T455 HydrophobicContact CB-CG2 4.37Å; M379-T455 HydrophobicContact CE-CG2 4.1Å; G452-T455 VanDerWaalsContact O-CB 3.27Å; G452-T455 WeakPolarHBondContact O-CB 3.37Å; G452-T455 PolarHBondContact O-N 3.48Å; G452-T455 VanDerWaalsContact O-N 3.12Å; E453-T455 VanDerWaalsContact C-N 3.28Å; E453-T455 PolarHBondContact O-N 3.32Å; T455-A458 PolarHBondContact O-N 3.01Å; T455-I459 HydrophobicContact CG2-CD1 4.01Å; T455-I459 WeakPolarHBondContact O-CG1 3.21Å; T455-I459 PolarHBondContact O-N 2.89Å
456	I	89.6	Confident	87.1	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-50	175.6	-62.7	167.2	0	0	0	110.9	W375 M379 F432 G452 E453 A458 I459 I460	W375-I456 HydrophobicContact CH2-CD1 3.68Å; W375-I456 HydrophobicContact CH2-CG1 3.6Å; W375-I456 HydrophobicContact CZ2-CD1 3.46Å; W375-I456 VanDerWaalsContact CZ2-CD1 3.46Å; W375-I456 HydrophobicContact CZ2-CG1 3.55Å; M379-I456 HydrophobicContact CE-CB 4.14Å; M379-I456 HydrophobicContact CE-CG1 3.47Å; M379-I456 VanDerWaalsContact CE-CG1 3.47Å; F432-I456 HydrophobicContact CB-CD1 3.79Å; F432-I456 HydrophobicContact CD1-CD1 3.24Å; F432-I456 HydrophobicContact CD2-CD1 3.75Å; F432-I456 HydrophobicContact CE1-CD1 3.61Å; F432-I456 HydrophobicContact CE2-CD1 4.08Å; F432-I456 HydrophobicContact CG-CD1 3.3Å; F432-I456 HydrophobicContact CZ-CD1 4.01Å; G452-I456 PolarHBondContact O-N 2.71Å; G452-I456 VanDerWaalsContact O-N 3.07Å; E453-I456 PolarHBondContact O-N 2.96Å; I456-A458 VanDerWaalsContact C-N 3.27Å; I456-A458 PolarHBondContact O-N 3.27Å; I456-I459 PolarHBondContact O-N 3.01Å; I456-I459 VanDerWaalsContact O-N 3.13Å; I456-I460 HydrophobicContact CG2-CD1 3.61Å; I456-I460 HydrophobicContact CG2-CG1 4.15Å; I456-I460 WeakPolarHBondContact O-CG1 3.31Å; I456-I460 PolarHBondContact O-N 3.35Å
457	C	86.8	Confident	86.6	Confident	27 Å²	27	46 Å²	46	18%	0.182	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-39.2	179.7	-66	0	0	0	0	112.2	E453 K454 I460 N461 K491	E453-C457 PolarHBondContact O-N 2.78Å; E453-C457 PolarHBondContact O-SG 3.08Å; E453-C457 VanDerWaalsContact O-SG 3.35Å; K454-C457 PolarHBondContact O-N 2.99Å; C457-I460 PolarHBondContact O-N 3.32Å; C457-N461 PolarHBondContact O-N 3.02Å; C457-N461 PolarHBondContact O-ND2 3.43Å; C457-K491 PolarHBondContact SG-NZ 3.06Å; C457-K491 VanDerWaalsContact SG-NZ 3.45Å
458	A	88.9	Confident	86.2	Confident	46 Å²	46	47.1 Å²	47.1	38%	0.38	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-44.5	175.5	0	0	0	0	0	111.8	K454 T455 I456 N461 L462	K454-A458 WeakPolarHBondContact O-CB 3.45Å; K454-A458 PolarHBondContact O-N 3.34Å; T455-A458 PolarHBondContact O-N 3.01Å; I456-A458 VanDerWaalsContact C-N 3.27Å; I456-A458 PolarHBondContact O-N 3.27Å; A458-N461 PolarHBondContact O-N 3.28Å; A458-L462 WeakPolarHBondContact O-CG 3.35Å; A458-L462 PolarHBondContact O-N 2.88Å
459	I	88.7	Confident	85.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-38.3	177.7	-75.9	159.9	0	0	0	111.9	M379 L382 R383 I386 L425 T455 I456 N461 L462 L463	M379-I459 HydrophobicContact CB-CD1 4.37Å; M379-I459 HydrophobicContact CE-CD1 3.37Å; M379-I459 HydrophobicContact SD-CD1 4.34Å; L382-I459 HydrophobicContact CD2-CG2 3.81Å; L382-I459 HydrophobicContact CG-CG2 4.21Å; R383-I459 HydrophobicContact CB-CD1 4.19Å; R383-I459 HydrophobicContact CB-CG1 4.21Å; I386-I459 HydrophobicContact CD1-CG2 3.7Å; L425-I459 HydrophobicContact CD1-CG2 3.91Å; T455-I459 HydrophobicContact CG2-CD1 4.01Å; T455-I459 WeakPolarHBondContact O-CG1 3.21Å; T455-I459 PolarHBondContact O-N 2.89Å; I456-I459 PolarHBondContact O-N 3.01Å; I456-I459 VanDerWaalsContact O-N 3.13Å; I459-N461 VanDerWaalsContact C-N 3.32Å; I459-N461 PolarHBondContact O-N 2.79Å; I459-L462 PolarHBondContact O-N 2.7Å; I459-L463 WeakPolarHBondContact O-CB 3.39Å; I459-L463 PolarHBondContact O-N 3.28Å
460	I	87.9	Confident	84.9	Confident	7 Å²	7	46 Å²	46	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-60	-44.1	173.3	-71.2	167.1	0	0	0	110.3	L425 I456 C457 L463 V464 K484 H487	L425-I460 HydrophobicContact CD1-CG1 4.47Å; L425-I460 HydrophobicContact CD2-CG1 3.94Å; I456-I460 HydrophobicContact CG2-CD1 3.61Å; I456-I460 HydrophobicContact CG2-CG1 4.15Å; I456-I460 WeakPolarHBondContact O-CG1 3.31Å; I456-I460 PolarHBondContact O-N 3.35Å; C457-I460 PolarHBondContact O-N 3.32Å; I460-L463 PolarHBondContact O-N 3.27Å; I460-V464 HydrophobicContact CG2-CG2 4.44Å; I460-V464 WeakPolarHBondContact O-CG2 3.35Å; I460-V464 PolarHBondContact O-N 2.93Å; I460-K484 HydrophobicContact CG2-CB 3.66Å; I460-K484 HydrophobicContact CG2-CD 4.36Å; I460-K484 HydrophobicContact CG2-CG 3.99Å; I460-H487 WeakPolarHBondContact CD1-CD2 3.42Å
461	N	87.3	Confident	83.7	Confident	66 Å²	66	52.5 Å²	52.5	35%	0.353	27%	0.27	S	S	.	.	H	α-helix	trans	-65	-40.5	178	-74.9	-26.7	0	0	0	112	C457 A458 I459 L463 V464 Q465 K484	C457-N461 PolarHBondContact O-N 3.02Å; C457-N461 PolarHBondContact O-ND2 3.43Å; A458-N461 PolarHBondContact O-N 3.28Å; I459-N461 VanDerWaalsContact C-N 3.32Å; I459-N461 PolarHBondContact O-N 2.79Å; N461-L463 VanDerWaalsContact C-N 3.33Å; N461-V464 PolarHBondContact O-N 3.22Å; N461-Q465 WeakPolarHBondContact O-CG 3.28Å; N461-Q465 PolarHBondContact O-N 3.11Å; N461-K484 VanDerWaalsContact OD1-CE 3.29Å; N461-K484 WeakPolarHBondContact OD1-CE 3.48Å; N461-K484 PolarHBondContact OD1-NZ 2.87Å
462	L	86	Confident	82.7	Confident	39 Å²	39	47.1 Å²	47.1	20%	0.204	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-39.7	173.1	-70	172.6	0	0	0	111.9	R383 I386 L390 A458 I459 Q465 Y466	R383-L462 HydrophobicContact CG-CD1 4.35Å; I386-L462 HydrophobicContact CG2-CB 3.92Å; L390-L462 HydrophobicContact CD1-CD2 4.47Å; A458-L462 WeakPolarHBondContact O-CG 3.35Å; A458-L462 PolarHBondContact O-N 2.88Å; I459-L462 PolarHBondContact O-N 2.7Å; L462-Q465 PolarHBondContact O-N 3.2Å; L462-Y466 WeakPolarHBondContact O-CB 3.39Å; L462-Y466 PolarHBondContact O-N 2.84Å
463	L	85	Confident	82.4	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-43.5	176.1	-176.3	70.7	0	0	0	111	I386 V421 L422 L425 I459 I460 N461 Q465 Y466 M467	I386-L463 HydrophobicContact CD1-CB 4.37Å; I386-L463 HydrophobicContact CD1-CD1 4.48Å; V421-L463 HydrophobicContact CB-CD1 4.06Å; V421-L463 HydrophobicContact CG1-CD1 3.6Å; L422-L463 HydrophobicContact CD1-CD2 4.16Å; L425-L463 HydrophobicContact CB-CD2 4.43Å; L425-L463 HydrophobicContact CD2-CB 4.36Å; L425-L463 HydrophobicContact CD2-CD2 3.28Å; L425-L463 HydrophobicContact CD2-CG 4.4Å; L425-L463 HydrophobicContact CG-CD2 4.49Å; I459-L463 WeakPolarHBondContact O-CB 3.39Å; I459-L463 PolarHBondContact O-N 3.28Å; I460-L463 PolarHBondContact O-N 3.27Å; N461-L463 VanDerWaalsContact C-N 3.33Å; L463-Q465 VanDerWaalsContact C-N 3.34Å; L463-Q465 PolarHBondContact O-N 3.1Å; L463-Y466 HydrophobicContact CD1-CD1 4.1Å; L463-Y466 WeakPolarHBondContact O-CB 3.49Å; L463-Y466 PolarHBondContact O-N 3.37Å; L463-M467 HydrophobicContact CD1-CG 4.3Å; L463-M467 HydrophobicContact CD1-SD 4.29Å; L463-M467 HydrophobicContact CD2-SD 4.07Å; L463-M467 HydrophobicContact CG-CG 4.22Å; L463-M467 HydrophobicContact CG-SD 3.85Å; L463-M467 WeakPolarHBondContact O-CB 3.34Å; L463-M467 VanDerWaalsContact O-CG 3.25Å; L463-M467 WeakPolarHBondContact O-CG 3.44Å; L463-M467 PolarHBondContact O-N 3.09Å
464	V	84.7	Confident	82.2	Confident	6 Å²	6	53.4 Å²	53.4	4%	0.036	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-44.7	176.8	167.3	0	0	0	0	110.5	I460 N461 Y466 M467 E468 Y481 K484	I460-V464 HydrophobicContact CG2-CG2 4.44Å; I460-V464 WeakPolarHBondContact O-CG2 3.35Å; I460-V464 PolarHBondContact O-N 2.93Å; N461-V464 PolarHBondContact O-N 3.22Å; V464-Y466 VanDerWaalsContact C-N 3.31Å; V464-Y466 PolarHBondContact O-N 3.3Å; V464-M467 PolarHBondContact O-N 3.37Å; V464-E468 HydrophobicContact CG1-CG 4.26Å; V464-E468 WeakPolarHBondContact CG1-OE1 3.44Å; V464-E468 WeakPolarHBondContact O-CB 3.45Å; V464-E468 WeakPolarHBondContact O-CG 3.45Å; V464-E468 PolarHBondContact O-N 3.17Å; V464-Y481 HydrophobicContact CG1-CE1 3.89Å; V464-Y481 HydrophobicContact CG2-CD1 4.27Å; V464-Y481 HydrophobicContact CG2-CE1 4.27Å; V464-K484 HydrophobicContact CG2-CD 4.16Å
465	Q	84.8	Confident	82	Confident	108 Å²	108	50 Å²	50	51%	0.505	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-42.7	174.4	-73	172.6	-2.9	0	0	112	N461 L462 L463 E468 S469	N461-Q465 WeakPolarHBondContact O-CG 3.28Å; N461-Q465 PolarHBondContact O-N 3.11Å; L462-Q465 PolarHBondContact O-N 3.2Å; L463-Q465 VanDerWaalsContact C-N 3.34Å; L463-Q465 PolarHBondContact O-N 3.1Å; Q465-E468 PolarHBondContact O-N 3.07Å; Q465-S469 WeakPolarHBondContact O-CB 3.49Å; Q465-S469 PolarHBondContact O-N 2.99Å; Q465-S469 PolarHBondContact O-OG 3.27Å
466	Y	81.2	Confident	81.7	Confident	12 Å²	12	50.3 Å²	50.3	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-43.4	175.8	170	-102.5	0	0	0	112.3	L389 L390 L462 L463 V464 S469 R470	L389-Y466 HydrophobicContact CB-CD2 4.09Å; L389-Y466 HydrophobicContact CB-CE2 3.48Å; L389-Y466 VanDerWaalsContact CB-CE2 3.48Å; L389-Y466 HydrophobicContact CD1-CE2 4.47Å; L389-Y466 HydrophobicContact CG-CE2 4.47Å; L390-Y466 HydrophobicContact CD2-CD2 4.08Å; L390-Y466 HydrophobicContact CD2-CG 4.46Å; L390-Y466 HydrophobicContact CG-CD2 4.23Å; L462-Y466 WeakPolarHBondContact O-CB 3.39Å; L462-Y466 PolarHBondContact O-N 2.84Å; L463-Y466 HydrophobicContact CD1-CD1 4.1Å; L463-Y466 WeakPolarHBondContact O-CB 3.49Å; L463-Y466 PolarHBondContact O-N 3.37Å; V464-Y466 VanDerWaalsContact C-N 3.31Å; V464-Y466 PolarHBondContact O-N 3.3Å; Y466-S469 PolarHBondContact O-N 3.39Å; Y466-S469 PolarHBondContact O-OG 3.36Å; Y466-R470 PolarHBondContact O-N 3.47Å; Y466-R470 PolarHBondContact OH-NE 3.33Å; Y466-R470 PolarHBondContact OH-NH1 3.28Å
467	M	79.8	Confident	81.5	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-75.6	-22.2	179.6	-68	-179.3	70	0	0	113.7	L463 V464 R470 S472 E476 L477 A480	L463-M467 HydrophobicContact CD1-CG 4.3Å; L463-M467 HydrophobicContact CD1-SD 4.29Å; L463-M467 HydrophobicContact CD2-SD 4.07Å; L463-M467 HydrophobicContact CG-CG 4.22Å; L463-M467 HydrophobicContact CG-SD 3.85Å; L463-M467 WeakPolarHBondContact O-CB 3.34Å; L463-M467 VanDerWaalsContact O-CG 3.25Å; L463-M467 WeakPolarHBondContact O-CG 3.44Å; L463-M467 PolarHBondContact O-N 3.09Å; V464-M467 PolarHBondContact O-N 3.37Å; M467-R470 CarbonylContact C-O 3.53Å; M467-S472 PolarHBondContact O-OG 3.4Å; M467-E476 HydrophobicContact CE-CB 3.55Å; M467-E476 WeakPolarHBondContact CE-O 3.28Å; M467-L477 HydrophobicContact CB-CD2 3.73Å; M467-L477 HydrophobicContact CE-CD2 4.15Å; M467-L477 HydrophobicContact CE-CG 4.34Å; M467-A480 HydrophobicContact CE-CB 4.04Å; M467-A480 HydrophobicContact SD-CB 3.59Å; M467-A480 VanDerWaalsContact SD-CB 3.59Å
468	E	81.7	Confident	81.5	Confident	113 Å²	113	49.8 Å²	49.8	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-80.8	-31.7	170.6	-73.8	173	176.2	0	0	111.2	V464 Q465 R470 Y481	V464-E468 HydrophobicContact CG1-CG 4.26Å; V464-E468 WeakPolarHBondContact CG1-OE1 3.44Å; V464-E468 WeakPolarHBondContact O-CB 3.45Å; V464-E468 WeakPolarHBondContact O-CG 3.45Å; V464-E468 PolarHBondContact O-N 3.17Å; Q465-E468 PolarHBondContact O-N 3.07Å; E468-R470 VanDerWaalsContact C-N 3.25Å; E468-R470 PolarHBondContact O-N 3.33Å; E468-Y481 PolarHBondContact OE1-OH 3.26Å
469	S	78.9	Confident	81.3	Confident	81 Å²	81	51 Å²	51	57%	0.566	26%	0.263	S	S	*	.	H	α-helix	trans	-71.1	-22.5	177.1	73.8	0	0	0	0	113.5	Q465 Y466	Q465-S469 WeakPolarHBondContact O-CB 3.49Å; Q465-S469 PolarHBondContact O-N 2.99Å; Q465-S469 PolarHBondContact O-OG 3.27Å; Y466-S469 PolarHBondContact O-N 3.39Å; Y466-S469 PolarHBondContact O-OG 3.36Å
470	R	69.1	Low	81.2	Confident	38 Å²	38	51.1 Å²	51.1	14%	0.143	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	130.5	175.3	-66.4	-176.4	169	-152.7	2.2	107	N392 P393 V395 Y466 M467 E468 S472	N392-R470 PolarHBondContact O-NH2 3.17Å; P393-R470 PolarHBondContact O-NH2 3.48Å; V395-R470 PolarHBondContact O-NH1 3.14Å; V395-R470 PolarHBondContact O-NH2 3.05Å; Y466-R470 PolarHBondContact O-N 3.47Å; Y466-R470 PolarHBondContact OH-NE 3.33Å; Y466-R470 PolarHBondContact OH-NH1 3.28Å; M467-R470 CarbonylContact C-O 3.53Å; E468-R470 VanDerWaalsContact C-N 3.25Å; E468-R470 PolarHBondContact O-N 3.33Å; R470-S472 PolarHBondContact O-N 2.83Å; R470-S472 PolarHBondContact O-OG 3.32Å; R470-S472 VanDerWaalsContact O-OG 3.04Å
471	D	64.4	Low	81.3	Confident	182 Å²	182	51.8 Å²	51.8	97%	0.973	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	70.4	172.8	-66.4	-40.8	0	0	0	110.6
472	S	66.6	Low	81.3	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.182	26%	0.256	C	S	.	.			trans	-76.4	157.9	-175.1	-53.9	0	0	0	0	109.3	M467 R470 D474	M467-S472 PolarHBondContact O-OG 3.4Å; R470-S472 PolarHBondContact O-N 2.83Å; R470-S472 PolarHBondContact O-OG 3.32Å; R470-S472 VanDerWaalsContact O-OG 3.04Å; S472-D474 PolarHBondContact O-N 2.6Å
473	T	79.3	Confident	81.4	Confident	77 Å²	77	50.5 Å²	50.5	47%	0.472	26%	0.257	S	S	.	.			trans	-58.9	136.7	178.4	59	0	0	0	0	111.1	E475 E476 L477	T473-E475 PolarHBondContact O-N 3.13Å; T473-E476 PolarHBondContact O-N 2.85Å; T473-E476 VanDerWaalsContact OG1-CG 3.25Å; T473-E476 WeakPolarHBondContact OG1-CG 3.4Å; T473-E476 PolarHBondContact OG1-OE2 3.42Å; T473-L477 PolarHBondContact O-N 3.22Å; T473-L477 VanDerWaalsContact O-N 3.15Å
474	D	81.1	Confident	81.5	Confident	77 Å²	77	51.6 Å²	51.6	41%	0.412	26%	0.261	S	S	.	.	H	α-helix	trans	-51.2	-33.1	177.3	-75.9	-2.8	0	0	0	112.2	S472 L477 C478 H528	S472-D474 PolarHBondContact O-N 2.6Å; D474-L477 PolarHBondContact O-N 2.74Å; D474-C478 WeakPolarHBondContact O-CB 2.76Å; D474-C478 PolarHBondContact O-N 2.66Å; D474-C478 PolarHBondContact O-SG 3.45Å; D474-H528 HydrophobicContact CB-CB 4.18Å; D474-H528 IonicContact OD2-CE1 3.01Å; D474-H528 IonicContact OD2-CG 3.75Å; D474-H528 IonicContact OD2-ND1 3.36Å; D474-H528 PolarHBondContact OD2-ND1 2.81Å
475	E	82.4	Confident	81.7	Confident	100 Å²	100	51.4 Å²	51.4	47%	0.467	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-38.5	178.3	-60	-166.1	155.1	0	0	113.4	T473 R479 T530	T473-E475 PolarHBondContact O-N 3.13Å; E475-R479 WeakPolarHBondContact O-CG 3.38Å; E475-R479 PolarHBondContact O-N 3.41Å; E475-R479 PolarHBondContact O-NE 2.97Å; E475-T530 PolarHBondContact OE1-OG1 3.49Å
476	E	81.9	Confident	81.8	Confident	38 Å²	38	47.4 Å²	47.4	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-68.8	-42	174.4	-74.5	176.8	158.5	0	0	110.6	L422 M467 T473 C478 R479 A480	L422-E476 HydrophobicContact CD2-CB 4.18Å; L422-E476 HydrophobicContact CD2-CG 4.28Å; M467-E476 HydrophobicContact CE-CB 3.55Å; M467-E476 WeakPolarHBondContact CE-O 3.28Å; T473-E476 PolarHBondContact O-N 2.85Å; T473-E476 VanDerWaalsContact OG1-CG 3.25Å; T473-E476 WeakPolarHBondContact OG1-CG 3.4Å; T473-E476 PolarHBondContact OG1-OE2 3.42Å; E476-C478 PolarHBondContact O-N 2.76Å; E476-R479 PolarHBondContact O-N 3.04Å; E476-A480 PolarHBondContact O-N 3.36Å
477	L	85.3	Confident	82.1	Confident	18 Å²	18	47.5 Å²	47.5	9%	0.094	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-44.7	174.8	-74.1	169.1	0	0	0	111.5	M467 T473 D474 R479 A480 Y481 F524	M467-L477 HydrophobicContact CB-CD2 3.73Å; M467-L477 HydrophobicContact CE-CD2 4.15Å; M467-L477 HydrophobicContact CE-CG 4.34Å; T473-L477 PolarHBondContact O-N 3.22Å; T473-L477 VanDerWaalsContact O-N 3.15Å; D474-L477 PolarHBondContact O-N 2.74Å; L477-R479 VanDerWaalsContact C-N 3.31Å; L477-R479 PolarHBondContact O-N 3.46Å; L477-A480 PolarHBondContact O-N 3.46Å; L477-Y481 WeakPolarHBondContact O-CB 3.36Å; L477-Y481 VanDerWaalsContact O-CG 3.24Å; L477-Y481 PolarHBondContact O-N 2.85Å; L477-F524 HydrophobicContact CB-CE1 3.89Å; L477-F524 HydrophobicContact CB-CZ 4.26Å; L477-F524 HydrophobicContact CD1-CZ 4.11Å
478	C	86	Confident	82.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-40.7	176.5	-72.7	0	0	0	0	112.4	D474 E476 T482 L534	D474-C478 WeakPolarHBondContact O-CB 2.76Å; D474-C478 PolarHBondContact O-N 2.66Å; D474-C478 PolarHBondContact O-SG 3.45Å; E476-C478 PolarHBondContact O-N 2.76Å; C478-T482 WeakPolarHBondContact O-CB 3.42Å; C478-T482 PolarHBondContact O-N 3.47Å; C478-T482 PolarHBondContact O-OG1 2.91Å; C478-L534 HydrophobicContact CB-CD1 4.43Å
479	R	86.4	Confident	82.7	Confident	70 Å²	70	44 Å²	44	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-45.3	176.1	-75.4	-175.7	-75.4	170.6	-6.4	112	L422 E475 E476 L477 Y481 T482 R483 L534	L422-R479 HydrophobicContact CD2-CB 3.73Å; E475-R479 WeakPolarHBondContact O-CG 3.38Å; E475-R479 PolarHBondContact O-N 3.41Å; E475-R479 PolarHBondContact O-NE 2.97Å; E476-R479 PolarHBondContact O-N 3.04Å; L477-R479 VanDerWaalsContact C-N 3.31Å; L477-R479 PolarHBondContact O-N 3.46Å; R479-Y481 PolarHBondContact O-N 3.29Å; R479-T482 WeakPolarHBondContact O-CB 3.49Å; R479-T482 PolarHBondContact O-N 3Å; R479-R483 PolarHBondContact O-N 3.41Å; R479-R483 VanDerWaalsContact O-N 3.09Å; R479-L534 HydrophobicContact CG-CD1 3.94Å
480	A	86.1	Confident	83.2	Confident	4 Å²	4	41.7 Å²	41.7	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-44.3	176.4	0	0	0	0	0	111.8	L422 M467 E476 L477 T482 R483 K484	L422-A480 HydrophobicContact CD1-CB 4.04Å; M467-A480 HydrophobicContact CE-CB 4.04Å; M467-A480 HydrophobicContact SD-CB 3.59Å; M467-A480 VanDerWaalsContact SD-CB 3.59Å; E476-A480 PolarHBondContact O-N 3.36Å; L477-A480 PolarHBondContact O-N 3.46Å; A480-T482 VanDerWaalsContact C-N 3.34Å; A480-T482 PolarHBondContact O-N 3.3Å; A480-R483 PolarHBondContact O-N 3.4Å; A480-K484 PolarHBondContact O-N 3.15Å
481	Y	89.2	Confident	83.9	Confident	20 Å²	20	43.1 Å²	43.1	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-38.8	175.5	-69.1	-10.5	0	0	0	112.3	V464 E468 L477 R479 R483 K484 V485 L521 F524	V464-Y481 HydrophobicContact CG1-CE1 3.89Å; V464-Y481 HydrophobicContact CG2-CD1 4.27Å; V464-Y481 HydrophobicContact CG2-CE1 4.27Å; E468-Y481 PolarHBondContact OE1-OH 3.26Å; L477-Y481 WeakPolarHBondContact O-CB 3.36Å; L477-Y481 VanDerWaalsContact O-CG 3.24Å; L477-Y481 PolarHBondContact O-N 2.85Å; R479-Y481 PolarHBondContact O-N 3.29Å; Y481-R483 VanDerWaalsContact C-N 3.29Å; Y481-R483 PolarHBondContact O-N 3.22Å; Y481-K484 PolarHBondContact O-N 2.95Å; Y481-V485 WeakPolarHBondContact O-CB 3.32Å; Y481-V485 VanDerWaalsContact O-CG2 3.26Å; Y481-V485 WeakPolarHBondContact O-CG2 3.37Å; Y481-V485 PolarHBondContact O-N 3.46Å; Y481-L521 HydrophobicContact CD1-CD2 3.41Å; Y481-L521 VanDerWaalsContact CD1-CD2 3.41Å; Y481-L521 HydrophobicContact CD2-CD2 3.89Å; Y481-L521 HydrophobicContact CE1-CD2 3.71Å; Y481-L521 HydrophobicContact CE2-CD2 4.18Å; Y481-L521 HydrophobicContact CG-CD2 3.5Å; Y481-F524 HydrophobicContact CD2-CB 4.14Å; Y481-F524 AromaticContact CD2-CD1 3.49Å; Y481-F524 HydrophobicContact CD2-CD1 3.49Å; Y481-F524 VanDerWaalsContact CD2-CD1 3.49Å; Y481-F524 HydrophobicContact CD2-CE1 4.13Å; Y481-F524 AromaticContact CD2-CG 3.98Å; Y481-F524 HydrophobicContact CD2-CG 3.98Å; Y481-F524 HydrophobicContact CE2-CB 4.01Å; Y481-F524 AromaticContact CE2-CD1 3.36Å; Y481-F524 HydrophobicContact CE2-CD1 3.36Å; Y481-F524 HydrophobicContact CE2-CD2 4.21Å; Y481-F524 AromaticContact CE2-CE1 3.79Å; Y481-F524 HydrophobicContact CE2-CE1 3.79Å; Y481-F524 AromaticContact CE2-CG 3.59Å; Y481-F524 HydrophobicContact CE2-CG 3.59Å; Y481-F524 HydrophobicContact CE2-CZ 4.38Å
482	T	88.2	Confident	84.7	Confident	23 Å²	23	36.9 Å²	36.9	14%	0.141	18%	0.183	C	C	.	.	H	α-helix	trans	-60.2	-40.6	174.6	-59.2	0	0	0	0	111.4	C478 R479 A480 G486 L534	C478-T482 WeakPolarHBondContact O-CB 3.42Å; C478-T482 PolarHBondContact O-N 3.47Å; C478-T482 PolarHBondContact O-OG1 2.91Å; R479-T482 WeakPolarHBondContact O-CB 3.49Å; R479-T482 PolarHBondContact O-N 3Å; A480-T482 VanDerWaalsContact C-N 3.34Å; A480-T482 PolarHBondContact O-N 3.3Å; T482-G486 PolarHBondContact O-N 2.81Å; T482-L534 HydrophobicContact CG2-CD2 4.1Å
483	R	87	Confident	85.1	Confident	55 Å²	55	37.3 Å²	37.3	21%	0.208	18%	0.184	C	C	.	.	H	α-helix	trans	-67.7	-42	175.2	-66.8	-67.5	-177.7	158.8	1.8	112.1	E426 D429 D430 R479 A480 Y481 G486 H487	E426-R483 HydrophobicContact CG-CG 4.29Å; E426-R483 IonicContact OE1-NE 3.21Å; D429-R483 WeakPolarHBondContact OD2-CD 3.47Å; D429-R483 IonicContact OD2-CZ 3.95Å; D429-R483 IonicContact OD2-NH1 2.75Å; D429-R483 PolarHBondContact OD2-NH1 3.29Å; D430-R483 IonicContact OD1-CZ 3.14Å; D430-R483 IonicContact OD1-NH1 2.7Å; D430-R483 PolarHBondContact OD1-NH1 3.05Å; D430-R483 IonicContact OD1-NH2 2.99Å; D430-R483 PolarHBondContact OD1-NH2 2.97Å; D430-R483 IonicContact OD2-NH2 3.2Å; R479-R483 PolarHBondContact O-N 3.41Å; R479-R483 VanDerWaalsContact O-N 3.09Å; A480-R483 PolarHBondContact O-N 3.4Å; Y481-R483 VanDerWaalsContact C-N 3.29Å; Y481-R483 PolarHBondContact O-N 3.22Å; R483-G486 PolarHBondContact O-N 2.76Å; R483-H487 PolarHBondContact O-CD2 3.08Å; R483-H487 PolarHBondContact O-N 2.93Å
484	K	87.3	Confident	84.4	Confident	28 Å²	28	38.2 Å²	38.2	12%	0.122	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-47.6	173.9	-174.7	169.4	175.2	174.8	0	111.7	I460 N461 V464 A480 Y481 G486 H487 L488 L521	I460-K484 HydrophobicContact CG2-CB 3.66Å; I460-K484 HydrophobicContact CG2-CD 4.36Å; I460-K484 HydrophobicContact CG2-CG 3.99Å; N461-K484 VanDerWaalsContact OD1-CE 3.29Å; N461-K484 WeakPolarHBondContact OD1-CE 3.48Å; N461-K484 PolarHBondContact OD1-NZ 2.87Å; V464-K484 HydrophobicContact CG2-CD 4.16Å; A480-K484 PolarHBondContact O-N 3.15Å; Y481-K484 PolarHBondContact O-N 2.95Å; K484-G486 VanDerWaalsContact C-N 3.28Å; K484-G486 PolarHBondContact O-N 2.86Å; K484-H487 PolarHBondContact O-N 3.39Å; K484-L488 HydrophobicContact CG-CD1 3.82Å; K484-L488 WeakPolarHBondContact O-CG 3.4Å; K484-L488 PolarHBondContact O-N 3.39Å; K484-L521 HydrophobicContact CB-CD1 4.48Å; K484-L521 HydrophobicContact CD-CD1 3.88Å; K484-L521 HydrophobicContact CD-CD2 4.47Å; K484-L521 HydrophobicContact CG-CD1 4.02Å
485	V	89.5	Confident	83.4	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-58.9	-41.3	174.7	166.9	0	0	0	0	110.8	Y481 H487 L488 Y489 M518 L521 C541	Y481-V485 WeakPolarHBondContact O-CB 3.32Å; Y481-V485 VanDerWaalsContact O-CG2 3.26Å; Y481-V485 WeakPolarHBondContact O-CG2 3.37Å; Y481-V485 PolarHBondContact O-N 3.46Å; V485-H487 PolarHBondContact O-N 2.91Å; V485-L488 PolarHBondContact O-N 2.92Å; V485-L488 VanDerWaalsContact O-N 3.11Å; V485-Y489 WeakPolarHBondContact O-CB 3.28Å; V485-Y489 WeakPolarHBondContact O-CD1 3.44Å; V485-Y489 PolarHBondContact O-N 3.49Å; V485-M518 HydrophobicContact CB-SD 4.23Å; V485-M518 HydrophobicContact CG1-CE 4.12Å; V485-M518 HydrophobicContact CG1-SD 3.63Å; V485-M518 HydrophobicContact CG2-SD 3.85Å; V485-L521 HydrophobicContact CG2-CB 3.88Å; V485-L521 HydrophobicContact CG2-CD1 4.01Å; V485-C541 HydrophobicContact CG1-CB 3.38Å
486	G	87.4	Confident	82.2	Confident	24 Å²	24	32.9 Å²	32.9	25%	0.247	17%	0.174	C	C	.	.	H	α-helix	trans	-56.4	-31.5	177	0	0	0	0	0	114.8	T482 R483 K484 Y489 Y490	T482-G486 PolarHBondContact O-N 2.81Å; R483-G486 PolarHBondContact O-N 2.76Å; K484-G486 VanDerWaalsContact C-N 3.28Å; K484-G486 PolarHBondContact O-N 2.86Å; G486-Y489 WeakPolarHBondContact O-CD1 3.41Å; G486-Y489 WeakPolarHBondContact O-CE1 3.5Å; G486-Y490 WeakPolarHBondContact O-CE1 3.19Å
487	H	85.6	Confident	81.1	Confident	15 Å²	15	32 Å²	32	7%	0.069	17%	0.172	C	C	.	.	H	α-helix	trans	-94.6	-10.6	177.6	-77.3	-71.6	0	0	0	114.8	D429 I460 R483 K484 V485 K491	D429-H487 IonicContact OD1-CD2 2.73Å; D429-H487 IonicContact OD1-CE1 3.79Å; D429-H487 PolarHBondContact OD1-CE1 3.17Å; D429-H487 IonicContact OD1-NE2 2.89Å; D429-H487 PolarHBondContact OD1-NE2 2.83Å; D429-H487 IonicContact OD2-NE2 2.88Å; I460-H487 WeakPolarHBondContact CD1-CD2 3.42Å; R483-H487 PolarHBondContact O-CD2 3.08Å; R483-H487 PolarHBondContact O-N 2.93Å; K484-H487 PolarHBondContact O-N 3.39Å; V485-H487 PolarHBondContact O-N 2.91Å; H487-K491 WeakPolarHBondContact O-CE 3.34Å; H487-K491 PolarHBondContact O-NZ 3.27Å
488	L	85.8	Confident	79.6	Confident	33 Å²	33	34.9 Å²	34.9	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-100.5	-36	-178.1	-70.8	173	0	0	0	112.7	K484 V485 Y490 K491 M518	K484-L488 HydrophobicContact CG-CD1 3.82Å; K484-L488 WeakPolarHBondContact O-CG 3.4Å; K484-L488 PolarHBondContact O-N 3.39Å; V485-L488 PolarHBondContact O-N 2.92Å; V485-L488 VanDerWaalsContact O-N 3.11Å; L488-Y490 VanDerWaalsContact C-N 3.27Å; L488-Y490 PolarHBondContact O-N 3.45Å; L488-Y490 VanDerWaalsContact O-N 3.09Å; L488-K491 PolarHBondContact O-N 2.99Å; L488-K491 VanDerWaalsContact O-N 3.11Å; L488-M518 HydrophobicContact CB-CE 3.86Å
489	Y	90.2	Very high	77.7	Confident	15 Å²	15	41.2 Å²	41.2	6%	0.059	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.8	-162.9	80.8	-86.4	0	0	0	115.3	V485 G486 C541 Y544 L578 M644	V485-Y489 WeakPolarHBondContact O-CB 3.28Å; V485-Y489 WeakPolarHBondContact O-CD1 3.44Å; V485-Y489 PolarHBondContact O-N 3.49Å; G486-Y489 WeakPolarHBondContact O-CD1 3.41Å; G486-Y489 WeakPolarHBondContact O-CE1 3.5Å; Y489-C541 HydrophobicContact CG-CB 4.11Å; Y489-Y544 AromaticContact CD2-CD1 3.31Å; Y489-Y544 HydrophobicContact CD2-CD1 3.31Å; Y489-Y544 HydrophobicContact CD2-CD2 4.43Å; Y489-Y544 AromaticContact CD2-CE1 3.92Å; Y489-Y544 HydrophobicContact CD2-CE1 3.92Å; Y489-Y544 AromaticContact CD2-CG 3.6Å; Y489-Y544 HydrophobicContact CD2-CG 3.6Å; Y489-Y544 AromaticContact CE2-CD1 3.62Å; Y489-Y544 HydrophobicContact CE2-CD1 3.62Å; Y489-Y544 HydrophobicContact CE2-CD2 4.12Å; Y489-Y544 AromaticContact CE2-CE1 3.87Å; Y489-Y544 HydrophobicContact CE2-CE1 3.87Å; Y489-Y544 HydrophobicContact CE2-CE2 4.42Å; Y489-Y544 AromaticContact CE2-CG 3.73Å; Y489-Y544 HydrophobicContact CE2-CG 3.73Å; Y489-L578 HydrophobicContact CE2-CD1 4.15Å; Y489-M644 HydrophobicContact CE1-CE 3.92Å; Y489-M644 WeakPolarHBondContact OH-CE 3.42Å
490	Y	88.2	Confident	75.5	Confident	32 Å²	32	45 Å²	45	13%	0.125	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.7	-178.4	60.8	-94.8	0	0	0	114.6	E453 G486 L488 I548 H643 M644	E453-Y490 VanDerWaalsContact CD-OH 3.31Å; E453-Y490 PolarHBondContact OE1-OH 3.11Å; G486-Y490 WeakPolarHBondContact O-CE1 3.19Å; L488-Y490 VanDerWaalsContact C-N 3.27Å; L488-Y490 PolarHBondContact O-N 3.45Å; L488-Y490 VanDerWaalsContact O-N 3.09Å; Y490-I548 WeakPolarHBondContact O-CD1 3.34Å; Y490-H643 AromaticContact CE2-CD2 3.71Å; Y490-H643 AromaticContact CZ-NE2 3.86Å; Y490-M644 HydrophobicContact CD1-CE 3.85Å; Y490-M644 HydrophobicContact CE1-CE 4.11Å
491	K	84.4	Confident	73.4	Confident	67 Å²	67	51 Å²	51	29%	0.291	28%	0.283	S	S	.	.	S	Bend	trans	-83.3	129.5	179.9	-68.8	172.8	179.3	147.8	0	109.9	E453 C457 H487 L488 D493	E453-K491 WeakPolarHBondContact OE1-CE 3.45Å; E453-K491 IonicContact OE1-NZ 3.45Å; E453-K491 PolarHBondContact OE1-NZ 3.08Å; C457-K491 PolarHBondContact SG-NZ 3.06Å; C457-K491 VanDerWaalsContact SG-NZ 3.45Å; H487-K491 WeakPolarHBondContact O-CE 3.34Å; H487-K491 PolarHBondContact O-NZ 3.27Å; L488-K491 PolarHBondContact O-N 2.99Å; L488-K491 VanDerWaalsContact O-N 3.11Å; K491-D493 PolarHBondContact O-N 3.34Å
492	F	81	Confident	71.2	Confident	51 Å²	51	58.5 Å²	58.5	22%	0.224	32%	0.319	C	S	.	.			trans	-82.6	105.4	170.8	-179.4	-94.5	0	0	0	109.5	P494 V497 I548 H549 Q739	F492-P494 HydrophobicContact CE1-CB 4Å; F492-P494 WeakPolarHBondContact O-CD 2.89Å; F492-V497 HydrophobicContact CE1-CG2 4.24Å; F492-V497 HydrophobicContact CE2-CG2 3.65Å; F492-V497 HydrophobicContact CZ-CG2 3.32Å; F492-I548 HydrophobicContact CB-CG2 3.95Å; F492-I548 HydrophobicContact CD2-CG2 3.57Å; F492-I548 HydrophobicContact CG-CG2 4.24Å; F492-H549 AromaticContact CD2-ND1 3.92Å; F492-Q739 HydrophobicContact CB-CG 4.46Å; F492-Q739 HydrophobicContact CD1-CB 4.28Å; F492-Q739 HydrophobicContact CD1-CG 3.69Å; F492-Q739 HydrophobicContact CD2-CG 4.22Å; F492-Q739 HydrophobicContact CE1-CB 3.84Å; F492-Q739 HydrophobicContact CE1-CG 3.8Å; F492-Q739 HydrophobicContact CE2-CB 4.38Å; F492-Q739 HydrophobicContact CE2-CG 4.34Å; F492-Q739 HydrophobicContact CG-CG 3.88Å; F492-Q739 HydrophobicContact CZ-CB 3.87Å; F492-Q739 HydrophobicContact CZ-CG 4.1Å
493	D	74.9	Confident	68.8	Low	36 Å²	36	64.3 Å²	64.3	19%	0.193	35%	0.35	C	S	.	.			trans	-76.3	113.9	160.4	-176.1	5.8	0	0	0	111.1	K491 A495 S496 S514 H549	K491-D493 PolarHBondContact O-N 3.34Å; D493-A495 PolarHBondContact O-N 3.19Å; D493-A495 VanDerWaalsContact OD1-CB 3.28Å; D493-A495 WeakPolarHBondContact OD1-CB 3.24Å; D493-A495 PolarHBondContact OD1-N 3.41Å; D493-S496 PolarHBondContact O-N 2.77Å; D493-S496 PolarHBondContact O-OG 2.97Å; D493-S496 VanDerWaalsContact O-OG 3.07Å; D493-S514 WeakPolarHBondContact OD2-CB 3.41Å; D493-S514 PolarHBondContact OD2-N 3.12Å; D493-H549 PolarHBondContact N-CE1 3.34Å; D493-H549 VanDerWaalsContact N-CE1 3.31Å; D493-H549 PolarHBondContact O-CE1 3.12Å; D493-H549 PolarHBondContact O-ND1 2.89Å
494	P	65.3	Low	66.4	Low	96 Å²	96	67.8 Å²	67.8	62%	0.623	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-65.7	-21.6	174.7	27	-33.5	0	0	0	113	F492 S496	F492-P494 HydrophobicContact CE1-CB 4Å; F492-P494 WeakPolarHBondContact O-CD 2.89Å; P494-S496 VanDerWaalsContact C-N 3.32Å; P494-S496 PolarHBondContact O-N 3.11Å
495	A	58.3	Low	64.2	Low	60 Å²	60	71.5 Å²	71.5	50%	0.496	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-76.7	-16.6	-177.9	0	0	0	0	0	113.7	D493	D493-A495 PolarHBondContact O-N 3.19Å; D493-A495 VanDerWaalsContact OD1-CB 3.28Å; D493-A495 WeakPolarHBondContact OD1-CB 3.24Å; D493-A495 PolarHBondContact OD1-N 3.41Å
496	S	57.8	Low	62	Low	4 Å²	4	75.6 Å²	75.6	3%	0.028	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-96.9	-4	-178	66.6	0	0	0	0	114.2	D493 P494 H549 R551	D493-S496 PolarHBondContact O-N 2.77Å; D493-S496 PolarHBondContact O-OG 2.97Å; D493-S496 VanDerWaalsContact O-OG 3.07Å; P494-S496 VanDerWaalsContact C-N 3.32Å; P494-S496 PolarHBondContact O-N 3.11Å; S496-H549 PolarHBondContact OG-CE1 3.21Å; S496-H549 PolarHBondContact OG-ND1 3.36Å; S496-H549 PolarHBondContact OG-NE2 2.88Å; S496-R551 PolarHBondContact O-NH2 3.28Å
497	V	58.8	Low	60	Low	21 Å²	21	81 Å²	81	13%	0.127	44%	0.44	C	S	.	.	S	Bend	trans	-67.9	128.8	173.9	-176.7	0	0	0	0	108.6	F492 M499	F492-V497 HydrophobicContact CE1-CG2 4.24Å; F492-V497 HydrophobicContact CE2-CG2 3.65Å; F492-V497 HydrophobicContact CZ-CG2 3.32Å; V497-M499 VanDerWaalsContact C-N 3.3Å; V497-M499 PolarHBondContact O-N 2.84Å
498	P	53.3	Low	58	Low	77 Å²	77	87.1 Å²	87.1	50%	0.5	47%	0.466	S	S	.	.			trans	-64.6	93.7	169	-11.8	26.3	0	0	0	108.7	R551	P498-R551 HydrophobicContact CG-CG 4.41Å
499	M	46.7	Very low	55.9	Low	134 Å²	134	89.2 Å²	89.2	66%	0.66	48%	0.48	S	S	*	.			trans	-83.4	143.4	163.4	-78.1	-99.1	-78.8	0	0	108.1	V497 V501	V497-M499 VanDerWaalsContact C-N 3.3Å; V497-M499 PolarHBondContact O-N 2.84Å; M499-V501 PolarHBondContact O-N 2.79Å
500	D	40.7	Very low	53.5	Low	148 Å²	148	95.4 Å²	95.4	79%	0.791	51%	0.514	S	S	*	.			trans	-53	138.8	173	-62.1	-48.4	0	0	0	109.8	E502	D500-E502 PolarHBondContact O-N 2.78Å
501	V	42	Very low	51.3	Low	130 Å²	130	96 Å²	96	79%	0.788	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	5.5	-157.2	-178	0	0	0	0	114.9	M499	M499-V501 PolarHBondContact O-N 2.79Å
502	E	42.4	Very low	49.8	Very low	179 Å²	179	97.6 Å²	97.6	84%	0.836	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-9.9	-162.6	-61.2	-171.7	166.9	0	0	115.8	D500	D500-E502 PolarHBondContact O-N 2.78Å
503	N	38.4	Very low	49	Very low	145 Å²	145	96.2 Å²	96.2	78%	0.775	54%	0.539	S	S	*	.			trans	-120.9	34.1	-176.1	-85.2	-15.1	0	0	0	114.8	D505	N503-D505 PolarHBondContact O-N 3.21Å
504	F	37.2	Very low	49	Very low	127 Å²	127	95.1 Å²	95.1	56%	0.557	54%	0.535	S	S	*	.			trans	-81.2	102.8	177.6	-100.2	-83.1	0	0	0	112.2	S506 V509	F504-S506 PolarHBondContact O-N 3.35Å; F504-V509 HydrophobicContact CD1-CG2 3.36Å; F504-V509 HydrophobicContact CE1-CG2 3.67Å; F504-V509 HydrophobicContact CG-CG2 4.33Å
505	D	40.2	Very low	49.6	Very low	106 Å²	106	92 Å²	92	57%	0.567	51%	0.51	S	S	*	.			trans	-59	122.9	148.4	-74.4	-36.3	0	0	0	107.5	N503 D507 K508	N503-D505 PolarHBondContact O-N 3.21Å; D505-D507 PolarHBondContact O-N 2.99Å; D505-K508 PolarHBondContact O-N 3.29Å; D505-K508 VanDerWaalsContact O-N 3.08Å
506	S	43.6	Very low	50.8	Low	88 Å²	88	95.4 Å²	95.4	62%	0.615	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-51.4	-23.7	178.9	49.7	0	0	0	0	113.6	F504	F504-S506 PolarHBondContact O-N 3.35Å
507	D	44.5	Very low	52	Low	138 Å²	138	98.2 Å²	98.2	74%	0.738	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-79.7	-16.3	-175	-63.3	-8	0	0	0	113.4	D505	D505-D507 PolarHBondContact O-N 2.99Å
508	K	44.1	Very low	53.3	Low	143 Å²	143	97.2 Å²	97.2	62%	0.622	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-89.9	-9.4	175.7	-70.7	178.6	-176.9	161.3	0	113.9	D505 N510	D505-K508 PolarHBondContact O-N 3.29Å; D505-K508 VanDerWaalsContact O-N 3.08Å; K508-N510 VanDerWaalsContact C-N 3.28Å; K508-N510 PolarHBondContact O-N 3.17Å
509	V	42.6	Very low	55	Low	76 Å²	76	99.1 Å²	99.1	46%	0.461	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.9	179.7	-176	0	0	0	0	112	F504	F504-V509 HydrophobicContact CD1-CG2 3.36Å; F504-V509 HydrophobicContact CE1-CG2 3.67Å; F504-V509 HydrophobicContact CG-CG2 4.33Å
510	N	39.2	Very low	57	Low	146 Å²	146	96.8 Å²	96.8	78%	0.781	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	2	-177.6	-71.2	-25.3	0	0	0	114.4	K508	K508-N510 VanDerWaalsContact C-N 3.28Å; K508-N510 PolarHBondContact O-N 3.17Å
511	A	42.1	Very low	59.3	Low	44 Å²	44	90.2 Å²	90.2	36%	0.364	48%	0.476	S	S	.	.	S	Bend	trans	-63.5	138.1	171.6	0	0	0	0	0	109.3	C513	A511-C513 VanDerWaalsContact C-N 3.33Å; A511-C513 PolarHBondContact O-N 3.12Å
512	P	53.2	Low	61.5	Low	101 Å²	101	84 Å²	84	66%	0.656	44%	0.439	S	S	*	.			trans	-59.3	98.6	178	23.6	-31.7	0	0	0	108.6	S514 E517	P512-S514 PolarHBondContact O-N 3.09Å; P512-E517 WeakPolarHBondContact CB-OE1 3.25Å
513	C	63.5	Low	63.7	Low	22 Å²	22	79.9 Å²	79.9	15%	0.149	42%	0.419	C	S	.	.			trans	-72.3	118	-175.9	-174.7	0	0	0	0	107.3	A511 Y515 K516 E517	A511-C513 VanDerWaalsContact C-N 3.33Å; A511-C513 PolarHBondContact O-N 3.12Å; C513-Y515 PolarHBondContact O-N 3.34Å; C513-K516 HydrophobicContact CB-CB 4.4Å; C513-K516 HydrophobicContact CB-CD 4.25Å; C513-K516 HydrophobicContact CB-CG 4.13Å; C513-K516 PolarHBondContact O-N 2.68Å; C513-E517 PolarHBondContact O-N 3.39Å
514	S	74.2	Confident	66.1	Low	13 Å²	13	75.3 Å²	75.3	9%	0.091	39%	0.392	C	S	.	.	H	α-helix	trans	-52.8	-31.5	-179	-177.8	0	0	0	0	112.2	D493 P512 E517 M518 H545	D493-S514 WeakPolarHBondContact OD2-CB 3.41Å; D493-S514 PolarHBondContact OD2-N 3.12Å; P512-S514 PolarHBondContact O-N 3.09Å; S514-E517 PolarHBondContact O-N 3.21Å; S514-M518 VanDerWaalsContact O-CB 3.28Å; S514-M518 WeakPolarHBondContact O-CB 3.39Å; S514-M518 PolarHBondContact O-N 3.19Å; S514-H545 PolarHBondContact OG-CE1 3.16Å; S514-H545 VanDerWaalsContact OG-CE1 3.28Å
515	Y	79.7	Confident	68.6	Low	29 Å²	29	69.2 Å²	69.2	11%	0.114	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-43.1	174.3	176.2	-91.9	0	0	0	113.7	C513 R519 L546 R551 E554	C513-Y515 PolarHBondContact O-N 3.34Å; Y515-R519 VanDerWaalsContact O-CB 3.3Å; Y515-R519 WeakPolarHBondContact O-CB 3.46Å; Y515-R519 PolarHBondContact O-N 3.48Å; Y515-L546 HydrophobicContact CD2-CD2 3.97Å; Y515-L546 HydrophobicContact CE2-CD2 3.41Å; Y515-L546 VanDerWaalsContact CE2-CD2 3.41Å; Y515-R551 VanDerWaalsContact CE1-NH1 3.33Å; Y515-R551 PolarHBondContact OH-NH1 3.47Å; Y515-E554 WeakPolarHBondContact CE2-OE2 3.02Å; Y515-E554 PolarHBondContact OH-OE2 3.48Å
516	K	83.1	Confident	70.9	Confident	132 Å²	132	67.4 Å²	67.4	57%	0.574	35%	0.352	S	S	*	.	H	α-helix	trans	-66.8	-45.3	179.4	-71.3	-178.6	-178.4	173.6	0	109.9	C513 R519 T520	C513-K516 HydrophobicContact CB-CB 4.4Å; C513-K516 HydrophobicContact CB-CD 4.25Å; C513-K516 HydrophobicContact CB-CG 4.13Å; C513-K516 PolarHBondContact O-N 2.68Å; K516-R519 PolarHBondContact O-N 2.83Å; K516-T520 WeakPolarHBondContact O-CG2 3.23Å; K516-T520 PolarHBondContact O-N 3.28Å; K516-T520 PolarHBondContact O-OG1 3.28Å
517	E	83.4	Confident	73	Confident	63 Å²	63	68.7 Å²	68.7	29%	0.294	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-46	176.2	-63.6	-171.2	177	0	0	111.8	P512 C513 S514 R519 T520 L521	P512-E517 WeakPolarHBondContact CB-OE1 3.25Å; C513-E517 PolarHBondContact O-N 3.39Å; S514-E517 PolarHBondContact O-N 3.21Å; E517-R519 VanDerWaalsContact C-N 3.28Å; E517-R519 PolarHBondContact O-N 3.06Å; E517-T520 PolarHBondContact O-N 3.33Å; E517-T520 PolarHBondContact O-OG1 2.82Å; E517-L521 WeakPolarHBondContact O-CB 3.37Å; E517-L521 WeakPolarHBondContact O-CD1 3.41Å; E517-L521 WeakPolarHBondContact O-CG 3.5Å; E517-L521 PolarHBondContact O-N 2.85Å
518	M	86.2	Confident	74.8	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-59.2	-42.9	177.3	-174.8	62.1	64.9	0	0	111.1	V485 L488 S514 C522 H545	V485-M518 HydrophobicContact CB-SD 4.23Å; V485-M518 HydrophobicContact CG1-CE 4.12Å; V485-M518 HydrophobicContact CG1-SD 3.63Å; V485-M518 HydrophobicContact CG2-SD 3.85Å; L488-M518 HydrophobicContact CB-CE 3.86Å; S514-M518 VanDerWaalsContact O-CB 3.28Å; S514-M518 WeakPolarHBondContact O-CB 3.39Å; S514-M518 PolarHBondContact O-N 3.19Å; M518-C522 VanDerWaalsContact O-CB 3.32Å; M518-C522 WeakPolarHBondContact O-CB 3.34Å; M518-C522 PolarHBondContact O-N 3.18Å; M518-C522 PolarHBondContact O-SG 3.11Å; M518-H545 HydrophobicContact CE-CB 4.3Å; M518-H545 HydrophobicContact CG-CB 4.31Å
519	R	88	Confident	76.5	Confident	117 Å²	117	58.8 Å²	58.8	44%	0.442	31%	0.307	S	S	.	.	H	α-helix	trans	-66.1	-45.9	179.5	-177.1	174.7	176.5	166.5	-3.3	112	Y515 K516 E517 C522 Q523	Y515-R519 VanDerWaalsContact O-CB 3.3Å; Y515-R519 WeakPolarHBondContact O-CB 3.46Å; Y515-R519 PolarHBondContact O-N 3.48Å; K516-R519 PolarHBondContact O-N 2.83Å; E517-R519 VanDerWaalsContact C-N 3.28Å; E517-R519 PolarHBondContact O-N 3.06Å; R519-C522 PolarHBondContact O-N 3.34Å; R519-Q523 HydrophobicContact CG-CG 4.33Å; R519-Q523 VanDerWaalsContact O-CB 3.28Å; R519-Q523 WeakPolarHBondContact O-CB 3.45Å; R519-Q523 WeakPolarHBondContact O-CG 3.36Å; R519-Q523 PolarHBondContact O-N 3.27Å
520	T	88.4	Confident	78.2	Confident	84 Å²	84	59.3 Å²	59.3	52%	0.515	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-44.4	179.6	52.5	0	0	0	0	111.2	K516 E517 Q523 F524	K516-T520 WeakPolarHBondContact O-CG2 3.23Å; K516-T520 PolarHBondContact O-N 3.28Å; K516-T520 PolarHBondContact O-OG1 3.28Å; E517-T520 PolarHBondContact O-N 3.33Å; E517-T520 PolarHBondContact O-OG1 2.82Å; T520-Q523 PolarHBondContact O-N 3.34Å; T520-F524 PolarHBondContact O-N 2.89Å
521	L	88.8	Confident	79.8	Confident	11 Å²	11	55.7 Å²	55.7	6%	0.058	29%	0.294	C	S	.	.	H	α-helix	trans	-62.5	-46.8	177.8	-65.3	171	0	0	0	111.7	Y481 K484 V485 E517 F524 I525	Y481-L521 HydrophobicContact CD1-CD2 3.41Å; Y481-L521 VanDerWaalsContact CD1-CD2 3.41Å; Y481-L521 HydrophobicContact CD2-CD2 3.89Å; Y481-L521 HydrophobicContact CE1-CD2 3.71Å; Y481-L521 HydrophobicContact CE2-CD2 4.18Å; Y481-L521 HydrophobicContact CG-CD2 3.5Å; K484-L521 HydrophobicContact CB-CD1 4.48Å; K484-L521 HydrophobicContact CD-CD1 3.88Å; K484-L521 HydrophobicContact CD-CD2 4.47Å; K484-L521 HydrophobicContact CG-CD1 4.02Å; V485-L521 HydrophobicContact CG2-CB 3.88Å; V485-L521 HydrophobicContact CG2-CD1 4.01Å; E517-L521 WeakPolarHBondContact O-CB 3.37Å; E517-L521 WeakPolarHBondContact O-CD1 3.41Å; E517-L521 WeakPolarHBondContact O-CG 3.5Å; E517-L521 PolarHBondContact O-N 2.85Å; L521-F524 PolarHBondContact O-N 3.38Å; L521-I525 VanDerWaalsContact O-CG1 3.31Å; L521-I525 WeakPolarHBondContact O-CG1 3.15Å; L521-I525 PolarHBondContact O-N 3.22Å; L521-I525 VanDerWaalsContact O-N 3.09Å
522	C	88.5	Confident	81.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.7	-39.1	179.6	-66.1	0	0	0	0	112.1	M518 R519 F524 I525 Y526	M518-C522 VanDerWaalsContact O-CB 3.32Å; M518-C522 WeakPolarHBondContact O-CB 3.34Å; M518-C522 PolarHBondContact O-N 3.18Å; M518-C522 PolarHBondContact O-SG 3.11Å; R519-C522 PolarHBondContact O-N 3.34Å; C522-F524 VanDerWaalsContact C-N 3.31Å; C522-F524 PolarHBondContact O-N 3.4Å; C522-I525 PolarHBondContact O-N 3.27Å; C522-Y526 HydrophobicContact CB-CE2 4.02Å; C522-Y526 VanDerWaalsContact O-CD1 3.31Å; C522-Y526 WeakPolarHBondContact O-CD1 3.34Å; C522-Y526 VanDerWaalsContact O-CD2 3.23Å; C522-Y526 WeakPolarHBondContact O-CD2 3.4Å; C522-Y526 PolarHBondContact O-N 3.11Å
523	Q	89.7	Confident	83.2	Confident	91 Å²	91	58.6 Å²	58.6	43%	0.425	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-40.3	175.7	-77.2	177	-19.5	0	0	111.9	R519 T520 Y526 V527	R519-Q523 HydrophobicContact CG-CG 4.33Å; R519-Q523 VanDerWaalsContact O-CB 3.28Å; R519-Q523 WeakPolarHBondContact O-CB 3.45Å; R519-Q523 WeakPolarHBondContact O-CG 3.36Å; R519-Q523 PolarHBondContact O-N 3.27Å; T520-Q523 PolarHBondContact O-N 3.34Å; Q523-Y526 PolarHBondContact O-N 2.93Å; Q523-V527 WeakPolarHBondContact O-CG2 3.25Å; Q523-V527 PolarHBondContact O-N 3.47Å
524	F	88.4	Confident	84.3	Confident	49 Å²	49	58.7 Å²	58.7	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-47.5	174.2	-171.4	-88.6	0	0	0	111.3	L477 Y481 T520 L521 C522 Y526 V527 H528	L477-F524 HydrophobicContact CB-CE1 3.89Å; L477-F524 HydrophobicContact CB-CZ 4.26Å; L477-F524 HydrophobicContact CD1-CZ 4.11Å; Y481-F524 HydrophobicContact CD2-CB 4.14Å; Y481-F524 AromaticContact CD2-CD1 3.49Å; Y481-F524 HydrophobicContact CD2-CD1 3.49Å; Y481-F524 VanDerWaalsContact CD2-CD1 3.49Å; Y481-F524 HydrophobicContact CD2-CE1 4.13Å; Y481-F524 AromaticContact CD2-CG 3.98Å; Y481-F524 HydrophobicContact CD2-CG 3.98Å; Y481-F524 HydrophobicContact CE2-CB 4.01Å; Y481-F524 AromaticContact CE2-CD1 3.36Å; Y481-F524 HydrophobicContact CE2-CD1 3.36Å; Y481-F524 HydrophobicContact CE2-CD2 4.21Å; Y481-F524 AromaticContact CE2-CE1 3.79Å; Y481-F524 HydrophobicContact CE2-CE1 3.79Å; Y481-F524 AromaticContact CE2-CG 3.59Å; Y481-F524 HydrophobicContact CE2-CG 3.59Å; Y481-F524 HydrophobicContact CE2-CZ 4.38Å; T520-F524 PolarHBondContact O-N 2.89Å; L521-F524 PolarHBondContact O-N 3.38Å; C522-F524 VanDerWaalsContact C-N 3.31Å; C522-F524 PolarHBondContact O-N 3.4Å; F524-Y526 PolarHBondContact O-N 3.19Å; F524-V527 PolarHBondContact O-N 3.04Å; F524-V527 VanDerWaalsContact O-N 3.15Å; F524-H528 HydrophobicContact CD1-CB 4.4Å; F524-H528 AromaticContact CD2-CD2 3.55Å; F524-H528 AromaticContact CD2-NE2 3.85Å; F524-H528 HydrophobicContact CE1-CB 4.07Å; F524-H528 AromaticContact CE1-CD2 3.94Å; F524-H528 AromaticContact CE2-CD2 3.45Å; F524-H528 VanDerWaalsContact CE2-CD2 3.45Å; F524-H528 WeakPolarHBondContact CE2-CD2 3.2Å; F524-H528 AromaticContact CE2-NE2 3.56Å; F524-H528 AromaticContact CG-CD2 3.85Å; F524-H528 HydrophobicContact CZ-CB 4.36Å; F524-H528 AromaticContact CZ-CD2 3.66Å; F524-H528 AromaticContact CZ-CG 3.88Å; F524-H528 PolarHBondContact O-CD2 3.23Å; F524-H528 PolarHBondContact O-N 2.89Å
525	I	88.9	Confident	85	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-36.4	176.8	-63.4	165	0	0	0	111	L521 C522 V527 D529 A538	L521-I525 VanDerWaalsContact O-CG1 3.31Å; L521-I525 WeakPolarHBondContact O-CG1 3.15Å; L521-I525 PolarHBondContact O-N 3.22Å; L521-I525 VanDerWaalsContact O-N 3.09Å; C522-I525 PolarHBondContact O-N 3.27Å; I525-V527 VanDerWaalsContact C-N 3.31Å; I525-V527 PolarHBondContact O-N 3.4Å; I525-D529 HydrophobicContact CG2-CB 4.13Å; I525-D529 WeakPolarHBondContact O-CB 3.25Å; I525-D529 PolarHBondContact O-N 3.23Å; I525-A538 HydrophobicContact CB-CB 4.29Å; I525-A538 HydrophobicContact CD1-CB 3.85Å; I525-A538 HydrophobicContact CG2-CB 3.83Å
526	Y	88	Confident	85.5	Confident	68 Å²	68	62.5 Å²	62.5	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-66.6	-31.6	179.1	-60.5	-24.2	0	0	0	113.9	C522 Q523 F524 R535 A538 V539 Q542	C522-Y526 HydrophobicContact CB-CE2 4.02Å; C522-Y526 VanDerWaalsContact O-CD1 3.31Å; C522-Y526 WeakPolarHBondContact O-CD1 3.34Å; C522-Y526 VanDerWaalsContact O-CD2 3.23Å; C522-Y526 WeakPolarHBondContact O-CD2 3.4Å; C522-Y526 PolarHBondContact O-N 3.11Å; Q523-Y526 PolarHBondContact O-N 2.93Å; F524-Y526 PolarHBondContact O-N 3.19Å; Y526-R535 HydrophobicContact CD1-CG 3.98Å; Y526-R535 HydrophobicContact CE1-CG 4.42Å; Y526-A538 HydrophobicContact CE1-CB 4.33Å; Y526-V539 HydrophobicContact CD1-CG2 4.49Å; Y526-V539 HydrophobicContact CE1-CG2 3.49Å; Y526-V539 VanDerWaalsContact CE1-CG2 3.49Å; Y526-V539 WeakPolarHBondContact OH-CA 3.38Å; Y526-V539 WeakPolarHBondContact OH-CG2 3.48Å; Y526-Q542 PolarHBondContact OH-OE1 2.7Å
527	V	88.7	Confident	85.9	Confident	114 Å²	114	59.9 Å²	59.9	69%	0.691	29%	0.294	S	S	*	.	H	α-helix	trans	-86	-43.9	-177.6	175.8	0	0	0	0	111.6	Q523 F524 I525	Q523-V527 WeakPolarHBondContact O-CG2 3.25Å; Q523-V527 PolarHBondContact O-N 3.47Å; F524-V527 PolarHBondContact O-N 3.04Å; F524-V527 VanDerWaalsContact O-N 3.15Å; I525-V527 VanDerWaalsContact C-N 3.31Å; I525-V527 PolarHBondContact O-N 3.4Å
528	H	82.8	Confident	86.2	Confident	64 Å²	64	56.9 Å²	56.9	30%	0.296	28%	0.28	S	S	.	.	H	α-helix	trans	-98.4	-11.3	-166.1	-67.4	-83.8	0	0	0	114.5	D474 F524 T530	D474-H528 HydrophobicContact CB-CB 4.18Å; D474-H528 IonicContact OD2-CE1 3.01Å; D474-H528 IonicContact OD2-CG 3.75Å; D474-H528 IonicContact OD2-ND1 3.36Å; D474-H528 PolarHBondContact OD2-ND1 2.81Å; F524-H528 HydrophobicContact CD1-CB 4.4Å; F524-H528 AromaticContact CD2-CD2 3.55Å; F524-H528 AromaticContact CD2-NE2 3.85Å; F524-H528 HydrophobicContact CE1-CB 4.07Å; F524-H528 AromaticContact CE1-CD2 3.94Å; F524-H528 AromaticContact CE2-CD2 3.45Å; F524-H528 VanDerWaalsContact CE2-CD2 3.45Å; F524-H528 WeakPolarHBondContact CE2-CD2 3.2Å; F524-H528 AromaticContact CE2-NE2 3.56Å; F524-H528 AromaticContact CG-CD2 3.85Å; F524-H528 HydrophobicContact CZ-CB 4.36Å; F524-H528 AromaticContact CZ-CD2 3.66Å; F524-H528 AromaticContact CZ-CG 3.88Å; F524-H528 PolarHBondContact O-CD2 3.23Å; F524-H528 PolarHBondContact O-N 2.89Å; H528-T530 PolarHBondContact O-N 3.23Å
529	D	79.6	Confident	86.5	Confident	9 Å²	9	57.6 Å²	57.6	5%	0.048	28%	0.284	C	S	.	.			trans	-79.5	120.1	-172.5	-176.5	31.3	0	0	0	113.4	I525 T531 L534 R535	I525-D529 HydrophobicContact CG2-CB 4.13Å; I525-D529 WeakPolarHBondContact O-CB 3.25Å; I525-D529 PolarHBondContact O-N 3.23Å; D529-T531 WeakPolarHBondContact OD1-CA 3.42Å; D529-T531 WeakPolarHBondContact OD1-CB 3.33Å; D529-T531 PolarHBondContact OD1-N 3.34Å; D529-L534 WeakPolarHBondContact OD2-CB 3.42Å; D529-R535 PolarHBondContact O-NH2 2.81Å; D529-R535 WeakPolarHBondContact OD2-CA 3.29Å; D529-R535 VanDerWaalsContact OD2-CB 3.27Å; D529-R535 WeakPolarHBondContact OD2-CB 3.4Å; D529-R535 PolarHBondContact OD2-N 3.21Å
530	T	78	Confident	86.8	Confident	87 Å²	87	52 Å²	52	53%	0.534	26%	0.263	S	S	.	.			trans	-80.8	-24.7	169.7	54.1	0	0	0	0	112.2	E475 H528	E475-T530 PolarHBondContact OE1-OG1 3.49Å; H528-T530 PolarHBondContact O-N 3.23Å
531	T	72.3	Confident	87	Confident	71 Å²	71	48.5 Å²	48.5	44%	0.436	24%	0.242	S	C	.	.			trans	-102.3	91.1	-170.4	-57.9	0	0	0	0	110.4	D529 L533 L534	D529-T531 WeakPolarHBondContact OD1-CA 3.42Å; D529-T531 WeakPolarHBondContact OD1-CB 3.33Å; D529-T531 PolarHBondContact OD1-N 3.34Å; T531-L533 HydrophobicContact CG2-CB 4.19Å; T531-L533 CarbonylContact O-C 3.57Å; T531-L533 PolarHBondContact O-N 3.24Å; T531-L534 HydrophobicContact CG2-CG 4.45Å; T531-L534 PolarHBondContact O-N 3.44Å
532	H	82.2	Confident	87.1	Confident	139 Å²	139	48.9 Å²	48.9	64%	0.644	24%	0.243	S	C	*	.	H	α-helix	trans	-39.8	-27.5	-178.9	-67.7	-82.3	0	0	0	117.1	T536	H532-T536 WeakPolarHBondContact O-CB 3.42Å; H532-T536 PolarHBondContact O-N 3.39Å; H532-T536 VanDerWaalsContact O-N 3.08Å; H532-T536 PolarHBondContact O-OG1 3.5Å
533	L	85.6	Confident	87.4	Confident	66 Å²	66	48.9 Å²	48.9	35%	0.346	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-44.9	173.8	-177.7	64.2	0	0	0	113.4	T531 T536 R537 D572	T531-L533 HydrophobicContact CG2-CB 4.19Å; T531-L533 CarbonylContact O-C 3.57Å; T531-L533 PolarHBondContact O-N 3.24Å; L533-T536 PolarHBondContact O-N 2.83Å; L533-R537 WeakPolarHBondContact O-CG 3.28Å; L533-R537 PolarHBondContact O-N 3.27Å; L533-D572 WeakPolarHBondContact CD1-OD1 3.38Å
534	L	85.9	Confident	87.6	Confident	25 Å²	25	45.1 Å²	45.1	13%	0.131	23%	0.225	C	C	.	.	H	α-helix	trans	-66.3	-45.5	-178.8	-64.2	177.7	0	0	0	110.1	C478 R479 T482 D529 T531 T536 R537 A538	C478-L534 HydrophobicContact CB-CD1 4.43Å; R479-L534 HydrophobicContact CG-CD1 3.94Å; T482-L534 HydrophobicContact CG2-CD2 4.1Å; D529-L534 WeakPolarHBondContact OD2-CB 3.42Å; T531-L534 HydrophobicContact CG2-CG 4.45Å; T531-L534 PolarHBondContact O-N 3.44Å; L534-T536 VanDerWaalsContact C-N 3.33Å; L534-T536 PolarHBondContact O-N 3.21Å; L534-R537 PolarHBondContact O-N 3.44Å; L534-A538 WeakPolarHBondContact O-CB 3.37Å; L534-A538 PolarHBondContact O-N 3.36Å
535	R	89.3	Confident	87.7	Confident	90 Å²	90	42.8 Å²	42.8	34%	0.34	22%	0.215	S	C	.	.	H	α-helix	trans	-52.4	-49.9	171	-170	-177.9	-54.7	179.1	3.8	112.1	Y526 D529 R537 A538 V539	Y526-R535 HydrophobicContact CD1-CG 3.98Å; Y526-R535 HydrophobicContact CE1-CG 4.42Å; D529-R535 PolarHBondContact O-NH2 2.81Å; D529-R535 WeakPolarHBondContact OD2-CA 3.29Å; D529-R535 VanDerWaalsContact OD2-CB 3.27Å; D529-R535 WeakPolarHBondContact OD2-CB 3.4Å; D529-R535 PolarHBondContact OD2-N 3.21Å; R535-R537 PolarHBondContact O-N 2.7Å; R535-A538 PolarHBondContact O-N 3.35Å; R535-V539 VanDerWaalsContact O-CG2 3.31Å; R535-V539 WeakPolarHBondContact O-CG2 3.33Å; R535-V539 PolarHBondContact O-N 2.91Å
536	T	90.3	Very high	87.7	Confident	32 Å²	32	42.9 Å²	42.9	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-45.7	-179.9	-60.2	0	0	0	0	111.4	H532 L533 L534 V539 L540 L564 T575	H532-T536 WeakPolarHBondContact O-CB 3.42Å; H532-T536 PolarHBondContact O-N 3.39Å; H532-T536 VanDerWaalsContact O-N 3.08Å; H532-T536 PolarHBondContact O-OG1 3.5Å; L533-T536 PolarHBondContact O-N 2.83Å; L534-T536 VanDerWaalsContact C-N 3.33Å; L534-T536 PolarHBondContact O-N 3.21Å; T536-V539 PolarHBondContact O-N 3.46Å; T536-L540 HydrophobicContact CG2-CD1 4.26Å; T536-L540 VanDerWaalsContact O-CG 3.32Å; T536-L540 WeakPolarHBondContact O-CG 3.36Å; T536-L540 PolarHBondContact O-N 3.42Å; T536-L540 VanDerWaalsContact O-N 3.09Å; T536-L564 HydrophobicContact CG2-CD1 4.21Å; T536-L564 HydrophobicContact CG2-CD2 3.55Å; T536-T575 HydrophobicContact CG2-CG2 3.8Å
537	R	90.2	Very high	87.9	Confident	77 Å²	77	39.7 Å²	39.7	29%	0.291	20%	0.203	S	C	.	.	H	α-helix	trans	-64.5	-41.2	177.9	-71.8	176.3	175.2	-178.7	0.1	112.1	L533 L534 R535 L540 C541 D572 T575 L578	L533-R537 WeakPolarHBondContact O-CG 3.28Å; L533-R537 PolarHBondContact O-N 3.27Å; L534-R537 PolarHBondContact O-N 3.44Å; R535-R537 PolarHBondContact O-N 2.7Å; R537-L540 PolarHBondContact O-N 3.31Å; R537-C541 WeakPolarHBondContact O-CB 3.34Å; R537-C541 PolarHBondContact O-N 2.97Å; R537-C541 PolarHBondContact O-SG 3.07Å; R537-D572 IonicContact CZ-OD2 3.89Å; R537-D572 IonicContact NH2-OD2 3.91Å; R537-D572 PolarHBondContact NH2-OD2 3.45Å; R537-T575 HydrophobicContact CG-CG2 4.37Å; R537-T575 PolarHBondContact NE-OG1 3.36Å; R537-L578 HydrophobicContact CB-CD2 4.45Å; R537-L578 HydrophobicContact CG-CD2 4.5Å
538	A	91.1	Very high	87.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-44.9	176.1	0	0	0	0	0	111.9	I525 Y526 L534 R535 L540 C541 Q542	I525-A538 HydrophobicContact CB-CB 4.29Å; I525-A538 HydrophobicContact CD1-CB 3.85Å; I525-A538 HydrophobicContact CG2-CB 3.83Å; Y526-A538 HydrophobicContact CE1-CB 4.33Å; L534-A538 WeakPolarHBondContact O-CB 3.37Å; L534-A538 PolarHBondContact O-N 3.36Å; R535-A538 PolarHBondContact O-N 3.35Å; A538-L540 VanDerWaalsContact C-N 3.34Å; A538-L540 PolarHBondContact O-N 3.46Å; A538-C541 PolarHBondContact O-N 2.94Å; A538-Q542 WeakPolarHBondContact O-CB 3.49Å; A538-Q542 PolarHBondContact O-N 2.91Å
539	V	92.2	Very high	88.1	Confident	15 Å²	15	31.8 Å²	31.8	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-55.8	-49.1	173.9	171.5	0	0	0	0	110.9	Y526 R535 T536 Q542 V543 I558 L564	Y526-V539 HydrophobicContact CD1-CG2 4.49Å; Y526-V539 HydrophobicContact CE1-CG2 3.49Å; Y526-V539 VanDerWaalsContact CE1-CG2 3.49Å; Y526-V539 WeakPolarHBondContact OH-CA 3.38Å; Y526-V539 WeakPolarHBondContact OH-CG2 3.48Å; R535-V539 VanDerWaalsContact O-CG2 3.31Å; R535-V539 WeakPolarHBondContact O-CG2 3.33Å; R535-V539 PolarHBondContact O-N 2.91Å; T536-V539 PolarHBondContact O-N 3.46Å; V539-Q542 PolarHBondContact O-N 2.96Å; V539-V543 HydrophobicContact CG1-CG2 4.46Å; V539-V543 WeakPolarHBondContact O-CG2 3.36Å; V539-V543 PolarHBondContact O-N 3.31Å; V539-I558 HydrophobicContact CG1-CG2 3.82Å; V539-L564 HydrophobicContact CB-CD1 4.43Å; V539-L564 HydrophobicContact CG1-CD1 3.9Å
540	L	93.3	Very high	88.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-40.2	-178.1	-64.1	174.2	0	0	0	112.6	T536 R537 A538 V543 Y544 L564 T575 L578 F579	T536-L540 HydrophobicContact CG2-CD1 4.26Å; T536-L540 VanDerWaalsContact O-CG 3.32Å; T536-L540 WeakPolarHBondContact O-CG 3.36Å; T536-L540 PolarHBondContact O-N 3.42Å; T536-L540 VanDerWaalsContact O-N 3.09Å; R537-L540 PolarHBondContact O-N 3.31Å; A538-L540 VanDerWaalsContact C-N 3.34Å; A538-L540 PolarHBondContact O-N 3.46Å; L540-V543 PolarHBondContact O-N 3.15Å; L540-Y544 WeakPolarHBondContact O-CB 3.5Å; L540-Y544 PolarHBondContact O-N 2.97Å; L540-L564 HydrophobicContact CD2-CD1 3.75Å; L540-L564 HydrophobicContact CG-CD1 4.15Å; L540-T575 HydrophobicContact CD1-CG2 3.87Å; L540-L578 HydrophobicContact CB-CD2 3.73Å; L540-L578 HydrophobicContact CB-CG 3.78Å; L540-L578 HydrophobicContact CD1-CB 4.29Å; L540-L578 HydrophobicContact CD1-CD2 4.13Å; L540-L578 HydrophobicContact CD1-CG 4.13Å; L540-F579 HydrophobicContact CD1-CB 4.02Å; L540-F579 HydrophobicContact CD2-CB 4.18Å; L540-F579 HydrophobicContact CD2-CD2 3.84Å
541	C	92.4	Very high	88.8	Confident	10 Å²	10	30 Å²	30	7%	0.068	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-41	173.8	-71.3	0	0	0	0	111.7	V485 Y489 R537 A538 Y544 H545	V485-C541 HydrophobicContact CG1-CB 3.38Å; Y489-C541 HydrophobicContact CG-CB 4.11Å; R537-C541 WeakPolarHBondContact O-CB 3.34Å; R537-C541 PolarHBondContact O-N 2.97Å; R537-C541 PolarHBondContact O-SG 3.07Å; A538-C541 PolarHBondContact O-N 2.94Å; C541-Y544 PolarHBondContact O-N 2.99Å; C541-H545 WeakPolarHBondContact O-CB 3.28Å; C541-H545 PolarHBondContact O-N 2.89Å
542	Q	92.6	Very high	89.7	Confident	19 Å²	19	27.3 Å²	27.3	9%	0.089	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-48	175.5	-171.2	179.6	1.6	0	0	111	Y526 A538 V539 Y544 H545 L546 I558	Y526-Q542 PolarHBondContact OH-OE1 2.7Å; A538-Q542 WeakPolarHBondContact O-CB 3.49Å; A538-Q542 PolarHBondContact O-N 2.91Å; V539-Q542 PolarHBondContact O-N 2.96Å; Q542-Y544 VanDerWaalsContact C-N 3.28Å; Q542-Y544 PolarHBondContact O-N 2.88Å; Q542-H545 PolarHBondContact O-N 3.42Å; Q542-L546 HydrophobicContact CG-CD1 4Å; Q542-L546 HydrophobicContact CG-CG 4.36Å; Q542-L546 WeakPolarHBondContact O-CB 3.44Å; Q542-L546 WeakPolarHBondContact O-CG 3.26Å; Q542-L546 PolarHBondContact O-N 3.06Å; Q542-I558 HydrophobicContact CG-CD1 4.24Å
543	V	93	Very high	90.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.2	-42.1	176.9	172.2	0	0	0	0	110.9	V539 L540 A547 I558 L559 A582 L586	V539-V543 HydrophobicContact CG1-CG2 4.46Å; V539-V543 WeakPolarHBondContact O-CG2 3.36Å; V539-V543 PolarHBondContact O-N 3.31Å; L540-V543 PolarHBondContact O-N 3.15Å; V543-A547 WeakPolarHBondContact O-CB 3.21Å; V543-A547 PolarHBondContact O-N 3.28Å; V543-I558 HydrophobicContact CG2-CB 4.09Å; V543-I558 HydrophobicContact CG2-CG2 3.67Å; V543-L559 HydrophobicContact CG2-CB 4.29Å; V543-A582 HydrophobicContact CG1-CB 4.43Å; V543-L586 HydrophobicContact CG1-CD1 3.92Å
544	Y	93.9	Very high	90.4	Very high	12 Å²	12	27.5 Å²	27.5	5%	0.047	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-45.2	177.6	-167.6	-78.7	0	0	0	112.2	Y489 L540 C541 Q542 A547 I548 R581 A582 Q585 I646	Y489-Y544 AromaticContact CD2-CD1 3.31Å; Y489-Y544 HydrophobicContact CD2-CD1 3.31Å; Y489-Y544 HydrophobicContact CD2-CD2 4.43Å; Y489-Y544 AromaticContact CD2-CE1 3.92Å; Y489-Y544 HydrophobicContact CD2-CE1 3.92Å; Y489-Y544 AromaticContact CD2-CG 3.6Å; Y489-Y544 HydrophobicContact CD2-CG 3.6Å; Y489-Y544 AromaticContact CE2-CD1 3.62Å; Y489-Y544 HydrophobicContact CE2-CD1 3.62Å; Y489-Y544 HydrophobicContact CE2-CD2 4.12Å; Y489-Y544 AromaticContact CE2-CE1 3.87Å; Y489-Y544 HydrophobicContact CE2-CE1 3.87Å; Y489-Y544 HydrophobicContact CE2-CE2 4.42Å; Y489-Y544 AromaticContact CE2-CG 3.73Å; Y489-Y544 HydrophobicContact CE2-CG 3.73Å; L540-Y544 WeakPolarHBondContact O-CB 3.5Å; L540-Y544 PolarHBondContact O-N 2.97Å; C541-Y544 PolarHBondContact O-N 2.99Å; Q542-Y544 VanDerWaalsContact C-N 3.28Å; Q542-Y544 PolarHBondContact O-N 2.88Å; Y544-A547 PolarHBondContact O-N 3.07Å; Y544-I548 HydrophobicContact CD1-CD1 3.68Å; Y544-I548 HydrophobicContact CD1-CG1 4.2Å; Y544-I548 HydrophobicContact CE1-CD1 3.32Å; Y544-I548 HydrophobicContact CE1-CG1 4.06Å; Y544-I548 PolarHBondContact O-N 3.02Å; Y544-R581 HydrophobicContact CD2-CB 4.48Å; Y544-R581 HydrophobicContact CE2-CB 4.11Å; Y544-A582 HydrophobicContact CD2-CB 4.45Å; Y544-Q585 HydrophobicContact CD2-CB 3.92Å; Y544-Q585 HydrophobicContact CD2-CG 4.3Å; Y544-Q585 HydrophobicContact CE1-CG 4.48Å; Y544-Q585 HydrophobicContact CE2-CB 3.83Å; Y544-Q585 HydrophobicContact CE2-CG 4.17Å; Y544-Q585 HydrophobicContact CG-CB 4.5Å; Y544-Q585 HydrophobicContact CG-CG 4.47Å; Y544-I646 HydrophobicContact CE2-CD1 4.27Å
545	H	91.1	Very high	90.6	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-62.6	-46.8	177.5	-178.9	74.2	0	0	0	111.6	S514 M518 C541 Q542 A547 I548 H549	S514-H545 PolarHBondContact OG-CE1 3.16Å; S514-H545 VanDerWaalsContact OG-CE1 3.28Å; M518-H545 HydrophobicContact CE-CB 4.3Å; M518-H545 HydrophobicContact CG-CB 4.31Å; C541-H545 WeakPolarHBondContact O-CB 3.28Å; C541-H545 PolarHBondContact O-N 2.89Å; Q542-H545 PolarHBondContact O-N 3.42Å; H545-A547 VanDerWaalsContact C-N 3.29Å; H545-A547 PolarHBondContact O-N 3.37Å; H545-I548 WeakPolarHBondContact O-CB 3.46Å; H545-I548 PolarHBondContact O-N 3.01Å; H545-I548 VanDerWaalsContact O-N 3.12Å; H545-H549 AromaticContact CD2-CD2 3.77Å; H545-H549 AromaticContact CE1-CD2 3.27Å; H545-H549 PolarHBondContact CE1-CD2 3.44Å; H545-H549 AromaticContact CE1-NE2 2.93Å; H545-H549 PolarHBondContact CE1-NE2 2.91Å; H545-H549 AromaticContact CG-CD2 3.88Å; H545-H549 AromaticContact ND1-CD2 3.56Å; H545-H549 AromaticContact ND1-NE2 3.36Å; H545-H549 PolarHBondContact ND1-NE2 3.33Å; H545-H549 AromaticContact NE2-CD2 3.38Å; H545-H549 PolarHBondContact NE2-CD2 3.28Å; H545-H549 AromaticContact NE2-NE2 3.52Å; H545-H549 PolarHBondContact O-CD2 2.81Å; H545-H549 PolarHBondContact O-N 2.73Å; H545-H549 VanDerWaalsContact O-N 3.16Å
546	L	90.1	Very high	90.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-41.4	175.1	-67.4	172.4	0	0	0	112	Y515 Q542 I548 H549 R551 E554 I558	Y515-L546 HydrophobicContact CD2-CD2 3.97Å; Y515-L546 HydrophobicContact CE2-CD2 3.41Å; Y515-L546 VanDerWaalsContact CE2-CD2 3.41Å; Q542-L546 HydrophobicContact CG-CD1 4Å; Q542-L546 HydrophobicContact CG-CG 4.36Å; Q542-L546 WeakPolarHBondContact O-CB 3.44Å; Q542-L546 WeakPolarHBondContact O-CG 3.26Å; Q542-L546 PolarHBondContact O-N 3.06Å; L546-I548 VanDerWaalsContact C-N 3.3Å; L546-I548 PolarHBondContact O-N 3.19Å; L546-H549 PolarHBondContact O-N 3.13Å; L546-R551 HydrophobicContact CB-CB 4.49Å; L546-R551 HydrophobicContact CD2-CB 4.36Å; L546-R551 PolarHBondContact O-N 3.49Å; L546-E554 HydrophobicContact CD1-CB 4.04Å; L546-E554 HydrophobicContact CD2-CB 4.31Å; L546-E554 WeakPolarHBondContact CD2-OE2 3.27Å; L546-I558 HydrophobicContact CD1-CD1 3.47Å; L546-I558 VanDerWaalsContact CD1-CD1 3.47Å
547	A	90.6	Very high	90.8	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.017	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-32.8	177.4	0	0	0	0	0	112.1	V543 Y544 H545 Q585 L586 C589 R592	V543-A547 WeakPolarHBondContact O-CB 3.21Å; V543-A547 PolarHBondContact O-N 3.28Å; Y544-A547 PolarHBondContact O-N 3.07Å; H545-A547 VanDerWaalsContact C-N 3.29Å; H545-A547 PolarHBondContact O-N 3.37Å; A547-Q585 HydrophobicContact CB-CB 4.21Å; A547-Q585 HydrophobicContact CB-CG 3.75Å; A547-L586 HydrophobicContact CB-CB 4.45Å; A547-C589 HydrophobicContact CB-CB 4Å; A547-C589 VanDerWaalsContact O-CB 3.27Å; A547-C589 WeakPolarHBondContact O-CB 3.5Å; A547-C589 PolarHBondContact O-SG 2.94Å; A547-C589 VanDerWaalsContact O-SG 3.37Å; A547-R592 PolarHBondContact O-NH2 3.38Å
548	I	90	Very high	90.9	Very high	11 Å²	11	25.2 Å²	25.2	6%	0.056	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-41.1	173.6	-81.8	-178	0	0	0	111.9	Y490 F492 Y544 H545 L546 D550 Q585 R592	Y490-I548 WeakPolarHBondContact O-CD1 3.34Å; F492-I548 HydrophobicContact CB-CG2 3.95Å; F492-I548 HydrophobicContact CD2-CG2 3.57Å; F492-I548 HydrophobicContact CG-CG2 4.24Å; Y544-I548 HydrophobicContact CD1-CD1 3.68Å; Y544-I548 HydrophobicContact CD1-CG1 4.2Å; Y544-I548 HydrophobicContact CE1-CD1 3.32Å; Y544-I548 HydrophobicContact CE1-CG1 4.06Å; Y544-I548 PolarHBondContact O-N 3.02Å; H545-I548 WeakPolarHBondContact O-CB 3.46Å; H545-I548 PolarHBondContact O-N 3.01Å; H545-I548 VanDerWaalsContact O-N 3.12Å; L546-I548 VanDerWaalsContact C-N 3.3Å; L546-I548 PolarHBondContact O-N 3.19Å; I548-D550 PolarHBondContact O-N 3.43Å; I548-Q585 HydrophobicContact CG1-CG 4.03Å; I548-R592 PolarHBondContact O-NH1 3.04Å; I548-R592 PolarHBondContact O-NH2 3.44Å
549	H	87.1	Confident	90.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	22	-176.2	-66	-60.2	0	0	0	115.2	F492 D493 S496 H545 L546 R551	F492-H549 AromaticContact CD2-ND1 3.92Å; D493-H549 PolarHBondContact N-CE1 3.34Å; D493-H549 VanDerWaalsContact N-CE1 3.31Å; D493-H549 PolarHBondContact O-CE1 3.12Å; D493-H549 PolarHBondContact O-ND1 2.89Å; S496-H549 PolarHBondContact OG-CE1 3.21Å; S496-H549 PolarHBondContact OG-ND1 3.36Å; S496-H549 PolarHBondContact OG-NE2 2.88Å; H545-H549 AromaticContact CD2-CD2 3.77Å; H545-H549 AromaticContact CE1-CD2 3.27Å; H545-H549 PolarHBondContact CE1-CD2 3.44Å; H545-H549 AromaticContact CE1-NE2 2.93Å; H545-H549 PolarHBondContact CE1-NE2 2.91Å; H545-H549 AromaticContact CG-CD2 3.88Å; H545-H549 AromaticContact ND1-CD2 3.56Å; H545-H549 AromaticContact ND1-NE2 3.36Å; H545-H549 PolarHBondContact ND1-NE2 3.33Å; H545-H549 AromaticContact NE2-CD2 3.38Å; H545-H549 PolarHBondContact NE2-CD2 3.28Å; H545-H549 AromaticContact NE2-NE2 3.52Å; H545-H549 PolarHBondContact O-CD2 2.81Å; H545-H549 PolarHBondContact O-N 2.73Å; H545-H549 VanDerWaalsContact O-N 3.16Å; L546-H549 PolarHBondContact O-N 3.13Å; H549-R551 PolarHBondContact O-N 3.42Å; H549-R551 VanDerWaalsContact O-N 3.16Å
550	D	84.3	Confident	90.8	Very high	10 Å²	10	29.2 Å²	29.2	5%	0.053	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	19	178.7	-68.2	-42.3	0	0	0	113.9	I548 W552 R592 Q593 N740	I548-D550 PolarHBondContact O-N 3.43Å; D550-W552 PolarHBondContact O-N 3.36Å; D550-R592 WeakPolarHBondContact OD1-CB 3.19Å; D550-R592 VanDerWaalsContact OD1-CD 3.26Å; D550-R592 WeakPolarHBondContact OD1-CD 3.28Å; D550-R592 IonicContact OD1-CZ 2.72Å; D550-R592 IonicContact OD1-NE 2.94Å; D550-R592 PolarHBondContact OD1-NE 3.49Å; D550-R592 IonicContact OD1-NH1 3.14Å; D550-R592 PolarHBondContact OD1-NH1 3.1Å; D550-R592 IonicContact OD1-NH2 3.28Å; D550-R592 PolarHBondContact OD1-NH2 2.94Å; D550-R592 IonicContact OD2-NH1 2.73Å; D550-R592 PolarHBondContact OD2-NH1 3.39Å; D550-Q593 PolarHBondContact O-NE2 3.27Å; D550-N740 PolarHBondContact OD2-ND2 2.89Å
551	R	87.3	Confident	90.7	Very high	49 Å²	49	35.7 Å²	35.7	19%	0.185	16%	0.164	C	C	.	.			trans	-94.7	72.7	177.6	-60.1	-171.6	-165.2	-161.6	7.1	111.6	S496 P498 Y515 L546 H549 E554 G555	S496-R551 PolarHBondContact O-NH2 3.28Å; P498-R551 HydrophobicContact CG-CG 4.41Å; Y515-R551 VanDerWaalsContact CE1-NH1 3.33Å; Y515-R551 PolarHBondContact OH-NH1 3.47Å; L546-R551 HydrophobicContact CB-CB 4.49Å; L546-R551 HydrophobicContact CD2-CB 4.36Å; L546-R551 PolarHBondContact O-N 3.49Å; H549-R551 PolarHBondContact O-N 3.42Å; H549-R551 VanDerWaalsContact O-N 3.16Å; R551-E554 HydrophobicContact CB-CB 4.49Å; R551-E554 IonicContact NH1-OE1 2.75Å; R551-G555 PolarHBondContact O-N 2.98Å
552	W	90.8	Very high	90.4	Very high	15 Å²	15	37 Å²	37	6%	0.057	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-46.2	-175.3	-177.6	78.2	0	0	0	113.6	D550 G555 R556 Q593 L595 E598	D550-W552 PolarHBondContact O-N 3.36Å; W552-G555 PolarHBondContact O-N 2.9Å; W552-R556 HydrophobicContact CZ2-CG 4.41Å; W552-R556 WeakPolarHBondContact O-CB 3.16Å; W552-R556 PolarHBondContact O-N 3.3Å; W552-Q593 HydrophobicContact CB-CG 4.08Å; W552-L595 HydrophobicContact CD2-CD1 3.66Å; W552-L595 HydrophobicContact CE3-CD1 3.42Å; W552-L595 VanDerWaalsContact CE3-CD1 3.42Å; W552-L595 HydrophobicContact CG-CD1 4.41Å; W552-L595 HydrophobicContact CH2-CD1 3.72Å; W552-L595 HydrophobicContact CZ2-CD1 3.98Å; W552-L595 HydrophobicContact CZ3-CD1 3.46Å; W552-L595 VanDerWaalsContact CZ3-CD1 3.46Å; W552-E598 HydrophobicContact CH2-CG 4.11Å; W552-E598 HydrophobicContact CZ2-CB 3.96Å; W552-E598 HydrophobicContact CZ2-CG 3.85Å
553	Y	92.4	Very high	90.3	Very high	136 Å²	136	42.1 Å²	42.1	53%	0.533	20%	0.197	S	C	.	.	H	α-helix	trans	-61.7	-49.2	-176.1	-65	-75	0	0	0	112.3	G555 R556 D557	Y553-G555 VanDerWaalsContact C-N 3.33Å; Y553-G555 PolarHBondContact O-N 2.92Å; Y553-R556 PolarHBondContact O-N 2.88Å; Y553-D557 WeakPolarHBondContact O-CB 3.47Å; Y553-D557 PolarHBondContact O-N 3.23Å
554	E	90.6	Very high	90	Very high	73 Å²	73	42.9 Å²	42.9	34%	0.341	20%	0.201	S	C	.	.	H	α-helix	trans	-59.4	-43.7	176.8	-65.5	179.5	-153	0	0	111.5	Y515 L546 R551 D557 I558	Y515-E554 WeakPolarHBondContact CE2-OE2 3.02Å; Y515-E554 PolarHBondContact OH-OE2 3.48Å; L546-E554 HydrophobicContact CD1-CB 4.04Å; L546-E554 HydrophobicContact CD2-CB 4.31Å; L546-E554 WeakPolarHBondContact CD2-OE2 3.27Å; R551-E554 HydrophobicContact CB-CB 4.49Å; R551-E554 IonicContact NH1-OE1 2.75Å; E554-D557 PolarHBondContact O-N 3.48Å; E554-I558 VanDerWaalsContact O-CG1 3.3Å; E554-I558 WeakPolarHBondContact O-CG1 3.46Å; E554-I558 PolarHBondContact O-N 3.36Å; E554-I558 VanDerWaalsContact O-N 3.08Å
555	G	90.2	Very high	89.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-41.7	178.8	0	0	0	0	0	113.1	R551 W552 Y553 L559	R551-G555 PolarHBondContact O-N 2.98Å; W552-G555 PolarHBondContact O-N 2.9Å; Y553-G555 VanDerWaalsContact C-N 3.33Å; Y553-G555 PolarHBondContact O-N 2.92Å; G555-L559 WeakPolarHBondContact O-CB 3.48Å; G555-L559 PolarHBondContact O-N 3.24Å; G555-L559 VanDerWaalsContact O-N 3.09Å
556	R	91.1	Very high	89.2	Confident	85 Å²	85	48.6 Å²	48.6	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-48.2	175.6	-179.1	-161.2	69	-173.8	-1.8	110.8	W552 Y553 I558 L559 L560	W552-R556 HydrophobicContact CZ2-CG 4.41Å; W552-R556 WeakPolarHBondContact O-CB 3.16Å; W552-R556 PolarHBondContact O-N 3.3Å; Y553-R556 PolarHBondContact O-N 2.88Å; R556-I558 PolarHBondContact O-N 2.76Å; R556-L559 PolarHBondContact O-N 3.19Å; R556-L560 HydrophobicContact CG-CD1 3.87Å; R556-L560 HydrophobicContact CG-CG 4.39Å; R556-L560 WeakPolarHBondContact O-CB 3.29Å; R556-L560 WeakPolarHBondContact O-CG 3.48Å; R556-L560 PolarHBondContact O-N 2.98Å
557	D	93.4	Very high	89	Confident	62 Å²	62	53.9 Å²	53.9	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-65.7	-42.2	-174.4	-64.6	-11.4	0	0	0	110.4	Y553 E554 L559 L560 M561	Y553-D557 WeakPolarHBondContact O-CB 3.47Å; Y553-D557 PolarHBondContact O-N 3.23Å; E554-D557 PolarHBondContact O-N 3.48Å; D557-L559 PolarHBondContact O-N 2.95Å; D557-L560 PolarHBondContact O-N 2.99Å; D557-M561 VanDerWaalsContact O-CB 3.32Å; D557-M561 WeakPolarHBondContact O-CB 3.43Å; D557-M561 WeakPolarHBondContact O-CG 3.15Å; D557-M561 PolarHBondContact O-N 2.79Å
558	I	91.6	Very high	88.8	Confident	27 Å²	27	54.7 Å²	54.7	14%	0.138	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-44.1	174.7	-68	170.8	0	0	0	111.7	V539 Q542 V543 L546 E554 R556 L560 M561 S562	V539-I558 HydrophobicContact CG1-CG2 3.82Å; Q542-I558 HydrophobicContact CG-CD1 4.24Å; V543-I558 HydrophobicContact CG2-CB 4.09Å; V543-I558 HydrophobicContact CG2-CG2 3.67Å; L546-I558 HydrophobicContact CD1-CD1 3.47Å; L546-I558 VanDerWaalsContact CD1-CD1 3.47Å; E554-I558 VanDerWaalsContact O-CG1 3.3Å; E554-I558 WeakPolarHBondContact O-CG1 3.46Å; E554-I558 PolarHBondContact O-N 3.36Å; E554-I558 VanDerWaalsContact O-N 3.08Å; R556-I558 PolarHBondContact O-N 2.76Å; I558-L560 VanDerWaalsContact C-N 3.33Å; I558-L560 PolarHBondContact O-N 3.27Å; I558-M561 HydrophobicContact CB-CE 4.35Å; I558-M561 HydrophobicContact CG1-CE 3.84Å; I558-M561 PolarHBondContact O-N 3.46Å; I558-S562 WeakPolarHBondContact O-CB 3.43Å; I558-S562 PolarHBondContact O-N 3.21Å; I558-S562 VanDerWaalsContact O-N 3.11Å; I558-S562 PolarHBondContact O-OG 3.5Å
559	L	89.8	Confident	88.6	Confident	11 Å²	11	58.8 Å²	58.8	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-41.4	178.3	-172.7	66.9	0	0	0	111.5	V543 G555 R556 D557 S562 F579 L586	V543-L559 HydrophobicContact CG2-CB 4.29Å; G555-L559 WeakPolarHBondContact O-CB 3.48Å; G555-L559 PolarHBondContact O-N 3.24Å; G555-L559 VanDerWaalsContact O-N 3.09Å; R556-L559 PolarHBondContact O-N 3.19Å; D557-L559 PolarHBondContact O-N 2.95Å; L559-S562 PolarHBondContact O-OG 3.41Å; L559-F579 HydrophobicContact CD1-CE2 4.13Å; L559-L586 HydrophobicContact CD2-CD1 4.08Å
560	L	91.4	Very high	88.6	Confident	89 Å²	89	69.8 Å²	69.8	47%	0.466	32%	0.322	S	S	.	.	H	α-helix	trans	-71.4	-42.6	178.2	-69.7	176	0	0	0	112.5	R556 D557 I558 S562 H563	R556-L560 HydrophobicContact CG-CD1 3.87Å; R556-L560 HydrophobicContact CG-CG 4.39Å; R556-L560 WeakPolarHBondContact O-CB 3.29Å; R556-L560 WeakPolarHBondContact O-CG 3.48Å; R556-L560 PolarHBondContact O-N 2.98Å; D557-L560 PolarHBondContact O-N 2.99Å; I558-L560 VanDerWaalsContact C-N 3.33Å; I558-L560 PolarHBondContact O-N 3.27Å; L560-S562 PolarHBondContact O-N 3Å; L560-H563 PolarHBondContact O-N 3.35Å
561	M	90.2	Very high	88.7	Confident	136 Å²	136	70.8 Å²	70.8	67%	0.67	33%	0.33	S	S	*	.	H	α-helix	trans	-58.9	-34.2	176.7	-76.5	-173	-60.7	0	0	112.2	D557 I558 H563	D557-M561 VanDerWaalsContact O-CB 3.32Å; D557-M561 WeakPolarHBondContact O-CB 3.43Å; D557-M561 WeakPolarHBondContact O-CG 3.15Å; D557-M561 PolarHBondContact O-N 2.79Å; I558-M561 HydrophobicContact CB-CE 4.35Å; I558-M561 HydrophobicContact CG1-CE 3.84Å; I558-M561 PolarHBondContact O-N 3.46Å; M561-H563 VanDerWaalsContact C-N 3.3Å; M561-H563 PolarHBondContact O-CD2 2.9Å; M561-H563 PolarHBondContact O-N 3.42Å
562	S	87.5	Confident	88.8	Confident	37 Å²	37	70.9 Å²	70.9	26%	0.259	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-16.6	-177.9	72.8	0	0	0	0	114.6	I558 L559 L560 L564	I558-S562 WeakPolarHBondContact O-CB 3.43Å; I558-S562 PolarHBondContact O-N 3.21Å; I558-S562 VanDerWaalsContact O-N 3.11Å; I558-S562 PolarHBondContact O-OG 3.5Å; L559-S562 PolarHBondContact O-OG 3.41Å; L560-S562 PolarHBondContact O-N 3Å; S562-L564 PolarHBondContact O-N 2.99Å; S562-L564 WeakPolarHBondContact OG-CD1 3.44Å; S562-L564 VanDerWaalsContact OG-CG 3.24Å; S562-L564 WeakPolarHBondContact OG-CG 3.5Å; S562-L564 PolarHBondContact OG-N 3.09Å
563	H	89.7	Confident	88.7	Confident	127 Å²	127	73.6 Å²	73.6	59%	0.588	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	26.3	-172.9	-63.8	-74	0	0	0	114.5	L560 M561 Q565 T566	L560-H563 PolarHBondContact O-N 3.35Å; M561-H563 VanDerWaalsContact C-N 3.3Å; M561-H563 PolarHBondContact O-CD2 2.9Å; M561-H563 PolarHBondContact O-N 3.42Å; H563-Q565 PolarHBondContact O-N 2.85Å; H563-T566 PolarHBondContact O-N 3.26Å; H563-T566 PolarHBondContact O-OG1 2.93Å
564	L	85.9	Confident	88.5	Confident	15 Å²	15	70.3 Å²	70.3	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-23.1	-175.1	-73.7	170.8	0	0	0	113.4	T536 V539 L540 S562 T566 H567 I568	T536-L564 HydrophobicContact CG2-CD1 4.21Å; T536-L564 HydrophobicContact CG2-CD2 3.55Å; V539-L564 HydrophobicContact CB-CD1 4.43Å; V539-L564 HydrophobicContact CG1-CD1 3.9Å; L540-L564 HydrophobicContact CD2-CD1 3.75Å; L540-L564 HydrophobicContact CG-CD1 4.15Å; S562-L564 PolarHBondContact O-N 2.99Å; S562-L564 WeakPolarHBondContact OG-CD1 3.44Å; S562-L564 VanDerWaalsContact OG-CG 3.24Å; S562-L564 WeakPolarHBondContact OG-CG 3.5Å; S562-L564 PolarHBondContact OG-N 3.09Å; L564-T566 PolarHBondContact O-N 3Å; L564-T566 VanDerWaalsContact O-N 3.13Å; L564-H567 PolarHBondContact O-N 2.81Å; L564-H567 VanDerWaalsContact O-N 3.09Å; L564-I568 WeakPolarHBondContact O-CB 3.41Å; L564-I568 PolarHBondContact O-N 3.48Å
565	Q	84.3	Confident	88.5	Confident	54 Å²	54	66.8 Å²	66.8	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-27.9	178.7	-60.5	174.1	12.7	0	0	113.6	M1 H563 F579	M1-Q565 HydrophobicContact SD-CG 4.44Å; M1-Q565 PolarHBondContact SD-NE2 3.09Å; H563-Q565 PolarHBondContact O-N 2.85Å; Q565-F579 HydrophobicContact CG-CZ 4.39Å
566	T	85.6	Confident	88.6	Confident	80 Å²	80	69.6 Å²	69.6	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-91.4	-20	179.4	51.9	0	0	0	0	113.6	H563 L564	H563-T566 PolarHBondContact O-N 3.26Å; H563-T566 PolarHBondContact O-OG1 2.93Å; L564-T566 PolarHBondContact O-N 3Å; L564-T566 VanDerWaalsContact O-N 3.13Å
567	H	85	Confident	88.6	Confident	112 Å²	112	66.5 Å²	66.5	52%	0.519	33%	0.331	S	S	.	.	H	α-helix	trans	-109.9	-18	-171.4	-63	-67.4	0	0	0	113.8	L564 E569 R570	L564-H567 PolarHBondContact O-N 2.81Å; L564-H567 VanDerWaalsContact O-N 3.09Å; H567-E569 PolarHBondContact O-N 2.91Å; H567-E569 VanDerWaalsContact O-N 3.17Å; H567-R570 PolarHBondContact O-N 3.45Å; H567-R570 VanDerWaalsContact O-N 3.09Å
568	I	86.2	Confident	88.5	Confident	19 Å²	19	64.5 Å²	64.5	10%	0.097	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-61.6	-27	-172.7	-162.5	70	0	0	0	113.8	L564 R570 S571 T575 Q576 F579	L564-I568 WeakPolarHBondContact O-CB 3.41Å; L564-I568 PolarHBondContact O-N 3.48Å; I568-R570 PolarHBondContact O-N 3.15Å; I568-S571 WeakPolarHBondContact CD1-OG 3.36Å; I568-S571 PolarHBondContact O-N 3.39Å; I568-S571 VanDerWaalsContact O-N 3.17Å; I568-S571 PolarHBondContact O-OG 3.06Å; I568-T575 HydrophobicContact CD1-CG2 4.18Å; I568-Q576 HydrophobicContact CG1-CG 4.24Å; I568-Q576 WeakPolarHBondContact O-CG 3.12Å; I568-Q576 PolarHBondContact O-NE2 3.27Å; I568-F579 HydrophobicContact CD1-CB 3.62Å; I568-F579 HydrophobicContact CD1-CD2 4.3Å; I568-F579 HydrophobicContact CD1-CG 3.96Å; I568-F579 HydrophobicContact CG1-CB 3.83Å; I568-F579 HydrophobicContact CG1-CD1 3.97Å; I568-F579 HydrophobicContact CG1-CD2 4.3Å; I568-F579 HydrophobicContact CG1-CG 3.78Å; I568-F579 HydrophobicContact CG2-CD1 4.44Å; I568-F579 HydrophobicContact CG2-CE1 4.34Å
569	E	86.5	Confident	88.6	Confident	97 Å²	97	64.3 Å²	64.3	45%	0.453	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-63.9	-28.8	177.9	-60.4	-170.3	144	0	0	112.9	F4 H567 Q576	F4-E569 VanDerWaalsContact CB-OE1 3.23Å; F4-E569 WeakPolarHBondContact CB-OE1 3.48Å; F4-E569 WeakPolarHBondContact CD1-OE1 3.26Å; H567-E569 PolarHBondContact O-N 2.91Å; H567-E569 VanDerWaalsContact O-N 3.17Å; E569-Q576 PolarHBondContact O-NE2 3.08Å
570	R	87.1	Confident	88.8	Confident	230 Å²	230	64.7 Å²	64.7	87%	0.868	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-89.7	-9.5	179.5	-59.3	-178.9	-174.7	177.9	0.5	112.9	H567 I568	H567-R570 PolarHBondContact O-N 3.45Å; H567-R570 VanDerWaalsContact O-N 3.09Å; I568-R570 PolarHBondContact O-N 3.15Å
571	S	85.8	Confident	88.9	Confident	31 Å²	31	60.5 Å²	60.5	22%	0.217	30%	0.298	C	S	.	.	S	Bend	trans	-78.5	162.1	177.7	70.6	0	0	0	0	111.5	I568 Q576	I568-S571 WeakPolarHBondContact CD1-OG 3.36Å; I568-S571 PolarHBondContact O-N 3.39Å; I568-S571 VanDerWaalsContact O-N 3.17Å; I568-S571 PolarHBondContact O-OG 3.06Å; S571-Q576 PolarHBondContact O-NE2 3.28Å
572	D	88.5	Confident	89	Confident	52 Å²	52	54.1 Å²	54.1	28%	0.278	27%	0.267	S	S	.	.			trans	-57.9	149	173.7	63.8	-51.4	0	0	0	112.6	L533 R537 P574 T575 Q576	L533-D572 WeakPolarHBondContact CD1-OD1 3.38Å; R537-D572 IonicContact CZ-OD2 3.89Å; R537-D572 IonicContact NH2-OD2 3.91Å; R537-D572 PolarHBondContact NH2-OD2 3.45Å; D572-P574 WeakPolarHBondContact OD2-CD 3.23Å; D572-T575 WeakPolarHBondContact O-CB 3.45Å; D572-T575 PolarHBondContact O-N 2.87Å; D572-T575 WeakPolarHBondContact OD1-CB 3.46Å; D572-T575 PolarHBondContact OD1-OG1 3.37Å; D572-T575 PolarHBondContact OD2-OG1 2.97Å; D572-T575 VanDerWaalsContact OD2-OG1 3.13Å; D572-Q576 PolarHBondContact O-N 2.88Å
573	I	89.1	Confident	89.2	Confident	71 Å²	71	53.2 Å²	53.2	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-56.4	-41.3	-176.4	-61.5	168.5	0	0	0	112.8	T575 Q576 I577	I573-T575 VanDerWaalsContact C-N 3.31Å; I573-T575 PolarHBondContact O-N 2.93Å; I573-Q576 WeakPolarHBondContact O-CB 3.49Å; I573-Q576 PolarHBondContact O-N 3.03Å; I573-I577 HydrophobicContact CG2-CD1 3.99Å; I573-I577 HydrophobicContact CG2-CG1 4.47Å; I573-I577 WeakPolarHBondContact O-CG1 3.36Å; I573-I577 PolarHBondContact O-N 3.33Å
574	P	89.2	Confident	89.4	Confident	67 Å²	67	47.2 Å²	47.2	44%	0.435	23%	0.232	S	C	.	.	H	α-helix	trans	-57.9	-39.4	173.9	-26	35.9	0	0	0	113.8	D572 I577 L578	D572-P574 WeakPolarHBondContact OD2-CD 3.23Å; P574-I577 PolarHBondContact O-N 3.33Å; P574-L578 PolarHBondContact O-N 3.41Å
575	T	90.4	Very high	89.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.1	-35.6	176.5	-56.7	0	0	0	0	111.6	T536 R537 L540 I568 D572 I573 L578 F579	T536-T575 HydrophobicContact CG2-CG2 3.8Å; R537-T575 HydrophobicContact CG-CG2 4.37Å; R537-T575 PolarHBondContact NE-OG1 3.36Å; L540-T575 HydrophobicContact CD1-CG2 3.87Å; I568-T575 HydrophobicContact CD1-CG2 4.18Å; D572-T575 WeakPolarHBondContact O-CB 3.45Å; D572-T575 PolarHBondContact O-N 2.87Å; D572-T575 WeakPolarHBondContact OD1-CB 3.46Å; D572-T575 PolarHBondContact OD1-OG1 3.37Å; D572-T575 PolarHBondContact OD2-OG1 2.97Å; D572-T575 VanDerWaalsContact OD2-OG1 3.13Å; I573-T575 VanDerWaalsContact C-N 3.31Å; I573-T575 PolarHBondContact O-N 2.93Å; T575-L578 PolarHBondContact O-N 3.38Å; T575-F579 PolarHBondContact O-N 3.07Å
576	Q	91.3	Very high	90.1	Very high	59 Å²	59	45.8 Å²	45.8	28%	0.276	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-42	171.8	-62.6	-179.1	7.7	0	0	112	I568 E569 S571 D572 I573 L578 F579 N580	I568-Q576 HydrophobicContact CG1-CG 4.24Å; I568-Q576 WeakPolarHBondContact O-CG 3.12Å; I568-Q576 PolarHBondContact O-NE2 3.27Å; E569-Q576 PolarHBondContact O-NE2 3.08Å; S571-Q576 PolarHBondContact O-NE2 3.28Å; D572-Q576 PolarHBondContact O-N 2.88Å; I573-Q576 WeakPolarHBondContact O-CB 3.49Å; I573-Q576 PolarHBondContact O-N 3.03Å; Q576-L578 VanDerWaalsContact C-N 3.33Å; Q576-L578 PolarHBondContact O-N 3.31Å; Q576-F579 PolarHBondContact O-N 3.17Å; Q576-N580 VanDerWaalsContact O-CG 3.31Å; Q576-N580 PolarHBondContact O-N 3.38Å; Q576-N580 PolarHBondContact O-ND2 3.18Å
577	I	91.7	Very high	90.5	Very high	20 Å²	20	42 Å²	42	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-44.2	175	-68.2	160.7	0	0	0	110.1	I573 P574 F579 N580 R581 A617 R638 V640	I573-I577 HydrophobicContact CG2-CD1 3.99Å; I573-I577 HydrophobicContact CG2-CG1 4.47Å; I573-I577 WeakPolarHBondContact O-CG1 3.36Å; I573-I577 PolarHBondContact O-N 3.33Å; P574-I577 PolarHBondContact O-N 3.33Å; I577-F579 VanDerWaalsContact C-N 3.34Å; I577-F579 PolarHBondContact O-N 2.62Å; I577-N580 PolarHBondContact O-N 3.1Å; I577-R581 HydrophobicContact CG2-CG 4.47Å; I577-R581 WeakPolarHBondContact O-CB 3.45Å; I577-R581 WeakPolarHBondContact O-CD 3.41Å; I577-R581 WeakPolarHBondContact O-CG 3.22Å; I577-R581 PolarHBondContact O-N 3.21Å; I577-A617 HydrophobicContact CB-CB 4.48Å; I577-A617 HydrophobicContact CD1-CB 3.68Å; I577-A617 HydrophobicContact CG1-CB 4Å; I577-A617 HydrophobicContact CG2-CB 3.63Å; I577-R638 HydrophobicContact CD1-CB 4.45Å; I577-V640 HydrophobicContact CG2-CG1 4.39Å
578	L	92.5	Very high	90.8	Very high	20 Å²	20	36.9 Å²	36.9	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-40.7	176.8	-176.4	61.7	0	0	0	111.9	Y489 R537 L540 P574 T575 Q576 R581 A582	Y489-L578 HydrophobicContact CE2-CD1 4.15Å; R537-L578 HydrophobicContact CB-CD2 4.45Å; R537-L578 HydrophobicContact CG-CD2 4.5Å; L540-L578 HydrophobicContact CB-CD2 3.73Å; L540-L578 HydrophobicContact CB-CG 3.78Å; L540-L578 HydrophobicContact CD1-CB 4.29Å; L540-L578 HydrophobicContact CD1-CD2 4.13Å; L540-L578 HydrophobicContact CD1-CG 4.13Å; P574-L578 PolarHBondContact O-N 3.41Å; T575-L578 PolarHBondContact O-N 3.38Å; Q576-L578 VanDerWaalsContact C-N 3.33Å; Q576-L578 PolarHBondContact O-N 3.31Å; L578-R581 PolarHBondContact O-N 3.01Å; L578-A582 WeakPolarHBondContact O-CB 3.37Å; L578-A582 PolarHBondContact O-N 3.33Å
579	F	93.8	Very high	91.1	Very high	24 Å²	24	36 Å²	36	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-49.2	174.6	172.5	-96.4	0	0	0	111.7	L540 L559 Q565 I568 T575 Q576 I577 R581 A582 V583	L540-F579 HydrophobicContact CD1-CB 4.02Å; L540-F579 HydrophobicContact CD2-CB 4.18Å; L540-F579 HydrophobicContact CD2-CD2 3.84Å; L559-F579 HydrophobicContact CD1-CE2 4.13Å; Q565-F579 HydrophobicContact CG-CZ 4.39Å; I568-F579 HydrophobicContact CD1-CB 3.62Å; I568-F579 HydrophobicContact CD1-CD2 4.3Å; I568-F579 HydrophobicContact CD1-CG 3.96Å; I568-F579 HydrophobicContact CG1-CB 3.83Å; I568-F579 HydrophobicContact CG1-CD1 3.97Å; I568-F579 HydrophobicContact CG1-CD2 4.3Å; I568-F579 HydrophobicContact CG1-CG 3.78Å; I568-F579 HydrophobicContact CG2-CD1 4.44Å; I568-F579 HydrophobicContact CG2-CE1 4.34Å; T575-F579 PolarHBondContact O-N 3.07Å; Q576-F579 PolarHBondContact O-N 3.17Å; I577-F579 VanDerWaalsContact C-N 3.34Å; I577-F579 PolarHBondContact O-N 2.62Å; F579-R581 VanDerWaalsContact C-N 3.26Å; F579-R581 PolarHBondContact O-N 3.5Å; F579-A582 PolarHBondContact O-N 3.48Å; F579-A582 VanDerWaalsContact O-N 3.14Å; F579-V583 HydrophobicContact CD1-CG2 4.24Å; F579-V583 HydrophobicContact CD2-CG2 4.25Å; F579-V583 HydrophobicContact CE1-CG2 3.86Å; F579-V583 HydrophobicContact CE2-CG2 3.88Å; F579-V583 HydrophobicContact CG-CG2 4.43Å; F579-V583 HydrophobicContact CZ-CG2 3.67Å; F579-V583 WeakPolarHBondContact O-CG2 3.47Å; F579-V583 PolarHBondContact O-N 3.48Å
580	N	93	Very high	91.4	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.102	15%	0.153	C	C	.	.	H	α-helix	trans	-58.4	-40.4	177.5	-69.4	-21.7	0	0	0	111.7	Q576 I577 C584 L606 L615 L616	Q576-N580 VanDerWaalsContact O-CG 3.31Å; Q576-N580 PolarHBondContact O-N 3.38Å; Q576-N580 PolarHBondContact O-ND2 3.18Å; I577-N580 PolarHBondContact O-N 3.1Å; N580-C584 VanDerWaalsContact O-CB 3.28Å; N580-C584 WeakPolarHBondContact O-CB 3.49Å; N580-C584 PolarHBondContact O-N 3.26Å; N580-L606 HydrophobicContact CB-CD2 4.42Å; N580-L615 PolarHBondContact ND2-O 3.08Å; N580-L616 HydrophobicContact CB-CD2 4.2Å
581	R	92.8	Very high	91.6	Very high	1 Å²	1	20.4 Å²	20.4	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-66.3	-43.3	175.8	-70.9	166.7	59.6	85.9	14.1	112	Y544 I577 L578 F579 C584 Q585 L616 M644	Y544-R581 HydrophobicContact CD2-CB 4.48Å; Y544-R581 HydrophobicContact CE2-CB 4.11Å; I577-R581 HydrophobicContact CG2-CG 4.47Å; I577-R581 WeakPolarHBondContact O-CB 3.45Å; I577-R581 WeakPolarHBondContact O-CD 3.41Å; I577-R581 WeakPolarHBondContact O-CG 3.22Å; I577-R581 PolarHBondContact O-N 3.21Å; L578-R581 PolarHBondContact O-N 3.01Å; F579-R581 VanDerWaalsContact C-N 3.26Å; F579-R581 PolarHBondContact O-N 3.5Å; R581-C584 PolarHBondContact O-N 2.76Å; R581-Q585 WeakPolarHBondContact O-CB 3.4Å; R581-Q585 PolarHBondContact O-N 3.25Å; R581-L616 HydrophobicContact CG-CD2 3.88Å; R581-M644 PolarHBondContact NH1-O 3.25Å; R581-M644 PolarHBondContact NH2-O 3.37Å
582	A	92.7	Very high	91.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-42.9	176.4	0	0	0	0	0	112.1	V543 Y544 L578 F579 Q585 L586	V543-A582 HydrophobicContact CG1-CB 4.43Å; Y544-A582 HydrophobicContact CD2-CB 4.45Å; L578-A582 WeakPolarHBondContact O-CB 3.37Å; L578-A582 PolarHBondContact O-N 3.33Å; F579-A582 PolarHBondContact O-N 3.48Å; F579-A582 VanDerWaalsContact O-N 3.14Å; A582-Q585 PolarHBondContact O-N 3.08Å; A582-L586 VanDerWaalsContact O-CB 3.31Å; A582-L586 WeakPolarHBondContact O-CB 3.36Å; A582-L586 PolarHBondContact O-N 3.36Å
583	V	92.7	Very high	91.8	Very high	18 Å²	18	20.1 Å²	20.1	11%	0.109	10%	0.104	C	C	.	.	H	α-helix	trans	-64	-44	175.4	173.4	0	0	0	0	111	F579 Q585 L586 G587 A602 L606	F579-V583 HydrophobicContact CD1-CG2 4.24Å; F579-V583 HydrophobicContact CD2-CG2 4.25Å; F579-V583 HydrophobicContact CE1-CG2 3.86Å; F579-V583 HydrophobicContact CE2-CG2 3.88Å; F579-V583 HydrophobicContact CG-CG2 4.43Å; F579-V583 HydrophobicContact CZ-CG2 3.67Å; F579-V583 WeakPolarHBondContact O-CG2 3.47Å; F579-V583 PolarHBondContact O-N 3.48Å; V583-Q585 VanDerWaalsContact C-N 3.34Å; V583-Q585 PolarHBondContact O-N 2.95Å; V583-L586 PolarHBondContact O-N 3.25Å; V583-G587 PolarHBondContact O-N 2.85Å; V583-A602 HydrophobicContact CG1-CB 4.49Å; V583-L606 HydrophobicContact CG1-CD1 4.32Å
584	C	93.2	Very high	91.7	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.014	9%	0.094	C	C	.	.	H	α-helix	trans	-59.3	-45.6	175.5	-173.8	0	0	0	0	111.4	N580 R581 G587 L588 L606 L616 I646 T651	N580-C584 VanDerWaalsContact O-CB 3.28Å; N580-C584 WeakPolarHBondContact O-CB 3.49Å; N580-C584 PolarHBondContact O-N 3.26Å; R581-C584 PolarHBondContact O-N 2.76Å; C584-G587 PolarHBondContact O-N 3.46Å; C584-L588 PolarHBondContact O-N 3.29Å; C584-L606 HydrophobicContact CB-CD1 4.19Å; C584-L616 HydrophobicContact CB-CD2 4.18Å; C584-I646 HydrophobicContact CB-CD1 4.28Å; C584-T651 VanDerWaalsContact SG-CG2 3.5Å
585	Q	93.2	Very high	91.8	Very high	22 Å²	22	16.9 Å²	16.9	10%	0.103	9%	0.087	C	C	.	.	H	α-helix	trans	-67.8	-36.9	178.7	-167.5	60.9	22	0	0	112.2	Y544 A547 I548 R581 A582 V583 G587 L588 C589	Y544-Q585 HydrophobicContact CD2-CB 3.92Å; Y544-Q585 HydrophobicContact CD2-CG 4.3Å; Y544-Q585 HydrophobicContact CE1-CG 4.48Å; Y544-Q585 HydrophobicContact CE2-CB 3.83Å; Y544-Q585 HydrophobicContact CE2-CG 4.17Å; Y544-Q585 HydrophobicContact CG-CB 4.5Å; Y544-Q585 HydrophobicContact CG-CG 4.47Å; A547-Q585 HydrophobicContact CB-CB 4.21Å; A547-Q585 HydrophobicContact CB-CG 3.75Å; I548-Q585 HydrophobicContact CG1-CG 4.03Å; R581-Q585 WeakPolarHBondContact O-CB 3.4Å; R581-Q585 PolarHBondContact O-N 3.25Å; A582-Q585 PolarHBondContact O-N 3.08Å; V583-Q585 VanDerWaalsContact C-N 3.34Å; V583-Q585 PolarHBondContact O-N 2.95Å; Q585-G587 VanDerWaalsContact C-N 3.32Å; Q585-L588 PolarHBondContact O-N 2.91Å; Q585-C589 WeakPolarHBondContact O-CB 3.1Å; Q585-C589 PolarHBondContact O-N 3.45Å
586	L	92.6	Very high	91.9	Very high	17 Å²	17	17.4 Å²	17.4	9%	0.089	9%	0.09	C	C	.	.	H	α-helix	trans	-64.8	-37	173.6	-170.8	147.2	0	0	0	111.4	V543 A547 L559 A582 V583 C589 A590	V543-L586 HydrophobicContact CG1-CD1 3.92Å; A547-L586 HydrophobicContact CB-CB 4.45Å; L559-L586 HydrophobicContact CD2-CD1 4.08Å; A582-L586 VanDerWaalsContact O-CB 3.31Å; A582-L586 WeakPolarHBondContact O-CB 3.36Å; A582-L586 PolarHBondContact O-N 3.36Å; V583-L586 PolarHBondContact O-N 3.25Å; L586-C589 WeakPolarHBondContact O-CB 3.41Å; L586-C589 PolarHBondContact O-N 3.44Å; L586-A590 WeakPolarHBondContact O-CB 3.17Å; L586-A590 PolarHBondContact O-N 3.28Å
587	G	92.8	Very high	91.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.2	-41.9	171.1	0	0	0	0	0	112.8	V583 C584 Q585 A590 F591 A599	V583-G587 PolarHBondContact O-N 2.85Å; C584-G587 PolarHBondContact O-N 3.46Å; Q585-G587 VanDerWaalsContact C-N 3.32Å; G587-A590 WeakPolarHBondContact O-CB 3.34Å; G587-A590 PolarHBondContact O-N 3.15Å; G587-F591 PolarHBondContact O-N 3.28Å; G587-A599 WeakPolarHBondContact O-CB 3.27Å
588	L	92	Very high	91.9	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-66.9	-36.3	173	-66.4	177.5	0	0	0	112.4	C584 Q585 F591 R592 I646 L650 T651 V654	C584-L588 PolarHBondContact O-N 3.29Å; Q585-L588 PolarHBondContact O-N 2.91Å; L588-F591 WeakPolarHBondContact O-CB 3.48Å; L588-F591 PolarHBondContact O-N 2.96Å; L588-R592 WeakPolarHBondContact O-CG 3.38Å; L588-R592 PolarHBondContact O-N 3.09Å; L588-I646 HydrophobicContact CD1-CG2 3.97Å; L588-L650 HydrophobicContact CD1-CD2 3.75Å; L588-L650 HydrophobicContact CD2-CD2 3.7Å; L588-L650 HydrophobicContact CG-CD2 4.4Å; L588-T651 HydrophobicContact CD1-CG2 4.23Å; L588-T651 HydrophobicContact CD2-CG2 4.4Å; L588-V654 HydrophobicContact CD2-CB 4.18Å; L588-V654 HydrophobicContact CD2-CG1 4.15Å; L588-V654 HydrophobicContact CD2-CG2 3.98Å
589	C	91.6	Very high	91.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-45.2	173.4	-172.1	0	0	0	0	111.7	A547 Q585 L586 F591 R592 Q593	A547-C589 HydrophobicContact CB-CB 4Å; A547-C589 VanDerWaalsContact O-CB 3.27Å; A547-C589 WeakPolarHBondContact O-CB 3.5Å; A547-C589 PolarHBondContact O-SG 2.94Å; A547-C589 VanDerWaalsContact O-SG 3.37Å; Q585-C589 WeakPolarHBondContact O-CB 3.1Å; Q585-C589 PolarHBondContact O-N 3.45Å; L586-C589 WeakPolarHBondContact O-CB 3.41Å; L586-C589 PolarHBondContact O-N 3.44Å; C589-F591 PolarHBondContact O-N 3Å; C589-R592 PolarHBondContact O-N 3Å; C589-R592 VanDerWaalsContact O-N 3.16Å; C589-Q593 PolarHBondContact O-N 3.42Å; C589-Q593 VanDerWaalsContact O-N 3.08Å
590	A	92.9	Very high	91.7	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.8	-42.3	174.7	0	0	0	0	0	111.2	L586 G587 Q593 G594 L595 E598 A599	L586-A590 WeakPolarHBondContact O-CB 3.17Å; L586-A590 PolarHBondContact O-N 3.28Å; G587-A590 WeakPolarHBondContact O-CB 3.34Å; G587-A590 PolarHBondContact O-N 3.15Å; A590-Q593 PolarHBondContact O-N 2.96Å; A590-G594 PolarHBondContact O-N 3.24Å; A590-L595 HydrophobicContact CB-CB 4.45Å; A590-L595 PolarHBondContact O-N 3.31Å; A590-E598 HydrophobicContact CB-CB 4.28Å; A590-A599 HydrophobicContact CB-CB 3.94Å
591	F	92.2	Very high	91.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-47.2	175.7	-179.2	-109	0	0	0	112.2	G587 L588 C589 Q593 G594 A599 V654 L657 C658 W735 V744 M747 I748	G587-F591 PolarHBondContact O-N 3.28Å; L588-F591 WeakPolarHBondContact O-CB 3.48Å; L588-F591 PolarHBondContact O-N 2.96Å; C589-F591 PolarHBondContact O-N 3Å; F591-Q593 PolarHBondContact O-N 2.72Å; F591-G594 PolarHBondContact O-N 2.84Å; F591-A599 HydrophobicContact CB-CB 4.02Å; F591-V654 HydrophobicContact CB-CG1 3.78Å; F591-V654 HydrophobicContact CD1-CG1 3.8Å; F591-V654 HydrophobicContact CD1-CG2 3.94Å; F591-V654 HydrophobicContact CD2-CG1 3.76Å; F591-V654 HydrophobicContact CE1-CG1 4.33Å; F591-V654 HydrophobicContact CE1-CG2 3.98Å; F591-V654 HydrophobicContact CE2-CG1 4.29Å; F591-V654 HydrophobicContact CG-CG1 3.48Å; F591-V654 VanDerWaalsContact CG-CG1 3.48Å; F591-V654 HydrophobicContact CG-CG2 4.47Å; F591-L657 HydrophobicContact CE2-CD2 3.6Å; F591-L657 HydrophobicContact CZ-CD2 3.84Å; F591-C658 VanDerWaalsContact CD2-SG 3.51Å; F591-W735 HydrophobicContact CE1-CH2 4.46Å; F591-W735 HydrophobicContact CE1-CZ3 4.05Å; F591-W735 HydrophobicContact CZ-CH2 4.39Å; F591-W735 HydrophobicContact CZ-CZ3 4.42Å; F591-V744 HydrophobicContact CE1-CG1 3.84Å; F591-M747 HydrophobicContact CD1-CE 4.29Å; F591-M747 HydrophobicContact CD2-CE 4.36Å; F591-M747 HydrophobicContact CE1-CE 4Å; F591-M747 HydrophobicContact CE2-CE 4.07Å; F591-M747 HydrophobicContact CG-CE 4.47Å; F591-M747 HydrophobicContact CZ-CE 3.9Å; F591-M747 WeakPolarHBondContact O-CE 3.47Å; F591-I748 HydrophobicContact CE1-CD1 4.27Å; F591-I748 HydrophobicContact CZ-CD1 3.86Å; F591-I748 HydrophobicContact CZ-CG1 3.84Å
592	R	89.8	Confident	91.4	Very high	9 Å²	9	27.7 Å²	27.7	3%	0.034	13%	0.134	C	C	.	.	H	α-helix	trans	-61.5	-29.7	178.5	-71.6	-171.9	-72.8	166.8	-2.4	113.6	A547 I548 D550 L588 C589 G594 F738 V744	A547-R592 PolarHBondContact O-NH2 3.38Å; I548-R592 PolarHBondContact O-NH1 3.04Å; I548-R592 PolarHBondContact O-NH2 3.44Å; D550-R592 WeakPolarHBondContact OD1-CB 3.19Å; D550-R592 VanDerWaalsContact OD1-CD 3.26Å; D550-R592 WeakPolarHBondContact OD1-CD 3.28Å; D550-R592 IonicContact OD1-CZ 2.72Å; D550-R592 IonicContact OD1-NE 2.94Å; D550-R592 PolarHBondContact OD1-NE 3.49Å; D550-R592 IonicContact OD1-NH1 3.14Å; D550-R592 PolarHBondContact OD1-NH1 3.1Å; D550-R592 IonicContact OD1-NH2 3.28Å; D550-R592 PolarHBondContact OD1-NH2 2.94Å; D550-R592 IonicContact OD2-NH1 2.73Å; D550-R592 PolarHBondContact OD2-NH1 3.39Å; L588-R592 WeakPolarHBondContact O-CG 3.38Å; L588-R592 PolarHBondContact O-N 3.09Å; C589-R592 PolarHBondContact O-N 3Å; C589-R592 VanDerWaalsContact O-N 3.16Å; R592-G594 VanDerWaalsContact C-N 3.31Å; R592-F738 HydrophobicContact CG-CD1 4.4Å; R592-F738 HydrophobicContact CG-CE1 4.33Å; R592-V744 HydrophobicContact CG-CG2 3.94Å
593	Q	88.7	Confident	91.3	Very high	68 Å²	68	27.9 Å²	27.9	32%	0.318	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-0.2	174.9	-68	-63.3	-8.4	0	0	114.3	D550 W552 C589 A590 F591 L595	D550-Q593 PolarHBondContact O-NE2 3.27Å; W552-Q593 HydrophobicContact CB-CG 4.08Å; C589-Q593 PolarHBondContact O-N 3.42Å; C589-Q593 VanDerWaalsContact O-N 3.08Å; A590-Q593 PolarHBondContact O-N 2.96Å; F591-Q593 PolarHBondContact O-N 2.72Å; Q593-L595 VanDerWaalsContact C-N 3.34Å
594	G	87	Confident	91.1	Very high	15 Å²	15	28.2 Å²	28.2	16%	0.155	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	9.5	-179.2	0	0	0	0	0	114.5	A590 F591 R592 I596 H751	A590-G594 PolarHBondContact O-N 3.24Å; F591-G594 PolarHBondContact O-N 2.84Å; R592-G594 VanDerWaalsContact C-N 3.31Å; G594-I596 PolarHBondContact O-N 3.06Å; G594-I596 VanDerWaalsContact O-N 3.09Å; G594-H751 PolarHBondContact O-NE2 3.49Å
595	L	91.7	Very high	90.6	Very high	54 Å²	54	31.9 Å²	31.9	28%	0.283	16%	0.158	S	C	.	.			trans	-86.8	75.3	178.2	-62.1	173.6	0	0	0	110.4	W552 A590 Q593 R597 E598 A599	W552-L595 HydrophobicContact CD2-CD1 3.66Å; W552-L595 HydrophobicContact CE3-CD1 3.42Å; W552-L595 VanDerWaalsContact CE3-CD1 3.42Å; W552-L595 HydrophobicContact CG-CD1 4.41Å; W552-L595 HydrophobicContact CH2-CD1 3.72Å; W552-L595 HydrophobicContact CZ2-CD1 3.98Å; W552-L595 HydrophobicContact CZ3-CD1 3.46Å; W552-L595 VanDerWaalsContact CZ3-CD1 3.46Å; A590-L595 HydrophobicContact CB-CB 4.45Å; A590-L595 PolarHBondContact O-N 3.31Å; Q593-L595 VanDerWaalsContact C-N 3.34Å; L595-R597 PolarHBondContact O-N 3.17Å; L595-E598 HydrophobicContact CB-CB 4.29Å; L595-E598 HydrophobicContact CB-CG 4.49Å; L595-E598 PolarHBondContact O-N 2.57Å; L595-A599 WeakPolarHBondContact O-CB 3.38Å; L595-A599 PolarHBondContact O-N 2.82Å
596	I	91.2	Very high	90.2	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.062	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-42.4	-172.6	-60.7	164.2	0	0	0	112.5	G594 A599 L600 C658 L661 L662 H751	G594-I596 PolarHBondContact O-N 3.06Å; G594-I596 VanDerWaalsContact O-N 3.09Å; I596-A599 PolarHBondContact O-N 3.24Å; I596-L600 WeakPolarHBondContact O-CB 3.46Å; I596-L600 PolarHBondContact O-N 3.44Å; I596-C658 HydrophobicContact CG2-CB 3.77Å; I596-L661 HydrophobicContact CD1-CB 4.4Å; I596-L661 HydrophobicContact CD1-CD1 3.6Å; I596-L661 HydrophobicContact CG1-CD1 4.39Å; I596-L661 HydrophobicContact CG2-CB 4.47Å; I596-L662 HydrophobicContact CG2-CD1 4.01Å; I596-L662 HydrophobicContact CG2-CG 4.02Å; I596-H751 HydrophobicContact CD1-CB 3.99Å; I596-H751 WeakPolarHBondContact CD1-ND1 3.44Å
597	R	91.4	Very high	89.8	Confident	162 Å²	162	32.1 Å²	32.1	61%	0.611	16%	0.159	S	C	*	.	H	α-helix	trans	-63.7	-44.4	-178.8	-69.2	-179	179	141.8	-3.3	112.1	L595 L600 N601 L662	L595-R597 PolarHBondContact O-N 3.17Å; R597-L600 PolarHBondContact O-N 3.21Å; R597-N601 VanDerWaalsContact O-CG 3.25Å; R597-N601 PolarHBondContact O-N 3.4Å; R597-N601 PolarHBondContact O-ND2 3.47Å; R597-L662 HydrophobicContact CG-CD1 3.86Å; R597-L662 HydrophobicContact CG-CD2 3.81Å
598	E	91.9	Very high	89.3	Confident	93 Å²	93	35.8 Å²	35.8	44%	0.435	18%	0.179	S	C	.	.	H	α-helix	trans	-68.4	-39.9	178.3	-62.6	-57.5	151.7	0	0	111.6	W552 A590 L595 L600 N601 A602	W552-E598 HydrophobicContact CH2-CG 4.11Å; W552-E598 HydrophobicContact CZ2-CB 3.96Å; W552-E598 HydrophobicContact CZ2-CG 3.85Å; A590-E598 HydrophobicContact CB-CB 4.28Å; L595-E598 HydrophobicContact CB-CB 4.29Å; L595-E598 HydrophobicContact CB-CG 4.49Å; L595-E598 PolarHBondContact O-N 2.57Å; E598-L600 VanDerWaalsContact C-N 3.35Å; E598-L600 PolarHBondContact O-N 2.58Å; E598-N601 PolarHBondContact O-N 2.87Å; E598-A602 WeakPolarHBondContact O-CB 3.28Å; E598-A602 PolarHBondContact O-N 3.47Å
599	A	91.9	Very high	88.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-44.3	174.2	0	0	0	0	0	111.8	G587 A590 F591 L595 I596 L603	G587-A599 WeakPolarHBondContact O-CB 3.27Å; A590-A599 HydrophobicContact CB-CB 3.94Å; F591-A599 HydrophobicContact CB-CB 4.02Å; L595-A599 WeakPolarHBondContact O-CB 3.38Å; L595-A599 PolarHBondContact O-N 2.82Å; I596-A599 PolarHBondContact O-N 3.24Å; A599-L603 WeakPolarHBondContact O-CB 3.36Å; A599-L603 WeakPolarHBondContact O-CG 3.4Å; A599-L603 PolarHBondContact O-N 3.3Å; A599-L603 VanDerWaalsContact O-N 3.12Å
600	L	91	Very high	87.9	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-47.2	177	-176.5	66.1	0	0	0	111.3	I596 R597 E598 A602 L603 S604 Y655 C658 A659 L662 I679	I596-L600 WeakPolarHBondContact O-CB 3.46Å; I596-L600 PolarHBondContact O-N 3.44Å; R597-L600 PolarHBondContact O-N 3.21Å; E598-L600 VanDerWaalsContact C-N 3.35Å; E598-L600 PolarHBondContact O-N 2.58Å; L600-A602 PolarHBondContact O-N 3.28Å; L600-L603 PolarHBondContact O-N 2.8Å; L600-S604 VanDerWaalsContact O-CB 3.24Å; L600-S604 WeakPolarHBondContact O-CB 3.32Å; L600-S604 PolarHBondContact O-N 2.94Å; L600-Y655 HydrophobicContact CD1-CD2 3.77Å; L600-Y655 HydrophobicContact CD1-CE2 3.49Å; L600-Y655 VanDerWaalsContact CD1-CE2 3.49Å; L600-C658 HydrophobicContact CB-CB 4.14Å; L600-C658 HydrophobicContact CD1-CB 4.29Å; L600-A659 HydrophobicContact CD1-CB 4.04Å; L600-L662 HydrophobicContact CB-CD1 4.38Å; L600-L662 HydrophobicContact CD2-CD1 3.69Å; L600-I679 HydrophobicContact CD2-CG2 3.62Å
601	N	91	Very high	87.4	Confident	88 Å²	88	46.3 Å²	46.3	47%	0.471	25%	0.25	S	C	.	.	H	α-helix	trans	-60.1	-46.3	-179.4	-71.7	-21	0	0	0	111.6	R597 E598 L603 S604	R597-N601 VanDerWaalsContact O-CG 3.25Å; R597-N601 PolarHBondContact O-N 3.4Å; R597-N601 PolarHBondContact O-ND2 3.47Å; E598-N601 PolarHBondContact O-N 2.87Å; N601-L603 PolarHBondContact O-N 3.47Å; N601-S604 PolarHBondContact O-OG 2.95Å
602	A	88.3	Confident	87	Confident	9 Å²	9	46.8 Å²	46.8	7%	0.074	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-38.9	179.7	0	0	0	0	0	113.2	V583 E598 L600	V583-A602 HydrophobicContact CG1-CB 4.49Å; E598-A602 WeakPolarHBondContact O-CB 3.28Å; E598-A602 PolarHBondContact O-N 3.47Å; L600-A602 PolarHBondContact O-N 3.28Å
603	L	90.1	Very high	86.7	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-86.9	-15.7	-177.2	-65	175.1	0	0	0	113.7	A599 L600 N601 D605 L606 Q607 V654 Y655	A599-L603 WeakPolarHBondContact O-CB 3.36Å; A599-L603 WeakPolarHBondContact O-CG 3.4Å; A599-L603 PolarHBondContact O-N 3.3Å; A599-L603 VanDerWaalsContact O-N 3.12Å; L600-L603 PolarHBondContact O-N 2.8Å; N601-L603 PolarHBondContact O-N 3.47Å; L603-D605 PolarHBondContact O-N 3.41Å; L603-L606 PolarHBondContact O-N 3.3Å; L603-Q607 PolarHBondContact O-N 3.35Å; L603-Q607 VanDerWaalsContact O-N 3.1Å; L603-V654 HydrophobicContact CD1-CG1 3.92Å; L603-Y655 HydrophobicContact CB-CD2 3.97Å
604	S	88	Confident	86.5	Confident	25 Å²	25	49.4 Å²	49.4	18%	0.175	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-45	-173.4	66.9	0	0	0	0	113.7	L600 N601 N608	L600-S604 VanDerWaalsContact O-CB 3.24Å; L600-S604 WeakPolarHBondContact O-CB 3.32Å; L600-S604 PolarHBondContact O-N 2.94Å; N601-S604 PolarHBondContact O-OG 2.95Å; S604-N608 WeakPolarHBondContact O-CB 3.4Å; S604-N608 PolarHBondContact O-N 2.86Å; S604-N608 PolarHBondContact O-ND2 3.14Å
605	D	84.2	Confident	86.5	Confident	79 Å²	79	50.6 Å²	50.6	42%	0.422	27%	0.268	S	S	.	.	H	α-helix	trans	-71.4	-35.1	-176.7	-68.7	-35.8	0	0	0	112.2	L603	L603-D605 PolarHBondContact O-N 3.41Å
606	L	84.8	Confident	86.3	Confident	14 Å²	14	48.1 Å²	48.1	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-47.7	177.1	-79.4	136.9	0	0	0	111.6	N580 V583 C584 L603 L616	N580-L606 HydrophobicContact CB-CD2 4.42Å; V583-L606 HydrophobicContact CG1-CD1 4.32Å; C584-L606 HydrophobicContact CB-CD1 4.19Å; L603-L606 PolarHBondContact O-N 3.3Å; L606-L616 HydrophobicContact CD2-CD2 3.96Å; L606-L616 HydrophobicContact CD2-CG 4.17Å
607	Q	83.7	Confident	85.9	Confident	31 Å²	31	48 Å²	48	15%	0.145	26%	0.256	C	S	.	.	H	α-helix	trans	-84.4	-34.7	-171.4	-165.7	62.5	10.8	0	0	113.4	L603 G609 G610 E652 Y655	L603-Q607 PolarHBondContact O-N 3.35Å; L603-Q607 VanDerWaalsContact O-N 3.1Å; Q607-G609 PolarHBondContact O-N 2.9Å; Q607-G610 PolarHBondContact O-N 2.87Å; Q607-E652 VanDerWaalsContact NE2-CG 3.3Å; Q607-E652 PolarHBondContact NE2-OE1 2.93Å; Q607-E652 VanDerWaalsContact NE2-OE1 3.16Å; Q607-Y655 HydrophobicContact CB-CD1 4.09Å; Q607-Y655 HydrophobicContact CB-CD2 4.36Å; Q607-Y655 HydrophobicContact CB-CE1 4.32Å; Q607-Y655 HydrophobicContact CB-CG 4.09Å; Q607-Y655 HydrophobicContact CG-CD1 3.71Å; Q607-Y655 HydrophobicContact CG-CE1 4.09Å; Q607-Y655 HydrophobicContact CG-CG 4.1Å
608	N	82.5	Confident	85.6	Confident	77 Å²	77	41.3 Å²	41.3	41%	0.412	23%	0.231	S	C	.	.	H	α-helix	trans	-65.4	-26.3	-179.9	-76.7	-33.3	0	0	0	113.1	S604 G610 Y655 S682	S604-N608 WeakPolarHBondContact O-CB 3.4Å; S604-N608 PolarHBondContact O-N 2.86Å; S604-N608 PolarHBondContact O-ND2 3.14Å; N608-G610 VanDerWaalsContact C-N 3.32Å; N608-G610 PolarHBondContact O-N 2.98Å; N608-Y655 PolarHBondContact OD1-OH 3.39Å; N608-S682 WeakPolarHBondContact OD1-CB 3.42Å
609	G	75.6	Confident	84.9	Confident	42 Å²	42	37.3 Å²	37.3	43%	0.433	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-11.3	-177.1	0	0	0	0	0	115.2	Q607 R611	Q607-G609 PolarHBondContact O-N 2.9Å; G609-R611 PolarHBondContact O-N 3.46Å
610	G	77.5	Confident	83.7	Confident	60 Å²	60	38.4 Å²	38.4	62%	0.619	22%	0.224	S	C	*	.	S	Bend	trans	62.4	1.9	-175.7	0	0	0	0	0	115.2	Q607 N608	Q607-G610 PolarHBondContact O-N 2.87Å; N608-G610 VanDerWaalsContact C-N 3.32Å; N608-G610 PolarHBondContact O-N 2.98Å
611	R	82.3	Confident	82.2	Confident	124 Å²	124	40.5 Å²	40.5	47%	0.468	24%	0.237	S	C	.	.			trans	-108.1	17.6	-179	-64.8	-176.9	-65.4	-178.7	2.5	112.5	G609 K613 E614 L615	G609-R611 PolarHBondContact O-N 3.46Å; R611-K613 PolarHBondContact O-N 3.22Å; R611-K613 VanDerWaalsContact O-N 3.15Å; R611-E614 PolarHBondContact O-N 3.32Å; R611-L615 HydrophobicContact CB-CG 4.42Å; R611-L615 WeakPolarHBondContact O-CG 3.49Å; R611-L615 PolarHBondContact O-N 2.83Å
612	A	83.5	Confident	80.4	Confident	10 Å²	10	44.2 Å²	44.2	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-53	-39.1	-176.8	0	0	0	0	0	112.9	E614 L615 L616	A612-E614 VanDerWaalsContact C-N 3.31Å; A612-E614 PolarHBondContact O-N 2.99Å; A612-L615 PolarHBondContact O-N 2.71Å; A612-L616 WeakPolarHBondContact O-CB 3.42Å; A612-L616 WeakPolarHBondContact O-CG 3.4Å; A612-L616 PolarHBondContact O-N 2.83Å
613	K	85.1	Confident	78.8	Confident	87 Å²	87	53.8 Å²	53.8	38%	0.378	29%	0.287	S	S	.	.	H	α-helix	trans	-61.8	-36.9	177.7	-168.1	173.5	-174.4	179.8	0	113.1	R611 A617 Q618 G619 V621 L648	R611-K613 PolarHBondContact O-N 3.22Å; R611-K613 VanDerWaalsContact O-N 3.15Å; K613-A617 PolarHBondContact O-N 3.4Å; K613-Q618 HydrophobicContact CG-CB 4.28Å; K613-Q618 PolarHBondContact O-N 3.4Å; K613-G619 CarbonylContact C-O 3.55Å; K613-G619 PolarHBondContact O-N 2.91Å; K613-V621 HydrophobicContact CB-CG2 4.3Å; K613-L648 HydrophobicContact CB-CD1 3.73Å; K613-L648 HydrophobicContact CD-CD1 4.23Å; K613-L648 HydrophobicContact CG-CD1 3.82Å
614	E	84.1	Confident	77	Confident	45 Å²	45	58.8 Å²	58.8	21%	0.21	32%	0.318	C	S	.	.	H	α-helix	trans	-79.7	-44.4	179.7	-66.6	178.8	167	0	0	111.4	R611 A612 L616 A617 V621 R627	R611-E614 PolarHBondContact O-N 3.32Å; A612-E614 VanDerWaalsContact C-N 3.31Å; A612-E614 PolarHBondContact O-N 2.99Å; E614-L616 PolarHBondContact O-N 3.28Å; E614-A617 WeakPolarHBondContact O-CA 3.25Å; E614-A617 PolarHBondContact O-N 2.84Å; E614-V621 HydrophobicContact CG-CG2 4.09Å; E614-V621 PolarHBondContact OE1-N 3.23Å; E614-R627 IonicContact OE1-CZ 2.75Å; E614-R627 VanDerWaalsContact OE1-CZ 3.27Å; E614-R627 IonicContact OE1-NH1 4Å; E614-R627 PolarHBondContact OE1-NH1 3.29Å; E614-R627 IonicContact OE1-NH2 3.94Å; E614-R627 PolarHBondContact OE1-NH2 2.84Å; E614-R627 IonicContact OE2-NH2 2.73Å; E614-R627 PolarHBondContact OE2-NH2 3.45Å
615	L	86.3	Confident	75.4	Confident	40 Å²	40	66.4 Å²	66.4	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-28.9	179.5	-67.5	175.3	0	0	0	112.9	N580 R611 A612	N580-L615 PolarHBondContact ND2-O 3.08Å; R611-L615 HydrophobicContact CB-CG 4.42Å; R611-L615 WeakPolarHBondContact O-CG 3.49Å; R611-L615 PolarHBondContact O-N 2.83Å; A612-L615 PolarHBondContact O-N 2.71Å
616	L	87.9	Confident	74.2	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	2.4	173.8	-62.9	174.7	0	0	0	113.3	N580 R581 C584 L606 A612 E614 Q618 L648	N580-L616 HydrophobicContact CB-CD2 4.2Å; R581-L616 HydrophobicContact CG-CD2 3.88Å; C584-L616 HydrophobicContact CB-CD2 4.18Å; L606-L616 HydrophobicContact CD2-CD2 3.96Å; L606-L616 HydrophobicContact CD2-CG 4.17Å; A612-L616 WeakPolarHBondContact O-CB 3.42Å; A612-L616 WeakPolarHBondContact O-CG 3.4Å; A612-L616 PolarHBondContact O-N 2.83Å; E614-L616 PolarHBondContact O-N 3.28Å; L616-Q618 VanDerWaalsContact C-N 3.26Å; L616-Q618 HydrophobicContact CB-CG 4.05Å; L616-Q618 PolarHBondContact O-N 3.34Å; L616-L648 HydrophobicContact CD1-CD2 3.8Å
617	A	83.7	Confident	73.2	Confident	10 Å²	10	72.5 Å²	72.5	8%	0.083	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	35.1	-178.7	0	0	0	0	0	115	I577 K613 E614 R639 V640	I577-A617 HydrophobicContact CB-CB 4.48Å; I577-A617 HydrophobicContact CD1-CB 3.68Å; I577-A617 HydrophobicContact CG1-CB 4Å; I577-A617 HydrophobicContact CG2-CB 3.63Å; K613-A617 PolarHBondContact O-N 3.4Å; E614-A617 WeakPolarHBondContact O-CA 3.25Å; E614-A617 PolarHBondContact O-N 2.84Å; A617-R639 WeakPolarHBondContact O-CA 3.27Å; A617-V640 HydrophobicContact CB-CG2 4.44Å; A617-V640 VanDerWaalsContact O-CG2 3.28Å; A617-V640 WeakPolarHBondContact O-CG2 3.47Å; A617-V640 PolarHBondContact O-N 2.84Å; A617-V640 VanDerWaalsContact O-N 3.08Å
618	Q	84.6	Confident	72.6	Confident	21 Å²	21	74.6 Å²	74.6	10%	0.098	39%	0.394	C	S	.	.	S	Bend	trans	-93.8	1.1	178.2	-59.5	-179.6	3.8	0	0	112.6	K613 L616 V640 H645 I646	K613-Q618 HydrophobicContact CG-CB 4.28Å; K613-Q618 PolarHBondContact O-N 3.4Å; L616-Q618 VanDerWaalsContact C-N 3.26Å; L616-Q618 HydrophobicContact CB-CG 4.05Å; L616-Q618 PolarHBondContact O-N 3.34Å; Q618-V640 HydrophobicContact CG-CG2 4.26Å; Q618-H645 HydrophobicContact CG-CB 4.31Å; Q618-I646 PolarHBondContact NE2-O 2.91Å; Q618-I646 PolarHBondContact OE1-O 3.23Å; Q618-I646 VanDerWaalsContact OE1-O 3.11Å
619	G	76.2	Confident	72.3	Confident	9 Å²	9	76 Å²	76	9%	0.093	40%	0.404	C	S	.	.			trans	147.6	172.7	173.7	0	0	0	0	0	112.2	K613	K613-G619 CarbonylContact C-O 3.55Å; K613-G619 PolarHBondContact O-N 2.91Å
620	A	66.8	Low	72.2	Confident	22 Å²	22	81 Å²	81	18%	0.182	42%	0.416	C	S	.	.			trans	-82	144.6	173	0	0	0	0	0	110.4
621	V	60.7	Low	72.2	Confident	50 Å²	50	82.6 Å²	82.6	30%	0.303	41%	0.408	S	S	.	.			trans	-77	136.9	162.1	176.5	0	0	0	0	107	K613 E614 R623	K613-V621 HydrophobicContact CB-CG2 4.3Å; E614-V621 HydrophobicContact CG-CG2 4.09Å; E614-V621 PolarHBondContact OE1-N 3.23Å; V621-R623 PolarHBondContact O-N 2.91Å
622	M	52.8	Low	71.8	Confident	167 Å²	167	79.4 Å²	79.4	82%	0.823	40%	0.398	S	S	*	.	S	Bend	trans	-64.2	29	-174.8	-73.6	-75.4	152.2	0	0	115.4	T624	M622-T624 PolarHBondContact O-N 3.03Å; M622-T624 PolarHBondContact O-OG1 3.25Å
623	R	53.9	Low	71.4	Confident	209 Å²	209	84.7 Å²	84.7	79%	0.789	42%	0.419	S	S	*	.			trans	-77.9	80.6	168.9	-71.8	-168.7	-175.1	175	2.9	108.7	V621 Q625	V621-R623 PolarHBondContact O-N 2.91Å; R623-Q625 PolarHBondContact O-N 3.26Å; R623-Q625 VanDerWaalsContact O-N 3.08Å
624	T	52.5	Low	71	Confident	111 Å²	111	84.3 Å²	84.3	68%	0.681	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	2.2	-175	-28.5	0	0	0	0	114.3	M622	M622-T624 PolarHBondContact O-N 3.03Å; M622-T624 PolarHBondContact O-OG1 3.25Å
625	Q	55.6	Low	70.5	Confident	184 Å²	184	84.7 Å²	84.7	86%	0.86	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-18.3	-166.5	-79.8	-179.7	-25	0	0	115.7	R623	R623-Q625 PolarHBondContact O-N 3.26Å; R623-Q625 VanDerWaalsContact O-N 3.08Å
626	D	58.3	Low	70	Confident	148 Å²	148	89 Å²	89	79%	0.791	44%	0.436	S	S	*	.	S	Bend	trans	-125	0.5	-171.4	-60.9	-39.3	0	0	0	116
627	R	62.9	Low	69.6	Low	74 Å²	74	93.6 Å²	93.6	28%	0.279	46%	0.458	S	S	.	.			trans	-99.7	130.4	-174	-69.5	-168.8	171.7	151.6	14	113.2	E614 E632 E635	E614-R627 IonicContact OE1-CZ 2.75Å; E614-R627 VanDerWaalsContact OE1-CZ 3.27Å; E614-R627 IonicContact OE1-NH1 4Å; E614-R627 PolarHBondContact OE1-NH1 3.29Å; E614-R627 IonicContact OE1-NH2 3.94Å; E614-R627 PolarHBondContact OE1-NH2 2.84Å; E614-R627 IonicContact OE2-NH2 2.73Å; E614-R627 PolarHBondContact OE2-NH2 3.45Å; R627-E632 HydrophobicContact CB-CG 4.18Å; R627-E635 IonicContact CZ-OE1 3.78Å; R627-E635 IonicContact CZ-OE2 2.97Å; R627-E635 IonicContact NE-OE1 2.9Å; R627-E635 PolarHBondContact NE-OE1 3.05Å; R627-E635 VanDerWaalsContact NE-OE1 3.15Å; R627-E635 IonicContact NE-OE2 2.8Å; R627-E635 IonicContact NH1-OE1 3.39Å; R627-E635 PolarHBondContact NH1-OE1 2.94Å; R627-E635 IonicContact NH1-OE2 3.58Å; R627-E635 PolarHBondContact NH1-OE2 3.32Å; R627-E635 IonicContact NH2-OE1 2.81Å
628	T	72.9	Confident	69.6	Low	75 Å²	75	98.1 Å²	98.1	46%	0.46	47%	0.473	S	S	.	.			trans	-71.5	149.3	170.5	63	0	0	0	0	110.3	E630 Q631 E632	T628-E630 PolarHBondContact O-N 2.89Å; T628-E630 VanDerWaalsContact O-N 3.11Å; T628-Q631 WeakPolarHBondContact O-CB 3.4Å; T628-Q631 PolarHBondContact O-N 2.96Å; T628-Q631 VanDerWaalsContact OG1-CG 3.24Å; T628-Q631 WeakPolarHBondContact OG1-CG 3.31Å; T628-Q631 PolarHBondContact OG1-N 3.42Å; T628-E632 PolarHBondContact O-N 3.34Å
629	V	75.4	Confident	69.6	Low	105 Å²	105	101.3 Å²	101.3	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-57	-30	178.6	179.2	0	0	0	0	111.6	K633	V629-K633 WeakPolarHBondContact O-CG 3.45Å; V629-K633 PolarHBondContact O-N 2.92Å; V629-K633 VanDerWaalsContact O-N 3.17Å
630	E	73.1	Confident	70.1	Confident	147 Å²	147	102 Å²	102	69%	0.687	49%	0.486	S	S	*	.	H	α-helix	trans	-71.2	-41.7	176.1	-62.2	-171.4	162.6	0	0	112.5	T628 K633 L634	T628-E630 PolarHBondContact O-N 2.89Å; T628-E630 VanDerWaalsContact O-N 3.11Å; E630-K633 PolarHBondContact O-N 3.42Å; E630-L634 WeakPolarHBondContact O-CG 3.3Å; E630-L634 PolarHBondContact O-N 2.94Å
631	Q	77.5	Confident	71.2	Confident	94 Å²	94	101.2 Å²	101.2	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-62.9	-42.4	174.4	-75.8	172.4	0.9	0	0	111.2	T628 K633 L634 E635	T628-Q631 WeakPolarHBondContact O-CB 3.4Å; T628-Q631 PolarHBondContact O-N 2.96Å; T628-Q631 VanDerWaalsContact OG1-CG 3.24Å; T628-Q631 WeakPolarHBondContact OG1-CG 3.31Å; T628-Q631 PolarHBondContact OG1-N 3.42Å; Q631-K633 VanDerWaalsContact C-N 3.29Å; Q631-K633 PolarHBondContact O-N 3.39Å; Q631-L634 PolarHBondContact O-N 2.93Å; Q631-E635 WeakPolarHBondContact O-CB 3.41Å; Q631-E635 WeakPolarHBondContact O-CG 3.39Å; Q631-E635 PolarHBondContact O-N 3.33Å
632	E	73.1	Confident	72.5	Confident	57 Å²	57	103.8 Å²	103.8	27%	0.266	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-37.7	175.3	-73.1	-162.2	179.8	0	0	112.8	R627 T628 E635 R636	R627-E632 HydrophobicContact CB-CG 4.18Å; T628-E632 PolarHBondContact O-N 3.34Å; E632-E635 PolarHBondContact O-N 3.3Å; E632-R636 WeakPolarHBondContact O-CB 3.43Å; E632-R636 WeakPolarHBondContact O-CG 3.27Å; E632-R636 PolarHBondContact O-N 3.09Å; E632-R636 IonicContact OE2-CZ 4Å; E632-R636 IonicContact OE2-NH2 2.61Å; E632-R636 PolarHBondContact OE2-NH2 3.44Å
633	K	75.7	Confident	74.2	Confident	122 Å²	122	98.3 Å²	98.3	53%	0.53	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-45.4	176	-75.9	173.4	-179.2	177.7	0	111.2	V629 E630 Q631 E635 R636 Q637	V629-K633 WeakPolarHBondContact O-CG 3.45Å; V629-K633 PolarHBondContact O-N 2.92Å; V629-K633 VanDerWaalsContact O-N 3.17Å; E630-K633 PolarHBondContact O-N 3.42Å; Q631-K633 VanDerWaalsContact C-N 3.29Å; Q631-K633 PolarHBondContact O-N 3.39Å; K633-E635 VanDerWaalsContact C-N 3.34Å; K633-R636 PolarHBondContact O-N 3.24Å; K633-Q637 WeakPolarHBondContact O-CG 3.5Å; K633-Q637 PolarHBondContact O-N 3.26Å
634	L	76.7	Confident	75.8	Confident	79 Å²	79	89.6 Å²	89.6	41%	0.414	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-39.9	175.7	-70.2	172.1	0	0	0	111.8	E630 Q631 Q637 R638	E630-L634 WeakPolarHBondContact O-CG 3.3Å; E630-L634 PolarHBondContact O-N 2.94Å; Q631-L634 PolarHBondContact O-N 2.93Å; L634-Q637 PolarHBondContact O-N 2.86Å; L634-R638 WeakPolarHBondContact O-CD 3.48Å; L634-R638 WeakPolarHBondContact O-CG 3.39Å; L634-R638 PolarHBondContact O-N 2.84Å; L634-R638 VanDerWaalsContact O-N 3.08Å
635	E	73.5	Confident	77.7	Confident	53 Å²	53	87 Å²	87	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-39.2	174.8	-76.7	-176.3	177.9	0	0	111.9	R627 Q631 E632 K633 R638 R639	R627-E635 IonicContact CZ-OE1 3.78Å; R627-E635 IonicContact CZ-OE2 2.97Å; R627-E635 IonicContact NE-OE1 2.9Å; R627-E635 PolarHBondContact NE-OE1 3.05Å; R627-E635 VanDerWaalsContact NE-OE1 3.15Å; R627-E635 IonicContact NE-OE2 2.8Å; R627-E635 IonicContact NH1-OE1 3.39Å; R627-E635 PolarHBondContact NH1-OE1 2.94Å; R627-E635 IonicContact NH1-OE2 3.58Å; R627-E635 PolarHBondContact NH1-OE2 3.32Å; R627-E635 IonicContact NH2-OE1 2.81Å; Q631-E635 WeakPolarHBondContact O-CB 3.41Å; Q631-E635 WeakPolarHBondContact O-CG 3.39Å; Q631-E635 PolarHBondContact O-N 3.33Å; E632-E635 PolarHBondContact O-N 3.3Å; K633-E635 VanDerWaalsContact C-N 3.34Å; E635-R638 PolarHBondContact O-N 3.31Å; E635-R639 WeakPolarHBondContact O-CG 3.45Å; E635-R639 PolarHBondContact O-N 2.77Å
636	R	76.9	Confident	79.3	Confident	130 Å²	130	78.7 Å²	78.7	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-44.2	174.3	-75.1	172.3	-157.7	-170.1	7.5	111.6	E632 K633 R638 R639	E632-R636 WeakPolarHBondContact O-CB 3.43Å; E632-R636 WeakPolarHBondContact O-CG 3.27Å; E632-R636 PolarHBondContact O-N 3.09Å; E632-R636 IonicContact OE2-CZ 4Å; E632-R636 IonicContact OE2-NH2 2.61Å; E632-R636 PolarHBondContact OE2-NH2 3.44Å; K633-R636 PolarHBondContact O-N 3.24Å; R636-R638 PolarHBondContact O-N 3.02Å; R636-R639 WeakPolarHBondContact O-CB 3.46Å; R636-R639 WeakPolarHBondContact O-CG 3.46Å; R636-R639 PolarHBondContact O-N 3.28Å; R636-R639 VanDerWaalsContact O-N 3.13Å
637	Q	79.2	Confident	80.8	Confident	99 Å²	99	74.7 Å²	74.7	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-28.7	176.5	-70.9	173.9	-1.8	0	0	113	Q437 K633 L634 R639	Q437-Q637 PolarHBondContact NE2-O 3.16Å; K633-Q637 WeakPolarHBondContact O-CG 3.5Å; K633-Q637 PolarHBondContact O-N 3.26Å; L634-Q637 PolarHBondContact O-N 2.86Å; Q637-R639 VanDerWaalsContact C-N 3.34Å
638	R	83.2	Confident	82.1	Confident	104 Å²	104	73.3 Å²	73.3	39%	0.392	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.3	178	-68.4	167.6	-174.8	174.8	1	113.6	I577 L634 E635 R636 V640	I577-R638 HydrophobicContact CD1-CB 4.45Å; L634-R638 WeakPolarHBondContact O-CD 3.48Å; L634-R638 WeakPolarHBondContact O-CG 3.39Å; L634-R638 PolarHBondContact O-N 2.84Å; L634-R638 VanDerWaalsContact O-N 3.08Å; E635-R638 PolarHBondContact O-N 3.31Å; R636-R638 PolarHBondContact O-N 3.02Å; R638-V640 PolarHBondContact O-N 2.84Å
639	R	84	Confident	82.9	Confident	88 Å²	88	73.6 Å²	73.6	33%	0.332	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-66.7	135.3	-178.8	-70.2	177.4	-173.9	-171	1	110.4	Q437 A617 E635 R636 Q637	Q437-R639 PolarHBondContact NE2-O 3.36Å; A617-R639 WeakPolarHBondContact O-CA 3.27Å; E635-R639 WeakPolarHBondContact O-CG 3.45Å; E635-R639 PolarHBondContact O-N 2.77Å; R636-R639 WeakPolarHBondContact O-CB 3.46Å; R636-R639 WeakPolarHBondContact O-CG 3.46Å; R636-R639 PolarHBondContact O-N 3.28Å; R636-R639 VanDerWaalsContact O-N 3.13Å; Q637-R639 VanDerWaalsContact C-N 3.34Å
640	V	87.6	Confident	83.6	Confident	23 Å²	23	69.1 Å²	69.1	14%	0.139	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-71.6	144.4	169	-74.9	0	0	0	0	110	I577 A617 Q618 R638 H645	I577-V640 HydrophobicContact CG2-CG1 4.39Å; A617-V640 HydrophobicContact CB-CG2 4.44Å; A617-V640 VanDerWaalsContact O-CG2 3.28Å; A617-V640 WeakPolarHBondContact O-CG2 3.47Å; A617-V640 PolarHBondContact O-N 2.84Å; A617-V640 VanDerWaalsContact O-N 3.08Å; Q618-V640 HydrophobicContact CG-CG2 4.26Å; R638-V640 PolarHBondContact O-N 2.84Å; V640-H645 PolarHBondContact O-NE2 2.89Å
641	P	89.1	Confident	84.4	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.039	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-55.7	149.8	170.4	-28.9	36.7	0	0	0	113.3	T433 L436 H643 M644 H645	T433-P641 HydrophobicContact CG2-CG 3.89Å; L436-P641 HydrophobicContact CB-CB 4.03Å; L436-P641 HydrophobicContact CB-CG 4.26Å; L436-P641 HydrophobicContact CD1-CB 4.24Å; L436-P641 HydrophobicContact CD1-CG 4.5Å; P641-H643 VanDerWaalsContact CB-CE1 3.45Å; P641-H643 WeakPolarHBondContact CB-CE1 3.43Å; P641-H643 PolarHBondContact O-N 3.44Å; P641-M644 HydrophobicContact CB-CG 4.48Å; P641-M644 HydrophobicContact CB-SD 4.49Å; P641-M644 HydrophobicContact CG-SD 4.22Å; P641-M644 WeakPolarHBondContact O-CB 3.27Å; P641-M644 PolarHBondContact O-N 3.12Å; P641-H645 PolarHBondContact O-CD2 3.29Å
642	Y	88.3	Confident	85	Confident	104 Å²	104	58.6 Å²	58.6	41%	0.408	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-58.5	-39.2	-175.2	-176.3	-107.7	0	0	0	115	C441 Y446 M644 H645	C441-Y642 HydrophobicContact CB-CD1 3.72Å; C441-Y642 HydrophobicContact CB-CD2 3.57Å; C441-Y642 HydrophobicContact CB-CE1 4.16Å; C441-Y642 HydrophobicContact CB-CE2 4.02Å; C441-Y642 HydrophobicContact CB-CG 3.4Å; Y446-Y642 PolarHBondContact OH-N 2.97Å; Y446-Y642 VanDerWaalsContact OH-N 3.08Å; Y642-M644 PolarHBondContact O-N 2.62Å; Y642-M644 VanDerWaalsContact O-N 3.11Å; Y642-H645 AromaticContact CD2-ND1 3.54Å; Y642-H645 VanDerWaalsContact O-CB 3.28Å; Y642-H645 WeakPolarHBondContact O-CB 3.2Å; Y642-H645 PolarHBondContact O-N 3.37Å
643	H	87.9	Confident	85.9	Confident	52 Å²	52	56 Å²	56	24%	0.241	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63.6	-17.7	176.8	66.7	-87.8	0	0	0	113.3	L436 Y446 L450 Y490 P641	L436-H643 VanDerWaalsContact CD1-CE1 3.46Å; L436-H643 WeakPolarHBondContact CD1-CE1 3.49Å; Y446-H643 HydrophobicContact CE1-CB 4.31Å; Y446-H643 AromaticContact CZ-ND1 3.97Å; Y446-H643 PolarHBondContact OH-N 3.24Å; Y446-H643 VanDerWaalsContact OH-N 3.13Å; Y446-H643 PolarHBondContact OH-ND1 2.88Å; L450-H643 HydrophobicContact CD1-CB 4.32Å; L450-H643 HydrophobicContact CD2-CB 4.4Å; Y490-H643 AromaticContact CE2-CD2 3.71Å; Y490-H643 AromaticContact CZ-NE2 3.86Å; P641-H643 VanDerWaalsContact CB-CE1 3.45Å; P641-H643 WeakPolarHBondContact CB-CE1 3.43Å; P641-H643 PolarHBondContact O-N 3.44Å
644	M	88.8	Confident	86.6	Confident	26 Å²	26	50.1 Å²	50.1	13%	0.128	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-93.1	-1	173.6	-53.1	-179.8	73.5	0	0	112.1	Y489 Y490 R581 P641 Y642	Y489-M644 HydrophobicContact CE1-CE 3.92Å; Y489-M644 WeakPolarHBondContact OH-CE 3.42Å; Y490-M644 HydrophobicContact CD1-CE 3.85Å; Y490-M644 HydrophobicContact CE1-CE 4.11Å; R581-M644 PolarHBondContact NH1-O 3.25Å; R581-M644 PolarHBondContact NH2-O 3.37Å; P641-M644 HydrophobicContact CB-CG 4.48Å; P641-M644 HydrophobicContact CB-SD 4.49Å; P641-M644 HydrophobicContact CG-SD 4.22Å; P641-M644 WeakPolarHBondContact O-CB 3.27Å; P641-M644 PolarHBondContact O-N 3.12Å; Y642-M644 PolarHBondContact O-N 2.62Å; Y642-M644 VanDerWaalsContact O-N 3.11Å
645	H	91.3	Very high	87.4	Confident	56 Å²	56	46.5 Å²	46.5	26%	0.259	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-70.5	137.7	-179.7	-71.3	-170.2	0	0	0	110.8	Q618 V640 P641 Y642	Q618-H645 HydrophobicContact CG-CB 4.31Å; V640-H645 PolarHBondContact O-NE2 2.89Å; P641-H645 PolarHBondContact O-CD2 3.29Å; Y642-H645 AromaticContact CD2-ND1 3.54Å; Y642-H645 VanDerWaalsContact O-CB 3.28Å; Y642-H645 WeakPolarHBondContact O-CB 3.2Å; Y642-H645 PolarHBondContact O-N 3.37Å
646	I	90.7	Very high	88.3	Confident	11 Å²	11	44 Å²	44	6%	0.056	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-92.9	122	167.5	-57	173	0	0	0	106.1	Y544 C584 L588 Q618 L648 T651	Y544-I646 HydrophobicContact CE2-CD1 4.27Å; C584-I646 HydrophobicContact CB-CD1 4.28Å; L588-I646 HydrophobicContact CD1-CG2 3.97Å; Q618-I646 PolarHBondContact NE2-O 2.91Å; Q618-I646 PolarHBondContact OE1-O 3.23Å; Q618-I646 VanDerWaalsContact OE1-O 3.11Å; I646-L648 PolarHBondContact O-N 3.36Å; I646-L648 VanDerWaalsContact O-N 3.12Å; I646-T651 HydrophobicContact CG2-CG2 3.6Å
647	N	89.9	Confident	89	Confident	64 Å²	64	37.8 Å²	37.8	34%	0.342	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-59.6	118.5	-177.6	-175.7	-8.9	0	0	0	111.2	E649 L650 T651 L737	N647-E649 VanDerWaalsContact C-N 3.31Å; N647-E649 PolarHBondContact O-N 3.12Å; N647-E649 WeakPolarHBondContact OD1-CB 3.42Å; N647-E649 PolarHBondContact OD1-N 3.09Å; N647-L650 HydrophobicContact CB-CB 4.05Å; N647-L650 WeakPolarHBondContact O-CB 3.46Å; N647-L650 PolarHBondContact O-N 3.24Å; N647-L650 VanDerWaalsContact O-N 3.17Å; N647-T651 PolarHBondContact O-N 2.94Å; N647-T651 VanDerWaalsContact O-N 3.12Å; N647-L737 HydrophobicContact CB-CD1 4.06Å; N647-L737 WeakPolarHBondContact ND2-CD1 3.22Å
648	L	89.4	Confident	89.6	Confident	45 Å²	45	33 Å²	33	24%	0.236	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-33.7	-178.7	-60.5	177.2	0	0	0	112.8	K613 L616 I646 L650 T651 E652	K613-L648 HydrophobicContact CB-CD1 3.73Å; K613-L648 HydrophobicContact CD-CD1 4.23Å; K613-L648 HydrophobicContact CG-CD1 3.82Å; L616-L648 HydrophobicContact CD1-CD2 3.8Å; I646-L648 PolarHBondContact O-N 3.36Å; I646-L648 VanDerWaalsContact O-N 3.12Å; L648-L650 VanDerWaalsContact C-N 3.28Å; L648-L650 PolarHBondContact O-N 3.34Å; L648-T651 WeakPolarHBondContact CA-OG1 3.48Å; L648-T651 PolarHBondContact O-N 2.86Å; L648-T651 PolarHBondContact O-OG1 2.8Å; L648-E652 VanDerWaalsContact O-CB 3.28Å; L648-E652 WeakPolarHBondContact O-CB 3.48Å; L648-E652 PolarHBondContact O-N 2.89Å
649	E	89	Confident	90	Very high	81 Å²	81	28.1 Å²	28.1	38%	0.379	13%	0.13	S	C	.	.	H	α-helix	trans	-65.9	-35.7	176.4	-65.5	-169.9	176.2	0	0	111	N647 C653	N647-E649 VanDerWaalsContact C-N 3.31Å; N647-E649 PolarHBondContact O-N 3.12Å; N647-E649 WeakPolarHBondContact OD1-CB 3.42Å; N647-E649 PolarHBondContact OD1-N 3.09Å; E649-C653 WeakPolarHBondContact O-CB 3.29Å; E649-C653 PolarHBondContact O-N 3.34Å
650	L	91	Very high	90.3	Very high	10 Å²	10	23.9 Å²	23.9	5%	0.052	11%	0.114	C	C	.	.	H	α-helix	trans	-68.3	-47.1	176.4	174.9	140.6	0	0	0	110.8	L588 N647 L648 E652 C653 V654 V734 L737 F738	L588-L650 HydrophobicContact CD1-CD2 3.75Å; L588-L650 HydrophobicContact CD2-CD2 3.7Å; L588-L650 HydrophobicContact CG-CD2 4.4Å; N647-L650 HydrophobicContact CB-CB 4.05Å; N647-L650 WeakPolarHBondContact O-CB 3.46Å; N647-L650 PolarHBondContact O-N 3.24Å; N647-L650 VanDerWaalsContact O-N 3.17Å; L648-L650 VanDerWaalsContact C-N 3.28Å; L648-L650 PolarHBondContact O-N 3.34Å; L650-E652 VanDerWaalsContact C-N 3.31Å; L650-E652 PolarHBondContact O-N 3.37Å; L650-C653 PolarHBondContact O-N 2.96Å; L650-V654 WeakPolarHBondContact O-CB 3.32Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.31Å; L650-V654 PolarHBondContact O-N 3.36Å; L650-V734 HydrophobicContact CB-CG1 4.32Å; L650-V734 HydrophobicContact CD1-CG1 4.06Å; L650-V734 WeakPolarHBondContact CD1-O 3.23Å; L650-V734 HydrophobicContact CG-CG1 4.07Å; L650-L737 HydrophobicContact CB-CD1 4.43Å; L650-L737 HydrophobicContact CD1-CB 3.79Å; L650-L737 HydrophobicContact CD1-CD1 3.95Å; L650-L737 HydrophobicContact CD1-CG 4.46Å; L650-F738 HydrophobicContact CD1-CD2 4.15Å; L650-F738 HydrophobicContact CD1-CE1 4.29Å; L650-F738 HydrophobicContact CD1-CE2 3.62Å; L650-F738 HydrophobicContact CD1-CZ 3.71Å; L650-F738 HydrophobicContact CD2-CE1 4.36Å; L650-F738 HydrophobicContact CD2-CZ 3.94Å; L650-F738 HydrophobicContact CG-CE2 4.17Å; L650-F738 HydrophobicContact CG-CZ 3.96Å
651	T	90.3	Very high	90.4	Very high	6 Å²	6	22.9 Å²	22.9	4%	0.037	11%	0.108	C	C	.	.	H	α-helix	trans	-63.8	-38.8	178.2	53.3	0	0	0	0	111.9	C584 L588 I646 N647 L648 Y655	C584-T651 VanDerWaalsContact SG-CG2 3.5Å; L588-T651 HydrophobicContact CD1-CG2 4.23Å; L588-T651 HydrophobicContact CD2-CG2 4.4Å; I646-T651 HydrophobicContact CG2-CG2 3.6Å; N647-T651 PolarHBondContact O-N 2.94Å; N647-T651 VanDerWaalsContact O-N 3.12Å; L648-T651 WeakPolarHBondContact CA-OG1 3.48Å; L648-T651 PolarHBondContact O-N 2.86Å; L648-T651 PolarHBondContact O-OG1 2.8Å; T651-Y655 VanDerWaalsContact O-CB 3.27Å; T651-Y655 WeakPolarHBondContact O-CB 3.47Å; T651-Y655 PolarHBondContact O-N 3.14Å
652	E	89.7	Confident	90.4	Very high	15 Å²	15	24 Å²	24	7%	0.07	11%	0.113	C	C	.	.	H	α-helix	trans	-68	-44.1	176.1	179.7	165.7	-146.1	0	0	111.9	Q607 L648 L650 V654 Y655 L656 Q686 R703	Q607-E652 VanDerWaalsContact NE2-CG 3.3Å; Q607-E652 PolarHBondContact NE2-OE1 2.93Å; Q607-E652 VanDerWaalsContact NE2-OE1 3.16Å; L648-E652 VanDerWaalsContact O-CB 3.28Å; L648-E652 WeakPolarHBondContact O-CB 3.48Å; L648-E652 PolarHBondContact O-N 2.89Å; L650-E652 VanDerWaalsContact C-N 3.31Å; L650-E652 PolarHBondContact O-N 3.37Å; E652-V654 VanDerWaalsContact C-N 3.34Å; E652-V654 PolarHBondContact O-N 3.28Å; E652-Y655 PolarHBondContact O-N 3.48Å; E652-L656 HydrophobicContact CG-CD1 3.81Å; E652-L656 HydrophobicContact CG-CG 4.25Å; E652-L656 WeakPolarHBondContact O-CB 3.46Å; E652-L656 VanDerWaalsContact O-CG 3.28Å; E652-L656 WeakPolarHBondContact O-CG 3.28Å; E652-L656 PolarHBondContact O-N 2.84Å; E652-Q686 PolarHBondContact OE1-NE2 3.33Å; E652-R703 IonicContact OE1-CZ 2.71Å; E652-R703 IonicContact OE1-NE 2.74Å; E652-R703 PolarHBondContact OE1-NE 3.07Å; E652-R703 IonicContact OE1-NH2 3.81Å; E652-R703 PolarHBondContact OE1-NH2 3.17Å; E652-R703 IonicContact OE2-CZ 2.73Å; E652-R703 IonicContact OE2-NE 2.72Å; E652-R703 PolarHBondContact OE2-NE 3.38Å; E652-R703 IonicContact OE2-NH2 3.61Å; E652-R703 PolarHBondContact OE2-NH2 3Å
653	C	91	Very high	90.3	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-44.1	177	-173.9	0	0	0	0	111.3	E649 L650 L656 L657 V734	E649-C653 WeakPolarHBondContact O-CB 3.29Å; E649-C653 PolarHBondContact O-N 3.34Å; L650-C653 PolarHBondContact O-N 2.96Å; C653-L656 PolarHBondContact O-N 2.9Å; C653-L657 VanDerWaalsContact O-CB 3.25Å; C653-L657 WeakPolarHBondContact O-CB 3.24Å; C653-L657 PolarHBondContact O-N 3.16Å; C653-V734 HydrophobicContact CB-CG1 4.31Å; C653-V734 HydrophobicContact CB-CG2 4.07Å
654	V	91.8	Very high	90.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.2	-46	176.3	170.6	0	0	0	0	110.6	L588 F591 L603 L650 E652 L656 L657 C658 F738	L588-V654 HydrophobicContact CD2-CB 4.18Å; L588-V654 HydrophobicContact CD2-CG1 4.15Å; L588-V654 HydrophobicContact CD2-CG2 3.98Å; F591-V654 HydrophobicContact CB-CG1 3.78Å; F591-V654 HydrophobicContact CD1-CG1 3.8Å; F591-V654 HydrophobicContact CD1-CG2 3.94Å; F591-V654 HydrophobicContact CD2-CG1 3.76Å; F591-V654 HydrophobicContact CE1-CG1 4.33Å; F591-V654 HydrophobicContact CE1-CG2 3.98Å; F591-V654 HydrophobicContact CE2-CG1 4.29Å; F591-V654 HydrophobicContact CG-CG1 3.48Å; F591-V654 VanDerWaalsContact CG-CG1 3.48Å; F591-V654 HydrophobicContact CG-CG2 4.47Å; L603-V654 HydrophobicContact CD1-CG1 3.92Å; L650-V654 WeakPolarHBondContact O-CB 3.32Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.31Å; L650-V654 PolarHBondContact O-N 3.36Å; E652-V654 VanDerWaalsContact C-N 3.34Å; E652-V654 PolarHBondContact O-N 3.28Å; V654-L656 PolarHBondContact O-N 3.35Å; V654-L657 PolarHBondContact O-N 3.04Å; V654-C658 WeakPolarHBondContact O-CB 3.24Å; V654-C658 PolarHBondContact O-N 3.21Å; V654-C658 PolarHBondContact O-SG 3.36Å; V654-F738 HydrophobicContact CG2-CZ 4.14Å
655	Y	92.6	Very high	89.9	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-58	-48.9	176.8	171.1	-99.6	0	0	0	112.3	L600 L603 Q607 N608 T651 E652 C658 A659 S680	L600-Y655 HydrophobicContact CD1-CD2 3.77Å; L600-Y655 HydrophobicContact CD1-CE2 3.49Å; L600-Y655 VanDerWaalsContact CD1-CE2 3.49Å; L603-Y655 HydrophobicContact CB-CD2 3.97Å; Q607-Y655 HydrophobicContact CB-CD1 4.09Å; Q607-Y655 HydrophobicContact CB-CD2 4.36Å; Q607-Y655 HydrophobicContact CB-CE1 4.32Å; Q607-Y655 HydrophobicContact CB-CG 4.09Å; Q607-Y655 HydrophobicContact CG-CD1 3.71Å; Q607-Y655 HydrophobicContact CG-CE1 4.09Å; Q607-Y655 HydrophobicContact CG-CG 4.1Å; N608-Y655 PolarHBondContact OD1-OH 3.39Å; T651-Y655 VanDerWaalsContact O-CB 3.27Å; T651-Y655 WeakPolarHBondContact O-CB 3.47Å; T651-Y655 PolarHBondContact O-N 3.14Å; E652-Y655 PolarHBondContact O-N 3.48Å; Y655-C658 PolarHBondContact O-N 3.29Å; Y655-A659 WeakPolarHBondContact O-CB 3.41Å; Y655-A659 PolarHBondContact O-N 2.96Å; Y655-S680 WeakPolarHBondContact OH-CB 3.45Å; Y655-S680 PolarHBondContact OH-OG 3.04Å
656	L	91.8	Very high	89.4	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66.8	-37	180	-68.9	170.8	0	0	0	112	E652 C653 V654 A659 M660 F683 R703 V706	E652-L656 HydrophobicContact CG-CD1 3.81Å; E652-L656 HydrophobicContact CG-CG 4.25Å; E652-L656 WeakPolarHBondContact O-CB 3.46Å; E652-L656 VanDerWaalsContact O-CG 3.28Å; E652-L656 WeakPolarHBondContact O-CG 3.28Å; E652-L656 PolarHBondContact O-N 2.84Å; C653-L656 PolarHBondContact O-N 2.9Å; V654-L656 PolarHBondContact O-N 3.35Å; L656-A659 PolarHBondContact O-N 3.23Å; L656-M660 WeakPolarHBondContact O-CB 3.26Å; L656-M660 PolarHBondContact O-N 3.28Å; L656-F683 HydrophobicContact CD2-CB 4.33Å; L656-F683 HydrophobicContact CD2-CD2 4.11Å; L656-R703 HydrophobicContact CD1-CB 4.46Å; L656-R703 HydrophobicContact CD1-CG 4.05Å; L656-V706 HydrophobicContact CB-CG1 3.95Å
657	L	91.6	Very high	88.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.5	-41.4	176	-173.1	147.5	0	0	0	111.4	F591 C653 V654 A659 M660 L661 L725 W735 I748	F591-L657 HydrophobicContact CE2-CD2 3.6Å; F591-L657 HydrophobicContact CZ-CD2 3.84Å; C653-L657 VanDerWaalsContact O-CB 3.25Å; C653-L657 WeakPolarHBondContact O-CB 3.24Å; C653-L657 PolarHBondContact O-N 3.16Å; V654-L657 PolarHBondContact O-N 3.04Å; L657-A659 VanDerWaalsContact C-N 3.35Å; L657-M660 HydrophobicContact CG-CE 4.34Å; L657-M660 WeakPolarHBondContact O-CB 3.23Å; L657-M660 PolarHBondContact O-N 2.94Å; L657-L661 HydrophobicContact CD2-CD1 3.6Å; L657-L661 HydrophobicContact CD2-CG 4.3Å; L657-L661 WeakPolarHBondContact O-CG 3.37Å; L657-L661 PolarHBondContact O-N 3.29Å; L657-L725 HydrophobicContact CD1-CD1 4.25Å; L657-L725 HydrophobicContact CD1-CD2 3.94Å; L657-W735 HydrophobicContact CD1-CH2 4.12Å; L657-W735 HydrophobicContact CD1-CZ2 4.23Å; L657-I748 HydrophobicContact CD1-CD1 4.44Å; L657-I748 HydrophobicContact CD1-CG2 4.12Å
658	C	92	Very high	88.3	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-41.7	173.3	-68.5	0	0	0	0	112	F591 I596 L600 V654 Y655 L662	F591-C658 VanDerWaalsContact CD2-SG 3.51Å; I596-C658 HydrophobicContact CG2-CB 3.77Å; L600-C658 HydrophobicContact CB-CB 4.14Å; L600-C658 HydrophobicContact CD1-CB 4.29Å; V654-C658 WeakPolarHBondContact O-CB 3.24Å; V654-C658 PolarHBondContact O-N 3.21Å; V654-C658 PolarHBondContact O-SG 3.36Å; Y655-C658 PolarHBondContact O-N 3.29Å; C658-L662 PolarHBondContact O-N 2.86Å
659	A	91.8	Very high	87.5	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-44.1	175	0	0	0	0	0	111.3	L600 Y655 L656 L657 L661 L662 E663 F683	L600-A659 HydrophobicContact CD1-CB 4.04Å; Y655-A659 WeakPolarHBondContact O-CB 3.41Å; Y655-A659 PolarHBondContact O-N 2.96Å; L656-A659 PolarHBondContact O-N 3.23Å; L657-A659 VanDerWaalsContact C-N 3.35Å; A659-L661 PolarHBondContact O-N 3.49Å; A659-L662 PolarHBondContact O-N 2.99Å; A659-E663 VanDerWaalsContact O-CB 3.27Å; A659-E663 WeakPolarHBondContact O-CB 3.18Å; A659-E663 WeakPolarHBondContact O-CG 3.09Å; A659-E663 PolarHBondContact O-N 3.35Å; A659-F683 HydrophobicContact CB-CB 3.78Å; A659-F683 HydrophobicContact CB-CD2 4.2Å; A659-F683 HydrophobicContact CB-CG 4.02Å
660	M	90.7	Very high	86.6	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-56.9	-49.6	177.6	-177.3	-169.8	77.2	0	0	111.9	L656 L657 L662 I664 F683 V706 A709 L725	L656-M660 WeakPolarHBondContact O-CB 3.26Å; L656-M660 PolarHBondContact O-N 3.28Å; L657-M660 HydrophobicContact CG-CE 4.34Å; L657-M660 WeakPolarHBondContact O-CB 3.23Å; L657-M660 PolarHBondContact O-N 2.94Å; M660-L662 VanDerWaalsContact C-N 3.28Å; M660-L662 PolarHBondContact O-N 3.35Å; M660-I664 HydrophobicContact CB-CD1 4.37Å; M660-I664 HydrophobicContact CG-CD1 3.31Å; M660-I664 HydrophobicContact CG-CG1 4.38Å; M660-I664 WeakPolarHBondContact O-CB 3.19Å; M660-I664 WeakPolarHBondContact O-CD1 3.33Å; M660-I664 WeakPolarHBondContact O-CG1 3.24Å; M660-I664 PolarHBondContact O-N 3.43Å; M660-I664 VanDerWaalsContact O-N 3.15Å; M660-I664 HydrophobicContact SD-CD1 4.46Å; M660-F683 HydrophobicContact CB-CE2 3.8Å; M660-F683 HydrophobicContact CB-CZ 4.08Å; M660-F683 HydrophobicContact CG-CE2 4.3Å; M660-F683 HydrophobicContact CG-CZ 4.27Å; M660-V706 HydrophobicContact CB-CG1 4.38Å; M660-V706 HydrophobicContact SD-CG1 3.95Å; M660-A709 HydrophobicContact SD-CB 4.03Å; M660-L725 HydrophobicContact CE-CD1 4.17Å
661	L	90.5	Very high	85.3	Confident	2 Å²	2	20 Å²	20	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-66	-28	-178.1	-70.3	174.7	0	0	0	113.3	I596 L657 A659 P665 H751 V752 E755	I596-L661 HydrophobicContact CD1-CB 4.4Å; I596-L661 HydrophobicContact CD1-CD1 3.6Å; I596-L661 HydrophobicContact CG1-CD1 4.39Å; I596-L661 HydrophobicContact CG2-CB 4.47Å; L657-L661 HydrophobicContact CD2-CD1 3.6Å; L657-L661 HydrophobicContact CD2-CG 4.3Å; L657-L661 WeakPolarHBondContact O-CG 3.37Å; L657-L661 PolarHBondContact O-N 3.29Å; A659-L661 PolarHBondContact O-N 3.49Å; L661-P665 WeakPolarHBondContact O-CD 3.27Å; L661-P665 WeakPolarHBondContact O-CG 3.33Å; L661-H751 HydrophobicContact CD1-CB 4.05Å; L661-V752 HydrophobicContact CD2-CG2 4.05Å; L661-E755 HydrophobicContact CB-CG 4.3Å; L661-E755 HydrophobicContact CD2-CB 4.2Å; L661-E755 HydrophobicContact CD2-CG 4.01Å
662	L	88.2	Confident	83.6	Confident	28 Å²	28	25.3 Å²	25.3	15%	0.147	13%	0.125	C	C	.	.	H	α-helix	trans	-92.5	-36.9	179.3	-69.2	172.9	0	0	0	113	I596 R597 L600 C658 A659 M660 M666 I679	I596-L662 HydrophobicContact CG2-CD1 4.01Å; I596-L662 HydrophobicContact CG2-CG 4.02Å; R597-L662 HydrophobicContact CG-CD1 3.86Å; R597-L662 HydrophobicContact CG-CD2 3.81Å; L600-L662 HydrophobicContact CB-CD1 4.38Å; L600-L662 HydrophobicContact CD2-CD1 3.69Å; C658-L662 PolarHBondContact O-N 2.86Å; A659-L662 PolarHBondContact O-N 2.99Å; M660-L662 VanDerWaalsContact C-N 3.28Å; M660-L662 PolarHBondContact O-N 3.35Å; L662-M666 WeakPolarHBondContact O-CG 3.44Å; L662-I679 HydrophobicContact CB-CD1 4.17Å
663	E	86.3	Confident	82.2	Confident	7 Å²	7	28.6 Å²	28.6	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-80	-35.9	-175.9	-74.6	-167	-167	0	0	113.5	A659 M666 M667 I679 S680 F683	A659-E663 VanDerWaalsContact O-CB 3.27Å; A659-E663 WeakPolarHBondContact O-CB 3.18Å; A659-E663 WeakPolarHBondContact O-CG 3.09Å; A659-E663 PolarHBondContact O-N 3.35Å; E663-M666 CarbonylContact O-C 3.58Å; E663-M666 WeakPolarHBondContact O-CB 3.15Å; E663-M666 PolarHBondContact O-N 2.98Å; E663-M667 WeakPolarHBondContact O-CB 3.44Å; E663-M667 VanDerWaalsContact O-CG 3.3Å; E663-M667 WeakPolarHBondContact O-CG 3.49Å; E663-M667 PolarHBondContact O-N 2.96Å; E663-I679 HydrophobicContact CG-CB 3.98Å; E663-I679 HydrophobicContact CG-CD1 4.1Å; E663-I679 HydrophobicContact CG-CG1 4.21Å; E663-S680 VanDerWaalsContact OE1-CA 3.26Å; E663-S680 WeakPolarHBondContact OE1-CA 3.39Å; E663-S680 WeakPolarHBondContact OE1-CB 3.49Å; E663-S680 PolarHBondContact OE1-N 3.03Å; E663-F683 HydrophobicContact CB-CD1 4.45Å; E663-F683 HydrophobicContact CB-CE1 4.38Å; E663-F683 WeakPolarHBondContact OE2-CD1 3.26Å
664	I	85.2	Confident	80.3	Confident	7 Å²	7	31.1 Å²	31.1	4%	0.036	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-47.1	-173.5	-68.5	169.4	0	0	0	112.7	M660 M666 M667 A668 L713 L714 T759	M660-I664 HydrophobicContact CB-CD1 4.37Å; M660-I664 HydrophobicContact CG-CD1 3.31Å; M660-I664 HydrophobicContact CG-CG1 4.38Å; M660-I664 WeakPolarHBondContact O-CB 3.19Å; M660-I664 WeakPolarHBondContact O-CD1 3.33Å; M660-I664 WeakPolarHBondContact O-CG1 3.24Å; M660-I664 PolarHBondContact O-N 3.43Å; M660-I664 VanDerWaalsContact O-N 3.15Å; M660-I664 HydrophobicContact SD-CD1 4.46Å; I664-M666 PolarHBondContact O-N 3.45Å; I664-M667 PolarHBondContact O-N 2.93Å; I664-M667 VanDerWaalsContact O-N 3.16Å; I664-A668 PolarHBondContact O-N 2.94Å; I664-L713 HydrophobicContact CB-CD2 4.14Å; I664-L713 HydrophobicContact CD1-CB 4.08Å; I664-L713 HydrophobicContact CD1-CD2 3.78Å; I664-L713 HydrophobicContact CD1-CG 4.36Å; I664-L713 HydrophobicContact CG2-CB 4.32Å; I664-L713 HydrophobicContact CG2-CD2 4.05Å; I664-L713 HydrophobicContact CG2-CG 4.03Å; I664-L714 HydrophobicContact CG2-CD1 4.45Å; I664-T759 HydrophobicContact CG2-CG2 3.89Å
665	P	82.8	Confident	78.4	Confident	17 Å²	17	38.4 Å²	38.4	11%	0.11	18%	0.183	C	C	.	.	H	α-helix	trans	-58.7	-39.2	173.7	-22.6	32.6	0	0	0	111.9	L661 A668 S669 E755	L661-P665 WeakPolarHBondContact O-CD 3.27Å; L661-P665 WeakPolarHBondContact O-CG 3.33Å; P665-A668 PolarHBondContact O-N 3.22Å; P665-S669 PolarHBondContact O-N 2.83Å; P665-S669 PolarHBondContact O-OG 2.79Å; P665-E755 HydrophobicContact CG-CB 4.06Å; P665-E755 HydrophobicContact CG-CG 4.38Å; P665-E755 WeakPolarHBondContact CG-OE2 3.43Å
666	M	80.9	Confident	76.9	Confident	65 Å²	65	46 Å²	46	32%	0.32	21%	0.211	S	C	.	.	H	α-helix	trans	-68.7	-36.3	177.1	-70.8	-66.4	-58.7	0	0	113	L662 E663 I664 S669 K670	L662-M666 WeakPolarHBondContact O-CG 3.44Å; E663-M666 CarbonylContact O-C 3.58Å; E663-M666 WeakPolarHBondContact O-CB 3.15Å; E663-M666 PolarHBondContact O-N 2.98Å; I664-M666 PolarHBondContact O-N 3.45Å; M666-S669 PolarHBondContact O-OG 3.37Å; M666-K670 HydrophobicContact CE-CD 3.83Å; M666-K670 WeakPolarHBondContact O-CB 3.24Å; M666-K670 PolarHBondContact O-N 3.39Å; M666-K670 VanDerWaalsContact O-N 3.11Å
667	M	79.6	Confident	75.5	Confident	69 Å²	69	55.4 Å²	55.4	34%	0.34	25%	0.247	S	C	.	.	H	α-helix	trans	-69.2	-37	176.3	-81.4	-174.6	55.2	0	0	111.1	E663 I664 E671 L687	E663-M667 WeakPolarHBondContact O-CB 3.44Å; E663-M667 VanDerWaalsContact O-CG 3.3Å; E663-M667 WeakPolarHBondContact O-CG 3.49Å; E663-M667 PolarHBondContact O-N 2.96Å; I664-M667 PolarHBondContact O-N 2.93Å; I664-M667 VanDerWaalsContact O-N 3.16Å; M667-E671 PolarHBondContact O-N 3.34Å; M667-E671 VanDerWaalsContact O-N 3.15Å; M667-L687 HydrophobicContact CE-CD2 4.05Å; M667-L687 HydrophobicContact SD-CD2 4.3Å
668	A	77.1	Confident	74.3	Confident	7 Å²	7	61 Å²	61	6%	0.058	27%	0.274	C	S	.	.	H	α-helix	trans	-69	-45.7	175.1	0	0	0	0	0	111.6	I664 P665 K670 T759 V762	I664-A668 PolarHBondContact O-N 2.94Å; P665-A668 PolarHBondContact O-N 3.22Å; A668-K670 VanDerWaalsContact C-N 3.31Å; A668-K670 PolarHBondContact O-N 3.47Å; A668-T759 HydrophobicContact CB-CG2 3.91Å; A668-V762 VanDerWaalsContact C-CG1 3.46Å; A668-V762 HydrophobicContact CB-CG1 4.04Å; A668-V762 WeakPolarHBondContact O-CG1 3.37Å
669	S	74.4	Confident	73.5	Confident	30 Å²	30	65.1 Å²	65.1	21%	0.21	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-31.1	-178.6	64.2	0	0	0	0	113.1	P665 M666 V762	P665-S669 PolarHBondContact O-N 2.83Å; P665-S669 PolarHBondContact O-OG 2.79Å; M666-S669 PolarHBondContact O-OG 3.37Å; S669-V762 VanDerWaalsContact CA-CG1 3.4Å
670	K	69.9	Low	72.8	Confident	42 Å²	42	65.2 Å²	65.2	18%	0.183	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	23.3	-174.9	-58.4	-176.6	176.9	-143.6	0	113.6	M666 A668 F672 E673	M666-K670 HydrophobicContact CE-CD 3.83Å; M666-K670 WeakPolarHBondContact O-CB 3.24Å; M666-K670 PolarHBondContact O-N 3.39Å; M666-K670 VanDerWaalsContact O-N 3.11Å; A668-K670 VanDerWaalsContact C-N 3.31Å; A668-K670 PolarHBondContact O-N 3.47Å; K670-F672 PolarHBondContact O-N 3.29Å; K670-E673 HydrophobicContact CB-CB 4.33Å; K670-E673 HydrophobicContact CB-CG 4.47Å; K670-E673 WeakPolarHBondContact CD-OE2 3.46Å; K670-E673 IonicContact NZ-OE2 3Å; K670-E673 PolarHBondContact O-N 3.04Å; K670-E673 VanDerWaalsContact O-N 3.16Å
671	E	62.4	Low	72.3	Confident	123 Å²	123	75.2 Å²	75.2	58%	0.575	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.4	178	-169.7	170.3	-173.1	0	0	111.6	M667	M667-E671 PolarHBondContact O-N 3.34Å; M667-E671 VanDerWaalsContact O-N 3.15Å
672	F	56	Low	72	Confident	117 Å²	117	76.2 Å²	76.2	51%	0.513	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-16.2	-175.6	-62.1	-54.1	0	0	0	115.7	K670 T823 Q827	K670-F672 PolarHBondContact O-N 3.29Å; F672-T823 HydrophobicContact CB-CG2 3.53Å; F672-T823 HydrophobicContact CD1-CG2 3.66Å; F672-T823 HydrophobicContact CG-CG2 3.84Å; F672-Q827 PolarHBondContact O-NE2 3.34Å
673	E	60.1	Low	71.9	Confident	84 Å²	84	74.9 Å²	74.9	39%	0.393	33%	0.334	S	S	.	.			trans	-77.9	136.7	177.8	-71.2	-172.1	166.7	0	0	111.3	K670 R675	K670-E673 HydrophobicContact CB-CB 4.33Å; K670-E673 HydrophobicContact CB-CG 4.47Å; K670-E673 WeakPolarHBondContact CD-OE2 3.46Å; K670-E673 IonicContact NZ-OE2 3Å; K670-E673 PolarHBondContact O-N 3.04Å; K670-E673 VanDerWaalsContact O-N 3.16Å; E673-R675 PolarHBondContact O-N 3.17Å
674	V	50.2	Low	71.8	Confident	54 Å²	54	76.9 Å²	76.9	33%	0.327	34%	0.343	S	S	.	.	S	Bend	trans	-65.9	-32.3	178.7	-174.7	0	0	0	0	110.9	R676 Q827 E830 K831	V674-R676 PolarHBondContact O-N 3.09Å; V674-Q827 VanDerWaalsContact CG2-CA 3.46Å; V674-Q827 HydrophobicContact CG2-CB 3.49Å; V674-Q827 VanDerWaalsContact CG2-CB 3.49Å; V674-Q827 HydrophobicContact CG2-CG 3.48Å; V674-Q827 VanDerWaalsContact CG2-CG 3.48Å; V674-E830 VanDerWaalsContact CB-OE2 3.3Å; V674-E830 WeakPolarHBondContact CB-OE2 3.48Å; V674-E830 HydrophobicContact CG2-CB 4.36Å; V674-E830 VanDerWaalsContact CG2-OE2 3.29Å; V674-E830 WeakPolarHBondContact CG2-OE2 3.34Å; V674-K831 HydrophobicContact CG1-CG 4.36Å
675	R	53.3	Low	71.8	Confident	153 Å²	153	83.3 Å²	83.3	58%	0.577	37%	0.368	S	S	*	.			trans	-92.5	80.1	-178.9	-71.9	-172.2	177.4	179.5	2.1	111.3	E673 R677	E673-R675 PolarHBondContact O-N 3.17Å; R675-R677 VanDerWaalsContact C-N 3.34Å; R675-R677 PolarHBondContact O-N 3.26Å
676	R	60	Low	71.9	Confident	160 Å²	160	83.4 Å²	83.4	60%	0.604	37%	0.367	S	S	*	.			trans	-59	94.2	163.7	-64.3	-179.2	-179.2	-174.2	-3.7	109.4	V674 M678	V674-R676 PolarHBondContact O-N 3.09Å; R676-M678 PolarHBondContact O-N 3.17Å
677	R	62.7	Low	72.2	Confident	199 Å²	199	81 Å²	81	75%	0.751	36%	0.355	S	S	*	.			trans	-70.9	96.9	170.9	-64.8	-171.5	-159.6	177.5	5.6	107.7	R675	R675-R677 VanDerWaalsContact C-N 3.34Å; R675-R677 PolarHBondContact O-N 3.26Å
678	M	67.2	Low	72.5	Confident	116 Å²	116	82.3 Å²	82.3	57%	0.571	36%	0.359	S	S	*	.			trans	-74.8	124.3	178.8	-56.9	171.9	-155.9	0	0	108.9	R676	R676-M678 PolarHBondContact O-N 3.17Å
679	I	74.5	Confident	73	Confident	87 Å²	87	86.6 Å²	86.6	45%	0.446	38%	0.378	S	S	.	.	S	Bend	trans	-80.4	-48.5	178.6	-55.5	176.5	0	0	0	109.3	L600 L662 E663	L600-I679 HydrophobicContact CD2-CG2 3.62Å; L662-I679 HydrophobicContact CB-CD1 4.17Å; E663-I679 HydrophobicContact CG-CB 3.98Å; E663-I679 HydrophobicContact CG-CD1 4.1Å; E663-I679 HydrophobicContact CG-CG1 4.21Å
680	S	76.6	Confident	73.5	Confident	2 Å²	2	85.8 Å²	85.8	1%	0.014	37%	0.372	C	S	.	.			trans	-118.9	117.8	177.7	173.8	0	0	0	0	110.5	Y655 E663 S682 F683 H684	Y655-S680 WeakPolarHBondContact OH-CB 3.45Å; Y655-S680 PolarHBondContact OH-OG 3.04Å; E663-S680 VanDerWaalsContact OE1-CA 3.26Å; E663-S680 WeakPolarHBondContact OE1-CA 3.39Å; E663-S680 WeakPolarHBondContact OE1-CB 3.49Å; E663-S680 PolarHBondContact OE1-N 3.03Å; S680-S682 VanDerWaalsContact C-N 3.28Å; S680-S682 PolarHBondContact O-N 3.4Å; S680-S682 PolarHBondContact OG-N 3.47Å; S680-F683 PolarHBondContact OG-N 2.64Å; S680-H684 PolarHBondContact O-N 3.02Å
681	R	81.2	Confident	74.2	Confident	211 Å²	211	89.8 Å²	89.8	80%	0.796	39%	0.392	S	S	*	.	H	α-helix	trans	-66.1	-33.6	169.8	-172.2	175.2	179.4	170.7	0.3	112.1	Y685	R681-Y685 WeakPolarHBondContact O-CB 3.45Å; R681-Y685 PolarHBondContact O-N 2.86Å
682	S	83.3	Confident	75.4	Confident	23 Å²	23	91.7 Å²	91.7	16%	0.161	39%	0.394	C	S	.	.	H	α-helix	trans	-70	-47	-176.4	-178.7	0	0	0	0	111.7	N608 S680 H684 Y685 Q686	N608-S682 WeakPolarHBondContact OD1-CB 3.42Å; S680-S682 VanDerWaalsContact C-N 3.28Å; S680-S682 PolarHBondContact O-N 3.4Å; S680-S682 PolarHBondContact OG-N 3.47Å; S682-H684 PolarHBondContact O-N 3.23Å; S682-Y685 PolarHBondContact O-N 3.42Å; S682-Q686 WeakPolarHBondContact O-CG 3.36Å; S682-Q686 PolarHBondContact O-N 3.09Å
683	F	85.7	Confident	76.9	Confident	0 Å²	0	90.2 Å²	90.2	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-61.2	-46.8	176.6	178.2	-95.6	0	0	0	111.4	L656 A659 M660 E663 S680 Y685 Q686 L687 M707	L656-F683 HydrophobicContact CD2-CB 4.33Å; L656-F683 HydrophobicContact CD2-CD2 4.11Å; A659-F683 HydrophobicContact CB-CB 3.78Å; A659-F683 HydrophobicContact CB-CD2 4.2Å; A659-F683 HydrophobicContact CB-CG 4.02Å; M660-F683 HydrophobicContact CB-CE2 3.8Å; M660-F683 HydrophobicContact CB-CZ 4.08Å; M660-F683 HydrophobicContact CG-CE2 4.3Å; M660-F683 HydrophobicContact CG-CZ 4.27Å; E663-F683 HydrophobicContact CB-CD1 4.45Å; E663-F683 HydrophobicContact CB-CE1 4.38Å; E663-F683 WeakPolarHBondContact OE2-CD1 3.26Å; S680-F683 PolarHBondContact OG-N 2.64Å; F683-Y685 VanDerWaalsContact C-N 3.31Å; F683-Y685 PolarHBondContact O-N 2.95Å; F683-Q686 PolarHBondContact O-N 3.13Å; F683-Q686 VanDerWaalsContact O-N 3.09Å; F683-L687 HydrophobicContact CE1-CD2 4.49Å; F683-L687 PolarHBondContact O-N 2.81Å; F683-M707 HydrophobicContact CE2-CE 4.28Å; F683-M707 HydrophobicContact CE2-SD 4.29Å; F683-M707 HydrophobicContact CZ-CE 4.47Å
684	H	84.2	Confident	78.1	Confident	48 Å²	48	97.8 Å²	97.8	22%	0.222	42%	0.415	C	S	.	.	H	α-helix	trans	-61.5	-38.5	177.9	-168.7	72.3	0	0	0	113	S680 S682 L687 K688	S680-H684 PolarHBondContact O-N 3.02Å; S682-H684 PolarHBondContact O-N 3.23Å; H684-L687 PolarHBondContact O-N 3.01Å; H684-K688 WeakPolarHBondContact O-CB 3.43Å; H684-K688 PolarHBondContact O-N 3.28Å
685	Y	86.2	Confident	79.7	Confident	142 Å²	142	102.6 Å²	102.6	56%	0.557	44%	0.438	S	S	*	.	H	α-helix	trans	-62	-44	173.7	177.9	-94.7	0	0	0	111.6	R681 S682 F683 K688 Q689	R681-Y685 WeakPolarHBondContact O-CB 3.45Å; R681-Y685 PolarHBondContact O-N 2.86Å; S682-Y685 PolarHBondContact O-N 3.42Å; F683-Y685 VanDerWaalsContact C-N 3.31Å; F683-Y685 PolarHBondContact O-N 2.95Å; Y685-K688 PolarHBondContact O-N 3.47Å; Y685-Q689 WeakPolarHBondContact O-CB 3.49Å; Y685-Q689 PolarHBondContact O-N 2.92Å
686	Q	85.7	Confident	81.1	Confident	19 Å²	19	100.2 Å²	100.2	9%	0.089	44%	0.436	C	S	.	.	H	α-helix	trans	-65.7	-37.9	176.5	-67.5	-171.8	30.9	0	0	112.3	E652 S682 F683 Q689 S690 M707	E652-Q686 PolarHBondContact OE1-NE2 3.33Å; S682-Q686 WeakPolarHBondContact O-CG 3.36Å; S682-Q686 PolarHBondContact O-N 3.09Å; F683-Q686 PolarHBondContact O-N 3.13Å; F683-Q686 VanDerWaalsContact O-N 3.09Å; Q686-Q689 PolarHBondContact O-N 3.37Å; Q686-S690 PolarHBondContact O-N 3.5Å; Q686-M707 HydrophobicContact CB-CE 4.43Å; Q686-M707 HydrophobicContact CB-SD 3.93Å
687	L	85.5	Confident	82.3	Confident	15 Å²	15	94.8 Å²	94.8	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-59.8	-53.1	173.4	-169.7	64.1	0	0	0	111.6	M667 F683 H684 Q689 S690 E691 M707	M667-L687 HydrophobicContact CE-CD2 4.05Å; M667-L687 HydrophobicContact SD-CD2 4.3Å; F683-L687 HydrophobicContact CE1-CD2 4.49Å; F683-L687 PolarHBondContact O-N 2.81Å; H684-L687 PolarHBondContact O-N 3.01Å; L687-Q689 VanDerWaalsContact C-N 3.25Å; L687-Q689 PolarHBondContact O-N 2.91Å; L687-S690 PolarHBondContact O-N 3.12Å; L687-S690 PolarHBondContact O-OG 3.01Å; L687-E691 WeakPolarHBondContact O-CG 3.48Å; L687-E691 PolarHBondContact O-N 2.81Å; L687-M707 HydrophobicContact CB-CE 3.6Å; L687-M707 HydrophobicContact CD1-CE 3.45Å; L687-M707 VanDerWaalsContact CD1-CE 3.45Å; L687-M707 HydrophobicContact CG-CE 4.13Å; L687-M707 VanDerWaalsContact N-CE 3.34Å
688	K	86.4	Confident	83.3	Confident	97 Å²	97	90.7 Å²	90.7	42%	0.422	43%	0.429	S	S	.	.	H	α-helix	trans	-60.3	-35.2	176.8	-170.3	175.2	-173.1	175.7	0	112.6	H684 Y685 R692	H684-K688 WeakPolarHBondContact O-CB 3.43Å; H684-K688 PolarHBondContact O-N 3.28Å; Y685-K688 PolarHBondContact O-N 3.47Å; K688-R692 WeakPolarHBondContact O-CD 3.33Å; K688-R692 WeakPolarHBondContact O-CG 3.49Å; K688-R692 PolarHBondContact O-N 3.08Å; K688-R692 VanDerWaalsContact O-N 3.15Å
689	Q	87.2	Confident	84.2	Confident	96 Å²	96	86.1 Å²	86.1	45%	0.449	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-41.7	175.3	-173.2	170.1	13.8	0	0	111.4	Y685 Q686 L687 E691 R692 Q693	Y685-Q689 WeakPolarHBondContact O-CB 3.49Å; Y685-Q689 PolarHBondContact O-N 2.92Å; Q686-Q689 PolarHBondContact O-N 3.37Å; L687-Q689 VanDerWaalsContact C-N 3.25Å; L687-Q689 PolarHBondContact O-N 2.91Å; Q689-E691 VanDerWaalsContact C-N 3.32Å; Q689-E691 PolarHBondContact O-N 3.36Å; Q689-R692 PolarHBondContact O-N 3.46Å; Q689-Q693 PolarHBondContact O-N 3.39Å
690	S	84.8	Confident	84.7	Confident	13 Å²	13	87.5 Å²	87.5	9%	0.091	41%	0.412	C	S	.	.	H	α-helix	trans	-67.6	-28.5	176.9	80.2	0	0	0	0	113.5	Q686 L687	Q686-S690 PolarHBondContact O-N 3.5Å; L687-S690 PolarHBondContact O-N 3.12Å; L687-S690 PolarHBondContact O-OG 3.01Å
691	E	84.6	Confident	85.2	Confident	126 Å²	126	90.2 Å²	90.2	59%	0.589	43%	0.427	S	S	*	.	H	α-helix	trans	-78.3	-28.2	175	-71.3	175	171.7	0	0	112.7	L687 Q689 Q693	L687-E691 WeakPolarHBondContact O-CG 3.48Å; L687-E691 PolarHBondContact O-N 2.81Å; Q689-E691 VanDerWaalsContact C-N 3.32Å; Q689-E691 PolarHBondContact O-N 3.36Å; E691-Q693 VanDerWaalsContact C-N 3.29Å
692	R	89	Confident	85.5	Confident	163 Å²	163	80.3 Å²	80.3	62%	0.615	39%	0.39	S	S	*	.	H	α-helix	trans	-75.4	-17.3	176.6	-76.9	170.3	170.9	-166.4	-7.6	113.3	K688 Q689 Y694	K688-R692 WeakPolarHBondContact O-CD 3.33Å; K688-R692 WeakPolarHBondContact O-CG 3.49Å; K688-R692 PolarHBondContact O-N 3.08Å; K688-R692 VanDerWaalsContact O-N 3.15Å; Q689-R692 PolarHBondContact O-N 3.46Å; R692-Y694 PolarHBondContact O-N 3.01Å
693	Q	86.1	Confident	85.7	Confident	87 Å²	87	84.3 Å²	84.3	41%	0.407	40%	0.401	S	S	.	.			trans	-71.6	116.3	176.2	-72.9	177	-13	0	0	109.6	Q689 E691 L695	Q689-Q693 PolarHBondContact O-N 3.39Å; E691-Q693 VanDerWaalsContact C-N 3.29Å; Q693-L695 VanDerWaalsContact C-N 3.32Å; Q693-L695 PolarHBondContact O-N 2.97Å
694	Y	85	Confident	85.9	Confident	242 Å²	242	87.8 Å²	87.8	95%	0.949	42%	0.418	S	S	*	.	S	Bend	trans	-65	-34.7	179.7	-67.5	-82.4	0	0	0	113.2	R692	R692-Y694 PolarHBondContact O-N 3.01Å
695	L	85.5	Confident	86.2	Confident	156 Å²	156	85.7 Å²	85.7	82%	0.817	41%	0.408	S	S	*	.	S	Bend	trans	-115.5	108	177.2	-177.2	67.1	0	0	0	109	Q693	Q693-L695 VanDerWaalsContact C-N 3.32Å; Q693-L695 PolarHBondContact O-N 2.97Å
696	I	82.4	Confident	86.5	Confident	103 Å²	103	79 Å²	79	53%	0.528	38%	0.381	S	S	.	.			trans	-95.2	102.2	174.9	-60	163.1	0	0	0	107.2
697	G	84.1	Confident	86.6	Confident	46 Å²	46	78.6 Å²	78.6	47%	0.474	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-74.4	172.5	171.6	0	0	0	0	0	112.5
698	P	84.9	Confident	86.8	Confident	112 Å²	112	79 Å²	79	73%	0.727	39%	0.385	S	S	*	.	S	Bend	trans	-59.7	140.2	168.4	27.3	-33.5	0	0	0	109.7	E700	P698-E700 PolarHBondContact O-N 3.34Å
699	P	85.4	Confident	87.1	Confident	20 Å²	20	74.3 Å²	74.3	13%	0.13	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.6	134.6	-171.3	27.6	-35.3	0	0	0	111.6	E704 H705 A708 F724	P699-E704 HydrophobicContact CB-CB 3.83Å; P699-H705 VanDerWaalsContact C-CE1 3.4Å; P699-H705 HydrophobicContact CB-CB 4.31Å; P699-H705 PolarHBondContact O-CE1 3.03Å; P699-H705 PolarHBondContact O-NE2 3.41Å; P699-A708 HydrophobicContact CB-CB 4.48Å; P699-A708 HydrophobicContact CG-CB 4.23Å; P699-F724 HydrophobicContact CG-CD1 3.92Å; P699-F724 HydrophobicContact CG-CE1 4.18Å
700	E	85.1	Confident	87.2	Confident	116 Å²	116	70 Å²	70	54%	0.542	35%	0.345	S	S	.	.			trans	-119.4	-36.1	176.6	-60.8	-140.4	117.4	0	0	112.3	P698 E704 K729 K733	P698-E700 PolarHBondContact O-N 3.34Å; E700-E704 PolarHBondContact N-OE2 3.35Å; E700-K729 IonicContact OE1-NZ 3.92Å; E700-K729 PolarHBondContact OE1-NZ 3.39Å; E700-K733 PolarHBondContact O-NZ 3.26Å
701	N	87.6	Confident	87.4	Confident	59 Å²	59	72.6 Å²	72.6	32%	0.316	36%	0.355	S	S	.	.	S	Bend	trans	-83.1	151.2	177.3	-162.9	-1.1	0	0	0	111.2	R703 E704 H705	N701-R703 VanDerWaalsContact C-N 3.25Å; N701-R703 PolarHBondContact O-N 3.43Å; N701-E704 HydrophobicContact CB-CB 4.33Å; N701-E704 HydrophobicContact CB-CG 4.03Å; N701-E704 PolarHBondContact N-OE2 3.33Å; N701-E704 VanDerWaalsContact N-OE2 3.11Å; N701-E704 PolarHBondContact O-N 3.39Å; N701-H705 PolarHBondContact O-N 3.27Å; N701-H705 PolarHBondContact O-ND1 3.45Å
702	T	85.8	Confident	87.6	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-56.1	-43.4	176.7	51.8	0	0	0	0	110.9	H705 V706 K733 V734	T702-H705 PolarHBondContact O-N 3.4Å; T702-V706 WeakPolarHBondContact O-CG2 3.4Å; T702-V706 PolarHBondContact O-N 3.49Å; T702-K733 HydrophobicContact CG2-CB 4.23Å; T702-K733 HydrophobicContact CG2-CD 3.91Å; T702-V734 HydrophobicContact CG2-CG2 3.94Å
703	R	88.4	Confident	87.6	Confident	106 Å²	106	59.4 Å²	59.4	40%	0.4	30%	0.303	S	S	.	.	H	α-helix	trans	-58	-50.3	175.6	-59.6	-178.7	-173.3	172.2	-5.2	112	E652 L656 N701 H705 V706 M707	E652-R703 IonicContact OE1-CZ 2.71Å; E652-R703 IonicContact OE1-NE 2.74Å; E652-R703 PolarHBondContact OE1-NE 3.07Å; E652-R703 IonicContact OE1-NH2 3.81Å; E652-R703 PolarHBondContact OE1-NH2 3.17Å; E652-R703 IonicContact OE2-CZ 2.73Å; E652-R703 IonicContact OE2-NE 2.72Å; E652-R703 PolarHBondContact OE2-NE 3.38Å; E652-R703 IonicContact OE2-NH2 3.61Å; E652-R703 PolarHBondContact OE2-NH2 3Å; L656-R703 HydrophobicContact CD1-CB 4.46Å; L656-R703 HydrophobicContact CD1-CG 4.05Å; N701-R703 VanDerWaalsContact C-N 3.25Å; N701-R703 PolarHBondContact O-N 3.43Å; R703-H705 VanDerWaalsContact C-N 3.31Å; R703-H705 PolarHBondContact O-N 2.94Å; R703-V706 PolarHBondContact O-N 3.46Å; R703-V706 VanDerWaalsContact O-N 3.12Å; R703-M707 VanDerWaalsContact O-CG 3.26Å; R703-M707 WeakPolarHBondContact O-CG 2.95Å; R703-M707 PolarHBondContact O-N 3.06Å
704	E	90.3	Very high	87.7	Confident	74 Å²	74	59.2 Å²	59.2	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-36.9	-179.2	-68.8	167.6	179.1	0	0	112.6	P699 E700 N701 M707 A708	P699-E704 HydrophobicContact CB-CB 3.83Å; E700-E704 PolarHBondContact N-OE2 3.35Å; N701-E704 HydrophobicContact CB-CB 4.33Å; N701-E704 HydrophobicContact CB-CG 4.03Å; N701-E704 PolarHBondContact N-OE2 3.33Å; N701-E704 VanDerWaalsContact N-OE2 3.11Å; N701-E704 PolarHBondContact O-N 3.39Å; E704-M707 PolarHBondContact O-N 3.27Å; E704-A708 WeakPolarHBondContact O-CB 3.31Å; E704-A708 PolarHBondContact O-N 2.87Å
705	H	91	Very high	87.8	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-43.6	174.7	-74.5	80.6	0	0	0	111.3	P699 N701 T702 R703 M707 A708 A709 F724 M730	P699-H705 VanDerWaalsContact C-CE1 3.4Å; P699-H705 HydrophobicContact CB-CB 4.31Å; P699-H705 PolarHBondContact O-CE1 3.03Å; P699-H705 PolarHBondContact O-NE2 3.41Å; N701-H705 PolarHBondContact O-N 3.27Å; N701-H705 PolarHBondContact O-ND1 3.45Å; T702-H705 PolarHBondContact O-N 3.4Å; R703-H705 VanDerWaalsContact C-N 3.31Å; R703-H705 PolarHBondContact O-N 2.94Å; H705-M707 VanDerWaalsContact C-N 3.34Å; H705-A708 PolarHBondContact O-N 3.39Å; H705-A709 VanDerWaalsContact O-CB 3.27Å; H705-A709 WeakPolarHBondContact O-CB 3.49Å; H705-A709 PolarHBondContact O-N 3.48Å; H705-F724 PolarHBondContact CD2-O 3.41Å; H705-F724 VanDerWaalsContact CD2-O 3.29Å; H705-M730 HydrophobicContact CB-CE 3.38Å; H705-M730 HydrophobicContact CB-SD 3.87Å
706	V	90.6	Very high	87.7	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-38.2	175.7	-179.3	0	0	0	0	110.9	L656 M660 T702 R703 A709 S710 L725 M730	L656-V706 HydrophobicContact CB-CG1 3.95Å; M660-V706 HydrophobicContact CB-CG1 4.38Å; M660-V706 HydrophobicContact SD-CG1 3.95Å; T702-V706 WeakPolarHBondContact O-CG2 3.4Å; T702-V706 PolarHBondContact O-N 3.49Å; R703-V706 PolarHBondContact O-N 3.46Å; R703-V706 VanDerWaalsContact O-N 3.12Å; V706-A709 PolarHBondContact O-N 3.39Å; V706-S710 WeakPolarHBondContact O-CB 3.36Å; V706-S710 PolarHBondContact O-N 3.49Å; V706-L725 HydrophobicContact CG2-CD2 4.49Å; V706-M730 HydrophobicContact CG2-CE 4.45Å
707	M	89.7	Confident	88	Confident	11 Å²	11	43 Å²	43	5%	0.054	24%	0.24	C	C	.	.	H	α-helix	trans	-68.1	-40.2	176.4	-57.8	-39.5	-57.9	0	0	112.6	F683 Q686 L687 R703 E704 H705 S710 K711	F683-M707 HydrophobicContact CE2-CE 4.28Å; F683-M707 HydrophobicContact CE2-SD 4.29Å; F683-M707 HydrophobicContact CZ-CE 4.47Å; Q686-M707 HydrophobicContact CB-CE 4.43Å; Q686-M707 HydrophobicContact CB-SD 3.93Å; L687-M707 HydrophobicContact CB-CE 3.6Å; L687-M707 HydrophobicContact CD1-CE 3.45Å; L687-M707 VanDerWaalsContact CD1-CE 3.45Å; L687-M707 HydrophobicContact CG-CE 4.13Å; L687-M707 VanDerWaalsContact N-CE 3.34Å; R703-M707 VanDerWaalsContact O-CG 3.26Å; R703-M707 WeakPolarHBondContact O-CG 2.95Å; R703-M707 PolarHBondContact O-N 3.06Å; E704-M707 PolarHBondContact O-N 3.27Å; H705-M707 VanDerWaalsContact C-N 3.34Å; M707-S710 WeakPolarHBondContact O-CB 3.2Å; M707-S710 PolarHBondContact O-N 2.91Å; M707-S710 PolarHBondContact O-OG 2.84Å; M707-K711 PolarHBondContact O-N 2.98Å
708	A	89	Confident	88.3	Confident	23 Å²	23	41.2 Å²	41.2	19%	0.19	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-42.9	173.9	0	0	0	0	0	111	P699 E704 H705 S710 K711 A712 F724	P699-A708 HydrophobicContact CB-CB 4.48Å; P699-A708 HydrophobicContact CG-CB 4.23Å; E704-A708 WeakPolarHBondContact O-CB 3.31Å; E704-A708 PolarHBondContact O-N 2.87Å; H705-A708 PolarHBondContact O-N 3.39Å; A708-S710 VanDerWaalsContact C-N 3.29Å; A708-S710 PolarHBondContact O-N 3.24Å; A708-K711 PolarHBondContact O-N 3.47Å; A708-A712 PolarHBondContact O-N 2.81Å; A708-A712 VanDerWaalsContact O-N 3.08Å; A708-F724 HydrophobicContact CB-CD1 4.13Å; A708-F724 HydrophobicContact CB-CD2 4.2Å; A708-F724 HydrophobicContact CB-CE1 4.27Å; A708-F724 HydrophobicContact CB-CE2 4.35Å; A708-F724 HydrophobicContact CB-CG 4.11Å; A708-F724 HydrophobicContact CB-CZ 4.39Å
709	A	92.1	Very high	88.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-38.9	173.1	0	0	0	0	0	112	M660 H705 V706 K711 A712 L713 F724 L725	M660-A709 HydrophobicContact SD-CB 4.03Å; H705-A709 VanDerWaalsContact O-CB 3.27Å; H705-A709 WeakPolarHBondContact O-CB 3.49Å; H705-A709 PolarHBondContact O-N 3.48Å; V706-A709 PolarHBondContact O-N 3.39Å; A709-K711 PolarHBondContact O-N 3.44Å; A709-A712 PolarHBondContact O-N 2.97Å; A709-L713 WeakPolarHBondContact O-CB 3.08Å; A709-L713 PolarHBondContact O-N 3.37Å; A709-F724 HydrophobicContact CB-CB 4.02Å; A709-L725 HydrophobicContact CB-CD2 3.86Å; A709-L725 HydrophobicContact CB-CG 3.92Å
710	S	90.2	Very high	88.9	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-41.4	176.8	76.7	0	0	0	0	112.8	V706 M707 A708 L713 L714	V706-S710 WeakPolarHBondContact O-CB 3.36Å; V706-S710 PolarHBondContact O-N 3.49Å; M707-S710 WeakPolarHBondContact O-CB 3.2Å; M707-S710 PolarHBondContact O-N 2.91Å; M707-S710 PolarHBondContact O-OG 2.84Å; A708-S710 VanDerWaalsContact C-N 3.29Å; A708-S710 PolarHBondContact O-N 3.24Å; S710-L713 PolarHBondContact O-N 3.34Å; S710-L714 PolarHBondContact O-N 2.94Å
711	K	87.6	Confident	89.2	Confident	68 Å²	68	36.2 Å²	36.2	30%	0.296	18%	0.184	S	C	.	.	H	α-helix	trans	-68.5	-39.6	177.1	-68	179.3	-179	178.1	0	111.5	M707 A708 A709 L714 V715	M707-K711 PolarHBondContact O-N 2.98Å; A708-K711 PolarHBondContact O-N 3.47Å; A709-K711 PolarHBondContact O-N 3.44Å; K711-L714 PolarHBondContact O-N 3.35Å; K711-V715 PolarHBondContact O-N 2.86Å
712	A	89.4	Confident	89.3	Confident	13 Å²	13	37.3 Å²	37.3	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-39.6	174.4	0	0	0	0	0	112.2	A708 A709 L714 V715 G716 D717 A720 C721 F724	A708-A712 PolarHBondContact O-N 2.81Å; A708-A712 VanDerWaalsContact O-N 3.08Å; A709-A712 PolarHBondContact O-N 2.97Å; A712-L714 VanDerWaalsContact C-N 3.34Å; A712-L714 PolarHBondContact O-N 3.34Å; A712-V715 PolarHBondContact O-N 3.08Å; A712-G716 PolarHBondContact O-N 3.25Å; A712-D717 PolarHBondContact O-N 3.25Å; A712-D717 VanDerWaalsContact O-N 3.17Å; A712-A720 HydrophobicContact CB-CB 3.95Å; A712-C721 HydrophobicContact CB-CB 4.27Å; A712-F724 HydrophobicContact CB-CD2 4.28Å; A712-F724 HydrophobicContact CB-CE2 4.25Å
713	L	90.1	Very high	89.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-36.6	178.2	-167.3	65.2	0	0	0	112	I664 A709 S710 V715 G716 V752 S756 T759	I664-L713 HydrophobicContact CB-CD2 4.14Å; I664-L713 HydrophobicContact CD1-CB 4.08Å; I664-L713 HydrophobicContact CD1-CD2 3.78Å; I664-L713 HydrophobicContact CD1-CG 4.36Å; I664-L713 HydrophobicContact CG2-CB 4.32Å; I664-L713 HydrophobicContact CG2-CD2 4.05Å; I664-L713 HydrophobicContact CG2-CG 4.03Å; A709-L713 WeakPolarHBondContact O-CB 3.08Å; A709-L713 PolarHBondContact O-N 3.37Å; S710-L713 PolarHBondContact O-N 3.34Å; L713-V715 VanDerWaalsContact C-N 3.28Å; L713-V715 PolarHBondContact O-N 3.4Å; L713-G716 WeakPolarHBondContact O-CA 3Å; L713-G716 PolarHBondContact O-N 2.57Å; L713-V752 HydrophobicContact CD1-CG1 4.45Å; L713-S756 VanDerWaalsContact CD1-CB 3.46Å; L713-T759 WeakPolarHBondContact O-CG2 3.48Å
714	L	86.7	Confident	89.5	Confident	82 Å²	82	38.9 Å²	38.9	43%	0.429	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-35.1	175.5	-171.1	68.6	0	0	0	112.6	I664 S710 K711 A712 G716	I664-L714 HydrophobicContact CG2-CD1 4.45Å; S710-L714 PolarHBondContact O-N 2.94Å; K711-L714 PolarHBondContact O-N 3.35Å; A712-L714 VanDerWaalsContact C-N 3.34Å; A712-L714 PolarHBondContact O-N 3.34Å; L714-G716 PolarHBondContact O-N 3.45Å
715	V	86.9	Confident	89.4	Confident	84 Å²	84	35.4 Å²	35.4	51%	0.509	18%	0.18	S	C	.	.	H	α-helix	trans	-74	-16.2	174.9	178.9	0	0	0	0	111.8	K711 A712 L713 Y764	K711-V715 PolarHBondContact O-N 2.86Å; A712-V715 PolarHBondContact O-N 3.08Å; L713-V715 VanDerWaalsContact C-N 3.28Å; L713-V715 PolarHBondContact O-N 3.4Å; V715-Y764 WeakPolarHBondContact O-CE2 3.23Å; V715-Y764 PolarHBondContact O-OH 3.3Å
716	G	83.4	Confident	89.2	Confident	7 Å²	7	37.4 Å²	37.4	7%	0.072	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	86	11.6	-175.3	0	0	0	0	0	114.2	A712 L713 L714 W718	A712-G716 PolarHBondContact O-N 3.25Å; L713-G716 WeakPolarHBondContact O-CA 3Å; L713-G716 PolarHBondContact O-N 2.57Å; L714-G716 PolarHBondContact O-N 3.45Å; G716-W718 PolarHBondContact O-N 3.28Å
717	D	89.1	Confident	88.9	Confident	70 Å²	70	40 Å²	40	37%	0.374	21%	0.205	S	C	.	.			trans	-89	98.5	176.7	-172.2	-1.5	0	0	0	111.4	A712 R719 A720 C721	A712-D717 PolarHBondContact O-N 3.25Å; A712-D717 VanDerWaalsContact O-N 3.17Å; D717-R719 VanDerWaalsContact C-N 3.32Å; D717-R719 PolarHBondContact O-N 2.91Å; D717-R719 WeakPolarHBondContact OD1-CB 3.31Å; D717-R719 PolarHBondContact OD1-N 3.15Å; D717-A720 HydrophobicContact CB-CB 4.29Å; D717-A720 PolarHBondContact OD1-N 3.27Å; D717-A720 WeakPolarHBondContact OD2-CB 3.47Å; D717-C721 WeakPolarHBondContact O-CB 3.37Å; D717-C721 PolarHBondContact O-N 2.75Å
718	W	91.7	Very high	88.5	Confident	9 Å²	9	48.7 Å²	48.7	3%	0.034	24%	0.242	C	C	.	.	H	α-helix	trans	-71.6	-25	178.8	75.5	-94.1	0	0	0	113.3	G716 R722 V752 K753 S756 M779 F780 E781	G716-W718 PolarHBondContact O-N 3.28Å; W718-R722 VanDerWaalsContact O-CB 3.29Å; W718-R722 WeakPolarHBondContact O-CB 3.31Å; W718-R722 PolarHBondContact O-N 2.93Å; W718-V752 HydrophobicContact CB-CG1 4.46Å; W718-K753 HydrophobicContact CD2-CG 4.1Å; W718-K753 HydrophobicContact CE3-CG 3.91Å; W718-K753 HydrophobicContact CG-CG 4.5Å; W718-K753 VanDerWaalsContact CH2-CE 3.47Å; W718-K753 HydrophobicContact CZ3-CD 4.5Å; W718-K753 HydrophobicContact CZ3-CG 4.35Å; W718-S756 VanDerWaalsContact CB-OG 3.31Å; W718-S756 WeakPolarHBondContact CB-OG 3.45Å; W718-M779 PolarHBondContact NE1-O 3.26Å; W718-F780 AromaticContact CD1-CD1 3.44Å; W718-F780 VanDerWaalsContact CD1-CD1 3.44Å; W718-F780 AromaticContact CD1-CE1 3.84Å; W718-F780 HydrophobicContact CG-CD1 4.18Å; W718-E781 VanDerWaalsContact CH2-OE2 3.24Å; W718-E781 WeakPolarHBondContact CH2-OE2 3.41Å; W718-E781 HydrophobicContact CZ2-CB 4.47Å; W718-E781 VanDerWaalsContact CZ2-CD 3.46Å; W718-E781 HydrophobicContact CZ2-CG 4.16Å; W718-E781 WeakPolarHBondContact CZ2-OE1 3.37Å
719	R	92.5	Very high	88.3	Confident	116 Å²	116	52.3 Å²	52.3	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-73.8	-47.5	-178.5	-66.9	-175.5	176.2	127.9	1	110.3	D717 C721 R722 D723 E781	D717-R719 VanDerWaalsContact C-N 3.32Å; D717-R719 PolarHBondContact O-N 2.91Å; D717-R719 WeakPolarHBondContact OD1-CB 3.31Å; D717-R719 PolarHBondContact OD1-N 3.15Å; R719-C721 VanDerWaalsContact C-N 3.31Å; R719-C721 PolarHBondContact O-N 3.24Å; R719-R722 WeakPolarHBondContact O-CB 3.34Å; R719-R722 PolarHBondContact O-N 3.28Å; R719-D723 WeakPolarHBondContact O-CB 3.45Å; R719-D723 PolarHBondContact O-N 2.98Å; R719-E781 IonicContact CZ-OE1 3.45Å; R719-E781 IonicContact NE-OE1 3.58Å; R719-E781 IonicContact NH2-OE1 3.8Å; R719-E781 PolarHBondContact NH2-OE1 3.33Å
720	A	90.2	Very high	87.8	Confident	27 Å²	27	52.4 Å²	52.4	22%	0.223	25%	0.254	C	S	.	.	H	α-helix	trans	-59.9	-42.7	172.6	0	0	0	0	0	111.5	A712 D717 D723 F724	A712-A720 HydrophobicContact CB-CB 3.95Å; D717-A720 HydrophobicContact CB-CB 4.29Å; D717-A720 PolarHBondContact OD1-N 3.27Å; D717-A720 WeakPolarHBondContact OD2-CB 3.47Å; A720-D723 PolarHBondContact O-N 3.02Å; A720-F724 HydrophobicContact CB-CE2 4.36Å; A720-F724 WeakPolarHBondContact O-CD2 3.34Å; A720-F724 PolarHBondContact O-N 3.19Å
721	C	90.2	Very high	87.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.7	-47.4	175.4	-175.3	0	0	0	0	112	A712 D717 R719 D723 F724 L725 V752	A712-C721 HydrophobicContact CB-CB 4.27Å; D717-C721 WeakPolarHBondContact O-CB 3.37Å; D717-C721 PolarHBondContact O-N 2.75Å; R719-C721 VanDerWaalsContact C-N 3.31Å; R719-C721 PolarHBondContact O-N 3.24Å; C721-D723 VanDerWaalsContact C-N 3.32Å; C721-D723 PolarHBondContact O-N 2.94Å; C721-F724 PolarHBondContact O-N 3.39Å; C721-L725 VanDerWaalsContact O-CG 3.3Å; C721-L725 WeakPolarHBondContact O-CG 3.42Å; C721-L725 PolarHBondContact O-N 3.31Å; C721-V752 HydrophobicContact CB-CG1 4.02Å
722	R	90	Very high	87.1	Confident	82 Å²	82	54.2 Å²	54.2	31%	0.309	27%	0.273	S	S	.	.	H	α-helix	trans	-57.8	-45.8	175.2	179.9	-161.1	67.9	-166.8	-2.5	111.3	W718 R719 F724 L725 I726 I749	W718-R722 VanDerWaalsContact O-CB 3.29Å; W718-R722 WeakPolarHBondContact O-CB 3.31Å; W718-R722 PolarHBondContact O-N 2.93Å; R719-R722 WeakPolarHBondContact O-CB 3.34Å; R719-R722 PolarHBondContact O-N 3.28Å; R722-F724 PolarHBondContact O-N 2.93Å; R722-L725 PolarHBondContact O-N 3.42Å; R722-I726 HydrophobicContact CG-CD1 3.83Å; R722-I726 HydrophobicContact CG-CG1 4.35Å; R722-I726 WeakPolarHBondContact O-CB 3.3Å; R722-I726 WeakPolarHBondContact O-CG1 3.46Å; R722-I726 PolarHBondContact O-N 2.7Å; R722-I749 HydrophobicContact CG-CG1 4.3Å
723	D	90.2	Very high	86.8	Confident	77 Å²	77	57.5 Å²	57.5	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-65.8	-40.8	-176.6	-65.6	-8.7	0	0	0	110.3	R719 A720 C721 L725 I726 N727	R719-D723 WeakPolarHBondContact O-CB 3.45Å; R719-D723 PolarHBondContact O-N 2.98Å; A720-D723 PolarHBondContact O-N 3.02Å; C721-D723 VanDerWaalsContact C-N 3.32Å; C721-D723 PolarHBondContact O-N 2.94Å; D723-L725 PolarHBondContact O-N 3.26Å; D723-I726 CarbonylContact O-C 3.6Å; D723-N727 PolarHBondContact O-N 3.25Å; D723-N727 PolarHBondContact O-ND2 2.68Å; D723-N727 PolarHBondContact O-OD1 2.92Å
724	F	89.4	Confident	86.6	Confident	65 Å²	65	57.5 Å²	57.5	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-39	172.3	-68.3	-53.8	0	0	0	113.3	P699 H705 A708 A709 A712 A720 C721 R722	P699-F724 HydrophobicContact CG-CD1 3.92Å; P699-F724 HydrophobicContact CG-CE1 4.18Å; H705-F724 PolarHBondContact CD2-O 3.41Å; H705-F724 VanDerWaalsContact CD2-O 3.29Å; A708-F724 HydrophobicContact CB-CD1 4.13Å; A708-F724 HydrophobicContact CB-CD2 4.2Å; A708-F724 HydrophobicContact CB-CE1 4.27Å; A708-F724 HydrophobicContact CB-CE2 4.35Å; A708-F724 HydrophobicContact CB-CG 4.11Å; A708-F724 HydrophobicContact CB-CZ 4.39Å; A709-F724 HydrophobicContact CB-CB 4.02Å; A712-F724 HydrophobicContact CB-CD2 4.28Å; A712-F724 HydrophobicContact CB-CE2 4.25Å; A720-F724 HydrophobicContact CB-CE2 4.36Å; A720-F724 WeakPolarHBondContact O-CD2 3.34Å; A720-F724 PolarHBondContact O-N 3.19Å; C721-F724 PolarHBondContact O-N 3.39Å; R722-F724 PolarHBondContact O-N 2.93Å
725	L	86.9	Confident	86.6	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-75.5	-35.2	-179.4	-67.6	175.9	0	0	0	113.4	L657 M660 V706 A709 C721 R722 D723 M730 W735 I748 V752	L657-L725 HydrophobicContact CD1-CD1 4.25Å; L657-L725 HydrophobicContact CD1-CD2 3.94Å; M660-L725 HydrophobicContact CE-CD1 4.17Å; V706-L725 HydrophobicContact CG2-CD2 4.49Å; A709-L725 HydrophobicContact CB-CD2 3.86Å; A709-L725 HydrophobicContact CB-CG 3.92Å; C721-L725 VanDerWaalsContact O-CG 3.3Å; C721-L725 WeakPolarHBondContact O-CG 3.42Å; C721-L725 PolarHBondContact O-N 3.31Å; R722-L725 PolarHBondContact O-N 3.42Å; D723-L725 PolarHBondContact O-N 3.26Å; L725-M730 HydrophobicContact CD2-CE 3.95Å; L725-M730 WeakPolarHBondContact O-CB 3.46Å; L725-M730 WeakPolarHBondContact O-CG 3.41Å; L725-W735 PolarHBondContact O-NE1 3.04Å; L725-I748 HydrophobicContact CD1-CG2 4.09Å; L725-V752 HydrophobicContact CD1-CG2 3.67Å
726	I	86.2	Confident	86.6	Confident	46 Å²	46	54.3 Å²	54.3	24%	0.236	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	53.5	-174.2	-47.3	-179.5	0	0	0	109.7	R722 D723 I749	R722-I726 HydrophobicContact CG-CD1 3.83Å; R722-I726 HydrophobicContact CG-CG1 4.35Å; R722-I726 WeakPolarHBondContact O-CB 3.3Å; R722-I726 WeakPolarHBondContact O-CG1 3.46Å; R722-I726 PolarHBondContact O-N 2.7Å; D723-I726 CarbonylContact O-C 3.6Å; I726-I749 HydrophobicContact CD1-CD1 3.58Å; I726-I749 HydrophobicContact CD1-CG1 3.53Å
727	N	85.1	Confident	86.6	Confident	54 Å²	54	58.1 Å²	58.1	29%	0.289	28%	0.284	S	S	.	.			trans	-87.6	154.3	170.9	-85.4	-31	0	0	0	111.6	D723 K729 M730 N731	D723-N727 PolarHBondContact O-N 3.25Å; D723-N727 PolarHBondContact O-ND2 2.68Å; D723-N727 PolarHBondContact O-OD1 2.92Å; N727-K729 PolarHBondContact O-N 3.36Å; N727-M730 PolarHBondContact O-N 2.64Å; N727-N731 WeakPolarHBondContact O-CB 3.37Å; N727-N731 PolarHBondContact O-N 3.22Å; N727-N731 PolarHBondContact O-ND2 3.16Å
728	K	82.6	Confident	86.3	Confident	194 Å²	194	55.6 Å²	55.6	84%	0.843	27%	0.269	S	S	*	.	H	α-helix	trans	-52	-39.2	172.9	-68.7	-176.8	179.8	179.2	0	112	S732	K728-S732 PolarHBondContact O-N 3.01Å
729	K	83.8	Confident	85.5	Confident	99 Å²	99	60.1 Å²	60.1	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-48.7	176.1	-66.5	-174.4	179.4	-178.6	0	111.9	E700 N727 S732 K733	E700-K729 IonicContact OE1-NZ 3.92Å; E700-K729 PolarHBondContact OE1-NZ 3.39Å; N727-K729 PolarHBondContact O-N 3.36Å; K729-S732 PolarHBondContact O-N 3.44Å; K729-K733 WeakPolarHBondContact O-CG 3.4Å; K729-K733 PolarHBondContact O-N 3.06Å; K729-K733 VanDerWaalsContact O-N 3.09Å
730	M	81.3	Confident	84.8	Confident	2 Å²	2	57 Å²	57	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-68.3	-37.4	179.7	-159.3	102	92.6	0	0	112.1	H705 V706 L725 N727 S732 K733 V734 W735	H705-M730 HydrophobicContact CB-CE 3.38Å; H705-M730 HydrophobicContact CB-SD 3.87Å; V706-M730 HydrophobicContact CG2-CE 4.45Å; L725-M730 HydrophobicContact CD2-CE 3.95Å; L725-M730 WeakPolarHBondContact O-CB 3.46Å; L725-M730 WeakPolarHBondContact O-CG 3.41Å; N727-M730 PolarHBondContact O-N 2.64Å; M730-S732 PolarHBondContact O-N 2.93Å; M730-K733 PolarHBondContact O-N 3.15Å; M730-V734 PolarHBondContact O-N 3.34Å; M730-W735 PolarHBondContact O-N 3.34Å
731	N	84.1	Confident	84.4	Confident	27 Å²	27	57.3 Å²	57.3	14%	0.144	28%	0.284	C	S	.	.	H	α-helix	trans	-58.4	-48.2	173.8	-75.3	-37	0	0	0	111.1	N727 K733 W735 N736 K745	N727-N731 WeakPolarHBondContact O-CB 3.37Å; N727-N731 PolarHBondContact O-N 3.22Å; N727-N731 PolarHBondContact O-ND2 3.16Å; N731-K733 PolarHBondContact O-N 2.71Å; N731-W735 PolarHBondContact O-N 3.16Å; N731-W735 VanDerWaalsContact OD1-CD1 3.22Å; N731-N736 VanDerWaalsContact O-CB 3.23Å; N731-N736 WeakPolarHBondContact O-CB 3.3Å; N731-N736 PolarHBondContact O-N 2.94Å; N731-N736 PolarHBondContact O-ND2 3.16Å; N731-N736 PolarHBondContact O-OD1 3.32Å; N731-K745 WeakPolarHBondContact OD1-CE 3.18Å
732	S	79.7	Confident	84.2	Confident	83 Å²	83	62.2 Å²	62.2	58%	0.58	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-37.2	178.8	-170.3	0	0	0	0	113.4	K728 K729 M730	K728-S732 PolarHBondContact O-N 3.01Å; K729-S732 PolarHBondContact O-N 3.44Å; M730-S732 PolarHBondContact O-N 2.93Å
733	K	83.7	Confident	84	Confident	81 Å²	81	64 Å²	64	35%	0.352	31%	0.313	S	S	.	.	H	α-helix	trans	-83.1	-38.3	-174.6	-72.2	-175.3	177.9	-177.3	0	113.7	E700 T702 K729 M730 N731 L737	E700-K733 PolarHBondContact O-NZ 3.26Å; T702-K733 HydrophobicContact CG2-CB 4.23Å; T702-K733 HydrophobicContact CG2-CD 3.91Å; K729-K733 WeakPolarHBondContact O-CG 3.4Å; K729-K733 PolarHBondContact O-N 3.06Å; K729-K733 VanDerWaalsContact O-N 3.09Å; M730-K733 PolarHBondContact O-N 3.15Å; N731-K733 PolarHBondContact O-N 2.71Å; K733-L737 WeakPolarHBondContact O-CD1 3.28Å
734	V	85.5	Confident	83.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-57.4	-169.2	-177.5	0	0	0	0	111.1	L650 C653 T702 M730 N736 L737 F738	L650-V734 HydrophobicContact CB-CG1 4.32Å; L650-V734 HydrophobicContact CD1-CG1 4.06Å; L650-V734 WeakPolarHBondContact CD1-O 3.23Å; L650-V734 HydrophobicContact CG-CG1 4.07Å; C653-V734 HydrophobicContact CB-CG1 4.31Å; C653-V734 HydrophobicContact CB-CG2 4.07Å; T702-V734 HydrophobicContact CG2-CG2 3.94Å; M730-V734 PolarHBondContact O-N 3.34Å; V734-N736 PolarHBondContact O-N 3.05Å; V734-L737 WeakPolarHBondContact O-CB 3.35Å; V734-L737 PolarHBondContact O-N 2.97Å; V734-F738 HydrophobicContact CG1-CE2 4.34Å
735	W	86.5	Confident	83.9	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.008	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-72.6	-30.6	-165.6	-51.5	124	0	0	0	114.3	F591 L657 L725 M730 N731 L737 F738 S741 V744 I748	F591-W735 HydrophobicContact CE1-CH2 4.46Å; F591-W735 HydrophobicContact CE1-CZ3 4.05Å; F591-W735 HydrophobicContact CZ-CH2 4.39Å; F591-W735 HydrophobicContact CZ-CZ3 4.42Å; L657-W735 HydrophobicContact CD1-CH2 4.12Å; L657-W735 HydrophobicContact CD1-CZ2 4.23Å; L725-W735 PolarHBondContact O-NE1 3.04Å; M730-W735 PolarHBondContact O-N 3.34Å; N731-W735 PolarHBondContact O-N 3.16Å; N731-W735 VanDerWaalsContact OD1-CD1 3.22Å; W735-L737 PolarHBondContact O-N 3.49Å; W735-F738 HydrophobicContact CE3-CD2 4.02Å; W735-F738 AromaticContact CE3-CE2 3.83Å; W735-F738 HydrophobicContact CE3-CE2 3.83Å; W735-F738 HydrophobicContact CZ3-CD2 4.49Å; W735-F738 AromaticContact CZ3-CE2 3.9Å; W735-F738 HydrophobicContact CZ3-CE2 3.9Å; W735-F738 PolarHBondContact O-N 3.43Å; W735-S741 VanDerWaalsContact O-CB 3.25Å; W735-S741 WeakPolarHBondContact O-CB 3.33Å; W735-V744 HydrophobicContact CE3-CG1 4.1Å; W735-V744 HydrophobicContact CZ3-CG1 4Å; W735-I748 HydrophobicContact CE3-CD1 4.05Å; W735-I748 HydrophobicContact CH2-CD1 3.21Å; W735-I748 HydrophobicContact CZ2-CD1 3.69Å; W735-I748 HydrophobicContact CZ3-CD1 3.41Å; W735-I748 VanDerWaalsContact CZ3-CD1 3.41Å
736	N	85.9	Confident	84	Confident	98 Å²	98	64 Å²	64	52%	0.524	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-72.8	-12.2	176.7	-68.5	-5.5	0	0	0	113.1	N731 V734 F738	N731-N736 VanDerWaalsContact O-CB 3.23Å; N731-N736 WeakPolarHBondContact O-CB 3.3Å; N731-N736 PolarHBondContact O-N 2.94Å; N731-N736 PolarHBondContact O-ND2 3.16Å; N731-N736 PolarHBondContact O-OD1 3.32Å; V734-N736 PolarHBondContact O-N 3.05Å; N736-F738 VanDerWaalsContact C-N 3.33Å
737	L	84.9	Confident	84.1	Confident	87 Å²	87	63 Å²	63	46%	0.455	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-78.8	-20.2	175.9	-58.5	178.1	0	0	0	112.2	N647 L650 K733 V734 W735	N647-L737 HydrophobicContact CB-CD1 4.06Å; N647-L737 WeakPolarHBondContact ND2-CD1 3.22Å; L650-L737 HydrophobicContact CB-CD1 4.43Å; L650-L737 HydrophobicContact CD1-CB 3.79Å; L650-L737 HydrophobicContact CD1-CD1 3.95Å; L650-L737 HydrophobicContact CD1-CG 4.46Å; K733-L737 WeakPolarHBondContact O-CD1 3.28Å; V734-L737 WeakPolarHBondContact O-CB 3.35Å; V734-L737 PolarHBondContact O-N 2.97Å; W735-L737 PolarHBondContact O-N 3.49Å
738	F	82.1	Confident	84.4	Confident	17 Å²	17	60.6 Å²	60.6	8%	0.075	29%	0.293	C	S	.	.	S	Bend	trans	-80.3	137.1	171.7	-66.9	-72.9	0	0	0	110.1	R592 L650 V654 V734 W735 N736 N740	R592-F738 HydrophobicContact CG-CD1 4.4Å; R592-F738 HydrophobicContact CG-CE1 4.33Å; L650-F738 HydrophobicContact CD1-CD2 4.15Å; L650-F738 HydrophobicContact CD1-CE1 4.29Å; L650-F738 HydrophobicContact CD1-CE2 3.62Å; L650-F738 HydrophobicContact CD1-CZ 3.71Å; L650-F738 HydrophobicContact CD2-CE1 4.36Å; L650-F738 HydrophobicContact CD2-CZ 3.94Å; L650-F738 HydrophobicContact CG-CE2 4.17Å; L650-F738 HydrophobicContact CG-CZ 3.96Å; V654-F738 HydrophobicContact CG2-CZ 4.14Å; V734-F738 HydrophobicContact CG1-CE2 4.34Å; W735-F738 HydrophobicContact CE3-CD2 4.02Å; W735-F738 AromaticContact CE3-CE2 3.83Å; W735-F738 HydrophobicContact CE3-CE2 3.83Å; W735-F738 HydrophobicContact CZ3-CD2 4.49Å; W735-F738 AromaticContact CZ3-CE2 3.9Å; W735-F738 HydrophobicContact CZ3-CE2 3.9Å; W735-F738 PolarHBondContact O-N 3.43Å; N736-F738 VanDerWaalsContact C-N 3.33Å; F738-N740 VanDerWaalsContact C-N 3.34Å; F738-N740 PolarHBondContact O-N 3.21Å
739	Q	74.8	Confident	84.8	Confident	103 Å²	103	53.4 Å²	53.4	48%	0.481	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-43.4	176.1	-60.5	83.8	1.5	0	0	110.9	F492 S741	F492-Q739 HydrophobicContact CB-CG 4.46Å; F492-Q739 HydrophobicContact CD1-CB 4.28Å; F492-Q739 HydrophobicContact CD1-CG 3.69Å; F492-Q739 HydrophobicContact CD2-CG 4.22Å; F492-Q739 HydrophobicContact CE1-CB 3.84Å; F492-Q739 HydrophobicContact CE1-CG 3.8Å; F492-Q739 HydrophobicContact CE2-CB 4.38Å; F492-Q739 HydrophobicContact CE2-CG 4.34Å; F492-Q739 HydrophobicContact CG-CG 3.88Å; F492-Q739 HydrophobicContact CZ-CB 3.87Å; F492-Q739 HydrophobicContact CZ-CG 4.1Å; Q739-S741 PolarHBondContact O-N 2.7Å
740	N	78	Confident	85.2	Confident	52 Å²	52	55.6 Å²	55.6	28%	0.278	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	56.3	178.7	-67.6	-23.3	0	0	0	111.7	D550 F738 E742 R743 V744	D550-N740 PolarHBondContact OD2-ND2 2.89Å; F738-N740 VanDerWaalsContact C-N 3.34Å; F738-N740 PolarHBondContact O-N 3.21Å; N740-E742 VanDerWaalsContact C-N 3.26Å; N740-E742 PolarHBondContact O-N 3.41Å; N740-R743 HydrophobicContact CB-CB 4.39Å; N740-R743 PolarHBondContact O-N 2.76Å; N740-V744 WeakPolarHBondContact O-CG2 3.3Å; N740-V744 PolarHBondContact O-N 3.32Å
741	S	81.9	Confident	85.6	Confident	33 Å²	33	57 Å²	57	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-57	-36.7	-173.5	69.7	0	0	0	0	113.6	W735 Q739 K745	W735-S741 VanDerWaalsContact O-CB 3.25Å; W735-S741 WeakPolarHBondContact O-CB 3.33Å; Q739-S741 PolarHBondContact O-N 2.7Å; S741-K745 VanDerWaalsContact O-CG 3.23Å; S741-K745 WeakPolarHBondContact O-CG 3.33Å; S741-K745 PolarHBondContact O-N 3.4Å
742	E	84.7	Confident	86	Confident	102 Å²	102	55.8 Å²	55.8	48%	0.477	27%	0.269	S	S	.	.	H	α-helix	trans	-72.4	-43.7	-176.2	-170.8	54.8	-150.9	0	0	112.7	N740 V744 K745 Q746	N740-E742 VanDerWaalsContact C-N 3.26Å; N740-E742 PolarHBondContact O-N 3.41Å; E742-V744 VanDerWaalsContact C-N 3.29Å; E742-V744 PolarHBondContact O-N 3.44Å; E742-K745 PolarHBondContact O-N 2.74Å; E742-Q746 WeakPolarHBondContact O-CG 3.47Å; E742-Q746 PolarHBondContact O-N 3.09Å; E742-Q746 PolarHBondContact OE1-NE2 2.92Å; E742-Q746 VanDerWaalsContact OE1-NE2 3.1Å
743	R	87.4	Confident	86.6	Confident	119 Å²	119	53 Å²	53	45%	0.449	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-42.4	176	-179.8	176.4	170.9	166.2	-0.5	111.3	N740 Q746 M747	N740-R743 HydrophobicContact CB-CB 4.39Å; N740-R743 PolarHBondContact O-N 2.76Å; R743-Q746 PolarHBondContact O-N 3.49Å; R743-M747 WeakPolarHBondContact O-CB 3.19Å; R743-M747 PolarHBondContact O-N 3.45Å
744	V	87.3	Confident	87	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-42.6	178.3	177.1	0	0	0	0	110.9	F591 R592 W735 N740 E742 M747 I748	F591-V744 HydrophobicContact CE1-CG1 3.84Å; R592-V744 HydrophobicContact CG-CG2 3.94Å; W735-V744 HydrophobicContact CE3-CG1 4.1Å; W735-V744 HydrophobicContact CZ3-CG1 4Å; N740-V744 WeakPolarHBondContact O-CG2 3.3Å; N740-V744 PolarHBondContact O-N 3.32Å; E742-V744 VanDerWaalsContact C-N 3.29Å; E742-V744 PolarHBondContact O-N 3.44Å; V744-M747 HydrophobicContact CG1-CE 4.26Å; V744-M747 PolarHBondContact O-N 3.11Å; V744-I748 HydrophobicContact CG1-CD1 3.83Å; V744-I748 HydrophobicContact CG1-CG1 4.47Å; V744-I748 VanDerWaalsContact O-CG1 3.27Å; V744-I748 WeakPolarHBondContact O-CG1 3.29Å; V744-I748 PolarHBondContact O-N 3.28Å
745	K	88.9	Confident	87.2	Confident	30 Å²	30	51.3 Å²	51.3	13%	0.13	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175.5	-73.1	168.2	-170	174	0	111.9	N731 S741 E742 M747 I748 I749	N731-K745 WeakPolarHBondContact OD1-CE 3.18Å; S741-K745 VanDerWaalsContact O-CG 3.23Å; S741-K745 WeakPolarHBondContact O-CG 3.33Å; S741-K745 PolarHBondContact O-N 3.4Å; E742-K745 PolarHBondContact O-N 2.74Å; K745-M747 VanDerWaalsContact C-N 3.34Å; K745-M747 PolarHBondContact O-N 3.27Å; K745-I748 PolarHBondContact O-N 3.48Å; K745-I749 VanDerWaalsContact O-CG1 3.24Å; K745-I749 WeakPolarHBondContact O-CG1 3.42Å; K745-I749 PolarHBondContact O-N 3.46Å
746	Q	89.1	Confident	87.4	Confident	113 Å²	113	51.2 Å²	51.2	53%	0.528	24%	0.239	S	C	.	.	H	α-helix	trans	-63	-41.2	178.1	-69.8	176.3	7.3	0	0	111.9	E742 R743 I749 R750	E742-Q746 WeakPolarHBondContact O-CG 3.47Å; E742-Q746 PolarHBondContact O-N 3.09Å; E742-Q746 PolarHBondContact OE1-NE2 2.92Å; E742-Q746 VanDerWaalsContact OE1-NE2 3.1Å; R743-Q746 PolarHBondContact O-N 3.49Å; Q746-I749 PolarHBondContact O-N 2.83Å; Q746-R750 WeakPolarHBondContact O-CB 3.32Å; Q746-R750 PolarHBondContact O-N 2.79Å
747	M	89.5	Confident	87.6	Confident	24 Å²	24	46.6 Å²	46.6	12%	0.118	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-45.9	174.3	178.7	-83.3	-64.8	0	0	111.5	F591 R743 V744 K745 R750 H751	F591-M747 HydrophobicContact CD1-CE 4.29Å; F591-M747 HydrophobicContact CD2-CE 4.36Å; F591-M747 HydrophobicContact CE1-CE 4Å; F591-M747 HydrophobicContact CE2-CE 4.07Å; F591-M747 HydrophobicContact CG-CE 4.47Å; F591-M747 HydrophobicContact CZ-CE 3.9Å; F591-M747 WeakPolarHBondContact O-CE 3.47Å; R743-M747 WeakPolarHBondContact O-CB 3.19Å; R743-M747 PolarHBondContact O-N 3.45Å; V744-M747 HydrophobicContact CG1-CE 4.26Å; V744-M747 PolarHBondContact O-N 3.11Å; K745-M747 VanDerWaalsContact C-N 3.34Å; K745-M747 PolarHBondContact O-N 3.27Å; M747-R750 PolarHBondContact O-N 2.82Å; M747-H751 PolarHBondContact O-CD2 3.04Å; M747-H751 VanDerWaalsContact O-CD2 3.26Å; M747-H751 PolarHBondContact O-N 3.42Å; M747-H751 PolarHBondContact SD-CD2 3.44Å
748	I	90.4	Very high	87.8	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-45.7	176.9	-66.6	162.6	0	0	0	110.8	F591 L657 L725 W735 V744 K745 R750 H751 V752	F591-I748 HydrophobicContact CE1-CD1 4.27Å; F591-I748 HydrophobicContact CZ-CD1 3.86Å; F591-I748 HydrophobicContact CZ-CG1 3.84Å; L657-I748 HydrophobicContact CD1-CD1 4.44Å; L657-I748 HydrophobicContact CD1-CG2 4.12Å; L725-I748 HydrophobicContact CD1-CG2 4.09Å; W735-I748 HydrophobicContact CE3-CD1 4.05Å; W735-I748 HydrophobicContact CH2-CD1 3.21Å; W735-I748 HydrophobicContact CZ2-CD1 3.69Å; W735-I748 HydrophobicContact CZ3-CD1 3.41Å; W735-I748 VanDerWaalsContact CZ3-CD1 3.41Å; V744-I748 HydrophobicContact CG1-CD1 3.83Å; V744-I748 HydrophobicContact CG1-CG1 4.47Å; V744-I748 VanDerWaalsContact O-CG1 3.27Å; V744-I748 WeakPolarHBondContact O-CG1 3.29Å; V744-I748 PolarHBondContact O-N 3.28Å; K745-I748 PolarHBondContact O-N 3.48Å; I748-R750 VanDerWaalsContact C-N 3.29Å; I748-R750 PolarHBondContact O-N 3.45Å; I748-H751 PolarHBondContact O-N 3.49Å; I748-V752 HydrophobicContact CG2-CG2 3.98Å; I748-V752 WeakPolarHBondContact O-CB 3.44Å; I748-V752 WeakPolarHBondContact O-CG2 3.4Å; I748-V752 PolarHBondContact O-N 3.36Å
749	I	92.1	Very high	88.1	Confident	44 Å²	44	43.9 Å²	43.9	23%	0.226	20%	0.199	C	C	.	.	H	α-helix	trans	-58.6	-45	178.2	-68	164.4	0	0	0	110.2	R722 I726 K745 Q746 V752 K753	R722-I749 HydrophobicContact CG-CG1 4.3Å; I726-I749 HydrophobicContact CD1-CD1 3.58Å; I726-I749 HydrophobicContact CD1-CG1 3.53Å; K745-I749 VanDerWaalsContact O-CG1 3.24Å; K745-I749 WeakPolarHBondContact O-CG1 3.42Å; K745-I749 PolarHBondContact O-N 3.46Å; Q746-I749 PolarHBondContact O-N 2.83Å; I749-V752 PolarHBondContact O-N 2.86Å; I749-K753 HydrophobicContact CG2-CD 4.14Å; I749-K753 HydrophobicContact CG2-CG 4.46Å; I749-K753 WeakPolarHBondContact O-CB 3.36Å; I749-K753 VanDerWaalsContact O-CG 3.3Å; I749-K753 WeakPolarHBondContact O-CG 3.43Å; I749-K753 PolarHBondContact O-N 3.31Å
750	R	91.6	Very high	88.8	Confident	145 Å²	145	40.6 Å²	40.6	55%	0.547	18%	0.183	S	C	.	.	H	α-helix	trans	-58.9	-52.2	177.3	179.5	179.8	173.1	163.6	1	111.1	Q746 M747 I748 V752 K753 E754	Q746-R750 WeakPolarHBondContact O-CB 3.32Å; Q746-R750 PolarHBondContact O-N 2.79Å; M747-R750 PolarHBondContact O-N 2.82Å; I748-R750 VanDerWaalsContact C-N 3.29Å; I748-R750 PolarHBondContact O-N 3.45Å; R750-V752 PolarHBondContact O-N 3.27Å; R750-K753 WeakPolarHBondContact O-CB 3.49Å; R750-K753 PolarHBondContact O-N 3.47Å; R750-E754 WeakPolarHBondContact CG-OE1 3.31Å; R750-E754 IonicContact CZ-OE1 3.97Å; R750-E754 IonicContact NE-OE1 3.66Å; R750-E754 PolarHBondContact NE-OE1 3.46Å; R750-E754 IonicContact NH2-OE1 3.57Å; R750-E754 WeakPolarHBondContact O-CG 3.18Å; R750-E754 PolarHBondContact O-N 3.36Å
751	H	90.3	Very high	89.3	Confident	30 Å²	30	38.4 Å²	38.4	14%	0.139	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-37.6	179.9	-77.8	-69.8	0	0	0	113.2	G594 I596 L661 M747 I748 K753 E754 E755	G594-H751 PolarHBondContact O-NE2 3.49Å; I596-H751 HydrophobicContact CD1-CB 3.99Å; I596-H751 WeakPolarHBondContact CD1-ND1 3.44Å; L661-H751 HydrophobicContact CD1-CB 4.05Å; M747-H751 PolarHBondContact O-CD2 3.04Å; M747-H751 VanDerWaalsContact O-CD2 3.26Å; M747-H751 PolarHBondContact O-N 3.42Å; M747-H751 PolarHBondContact SD-CD2 3.44Å; I748-H751 PolarHBondContact O-N 3.49Å; H751-K753 VanDerWaalsContact C-N 3.32Å; H751-K753 PolarHBondContact O-N 2.95Å; H751-E754 IonicContact ND1-OE2 3.77Å; H751-E754 PolarHBondContact O-N 3.45Å; H751-E755 WeakPolarHBondContact O-CB 3.17Å; H751-E755 WeakPolarHBondContact O-CG 3.48Å; H751-E755 PolarHBondContact O-N 2.87Å
752	V	92.3	Very high	89.4	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-42.5	174.3	169.7	0	0	0	0	110.4	L661 L713 W718 C721 L725 I748 I749 R750 S756	L661-V752 HydrophobicContact CD2-CG2 4.05Å; L713-V752 HydrophobicContact CD1-CG1 4.45Å; W718-V752 HydrophobicContact CB-CG1 4.46Å; C721-V752 HydrophobicContact CB-CG1 4.02Å; L725-V752 HydrophobicContact CD1-CG2 3.67Å; I748-V752 HydrophobicContact CG2-CG2 3.98Å; I748-V752 WeakPolarHBondContact O-CB 3.44Å; I748-V752 WeakPolarHBondContact O-CG2 3.4Å; I748-V752 PolarHBondContact O-N 3.36Å; I749-V752 PolarHBondContact O-N 2.86Å; R750-V752 PolarHBondContact O-N 3.27Å; V752-S756 WeakPolarHBondContact O-CB 3.37Å; V752-S756 PolarHBondContact O-N 2.84Å; V752-S756 PolarHBondContact O-OG 2.75Å
753	K	92.1	Very high	89.3	Confident	25 Å²	25	35.2 Å²	35.2	11%	0.109	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-49.6	173.9	-75.1	177	168.3	-165.5	0	111.4	W718 I749 R750 H751 S756 L757 F780 E781 L782	W718-K753 HydrophobicContact CD2-CG 4.1Å; W718-K753 HydrophobicContact CE3-CG 3.91Å; W718-K753 HydrophobicContact CG-CG 4.5Å; W718-K753 VanDerWaalsContact CH2-CE 3.47Å; W718-K753 HydrophobicContact CZ3-CD 4.5Å; W718-K753 HydrophobicContact CZ3-CG 4.35Å; I749-K753 HydrophobicContact CG2-CD 4.14Å; I749-K753 HydrophobicContact CG2-CG 4.46Å; I749-K753 WeakPolarHBondContact O-CB 3.36Å; I749-K753 VanDerWaalsContact O-CG 3.3Å; I749-K753 WeakPolarHBondContact O-CG 3.43Å; I749-K753 PolarHBondContact O-N 3.31Å; R750-K753 WeakPolarHBondContact O-CB 3.49Å; R750-K753 PolarHBondContact O-N 3.47Å; H751-K753 VanDerWaalsContact C-N 3.32Å; H751-K753 PolarHBondContact O-N 2.95Å; K753-S756 WeakPolarHBondContact CA-OG 3.38Å; K753-S756 PolarHBondContact O-N 2.94Å; K753-S756 PolarHBondContact O-OG 2.95Å; K753-L757 WeakPolarHBondContact O-CB 3.19Å; K753-L757 PolarHBondContact O-N 2.87Å; K753-F780 WeakPolarHBondContact CD-O 3.49Å; K753-F780 WeakPolarHBondContact CE-O 3.36Å; K753-E781 VanDerWaalsContact NZ-CB 3.32Å; K753-E781 PolarHBondContact NZ-O 3.24Å; K753-E781 IonicContact NZ-OE2 2.84Å; K753-E781 PolarHBondContact NZ-OE2 2.87Å; K753-L782 HydrophobicContact CB-CD1 4.14Å; K753-L782 HydrophobicContact CB-CD2 3.96Å; K753-L782 HydrophobicContact CB-CG 4.16Å; K753-L782 HydrophobicContact CD-CD2 4.08Å; K753-L782 HydrophobicContact CD-CG 4.43Å
754	E	90.7	Very high	89.3	Confident	28 Å²	28	33.2 Å²	33.2	13%	0.131	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-47.8	179.3	-66.7	178.7	-174.5	0	0	112	R750 H751 L757 K758 I790	R750-E754 WeakPolarHBondContact CG-OE1 3.31Å; R750-E754 IonicContact CZ-OE1 3.97Å; R750-E754 IonicContact NE-OE1 3.66Å; R750-E754 PolarHBondContact NE-OE1 3.46Å; R750-E754 IonicContact NH2-OE1 3.57Å; R750-E754 WeakPolarHBondContact O-CG 3.18Å; R750-E754 PolarHBondContact O-N 3.36Å; H751-E754 IonicContact ND1-OE2 3.77Å; H751-E754 PolarHBondContact O-N 3.45Å; E754-L757 PolarHBondContact O-N 3.28Å; E754-K758 WeakPolarHBondContact O-CG 3.32Å; E754-K758 PolarHBondContact O-N 3.09Å; E754-I790 HydrophobicContact CB-CD1 4.04Å; E754-I790 HydrophobicContact CG-CD1 3.72Å
755	E	89.7	Confident	89.1	Confident	18 Å²	18	33.3 Å²	33.3	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-75.2	-31.1	-179.1	-61.3	-53.3	155.4	0	0	113.1	L661 P665 H751 L757 K758 T759	L661-E755 HydrophobicContact CB-CG 4.3Å; L661-E755 HydrophobicContact CD2-CB 4.2Å; L661-E755 HydrophobicContact CD2-CG 4.01Å; P665-E755 HydrophobicContact CG-CB 4.06Å; P665-E755 HydrophobicContact CG-CG 4.38Å; P665-E755 WeakPolarHBondContact CG-OE2 3.43Å; H751-E755 WeakPolarHBondContact O-CB 3.17Å; H751-E755 WeakPolarHBondContact O-CG 3.48Å; H751-E755 PolarHBondContact O-N 2.87Å; E755-L757 VanDerWaalsContact C-N 3.33Å; E755-K758 PolarHBondContact O-N 3.3Å; E755-K758 IonicContact OE1-NZ 2.95Å; E755-K758 PolarHBondContact OE1-NZ 3.08Å; E755-K758 WeakPolarHBondContact OE2-CD 3.45Å; E755-K758 WeakPolarHBondContact OE2-CE 3.45Å; E755-K758 IonicContact OE2-NZ 3.88Å; E755-K758 PolarHBondContact OE2-NZ 3.46Å; E755-T759 WeakPolarHBondContact O-CB 3.43Å; E755-T759 PolarHBondContact O-N 3.32Å; E755-T759 PolarHBondContact O-OG1 3.39Å
756	S	91.6	Very high	88.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-39	172.7	68.3	0	0	0	0	111.7	L713 W718 V752 K753 T759 Y760 F780	L713-S756 VanDerWaalsContact CD1-CB 3.46Å; W718-S756 VanDerWaalsContact CB-OG 3.31Å; W718-S756 WeakPolarHBondContact CB-OG 3.45Å; V752-S756 WeakPolarHBondContact O-CB 3.37Å; V752-S756 PolarHBondContact O-N 2.84Å; V752-S756 PolarHBondContact O-OG 2.75Å; K753-S756 WeakPolarHBondContact CA-OG 3.38Å; K753-S756 PolarHBondContact O-N 2.94Å; K753-S756 PolarHBondContact O-OG 2.95Å; S756-T759 PolarHBondContact O-N 2.94Å; S756-Y760 WeakPolarHBondContact O-CB 3.3Å; S756-Y760 PolarHBondContact O-N 2.96Å; S756-F780 WeakPolarHBondContact OG-CD1 3.45Å; S756-F780 WeakPolarHBondContact OG-CE1 3.38Å
757	L	90.4	Very high	88.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-47.6	174.8	172.3	69.8	0	0	0	110.5	K753 E754 E755 T759 Y760 L761 L776 F780 L782 V787 I790	K753-L757 WeakPolarHBondContact O-CB 3.19Å; K753-L757 PolarHBondContact O-N 2.87Å; E754-L757 PolarHBondContact O-N 3.28Å; E755-L757 VanDerWaalsContact C-N 3.33Å; L757-T759 PolarHBondContact O-N 3.05Å; L757-Y760 PolarHBondContact O-N 3.06Å; L757-L761 HydrophobicContact CD1-CD1 4Å; L757-L761 HydrophobicContact CD1-CG 4.18Å; L757-L761 HydrophobicContact CG-CD1 4.06Å; L757-L761 WeakPolarHBondContact O-CB 3.5Å; L757-L761 VanDerWaalsContact O-CG 3.29Å; L757-L761 WeakPolarHBondContact O-CG 3.48Å; L757-L761 PolarHBondContact O-N 3.36Å; L757-L776 HydrophobicContact CD1-CB 4.38Å; L757-L776 HydrophobicContact CD1-CD1 4.48Å; L757-L776 HydrophobicContact CD1-CD2 3.94Å; L757-F780 HydrophobicContact CB-CD1 4.32Å; L757-F780 HydrophobicContact CB-CD2 4.33Å; L757-F780 HydrophobicContact CB-CE1 4.42Å; L757-F780 HydrophobicContact CB-CE2 4.42Å; L757-F780 HydrophobicContact CB-CG 4.28Å; L757-F780 HydrophobicContact CB-CZ 4.48Å; L757-F780 HydrophobicContact CD1-CD2 3.58Å; L757-F780 HydrophobicContact CD1-CE2 3.6Å; L757-F780 HydrophobicContact CD1-CG 4.31Å; L757-F780 HydrophobicContact CD1-CZ 4.35Å; L757-L782 HydrophobicContact CD2-CD1 4.31Å; L757-V787 HydrophobicContact CD2-CB 4.47Å; L757-V787 HydrophobicContact CD2-CG1 4.04Å; L757-V787 HydrophobicContact CD2-CG2 4.32Å; L757-I790 HydrophobicContact CD2-CB 4.42Å; L757-I790 HydrophobicContact CD2-CD1 4.21Å; L757-I790 HydrophobicContact CD2-CG2 4.17Å
758	K	89.1	Confident	88.4	Confident	47 Å²	47	37.8 Å²	37.8	20%	0.204	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-47.4	177.8	-59.4	-171.9	-156.9	149.1	0	111.5	E754 E755 Y760 L761 V762 I790 M794	E754-K758 WeakPolarHBondContact O-CG 3.32Å; E754-K758 PolarHBondContact O-N 3.09Å; E755-K758 PolarHBondContact O-N 3.3Å; E755-K758 IonicContact OE1-NZ 2.95Å; E755-K758 PolarHBondContact OE1-NZ 3.08Å; E755-K758 WeakPolarHBondContact OE2-CD 3.45Å; E755-K758 WeakPolarHBondContact OE2-CE 3.45Å; E755-K758 IonicContact OE2-NZ 3.88Å; E755-K758 PolarHBondContact OE2-NZ 3.46Å; K758-Y760 VanDerWaalsContact C-N 3.33Å; K758-Y760 PolarHBondContact O-N 2.84Å; K758-L761 PolarHBondContact O-N 3Å; K758-V762 VanDerWaalsContact O-CG2 3.3Å; K758-V762 WeakPolarHBondContact O-CG2 3.26Å; K758-V762 PolarHBondContact O-N 3.01Å; K758-I790 HydrophobicContact CD-CG2 4.3Å; K758-I790 HydrophobicContact CG-CG2 3.74Å; K758-M794 HydrophobicContact CB-CE 4.01Å; K758-M794 HydrophobicContact CB-SD 3.83Å; K758-M794 HydrophobicContact CD-CG 4.4Å; K758-M794 HydrophobicContact CD-SD 4.26Å; K758-M794 HydrophobicContact CG-CE 4.42Å; K758-M794 HydrophobicContact CG-CG 4.35Å; K758-M794 HydrophobicContact CG-SD 3.6Å
759	T	88.6	Confident	88.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-42	-180	-50.9	0	0	0	0	111	I664 A668 L713 E755 S756 L757 V762 T763	I664-T759 HydrophobicContact CG2-CG2 3.89Å; A668-T759 HydrophobicContact CB-CG2 3.91Å; L713-T759 WeakPolarHBondContact O-CG2 3.48Å; E755-T759 WeakPolarHBondContact O-CB 3.43Å; E755-T759 PolarHBondContact O-N 3.32Å; E755-T759 PolarHBondContact O-OG1 3.39Å; S756-T759 PolarHBondContact O-N 2.94Å; L757-T759 PolarHBondContact O-N 3.05Å; T759-V762 PolarHBondContact O-N 3.15Å; T759-T763 VanDerWaalsContact O-CB 3.29Å; T759-T763 WeakPolarHBondContact O-CB 3.41Å; T759-T763 PolarHBondContact O-N 3.39Å; T759-T763 PolarHBondContact O-OG1 3.11Å
760	Y	89.5	Confident	87.9	Confident	35 Å²	35	44.1 Å²	44.1	14%	0.137	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-48.9	176.5	-178.4	-90.8	0	0	0	112.1	S756 L757 K758 V762 T763 Y764 Y768 F780	S756-Y760 WeakPolarHBondContact O-CB 3.3Å; S756-Y760 PolarHBondContact O-N 2.96Å; L757-Y760 PolarHBondContact O-N 3.06Å; K758-Y760 VanDerWaalsContact C-N 3.33Å; K758-Y760 PolarHBondContact O-N 2.84Å; Y760-V762 VanDerWaalsContact C-N 3.3Å; Y760-V762 PolarHBondContact O-N 3.16Å; Y760-T763 PolarHBondContact O-N 3.42Å; Y760-Y764 HydrophobicContact CD1-CD2 4.32Å; Y760-Y764 AromaticContact CD2-CD2 3.37Å; Y760-Y764 HydrophobicContact CD2-CD2 3.37Å; Y760-Y764 AromaticContact CD2-CE2 3.43Å; Y760-Y764 HydrophobicContact CD2-CE2 3.43Å; Y760-Y764 VanDerWaalsContact CD2-CE2 3.43Å; Y760-Y764 HydrophobicContact CE1-CD2 4.33Å; Y760-Y764 AromaticContact CE2-CD2 3.39Å; Y760-Y764 HydrophobicContact CE2-CD2 3.39Å; Y760-Y764 AromaticContact CE2-CE2 3.51Å; Y760-Y764 HydrophobicContact CE2-CE2 3.51Å; Y760-Y764 HydrophobicContact CE2-CG 4.37Å; Y760-Y764 AromaticContact CG-CD2 3.86Å; Y760-Y764 HydrophobicContact CG-CD2 3.86Å; Y760-Y764 HydrophobicContact CG-CE2 4.29Å; Y760-Y764 AromaticContact CZ-CD2 3.89Å; Y760-Y764 VanDerWaalsContact O-CD2 3.31Å; Y760-Y764 WeakPolarHBondContact O-CD2 3.4Å; Y760-Y764 PolarHBondContact O-N 3.34Å; Y760-Y768 HydrophobicContact CE1-CE2 4.07Å; Y760-Y768 PolarHBondContact OH-OH 3.28Å; Y760-F780 HydrophobicContact CD1-CE2 4.2Å; Y760-F780 HydrophobicContact CD1-CZ 4.13Å; Y760-F780 HydrophobicContact CD2-CZ 4.23Å; Y760-F780 HydrophobicContact CG-CE2 4.31Å; Y760-F780 AromaticContact CG-CZ 3.77Å; Y760-F780 HydrophobicContact CG-CZ 3.77Å
761	L	87.3	Confident	87.8	Confident	5 Å²	5	38 Å²	38	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-39.8	-179.6	-73.3	173.1	0	0	0	112.2	L757 K758 S765 I771 L776 V791 M794 F800	L757-L761 HydrophobicContact CD1-CD1 4Å; L757-L761 HydrophobicContact CD1-CG 4.18Å; L757-L761 HydrophobicContact CG-CD1 4.06Å; L757-L761 WeakPolarHBondContact O-CB 3.5Å; L757-L761 VanDerWaalsContact O-CG 3.29Å; L757-L761 WeakPolarHBondContact O-CG 3.48Å; L757-L761 PolarHBondContact O-N 3.36Å; K758-L761 PolarHBondContact O-N 3Å; L761-S765 WeakPolarHBondContact O-CA 3.41Å; L761-S765 VanDerWaalsContact O-CB 3.25Å; L761-S765 WeakPolarHBondContact O-CB 3.33Å; L761-S765 PolarHBondContact O-N 3.31Å; L761-I771 HydrophobicContact CD2-CD1 3.85Å; L761-L776 HydrophobicContact CD2-CD1 4.07Å; L761-L776 HydrophobicContact CD2-CD2 4.17Å; L761-V791 HydrophobicContact CD1-CG2 3.69Å; L761-M794 HydrophobicContact CB-CE 4.33Å; L761-M794 HydrophobicContact CD1-SD 4.23Å; L761-F800 HydrophobicContact CB-CE2 4.35Å; L761-F800 HydrophobicContact CB-CZ 4.5Å; L761-F800 WeakPolarHBondContact O-CE2 3.48Å
762	V	84.2	Confident	87.7	Confident	20 Å²	20	38.8 Å²	38.8	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-74.3	-39.3	178.9	171.4	0	0	0	0	112.3	A668 S669 K758 T759 Y760 S765 M794	A668-V762 VanDerWaalsContact C-CG1 3.46Å; A668-V762 HydrophobicContact CB-CG1 4.04Å; A668-V762 WeakPolarHBondContact O-CG1 3.37Å; S669-V762 VanDerWaalsContact CA-CG1 3.4Å; K758-V762 VanDerWaalsContact O-CG2 3.3Å; K758-V762 WeakPolarHBondContact O-CG2 3.26Å; K758-V762 PolarHBondContact O-N 3.01Å; T759-V762 PolarHBondContact O-N 3.15Å; Y760-V762 VanDerWaalsContact C-N 3.3Å; Y760-V762 PolarHBondContact O-N 3.16Å; V762-S765 PolarHBondContact O-OG 2.97Å; V762-M794 HydrophobicContact CG2-CE 3.51Å
763	T	84.3	Confident	87.5	Confident	49 Å²	49	39.2 Å²	39.2	30%	0.301	21%	0.213	S	C	.	.	H	α-helix	trans	-72.8	-38.2	-177.4	-53.9	0	0	0	0	111.5	T759 Y760	T759-T763 VanDerWaalsContact O-CB 3.29Å; T759-T763 WeakPolarHBondContact O-CB 3.41Å; T759-T763 PolarHBondContact O-N 3.39Å; T759-T763 PolarHBondContact O-OG1 3.11Å; Y760-T763 PolarHBondContact O-N 3.42Å
764	Y	86	Confident	87.3	Confident	76 Å²	76	43 Å²	43	30%	0.298	24%	0.235	S	C	.	.	S	Bend	trans	-102.9	10.4	-177.5	-58.1	-70.1	0	0	0	113.6	V715 Y760 C766 V767 Y768	V715-Y764 WeakPolarHBondContact O-CE2 3.23Å; V715-Y764 PolarHBondContact O-OH 3.3Å; Y760-Y764 HydrophobicContact CD1-CD2 4.32Å; Y760-Y764 AromaticContact CD2-CD2 3.37Å; Y760-Y764 HydrophobicContact CD2-CD2 3.37Å; Y760-Y764 AromaticContact CD2-CE2 3.43Å; Y760-Y764 HydrophobicContact CD2-CE2 3.43Å; Y760-Y764 VanDerWaalsContact CD2-CE2 3.43Å; Y760-Y764 HydrophobicContact CE1-CD2 4.33Å; Y760-Y764 AromaticContact CE2-CD2 3.39Å; Y760-Y764 HydrophobicContact CE2-CD2 3.39Å; Y760-Y764 AromaticContact CE2-CE2 3.51Å; Y760-Y764 HydrophobicContact CE2-CE2 3.51Å; Y760-Y764 HydrophobicContact CE2-CG 4.37Å; Y760-Y764 AromaticContact CG-CD2 3.86Å; Y760-Y764 HydrophobicContact CG-CD2 3.86Å; Y760-Y764 HydrophobicContact CG-CE2 4.29Å; Y760-Y764 AromaticContact CZ-CD2 3.89Å; Y760-Y764 VanDerWaalsContact O-CD2 3.31Å; Y760-Y764 WeakPolarHBondContact O-CD2 3.4Å; Y760-Y764 PolarHBondContact O-N 3.34Å; Y764-C766 PolarHBondContact O-N 3.43Å; Y764-V767 PolarHBondContact O-N 3.03Å; Y764-V767 VanDerWaalsContact O-N 3.08Å; Y764-Y768 VanDerWaalsContact O-CD2 3.26Å; Y764-Y768 WeakPolarHBondContact O-CD2 3.26Å
765	S	83.5	Confident	87.2	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.035	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-38.5	175.9	55.3	0	0	0	0	112.2	L761 V762 V767 E817	L761-S765 WeakPolarHBondContact O-CA 3.41Å; L761-S765 VanDerWaalsContact O-CB 3.25Å; L761-S765 WeakPolarHBondContact O-CB 3.33Å; L761-S765 PolarHBondContact O-N 3.31Å; V762-S765 PolarHBondContact O-OG 2.97Å; S765-V767 PolarHBondContact O-N 2.98Å; S765-E817 WeakPolarHBondContact CB-OE1 2.95Å; S765-E817 PolarHBondContact OG-OE1 3.42Å; S765-E817 PolarHBondContact OG-OE2 2.89Å
766	C	79.3	Confident	87.2	Confident	81 Å²	81	48 Å²	48	55%	0.547	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.3	-178.3	63.6	0	0	0	0	114.9	Y764 E817	Y764-C766 PolarHBondContact O-N 3.43Å; C766-E817 WeakPolarHBondContact CB-OE2 3.46Å
767	V	86	Confident	87	Confident	103 Å²	103	48.5 Å²	48.5	62%	0.624	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-22.5	-175.2	-173.1	0	0	0	0	112.3	Y764 S765	Y764-V767 PolarHBondContact O-N 3.03Å; Y764-V767 VanDerWaalsContact O-N 3.08Å; S765-V767 PolarHBondContact O-N 2.98Å
768	Y	87	Confident	87	Confident	77 Å²	77	52.4 Å²	52.4	30%	0.302	28%	0.284	S	S	.	.			trans	-101.6	132.9	-176.4	-69.4	-67.3	0	0	0	111.5	Y760 Y764 I771 I813	Y760-Y768 HydrophobicContact CE1-CE2 4.07Å; Y760-Y768 PolarHBondContact OH-OH 3.28Å; Y764-Y768 VanDerWaalsContact O-CD2 3.26Å; Y764-Y768 WeakPolarHBondContact O-CD2 3.26Å; Y768-I771 HydrophobicContact CD1-CD1 4.45Å; Y768-I771 HydrophobicContact CD1-CG1 4.18Å; Y768-I771 HydrophobicContact CD2-CD1 3.79Å; Y768-I771 HydrophobicContact CD2-CG1 4.39Å; Y768-I771 HydrophobicContact CG-CD1 3.74Å; Y768-I771 HydrophobicContact CG-CG1 3.85Å; Y768-I813 WeakPolarHBondContact O-CD1 3.3Å
769	D	85.7	Confident	87	Confident	106 Å²	106	53.3 Å²	53.3	57%	0.567	29%	0.289	S	S	*	.	S	Bend	trans	-91	-40.9	171.7	-61.7	0.1	0	0	0	110.7	I813 H815	D769-I813 PolarHBondContact O-N 2.75Å; D769-H815 IonicContact OD1-CE1 3.82Å; D769-H815 PolarHBondContact OD1-CE1 2.76Å; D769-H815 IonicContact OD1-NE2 2.75Å; D769-H815 PolarHBondContact OD1-NE2 3.42Å
770	S	87.9	Confident	87	Confident	75 Å²	75	53.6 Å²	53.6	52%	0.524	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	141.4	176.8	59	0	0	0	0	111.3	V811	S770-V811 CarbonylContact C-O 3.6Å; S770-V811 VanDerWaalsContact CA-O 3.29Å; S770-V811 WeakPolarHBondContact CA-O 3.44Å
771	I	88	Confident	87	Confident	15 Å²	15	56.6 Å²	56.6	8%	0.077	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.8	-178.2	-51.9	176.2	0	0	0	109.4	L761 Y768 L776 C810 V811 I813	L761-I771 HydrophobicContact CD2-CD1 3.85Å; Y768-I771 HydrophobicContact CD1-CD1 4.45Å; Y768-I771 HydrophobicContact CD1-CG1 4.18Å; Y768-I771 HydrophobicContact CD2-CD1 3.79Å; Y768-I771 HydrophobicContact CD2-CG1 4.39Å; Y768-I771 HydrophobicContact CG-CD1 3.74Å; Y768-I771 HydrophobicContact CG-CG1 3.85Å; I771-L776 HydrophobicContact CG2-CD1 3.67Å; I771-L776 HydrophobicContact CG2-CD2 3.87Å; I771-L776 HydrophobicContact CG2-CG 3.56Å; I771-C810 CarbonylContact O-C 3.6Å; I771-C810 WeakPolarHBondContact O-CA 3.29Å; I771-V811 PolarHBondContact N-O 3.35Å; I771-V811 PolarHBondContact O-N 2.91Å; I771-I813 HydrophobicContact CD1-CD1 3.93Å; I771-I813 HydrophobicContact CG1-CD1 4.28Å
772	S	89.6	Confident	87.1	Confident	48 Å²	48	57.5 Å²	57.5	34%	0.336	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	137.3	174.5	62.3	0	0	0	0	111.9	D774 R775 L776	S772-D774 VanDerWaalsContact C-N 3.29Å; S772-D774 PolarHBondContact O-N 2.99Å; S772-R775 PolarHBondContact O-N 3.49Å; S772-R775 WeakPolarHBondContact OG-CB 3.47Å; S772-L776 PolarHBondContact O-N 3.36Å
773	L	86.7	Confident	87.3	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-36.8	177.6	-72.6	-178.5	0	0	0	112.3	R775 L776 G777 V787 H788 F804 A809 V811	L773-R775 VanDerWaalsContact C-N 3.28Å; L773-R775 PolarHBondContact O-N 3.07Å; L773-L776 PolarHBondContact O-N 2.93Å; L773-G777 PolarHBondContact O-N 3.23Å; L773-V787 HydrophobicContact CD2-CG1 3.91Å; L773-H788 HydrophobicContact CD1-CB 4.13Å; L773-F804 HydrophobicContact CD1-CE2 3.37Å; L773-F804 HydrophobicContact CD1-CZ 3.55Å; L773-F804 HydrophobicContact CD2-CE2 4.38Å; L773-F804 HydrophobicContact CG-CE2 3.9Å; L773-F804 HydrophobicContact CG-CZ 4.48Å; L773-A809 WeakPolarHBondContact CG-O 3.47Å; L773-A809 PolarHBondContact N-O 3.34Å; L773-V811 HydrophobicContact CD2-CG2 3.86Å; L773-V811 HydrophobicContact CG-CG2 4.44Å
774	D	87.9	Confident	87.4	Confident	105 Å²	105	62.1 Å²	62.1	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-64.3	-35.9	179.9	-66.4	-25.7	0	0	0	111.9	S772 S778	S772-D774 VanDerWaalsContact C-N 3.29Å; S772-D774 PolarHBondContact O-N 2.99Å; D774-S778 WeakPolarHBondContact O-CB 3.22Å; D774-S778 PolarHBondContact O-N 3.28Å; D774-S778 PolarHBondContact O-OG 3.4Å
775	R	89.1	Confident	87.6	Confident	150 Å²	150	67.4 Å²	67.4	57%	0.566	35%	0.352	S	S	*	.	H	α-helix	trans	-70.1	-41.3	176.2	-172.4	62.4	177.2	-176.8	3	111	S772 L773 S778 M779	S772-R775 PolarHBondContact O-N 3.49Å; S772-R775 WeakPolarHBondContact OG-CB 3.47Å; L773-R775 VanDerWaalsContact C-N 3.28Å; L773-R775 PolarHBondContact O-N 3.07Å; R775-S778 PolarHBondContact O-N 3.38Å; R775-M779 HydrophobicContact CG-CE 3.87Å; R775-M779 HydrophobicContact CG-CG 4.43Å; R775-M779 HydrophobicContact CG-SD 4.26Å; R775-M779 WeakPolarHBondContact O-CB 3.19Å; R775-M779 VanDerWaalsContact O-CG 3.26Å; R775-M779 WeakPolarHBondContact O-CG 3.5Å; R775-M779 PolarHBondContact O-N 2.82Å
776	L	88.8	Confident	87.9	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-62.5	-43.9	173.7	-70.9	173.5	0	0	0	111.8	L757 L761 I771 S772 L773 S778 M779 F780 V787	L757-L776 HydrophobicContact CD1-CB 4.38Å; L757-L776 HydrophobicContact CD1-CD1 4.48Å; L757-L776 HydrophobicContact CD1-CD2 3.94Å; L761-L776 HydrophobicContact CD2-CD1 4.07Å; L761-L776 HydrophobicContact CD2-CD2 4.17Å; I771-L776 HydrophobicContact CG2-CD1 3.67Å; I771-L776 HydrophobicContact CG2-CD2 3.87Å; I771-L776 HydrophobicContact CG2-CG 3.56Å; S772-L776 PolarHBondContact O-N 3.36Å; L773-L776 PolarHBondContact O-N 2.93Å; L776-S778 VanDerWaalsContact C-N 3.3Å; L776-S778 PolarHBondContact O-N 3.39Å; L776-M779 PolarHBondContact O-N 3.14Å; L776-F780 HydrophobicContact CD2-CE2 4.3Å; L776-F780 WeakPolarHBondContact O-CD2 3.44Å; L776-F780 PolarHBondContact O-N 3.4Å; L776-V787 HydrophobicContact CB-CG1 3.87Å; L776-V787 HydrophobicContact CD1-CG1 4.19Å
777	G	89.2	Confident	88.4	Confident	9 Å²	9	64.8 Å²	64.8	9%	0.093	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-41.6	175	0	0	0	0	0	112.2	L773 E781 L782	L773-G777 PolarHBondContact O-N 3.23Å; G777-E781 VanDerWaalsContact O-CA 3.23Å; G777-E781 WeakPolarHBondContact O-CA 3.3Å; G777-E781 PolarHBondContact O-N 3.45Å; G777-L782 WeakPolarHBondContact CA-O 3.39Å; G777-L782 PolarHBondContact O-N 3.23Å
778	S	90.1	Very high	88.6	Confident	82 Å²	82	63.3 Å²	63.3	57%	0.573	32%	0.32	S	S	*	.	H	α-helix	trans	-70.8	-38.7	176.8	-57.9	0	0	0	0	113.3	D774 R775 L776	D774-S778 WeakPolarHBondContact O-CB 3.22Å; D774-S778 PolarHBondContact O-N 3.28Å; D774-S778 PolarHBondContact O-OG 3.4Å; R775-S778 PolarHBondContact O-N 3.38Å; L776-S778 VanDerWaalsContact C-N 3.3Å; L776-S778 PolarHBondContact O-N 3.39Å
779	M	89.5	Confident	88.9	Confident	66 Å²	66	62.9 Å²	62.9	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-42.6	-179.1	-78.2	180	170.9	0	0	112.5	W718 R775 L776	W718-M779 PolarHBondContact NE1-O 3.26Å; R775-M779 HydrophobicContact CG-CE 3.87Å; R775-M779 HydrophobicContact CG-CG 4.43Å; R775-M779 HydrophobicContact CG-SD 4.26Å; R775-M779 WeakPolarHBondContact O-CB 3.19Å; R775-M779 VanDerWaalsContact O-CG 3.26Å; R775-M779 WeakPolarHBondContact O-CG 3.5Å; R775-M779 PolarHBondContact O-N 2.82Å; L776-M779 PolarHBondContact O-N 3.14Å
780	F	87.9	Confident	89.1	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-97	-2.3	-177.7	-68.6	-83.1	0	0	0	113.6	W718 K753 S756 L757 Y760 L776 L782	W718-F780 AromaticContact CD1-CD1 3.44Å; W718-F780 VanDerWaalsContact CD1-CD1 3.44Å; W718-F780 AromaticContact CD1-CE1 3.84Å; W718-F780 HydrophobicContact CG-CD1 4.18Å; K753-F780 WeakPolarHBondContact CD-O 3.49Å; K753-F780 WeakPolarHBondContact CE-O 3.36Å; S756-F780 WeakPolarHBondContact OG-CD1 3.45Å; S756-F780 WeakPolarHBondContact OG-CE1 3.38Å; L757-F780 HydrophobicContact CB-CD1 4.32Å; L757-F780 HydrophobicContact CB-CD2 4.33Å; L757-F780 HydrophobicContact CB-CE1 4.42Å; L757-F780 HydrophobicContact CB-CE2 4.42Å; L757-F780 HydrophobicContact CB-CG 4.28Å; L757-F780 HydrophobicContact CB-CZ 4.48Å; L757-F780 HydrophobicContact CD1-CD2 3.58Å; L757-F780 HydrophobicContact CD1-CE2 3.6Å; L757-F780 HydrophobicContact CD1-CG 4.31Å; L757-F780 HydrophobicContact CD1-CZ 4.35Å; Y760-F780 HydrophobicContact CD1-CE2 4.2Å; Y760-F780 HydrophobicContact CD1-CZ 4.13Å; Y760-F780 HydrophobicContact CD2-CZ 4.23Å; Y760-F780 HydrophobicContact CG-CE2 4.31Å; Y760-F780 AromaticContact CG-CZ 3.77Å; Y760-F780 HydrophobicContact CG-CZ 3.77Å; L776-F780 HydrophobicContact CD2-CE2 4.3Å; L776-F780 WeakPolarHBondContact O-CD2 3.44Å; L776-F780 PolarHBondContact O-N 3.4Å; F780-L782 VanDerWaalsContact C-N 3.31Å; F780-L782 HydrophobicContact CB-CD1 4Å; F780-L782 HydrophobicContact CB-CG 4.16Å; F780-L782 PolarHBondContact O-N 2.64Å
781	E	89.6	Confident	89.2	Confident	98 Å²	98	55.1 Å²	55.1	46%	0.458	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	52.2	-176	-61.9	162.7	-158.5	0	0	110.7	W718 R719 K753 G777	W718-E781 VanDerWaalsContact CH2-OE2 3.24Å; W718-E781 WeakPolarHBondContact CH2-OE2 3.41Å; W718-E781 HydrophobicContact CZ2-CB 4.47Å; W718-E781 VanDerWaalsContact CZ2-CD 3.46Å; W718-E781 HydrophobicContact CZ2-CG 4.16Å; W718-E781 WeakPolarHBondContact CZ2-OE1 3.37Å; R719-E781 IonicContact CZ-OE1 3.45Å; R719-E781 IonicContact NE-OE1 3.58Å; R719-E781 IonicContact NH2-OE1 3.8Å; R719-E781 PolarHBondContact NH2-OE1 3.33Å; K753-E781 VanDerWaalsContact NZ-CB 3.32Å; K753-E781 PolarHBondContact NZ-O 3.24Å; K753-E781 IonicContact NZ-OE2 2.84Å; K753-E781 PolarHBondContact NZ-OE2 2.87Å; G777-E781 VanDerWaalsContact O-CA 3.23Å; G777-E781 WeakPolarHBondContact O-CA 3.3Å; G777-E781 PolarHBondContact O-N 3.45Å
782	L	88.4	Confident	89.2	Confident	25 Å²	25	56 Å²	56	13%	0.131	29%	0.286	C	S	.	.			trans	-120.3	149.7	178.4	-73.3	174.7	0	0	0	109.6	K753 L757 G777 F780 V787	K753-L782 HydrophobicContact CB-CD1 4.14Å; K753-L782 HydrophobicContact CB-CD2 3.96Å; K753-L782 HydrophobicContact CB-CG 4.16Å; K753-L782 HydrophobicContact CD-CD2 4.08Å; K753-L782 HydrophobicContact CD-CG 4.43Å; L757-L782 HydrophobicContact CD2-CD1 4.31Å; G777-L782 WeakPolarHBondContact CA-O 3.39Å; G777-L782 PolarHBondContact O-N 3.23Å; F780-L782 VanDerWaalsContact C-N 3.31Å; F780-L782 HydrophobicContact CB-CD1 4Å; F780-L782 HydrophobicContact CB-CG 4.16Å; F780-L782 PolarHBondContact O-N 2.64Å; L782-V787 HydrophobicContact CB-CG2 3.79Å; L782-V787 HydrophobicContact CD1-CG2 4.42Å
783	E	89.8	Confident	89.2	Confident	103 Å²	103	59.8 Å²	59.8	48%	0.481	30%	0.296	S	S	.	.			trans	-64.5	134	174.9	-172.9	-176.5	174.1	0	0	109.6	R785 T786 V787	E783-R785 HydrophobicContact CG-CB 4.27Å; E783-R785 PolarHBondContact O-N 3.04Å; E783-R785 WeakPolarHBondContact OE1-CD 3.29Å; E783-R785 IonicContact OE1-NE 3.05Å; E783-T786 HydrophobicContact CB-CG2 4.2Å; E783-T786 PolarHBondContact N-OG1 2.91Å; E783-T786 WeakPolarHBondContact O-CA 3.47Å; E783-T786 WeakPolarHBondContact O-CB 3.28Å; E783-T786 PolarHBondContact O-N 3.2Å; E783-T786 PolarHBondContact O-OG1 3.43Å; E783-V787 PolarHBondContact O-N 2.95Å; E783-V787 VanDerWaalsContact O-N 3.14Å
784	P	85.4	Confident	89.1	Confident	63 Å²	63	59.6 Å²	59.6	41%	0.409	30%	0.295	S	S	.	.	H	α-helix	trans	-57	-28.7	-176.6	21.6	-33.8	0	0	0	113	V787 H788	P784-V787 PolarHBondContact O-N 3.39Å; P784-H788 WeakPolarHBondContact O-CB 3.3Å; P784-H788 PolarHBondContact O-N 3.49Å
785	R	89.8	Confident	89.1	Confident	186 Å²	186	57 Å²	57	70%	0.702	28%	0.281	S	S	*	.	H	α-helix	trans	-64.2	-40.1	173.3	-63.7	-174.5	179.1	169.2	-4.3	113.1	E783 T789	E783-R785 HydrophobicContact CG-CB 4.27Å; E783-R785 PolarHBondContact O-N 3.04Å; E783-R785 WeakPolarHBondContact OE1-CD 3.29Å; E783-R785 IonicContact OE1-NE 3.05Å; R785-T789 WeakPolarHBondContact O-CB 3.36Å; R785-T789 PolarHBondContact O-N 3.22Å; R785-T789 PolarHBondContact O-OG1 3.49Å
786	T	90.4	Very high	89.2	Confident	32 Å²	32	56.8 Å²	56.8	20%	0.196	29%	0.289	C	S	.	.	H	α-helix	trans	-68.7	-41.9	176.1	62.7	0	0	0	0	110.8	E783 T789 I790	E783-T786 HydrophobicContact CB-CG2 4.2Å; E783-T786 PolarHBondContact N-OG1 2.91Å; E783-T786 WeakPolarHBondContact O-CA 3.47Å; E783-T786 WeakPolarHBondContact O-CB 3.28Å; E783-T786 PolarHBondContact O-N 3.2Å; E783-T786 PolarHBondContact O-OG1 3.43Å; T786-T789 PolarHBondContact O-N 3.02Å; T786-I790 WeakPolarHBondContact O-CD1 3.25Å; T786-I790 VanDerWaalsContact O-CG1 3.22Å; T786-I790 WeakPolarHBondContact O-CG1 3.16Å; T786-I790 PolarHBondContact O-N 2.53Å
787	V	91	Very high	89	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.8	-49.6	174.8	179.9	0	0	0	0	110.5	L757 L773 L776 L782 E783 P784 T789 I790 V791	L757-V787 HydrophobicContact CD2-CB 4.47Å; L757-V787 HydrophobicContact CD2-CG1 4.04Å; L757-V787 HydrophobicContact CD2-CG2 4.32Å; L773-V787 HydrophobicContact CD2-CG1 3.91Å; L776-V787 HydrophobicContact CB-CG1 3.87Å; L776-V787 HydrophobicContact CD1-CG1 4.19Å; L782-V787 HydrophobicContact CB-CG2 3.79Å; L782-V787 HydrophobicContact CD1-CG2 4.42Å; E783-V787 PolarHBondContact O-N 2.95Å; E783-V787 VanDerWaalsContact O-N 3.14Å; P784-V787 PolarHBondContact O-N 3.39Å; V787-T789 VanDerWaalsContact C-N 3.34Å; V787-T789 PolarHBondContact O-N 2.92Å; V787-I790 PolarHBondContact O-N 2.84Å; V787-V791 HydrophobicContact CG1-CG2 4.29Å; V787-V791 WeakPolarHBondContact O-CG2 3.34Å; V787-V791 PolarHBondContact O-N 3.5Å
788	H	90.1	Very high	88.5	Confident	72 Å²	72	64.8 Å²	64.8	33%	0.333	34%	0.34	S	S	.	.	H	α-helix	trans	-54.8	-49.3	175	177.6	-86.9	0	0	0	111.2	L773 P784 I790 V791 S792 F804	L773-H788 HydrophobicContact CD1-CB 4.13Å; P784-H788 WeakPolarHBondContact O-CB 3.3Å; P784-H788 PolarHBondContact O-N 3.49Å; H788-I790 VanDerWaalsContact C-N 3.32Å; H788-I790 PolarHBondContact O-N 3.38Å; H788-V791 PolarHBondContact O-N 3.12Å; H788-S792 PolarHBondContact CE1-OG 2.86Å; H788-S792 WeakPolarHBondContact O-CB 3.37Å; H788-S792 PolarHBondContact O-N 2.91Å; H788-S792 PolarHBondContact O-OG 3.08Å; H788-F804 AromaticContact CD2-CE1 3.97Å; H788-F804 AromaticContact CD2-CE2 3.95Å; H788-F804 AromaticContact CD2-CZ 3.68Å; H788-F804 AromaticContact NE2-CE1 3.86Å
789	T	91.9	Very high	87.8	Confident	68 Å²	68	63.8 Å²	63.8	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-40.3	179.1	-55.5	0	0	0	0	112.5	R785 T786 V787 K793	R785-T789 WeakPolarHBondContact O-CB 3.36Å; R785-T789 PolarHBondContact O-N 3.22Å; R785-T789 PolarHBondContact O-OG1 3.49Å; T786-T789 PolarHBondContact O-N 3.02Å; V787-T789 VanDerWaalsContact C-N 3.34Å; V787-T789 PolarHBondContact O-N 2.92Å; T789-K793 HydrophobicContact CG2-CD 4.46Å; T789-K793 WeakPolarHBondContact O-CB 3.42Å; T789-K793 VanDerWaalsContact O-CG 3.27Å; T789-K793 WeakPolarHBondContact O-CG 3.43Å; T789-K793 PolarHBondContact O-N 3.35Å; T789-K793 VanDerWaalsContact O-N 3.12Å
790	I	90.4	Very high	87.3	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.077	31%	0.314	C	S	.	.	H	α-helix	trans	-69.2	-48	179.9	-67.3	160.2	0	0	0	110.4	E754 L757 K758 T786 V787 H788 K793 M794	E754-I790 HydrophobicContact CB-CD1 4.04Å; E754-I790 HydrophobicContact CG-CD1 3.72Å; L757-I790 HydrophobicContact CD2-CB 4.42Å; L757-I790 HydrophobicContact CD2-CD1 4.21Å; L757-I790 HydrophobicContact CD2-CG2 4.17Å; K758-I790 HydrophobicContact CD-CG2 4.3Å; K758-I790 HydrophobicContact CG-CG2 3.74Å; T786-I790 WeakPolarHBondContact O-CD1 3.25Å; T786-I790 VanDerWaalsContact O-CG1 3.22Å; T786-I790 WeakPolarHBondContact O-CG1 3.16Å; T786-I790 PolarHBondContact O-N 2.53Å; V787-I790 PolarHBondContact O-N 2.84Å; H788-I790 VanDerWaalsContact C-N 3.32Å; H788-I790 PolarHBondContact O-N 3.38Å; I790-K793 WeakPolarHBondContact O-CB 3.15Å; I790-K793 PolarHBondContact O-N 3.2Å; I790-M794 HydrophobicContact CG2-SD 4.35Å; I790-M794 WeakPolarHBondContact O-CG 3.48Å; I790-M794 PolarHBondContact O-N 3.34Å
791	V	89.2	Confident	87	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-43.8	-180	177.3	0	0	0	0	110.9	L761 V787 H788 K793 M794 I795 V811	L761-V791 HydrophobicContact CD1-CG2 3.69Å; V787-V791 HydrophobicContact CG1-CG2 4.29Å; V787-V791 WeakPolarHBondContact O-CG2 3.34Å; V787-V791 PolarHBondContact O-N 3.5Å; H788-V791 PolarHBondContact O-N 3.12Å; V791-K793 VanDerWaalsContact C-N 3.28Å; V791-K793 PolarHBondContact O-N 3.02Å; V791-M794 WeakPolarHBondContact O-CB 3.5Å; V791-M794 PolarHBondContact O-N 2.92Å; V791-M794 VanDerWaalsContact O-N 3.12Å; V791-I795 HydrophobicContact CG1-CD1 3.91Å; V791-I795 HydrophobicContact CG1-CG1 4.44Å; V791-I795 WeakPolarHBondContact O-CG1 3.46Å; V791-I795 PolarHBondContact O-N 3.23Å; V791-V811 HydrophobicContact CG1-CG1 4.15Å; V791-V811 HydrophobicContact CG1-CG2 3.96Å
792	S	89	Confident	86.8	Confident	34 Å²	34	58.4 Å²	58.4	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-39.8	175	-57.6	0	0	0	0	111.9	H788 I795 I796	H788-S792 PolarHBondContact CE1-OG 2.86Å; H788-S792 WeakPolarHBondContact O-CB 3.37Å; H788-S792 PolarHBondContact O-N 2.91Å; H788-S792 PolarHBondContact O-OG 3.08Å; S792-I795 PolarHBondContact O-N 2.91Å; S792-I796 WeakPolarHBondContact O-CD1 3.36Å; S792-I796 VanDerWaalsContact O-CG1 3.26Å; S792-I796 WeakPolarHBondContact O-CG1 3.29Å; S792-I796 PolarHBondContact O-N 3.39Å
793	K	90	Very high	86.7	Confident	127 Å²	127	59.6 Å²	59.6	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-62.6	-43.8	174.5	-78	175.7	179.9	-179.6	0	111.8	T789 I790 V791 I795 I796 E797	T789-K793 HydrophobicContact CG2-CD 4.46Å; T789-K793 WeakPolarHBondContact O-CB 3.42Å; T789-K793 VanDerWaalsContact O-CG 3.27Å; T789-K793 WeakPolarHBondContact O-CG 3.43Å; T789-K793 PolarHBondContact O-N 3.35Å; T789-K793 VanDerWaalsContact O-N 3.12Å; I790-K793 WeakPolarHBondContact O-CB 3.15Å; I790-K793 PolarHBondContact O-N 3.2Å; V791-K793 VanDerWaalsContact C-N 3.28Å; V791-K793 PolarHBondContact O-N 3.02Å; K793-I795 VanDerWaalsContact C-N 3.32Å; K793-I795 PolarHBondContact O-N 3.33Å; K793-I796 PolarHBondContact O-N 3.18Å; K793-E797 WeakPolarHBondContact O-CB 3.33Å; K793-E797 WeakPolarHBondContact O-CG 3.37Å; K793-E797 PolarHBondContact O-N 3.12Å
794	M	84.9	Confident	86.6	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.03	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-37.4	177.4	-68	174.8	70.9	0	0	112.8	K758 L761 V762 I790 V791 G798 D799 F800	K758-M794 HydrophobicContact CB-CE 4.01Å; K758-M794 HydrophobicContact CB-SD 3.83Å; K758-M794 HydrophobicContact CD-CG 4.4Å; K758-M794 HydrophobicContact CD-SD 4.26Å; K758-M794 HydrophobicContact CG-CE 4.42Å; K758-M794 HydrophobicContact CG-CG 4.35Å; K758-M794 HydrophobicContact CG-SD 3.6Å; L761-M794 HydrophobicContact CB-CE 4.33Å; L761-M794 HydrophobicContact CD1-SD 4.23Å; V762-M794 HydrophobicContact CG2-CE 3.51Å; I790-M794 HydrophobicContact CG2-SD 4.35Å; I790-M794 WeakPolarHBondContact O-CG 3.48Å; I790-M794 PolarHBondContact O-N 3.34Å; V791-M794 WeakPolarHBondContact O-CB 3.5Å; V791-M794 PolarHBondContact O-N 2.92Å; V791-M794 VanDerWaalsContact O-N 3.12Å; M794-G798 PolarHBondContact O-N 2.93Å; M794-D799 PolarHBondContact O-N 3Å; M794-F800 HydrophobicContact CB-CB 4.06Å; M794-F800 HydrophobicContact CE-CB 4.15Å; M794-F800 PolarHBondContact O-N 2.87Å
795	I	87.7	Confident	86.7	Confident	51 Å²	51	57.4 Å²	57.4	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-67.5	-42.3	176.6	-65.6	167	0	0	0	110.5	V791 S792 K793 G798 F800 A802	V791-I795 HydrophobicContact CG1-CD1 3.91Å; V791-I795 HydrophobicContact CG1-CG1 4.44Å; V791-I795 WeakPolarHBondContact O-CG1 3.46Å; V791-I795 PolarHBondContact O-N 3.23Å; S792-I795 PolarHBondContact O-N 2.91Å; K793-I795 VanDerWaalsContact C-N 3.32Å; K793-I795 PolarHBondContact O-N 3.33Å; I795-G798 PolarHBondContact O-N 2.96Å; I795-F800 HydrophobicContact CG1-CD1 4.24Å; I795-A802 HydrophobicContact CD1-CB 4.26Å; I795-A802 HydrophobicContact CG1-CB 4.35Å; I795-A802 WeakPolarHBondContact CG2-O 3.4Å
796	I	90.1	Very high	86.2	Confident	145 Å²	145	56.3 Å²	56.3	74%	0.744	31%	0.306	S	S	*	.	H	α-helix	trans	-68.7	-39.8	178.6	-66.8	165.2	0	0	0	111.7	S792 K793 G798	S792-I796 WeakPolarHBondContact O-CD1 3.36Å; S792-I796 VanDerWaalsContact O-CG1 3.26Å; S792-I796 WeakPolarHBondContact O-CG1 3.29Å; S792-I796 PolarHBondContact O-N 3.39Å; K793-I796 PolarHBondContact O-N 3.18Å; I796-G798 PolarHBondContact O-N 2.8Å
797	E	84.6	Confident	85.8	Confident	120 Å²	120	60.2 Å²	60.2	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-66.8	-18.3	176.5	-73.4	176.2	169.3	0	0	112	K793 D799	K793-E797 WeakPolarHBondContact O-CB 3.33Å; K793-E797 WeakPolarHBondContact O-CG 3.37Å; K793-E797 PolarHBondContact O-N 3.12Å; E797-D799 VanDerWaalsContact C-N 3.35Å
798	G	78.3	Confident	85.1	Confident	59 Å²	59	63.6 Å²	63.6	61%	0.608	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	7.4	177.8	0	0	0	0	0	114.1	M794 I795 I796 F800	M794-G798 PolarHBondContact O-N 2.93Å; I795-G798 PolarHBondContact O-N 2.96Å; I796-G798 PolarHBondContact O-N 2.8Å; G798-F800 VanDerWaalsContact C-N 3.35Å
799	D	75.4	Confident	84.8	Confident	61 Å²	61	61.8 Å²	61.8	33%	0.326	35%	0.353	S	S	.	.	S	Bend	trans	-77.6	-21.6	-179.1	-77.2	-13.6	0	0	0	112.5	M794 E797	M794-D799 PolarHBondContact O-N 3Å; E797-D799 VanDerWaalsContact C-N 3.35Å
800	F	79.8	Confident	84.6	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.018	34%	0.342	C	S	.	.	S	Bend	trans	-131.8	108.7	-176.3	-174.3	-117.9	0	0	0	111.1	L761 M794 I795 G798 A802 V811 I813	L761-F800 HydrophobicContact CB-CE2 4.35Å; L761-F800 HydrophobicContact CB-CZ 4.5Å; L761-F800 WeakPolarHBondContact O-CE2 3.48Å; M794-F800 HydrophobicContact CB-CB 4.06Å; M794-F800 HydrophobicContact CE-CB 4.15Å; M794-F800 PolarHBondContact O-N 2.87Å; I795-F800 HydrophobicContact CG1-CD1 4.24Å; G798-F800 VanDerWaalsContact C-N 3.35Å; F800-A802 VanDerWaalsContact C-N 3.27Å; F800-A802 HydrophobicContact CD1-CB 3.46Å; F800-A802 VanDerWaalsContact CD1-CB 3.46Å; F800-A802 HydrophobicContact CE1-CB 3.21Å; F800-A802 HydrophobicContact CG-CB 4.41Å; F800-A802 HydrophobicContact CZ-CB 4Å; F800-A802 PolarHBondContact O-N 2.79Å; F800-V811 HydrophobicContact CE1-CG1 3.85Å; F800-I813 HydrophobicContact CE1-CG1 4.34Å; F800-I813 HydrophobicContact CE2-CD1 4.33Å; F800-I813 HydrophobicContact CE2-CG1 4.31Å; F800-I813 HydrophobicContact CZ-CD1 3.83Å; F800-I813 HydrophobicContact CZ-CG1 3.63Å
801	P	82.3	Confident	84.5	Confident	45 Å²	45	59.3 Å²	59.3	29%	0.292	34%	0.339	S	S	.	.			trans	-78.2	75.6	-176.5	32.8	-35.2	0	0	0	110.7	N814 E817	P801-N814 WeakPolarHBondContact O-CB 3.27Å; P801-N814 PolarHBondContact O-N 3.49Å; P801-E817 HydrophobicContact CG-CG 4.47Å
802	A	85.4	Confident	84.4	Confident	7 Å²	7	61.8 Å²	61.8	6%	0.058	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	158.7	176.7	0	0	0	0	0	111.9	I795 F800 V811 V812 I813	I795-A802 HydrophobicContact CD1-CB 4.26Å; I795-A802 HydrophobicContact CG1-CB 4.35Å; I795-A802 WeakPolarHBondContact CG2-O 3.4Å; F800-A802 VanDerWaalsContact C-N 3.27Å; F800-A802 HydrophobicContact CD1-CB 3.46Å; F800-A802 VanDerWaalsContact CD1-CB 3.46Å; F800-A802 HydrophobicContact CE1-CB 3.21Å; F800-A802 HydrophobicContact CG-CB 4.41Å; F800-A802 HydrophobicContact CZ-CB 4Å; F800-A802 PolarHBondContact O-N 2.79Å; A802-V811 HydrophobicContact CB-CG1 3.62Å; A802-V812 CarbonylContact C-O 3.56Å; A802-V812 WeakPolarHBondContact CA-O 3.46Å; A802-V812 WeakPolarHBondContact CB-O 3.44Å; A802-I813 HydrophobicContact CB-CG1 4.31Å
803	S	86.3	Confident	84.3	Confident	50 Å²	50	60.4 Å²	60.4	35%	0.35	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	152.4	171.1	56.3	0	0	0	0	109.9	V812	S803-V812 PolarHBondContact N-O 3.39Å; S803-V812 PolarHBondContact O-N 2.91Å; S803-V812 PolarHBondContact OG-O 3.26Å
804	F	86	Confident	83.8	Confident	65 Å²	65	57.7 Å²	57.7	29%	0.285	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127	178.5	-167.9	-110.1	0	0	0	109.9	L773 H788 E806 V811	L773-F804 HydrophobicContact CD1-CE2 3.37Å; L773-F804 HydrophobicContact CD1-CZ 3.55Å; L773-F804 HydrophobicContact CD2-CE2 4.38Å; L773-F804 HydrophobicContact CG-CE2 3.9Å; L773-F804 HydrophobicContact CG-CZ 4.48Å; H788-F804 AromaticContact CD2-CE1 3.97Å; H788-F804 AromaticContact CD2-CE2 3.95Å; H788-F804 AromaticContact CD2-CZ 3.68Å; H788-F804 AromaticContact NE2-CE1 3.86Å; F804-E806 HydrophobicContact CD1-CB 4.43Å; F804-E806 HydrophobicContact CD1-CG 3.69Å; F804-E806 HydrophobicContact CE1-CB 4.34Å; F804-E806 HydrophobicContact CE1-CG 3.92Å; F804-V811 HydrophobicContact CD2-CG2 4.13Å; F804-V811 HydrophobicContact CE2-CG2 4.37Å
805	D	87.6	Confident	83.3	Confident	56 Å²	56	62.9 Å²	62.9	30%	0.299	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	96.9	169.5	-175.1	40.6	0	0	0	109	P807 S808 A809 C810 V812	D805-P807 VanDerWaalsContact OD1-CD 3.27Å; D805-P807 WeakPolarHBondContact OD1-CD 3.4Å; D805-P807 WeakPolarHBondContact OD1-CG 3.47Å; D805-S808 PolarHBondContact O-N 3.17Å; D805-S808 WeakPolarHBondContact OD2-CB 3.25Å; D805-S808 PolarHBondContact OD2-OG 3.24Å; D805-A809 PolarHBondContact O-N 3.02Å; D805-A809 VanDerWaalsContact O-N 3.1Å; D805-C810 PolarHBondContact N-O 3.37Å; D805-C810 PolarHBondContact O-N 3.49Å; D805-V812 HydrophobicContact CB-CG2 4.26Å
806	E	79.6	Confident	82.6	Confident	163 Å²	163	65.9 Å²	65.9	76%	0.762	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-46.2	-178.6	-68.4	-176.1	170.6	0	0	114.9	F804 S808	F804-E806 HydrophobicContact CD1-CB 4.43Å; F804-E806 HydrophobicContact CD1-CG 3.69Å; F804-E806 HydrophobicContact CE1-CB 4.34Å; F804-E806 HydrophobicContact CE1-CG 3.92Å; E806-S808 PolarHBondContact O-N 2.83Å
807	P	81.6	Confident	81.5	Confident	114 Å²	114	62.5 Å²	62.5	74%	0.74	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-34	-177.6	24.4	-34.8	0	0	0	113.7	D805	D805-P807 VanDerWaalsContact OD1-CD 3.27Å; D805-P807 WeakPolarHBondContact OD1-CD 3.4Å; D805-P807 WeakPolarHBondContact OD1-CG 3.47Å
808	S	78	Confident	81	Confident	71 Å²	71	59.6 Å²	59.6	50%	0.497	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-5.6	-177.2	-48.1	0	0	0	0	113.5	D805 E806 C810	D805-S808 PolarHBondContact O-N 3.17Å; D805-S808 WeakPolarHBondContact OD2-CB 3.25Å; D805-S808 PolarHBondContact OD2-OG 3.24Å; E806-S808 PolarHBondContact O-N 2.83Å; S808-C810 PolarHBondContact O-N 3.1Å; S808-C810 PolarHBondContact O-SG 2.9Å; S808-C810 VanDerWaalsContact O-SG 3.33Å
809	A	83.2	Confident	81	Confident	33 Å²	33	64.5 Å²	64.5	27%	0.273	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	37.4	-169	0	0	0	0	0	112.4	L773 D805	L773-A809 WeakPolarHBondContact CG-O 3.47Å; L773-A809 PolarHBondContact N-O 3.34Å; D805-A809 PolarHBondContact O-N 3.02Å; D805-A809 VanDerWaalsContact O-N 3.1Å
810	C	87.2	Confident	81.3	Confident	29 Å²	29	71.4 Å²	71.4	20%	0.196	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.4	-178.4	-72.7	0	0	0	0	110.2	I771 D805 S808	I771-C810 CarbonylContact O-C 3.6Å; I771-C810 WeakPolarHBondContact O-CA 3.29Å; D805-C810 PolarHBondContact N-O 3.37Å; D805-C810 PolarHBondContact O-N 3.49Å; S808-C810 PolarHBondContact O-N 3.1Å; S808-C810 PolarHBondContact O-SG 2.9Å; S808-C810 VanDerWaalsContact O-SG 3.33Å
811	V	87.6	Confident	81.7	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.012	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	116.2	171	-177.7	0	0	0	0	106.9	S770 I771 L773 V791 F800 A802 F804	S770-V811 CarbonylContact C-O 3.6Å; S770-V811 VanDerWaalsContact CA-O 3.29Å; S770-V811 WeakPolarHBondContact CA-O 3.44Å; I771-V811 PolarHBondContact N-O 3.35Å; I771-V811 PolarHBondContact O-N 2.91Å; L773-V811 HydrophobicContact CD2-CG2 3.86Å; L773-V811 HydrophobicContact CG-CG2 4.44Å; V791-V811 HydrophobicContact CG1-CG1 4.15Å; V791-V811 HydrophobicContact CG1-CG2 3.96Å; F800-V811 HydrophobicContact CE1-CG1 3.85Å; A802-V811 HydrophobicContact CB-CG1 3.62Å; F804-V811 HydrophobicContact CD2-CG2 4.13Å; F804-V811 HydrophobicContact CE2-CG2 4.37Å
812	V	88.1	Confident	81.9	Confident	55 Å²	55	80.3 Å²	80.3	33%	0.333	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.1	178.3	-179.9	0	0	0	0	108.1	A802 S803 D805	A802-V812 CarbonylContact C-O 3.56Å; A802-V812 WeakPolarHBondContact CA-O 3.46Å; A802-V812 WeakPolarHBondContact CB-O 3.44Å; S803-V812 PolarHBondContact N-O 3.39Å; S803-V812 PolarHBondContact O-N 2.91Å; S803-V812 PolarHBondContact OG-O 3.26Å; D805-V812 HydrophobicContact CB-CG2 4.26Å
813	I	85.6	Confident	81.7	Confident	6 Å²	6	80.3 Å²	80.3	3%	0.031	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.8	-177.9	-64.2	163.7	0	0	0	108.2	Y768 D769 I771 F800 A802 H815	Y768-I813 WeakPolarHBondContact O-CD1 3.3Å; D769-I813 PolarHBondContact O-N 2.75Å; I771-I813 HydrophobicContact CD1-CD1 3.93Å; I771-I813 HydrophobicContact CG1-CD1 4.28Å; F800-I813 HydrophobicContact CE1-CG1 4.34Å; F800-I813 HydrophobicContact CE2-CD1 4.33Å; F800-I813 HydrophobicContact CE2-CG1 4.31Å; F800-I813 HydrophobicContact CZ-CD1 3.83Å; F800-I813 HydrophobicContact CZ-CG1 3.63Å; A802-I813 HydrophobicContact CB-CG1 4.31Å; I813-H815 PolarHBondContact O-N 3.18Å
814	N	81.5	Confident	81.7	Confident	70 Å²	70	82 Å²	82	37%	0.374	42%	0.424	S	S	.	.			trans	-83.7	113.9	173.2	-58.3	-31.7	0	0	0	106.8	P801 V816	P801-N814 WeakPolarHBondContact O-CB 3.27Å; P801-N814 PolarHBondContact O-N 3.49Å; N814-V816 HydrophobicContact CB-CG2 3.95Å; N814-V816 PolarHBondContact O-N 3.26Å
815	H	73.1	Confident	81.9	Confident	114 Å²	114	81.1 Å²	81.1	53%	0.528	43%	0.428	S	S	.	.			trans	-70.3	49.4	-179.3	-61	-72	0	0	0	114.2	D769 I813 E817	D769-H815 IonicContact OD1-CE1 3.82Å; D769-H815 PolarHBondContact OD1-CE1 2.76Å; D769-H815 IonicContact OD1-NE2 2.75Å; D769-H815 PolarHBondContact OD1-NE2 3.42Å; I813-H815 PolarHBondContact O-N 3.18Å; H815-E817 PolarHBondContact O-N 2.83Å
816	V	72.6	Confident	81.8	Confident	115 Å²	115	83.3 Å²	83.3	70%	0.697	44%	0.44	S	S	*	.			trans	-83	-0.6	178.2	-170.5	0	0	0	0	111.1	N814	N814-V816 HydrophobicContact CB-CG2 3.95Å; N814-V816 PolarHBondContact O-N 3.26Å
817	E	68.3	Low	82	Confident	73 Å²	73	77.9 Å²	77.9	34%	0.341	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-62.2	128.9	-176.7	-66.2	-170.4	168.2	0	0	112.2	S765 C766 P801 H815 K819	S765-E817 WeakPolarHBondContact CB-OE1 2.95Å; S765-E817 PolarHBondContact OG-OE1 3.42Å; S765-E817 PolarHBondContact OG-OE2 2.89Å; C766-E817 WeakPolarHBondContact CB-OE2 3.46Å; P801-E817 HydrophobicContact CG-CG 4.47Å; H815-E817 PolarHBondContact O-N 2.83Å; E817-K819 PolarHBondContact O-N 2.85Å
818	P	73.6	Confident	82.4	Confident	60 Å²	60	77.1 Å²	77.1	39%	0.39	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-64.7	129.8	179.1	25.1	-31.8	0	0	0	110	H822 T823	P818-H822 HydrophobicContact CB-CB 3.68Å; P818-T823 PolarHBondContact O-OG1 3.48Å
819	K	79.2	Confident	83	Confident	161 Å²	161	77.2 Å²	77.2	70%	0.7	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-55	151.6	166.3	-68.5	-176.4	178.6	179.3	0	109.3	E817 L821 H822 T823	E817-K819 PolarHBondContact O-N 2.85Å; K819-L821 CarbonylContact O-C 3.59Å; K819-L821 PolarHBondContact O-N 2.7Å; K819-H822 WeakPolarHBondContact O-CA 3.36Å; K819-H822 WeakPolarHBondContact O-CB 3.36Å; K819-H822 PolarHBondContact O-N 3.37Å; K819-T823 PolarHBondContact O-N 3.35Å; K819-T823 PolarHBondContact O-OG1 3.21Å
820	R	80.7	Confident	83.2	Confident	206 Å²	206	79.4 Å²	79.4	78%	0.777	41%	0.405	S	S	*	.	H	α-helix	trans	-45.4	-36.6	179.4	-176.5	174.5	176	158.9	-0.2	114.5	T823 L824	R820-T823 WeakPolarHBondContact O-CB 3.21Å; R820-T823 PolarHBondContact O-N 3.26Å; R820-L824 WeakPolarHBondContact O-CG 3.27Å; R820-L824 PolarHBondContact O-N 2.87Å
821	L	87.2	Confident	83.3	Confident	132 Å²	132	83.6 Å²	83.6	69%	0.691	42%	0.42	S	S	*	.	H	α-helix	trans	-68.9	-41.1	176.5	-172.1	134.9	0	0	0	112.9	K819 T823 L824 A825	K819-L821 CarbonylContact O-C 3.59Å; K819-L821 PolarHBondContact O-N 2.7Å; L821-T823 VanDerWaalsContact C-N 3.3Å; L821-L824 PolarHBondContact O-N 2.89Å; L821-A825 WeakPolarHBondContact O-CB 3.39Å; L821-A825 PolarHBondContact O-N 2.85Å
822	H	87	Confident	83.6	Confident	105 Å²	105	88.2 Å²	88.2	49%	0.486	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-41.5	172.1	-61.9	171.9	0	0	0	110.4	P818 K819 A825 L826	P818-H822 HydrophobicContact CB-CB 3.68Å; K819-H822 WeakPolarHBondContact O-CA 3.36Å; K819-H822 WeakPolarHBondContact O-CB 3.36Å; K819-H822 PolarHBondContact O-N 3.37Å; H822-A825 WeakPolarHBondContact O-CB 3.38Å; H822-A825 PolarHBondContact O-N 2.78Å; H822-L826 WeakPolarHBondContact O-CG 3.3Å; H822-L826 PolarHBondContact O-N 3.22Å
823	T	81.8	Confident	83.8	Confident	7 Å²	7	90 Å²	90	4%	0.043	45%	0.452	C	S	.	.	H	α-helix	trans	-60	-49.1	175.3	-50.2	0	0	0	0	111.9	F672 P818 K819 R820 L821 A825 L826 Q827	F672-T823 HydrophobicContact CB-CG2 3.53Å; F672-T823 HydrophobicContact CD1-CG2 3.66Å; F672-T823 HydrophobicContact CG-CG2 3.84Å; P818-T823 PolarHBondContact O-OG1 3.48Å; K819-T823 PolarHBondContact O-N 3.35Å; K819-T823 PolarHBondContact O-OG1 3.21Å; R820-T823 WeakPolarHBondContact O-CB 3.21Å; R820-T823 PolarHBondContact O-N 3.26Å; L821-T823 VanDerWaalsContact C-N 3.3Å; T823-A825 VanDerWaalsContact C-N 3.27Å; T823-A825 PolarHBondContact O-N 2.95Å; T823-L826 WeakPolarHBondContact O-CB 3.46Å; T823-L826 PolarHBondContact O-N 2.86Å; T823-Q827 HydrophobicContact CG2-CG 4.47Å; T823-Q827 VanDerWaalsContact O-CG 3.28Å; T823-Q827 WeakPolarHBondContact O-CG 3.46Å; T823-Q827 PolarHBondContact O-N 2.88Å
824	L	85.5	Confident	84	Confident	84 Å²	84	92 Å²	92	44%	0.44	46%	0.464	S	S	.	.	H	α-helix	trans	-60.8	-38	176.4	-72.2	173.1	0	0	0	111.9	R820 L821 Q827 I828	R820-L824 WeakPolarHBondContact O-CG 3.27Å; R820-L824 PolarHBondContact O-N 2.87Å; L821-L824 PolarHBondContact O-N 2.89Å; L824-Q827 PolarHBondContact O-N 3.16Å; L824-I828 WeakPolarHBondContact O-CB 3.4Å; L824-I828 VanDerWaalsContact O-CG1 3.28Å; L824-I828 WeakPolarHBondContact O-CG1 3.36Å; L824-I828 PolarHBondContact O-N 3.45Å
825	A	89.8	Confident	84.5	Confident	47 Å²	47	93.3 Å²	93.3	39%	0.388	47%	0.471	S	S	.	.	H	α-helix	trans	-64.3	-42.9	174.6	0	0	0	0	0	112.1	L821 H822 T823 Q827 I828 T829	L821-A825 WeakPolarHBondContact O-CB 3.39Å; L821-A825 PolarHBondContact O-N 2.85Å; H822-A825 WeakPolarHBondContact O-CB 3.38Å; H822-A825 PolarHBondContact O-N 2.78Å; T823-A825 VanDerWaalsContact C-N 3.27Å; T823-A825 PolarHBondContact O-N 2.95Å; A825-Q827 VanDerWaalsContact C-N 3.35Å; A825-I828 PolarHBondContact O-N 3.18Å; A825-T829 WeakPolarHBondContact O-CB 3.22Å; A825-T829 PolarHBondContact O-N 2.84Å; A825-T829 PolarHBondContact O-OG1 3.36Å
826	L	85.9	Confident	85.4	Confident	103 Å²	103	90 Å²	90	54%	0.539	46%	0.464	S	S	.	.	H	α-helix	trans	-60.7	-44.6	173	-72	169.8	0	0	0	111	H822 T823 I828 T829 E830	H822-L826 WeakPolarHBondContact O-CG 3.3Å; H822-L826 PolarHBondContact O-N 3.22Å; T823-L826 WeakPolarHBondContact O-CB 3.46Å; T823-L826 PolarHBondContact O-N 2.86Å; L826-I828 PolarHBondContact O-N 3.44Å; L826-T829 WeakPolarHBondContact O-CB 3.28Å; L826-T829 PolarHBondContact O-N 2.71Å; L826-T829 VanDerWaalsContact O-N 3.16Å; L826-E830 PolarHBondContact O-N 3.45Å
827	Q	84	Confident	86.4	Confident	48 Å²	48	88.9 Å²	88.9	22%	0.224	45%	0.451	C	S	.	.	H	α-helix	trans	-63.1	-41.3	177.9	-68.7	-177	-7.6	0	0	112.7	F672 V674 T823 L824 A825 T829 K831	F672-Q827 PolarHBondContact O-NE2 3.34Å; V674-Q827 VanDerWaalsContact CG2-CA 3.46Å; V674-Q827 HydrophobicContact CG2-CB 3.49Å; V674-Q827 VanDerWaalsContact CG2-CB 3.49Å; V674-Q827 HydrophobicContact CG2-CG 3.48Å; V674-Q827 VanDerWaalsContact CG2-CG 3.48Å; T823-Q827 HydrophobicContact CG2-CG 4.47Å; T823-Q827 VanDerWaalsContact O-CG 3.28Å; T823-Q827 WeakPolarHBondContact O-CG 3.46Å; T823-Q827 PolarHBondContact O-N 2.88Å; L824-Q827 PolarHBondContact O-N 3.16Å; A825-Q827 VanDerWaalsContact C-N 3.35Å; Q827-T829 VanDerWaalsContact C-N 3.35Å; Q827-K831 WeakPolarHBondContact O-CB 3.37Å; Q827-K831 VanDerWaalsContact O-CG 3.3Å; Q827-K831 WeakPolarHBondContact O-CG 3.39Å; Q827-K831 PolarHBondContact O-N 3.02Å
828	I	90.3	Very high	87.5	Confident	99 Å²	99	88.8 Å²	88.8	51%	0.508	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-41.3	174.4	-70.5	166.6	0	0	0	109.9	L824 A825 L826 K831 L832	L824-I828 WeakPolarHBondContact O-CB 3.4Å; L824-I828 VanDerWaalsContact O-CG1 3.28Å; L824-I828 WeakPolarHBondContact O-CG1 3.36Å; L824-I828 PolarHBondContact O-N 3.45Å; A825-I828 PolarHBondContact O-N 3.18Å; L826-I828 PolarHBondContact O-N 3.44Å; I828-K831 CarbonylContact O-C 3.57Å; I828-K831 PolarHBondContact O-N 3.23Å; I828-L832 HydrophobicContact CG2-CD1 3.84Å; I828-L832 HydrophobicContact CG2-CG 4.1Å; I828-L832 WeakPolarHBondContact O-CB 3.39Å; I828-L832 VanDerWaalsContact O-CG 3.27Å; I828-L832 WeakPolarHBondContact O-CG 3.46Å; I828-L832 PolarHBondContact O-N 3.23Å
829	T	91.2	Very high	88.3	Confident	72 Å²	72	89.6 Å²	89.6	44%	0.442	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-45.7	178.5	-55.7	0	0	0	0	111.3	A825 L826 Q827 K831 L832 N833	A825-T829 WeakPolarHBondContact O-CB 3.22Å; A825-T829 PolarHBondContact O-N 2.84Å; A825-T829 PolarHBondContact O-OG1 3.36Å; L826-T829 WeakPolarHBondContact O-CB 3.28Å; L826-T829 PolarHBondContact O-N 2.71Å; L826-T829 VanDerWaalsContact O-N 3.16Å; Q827-T829 VanDerWaalsContact C-N 3.35Å; T829-K831 PolarHBondContact O-N 3.27Å; T829-L832 PolarHBondContact O-N 3.29Å; T829-N833 VanDerWaalsContact O-CG 3.3Å; T829-N833 PolarHBondContact O-N 3Å
830	E	87.4	Confident	88.9	Confident	80 Å²	80	87.9 Å²	87.9	37%	0.374	45%	0.45	S	S	.	.	H	α-helix	trans	-61.9	-42.5	173.3	-73.8	-175.2	169.5	0	0	112.3	V674 L826 L832 N833 V834	V674-E830 VanDerWaalsContact CB-OE2 3.3Å; V674-E830 WeakPolarHBondContact CB-OE2 3.48Å; V674-E830 HydrophobicContact CG2-CB 4.36Å; V674-E830 VanDerWaalsContact CG2-OE2 3.29Å; V674-E830 WeakPolarHBondContact CG2-OE2 3.34Å; L826-E830 PolarHBondContact O-N 3.45Å; E830-L832 VanDerWaalsContact C-N 3.33Å; E830-L832 PolarHBondContact O-N 3.05Å; E830-N833 PolarHBondContact O-N 2.84Å; E830-V834 WeakPolarHBondContact O-CG2 3.33Å; E830-V834 PolarHBondContact O-N 2.87Å
831	K	88.6	Confident	89.2	Confident	117 Å²	117	84 Å²	84	51%	0.509	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-38	175.8	-76.5	178.6	179.4	178.9	0	112.1	V674 Q827 I828 T829 V834 L835	V674-K831 HydrophobicContact CG1-CG 4.36Å; Q827-K831 WeakPolarHBondContact O-CB 3.37Å; Q827-K831 VanDerWaalsContact O-CG 3.3Å; Q827-K831 WeakPolarHBondContact O-CG 3.39Å; Q827-K831 PolarHBondContact O-N 3.02Å; I828-K831 CarbonylContact O-C 3.57Å; I828-K831 PolarHBondContact O-N 3.23Å; T829-K831 PolarHBondContact O-N 3.27Å; K831-V834 PolarHBondContact O-N 3.03Å; K831-L835 WeakPolarHBondContact O-CB 3.39Å; K831-L835 VanDerWaalsContact O-CG 3.22Å; K831-L835 WeakPolarHBondContact O-CG 3.44Å; K831-L835 PolarHBondContact O-N 3.26Å
832	L	93.2	Very high	89.1	Confident	99 Å²	99	82.7 Å²	82.7	52%	0.518	43%	0.434	S	S	.	.	H	α-helix	trans	-65.9	-39.9	174.3	-74.8	173.8	0	0	0	110.9	I828 T829 E830 L835 A836	I828-L832 HydrophobicContact CG2-CD1 3.84Å; I828-L832 HydrophobicContact CG2-CG 4.1Å; I828-L832 WeakPolarHBondContact O-CB 3.39Å; I828-L832 VanDerWaalsContact O-CG 3.27Å; I828-L832 WeakPolarHBondContact O-CG 3.46Å; I828-L832 PolarHBondContact O-N 3.23Å; T829-L832 PolarHBondContact O-N 3.29Å; E830-L832 VanDerWaalsContact C-N 3.33Å; E830-L832 PolarHBondContact O-N 3.05Å; L832-L835 CarbonylContact O-C 3.58Å; L832-L835 PolarHBondContact O-N 3.39Å; L832-A836 WeakPolarHBondContact O-CB 3.44Å; L832-A836 PolarHBondContact O-N 3.49Å
833	N	92.3	Very high	88.9	Confident	92 Å²	92	81.5 Å²	81.5	49%	0.492	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-45.2	173.6	-70.9	-18.2	0	0	0	111.4	T829 E830 L835 A836 E837	T829-N833 VanDerWaalsContact O-CG 3.3Å; T829-N833 PolarHBondContact O-N 3Å; E830-N833 PolarHBondContact O-N 2.84Å; N833-L835 VanDerWaalsContact C-N 3.3Å; N833-L835 PolarHBondContact O-N 2.98Å; N833-A836 WeakPolarHBondContact O-CB 3.47Å; N833-A836 PolarHBondContact O-N 2.82Å; N833-E837 WeakPolarHBondContact O-CG 3.37Å; N833-E837 PolarHBondContact O-N 2.94Å
834	V	90.7	Very high	88.8	Confident	48 Å²	48	85.9 Å²	85.9	29%	0.291	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-37.5	174.6	171.9	0	0	0	0	111.5	E830 K831 N838	E830-V834 WeakPolarHBondContact O-CG2 3.33Å; E830-V834 PolarHBondContact O-N 2.87Å; K831-V834 PolarHBondContact O-N 3.03Å; V834-N838 WeakPolarHBondContact O-CB 3.26Å; V834-N838 PolarHBondContact O-N 3.33Å; V834-N838 PolarHBondContact O-ND2 3.19Å
835	L	92.5	Very high	88.2	Confident	98 Å²	98	85.7 Å²	85.7	51%	0.513	46%	0.458	S	S	.	.	H	α-helix	trans	-67.3	-39	174.2	-76.1	168.5	0	0	0	111.6	K831 L832 N833 N838 V839	K831-L835 WeakPolarHBondContact O-CB 3.39Å; K831-L835 VanDerWaalsContact O-CG 3.22Å; K831-L835 WeakPolarHBondContact O-CG 3.44Å; K831-L835 PolarHBondContact O-N 3.26Å; L832-L835 CarbonylContact O-C 3.58Å; L832-L835 PolarHBondContact O-N 3.39Å; N833-L835 VanDerWaalsContact C-N 3.3Å; N833-L835 PolarHBondContact O-N 2.98Å; L835-N838 PolarHBondContact O-N 3.42Å; L835-V839 WeakPolarHBondContact O-CB 3.37Å; L835-V839 WeakPolarHBondContact O-CG2 3.49Å; L835-V839 PolarHBondContact O-N 2.88Å
836	A	92.2	Very high	86.9	Confident	45 Å²	45	92.3 Å²	92.3	37%	0.372	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-48.2	174.4	0	0	0	0	0	110.6	L832 N833 N838 V839 E840	L832-A836 WeakPolarHBondContact O-CB 3.44Å; L832-A836 PolarHBondContact O-N 3.49Å; N833-A836 WeakPolarHBondContact O-CB 3.47Å; N833-A836 PolarHBondContact O-N 2.82Å; A836-N838 VanDerWaalsContact C-N 3.32Å; A836-N838 PolarHBondContact O-N 2.89Å; A836-V839 PolarHBondContact O-N 3.39Å; A836-V839 VanDerWaalsContact O-N 3.1Å; A836-E840 WeakPolarHBondContact O-CG 3.41Å; A836-E840 PolarHBondContact O-N 3.41Å
837	E	92.2	Very high	85.8	Confident	91 Å²	91	91.4 Å²	91.4	43%	0.425	47%	0.471	S	S	.	.	H	α-helix	trans	-55.8	-45	172.8	-72.7	174.3	-179.3	0	0	111.4	N833 V839 E840 Q841	N833-E837 WeakPolarHBondContact O-CG 3.37Å; N833-E837 PolarHBondContact O-N 2.94Å; E837-V839 PolarHBondContact O-N 3.1Å; E837-E840 PolarHBondContact O-N 2.85Å; E837-Q841 WeakPolarHBondContact O-CB 3.32Å; E837-Q841 VanDerWaalsContact O-CG 3.3Å; E837-Q841 WeakPolarHBondContact O-CG 3.37Å; E837-Q841 PolarHBondContact O-N 3.45Å
838	N	91.8	Very high	84.6	Confident	71 Å²	71	94.3 Å²	94.3	38%	0.38	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-36.8	177.1	-72.3	-24.9	0	0	0	112.4	V834 L835 A836 L842	V834-N838 WeakPolarHBondContact O-CB 3.26Å; V834-N838 PolarHBondContact O-N 3.33Å; V834-N838 PolarHBondContact O-ND2 3.19Å; L835-N838 PolarHBondContact O-N 3.42Å; A836-N838 VanDerWaalsContact C-N 3.32Å; A836-N838 PolarHBondContact O-N 2.89Å; N838-L842 WeakPolarHBondContact O-CB 3.47Å; N838-L842 VanDerWaalsContact O-CG 3.25Å; N838-L842 WeakPolarHBondContact O-CG 3.42Å; N838-L842 PolarHBondContact O-N 3.47Å
839	V	90.9	Very high	82.8	Confident	77 Å²	77	91.6 Å²	91.6	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-68.7	-42.5	176.2	167.3	0	0	0	0	110.3	L835 A836 E837 L842 I843	L835-V839 WeakPolarHBondContact O-CB 3.37Å; L835-V839 WeakPolarHBondContact O-CG2 3.49Å; L835-V839 PolarHBondContact O-N 2.88Å; A836-V839 PolarHBondContact O-N 3.39Å; A836-V839 VanDerWaalsContact O-N 3.1Å; E837-V839 PolarHBondContact O-N 3.1Å; V839-L842 PolarHBondContact O-N 3.36Å; V839-L842 VanDerWaalsContact O-N 3.17Å; V839-I843 HydrophobicContact CG1-CD1 3.67Å; V839-I843 HydrophobicContact CG1-CG1 4.34Å; V839-I843 WeakPolarHBondContact O-CB 3.39Å; V839-I843 VanDerWaalsContact O-CG1 3.24Å; V839-I843 WeakPolarHBondContact O-CG1 3.5Å; V839-I843 PolarHBondContact O-N 3.31Å
840	E	90.5	Very high	80.9	Confident	124 Å²	124	93.6 Å²	93.6	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-58.2	-48.6	173	-73.1	175.1	-179.5	0	0	110.8	A836 E837 L842 I843 D844	A836-E840 WeakPolarHBondContact O-CG 3.41Å; A836-E840 PolarHBondContact O-N 3.41Å; E837-E840 PolarHBondContact O-N 2.85Å; E840-L842 VanDerWaalsContact C-N 3.26Å; E840-L842 PolarHBondContact O-N 3.21Å; E840-I843 PolarHBondContact O-N 3.34Å; E840-D844 PolarHBondContact O-N 2.84Å
841	Q	88.2	Confident	79.2	Confident	126 Å²	126	99.4 Å²	99.4	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-61.5	-29.1	175.6	-73.9	178.3	12.6	0	0	113.9	E837 P845	E837-Q841 WeakPolarHBondContact O-CB 3.32Å; E837-Q841 VanDerWaalsContact O-CG 3.3Å; E837-Q841 WeakPolarHBondContact O-CG 3.37Å; E837-Q841 PolarHBondContact O-N 3.45Å; Q841-P845 WeakPolarHBondContact O-CD 3.24Å
842	L	85.4	Confident	77.4	Confident	104 Å²	104	95.9 Å²	95.9	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-80.7	-28.3	174.2	-75.1	169	0	0	0	112.5	N838 V839 E840 R846	N838-L842 WeakPolarHBondContact O-CB 3.47Å; N838-L842 VanDerWaalsContact O-CG 3.25Å; N838-L842 WeakPolarHBondContact O-CG 3.42Å; N838-L842 PolarHBondContact O-N 3.47Å; V839-L842 PolarHBondContact O-N 3.36Å; V839-L842 VanDerWaalsContact O-N 3.17Å; E840-L842 VanDerWaalsContact C-N 3.26Å; E840-L842 PolarHBondContact O-N 3.21Å; L842-R846 WeakPolarHBondContact O-CG 3.46Å
843	I	82.1	Confident	75.4	Confident	80 Å²	80	99.4 Å²	99.4	41%	0.41	52%	0.52	S	S	.	.	H	α-helix	trans	-75	-40.8	177.2	-71.8	168.5	0	0	0	110.4	V839 E840 R846 T847	V839-I843 HydrophobicContact CG1-CD1 3.67Å; V839-I843 HydrophobicContact CG1-CG1 4.34Å; V839-I843 WeakPolarHBondContact O-CB 3.39Å; V839-I843 VanDerWaalsContact O-CG1 3.24Å; V839-I843 WeakPolarHBondContact O-CG1 3.5Å; V839-I843 PolarHBondContact O-N 3.31Å; E840-I843 PolarHBondContact O-N 3.34Å; I843-R846 CarbonylContact O-C 3.53Å; I843-R846 WeakPolarHBondContact O-CA 3.49Å; I843-R846 WeakPolarHBondContact O-CB 3.37Å; I843-R846 PolarHBondContact O-N 2.89Å; I843-T847 HydrophobicContact CG2-CG2 3.66Å; I843-T847 PolarHBondContact O-N 3.03Å; I843-T847 PolarHBondContact O-OG1 3.42Å; I843-T847 VanDerWaalsContact O-OG1 3.09Å
844	D	80.2	Confident	73.5	Confident	99 Å²	99	98.3 Å²	98.3	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-50.6	-46.8	-179.4	-76.7	-18.4	0	0	0	115.1	E840 R846 T847 T848	E840-D844 PolarHBondContact O-N 2.84Å; D844-R846 VanDerWaalsContact C-N 3.34Å; D844-T847 PolarHBondContact O-OG1 2.87Å; D844-T847 VanDerWaalsContact O-OG1 3.04Å; D844-T848 WeakPolarHBondContact O-CB 3.07Å; D844-T848 PolarHBondContact O-N 3.04Å; D844-T848 PolarHBondContact O-OG1 2.87Å
845	P	72.2	Confident	71.7	Confident	80 Å²	80	101.6 Å²	101.6	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-73.1	-24.5	174.1	24.8	-30.8	0	0	0	112.9	Q841 G849	Q841-P845 WeakPolarHBondContact O-CD 3.24Å; P845-G849 WeakPolarHBondContact O-CA 3.27Å; P845-G849 PolarHBondContact O-N 3.27Å
846	R	63.7	Low	69.8	Low	186 Å²	186	105.3 Å²	105.3	70%	0.702	54%	0.544	S	S	*	.	H	α-helix	trans	-77.9	-35.7	177.9	-70.4	179.6	178.1	-175.7	1.1	112.5	L842 I843 D844 T848 N850	L842-R846 WeakPolarHBondContact O-CG 3.46Å; I843-R846 CarbonylContact O-C 3.53Å; I843-R846 WeakPolarHBondContact O-CA 3.49Å; I843-R846 WeakPolarHBondContact O-CB 3.37Å; I843-R846 PolarHBondContact O-N 2.89Å; D844-R846 VanDerWaalsContact C-N 3.34Å; R846-T848 VanDerWaalsContact C-N 3.34Å; R846-N850 WeakPolarHBondContact O-CB 3.33Å; R846-N850 PolarHBondContact O-N 2.95Å
847	T	62.9	Low	67.9	Low	83 Å²	83	107.7 Å²	107.7	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-72.3	-30.5	174.9	47.7	0	0	0	0	111.7	I843 D844	I843-T847 HydrophobicContact CG2-CG2 3.66Å; I843-T847 PolarHBondContact O-N 3.03Å; I843-T847 PolarHBondContact O-OG1 3.42Å; I843-T847 VanDerWaalsContact O-OG1 3.09Å; D844-T847 PolarHBondContact O-OG1 2.87Å; D844-T847 VanDerWaalsContact O-OG1 3.04Å
848	T	58.1	Low	66.2	Low	109 Å²	109	106.2 Å²	106.2	67%	0.669	55%	0.553	S	S	*	*	H	α-helix	trans	-87.9	-33.4	178.9	-39.6	0	0	0	0	112.7	D844 R846	D844-T848 WeakPolarHBondContact O-CB 3.07Å; D844-T848 PolarHBondContact O-N 3.04Å; D844-T848 PolarHBondContact O-OG1 2.87Å; R846-T848 VanDerWaalsContact C-N 3.34Å
849	G	53.4	Low	64.5	Low	43 Å²	43	105.9 Å²	105.9	44%	0.443	56%	0.561	S	S	.	*	H	α-helix	trans	-77.5	-25.6	179.6	0	0	0	0	0	115.3	P845 R851 G852	P845-G849 WeakPolarHBondContact O-CA 3.27Å; P845-G849 PolarHBondContact O-N 3.27Å; G849-R851 VanDerWaalsContact C-N 3.3Å; G849-R851 PolarHBondContact O-N 2.77Å; G849-G852 PolarHBondContact O-N 3.09Å
850	N	50.2	Low	62.7	Low	114 Å²	114	108.5 Å²	108.5	61%	0.61	57%	0.568	S	S	*	*	H	α-helix	trans	-80.6	-9.4	-178.9	-150.1	36.6	0	0	0	113.8	R846 S854	R846-N850 WeakPolarHBondContact O-CB 3.33Å; R846-N850 PolarHBondContact O-N 2.95Å; N850-S854 VanDerWaalsContact O-CB 3.26Å; N850-S854 WeakPolarHBondContact O-CB 3.21Å; N850-S854 PolarHBondContact O-N 3.37Å
851	R	51.3	Low	61	Low	201 Å²	201	112.5 Å²	112.5	76%	0.758	58%	0.578	S	S	*	*	H	α-helix	trans	-78.4	-23.2	169.4	-76.8	-175.7	177	171.6	0.6	112.9	G849 N855	G849-R851 VanDerWaalsContact C-N 3.3Å; G849-R851 PolarHBondContact O-N 2.77Å; R851-N855 PolarHBondContact O-ND2 3.22Å
852	G	51.6	Low	59.4	Low	43 Å²	43	109.3 Å²	109.3	44%	0.443	58%	0.579	S	S	.	*	H	α-helix	trans	-78.7	-43.6	174.7	0	0	0	0	0	113.2	G849 Y856	G849-G852 PolarHBondContact O-N 3.09Å; G852-Y856 PolarHBondContact O-N 2.81Å
853	Y	50.8	Low	57.9	Low	174 Å²	174	112.3 Å²	112.3	68%	0.682	59%	0.59	S	S	*	*	H	α-helix	trans	-77.2	-33.7	-177.5	-111.5	-91.3	0	0	0	113.6	Y856 L857	Y853-Y856 PolarHBondContact O-N 2.62Å; Y853-L857 PolarHBondContact O-N 3.5Å; Y853-L857 VanDerWaalsContact O-N 3.09Å
854	S	52.2	Low	56.2	Low	69 Å²	69	115 Å²	115	48%	0.483	61%	0.606	S	S	.	*	H	α-helix	trans	-68.3	-35.5	175.1	-164.8	0	0	0	0	111.8	N850 A858	N850-S854 VanDerWaalsContact O-CB 3.26Å; N850-S854 WeakPolarHBondContact O-CB 3.21Å; N850-S854 PolarHBondContact O-N 3.37Å; S854-A858 WeakPolarHBondContact O-CB 3.26Å; S854-A858 PolarHBondContact O-N 3.27Å
855	N	52.8	Low	54.5	Low	116 Å²	116	124.1 Å²	124.1	62%	0.62	63%	0.634	S	S	*	*	H	α-helix	trans	-71.5	-31.8	174.2	-79.3	-9	0	0	0	112.8	R851 A859	R851-N855 PolarHBondContact O-ND2 3.22Å; N855-A859 WeakPolarHBondContact O-CB 3.15Å; N855-A859 PolarHBondContact O-N 2.94Å
856	Y	52.4	Low	53.6	Low	176 Å²	176	126.3 Å²	126.3	69%	0.69	64%	0.64	S	S	*	*	H	α-helix	trans	-69.5	-40.8	174.6	-115.2	-90	0	0	0	112.7	G852 Y853 Q860	G852-Y856 PolarHBondContact O-N 2.81Å; Y853-Y856 PolarHBondContact O-N 2.62Å; Y856-Q860 PolarHBondContact O-N 2.89Å
857	L	53	Low	53.1	Low	96 Å²	96	123.2 Å²	123.2	50%	0.503	64%	0.637	S	S	.	*	H	α-helix	trans	-75.5	-30.7	176.1	-81.5	160.7	0	0	0	112.9	Y853 R861	Y853-L857 PolarHBondContact O-N 3.5Å; Y853-L857 VanDerWaalsContact O-N 3.09Å; L857-R861 PolarHBondContact O-N 3.32Å
858	A	57	Low	52.5	Low	59 Å²	59	125.4 Å²	125.4	49%	0.488	64%	0.644	S	S	.	*	H	α-helix	trans	-71.3	-36.4	172.6	0	0	0	0	0	112.1	S854 Q860 R861 G862	S854-A858 WeakPolarHBondContact O-CB 3.26Å; S854-A858 PolarHBondContact O-N 3.27Å; A858-Q860 PolarHBondContact O-N 3.09Å; A858-R861 PolarHBondContact O-N 3.42Å; A858-G862 PolarHBondContact O-N 3.18Å
859	A	56.2	Low	52.2	Low	65 Å²	65	126.4 Å²	126.4	54%	0.537	64%	0.642	S	S	.	*	H	α-helix	trans	-66.4	-34.5	175.2	0	0	0	0	0	112.7	N855	N855-A859 WeakPolarHBondContact O-CB 3.15Å; N855-A859 PolarHBondContact O-N 2.94Å
860	Q	53	Low	52.1	Low	132 Å²	132	131.6 Å²	131.6	62%	0.617	66%	0.655	S	S	*	*	H	α-helix	trans	-77.5	-25.7	175.6	-79.5	-173.6	-10.9	0	0	114	Y856 A858	Y856-Q860 PolarHBondContact O-N 2.89Å; A858-Q860 PolarHBondContact O-N 3.09Å
861	R	54.8	Low	52.2	Low	207 Å²	207	132.7 Å²	132.7	78%	0.781	66%	0.658	S	S	*	*	H	α-helix	trans	-83.5	-14.8	175.5	-76.1	-175.4	179.2	176.1	0.7	113.9	L857 A858	L857-R861 PolarHBondContact O-N 3.32Å; A858-R861 PolarHBondContact O-N 3.42Å
862	G	55	Low	52.3	Low	60 Å²	60	127.9 Å²	127.9	62%	0.619	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	0	176.9	0	0	0	0	0	115.9	A858	A858-G862 PolarHBondContact O-N 3.18Å
863	Q	53.1	Low	52.4	Low	166 Å²	166	134.4 Å²	134.4	78%	0.776	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	6.6	179.5	-81.4	-173	-19.8	0	0	114.5
864	N	47.4	Very low	52.5	Low	138 Å²	138	131.1 Å²	131.1	74%	0.738	67%	0.665	S	S	*	*			trans	-117.5	26.4	-179.1	-81.1	-32.3	0	0	0	114.1
865	Y	43.1	Very low	52.5	Low	289 Å²	289	136.7 Å²	136.7	100%	1.133	68%	0.682	S	S	*	*			trans	-139.8	0	166.8	-86.5	-79.6	0	0	0	111.6

Retrieved 865 of 865 residues in 322.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).