A0A077Z4N4_TRITR Loading...

NAD(P) transhydrogenase, mitochondrial

The transhydrogenation between NADH and NADP is coupled to respiration and ATP hydrolysis and functions as a proton pump across the membrane. May play a role in reactive oxygen species (ROS) detoxification in the adrenal gland.

AlphaFold DB , UniProt , Accession A0A077Z4N4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,084 aa.

						>A0A077Z4N4_TRITR|A0A077Z4N4
MIRTSMLLQKVCSDCALIQCSGSKFLASLRCGKRYFSQSPLLGQQQQKAKEPPPPPKGIPYSKLSIGVPKETYTGEQRVALSPAVAQTLIKKGFTVRLEKNAGSAAKFGDAEYAAAGVNLSDSPDAVYSSDIVLKVRQPSSAEVAKFKSGGTLISFIYPAQNEALVKEMASRKLTVFGMDCVPRISRAQVFDALSSMANIAGYKAVIEAANSFGRFFTGQITAAGKVPPAKIMVIGGGVAGLAAIGTAKNMGAIVRAFDTRAAVKEQVESLGAEFLEVSVKEAGEGAGGYAKEMSKEFIEAEMALFAQQCKEIDILISTALIPGKPAPKLISKKMVESMKPGSVVVDLAAEAGGNIETTRPGQMYVSNNDVIHIGYTDFPSRLPTQSSTLYANNISKFLLSIGAKDHFYIDLEDDVTRGAIVLKEGQMMWPPPKIEEPSPPPAAPKPVAVAPPPEPNYFMETMKKAGTYSAGFGTIIGLGYISPNAAFSSMCTTFGLAGIVGYHTVWGVTPALHSPLMSVTNAISGITAAGALLLMGGQYMPTSVPQSLASLACFISSINIGGGFLITQRMLDMFKRPTDPPEYNYLYTVPAAVFLGGYGYGLYTKVPEINSLCYLGASLACVGALAGLSSQTTCRLGNNLGMIGVAGAMASTIGALEPSKELLAQMLTCISLGGSIGLAIAKRIEVTDLPQLVAAFHSFVGVAAALTCIANYLVEYPHFASDPALAVNKCALFLGTFIGGVTFTGSLMAFGKLQGILNSAAVLLPGRHALNTGLTLANLGALGWYMSSDDLNIGLANLGATALLSSVMGVTMTMAIGGKFNAQATLVRLRADMPVVITVLNSYSGWALCAEGFMMDNDLLTVVGALIGSSGAILSYIMCKAMNRSLANVILGGYGTVSTAGGKPREITGTHTEVDVETTVDWLLNAKNVIIVPGYGLCAARAQYPIAELVSTLRKRNINVRFGRMPGQLNVLLAEAGVPYDIVLEMDEINPDFNDTDVVLVIGANDTVNSAAEDDPNSIIAGMPVLRVWKAKQVVVMKRSLGVGYAAVDNPIFYNPNTAMLLGDAKKRCDELLEAVKQKIANS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	28.6	Very low	234 Å²	234	167.5 Å²	167.5	100%	1.153	84%	0.842	S	S	*	*				0	87.8	0	-75.1	175.9	-177.6	0	0	106.9
2	I	27.7	Very low	28.5	Very low	153 Å²	153	162.8 Å²	162.8	79%	0.785	84%	0.835	S	S	*	*				95.7	117.2	60.7	-68.1	169.6	0	0	0	111
3	R	27.4	Very low	28.3	Very low	233 Å²	233	158 Å²	158	88%	0.879	82%	0.824	S	S	*	*			trans	78.2	120.1	175.9	-66.3	168.7	178.6	-170.6	-1	114.1
4	T	31.1	Very low	28.5	Very low	132 Å²	132	158.5 Å²	158.5	81%	0.81	83%	0.829	S	S	*	*				-171.6	110.9	58.1	-46.3	0	0	0	0	107.2
5	S	29.6	Very low	28.4	Very low	90 Å²	90	156.5 Å²	156.5	63%	0.629	83%	0.831	S	S	*	*				67.1	112.1	88	-166	0	0	0	0	117.3
6	M	28.8	Very low	28.4	Very low	172 Å²	172	152.1 Å²	152.1	85%	0.847	82%	0.823	S	S	*	*			trans	69.2	112.8	141.9	-71.9	177.6	-174.6	0	0	121.3
7	L	29.9	Very low	28.4	Very low	156 Å²	156	152.2 Å²	152.2	82%	0.817	82%	0.823	S	S	*	*				-160.9	118.9	110.9	-126.6	82.2	0	0	0	112.5
8	L	28.3	Very low	28.5	Very low	159 Å²	159	152.6 Å²	152.6	83%	0.832	82%	0.822	S	S	*	*			trans	78.3	102.7	144.8	-76.3	156.1	0	0	0	122.2
9	Q	23.3	Very low	28.2	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	82%	0.823	S	S	*	*			trans	-104.9	127.5	165.9	-172.4	179.7	8.5	0	0	108.7
10	K	28.2	Very low	28.1	Very low	199 Å²	199	153.2 Å²	153.2	87%	0.865	83%	0.828	S	S	*	*			trans	177.4	111.7	160.3	-107.7	178	-179.5	-179.4	0	103.7
11	V	29.2	Very low	28.1	Very low	127 Å²	127	151.7 Å²	151.7	77%	0.77	83%	0.829	S	S	*	*				-167.2	110	54	168.2	0	0	0	0	106.4
12	C	27	Very low	27.9	Very low	112 Å²	112	143.6 Å²	143.6	76%	0.757	81%	0.806	S	S	*	*				29.2	108.7	115.3	-87.6	0	0	0	0	115.8
13	S	26.1	Very low	27.8	Very low	100 Å²	100	142 Å²	142	70%	0.699	81%	0.808	S	S	*	*				91.9	106.7	90	-69.1	0	0	0	0	111.6
14	D	31.4	Very low	27.8	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	81%	0.807	S	S	*	*				-168.1	136.3	125.8	-93.2	-20.8	0	0	0	113.2
15	C	27.7	Very low	27.6	Very low	129 Å²	129	142.9 Å²	142.9	87%	0.872	81%	0.808	S	S	*	*			trans	73.1	92.6	164	-80.8	0	0	0	0	120.8
16	A	28	Very low	27.5	Very low	85 Å²	85	146.1 Å²	146.1	70%	0.702	82%	0.817	S	S	*	*			trans	-77.6	174.5	156.4	0	0	0	0	0	113.1
17	L	27.4	Very low	27.3	Very low	155 Å²	155	142.3 Å²	142.3	81%	0.812	81%	0.813	S	S	*	*			trans	86.3	105.3	144.9	-78.9	160.3	0	0	0	118.7
18	I	30	Very low	27.2	Very low	158 Å²	158	140 Å²	140	81%	0.81	81%	0.81	S	S	*	*				169.9	132.8	99.4	-87.3	146.5	0	0	0	111.5
19	Q	24.4	Very low	27.3	Very low	181 Å²	181	140 Å²	140	85%	0.846	81%	0.81	S	S	*	*			trans	-59.7	140.3	166.4	-64.8	159.4	-68.5	0	0	111.6
20	C	26.2	Very low	27.5	Very low	136 Å²	136	142.2 Å²	142.2	92%	0.919	81%	0.81	S	S	*	*				-174.1	148.3	129.2	-114.6	0	0	0	0	113.8
21	S	26.9	Very low	27.4	Very low	122 Å²	122	139 Å²	139	85%	0.853	81%	0.812	S	S	*	*			trans	-63.8	152.8	179.8	175.7	0	0	0	0	115.2
22	G	28.1	Very low	27.5	Very low	65 Å²	65	137 Å²	137	67%	0.67	82%	0.817	S	S	*	*			trans	99.2	111.5	137.6	0	0	0	0	0	118.8
23	S	25	Very low	27.6	Very low	119 Å²	119	140.4 Å²	140.4	83%	0.832	82%	0.819	S	S	*	*			trans	16.2	119.2	148.1	-77.9	0	0	0	0	119.8
24	K	28.1	Very low	27.8	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	83%	0.825	S	S	*	*				169.1	142.6	114.2	-94.4	174.6	-176.7	179.9	0	112.3
25	F	26.6	Very low	27.8	Very low	190 Å²	190	148.6 Å²	148.6	83%	0.833	82%	0.823	S	S	*	*			trans	91.4	134.5	137	-105.7	-106.4	0	0	0	122.7
26	L	26.9	Very low	28	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	83%	0.828	S	S	*	*			trans	-65	160	168	-79.1	131.6	0	0	0	113.5
27	A	25.4	Very low	28.3	Very low	92 Å²	92	153.4 Å²	153.4	76%	0.76	83%	0.825	S	S	*	*			trans	90.6	145.2	152	0	0	0	0	0	118.7
28	S	28.1	Very low	28.6	Very low	107 Å²	107	155 Å²	155	75%	0.748	83%	0.828	S	S	*	*			trans	87.1	127.5	180	104.4	0	0	0	0	112.1
29	L	28.9	Very low	28.5	Very low	159 Å²	159	153 Å²	153	83%	0.832	83%	0.829	S	S	*	*			cis	-161.6	139.6	24.7	-97.9	133.7	0	0	0	111.2
30	R	28.2	Very low	28.8	Very low	234 Å²	234	149.3 Å²	149.3	88%	0.883	82%	0.82	S	S	*	*			trans	-62	157.6	148.7	-78.1	172.4	166	-174.1	-2.4	110.3
31	C	26.8	Very low	29.3	Very low	133 Å²	133	150.6 Å²	150.6	90%	0.899	82%	0.818	S	S	*	*			trans	96.8	102.3	160.5	-142.6	0	0	0	0	116.4
32	G	30.1	Very low	29.8	Very low	85 Å²	85	153.7 Å²	153.7	88%	0.876	82%	0.823	S	S	*	*			trans	-156.7	67.7	168.6	0	0	0	0	0	109.6
33	K	30.2	Very low	30	Very low	183 Å²	183	154.1 Å²	154.1	80%	0.796	83%	0.828	S	S	*	*			trans	-81.5	145.1	169.7	-116	178.2	-177.5	176.8	0	108.6
34	R	29.3	Very low	30.3	Very low	222 Å²	222	158 Å²	158	84%	0.838	83%	0.833	S	S	*	*			trans	76.7	113.8	161.9	-62.6	172.8	174.1	172.7	-2.7	116.3
35	Y	31.1	Very low	30.8	Very low	215 Å²	215	157.7 Å²	157.7	84%	0.843	83%	0.834	S	S	*	*				-179.8	98.1	119.3	-100.1	-77.5	0	0	0	107.9
36	F	32.1	Very low	30.9	Very low	223 Å²	223	157.9 Å²	157.9	98%	0.978	84%	0.838	S	S	*	*			trans	-154.1	86.7	148.5	-103.6	-74.2	0	0	0	106.4
37	S	34.4	Very low	31.3	Very low	91 Å²	91	159.7 Å²	159.7	64%	0.636	84%	0.842	S	S	*	*			trans	-90.5	130.6	168.5	63.8	0	0	0	0	109.3
38	Q	32.8	Very low	31.7	Very low	188 Å²	188	164.7 Å²	164.7	88%	0.879	85%	0.847	S	S	*	*			trans	39.9	105.9	136.2	-63.6	-179.5	-13	0	0	117.8
39	S	29.6	Very low	32	Very low	118 Å²	118	164.2 Å²	164.2	83%	0.825	85%	0.85	S	S	*	*			trans	-129	114.3	136.9	-161.8	0	0	0	0	107.4
40	P	30.7	Very low	32.5	Very low	102 Å²	102	166.3 Å²	166.3	66%	0.662	85%	0.852	S	S	*	*			trans	-87.7	154.1	168.9	34.3	-27.2	0	0	0	109.2
41	L	36.5	Very low	32.9	Very low	164 Å²	164	163.4 Å²	163.4	86%	0.859	85%	0.848	S	S	*	*			trans	105.6	128.8	-179.1	-59.2	156.2	0	0	0	112.7
42	L	36	Very low	33.7	Very low	186 Å²	186	162.5 Å²	162.5	97%	0.974	84%	0.841	S	S	*	*	S	Bend	trans	82.5	111.2	-174.1	-58.5	145.1	0	0	0	113.3
43	G	34	Very low	34.8	Very low	74 Å²	74	164 Å²	164	76%	0.763	84%	0.835	S	S	*	*			cis	-152.7	130.9	7.1	0	0	0	0	0	109.3	Q45	G43-Q45 PolarHBondContact O-N 2.94Å
44	Q	31.3	Very low	36.2	Very low	201 Å²	201	160.5 Å²	160.5	94%	0.939	83%	0.831	S	S	*	*			trans	-63.7	111.5	174.1	-68	167.1	-19.3	0	0	109.6
45	Q	36.7	Very low	37.9	Very low	187 Å²	187	155.3 Å²	155.3	87%	0.874	83%	0.826	S	S	*	*			trans	-128.3	93.4	155.4	-81.7	-171.1	-13.9	0	0	108.6	G43 Q47	G43-Q45 PolarHBondContact O-N 2.94Å; Q45-Q47 PolarHBondContact O-N 3.24Å
46	Q	30.6	Very low	39.6	Very low	194 Å²	194	148.6 Å²	148.6	91%	0.907	81%	0.809	S	S	*	*			trans	41.6	70.3	155.2	-66.3	-179.9	-9.7	0	0	117.2	K48	Q46-K48 PolarHBondContact O-N 3.02Å
47	Q	33.6	Very low	41.7	Very low	195 Å²	195	144.3 Å²	144.3	91%	0.911	79%	0.79	S	S	*	*			trans	-75.8	98.7	143.9	-78.9	177.2	-7.7	0	0	107.6	Q45 A49	Q45-Q47 PolarHBondContact O-N 3.24Å; Q47-A49 PolarHBondContact O-N 3.42Å; Q47-A49 VanDerWaalsContact O-N 3.09Å
48	K	34.2	Very low	44	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.857	78%	0.777	S	S	*	*			trans	-58.9	112.2	157.4	-96.4	-178.2	174	-180	0	106.5	Q46 K50	Q46-K48 PolarHBondContact O-N 3.02Å; K48-K50 PolarHBondContact O-N 3.28Å
49	A	34.9	Very low	46.6	Very low	98 Å²	98	136.7 Å²	136.7	81%	0.81	76%	0.756	S	S	*	*			trans	-54.4	112	165.2	0	0	0	0	0	107.4	Q47 E51	Q47-A49 PolarHBondContact O-N 3.42Å; Q47-A49 VanDerWaalsContact O-N 3.09Å; A49-E51 PolarHBondContact O-N 3.22Å
50	K	38.5	Very low	49.5	Very low	203 Å²	203	133 Å²	133	88%	0.883	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-63.1	118.8	166.8	-88.3	179.7	171.7	179.7	0	106.3	K48	K48-K50 PolarHBondContact O-N 3.28Å
51	E	37.4	Very low	52.4	Low	173 Å²	173	128.4 Å²	128.4	81%	0.808	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-47.8	143.9	163.8	-75.9	176.4	149.6	0	0	109.2	A49	A49-E51 PolarHBondContact O-N 3.22Å
52	P	44.4	Very low	54.9	Low	114 Å²	114	124.6 Å²	124.6	74%	0.74	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-52.7	136.7	172.5	22.8	-31.4	0	0	0	108.6
53	P	53.1	Low	57.6	Low	116 Å²	116	123.1 Å²	123.1	75%	0.753	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-55.3	135.5	-178.6	22.3	-31.4	0	0	0	108.9
54	P	59.1	Low	60.4	Low	109 Å²	109	120.2 Å²	120.2	71%	0.708	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-54.6	145.9	178.7	22	-32.1	0	0	0	109.6
55	P	64.1	Low	63.4	Low	113 Å²	113	111.3 Å²	111.3	73%	0.734	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-52.1	138	178.3	21.6	-32.1	0	0	0	109.6	K57	P55-K57 PolarHBondContact O-N 2.76Å
56	P	67.5	Low	66.2	Low	75 Å²	75	102.4 Å²	102.4	49%	0.487	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-56.7	125.7	-176	22.6	-32.2	0	0	0	109.4	H407	P56-H407 VanDerWaalsContact CG-CE1 3.5Å; P56-H407 WeakPolarHBondContact CG-CE1 3.42Å
57	K	75.8	Confident	69.3	Low	133 Å²	133	93.1 Å²	93.1	58%	0.578	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-69.7	137.6	176.8	-64.4	-178.6	-179.4	177.9	0	108.9	P55 Y409	P55-K57 PolarHBondContact O-N 2.76Å; K57-Y409 HydrophobicContact CB-CD1 4.27Å; K57-Y409 HydrophobicContact CB-CD2 3.86Å; K57-Y409 HydrophobicContact CB-CE1 4.47Å; K57-Y409 HydrophobicContact CB-CE2 4.06Å; K57-Y409 HydrophobicContact CB-CG 3.97Å; K57-Y409 HydrophobicContact CD-CE1 4.26Å; K57-Y409 HydrophobicContact CD-CE2 4.34Å; K57-Y409 WeakPolarHBondContact O-CB 3.36Å
58	G	83.1	Confident	72.3	Confident	36 Å²	36	83.9 Å²	83.9	37%	0.371	47%	0.469	S	S	.	.	S	Bend	trans	117.8	-179.7	172.7	0	0	0	0	0	115.6	F408	G58-F408 CarbonylContact C-O 3.18Å; G58-F408 WeakPolarHBondContact CA-O 2.94Å
59	I	87.8	Confident	75.2	Confident	83 Å²	83	74.6 Å²	74.6	43%	0.426	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127	176.7	-57.5	171.6	0	0	0	107.9	K63 L64 H407 F408	I59-K63 HydrophobicContact CG2-CB 3.92Å; I59-L64 HydrophobicContact CB-CD1 4.32Å; I59-L64 HydrophobicContact CB-CG 4.48Å; I59-L64 HydrophobicContact CD1-CD2 4.4Å; I59-L64 HydrophobicContact CG2-CD1 4.26Å; I59-L64 HydrophobicContact CG2-CD2 4.02Å; I59-L64 HydrophobicContact CG2-CG 3.92Å; I59-H407 WeakPolarHBondContact O-CA 3.31Å; I59-F408 PolarHBondContact N-O 3.32Å; I59-F408 PolarHBondContact O-N 3.19Å
60	P	89.5	Confident	78	Confident	39 Å²	39	74.5 Å²	74.5	25%	0.253	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	140.1	174.7	-22.9	30.9	0	0	0	111.7	S62 K63	P60-S62 PolarHBondContact O-N 2.94Å; P60-S62 VanDerWaalsContact O-N 3.08Å; P60-K63 PolarHBondContact O-N 3.3Å
61	Y	91.2	Very high	80.7	Confident	6 Å²	6	65.8 Å²	65.8	2%	0.024	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-56.1	-30	-179.7	-63.5	-28.6	0	0	0	113.6	K63 L64 K92 F94 L400 D406 F408	Y61-K63 PolarHBondContact O-N 2.99Å; Y61-K63 VanDerWaalsContact O-N 3.16Å; Y61-L64 PolarHBondContact O-N 3.35Å; Y61-L64 VanDerWaalsContact O-N 3.11Å; Y61-K92 HydrophobicContact CD2-CB 4.39Å; Y61-F94 AromaticContact CD1-CE1 3.63Å; Y61-F94 HydrophobicContact CD1-CE1 3.63Å; Y61-F94 AromaticContact CD1-CE2 3.74Å; Y61-F94 HydrophobicContact CD1-CE2 3.74Å; Y61-F94 AromaticContact CD1-CZ 3.12Å; Y61-F94 HydrophobicContact CD1-CZ 3.12Å; Y61-F94 AromaticContact CD2-CE2 3.8Å; Y61-F94 HydrophobicContact CD2-CE2 3.8Å; Y61-F94 HydrophobicContact CD2-CZ 4.08Å; Y61-F94 HydrophobicContact CE1-CE1 4.32Å; Y61-F94 HydrophobicContact CE1-CE2 4.11Å; Y61-F94 AromaticContact CE1-CZ 3.5Å; Y61-F94 HydrophobicContact CE1-CZ 3.5Å; Y61-F94 VanDerWaalsContact CE1-CZ 3.5Å; Y61-F94 HydrophobicContact CE2-CE2 4.19Å; Y61-F94 HydrophobicContact CE2-CZ 4.39Å; Y61-F94 HydrophobicContact CG-CD2 4.24Å; Y61-F94 HydrophobicContact CG-CE1 4.01Å; Y61-F94 AromaticContact CG-CE2 3.56Å; Y61-F94 HydrophobicContact CG-CE2 3.56Å; Y61-F94 AromaticContact CG-CZ 3.45Å; Y61-F94 HydrophobicContact CG-CZ 3.45Å; Y61-F94 VanDerWaalsContact CG-CZ 3.45Å; Y61-L400 HydrophobicContact CD2-CD2 4.47Å; Y61-L400 HydrophobicContact CE2-CD2 3.72Å; Y61-D406 HydrophobicContact CD2-CB 4.44Å; Y61-D406 VanDerWaalsContact CE2-CA 3.46Å; Y61-D406 PolarHBondContact N-O 3.39Å; Y61-F408 HydrophobicContact CD1-CB 4.12Å; Y61-F408 HydrophobicContact CE1-CB 3.88Å; Y61-F408 VanDerWaalsContact CE1-N 3.32Å
62	S	90.6	Very high	83.3	Confident	84 Å²	84	62.1 Å²	62.1	59%	0.587	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-61.9	-17.6	176	58.2	0	0	0	0	115.4	P60 G93	P60-S62 PolarHBondContact O-N 2.94Å; P60-S62 VanDerWaalsContact O-N 3.08Å; S62-G93 VanDerWaalsContact CA-O 3.26Å; S62-G93 WeakPolarHBondContact CA-O 3.06Å
63	K	91.1	Very high	85.5	Confident	156 Å²	156	62.9 Å²	62.9	68%	0.678	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-99.1	0.2	177.8	-66.2	-171.2	177.4	-178.1	0	113.6	I59 P60 Y61	I59-K63 HydrophobicContact CG2-CB 3.92Å; P60-K63 PolarHBondContact O-N 3.3Å; Y61-K63 PolarHBondContact O-N 2.99Å; Y61-K63 VanDerWaalsContact O-N 3.16Å
64	L	92.8	Very high	87.2	Confident	12 Å²	12	63.7 Å²	63.7	6%	0.063	36%	0.355	C	S	.	.			trans	-111.3	135.3	-175.6	-66.4	170.3	0	0	0	111	I59 Y61 F94 T95 D131 I132 F408	I59-L64 HydrophobicContact CB-CD1 4.32Å; I59-L64 HydrophobicContact CB-CG 4.48Å; I59-L64 HydrophobicContact CD1-CD2 4.4Å; I59-L64 HydrophobicContact CG2-CD1 4.26Å; I59-L64 HydrophobicContact CG2-CD2 4.02Å; I59-L64 HydrophobicContact CG2-CG 3.92Å; Y61-L64 PolarHBondContact O-N 3.35Å; Y61-L64 VanDerWaalsContact O-N 3.11Å; L64-F94 HydrophobicContact CB-CD1 4.01Å; L64-F94 HydrophobicContact CB-CE1 4.07Å; L64-F94 HydrophobicContact CD1-CE1 4.18Å; L64-T95 PolarHBondContact O-N 3.3Å; L64-D131 HydrophobicContact CD2-CB 3.9Å; L64-I132 HydrophobicContact CD1-CD1 4.39Å; L64-F408 HydrophobicContact CD1-CB 3.41Å; L64-F408 VanDerWaalsContact CD1-CB 3.41Å; L64-F408 HydrophobicContact CD1-CD1 4.24Å; L64-F408 HydrophobicContact CD1-CG 3.93Å
65	S	94.7	Very high	88.6	Confident	14 Å²	14	60.5 Å²	60.5	10%	0.098	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.1	171.4	68	0	0	0	0	111.8	T95 S130 D131 I132	S65-T95 CarbonylContact C-O 3.48Å; S65-T95 VanDerWaalsContact CA-O 3.24Å; S65-T95 WeakPolarHBondContact CA-O 3.41Å; S65-S130 WeakPolarHBondContact OG-CA 3.37Å; S65-S130 WeakPolarHBondContact OG-CB 3.39Å; S65-D131 PolarHBondContact N-OD2 3.4Å; S65-D131 VanDerWaalsContact N-OD2 3.09Å; S65-D131 PolarHBondContact O-N 2.92Å; S65-D131 PolarHBondContact OG-N 3.17Å; S65-D131 PolarHBondContact OG-OD2 3.17Å; S65-I132 PolarHBondContact O-N 2.78Å
66	I	96.2	Very high	90	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.9	173.8	-61.8	177.7	0	0	0	109.3	V68 L89 F94 T95 V96 R97 I132 L134 L399	I66-V68 HydrophobicContact CG2-CG2 4.35Å; I66-L89 HydrophobicContact CD1-CD1 3.93Å; I66-F94 HydrophobicContact CD1-CB 3.72Å; I66-F94 HydrophobicContact CD1-CD1 3.7Å; I66-F94 HydrophobicContact CD1-CD2 4.08Å; I66-F94 HydrophobicContact CD1-CE1 4.26Å; I66-F94 HydrophobicContact CD1-CG 3.57Å; I66-F94 HydrophobicContact CG1-CB 4.16Å; I66-F94 HydrophobicContact CG1-CD1 3.88Å; I66-F94 HydrophobicContact CG1-CG 4.16Å; I66-T95 PolarHBondContact N-O 3.39Å; I66-V96 HydrophobicContact CB-CG2 4.4Å; I66-V96 CarbonylContact O-C 3.55Å; I66-V96 WeakPolarHBondContact O-CA 3.24Å; I66-R97 PolarHBondContact O-N 3.38Å; I66-I132 CarbonylContact C-O 3.58Å; I66-I132 VanDerWaalsContact CA-O 3.26Å; I66-I132 WeakPolarHBondContact CA-O 3.44Å; I66-I132 HydrophobicContact CG1-CB 4.38Å; I66-L134 HydrophobicContact CG2-CD1 3.53Å; I66-L134 HydrophobicContact CG2-CG 3.71Å; I66-L399 HydrophobicContact CD1-CD2 3.69Å
67	G	96.1	Very high	91.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132	174.1	0	0	0	0	0	111.9	R97 S130 I132 V133 L134	G67-R97 CarbonylContact C-O 3.44Å; G67-R97 WeakPolarHBondContact CA-O 3.42Å; G67-S130 WeakPolarHBondContact CA-OG 3.33Å; G67-S130 VanDerWaalsContact N-CB 3.34Å; G67-S130 PolarHBondContact N-OG 3.46Å; G67-I132 PolarHBondContact N-O 3.28Å; G67-V133 CarbonylContact O-C 3.6Å; G67-V133 WeakPolarHBondContact O-CA 3.49Å; G67-L134 PolarHBondContact O-N 2.93Å
68	V	96.2	Very high	92.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	93	175.8	-175	0	0	0	0	109.1	I66 V79 A80 L81 V96 R97 L98 E99 V127 L134	I66-V68 HydrophobicContact CG2-CG2 4.35Å; V68-V79 HydrophobicContact CG1-CG2 4.03Å; V68-A80 HydrophobicContact CG1-CB 4.23Å; V68-L81 HydrophobicContact CG1-CB 4.28Å; V68-L81 HydrophobicContact CG2-CB 3.89Å; V68-L81 HydrophobicContact CG2-CD2 3.9Å; V68-V96 HydrophobicContact CG2-CG1 4.47Å; V68-R97 PolarHBondContact N-O 2.91Å; V68-L98 HydrophobicContact CB-CB 4.5Å; V68-L98 HydrophobicContact CB-CD1 4.15Å; V68-L98 HydrophobicContact CB-CG 4.46Å; V68-L98 HydrophobicContact CG1-CD1 4.09Å; V68-E99 PolarHBondContact O-N 2.8Å; V68-V127 VanDerWaalsContact C-CG1 3.48Å; V68-V127 VanDerWaalsContact N-CG1 3.31Å; V68-L134 HydrophobicContact CG2-CB 4.47Å
69	P	95.1	Very high	93	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.019	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-76	162.9	178.7	33	-35.8	0	0	0	111.2	V127 Y128 V133 L134 K135	P69-V127 HydrophobicContact CB-CG1 4.24Å; P69-Y128 HydrophobicContact CB-CD2 4.35Å; P69-Y128 HydrophobicContact CB-CE1 4.23Å; P69-Y128 HydrophobicContact CB-CE2 3.61Å; P69-Y128 WeakPolarHBondContact CB-OH 3.42Å; P69-Y128 HydrophobicContact CG-CE1 3.93Å; P69-Y128 HydrophobicContact CG-CE2 4.24Å; P69-Y128 WeakPolarHBondContact CG-OH 3.26Å; P69-V133 HydrophobicContact CG-CG1 4.12Å; P69-L134 WeakPolarHBondContact CD-O 3.26Å; P69-K135 HydrophobicContact CG-CD 3.96Å; P69-K135 HydrophobicContact CG-CG 3.54Å
70	K	94.4	Very high	93.4	Very high	95 Å²	95	45.8 Å²	45.8	41%	0.413	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-74.2	140.9	170.1	-176	175.7	178.3	-176.9	0	109.7	E99 A102	K70-E99 HydrophobicContact CB-CB 4.41Å; K70-E99 VanDerWaalsContact CB-CD 3.44Å; K70-E99 HydrophobicContact CB-CG 4.22Å; K70-E99 WeakPolarHBondContact CB-OE1 3.35Å; K70-E99 WeakPolarHBondContact CB-OE2 3.26Å; K70-E99 PolarHBondContact N-OE2 2.75Å; K70-A102 HydrophobicContact CB-CB 4.06Å
71	E	94	Very high	93.7	Very high	21 Å²	21	44 Å²	44	10%	0.098	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72.4	131.9	174.6	-66	-60.2	163	0	0	111.2	E76 K135 V136	E71-E76 HydrophobicContact CB-CB 4.12Å; E71-E76 HydrophobicContact CB-CG 3.66Å; E71-E76 HydrophobicContact CG-CG 3.79Å; E71-K135 IonicContact OE1-NZ 3.06Å; E71-K135 IonicContact OE2-NZ 2.67Å; E71-K135 PolarHBondContact OE2-NZ 3.37Å; E71-V136 HydrophobicContact CG-CB 4.3Å; E71-V136 HydrophobicContact CG-CG2 4.35Å; E71-V136 PolarHBondContact OE1-N 2.91Å
72	T	92.2	Very high	93.9	Very high	95 Å²	95	43.9 Å²	43.9	58%	0.583	24%	0.235	S	C	*	.			trans	-99.1	-11	-179.3	58.5	0	0	0	0	113.1	T74 E143	T72-T74 PolarHBondContact O-N 2.92Å; T72-E143 PolarHBondContact OG1-OE1 2.89Å
73	Y	91	Very high	94	Very high	130 Å²	130	40.7 Å²	40.7	51%	0.51	21%	0.212	S	C	.	.	S	Bend	trans	-67.4	131.1	-179.5	-168.6	-87.9	0	0	0	111.5	G75 E76	Y73-G75 PolarHBondContact O-N 3.01Å; Y73-E76 WeakPolarHBondContact O-CB 3.21Å; Y73-E76 PolarHBondContact O-N 3.06Å; Y73-E76 VanDerWaalsContact O-N 3.1Å
74	T	89.3	Confident	94.1	Very high	133 Å²	133	36.3 Å²	36.3	82%	0.816	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	122.9	-177.4	-51.6	0	0	0	0	111.6	T72	T72-T74 PolarHBondContact O-N 2.92Å
75	G	87.9	Confident	94.1	Very high	42 Å²	42	36 Å²	36	43%	0.433	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	-2.3	178.8	0	0	0	0	0	115.3	Y73 Q77 S381	Y73-G75 PolarHBondContact O-N 3.01Å; G75-Q77 PolarHBondContact O-N 3.03Å; G75-S381 PolarHBondContact O-OG 3.36Å
76	E	93.8	Very high	94.1	Very high	22 Å²	22	35.3 Å²	35.3	10%	0.103	20%	0.199	C	C	.	.			trans	-74.7	122.7	172.6	-175	58.5	-99.9	0	0	110.5	E71 Y73 R78 R137	E71-E76 HydrophobicContact CB-CB 4.12Å; E71-E76 HydrophobicContact CB-CG 3.66Å; E71-E76 HydrophobicContact CG-CG 3.79Å; Y73-E76 WeakPolarHBondContact O-CB 3.21Å; Y73-E76 PolarHBondContact O-N 3.06Å; Y73-E76 VanDerWaalsContact O-N 3.1Å; E76-R78 VanDerWaalsContact OE1-CB 3.24Å; E76-R78 WeakPolarHBondContact OE1-CB 3.48Å; E76-R78 VanDerWaalsContact OE1-CG 3.3Å; E76-R78 WeakPolarHBondContact OE1-CG 3.38Å; E76-R78 IonicContact OE1-CZ 2.91Å; E76-R78 PolarHBondContact OE1-N 3.48Å; E76-R78 IonicContact OE1-NE 2.72Å; E76-R78 PolarHBondContact OE1-NE 3.03Å; E76-R78 IonicContact OE1-NH2 3.52Å; E76-R78 IonicContact OE2-CZ 3.94Å; E76-R78 IonicContact OE2-NE 3.64Å; E76-R78 PolarHBondContact OE2-NE 2.88Å; E76-R78 IonicContact OE2-NH2 3.71Å; E76-R78 PolarHBondContact OE2-NH2 2.98Å; E76-R137 WeakPolarHBondContact OE2-CD 3.46Å
77	Q	95.7	Very high	93.9	Very high	79 Å²	79	39.6 Å²	39.6	37%	0.369	22%	0.219	S	C	.	.			trans	-116.2	-8.2	-177.7	-61.3	-175.1	19.2	0	0	112.5	G75 A105 A106 S381 P384	G75-Q77 PolarHBondContact O-N 3.03Å; Q77-A105 HydrophobicContact CB-CB 3.95Å; Q77-A105 HydrophobicContact CG-CB 4.34Å; Q77-A105 CarbonylContact O-C 3.6Å; Q77-A105 WeakPolarHBondContact O-CB 3.43Å; Q77-A106 WeakPolarHBondContact O-CB 3.46Å; Q77-A106 PolarHBondContact O-N 3.06Å; Q77-A106 VanDerWaalsContact O-N 3.15Å; Q77-S381 WeakPolarHBondContact CB-OG 3.44Å; Q77-S381 PolarHBondContact N-OG 3.38Å; Q77-S381 PolarHBondContact OE1-O 3.42Å; Q77-P384 HydrophobicContact CB-CB 3.75Å; Q77-P384 HydrophobicContact CB-CG 4.11Å; Q77-P384 WeakPolarHBondContact O-CB 3.13Å
78	R	96.4	Very high	93.6	Very high	27 Å²	27	42.8 Å²	42.8	10%	0.102	24%	0.239	C	C	.	.			trans	-80.7	161.4	-179.9	-58.2	172.4	-67.7	168.9	2.1	111.2	E76 V136 M197 P384 S387 S388	E76-R78 VanDerWaalsContact OE1-CB 3.24Å; E76-R78 WeakPolarHBondContact OE1-CB 3.48Å; E76-R78 VanDerWaalsContact OE1-CG 3.3Å; E76-R78 WeakPolarHBondContact OE1-CG 3.38Å; E76-R78 IonicContact OE1-CZ 2.91Å; E76-R78 PolarHBondContact OE1-N 3.48Å; E76-R78 IonicContact OE1-NE 2.72Å; E76-R78 PolarHBondContact OE1-NE 3.03Å; E76-R78 IonicContact OE1-NH2 3.52Å; E76-R78 IonicContact OE2-CZ 3.94Å; E76-R78 IonicContact OE2-NE 3.64Å; E76-R78 PolarHBondContact OE2-NE 2.88Å; E76-R78 IonicContact OE2-NH2 3.71Å; E76-R78 PolarHBondContact OE2-NH2 2.98Å; R78-V136 HydrophobicContact CB-CG1 4.48Å; R78-V136 HydrophobicContact CB-CG2 4.27Å; R78-M197 PolarHBondContact NH1-SD 2.93Å; R78-P384 HydrophobicContact CG-CB 4.31Å; R78-S387 VanDerWaalsContact CD-CB 3.4Å; R78-S388 WeakPolarHBondContact CA-OG 3.42Å
79	V	96.6	Very high	93.5	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	24%	0.239	C	C	.	.			trans	-127.7	147.3	172.4	64.4	0	0	0	0	109.8	V68 L81 A102 A106 F108 Y113 S388	V68-V79 HydrophobicContact CG1-CG2 4.03Å; V79-L81 VanDerWaalsContact C-N 3.27Å; V79-L81 PolarHBondContact O-N 3.03Å; V79-A102 HydrophobicContact CG2-CB 4.32Å; V79-A106 HydrophobicContact CG1-CB 3.93Å; V79-F108 HydrophobicContact CG1-CD2 3.9Å; V79-F108 HydrophobicContact CG1-CE2 4.28Å; V79-Y113 WeakPolarHBondContact CG1-OH 3.44Å; V79-S388 PolarHBondContact N-OG 3.39Å; V79-S388 WeakPolarHBondContact O-CB 3.39Å; V79-S388 PolarHBondContact O-OG 3.42Å
80	A	96.4	Very high	93.4	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.017	25%	0.25	C	S	.	.	S	Bend	trans	-70.9	-20.5	-173.7	0	0	0	0	0	114.1	V68 L134 V136 Y391 A392 I395	V68-A80 HydrophobicContact CG1-CB 4.23Å; A80-L134 HydrophobicContact CB-CB 4.03Å; A80-L134 WeakPolarHBondContact CB-O 3.23Å; A80-V136 HydrophobicContact CB-CG2 4.13Å; A80-Y391 HydrophobicContact CB-CE1 4.36Å; A80-A392 WeakPolarHBondContact O-CA 3.45Å; A80-I395 HydrophobicContact CB-CD1 4.5Å
81	L	95.7	Very high	93.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.264	C	S	.	.			trans	-140.2	126.3	-175.5	-169	67.6	0	0	0	110.3	V68 V79 V85 A86 L89 V96 Y113 A392	V68-L81 HydrophobicContact CG1-CB 4.28Å; V68-L81 HydrophobicContact CG2-CB 3.89Å; V68-L81 HydrophobicContact CG2-CD2 3.9Å; V79-L81 VanDerWaalsContact C-N 3.27Å; V79-L81 PolarHBondContact O-N 3.03Å; L81-V85 HydrophobicContact CD1-CB 3.91Å; L81-V85 HydrophobicContact CD1-CG1 3.62Å; L81-A86 HydrophobicContact CD2-CB 3.62Å; L81-A86 HydrophobicContact CG-CB 3.94Å; L81-L89 HydrophobicContact CD1-CD1 3.76Å; L81-L89 HydrophobicContact CD2-CD1 4.45Å; L81-V96 HydrophobicContact CD2-CG1 3.69Å; L81-Y113 WeakPolarHBondContact O-CE1 3.33Å; L81-Y113 PolarHBondContact O-OH 2.83Å; L81-A392 HydrophobicContact CD1-CB 4.38Å
82	S	95.4	Very high	93	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.021	28%	0.28	C	S	.	.			trans	-88.9	158.8	171.6	68.9	0	0	0	0	111.3	A84 V85 A86	S82-A84 VanDerWaalsContact C-N 3.3Å; S82-A84 PolarHBondContact O-N 3.47Å; S82-V85 PolarHBondContact O-N 2.93Å; S82-V85 WeakPolarHBondContact OG-CG2 3.36Å; S82-A86 PolarHBondContact O-N 3.29Å
83	P	94.1	Very high	92.9	Very high	16 Å²	16	49 Å²	49	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-55.4	-40.3	180	-27.3	34.7	0	0	0	114	V85 A86 Q87 F108 E112 Y113 A116	P83-V85 PolarHBondContact O-N 2.95Å; P83-A86 WeakPolarHBondContact O-CB 3.49Å; P83-A86 PolarHBondContact O-N 3.16Å; P83-Q87 PolarHBondContact O-N 2.99Å; P83-F108 HydrophobicContact CG-CB 4.09Å; P83-F108 HydrophobicContact CG-CD1 3.95Å; P83-F108 HydrophobicContact CG-CG 4.11Å; P83-E112 HydrophobicContact CB-CB 4.32Å; P83-E112 HydrophobicContact CG-CB 3.98Å; P83-Y113 HydrophobicContact CB-CD1 4.41Å; P83-Y113 HydrophobicContact CB-CE1 4.5Å; P83-Y113 HydrophobicContact CG-CD1 4.01Å; P83-Y113 HydrophobicContact CG-CD2 4.49Å; P83-Y113 HydrophobicContact CG-CE1 3.82Å; P83-Y113 HydrophobicContact CG-CE2 4.31Å; P83-Y113 HydrophobicContact CG-CG 4.35Å; P83-A116 HydrophobicContact CB-CB 4.3Å; P83-A116 WeakPolarHBondContact O-CB 3.4Å
84	A	91.5	Very high	93.1	Very high	65 Å²	65	43 Å²	43	54%	0.537	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-40.2	179.5	0	0	0	0	0	113	S82 T88	S82-A84 VanDerWaalsContact C-N 3.3Å; S82-A84 PolarHBondContact O-N 3.47Å; A84-T88 PolarHBondContact O-N 3.34Å; A84-T88 PolarHBondContact O-OG1 3.33Å
85	V	93.1	Very high	93.3	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-76.2	-35.9	178	-178.6	0	0	0	0	110.7	L81 S82 P83 Q87 T88 L89 A392 N393 S396	L81-V85 HydrophobicContact CD1-CB 3.91Å; L81-V85 HydrophobicContact CD1-CG1 3.62Å; S82-V85 PolarHBondContact O-N 2.93Å; S82-V85 WeakPolarHBondContact OG-CG2 3.36Å; P83-V85 PolarHBondContact O-N 2.95Å; V85-Q87 VanDerWaalsContact C-N 3.3Å; V85-Q87 PolarHBondContact O-N 3.38Å; V85-T88 WeakPolarHBondContact O-CA 3.48Å; V85-T88 WeakPolarHBondContact O-CB 3.37Å; V85-T88 PolarHBondContact O-N 2.67Å; V85-L89 PolarHBondContact O-N 3.43Å; V85-A392 HydrophobicContact CB-CB 3.97Å; V85-A392 HydrophobicContact CG1-CB 4.19Å; V85-A392 HydrophobicContact CG2-CB 3.8Å; V85-N393 VanDerWaalsContact CG2-OD1 3.29Å; V85-N393 WeakPolarHBondContact CG2-OD1 3.47Å; V85-S396 VanDerWaalsContact CG1-OG 3.28Å; V85-S396 WeakPolarHBondContact CG1-OG 3.35Å
86	A	94.4	Very high	93.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.8	-45.2	173.4	0	0	0	0	0	111.6	L81 S82 P83 T88 L89 I90 V118	L81-A86 HydrophobicContact CD2-CB 3.62Å; L81-A86 HydrophobicContact CG-CB 3.94Å; S82-A86 PolarHBondContact O-N 3.29Å; P83-A86 WeakPolarHBondContact O-CB 3.49Å; P83-A86 PolarHBondContact O-N 3.16Å; A86-T88 PolarHBondContact O-N 3.45Å; A86-L89 PolarHBondContact O-N 3.1Å; A86-I90 VanDerWaalsContact O-CG1 3.32Å; A86-I90 WeakPolarHBondContact O-CG1 3.36Å; A86-I90 PolarHBondContact O-N 3.49Å; A86-V118 HydrophobicContact CB-CG2 3.59Å
87	Q	92.6	Very high	93.7	Very high	89 Å²	89	41 Å²	41	42%	0.416	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-37.4	175.1	-165.8	-173.2	35.8	0	0	112	P83 V85 K91 A116	P83-Q87 PolarHBondContact O-N 2.99Å; V85-Q87 VanDerWaalsContact C-N 3.3Å; V85-Q87 PolarHBondContact O-N 3.38Å; Q87-K91 WeakPolarHBondContact O-CB 3.46Å; Q87-K91 VanDerWaalsContact O-CG 3.29Å; Q87-K91 WeakPolarHBondContact O-CG 3.43Å; Q87-K91 PolarHBondContact O-N 3.22Å; Q87-A116 HydrophobicContact CB-CB 4.33Å
88	T	90.6	Very high	93.7	Very high	68 Å²	68	37.2 Å²	37.2	42%	0.417	20%	0.196	S	C	.	.	H	α-helix	trans	-67.8	-43.6	177.8	-57.7	0	0	0	0	111.7	A84 V85 A86 K91 K92	A84-T88 PolarHBondContact O-N 3.34Å; A84-T88 PolarHBondContact O-OG1 3.33Å; V85-T88 WeakPolarHBondContact O-CA 3.48Å; V85-T88 WeakPolarHBondContact O-CB 3.37Å; V85-T88 PolarHBondContact O-N 2.67Å; A86-T88 PolarHBondContact O-N 3.45Å; T88-K91 PolarHBondContact O-N 3.11Å; T88-K92 WeakPolarHBondContact O-CG 3.21Å; T88-K92 PolarHBondContact O-N 3.42Å; T88-K92 VanDerWaalsContact O-N 3.12Å
89	L	92.7	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-38.5	177.5	-67.1	177.1	0	0	0	112.2	I66 L81 V85 A86 K92 G93 F94 L399 L400	I66-L89 HydrophobicContact CD1-CD1 3.93Å; L81-L89 HydrophobicContact CD1-CD1 3.76Å; L81-L89 HydrophobicContact CD2-CD1 4.45Å; V85-L89 PolarHBondContact O-N 3.43Å; A86-L89 PolarHBondContact O-N 3.1Å; L89-K92 WeakPolarHBondContact O-CB 3.49Å; L89-K92 PolarHBondContact O-N 3.3Å; L89-K92 VanDerWaalsContact O-N 3.17Å; L89-G93 PolarHBondContact O-N 3.19Å; L89-F94 HydrophobicContact CB-CD2 4.28Å; L89-F94 HydrophobicContact CD2-CD2 4.26Å; L89-F94 HydrophobicContact CD2-CE2 4.36Å; L89-F94 PolarHBondContact O-N 3.2Å; L89-F94 VanDerWaalsContact O-N 3.17Å; L89-L399 HydrophobicContact CD2-CD2 4.26Å; L89-L400 HydrophobicContact CD2-CD1 4.49Å; L89-L400 HydrophobicContact CD2-CG 4.39Å
90	I	93.7	Very high	93.5	Very high	52 Å²	52	41.9 Å²	41.9	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-64.3	-43.8	174.6	-67.3	162.1	0	0	0	110.5	A86 K92 G93 V96 A116 G117 V118	A86-I90 VanDerWaalsContact O-CG1 3.32Å; A86-I90 WeakPolarHBondContact O-CG1 3.36Å; A86-I90 PolarHBondContact O-N 3.49Å; I90-K92 PolarHBondContact O-N 3.16Å; I90-G93 WeakPolarHBondContact O-CA 3.24Å; I90-G93 PolarHBondContact O-N 3.09Å; I90-V96 HydrophobicContact CD1-CB 4.44Å; I90-V96 HydrophobicContact CD1-CG2 4.28Å; I90-V96 HydrophobicContact CG1-CB 4.36Å; I90-V96 HydrophobicContact CG1-CG2 3.78Å; I90-A116 VanDerWaalsContact CD1-O 3.26Å; I90-A116 WeakPolarHBondContact CD1-O 3.31Å; I90-G117 VanDerWaalsContact CD1-C 3.45Å; I90-G117 WeakPolarHBondContact CD1-O 3.44Å; I90-V118 HydrophobicContact CD1-CG2 4.03Å
91	K	91	Very high	93.3	Very high	160 Å²	160	45.6 Å²	45.6	70%	0.696	24%	0.237	S	C	*	.	H	α-helix	trans	-59.9	-27.5	173.9	-78.2	176.7	179.5	177.8	0	113.1	Q87 T88	Q87-K91 WeakPolarHBondContact O-CB 3.46Å; Q87-K91 VanDerWaalsContact O-CG 3.29Å; Q87-K91 WeakPolarHBondContact O-CG 3.43Å; Q87-K91 PolarHBondContact O-N 3.22Å; T88-K91 PolarHBondContact O-N 3.11Å
92	K	88.9	Confident	93.2	Very high	102 Å²	102	45.9 Å²	45.9	44%	0.443	24%	0.24	S	C	.	.	H	α-helix	trans	-80.5	-14.3	173.6	-70.2	-67.2	-172.1	-179.9	0	113.7	Y61 T88 L89 I90 L400	Y61-K92 HydrophobicContact CD2-CB 4.39Å; T88-K92 WeakPolarHBondContact O-CG 3.21Å; T88-K92 PolarHBondContact O-N 3.42Å; T88-K92 VanDerWaalsContact O-N 3.12Å; L89-K92 WeakPolarHBondContact O-CB 3.49Å; L89-K92 PolarHBondContact O-N 3.3Å; L89-K92 VanDerWaalsContact O-N 3.17Å; I90-K92 PolarHBondContact O-N 3.16Å; K92-L400 HydrophobicContact CB-CD2 4.3Å; K92-L400 HydrophobicContact CG-CD1 4.37Å; K92-L400 HydrophobicContact CG-CD2 4.06Å
93	G	91.2	Very high	93	Very high	29 Å²	29	45.7 Å²	45.7	30%	0.299	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	120.4	-8.2	172.2	0	0	0	0	0	115.4	S62 L89 I90	S62-G93 VanDerWaalsContact CA-O 3.26Å; S62-G93 WeakPolarHBondContact CA-O 3.06Å; L89-G93 PolarHBondContact O-N 3.19Å; I90-G93 WeakPolarHBondContact O-CA 3.24Å; I90-G93 PolarHBondContact O-N 3.09Å
94	F	93.4	Very high	93	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.018	25%	0.25	C	S	.	.			trans	-69.9	146.1	-178.7	-67.5	-81.2	0	0	0	112.5	Y61 L64 I66 L89 I132 L399 L400	Y61-F94 AromaticContact CD1-CE1 3.63Å; Y61-F94 HydrophobicContact CD1-CE1 3.63Å; Y61-F94 AromaticContact CD1-CE2 3.74Å; Y61-F94 HydrophobicContact CD1-CE2 3.74Å; Y61-F94 AromaticContact CD1-CZ 3.12Å; Y61-F94 HydrophobicContact CD1-CZ 3.12Å; Y61-F94 AromaticContact CD2-CE2 3.8Å; Y61-F94 HydrophobicContact CD2-CE2 3.8Å; Y61-F94 HydrophobicContact CD2-CZ 4.08Å; Y61-F94 HydrophobicContact CE1-CE1 4.32Å; Y61-F94 HydrophobicContact CE1-CE2 4.11Å; Y61-F94 AromaticContact CE1-CZ 3.5Å; Y61-F94 HydrophobicContact CE1-CZ 3.5Å; Y61-F94 VanDerWaalsContact CE1-CZ 3.5Å; Y61-F94 HydrophobicContact CE2-CE2 4.19Å; Y61-F94 HydrophobicContact CE2-CZ 4.39Å; Y61-F94 HydrophobicContact CG-CD2 4.24Å; Y61-F94 HydrophobicContact CG-CE1 4.01Å; Y61-F94 AromaticContact CG-CE2 3.56Å; Y61-F94 HydrophobicContact CG-CE2 3.56Å; Y61-F94 AromaticContact CG-CZ 3.45Å; Y61-F94 HydrophobicContact CG-CZ 3.45Å; Y61-F94 VanDerWaalsContact CG-CZ 3.45Å; L64-F94 HydrophobicContact CB-CD1 4.01Å; L64-F94 HydrophobicContact CB-CE1 4.07Å; L64-F94 HydrophobicContact CD1-CE1 4.18Å; I66-F94 HydrophobicContact CD1-CB 3.72Å; I66-F94 HydrophobicContact CD1-CD1 3.7Å; I66-F94 HydrophobicContact CD1-CD2 4.08Å; I66-F94 HydrophobicContact CD1-CE1 4.26Å; I66-F94 HydrophobicContact CD1-CG 3.57Å; I66-F94 HydrophobicContact CG1-CB 4.16Å; I66-F94 HydrophobicContact CG1-CD1 3.88Å; I66-F94 HydrophobicContact CG1-CG 4.16Å; L89-F94 HydrophobicContact CB-CD2 4.28Å; L89-F94 HydrophobicContact CD2-CD2 4.26Å; L89-F94 HydrophobicContact CD2-CE2 4.36Å; L89-F94 PolarHBondContact O-N 3.2Å; L89-F94 VanDerWaalsContact O-N 3.17Å; F94-I132 HydrophobicContact CE1-CD1 4.23Å; F94-L399 HydrophobicContact CE2-CD2 4.3Å; F94-L399 HydrophobicContact CZ-CD1 4.49Å; F94-L399 HydrophobicContact CZ-CD2 4.09Å; F94-L399 HydrophobicContact CZ-CG 4.21Å; F94-L400 HydrophobicContact CE2-CD2 4.12Å
95	T	94.3	Very high	93.1	Very high	60 Å²	60	46.5 Å²	46.5	37%	0.368	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116	166.5	-60.4	0	0	0	0	109.6	L64 S65 I66	L64-T95 PolarHBondContact O-N 3.3Å; S65-T95 CarbonylContact C-O 3.48Å; S65-T95 VanDerWaalsContact CA-O 3.24Å; S65-T95 WeakPolarHBondContact CA-O 3.41Å; I66-T95 PolarHBondContact N-O 3.39Å
96	V	95.5	Very high	93.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.8	-178	-173.6	0	0	0	0	110.6	I66 V68 L81 I90 V118 N119	I66-V96 HydrophobicContact CB-CG2 4.4Å; I66-V96 CarbonylContact O-C 3.55Å; I66-V96 WeakPolarHBondContact O-CA 3.24Å; V68-V96 HydrophobicContact CG2-CG1 4.47Å; L81-V96 HydrophobicContact CD2-CG1 3.69Å; I90-V96 HydrophobicContact CD1-CB 4.44Å; I90-V96 HydrophobicContact CD1-CG2 4.28Å; I90-V96 HydrophobicContact CG1-CB 4.36Å; I90-V96 HydrophobicContact CG1-CG2 3.78Å; V96-V118 HydrophobicContact CB-CG1 4.33Å; V96-V118 HydrophobicContact CB-CG2 4.28Å; V96-V118 HydrophobicContact CG1-CG1 3.93Å; V96-V118 HydrophobicContact CG1-CG2 4.15Å; V96-N119 PolarHBondContact O-N 3.18Å
97	R	95.2	Very high	93.2	Very high	94 Å²	94	53.8 Å²	53.8	36%	0.355	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130	173.6	-63.4	-179.2	-177	174.5	2.7	109.7	I66 G67 V68 N119	I66-R97 PolarHBondContact O-N 3.38Å; G67-R97 CarbonylContact C-O 3.44Å; G67-R97 WeakPolarHBondContact CA-O 3.42Å; V68-R97 PolarHBondContact N-O 2.91Å; R97-N119 CarbonylContact C-O 3.54Å; R97-N119 VanDerWaalsContact CA-O 3.24Å; R97-N119 WeakPolarHBondContact CA-O 3.49Å; R97-N119 HydrophobicContact CG-CB 4.34Å
98	L	95.2	Very high	93.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.8	-178.3	179.7	134.4	0	0	0	110.5	V68 A102 Y113 V118 N119 L120 S121	V68-L98 HydrophobicContact CB-CB 4.5Å; V68-L98 HydrophobicContact CB-CD1 4.15Å; V68-L98 HydrophobicContact CB-CG 4.46Å; V68-L98 HydrophobicContact CG1-CD1 4.09Å; L98-A102 HydrophobicContact CD1-CB 4.38Å; L98-A102 HydrophobicContact CD2-CB 4.13Å; L98-A102 HydrophobicContact CG-CB 4.06Å; L98-Y113 HydrophobicContact CD1-CD1 3.78Å; L98-Y113 HydrophobicContact CD1-CD2 4.24Å; L98-Y113 HydrophobicContact CD1-CE1 3.6Å; L98-Y113 HydrophobicContact CD1-CE2 4.08Å; L98-Y113 HydrophobicContact CD1-CG 4.1Å; L98-Y113 HydrophobicContact CD2-CD2 4.07Å; L98-Y113 HydrophobicContact CD2-CE2 4.4Å; L98-Y113 HydrophobicContact CD2-CG 4.25Å; L98-V118 HydrophobicContact CB-CG1 3.53Å; L98-N119 PolarHBondContact N-O 2.98Å; L98-L120 HydrophobicContact CB-CD2 4.39Å; L98-L120 HydrophobicContact CD2-CD2 3.51Å; L98-L120 WeakPolarHBondContact O-CA 3.37Å; L98-S121 PolarHBondContact O-N 3.08Å
99	E	95	Very high	93.4	Very high	34 Å²	34	48.7 Å²	48.7	16%	0.159	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.6	172.8	-174.6	-178	155.9	0	0	109.7	V68 K70 N101 A102 V127	V68-E99 PolarHBondContact O-N 2.8Å; K70-E99 HydrophobicContact CB-CB 4.41Å; K70-E99 VanDerWaalsContact CB-CD 3.44Å; K70-E99 HydrophobicContact CB-CG 4.22Å; K70-E99 WeakPolarHBondContact CB-OE1 3.35Å; K70-E99 WeakPolarHBondContact CB-OE2 3.26Å; K70-E99 PolarHBondContact N-OE2 2.75Å; E99-N101 PolarHBondContact O-N 3.42Å; E99-A102 HydrophobicContact CB-CB 4.41Å; E99-A102 WeakPolarHBondContact O-CB 3.18Å; E99-A102 PolarHBondContact O-N 2.75Å; E99-V127 HydrophobicContact CB-CG2 4.1Å
100	K	92.8	Very high	93.5	Very high	94 Å²	94	50 Å²	50	41%	0.409	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	134.8	-179.3	-164.4	175.3	-178.8	173.8	0	111.7	A102 D110 S121 D122	K100-A102 VanDerWaalsContact C-N 3.26Å; K100-A102 PolarHBondContact O-N 2.74Å; K100-D110 WeakPolarHBondContact CG-OD2 3.36Å; K100-S121 PolarHBondContact N-O 2.97Å; K100-D122 WeakPolarHBondContact CD-OD1 3.47Å; K100-D122 IonicContact NZ-OD1 3.52Å; K100-D122 PolarHBondContact NZ-OD1 3.19Å
101	N	93	Very high	93.5	Very high	79 Å²	79	51.4 Å²	51.4	42%	0.422	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	17.2	-173.7	-55.8	-73.9	0	0	0	116.2	E99 G103 S104 D110	E99-N101 PolarHBondContact O-N 3.42Å; N101-G103 VanDerWaalsContact C-N 3.28Å; N101-G103 PolarHBondContact O-N 3.22Å; N101-S104 WeakPolarHBondContact CA-OG 3.48Å; N101-S104 WeakPolarHBondContact CB-OG 3.49Å; N101-S104 PolarHBondContact O-N 3.3Å; N101-S104 PolarHBondContact OD1-OG 2.76Å; N101-D110 WeakPolarHBondContact CA-OD1 3.34Å; N101-D110 PolarHBondContact N-OD1 3.47Å; N101-D110 PolarHBondContact N-OD2 2.87Å; N101-D110 VanDerWaalsContact N-OD2 3.1Å
102	A	93	Very high	93.6	Very high	8 Å²	8	48.2 Å²	48.2	7%	0.066	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-35.5	175.7	0	0	0	0	0	112.6	K70 V79 L98 E99 K100	K70-A102 HydrophobicContact CB-CB 4.06Å; V79-A102 HydrophobicContact CG2-CB 4.32Å; L98-A102 HydrophobicContact CD1-CB 4.38Å; L98-A102 HydrophobicContact CD2-CB 4.13Å; L98-A102 HydrophobicContact CG-CB 4.06Å; E99-A102 HydrophobicContact CB-CB 4.41Å; E99-A102 WeakPolarHBondContact O-CB 3.18Å; E99-A102 PolarHBondContact O-N 2.75Å; K100-A102 VanDerWaalsContact C-N 3.26Å; K100-A102 PolarHBondContact O-N 2.74Å
103	G	92.6	Very high	93.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-6	-178.8	0	0	0	0	0	115.9	N101 A105 A106 K107 F108	N101-G103 VanDerWaalsContact C-N 3.28Å; N101-G103 PolarHBondContact O-N 3.22Å; G103-A105 VanDerWaalsContact C-N 3.31Å; G103-A105 PolarHBondContact O-N 3.13Å; G103-A106 CarbonylContact O-C 3.53Å; G103-A106 WeakPolarHBondContact O-CA 3.5Å; G103-A106 PolarHBondContact O-N 3.01Å; G103-K107 PolarHBondContact O-N 3.36Å; G103-F108 CarbonylContact C-O 3.59Å; G103-F108 PolarHBondContact O-N 3.43Å
104	S	93.5	Very high	93.9	Very high	50 Å²	50	44.6 Å²	44.6	35%	0.35	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-35.8	-169.2	-56.8	0	0	0	0	113.2	N101 K107	N101-S104 WeakPolarHBondContact CA-OG 3.48Å; N101-S104 WeakPolarHBondContact CB-OG 3.49Å; N101-S104 PolarHBondContact O-N 3.3Å; N101-S104 PolarHBondContact OD1-OG 2.76Å; S104-K107 PolarHBondContact O-N 2.84Å
105	A	93.4	Very high	93.9	Very high	47 Å²	47	48.6 Å²	48.6	39%	0.388	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-33.1	175.5	0	0	0	0	0	112.5	Q77 G103 K107	Q77-A105 HydrophobicContact CB-CB 3.95Å; Q77-A105 HydrophobicContact CG-CB 4.34Å; Q77-A105 CarbonylContact O-C 3.6Å; Q77-A105 WeakPolarHBondContact O-CB 3.43Å; G103-A105 VanDerWaalsContact C-N 3.31Å; G103-A105 PolarHBondContact O-N 3.13Å; A105-K107 PolarHBondContact O-N 3.32Å
106	A	94.4	Very high	93.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	5.1	174.8	0	0	0	0	0	113.9	Q77 V79 G103 F108 P384 T385	Q77-A106 WeakPolarHBondContact O-CB 3.46Å; Q77-A106 PolarHBondContact O-N 3.06Å; Q77-A106 VanDerWaalsContact O-N 3.15Å; V79-A106 HydrophobicContact CG1-CB 3.93Å; G103-A106 CarbonylContact O-C 3.53Å; G103-A106 WeakPolarHBondContact O-CA 3.5Å; G103-A106 PolarHBondContact O-N 3.01Å; A106-F108 VanDerWaalsContact C-N 3.34Å; A106-F108 HydrophobicContact CB-CD2 3.84Å; A106-F108 HydrophobicContact CB-CE2 4.08Å; A106-P384 HydrophobicContact CB-CB 4.25Å; A106-T385 WeakPolarHBondContact O-CB 3.48Å; A106-T385 PolarHBondContact O-OG1 3.26Å
107	K	94.9	Very high	93.6	Very high	159 Å²	159	48.4 Å²	48.4	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	30.8	-177.4	-51.5	-62.2	-177.4	-178.7	0	114.3	G103 S104 A105	G103-K107 PolarHBondContact O-N 3.36Å; S104-K107 PolarHBondContact O-N 2.84Å; A105-K107 PolarHBondContact O-N 3.32Å
108	F	94.6	Very high	93.4	Very high	21 Å²	21	44.3 Å²	44.3	9%	0.092	28%	0.282	C	S	.	.			trans	-106.9	114	167.7	-59.6	-57.7	0	0	0	109.5	V79 P83 G103 A106 Y113 T385	V79-F108 HydrophobicContact CG1-CD2 3.9Å; V79-F108 HydrophobicContact CG1-CE2 4.28Å; P83-F108 HydrophobicContact CG-CB 4.09Å; P83-F108 HydrophobicContact CG-CD1 3.95Å; P83-F108 HydrophobicContact CG-CG 4.11Å; G103-F108 CarbonylContact C-O 3.59Å; G103-F108 PolarHBondContact O-N 3.43Å; A106-F108 VanDerWaalsContact C-N 3.34Å; A106-F108 HydrophobicContact CB-CD2 3.84Å; A106-F108 HydrophobicContact CB-CE2 4.08Å; F108-Y113 HydrophobicContact CB-CE2 3.6Å; F108-T385 HydrophobicContact CE1-CG2 3.97Å; F108-T385 HydrophobicContact CE2-CG2 4.4Å; F108-T385 HydrophobicContact CZ-CG2 3.66Å
109	G	93.7	Very high	93.4	Very high	29 Å²	29	48.5 Å²	48.5	30%	0.299	30%	0.304	S	S	.	.			trans	-74	149.9	179.1	0	0	0	0	0	112.7	A111 E112 Y113	G109-A111 PolarHBondContact O-N 3.13Å; G109-A111 VanDerWaalsContact O-N 3.16Å; G109-E112 PolarHBondContact N-OE1 3.26Å; G109-E112 WeakPolarHBondContact O-CB 3.45Å; G109-E112 PolarHBondContact O-N 3Å; G109-Y113 WeakPolarHBondContact O-CD2 3.47Å; G109-Y113 PolarHBondContact O-N 3.14Å
110	D	94.3	Very high	93.3	Very high	28 Å²	28	50.3 Å²	50.3	15%	0.15	31%	0.314	C	S	.	.	H	α-helix	trans	-55.9	-32.3	175	-74.9	-7.1	0	0	0	112.4	K100 N101 E112 Y113 A114 L120	K100-D110 WeakPolarHBondContact CG-OD2 3.36Å; N101-D110 WeakPolarHBondContact CA-OD1 3.34Å; N101-D110 PolarHBondContact N-OD1 3.47Å; N101-D110 PolarHBondContact N-OD2 2.87Å; N101-D110 VanDerWaalsContact N-OD2 3.1Å; D110-E112 VanDerWaalsContact C-N 3.33Å; D110-E112 PolarHBondContact O-N 2.77Å; D110-Y113 PolarHBondContact O-N 2.74Å; D110-A114 PolarHBondContact O-N 3.46Å; D110-L120 HydrophobicContact CB-CD1 3.82Å; D110-L120 HydrophobicContact CB-CD2 4.38Å
111	A	93.2	Very high	93.1	Very high	80 Å²	80	46.9 Å²	46.9	66%	0.661	30%	0.302	S	S	*	.	H	α-helix	trans	-63.5	-34.9	175.1	0	0	0	0	0	113.1	G109 A114 A115	G109-A111 PolarHBondContact O-N 3.13Å; G109-A111 VanDerWaalsContact O-N 3.16Å; A111-A114 PolarHBondContact O-N 3.41Å; A111-A115 WeakPolarHBondContact O-CB 3.44Å; A111-A115 PolarHBondContact O-N 3.43Å
112	E	93.2	Very high	92.9	Very high	94 Å²	94	49.1 Å²	49.1	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-69.8	-39.1	176.3	-64.5	170.5	-118.8	0	0	111	P83 G109 D110 A115 A116	P83-E112 HydrophobicContact CB-CB 4.32Å; P83-E112 HydrophobicContact CG-CB 3.98Å; G109-E112 PolarHBondContact N-OE1 3.26Å; G109-E112 WeakPolarHBondContact O-CB 3.45Å; G109-E112 PolarHBondContact O-N 3Å; D110-E112 VanDerWaalsContact C-N 3.33Å; D110-E112 PolarHBondContact O-N 2.77Å; E112-A115 PolarHBondContact O-N 3.4Å; E112-A116 WeakPolarHBondContact O-CB 3.45Å; E112-A116 PolarHBondContact O-N 3.5Å
113	Y	94.9	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-44	173.2	-74.3	-70	0	0	0	111.9	V79 L81 P83 L98 F108 G109 D110 A115 A116 G117 V118	V79-Y113 WeakPolarHBondContact CG1-OH 3.44Å; L81-Y113 WeakPolarHBondContact O-CE1 3.33Å; L81-Y113 PolarHBondContact O-OH 2.83Å; P83-Y113 HydrophobicContact CB-CD1 4.41Å; P83-Y113 HydrophobicContact CB-CE1 4.5Å; P83-Y113 HydrophobicContact CG-CD1 4.01Å; P83-Y113 HydrophobicContact CG-CD2 4.49Å; P83-Y113 HydrophobicContact CG-CE1 3.82Å; P83-Y113 HydrophobicContact CG-CE2 4.31Å; P83-Y113 HydrophobicContact CG-CG 4.35Å; L98-Y113 HydrophobicContact CD1-CD1 3.78Å; L98-Y113 HydrophobicContact CD1-CD2 4.24Å; L98-Y113 HydrophobicContact CD1-CE1 3.6Å; L98-Y113 HydrophobicContact CD1-CE2 4.08Å; L98-Y113 HydrophobicContact CD1-CG 4.1Å; L98-Y113 HydrophobicContact CD2-CD2 4.07Å; L98-Y113 HydrophobicContact CD2-CE2 4.4Å; L98-Y113 HydrophobicContact CD2-CG 4.25Å; F108-Y113 HydrophobicContact CB-CE2 3.6Å; G109-Y113 WeakPolarHBondContact O-CD2 3.47Å; G109-Y113 PolarHBondContact O-N 3.14Å; D110-Y113 PolarHBondContact O-N 2.74Å; Y113-A115 VanDerWaalsContact C-N 3.33Å; Y113-A115 PolarHBondContact O-N 2.99Å; Y113-A116 PolarHBondContact O-N 3.01Å; Y113-A116 VanDerWaalsContact O-N 3.14Å; Y113-G117 PolarHBondContact O-N 3.26Å; Y113-V118 HydrophobicContact CD1-CG2 4.2Å; Y113-V118 WeakPolarHBondContact O-CB 3.46Å; Y113-V118 PolarHBondContact O-N 3.02Å
114	A	92.8	Very high	92.4	Very high	54 Å²	54	53 Å²	53	45%	0.446	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-43	175.7	0	0	0	0	0	111.5	D110 A111 A116 G117 L120	D110-A114 PolarHBondContact O-N 3.46Å; A111-A114 PolarHBondContact O-N 3.41Å; A114-A116 VanDerWaalsContact C-N 3.28Å; A114-A116 PolarHBondContact O-N 2.96Å; A114-G117 PolarHBondContact O-N 3.35Å; A114-L120 HydrophobicContact CB-CD1 4.4Å
115	A	92	Very high	92.1	Very high	89 Å²	89	54.6 Å²	54.6	74%	0.736	35%	0.345	S	S	*	.	H	α-helix	trans	-64.7	-29.9	175.5	0	0	0	0	0	113.2	A111 E112 Y113 G117	A111-A115 WeakPolarHBondContact O-CB 3.44Å; A111-A115 PolarHBondContact O-N 3.43Å; E112-A115 PolarHBondContact O-N 3.4Å; Y113-A115 VanDerWaalsContact C-N 3.33Å; Y113-A115 PolarHBondContact O-N 2.99Å; A115-G117 PolarHBondContact O-N 3.46Å
116	A	90.9	Very high	91.8	Very high	15 Å²	15	54 Å²	54	12%	0.124	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.6	173.4	0	0	0	0	0	113.7	P83 Q87 I90 E112 Y113 A114	P83-A116 HydrophobicContact CB-CB 4.3Å; P83-A116 WeakPolarHBondContact O-CB 3.4Å; Q87-A116 HydrophobicContact CB-CB 4.33Å; I90-A116 VanDerWaalsContact CD1-O 3.26Å; I90-A116 WeakPolarHBondContact CD1-O 3.31Å; E112-A116 WeakPolarHBondContact O-CB 3.45Å; E112-A116 PolarHBondContact O-N 3.5Å; Y113-A116 PolarHBondContact O-N 3.01Å; Y113-A116 VanDerWaalsContact O-N 3.14Å; A114-A116 VanDerWaalsContact C-N 3.28Å; A114-A116 PolarHBondContact O-N 2.96Å
117	G	92.1	Very high	91.7	Very high	42 Å²	42	54 Å²	54	43%	0.433	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	16.5	179.8	0	0	0	0	0	115	I90 Y113 A114 A115	I90-G117 VanDerWaalsContact CD1-C 3.45Å; I90-G117 WeakPolarHBondContact CD1-O 3.44Å; Y113-G117 PolarHBondContact O-N 3.26Å; A114-G117 PolarHBondContact O-N 3.35Å; A115-G117 PolarHBondContact O-N 3.46Å
118	V	93	Very high	91.6	Very high	8 Å²	8	46.6 Å²	46.6	5%	0.048	31%	0.307	C	S	.	.			trans	-83.4	137.3	-179.7	179	0	0	0	0	111.1	A86 I90 V96 L98 Y113 L120	A86-V118 HydrophobicContact CB-CG2 3.59Å; I90-V118 HydrophobicContact CD1-CG2 4.03Å; V96-V118 HydrophobicContact CB-CG1 4.33Å; V96-V118 HydrophobicContact CB-CG2 4.28Å; V96-V118 HydrophobicContact CG1-CG1 3.93Å; V96-V118 HydrophobicContact CG1-CG2 4.15Å; L98-V118 HydrophobicContact CB-CG1 3.53Å; Y113-V118 HydrophobicContact CD1-CG2 4.2Å; Y113-V118 WeakPolarHBondContact O-CB 3.46Å; Y113-V118 PolarHBondContact O-N 3.02Å; V118-L120 PolarHBondContact O-N 3.24Å
119	N	93.3	Very high	91.5	Very high	88 Å²	88	48 Å²	48	47%	0.471	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.6	175	-63.4	-57.5	0	0	0	110.5	V96 R97 L98	V96-N119 PolarHBondContact O-N 3.18Å; R97-N119 CarbonylContact C-O 3.54Å; R97-N119 VanDerWaalsContact CA-O 3.24Å; R97-N119 WeakPolarHBondContact CA-O 3.49Å; R97-N119 HydrophobicContact CG-CB 4.34Å; L98-N119 PolarHBondContact N-O 2.98Å
120	L	93.1	Very high	91.5	Very high	71 Å²	71	46.7 Å²	46.7	37%	0.372	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.1	176.4	-60.7	171.2	0	0	0	110.6	L98 D110 A114 V118	L98-L120 HydrophobicContact CB-CD2 4.39Å; L98-L120 HydrophobicContact CD2-CD2 3.51Å; L98-L120 WeakPolarHBondContact O-CA 3.37Å; D110-L120 HydrophobicContact CB-CD1 3.82Å; D110-L120 HydrophobicContact CB-CD2 4.38Å; A114-L120 HydrophobicContact CB-CD1 4.4Å; V118-L120 PolarHBondContact O-N 3.24Å
121	S	90.1	Very high	91.4	Very high	22 Å²	22	47.1 Å²	47.1	15%	0.154	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.6	177.3	179.1	0	0	0	0	110.9	L98 K100 S123	L98-S121 PolarHBondContact O-N 3.08Å; K100-S121 PolarHBondContact N-O 2.97Å; S121-S123 VanDerWaalsContact C-N 3.33Å; S121-S123 PolarHBondContact OG-N 3.34Å; S121-S123 PolarHBondContact OG-O 2.96Å
122	D	87.7	Confident	91.5	Very high	126 Å²	126	43.3 Å²	43.3	67%	0.674	28%	0.277	S	S	*	.	S	Bend	trans	-76.2	-22.2	171.2	-66.2	-60.3	0	0	0	112.2	K100 P124	K100-D122 WeakPolarHBondContact CD-OD1 3.47Å; K100-D122 IonicContact NZ-OD1 3.52Å; K100-D122 PolarHBondContact NZ-OD1 3.19Å; D122-P124 WeakPolarHBondContact O-CD 3.21Å
123	S	87.8	Confident	91.7	Very high	51 Å²	51	38.9 Å²	38.9	36%	0.357	26%	0.256	S	S	.	.			trans	-93.5	117.8	178.8	175	0	0	0	0	110.4	S121 D125 A126	S121-S123 VanDerWaalsContact C-N 3.33Å; S121-S123 PolarHBondContact OG-N 3.34Å; S121-S123 PolarHBondContact OG-O 2.96Å; S123-D125 PolarHBondContact O-N 3.49Å; S123-D125 PolarHBondContact OG-N 3.23Å; S123-A126 PolarHBondContact O-N 3.07Å; S123-A126 PolarHBondContact OG-N 3.2Å
124	P	87.2	Confident	91.8	Very high	39 Å²	39	38.9 Å²	38.9	25%	0.253	26%	0.256	S	S	.	.	H	α-helix	trans	-58.6	-37.1	172	-24.6	34.5	0	0	0	111.9	D122 A126 V127 Y128	D122-P124 WeakPolarHBondContact O-CD 3.21Å; P124-A126 VanDerWaalsContact C-N 3.29Å; P124-A126 PolarHBondContact O-N 3.04Å; P124-V127 WeakPolarHBondContact O-CB 3.46Å; P124-V127 PolarHBondContact O-N 2.97Å; P124-Y128 VanDerWaalsContact O-CD2 3.26Å; P124-Y128 WeakPolarHBondContact O-CD2 3.26Å; P124-Y128 PolarHBondContact O-N 3.41Å
125	D	87.6	Confident	92	Very high	84 Å²	84	36.3 Å²	36.3	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-64.8	-35.2	-177.5	-56.3	-24.9	0	0	0	111.4	S123 V127 Y128 S129 K146	S123-D125 PolarHBondContact O-N 3.49Å; S123-D125 PolarHBondContact OG-N 3.23Å; D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 PolarHBondContact O-N 3.23Å; D125-Y128 PolarHBondContact O-N 2.92Å; D125-S129 WeakPolarHBondContact O-CB 3.47Å; D125-S129 PolarHBondContact O-N 3.37Å; D125-K146 WeakPolarHBondContact OD1-CD 3.5Å; D125-K146 VanDerWaalsContact OD1-CE 3.26Å; D125-K146 WeakPolarHBondContact OD1-CE 3.17Å; D125-K146 IonicContact OD1-NZ 3.02Å; D125-K146 PolarHBondContact OD1-NZ 2.85Å
126	A	87.9	Confident	92.2	Very high	34 Å²	34	32.1 Å²	32.1	28%	0.281	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-29.9	173.9	0	0	0	0	0	112.8	S123 P124 S129	S123-A126 PolarHBondContact O-N 3.07Å; S123-A126 PolarHBondContact OG-N 3.2Å; P124-A126 VanDerWaalsContact C-N 3.29Å; P124-A126 PolarHBondContact O-N 3.04Å; A126-S129 PolarHBondContact O-OG 2.85Å
127	V	92.6	Very high	92.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-75.7	-45.7	175.6	-177.7	0	0	0	0	110.6	V68 P69 E99 P124 D125 S129 S130	V68-V127 VanDerWaalsContact C-CG1 3.48Å; V68-V127 VanDerWaalsContact N-CG1 3.31Å; P69-V127 HydrophobicContact CB-CG1 4.24Å; E99-V127 HydrophobicContact CB-CG2 4.1Å; P124-V127 WeakPolarHBondContact O-CB 3.46Å; P124-V127 PolarHBondContact O-N 2.97Å; D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 PolarHBondContact O-N 3.23Å; V127-S129 PolarHBondContact O-N 2.99Å; V127-S130 VanDerWaalsContact O-CB 3.31Å; V127-S130 WeakPolarHBondContact O-CB 3.26Å; V127-S130 PolarHBondContact O-N 2.64Å; V127-S130 PolarHBondContact O-OG 3.22Å
128	Y	92.5	Very high	92.3	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-22.1	175.7	-80.2	-73.4	0	0	0	113.9	P69 P124 D125 S130 V133 K135 E143 K146 F147	P69-Y128 HydrophobicContact CB-CD2 4.35Å; P69-Y128 HydrophobicContact CB-CE1 4.23Å; P69-Y128 HydrophobicContact CB-CE2 3.61Å; P69-Y128 WeakPolarHBondContact CB-OH 3.42Å; P69-Y128 HydrophobicContact CG-CE1 3.93Å; P69-Y128 HydrophobicContact CG-CE2 4.24Å; P69-Y128 WeakPolarHBondContact CG-OH 3.26Å; P124-Y128 VanDerWaalsContact O-CD2 3.26Å; P124-Y128 WeakPolarHBondContact O-CD2 3.26Å; P124-Y128 PolarHBondContact O-N 3.41Å; D125-Y128 PolarHBondContact O-N 2.92Å; Y128-S130 PolarHBondContact O-N 3.1Å; Y128-V133 HydrophobicContact CD1-CG1 4.31Å; Y128-V133 HydrophobicContact CE1-CG1 4.33Å; Y128-K135 HydrophobicContact CE1-CD 4.22Å; Y128-K135 PolarHBondContact OH-NZ 3.34Å; Y128-E143 HydrophobicContact CE1-CB 4.21Å; Y128-E143 HydrophobicContact CE2-CG 4.38Å; Y128-E143 VanDerWaalsContact OH-CD 3.24Å; Y128-E143 WeakPolarHBondContact OH-CG 3.45Å; Y128-E143 PolarHBondContact OH-OE1 3.07Å; Y128-K146 HydrophobicContact CD1-CB 4.49Å; Y128-K146 HydrophobicContact CD2-CB 4.16Å; Y128-K146 HydrophobicContact CD2-CD 3.92Å; Y128-K146 HydrophobicContact CE2-CD 4.3Å; Y128-K146 HydrophobicContact CG-CB 3.89Å; Y128-K146 HydrophobicContact CG-CD 4.47Å; Y128-F147 HydrophobicContact CD1-CD1 4.41Å; Y128-F147 HydrophobicContact CD1-CD2 4.17Å; Y128-F147 HydrophobicContact CD1-CE1 4.13Å; Y128-F147 AromaticContact CD1-CE2 3.86Å; Y128-F147 HydrophobicContact CD1-CE2 3.86Å; Y128-F147 HydrophobicContact CD1-CG 4.45Å; Y128-F147 AromaticContact CD1-CZ 3.84Å; Y128-F147 HydrophobicContact CD1-CZ 3.84Å; Y128-F147 HydrophobicContact CE1-CE1 4.42Å; Y128-F147 AromaticContact CE1-CE2 3.87Å; Y128-F147 HydrophobicContact CE1-CE2 3.87Å; Y128-F147 AromaticContact CE1-CZ 3.77Å; Y128-F147 HydrophobicContact CE1-CZ 3.77Å
129	S	91.3	Very high	92.4	Very high	51 Å²	51	33.2 Å²	33.2	36%	0.357	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-2.2	175.2	76.1	0	0	0	0	115.1	D125 A126 V127	D125-S129 WeakPolarHBondContact O-CB 3.47Å; D125-S129 PolarHBondContact O-N 3.37Å; A126-S129 PolarHBondContact O-OG 2.85Å; V127-S129 PolarHBondContact O-N 2.99Å
130	S	93.4	Very high	92.3	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	18%	0.184	C	C	.	.	S	Bend	trans	-68.4	152.1	178.9	-54.9	0	0	0	0	112	S65 G67 V127 Y128 I132	S65-S130 WeakPolarHBondContact OG-CA 3.37Å; S65-S130 WeakPolarHBondContact OG-CB 3.39Å; G67-S130 WeakPolarHBondContact CA-OG 3.33Å; G67-S130 VanDerWaalsContact N-CB 3.34Å; G67-S130 PolarHBondContact N-OG 3.46Å; V127-S130 VanDerWaalsContact O-CB 3.31Å; V127-S130 WeakPolarHBondContact O-CB 3.26Å; V127-S130 PolarHBondContact O-N 2.64Å; V127-S130 PolarHBondContact O-OG 3.22Å; Y128-S130 PolarHBondContact O-N 3.1Å; S130-I132 VanDerWaalsContact C-N 3.3Å; S130-I132 PolarHBondContact O-N 3.2Å
131	D	93.9	Very high	92.1	Very high	37 Å²	37	31.3 Å²	31.3	20%	0.198	19%	0.189	C	C	.	.	S	Bend	trans	-60.8	-37.6	178.2	-57	-53.3	0	0	0	113.3	L64 S65 K148 T152	L64-D131 HydrophobicContact CD2-CB 3.9Å; S65-D131 PolarHBondContact N-OD2 3.4Å; S65-D131 VanDerWaalsContact N-OD2 3.09Å; S65-D131 PolarHBondContact O-N 2.92Å; S65-D131 PolarHBondContact OG-N 3.17Å; S65-D131 PolarHBondContact OG-OD2 3.17Å; D131-K148 IonicContact OD1-NZ 3.06Å; D131-K148 PolarHBondContact OD1-NZ 2.74Å; D131-T152 PolarHBondContact O-N 3.19Å
132	I	95.2	Very high	92.1	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.9	176	-58	171.9	0	0	0	108	L64 S65 I66 G67 F94 S130 L134 T152 I154 L399 F408	L64-I132 HydrophobicContact CD1-CD1 4.39Å; S65-I132 PolarHBondContact O-N 2.78Å; I66-I132 CarbonylContact C-O 3.58Å; I66-I132 VanDerWaalsContact CA-O 3.26Å; I66-I132 WeakPolarHBondContact CA-O 3.44Å; I66-I132 HydrophobicContact CG1-CB 4.38Å; G67-I132 PolarHBondContact N-O 3.28Å; F94-I132 HydrophobicContact CE1-CD1 4.23Å; S130-I132 VanDerWaalsContact C-N 3.3Å; S130-I132 PolarHBondContact O-N 3.2Å; I132-L134 HydrophobicContact CG2-CD2 3.82Å; I132-T152 CarbonylContact C-O 3.54Å; I132-T152 WeakPolarHBondContact CA-O 3.34Å; I132-I154 HydrophobicContact CG2-CD1 4.44Å; I132-L399 HydrophobicContact CD1-CD1 3.92Å; I132-F408 HydrophobicContact CD1-CD2 4.32Å; I132-F408 HydrophobicContact CD1-CE2 4.21Å; I132-F408 HydrophobicContact CD1-CZ 4.45Å
133	V	96.5	Very high	92.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.9	175.5	176.3	0	0	0	0	108.8	G67 P69 Y128 K135 F147 T152 L153 I154	G67-V133 CarbonylContact O-C 3.6Å; G67-V133 WeakPolarHBondContact O-CA 3.49Å; P69-V133 HydrophobicContact CG-CG1 4.12Å; Y128-V133 HydrophobicContact CD1-CG1 4.31Å; Y128-V133 HydrophobicContact CE1-CG1 4.33Å; V133-K135 HydrophobicContact CG1-CG 4.27Å; V133-F147 HydrophobicContact CB-CD1 4.36Å; V133-F147 HydrophobicContact CB-CE1 3.73Å; V133-F147 HydrophobicContact CG1-CE1 3.84Å; V133-F147 HydrophobicContact CG1-CZ 4.31Å; V133-F147 HydrophobicContact CG2-CD1 4.06Å; V133-F147 HydrophobicContact CG2-CE1 3.9Å; V133-T152 PolarHBondContact N-O 3.23Å; V133-L153 HydrophobicContact CG1-CD1 4.4Å; V133-I154 PolarHBondContact O-N 3.01Å
134	L	96.9	Very high	92.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	117.2	177.7	-51.7	179.8	0	0	0	108.6	I66 G67 V68 P69 A80 I132 I154 I395	I66-L134 HydrophobicContact CG2-CD1 3.53Å; I66-L134 HydrophobicContact CG2-CG 3.71Å; G67-L134 PolarHBondContact O-N 2.93Å; V68-L134 HydrophobicContact CG2-CB 4.47Å; P69-L134 WeakPolarHBondContact CD-O 3.26Å; A80-L134 HydrophobicContact CB-CB 4.03Å; A80-L134 WeakPolarHBondContact CB-O 3.23Å; I132-L134 HydrophobicContact CG2-CD2 3.82Å; L134-I154 HydrophobicContact CD2-CB 3.84Å; L134-I154 HydrophobicContact CD2-CD1 3.96Å; L134-I154 HydrophobicContact CD2-CG1 4.11Å; L134-I395 HydrophobicContact CD1-CG2 3.85Å; L134-I395 HydrophobicContact CD2-CG2 3.67Å; L134-I395 HydrophobicContact CG-CG2 4.23Å
135	K	96.9	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.171	C	C	.	.			trans	-121.5	161.9	173.7	-78.8	-176.2	66.2	76.2	0	110	P69 E71 Y128 V133 R137 E143 L153 I154 S155 Y391	P69-K135 HydrophobicContact CG-CD 3.96Å; P69-K135 HydrophobicContact CG-CG 3.54Å; E71-K135 IonicContact OE1-NZ 3.06Å; E71-K135 IonicContact OE2-NZ 2.67Å; E71-K135 PolarHBondContact OE2-NZ 3.37Å; Y128-K135 HydrophobicContact CE1-CD 4.22Å; Y128-K135 PolarHBondContact OH-NZ 3.34Å; V133-K135 HydrophobicContact CG1-CG 4.27Å; K135-R137 WeakPolarHBondContact CB-O 3.29Å; K135-E143 IonicContact NZ-OE1 2.91Å; K135-E143 PolarHBondContact NZ-OE1 2.91Å; K135-E143 IonicContact NZ-OE2 3.18Å; K135-L153 HydrophobicContact CB-CD1 4.39Å; K135-I154 PolarHBondContact N-O 2.68Å; K135-S155 WeakPolarHBondContact O-CA 3.42Å; K135-S155 WeakPolarHBondContact O-CB 3.32Å; K135-Y391 PolarHBondContact O-OH 2.99Å
136	V	95.6	Very high	92.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	17%	0.167	C	C	.	.	S	Bend	trans	-81.7	-63.2	169	-175	0	0	0	0	109.1	E71 R78 A80 F156 Y391	E71-V136 HydrophobicContact CG-CB 4.3Å; E71-V136 HydrophobicContact CG-CG2 4.35Å; E71-V136 PolarHBondContact OE1-N 2.91Å; R78-V136 HydrophobicContact CB-CG1 4.48Å; R78-V136 HydrophobicContact CB-CG2 4.27Å; A80-V136 HydrophobicContact CB-CG2 4.13Å; V136-F156 WeakPolarHBondContact O-CD2 3.37Å; V136-F156 PolarHBondContact O-N 2.75Å; V136-F156 VanDerWaalsContact O-N 3.08Å; V136-Y391 HydrophobicContact CB-CE1 4.1Å; V136-Y391 HydrophobicContact CG1-CE1 4.2Å; V136-Y391 HydrophobicContact CG2-CD1 4.08Å; V136-Y391 HydrophobicContact CG2-CE1 3.9Å; V136-Y391 PolarHBondContact O-OH 2.82Å
137	R	93.7	Very high	92.9	Very high	40 Å²	40	25 Å²	25	15%	0.151	16%	0.155	C	C	.	.	S	Bend	trans	-93.2	168.7	-178.9	-60.6	-170.1	78.6	126.5	4	111.5	E76 K135 E351	E76-R137 WeakPolarHBondContact OE2-CD 3.46Å; K135-R137 WeakPolarHBondContact CB-O 3.29Å; R137-E351 IonicContact NH2-OE1 3.61Å
138	Q	93	Very high	92.7	Very high	45 Å²	45	29.7 Å²	29.7	21%	0.21	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-61	145.6	172.7	70.8	-85.4	32.7	0	0	110.8	F156 L165	Q138-F156 VanDerWaalsContact CA-O 3.29Å; Q138-F156 WeakPolarHBondContact CA-O 3.46Å; Q138-F156 WeakPolarHBondContact CB-O 3.41Å; Q138-F156 PolarHBondContact N-O 3.15Å; Q138-F156 VanDerWaalsContact N-O 3.13Å; Q138-L165 HydrophobicContact CB-CD2 3.68Å; Q138-L165 HydrophobicContact CG-CD2 3.63Å
139	P	93.7	Very high	92.4	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.013	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-67.3	146.6	176.4	28.8	-35	0	0	0	111.2	E143 V144 F147 L153 L165 M169	P139-E143 WeakPolarHBondContact CA-OE2 3.48Å; P139-E143 HydrophobicContact CB-CB 4Å; P139-V144 HydrophobicContact CB-CG2 4.08Å; P139-V144 HydrophobicContact CG-CG2 3.91Å; P139-F147 HydrophobicContact CB-CE2 4.04Å; P139-F147 HydrophobicContact CB-CZ 4.31Å; P139-F147 HydrophobicContact CG-CE2 4.37Å; P139-F147 HydrophobicContact CG-CZ 4.48Å; P139-L153 HydrophobicContact CG-CD2 3.87Å; P139-L165 VanDerWaalsContact O-CD1 3.23Å; P139-L165 WeakPolarHBondContact O-CD1 3.47Å; P139-L165 WeakPolarHBondContact O-CD2 3.33Å; P139-M169 HydrophobicContact CG-SD 3.92Å
140	S	92	Very high	92.1	Very high	51 Å²	51	33.1 Å²	33.1	36%	0.357	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-71.4	157	163.3	61.4	0	0	0	0	110.7	A142 E143 V144	S140-A142 PolarHBondContact O-N 2.99Å; S140-A142 VanDerWaalsContact O-N 3.13Å; S140-E143 WeakPolarHBondContact CB-OE2 3.46Å; S140-E143 PolarHBondContact N-OE2 3.03Å; S140-E143 WeakPolarHBondContact O-CA 3.5Å; S140-E143 WeakPolarHBondContact O-CB 3.37Å; S140-E143 PolarHBondContact O-N 3.18Å; S140-E143 WeakPolarHBondContact OG-CG 3.42Å; S140-E143 PolarHBondContact OG-N 3.28Å; S140-E143 PolarHBondContact OG-OE2 3.4Å; S140-V144 WeakPolarHBondContact O-CG2 3.46Å; S140-V144 PolarHBondContact O-N 3.46Å
141	S	88.9	Confident	92	Very high	69 Å²	69	33.2 Å²	33.2	48%	0.483	21%	0.208	S	C	.	.	H	α-helix	trans	-54.2	-34.3	176.6	-62.2	0	0	0	0	113.1	E143 V144 E168	S141-E143 VanDerWaalsContact C-N 3.33Å; S141-E143 PolarHBondContact O-N 2.94Å; S141-V144 PolarHBondContact O-N 3.34Å; S141-E168 WeakPolarHBondContact CA-OE1 3.28Å; S141-E168 WeakPolarHBondContact CB-OE1 3.48Å; S141-E168 WeakPolarHBondContact CB-OE2 3.5Å; S141-E168 PolarHBondContact OG-OE2 3.39Å
142	A	90.4	Very high	92.1	Very high	73 Å²	73	32 Å²	32	60%	0.603	20%	0.202	S	C	*	.	H	α-helix	trans	-65.9	-33.2	174.8	0	0	0	0	0	113.2	S140	S140-A142 PolarHBondContact O-N 2.99Å; S140-A142 VanDerWaalsContact O-N 3.13Å
143	E	92	Very high	92.1	Very high	10 Å²	10	32 Å²	32	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-76.9	-35.8	175.8	-69.7	163.8	132.3	0	0	111.6	T72 Y128 K135 P139 S140 S141 A145 K146 F147	T72-E143 PolarHBondContact OG1-OE1 2.89Å; Y128-E143 HydrophobicContact CE1-CB 4.21Å; Y128-E143 HydrophobicContact CE2-CG 4.38Å; Y128-E143 VanDerWaalsContact OH-CD 3.24Å; Y128-E143 WeakPolarHBondContact OH-CG 3.45Å; Y128-E143 PolarHBondContact OH-OE1 3.07Å; K135-E143 IonicContact NZ-OE1 2.91Å; K135-E143 PolarHBondContact NZ-OE1 2.91Å; K135-E143 IonicContact NZ-OE2 3.18Å; P139-E143 WeakPolarHBondContact CA-OE2 3.48Å; P139-E143 HydrophobicContact CB-CB 4Å; S140-E143 WeakPolarHBondContact CB-OE2 3.46Å; S140-E143 PolarHBondContact N-OE2 3.03Å; S140-E143 WeakPolarHBondContact O-CA 3.5Å; S140-E143 WeakPolarHBondContact O-CB 3.37Å; S140-E143 PolarHBondContact O-N 3.18Å; S140-E143 WeakPolarHBondContact OG-CG 3.42Å; S140-E143 PolarHBondContact OG-N 3.28Å; S140-E143 PolarHBondContact OG-OE2 3.4Å; S141-E143 VanDerWaalsContact C-N 3.33Å; S141-E143 PolarHBondContact O-N 2.94Å; E143-A145 PolarHBondContact O-N 2.93Å; E143-A145 VanDerWaalsContact O-N 3.13Å; E143-K146 WeakPolarHBondContact O-CB 3.46Å; E143-K146 PolarHBondContact O-N 3.17Å; E143-F147 WeakPolarHBondContact O-CD2 3.48Å; E143-F147 WeakPolarHBondContact O-CE2 3.4Å
144	V	90.7	Very high	92.1	Very high	1 Å²	1	32 Å²	32	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-55.1	-34	178	178.2	0	0	0	0	111.5	P139 S140 S141 K146 L165 E168 M169 R172	P139-V144 HydrophobicContact CB-CG2 4.08Å; P139-V144 HydrophobicContact CG-CG2 3.91Å; S140-V144 WeakPolarHBondContact O-CG2 3.46Å; S140-V144 PolarHBondContact O-N 3.46Å; S141-V144 PolarHBondContact O-N 3.34Å; V144-K146 PolarHBondContact O-N 3.25Å; V144-L165 HydrophobicContact CG2-CD1 3.78Å; V144-E168 HydrophobicContact CB-CG 4.38Å; V144-E168 HydrophobicContact CG1-CB 4.4Å; V144-E168 HydrophobicContact CG1-CG 3.88Å; V144-M169 HydrophobicContact CG1-CG 4.11Å; V144-M169 HydrophobicContact CG2-CG 4.01Å; V144-R172 HydrophobicContact CG1-CG 4.21Å
145	A	88.6	Confident	92.1	Very high	48 Å²	48	32 Å²	32	40%	0.397	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.4	178.1	0	0	0	0	0	115	E143 R172	E143-A145 PolarHBondContact O-N 2.93Å; E143-A145 VanDerWaalsContact O-N 3.13Å; A145-R172 PolarHBondContact O-NH1 3.21Å; A145-R172 PolarHBondContact O-NH2 3.47Å
146	K	91.3	Very high	92	Very high	83 Å²	83	32.5 Å²	32.5	36%	0.361	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-15.7	-173.5	-59.4	179	172.2	-152.7	0	113.9	D125 Y128 E143 V144	D125-K146 WeakPolarHBondContact OD1-CD 3.5Å; D125-K146 VanDerWaalsContact OD1-CE 3.26Å; D125-K146 WeakPolarHBondContact OD1-CE 3.17Å; D125-K146 IonicContact OD1-NZ 3.02Å; D125-K146 PolarHBondContact OD1-NZ 2.85Å; Y128-K146 HydrophobicContact CD1-CB 4.49Å; Y128-K146 HydrophobicContact CD2-CB 4.16Å; Y128-K146 HydrophobicContact CD2-CD 3.92Å; Y128-K146 HydrophobicContact CE2-CD 4.3Å; Y128-K146 HydrophobicContact CG-CB 3.89Å; Y128-K146 HydrophobicContact CG-CD 4.47Å; E143-K146 WeakPolarHBondContact O-CB 3.46Å; E143-K146 PolarHBondContact O-N 3.17Å; V144-K146 PolarHBondContact O-N 3.25Å
147	F	91.6	Very high	91.9	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.031	20%	0.204	C	C	.	.	S	Bend	trans	-66.1	142.2	-179.4	-72.6	-97.6	0	0	0	111.5	Y128 V133 P139 E143 S149 L153 L174	Y128-F147 HydrophobicContact CD1-CD1 4.41Å; Y128-F147 HydrophobicContact CD1-CD2 4.17Å; Y128-F147 HydrophobicContact CD1-CE1 4.13Å; Y128-F147 AromaticContact CD1-CE2 3.86Å; Y128-F147 HydrophobicContact CD1-CE2 3.86Å; Y128-F147 HydrophobicContact CD1-CG 4.45Å; Y128-F147 AromaticContact CD1-CZ 3.84Å; Y128-F147 HydrophobicContact CD1-CZ 3.84Å; Y128-F147 HydrophobicContact CE1-CE1 4.42Å; Y128-F147 AromaticContact CE1-CE2 3.87Å; Y128-F147 HydrophobicContact CE1-CE2 3.87Å; Y128-F147 AromaticContact CE1-CZ 3.77Å; Y128-F147 HydrophobicContact CE1-CZ 3.77Å; V133-F147 HydrophobicContact CB-CD1 4.36Å; V133-F147 HydrophobicContact CB-CE1 3.73Å; V133-F147 HydrophobicContact CG1-CE1 3.84Å; V133-F147 HydrophobicContact CG1-CZ 4.31Å; V133-F147 HydrophobicContact CG2-CD1 4.06Å; V133-F147 HydrophobicContact CG2-CE1 3.9Å; P139-F147 HydrophobicContact CB-CE2 4.04Å; P139-F147 HydrophobicContact CB-CZ 4.31Å; P139-F147 HydrophobicContact CG-CE2 4.37Å; P139-F147 HydrophobicContact CG-CZ 4.48Å; E143-F147 WeakPolarHBondContact O-CD2 3.48Å; E143-F147 WeakPolarHBondContact O-CE2 3.4Å; F147-S149 PolarHBondContact O-N 2.95Å; F147-L153 HydrophobicContact CE1-CB 4.2Å; F147-L153 HydrophobicContact CE1-CD1 4.02Å; F147-L153 HydrophobicContact CE1-CG 4.49Å; F147-L153 HydrophobicContact CZ-CD1 4.04Å; F147-L153 HydrophobicContact CZ-CD2 4.31Å; F147-L174 HydrophobicContact CB-CD1 4.09Å; F147-L174 HydrophobicContact CB-CD2 3.73Å; F147-L174 HydrophobicContact CD1-CD1 4.33Å; F147-L174 HydrophobicContact CD2-CD1 4.28Å; F147-L174 HydrophobicContact CG-CD1 3.99Å; F147-L174 HydrophobicContact CG-CD2 4.32Å
148	K	89.3	Confident	91.7	Very high	99 Å²	99	34.3 Å²	34.3	43%	0.43	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-58.7	134.3	166.2	179.4	179.3	172.8	-177.2	0	109.6	D131 G150 G151 L174	D131-K148 IonicContact OD1-NZ 3.06Å; D131-K148 PolarHBondContact OD1-NZ 2.74Å; K148-G150 PolarHBondContact O-N 3.03Å; K148-G151 PolarHBondContact O-N 3.34Å; K148-L174 WeakPolarHBondContact O-CD2 3.48Å
149	S	85.5	Confident	91.5	Very high	81 Å²	81	32.5 Å²	32.5	57%	0.566	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	128.6	174.6	-169.2	0	0	0	0	109.9	F147 G151 R172	F147-S149 PolarHBondContact O-N 2.95Å; S149-G151 VanDerWaalsContact C-N 3.33Å; S149-R172 PolarHBondContact OG-O 3.13Å
150	G	84.6	Confident	91.2	Very high	45 Å²	45	34.8 Å²	34.8	46%	0.464	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	5	-171.7	0	0	0	0	0	115.2	K148 K173	K148-G150 PolarHBondContact O-N 3.03Å; G150-K173 WeakPolarHBondContact CA-O 3.27Å
151	G	92.1	Very high	90.9	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	23%	0.23	C	C	.	.			trans	-66.3	158.1	175.9	0	0	0	0	0	113.1	K148 S149 T175	K148-G151 PolarHBondContact O-N 3.34Å; S149-G151 VanDerWaalsContact C-N 3.33Å; G151-T175 PolarHBondContact O-N 3.1Å
152	T	95	Very high	90.8	Very high	12 Å²	12	36.4 Å²	36.4	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.1	177.7	-57	0	0	0	0	110.8	D131 I132 V133 T175 F177 F408	D131-T152 PolarHBondContact O-N 3.19Å; I132-T152 CarbonylContact C-O 3.54Å; I132-T152 WeakPolarHBondContact CA-O 3.34Å; V133-T152 PolarHBondContact N-O 3.23Å; T152-T175 CarbonylContact C-O 3.5Å; T152-T175 WeakPolarHBondContact CA-O 3.43Å; T152-T175 HydrophobicContact CG2-CG2 4.32Å; T152-F177 HydrophobicContact CG2-CD2 3.87Å; T152-F177 HydrophobicContact CG2-CE2 3.86Å; T152-F408 HydrophobicContact CG2-CZ 4.4Å
153	L	96	Very high	90.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.7	173.7	171.7	64.7	0	0	0	110	V133 K135 P139 F147 I157 M169 T175 V176 F177	V133-L153 HydrophobicContact CG1-CD1 4.4Å; K135-L153 HydrophobicContact CB-CD1 4.39Å; P139-L153 HydrophobicContact CG-CD2 3.87Å; F147-L153 HydrophobicContact CE1-CB 4.2Å; F147-L153 HydrophobicContact CE1-CD1 4.02Å; F147-L153 HydrophobicContact CE1-CG 4.49Å; F147-L153 HydrophobicContact CZ-CD1 4.04Å; F147-L153 HydrophobicContact CZ-CD2 4.31Å; L153-I157 HydrophobicContact CD2-CD1 3.97Å; L153-M169 HydrophobicContact CD2-SD 3.79Å; L153-T175 PolarHBondContact N-O 3.3Å; L153-V176 HydrophobicContact CB-CG1 4.49Å; L153-V176 HydrophobicContact CB-CG2 4.29Å; L153-V176 HydrophobicContact CD2-CG1 4.2Å; L153-V176 HydrophobicContact CD2-CG2 4.5Å; L153-V176 HydrophobicContact CG-CG1 4.47Å; L153-V176 WeakPolarHBondContact O-CA 3.48Å; L153-F177 PolarHBondContact O-N 3.37Å
154	I	96.4	Very high	90.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	113.6	167.7	-50.6	-177.5	0	0	0	107.7	I132 V133 L134 K135 F177 M179 I395 F398 L399	I132-I154 HydrophobicContact CG2-CD1 4.44Å; V133-I154 PolarHBondContact O-N 3.01Å; L134-I154 HydrophobicContact CD2-CB 3.84Å; L134-I154 HydrophobicContact CD2-CD1 3.96Å; L134-I154 HydrophobicContact CD2-CG1 4.11Å; K135-I154 PolarHBondContact N-O 2.68Å; I154-F177 HydrophobicContact CG1-CB 4.24Å; I154-F177 HydrophobicContact CG1-CD2 4.2Å; I154-F177 HydrophobicContact CG2-CB 4.48Å; I154-M179 HydrophobicContact CG2-CG 3.87Å; I154-M179 HydrophobicContact CG2-SD 3.54Å; I154-M179 VanDerWaalsContact CG2-SD 3.54Å; I154-I395 HydrophobicContact CG2-CG1 4.39Å; I154-I395 HydrophobicContact CG2-CG2 4.36Å; I154-F398 HydrophobicContact CD1-CD1 4.44Å; I154-F398 HydrophobicContact CD1-CE1 4.47Å; I154-F398 HydrophobicContact CG2-CD1 4.31Å; I154-F398 HydrophobicContact CG2-CE1 4.43Å; I154-L399 HydrophobicContact CD1-CD1 4.18Å
155	S	96	Very high	90.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	179.1	177.8	71.1	0	0	0	0	110.9	K135 I157 F177 G178 M179	K135-S155 WeakPolarHBondContact O-CA 3.42Å; K135-S155 WeakPolarHBondContact O-CB 3.32Å; S155-I157 WeakPolarHBondContact OG-CD1 3.42Å; S155-F177 PolarHBondContact N-O 3.49Å; S155-G178 WeakPolarHBondContact O-CA 3.46Å; S155-M179 PolarHBondContact O-N 3.47Å
156	F	94.5	Very high	91	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.048	23%	0.231	C	C	.	.			trans	-68.5	138.3	157.1	-69.4	-63.9	0	0	0	109.9	V136 Q138 Y158 M179 D180 A193 L194 M197 Y391	V136-F156 WeakPolarHBondContact O-CD2 3.37Å; V136-F156 PolarHBondContact O-N 2.75Å; V136-F156 VanDerWaalsContact O-N 3.08Å; Q138-F156 VanDerWaalsContact CA-O 3.29Å; Q138-F156 WeakPolarHBondContact CA-O 3.46Å; Q138-F156 WeakPolarHBondContact CB-O 3.41Å; Q138-F156 PolarHBondContact N-O 3.15Å; Q138-F156 VanDerWaalsContact N-O 3.13Å; F156-Y158 HydrophobicContact CB-CD2 4.31Å; F156-Y158 HydrophobicContact CB-CE2 3.79Å; F156-Y158 HydrophobicContact CD1-CE2 4.46Å; F156-Y158 HydrophobicContact CG-CE2 4.29Å; F156-M179 HydrophobicContact CD1-CB 3.98Å; F156-M179 HydrophobicContact CE1-CB 3.96Å; F156-D180 HydrophobicContact CD1-CB 3.91Å; F156-D180 HydrophobicContact CE1-CB 4.44Å; F156-A193 HydrophobicContact CE1-CB 3.97Å; F156-A193 HydrophobicContact CZ-CB 3.61Å; F156-L194 HydrophobicContact CD1-CD2 4.46Å; F156-L194 HydrophobicContact CE1-CD2 3.72Å; F156-L194 HydrophobicContact CE1-CG 4.29Å; F156-L194 HydrophobicContact CZ-CD2 4.34Å; F156-M197 HydrophobicContact CE2-CG 4.48Å; F156-M197 HydrophobicContact CZ-CG 4.33Å; F156-Y391 HydrophobicContact CD2-CE2 4.13Å; F156-Y391 HydrophobicContact CE2-CD2 4.14Å; F156-Y391 AromaticContact CE2-CE2 3.47Å; F156-Y391 HydrophobicContact CE2-CE2 3.47Å; F156-Y391 VanDerWaalsContact CE2-CE2 3.47Å; F156-Y391 HydrophobicContact CZ-CD2 4.41Å; F156-Y391 AromaticContact CZ-CE2 3.81Å; F156-Y391 HydrophobicContact CZ-CE2 3.81Å
157	I	93.5	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.			trans	-126.7	-43.4	-175.3	-60	-65.1	0	0	0	111.5	L153 S155 P159 N162 V166 M169 V176 D180	L153-I157 HydrophobicContact CD2-CD1 3.97Å; S155-I157 WeakPolarHBondContact OG-CD1 3.42Å; I157-P159 HydrophobicContact CG2-CB 4.31Å; I157-N162 PolarHBondContact O-ND2 3.45Å; I157-V166 HydrophobicContact CG2-CG2 4.13Å; I157-M169 HydrophobicContact CD1-CE 4.25Å; I157-M169 HydrophobicContact CG2-CE 4.33Å; I157-V176 HydrophobicContact CD1-CG1 3.48Å; I157-V176 VanDerWaalsContact CD1-CG1 3.48Å; I157-V176 HydrophobicContact CG1-CG1 3.68Å; I157-D180 PolarHBondContact N-OD1 2.63Å
158	Y	89.5	Confident	91.1	Very high	80 Å²	80	46 Å²	46	31%	0.314	26%	0.255	S	S	.	.			trans	51.6	62.2	-174.7	-58.6	-75.8	0	0	0	111.7	F156 A160 Q161 N162 D180	F156-Y158 HydrophobicContact CB-CD2 4.31Å; F156-Y158 HydrophobicContact CB-CE2 3.79Å; F156-Y158 HydrophobicContact CD1-CE2 4.46Å; F156-Y158 HydrophobicContact CG-CE2 4.29Å; Y158-A160 PolarHBondContact O-N 3.02Å; Y158-Q161 PolarHBondContact O-N 2.92Å; Y158-Q161 PolarHBondContact O-OE1 2.89Å; Y158-N162 PolarHBondContact O-N 2.82Å; Y158-N162 PolarHBondContact O-ND2 3.11Å; Y158-D180 VanDerWaalsContact CA-OD2 3.29Å; Y158-D180 WeakPolarHBondContact CA-OD2 3.47Å; Y158-D180 HydrophobicContact CD1-CB 4.07Å; Y158-D180 HydrophobicContact CE1-CB 3.88Å; Y158-D180 PolarHBondContact N-OD1 3.45Å; Y158-D180 PolarHBondContact N-OD2 2.85Å
159	P	89.7	Confident	91.3	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.039	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.8	-168.1	24.1	-34.3	0	0	0	113.8	I157 Q161 V166 D180 V422 W430	I157-P159 HydrophobicContact CG2-CB 4.31Å; P159-Q161 VanDerWaalsContact C-N 3.31Å; P159-Q161 PolarHBondContact O-N 2.8Å; P159-V166 HydrophobicContact CB-CG2 4.12Å; P159-D180 VanDerWaalsContact CD-OD2 3.29Å; P159-D180 WeakPolarHBondContact CD-OD2 3.23Å; P159-V422 HydrophobicContact CB-CG1 3.9Å; P159-V422 HydrophobicContact CG-CG1 4.45Å; P159-V422 HydrophobicContact CG-CG2 4.28Å; P159-W430 HydrophobicContact CB-CD2 4.07Å; P159-W430 HydrophobicContact CB-CE3 4.43Å; P159-W430 HydrophobicContact CB-CG 4.24Å; P159-W430 HydrophobicContact CG-CD2 3.88Å; P159-W430 HydrophobicContact CG-CG 3.9Å; P159-W430 HydrophobicContact CG-CZ2 4.27Å
160	A	86.6	Confident	91.6	Very high	50 Å²	50	38.6 Å²	38.6	41%	0.413	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-29.5	176.3	0	0	0	0	0	113.1	Y158 W430	Y158-A160 PolarHBondContact O-N 3.02Å; A160-W430 HydrophobicContact CB-CH2 3.74Å; A160-W430 HydrophobicContact CB-CZ2 3.88Å
161	Q	85.7	Confident	91.9	Very high	111 Å²	111	40.9 Å²	40.9	52%	0.519	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-24	-178.9	-66	78.8	9.9	0	0	112.4	Y158 P159	Y158-Q161 PolarHBondContact O-N 2.92Å; Y158-Q161 PolarHBondContact O-OE1 2.89Å; P159-Q161 VanDerWaalsContact C-N 3.31Å; P159-Q161 PolarHBondContact O-N 2.8Å
162	N	88.5	Confident	91.7	Very high	44 Å²	44	45.5 Å²	45.5	24%	0.235	24%	0.243	C	C	.	.			trans	-117.5	40.5	-170.5	-64.1	-57.5	0	0	0	113.2	I157 Y158 A164 L165 V166	I157-N162 PolarHBondContact O-ND2 3.45Å; Y158-N162 PolarHBondContact O-N 2.82Å; Y158-N162 PolarHBondContact O-ND2 3.11Å; N162-A164 PolarHBondContact O-N 3.08Å; N162-A164 VanDerWaalsContact O-N 3.14Å; N162-L165 HydrophobicContact CB-CB 4.19Å; N162-L165 WeakPolarHBondContact O-CB 3.2Å; N162-L165 PolarHBondContact O-N 3.45Å; N162-V166 PolarHBondContact O-N 2.86Å; N162-V166 VanDerWaalsContact O-N 3.08Å
163	E	89.3	Confident	91.6	Very high	115 Å²	115	51.3 Å²	51.3	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-53.1	-38.4	-176	-66.7	-170.9	-176.7	0	0	114	V166 K167	E163-V166 PolarHBondContact O-N 2.99Å; E163-K167 WeakPolarHBondContact O-CG 3.35Å; E163-K167 PolarHBondContact O-N 2.91Å
164	A	91.1	Very high	91.5	Very high	79 Å²	79	51.3 Å²	51.3	65%	0.653	27%	0.268	S	S	*	.	H	α-helix	trans	-63.2	-42.5	178.7	0	0	0	0	0	112	N162 K167 E168	N162-A164 PolarHBondContact O-N 3.08Å; N162-A164 VanDerWaalsContact O-N 3.14Å; A164-K167 PolarHBondContact O-N 2.99Å; A164-E168 PolarHBondContact O-N 2.84Å; A164-E168 VanDerWaalsContact O-N 3.1Å
165	L	92.1	Very high	91.4	Very high	18 Å²	18	51.6 Å²	51.6	9%	0.094	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-40.1	177.8	-177.1	65.8	0	0	0	111.3	Q138 P139 V144 N162 K167 E168 M169	Q138-L165 HydrophobicContact CB-CD2 3.68Å; Q138-L165 HydrophobicContact CG-CD2 3.63Å; P139-L165 VanDerWaalsContact O-CD1 3.23Å; P139-L165 WeakPolarHBondContact O-CD1 3.47Å; P139-L165 WeakPolarHBondContact O-CD2 3.33Å; V144-L165 HydrophobicContact CG2-CD1 3.78Å; N162-L165 HydrophobicContact CB-CB 4.19Å; N162-L165 WeakPolarHBondContact O-CB 3.2Å; N162-L165 PolarHBondContact O-N 3.45Å; L165-K167 VanDerWaalsContact C-N 3.32Å; L165-K167 PolarHBondContact O-N 2.81Å; L165-E168 WeakPolarHBondContact O-CB 3.48Å; L165-E168 PolarHBondContact O-N 3.04Å; L165-M169 HydrophobicContact CG-CE 4.13Å; L165-M169 WeakPolarHBondContact O-CG 3.43Å; L165-M169 PolarHBondContact O-N 3.12Å
166	V	92.8	Very high	91.4	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.03	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-42.1	176.3	178.7	0	0	0	0	110.9	I157 P159 N162 E163 E168 M169 A170 V422 L423 M428	I157-V166 HydrophobicContact CG2-CG2 4.13Å; P159-V166 HydrophobicContact CB-CG2 4.12Å; N162-V166 PolarHBondContact O-N 2.86Å; N162-V166 VanDerWaalsContact O-N 3.08Å; E163-V166 PolarHBondContact O-N 2.99Å; V166-E168 VanDerWaalsContact C-N 3.34Å; V166-E168 PolarHBondContact O-N 3.37Å; V166-M169 HydrophobicContact CB-CE 4.49Å; V166-M169 HydrophobicContact CG2-CE 4.2Å; V166-M169 PolarHBondContact O-N 2.85Å; V166-A170 WeakPolarHBondContact O-CB 3.4Å; V166-A170 PolarHBondContact O-N 3.08Å; V166-V422 HydrophobicContact CG1-CG1 4.12Å; V166-V422 HydrophobicContact CG2-CG1 4.48Å; V166-L423 HydrophobicContact CG1-CD1 4.1Å; V166-L423 HydrophobicContact CG1-CD2 4.11Å; V166-L423 HydrophobicContact CG1-CG 4.14Å; V166-M428 HydrophobicContact CG1-CE 4.04Å; V166-M428 HydrophobicContact CG1-SD 3.73Å
167	K	92.2	Very high	91.5	Very high	146 Å²	146	51.1 Å²	51.1	64%	0.635	27%	0.267	S	S	*	.	H	α-helix	trans	-63.1	-38.5	175	-72.9	170.9	-179	165.5	0	112.4	E163 A164 L165 A170 S171	E163-K167 WeakPolarHBondContact O-CG 3.35Å; E163-K167 PolarHBondContact O-N 2.91Å; A164-K167 PolarHBondContact O-N 2.99Å; L165-K167 VanDerWaalsContact C-N 3.32Å; L165-K167 PolarHBondContact O-N 2.81Å; K167-A170 WeakPolarHBondContact O-CB 3.29Å; K167-A170 PolarHBondContact O-N 3.02Å; K167-S171 PolarHBondContact O-N 3.01Å; K167-S171 VanDerWaalsContact O-N 3.07Å
168	E	91.8	Very high	91.5	Very high	59 Å²	59	51.1 Å²	51.1	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-46.4	176.2	-161.7	-177.5	163.1	0	0	111.4	S141 V144 A164 L165 V166 A170 S171	S141-E168 WeakPolarHBondContact CA-OE1 3.28Å; S141-E168 WeakPolarHBondContact CB-OE1 3.48Å; S141-E168 WeakPolarHBondContact CB-OE2 3.5Å; S141-E168 PolarHBondContact OG-OE2 3.39Å; V144-E168 HydrophobicContact CB-CG 4.38Å; V144-E168 HydrophobicContact CG1-CB 4.4Å; V144-E168 HydrophobicContact CG1-CG 3.88Å; A164-E168 PolarHBondContact O-N 2.84Å; A164-E168 VanDerWaalsContact O-N 3.1Å; L165-E168 WeakPolarHBondContact O-CB 3.48Å; L165-E168 PolarHBondContact O-N 3.04Å; V166-E168 VanDerWaalsContact C-N 3.34Å; V166-E168 PolarHBondContact O-N 3.37Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.14Å; E168-S171 WeakPolarHBondContact O-CB 3.29Å; E168-S171 PolarHBondContact O-N 3.03Å; E168-S171 PolarHBondContact O-OG 3.45Å
169	M	93.5	Very high	91.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-36.1	175.4	-68	-174.6	-65.4	0	0	112.4	P139 V144 L153 I157 L165 V166 S171 R172 L174 V176 L423	P139-M169 HydrophobicContact CG-SD 3.92Å; V144-M169 HydrophobicContact CG1-CG 4.11Å; V144-M169 HydrophobicContact CG2-CG 4.01Å; L153-M169 HydrophobicContact CD2-SD 3.79Å; I157-M169 HydrophobicContact CD1-CE 4.25Å; I157-M169 HydrophobicContact CG2-CE 4.33Å; L165-M169 HydrophobicContact CG-CE 4.13Å; L165-M169 WeakPolarHBondContact O-CG 3.43Å; L165-M169 PolarHBondContact O-N 3.12Å; V166-M169 HydrophobicContact CB-CE 4.49Å; V166-M169 HydrophobicContact CG2-CE 4.2Å; V166-M169 PolarHBondContact O-N 2.85Å; M169-S171 VanDerWaalsContact C-N 3.34Å; M169-S171 PolarHBondContact O-N 3.39Å; M169-R172 PolarHBondContact O-N 3.02Å; M169-L174 HydrophobicContact CB-CD1 4.08Å; M169-L174 HydrophobicContact CG-CD1 4.15Å; M169-L174 PolarHBondContact O-N 2.86Å; M169-V176 HydrophobicContact CB-CG2 4.37Å; M169-V176 HydrophobicContact CE-CG1 4.41Å; M169-V176 HydrophobicContact CE-CG2 4.48Å; M169-V176 HydrophobicContact SD-CG1 4.48Å; M169-V176 HydrophobicContact SD-CG2 4.03Å; M169-L423 HydrophobicContact CB-CD1 3.71Å
170	A	92.3	Very high	91.8	Very high	26 Å²	26	48.3 Å²	48.3	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-40.8	175.5	0	0	0	0	0	111.9	V166 K167 E168 R172 K173 L423	V166-A170 WeakPolarHBondContact O-CB 3.4Å; V166-A170 PolarHBondContact O-N 3.08Å; K167-A170 WeakPolarHBondContact O-CB 3.29Å; K167-A170 PolarHBondContact O-N 3.02Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.14Å; A170-R172 PolarHBondContact O-N 3.31Å; A170-K173 PolarHBondContact O-N 3.47Å; A170-L423 HydrophobicContact CB-CD1 4.12Å; A170-L423 HydrophobicContact CB-CD2 3.87Å
171	S	90.7	Very high	92	Very high	93 Å²	93	47 Å²	47	65%	0.65	25%	0.245	S	C	*	.	H	α-helix	trans	-60.6	-27	177.4	80	0	0	0	0	113.5	K167 E168 M169 K173	K167-S171 PolarHBondContact O-N 3.01Å; K167-S171 VanDerWaalsContact O-N 3.07Å; E168-S171 WeakPolarHBondContact O-CB 3.29Å; E168-S171 PolarHBondContact O-N 3.03Å; E168-S171 PolarHBondContact O-OG 3.45Å; M169-S171 VanDerWaalsContact C-N 3.34Å; M169-S171 PolarHBondContact O-N 3.39Å; S171-K173 VanDerWaalsContact C-N 3.32Å
172	R	88.5	Confident	92.2	Very high	99 Å²	99	42.2 Å²	42.2	37%	0.374	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	1.1	176.5	-73.5	-71.4	-174.4	151.9	0.3	114	V144 A145 S149 M169 A170 L174	V144-R172 HydrophobicContact CG1-CG 4.21Å; A145-R172 PolarHBondContact O-NH1 3.21Å; A145-R172 PolarHBondContact O-NH2 3.47Å; S149-R172 PolarHBondContact OG-O 3.13Å; M169-R172 PolarHBondContact O-N 3.02Å; A170-R172 PolarHBondContact O-N 3.31Å; R172-L174 VanDerWaalsContact C-N 3.26Å; R172-L174 HydrophobicContact CB-CD1 4.33Å; R172-L174 HydrophobicContact CB-CD2 4.32Å; R172-L174 HydrophobicContact CB-CG 3.88Å; R172-L174 PolarHBondContact O-N 3.08Å
173	K	91.9	Very high	92.1	Very high	135 Å²	135	41.1 Å²	41.1	59%	0.587	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	35.3	-175.6	-56	-179.7	178.8	-177.7	0	112.9	G150 A170 S171	G150-K173 WeakPolarHBondContact CA-O 3.27Å; A170-K173 PolarHBondContact O-N 3.47Å; S171-K173 VanDerWaalsContact C-N 3.32Å
174	L	94.2	Very high	91.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.			trans	-73.9	151.5	178.6	-60.3	-178.7	0	0	0	111.5	F147 K148 M169 R172 V176 E425 G426	F147-L174 HydrophobicContact CB-CD1 4.09Å; F147-L174 HydrophobicContact CB-CD2 3.73Å; F147-L174 HydrophobicContact CD1-CD1 4.33Å; F147-L174 HydrophobicContact CD2-CD1 4.28Å; F147-L174 HydrophobicContact CG-CD1 3.99Å; F147-L174 HydrophobicContact CG-CD2 4.32Å; K148-L174 WeakPolarHBondContact O-CD2 3.48Å; M169-L174 HydrophobicContact CB-CD1 4.08Å; M169-L174 HydrophobicContact CG-CD1 4.15Å; M169-L174 PolarHBondContact O-N 2.86Å; R172-L174 VanDerWaalsContact C-N 3.26Å; R172-L174 HydrophobicContact CB-CD1 4.33Å; R172-L174 HydrophobicContact CB-CD2 4.32Å; R172-L174 HydrophobicContact CB-CG 3.88Å; R172-L174 PolarHBondContact O-N 3.08Å; L174-V176 HydrophobicContact CB-CG2 3.98Å; L174-E425 PolarHBondContact O-N 3.11Å; L174-G426 PolarHBondContact O-N 3.01Å
175	T	95.7	Very high	91.2	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.043	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.4	163.1	-64.2	0	0	0	0	107.9	G151 T152 L153 F177 I410 I421 L423 E425	G151-T175 PolarHBondContact O-N 3.1Å; T152-T175 CarbonylContact C-O 3.5Å; T152-T175 WeakPolarHBondContact CA-O 3.43Å; T152-T175 HydrophobicContact CG2-CG2 4.32Å; L153-T175 PolarHBondContact N-O 3.3Å; T175-F177 HydrophobicContact CG2-CE2 3.94Å; T175-F177 HydrophobicContact CG2-CZ 4.46Å; T175-I410 HydrophobicContact CG2-CD1 3.69Å; T175-I421 HydrophobicContact CG2-CD1 4.23Å; T175-L423 CarbonylContact C-O 3.46Å; T175-L423 VanDerWaalsContact CA-O 3.27Å; T175-L423 WeakPolarHBondContact CA-O 3.45Å; T175-E425 PolarHBondContact OG1-N 2.82Å; T175-E425 VanDerWaalsContact OG1-N 3.08Å
176	V	96.2	Very high	90.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.3	-170.8	-178.1	0	0	0	0	109.8	L153 I157 M169 L174 V422 L423	L153-V176 HydrophobicContact CB-CG1 4.49Å; L153-V176 HydrophobicContact CB-CG2 4.29Å; L153-V176 HydrophobicContact CD2-CG1 4.2Å; L153-V176 HydrophobicContact CD2-CG2 4.5Å; L153-V176 HydrophobicContact CG-CG1 4.47Å; L153-V176 WeakPolarHBondContact O-CA 3.48Å; I157-V176 HydrophobicContact CD1-CG1 3.48Å; I157-V176 VanDerWaalsContact CD1-CG1 3.48Å; I157-V176 HydrophobicContact CG1-CG1 3.68Å; M169-V176 HydrophobicContact CB-CG2 4.37Å; M169-V176 HydrophobicContact CE-CG1 4.41Å; M169-V176 HydrophobicContact CE-CG2 4.48Å; M169-V176 HydrophobicContact SD-CG1 4.48Å; M169-V176 HydrophobicContact SD-CG2 4.03Å; L174-V176 HydrophobicContact CB-CG2 3.98Å; V176-V422 HydrophobicContact CG1-CB 4.48Å; V176-V422 PolarHBondContact O-N 3.31Å; V176-L423 HydrophobicContact CB-CB 4.06Å; V176-L423 HydrophobicContact CB-CD1 4.39Å; V176-L423 HydrophobicContact CB-CG 4.5Å; V176-L423 HydrophobicContact CG2-CB 4.11Å; V176-L423 HydrophobicContact CG2-CD1 3.87Å; V176-L423 HydrophobicContact CG2-CG 4.44Å; V176-L423 PolarHBondContact N-O 2.86Å; V176-L423 PolarHBondContact O-N 2.85Å
177	F	95.7	Very high	89.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.4	169.9	-65.4	-84.7	0	0	0	109.9	T152 L153 I154 S155 T175 F398 I402 I410 T417 A420 I421	T152-F177 HydrophobicContact CG2-CD2 3.87Å; T152-F177 HydrophobicContact CG2-CE2 3.86Å; L153-F177 PolarHBondContact O-N 3.37Å; I154-F177 HydrophobicContact CG1-CB 4.24Å; I154-F177 HydrophobicContact CG1-CD2 4.2Å; I154-F177 HydrophobicContact CG2-CB 4.48Å; S155-F177 PolarHBondContact N-O 3.49Å; T175-F177 HydrophobicContact CG2-CE2 3.94Å; T175-F177 HydrophobicContact CG2-CZ 4.46Å; F177-F398 HydrophobicContact CB-CE1 3.83Å; F177-F398 HydrophobicContact CB-CZ 4.24Å; F177-F398 AromaticContact CD1-CE1 4Å; F177-F398 HydrophobicContact CD1-CE1 4Å; F177-F398 AromaticContact CD1-CZ 3.66Å; F177-F398 HydrophobicContact CD1-CZ 3.66Å; F177-F398 HydrophobicContact CE1-CZ 4.25Å; F177-F398 AromaticContact CG-CE1 3.94Å; F177-F398 HydrophobicContact CG-CE1 3.94Å; F177-F398 HydrophobicContact CG-CZ 4.1Å; F177-I402 HydrophobicContact CD2-CD1 4.43Å; F177-I402 HydrophobicContact CE1-CD1 4.29Å; F177-I402 HydrophobicContact CE2-CD1 4.12Å; F177-I402 HydrophobicContact CZ-CD1 4.04Å; F177-I402 HydrophobicContact CZ-CG2 4.45Å; F177-I410 HydrophobicContact CE2-CD1 4.16Å; F177-I410 HydrophobicContact CZ-CD1 3.9Å; F177-I410 HydrophobicContact CZ-CG1 4.05Å; F177-I410 HydrophobicContact CZ-CG2 4.19Å; F177-T417 HydrophobicContact CE1-CG2 4Å; F177-T417 HydrophobicContact CZ-CG2 4.46Å; F177-A420 CarbonylContact C-O 3.6Å; F177-A420 WeakPolarHBondContact CA-O 3.08Å; F177-A420 HydrophobicContact CD1-CB 4.21Å; F177-I421 HydrophobicContact CD1-CB 3.83Å; F177-I421 HydrophobicContact CD1-CG1 4.18Å; F177-I421 HydrophobicContact CE1-CB 3.67Å; F177-I421 HydrophobicContact CE1-CD1 4Å; F177-I421 HydrophobicContact CE1-CG1 3.9Å; F177-I421 HydrophobicContact CZ-CD1 4.03Å; F177-I421 HydrophobicContact CZ-CG1 4.3Å
178	G	94.5	Very high	89.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.3	174.6	0	0	0	0	0	110.6	S155 D180 C181 A420	S155-G178 WeakPolarHBondContact O-CA 3.46Å; G178-D180 PolarHBondContact O-N 3.2Å; G178-C181 WeakPolarHBondContact O-CA 3.2Å; G178-C181 WeakPolarHBondContact O-CB 3.4Å; G178-C181 PolarHBondContact O-N 3.04Å; G178-A420 PolarHBondContact N-O 2.82Å
179	M	94.5	Very high	88.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	173.7	-67.8	-57.2	-61.2	0	0	112.5	I154 S155 F156 C181 A193 Y391 N394 I395 F398	I154-M179 HydrophobicContact CG2-CG 3.87Å; I154-M179 HydrophobicContact CG2-SD 3.54Å; I154-M179 VanDerWaalsContact CG2-SD 3.54Å; S155-M179 PolarHBondContact O-N 3.47Å; F156-M179 HydrophobicContact CD1-CB 3.98Å; F156-M179 HydrophobicContact CE1-CB 3.96Å; M179-C181 VanDerWaalsContact C-N 3.34Å; M179-A193 HydrophobicContact CB-CB 4.11Å; M179-A193 HydrophobicContact CE-CB 3.92Å; M179-Y391 HydrophobicContact CB-CE2 4.43Å; M179-Y391 HydrophobicContact CG-CE2 4.32Å; M179-N394 HydrophobicContact CE-CB 4.26Å; M179-I395 HydrophobicContact CE-CG1 4.11Å; M179-I395 HydrophobicContact CG-CG1 4.3Å; M179-I395 HydrophobicContact SD-CG1 4.1Å; M179-F398 HydrophobicContact SD-CD1 3.92Å; M179-F398 HydrophobicContact SD-CE1 4.43Å; M179-F398 HydrophobicContact SD-CG 4.47Å
180	D	90.6	Very high	88.6	Confident	26 Å²	26	49 Å²	49	14%	0.139	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-17.4	169.5	52.4	-70.7	0	0	0	113.7	F156 I157 Y158 P159 G178	F156-D180 HydrophobicContact CD1-CB 3.91Å; F156-D180 HydrophobicContact CE1-CB 4.44Å; I157-D180 PolarHBondContact N-OD1 2.63Å; Y158-D180 VanDerWaalsContact CA-OD2 3.29Å; Y158-D180 WeakPolarHBondContact CA-OD2 3.47Å; Y158-D180 HydrophobicContact CD1-CB 4.07Å; Y158-D180 HydrophobicContact CE1-CB 3.88Å; Y158-D180 PolarHBondContact N-OD1 3.45Å; Y158-D180 PolarHBondContact N-OD2 2.85Å; P159-D180 VanDerWaalsContact CD-OD2 3.29Å; P159-D180 WeakPolarHBondContact CD-OD2 3.23Å; G178-D180 PolarHBondContact O-N 3.2Å
181	C	90.5	Very high	88.4	Confident	22 Å²	22	48.3 Å²	48.3	15%	0.149	24%	0.243	C	C	.	.	S	Bend	trans	-95.6	0.1	-178.3	-65.8	0	0	0	0	113.2	G178 M179 G419	G178-C181 WeakPolarHBondContact O-CA 3.2Å; G178-C181 WeakPolarHBondContact O-CB 3.4Å; G178-C181 PolarHBondContact O-N 3.04Å; M179-C181 VanDerWaalsContact C-N 3.34Å; C181-G419 CarbonylContact O-C 3.44Å
182	V	89.9	Confident	88.4	Confident	12 Å²	12	44.4 Å²	44.4	7%	0.073	21%	0.214	C	C	.	.			trans	-60.6	125.6	176.4	174.8	0	0	0	0	109.9	A188 F191 A420	V182-A188 HydrophobicContact CG1-CB 4.16Å; V182-F191 HydrophobicContact CG1-CD2 3.68Å; V182-F191 HydrophobicContact CG1-CE2 3.67Å; V182-A420 HydrophobicContact CG2-CB 4.15Å
183	P	86.2	Confident	88.7	Confident	21 Å²	21	39.7 Å²	39.7	14%	0.136	20%	0.197	C	C	.	.			trans	-70	140.6	-178.4	27.8	-33.7	0	0	0	111.4	I185 A188 V416 I435	P183-I185 VanDerWaalsContact C-N 3.26Å; P183-I185 HydrophobicContact CG-CD1 4.45Å; P183-I185 HydrophobicContact CG-CG1 4.49Å; P183-I185 PolarHBondContact O-N 2.72Å; P183-A188 WeakPolarHBondContact O-CB 3.21Å; P183-V416 HydrophobicContact CG-CG2 4.41Å; P183-I435 HydrophobicContact CB-CD1 3.71Å; P183-I435 HydrophobicContact CG-CD1 4.23Å
184	R	79.9	Confident	88.7	Confident	118 Å²	118	35.4 Å²	35.4	45%	0.445	18%	0.18	S	C	.	.			trans	-82.3	63.6	-179.3	-66.9	-177.1	176.5	178.6	1	112.6	Y290	R184-Y290 PolarHBondContact NH1-OH 2.98Å; R184-Y290 VanDerWaalsContact NH1-OH 3.13Å; R184-Y290 PolarHBondContact NH2-OH 3.41Å
185	I	81.7	Confident	88.5	Confident	33 Å²	33	37 Å²	37	17%	0.169	19%	0.191	C	C	.	.			trans	-106	156.7	175.5	59.2	177.2	0	0	0	111	P183 R187 A188 Q189 V416	P183-I185 VanDerWaalsContact C-N 3.26Å; P183-I185 HydrophobicContact CG-CD1 4.45Å; P183-I185 HydrophobicContact CG-CG1 4.49Å; P183-I185 PolarHBondContact O-N 2.72Å; I185-R187 VanDerWaalsContact C-N 3.27Å; I185-R187 HydrophobicContact CD1-CG 3.61Å; I185-R187 VanDerWaalsContact CD1-NE 3.34Å; I185-R187 HydrophobicContact CG1-CG 3.85Å; I185-R187 PolarHBondContact O-N 3.48Å; I185-R187 VanDerWaalsContact O-N 3.15Å; I185-A188 HydrophobicContact CD1-CB 4.47Å; I185-A188 HydrophobicContact CG1-CB 3.58Å; I185-A188 WeakPolarHBondContact O-CA 3.33Å; I185-A188 WeakPolarHBondContact O-CB 3.3Å; I185-A188 PolarHBondContact O-N 2.96Å; I185-Q189 PolarHBondContact O-N 3.22Å; I185-V416 HydrophobicContact CD1-CG2 3.8Å; I185-V416 HydrophobicContact CG1-CG2 4.41Å
186	S	73.9	Confident	88.4	Confident	102 Å²	102	37.6 Å²	37.6	71%	0.713	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-53.7	-40.5	-173.5	-53.3	0	0	0	0	113.7	A188	S186-A188 VanDerWaalsContact C-N 3.26Å; S186-A188 PolarHBondContact O-N 3.41Å
187	R	78.8	Confident	88.4	Confident	120 Å²	120	38.3 Å²	38.3	45%	0.453	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-67.9	-24.5	177.1	68.8	178	179.8	145.7	-0.2	114	I185 D414 D415 V416	I185-R187 VanDerWaalsContact C-N 3.27Å; I185-R187 HydrophobicContact CD1-CG 3.61Å; I185-R187 VanDerWaalsContact CD1-NE 3.34Å; I185-R187 HydrophobicContact CG1-CG 3.85Å; I185-R187 PolarHBondContact O-N 3.48Å; I185-R187 VanDerWaalsContact O-N 3.15Å; R187-D414 IonicContact CZ-OD1 3.06Å; R187-D414 IonicContact NH1-OD1 2.83Å; R187-D414 PolarHBondContact NH1-OD1 2.9Å; R187-D414 IonicContact NH2-OD1 3.98Å; R187-D414 PolarHBondContact NH2-OD1 2.74Å; R187-D415 IonicContact CZ-OD2 3.46Å; R187-D415 VanDerWaalsContact NH2-N 3.11Å; R187-D415 IonicContact NH2-OD2 2.93Å; R187-D415 PolarHBondContact NH2-OD2 2.8Å; R187-V416 HydrophobicContact CG-CG2 4.24Å
188	A	84.6	Confident	88.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-92.6	-10	-174	0	0	0	0	0	114.7	V182 P183 I185 S186 V190 F191 D192 V416	V182-A188 HydrophobicContact CG1-CB 4.16Å; P183-A188 WeakPolarHBondContact O-CB 3.21Å; I185-A188 HydrophobicContact CD1-CB 4.47Å; I185-A188 HydrophobicContact CG1-CB 3.58Å; I185-A188 WeakPolarHBondContact O-CA 3.33Å; I185-A188 WeakPolarHBondContact O-CB 3.3Å; I185-A188 PolarHBondContact O-N 2.96Å; S186-A188 VanDerWaalsContact C-N 3.26Å; S186-A188 PolarHBondContact O-N 3.41Å; A188-V190 PolarHBondContact O-N 2.85Å; A188-V190 VanDerWaalsContact O-N 3.11Å; A188-F191 VanDerWaalsContact CA-CE2 3.43Å; A188-F191 HydrophobicContact CB-CD2 4.31Å; A188-F191 HydrophobicContact CB-CE2 3.39Å; A188-F191 HydrophobicContact CB-CZ 3.64Å; A188-F191 WeakPolarHBondContact O-CD2 3.24Å; A188-F191 PolarHBondContact O-N 3.14Å; A188-F191 VanDerWaalsContact O-N 3.1Å; A188-D192 PolarHBondContact O-N 3.45Å; A188-V416 HydrophobicContact CB-CG2 4.01Å
189	Q	84.4	Confident	88.3	Confident	136 Å²	136	43.4 Å²	43.4	64%	0.636	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-56.3	-31.6	-179.5	-68.2	-179	-11.2	0	0	112.9	I185 F191 D192	I185-Q189 PolarHBondContact O-N 3.22Å; Q189-F191 PolarHBondContact O-N 3.28Å; Q189-D192 PolarHBondContact O-N 3.3Å
190	V	85.8	Confident	88.4	Confident	77 Å²	77	43.8 Å²	43.8	47%	0.467	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-70.7	-12.9	-177.8	-62.3	0	0	0	0	114.5	A188 N394 K397	A188-V190 PolarHBondContact O-N 2.85Å; A188-V190 VanDerWaalsContact O-N 3.11Å; V190-N394 PolarHBondContact O-OD1 3.41Å; V190-K397 HydrophobicContact CB-CD 4.25Å; V190-K397 HydrophobicContact CG2-CD 4.48Å; V190-K397 WeakPolarHBondContact O-CD 3.32Å
191	F	88.9	Confident	88.7	Confident	11 Å²	11	43.1 Å²	43.1	5%	0.048	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-128.4	17.6	175	46.1	-104.8	0	0	0	113.2	V182 A188 Q189 A193 N394 K397 F398 V416	V182-F191 HydrophobicContact CG1-CD2 3.68Å; V182-F191 HydrophobicContact CG1-CE2 3.67Å; A188-F191 VanDerWaalsContact CA-CE2 3.43Å; A188-F191 HydrophobicContact CB-CD2 4.31Å; A188-F191 HydrophobicContact CB-CE2 3.39Å; A188-F191 HydrophobicContact CB-CZ 3.64Å; A188-F191 WeakPolarHBondContact O-CD2 3.24Å; A188-F191 PolarHBondContact O-N 3.14Å; A188-F191 VanDerWaalsContact O-N 3.1Å; Q189-F191 PolarHBondContact O-N 3.28Å; F191-A193 PolarHBondContact O-N 3.25Å; F191-N394 HydrophobicContact CB-CB 4.39Å; F191-N394 VanDerWaalsContact CB-O 3.23Å; F191-N394 WeakPolarHBondContact CB-O 3.41Å; F191-K397 HydrophobicContact CB-CB 4.28Å; F191-K397 HydrophobicContact CD1-CB 4.38Å; F191-F398 HydrophobicContact CB-CB 3.91Å; F191-F398 HydrophobicContact CD2-CB 4.3Å; F191-F398 HydrophobicContact CD2-CD2 4.12Å; F191-F398 HydrophobicContact CE2-CD2 4.26Å; F191-F398 HydrophobicContact CG-CB 4.01Å; F191-V416 HydrophobicContact CD2-CG1 4.43Å; F191-V416 HydrophobicContact CE2-CB 4.44Å; F191-V416 HydrophobicContact CE2-CG1 3.3Å; F191-V416 HydrophobicContact CE2-CG2 4.3Å; F191-V416 HydrophobicContact CZ-CB 4.26Å; F191-V416 HydrophobicContact CZ-CG1 3.4Å; F191-V416 VanDerWaalsContact CZ-CG1 3.4Å; F191-V416 HydrophobicContact CZ-CG2 3.96Å
192	D	90.8	Very high	88.9	Confident	11 Å²	11	42.1 Å²	42.1	6%	0.059	22%	0.224	C	C	.	.			trans	-71.8	100.3	172.7	-176.9	-10.6	0	0	0	110.7	A188 Q189 L194 S195 S196	A188-D192 PolarHBondContact O-N 3.45Å; Q189-D192 PolarHBondContact O-N 3.3Å; D192-L194 WeakPolarHBondContact OD1-CB 3.35Å; D192-L194 PolarHBondContact OD1-N 3.5Å; D192-S195 VanDerWaalsContact CG-OG 3.25Å; D192-S195 PolarHBondContact OD1-N 2.67Å; D192-S195 WeakPolarHBondContact OD2-CB 3.29Å; D192-S195 PolarHBondContact OD2-OG 3.27Å; D192-S196 PolarHBondContact O-N 3.08Å; D192-S196 PolarHBondContact O-OG 3.19Å
193	A	93.6	Very high	89.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.8	-32.8	178.8	0	0	0	0	0	113.1	F156 M179 F191 S196 M197 Y391 N394	F156-A193 HydrophobicContact CE1-CB 3.97Å; F156-A193 HydrophobicContact CZ-CB 3.61Å; M179-A193 HydrophobicContact CB-CB 4.11Å; M179-A193 HydrophobicContact CE-CB 3.92Å; F191-A193 PolarHBondContact O-N 3.25Å; A193-S196 PolarHBondContact O-N 3.15Å; A193-M197 VanDerWaalsContact O-CG 3.3Å; A193-M197 WeakPolarHBondContact O-CG 3.42Å; A193-M197 PolarHBondContact O-N 3.4Å; A193-Y391 HydrophobicContact CB-CD2 3.88Å; A193-Y391 HydrophobicContact CB-CE2 3.8Å; A193-N394 HydrophobicContact CB-CB 4.49Å
194	L	92.2	Very high	89.8	Confident	45 Å²	45	46.9 Å²	46.9	24%	0.236	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-43.9	179.2	-66.3	176.8	0	0	0	110.6	F156 D192 S196 M197 A198	F156-L194 HydrophobicContact CD1-CD2 4.46Å; F156-L194 HydrophobicContact CE1-CD2 3.72Å; F156-L194 HydrophobicContact CE1-CG 4.29Å; F156-L194 HydrophobicContact CZ-CD2 4.34Å; D192-L194 WeakPolarHBondContact OD1-CB 3.35Å; D192-L194 PolarHBondContact OD1-N 3.5Å; L194-S196 VanDerWaalsContact C-N 3.32Å; L194-S196 PolarHBondContact O-N 3.44Å; L194-M197 PolarHBondContact O-N 2.81Å; L194-A198 WeakPolarHBondContact O-CB 3.3Å; L194-A198 PolarHBondContact O-N 3.03Å
195	S	91.2	Very high	90.6	Very high	33 Å²	33	41.2 Å²	41.2	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-41.8	175.3	-72.2	0	0	0	0	111.7	D192 A198 N199 V239	D192-S195 VanDerWaalsContact CG-OG 3.25Å; D192-S195 PolarHBondContact OD1-N 2.67Å; D192-S195 WeakPolarHBondContact OD2-CB 3.29Å; D192-S195 PolarHBondContact OD2-OG 3.27Å; S195-A198 PolarHBondContact O-N 2.88Å; S195-N199 WeakPolarHBondContact O-CB 3.5Å; S195-N199 PolarHBondContact O-N 3.24Å; S195-V239 VanDerWaalsContact O-CG1 3.31Å; S195-V239 WeakPolarHBondContact O-CG1 3.19Å
196	S	93.4	Very high	91.4	Very high	20 Å²	20	39.7 Å²	39.7	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-45.5	176.1	-64.6	0	0	0	0	112.6	D192 A193 L194 I200 N394	D192-S196 PolarHBondContact O-N 3.08Å; D192-S196 PolarHBondContact O-OG 3.19Å; A193-S196 PolarHBondContact O-N 3.15Å; L194-S196 VanDerWaalsContact C-N 3.32Å; L194-S196 PolarHBondContact O-N 3.44Å; S196-I200 WeakPolarHBondContact O-CG1 3.35Å; S196-I200 PolarHBondContact O-N 3.23Å; S196-N394 VanDerWaalsContact CB-ND2 3.31Å; S196-N394 WeakPolarHBondContact CB-ND2 2.89Å; S196-N394 PolarHBondContact OG-ND2 3.24Å
197	M	94.7	Very high	92.5	Very high	16 Å²	16	37.3 Å²	37.3	8%	0.079	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-37.4	178.3	-65.7	-54.2	102.7	0	0	112	R78 F156 A193 L194 I200 A201 P380	R78-M197 PolarHBondContact NH1-SD 2.93Å; F156-M197 HydrophobicContact CE2-CG 4.48Å; F156-M197 HydrophobicContact CZ-CG 4.33Å; A193-M197 VanDerWaalsContact O-CG 3.3Å; A193-M197 WeakPolarHBondContact O-CG 3.42Å; A193-M197 PolarHBondContact O-N 3.4Å; L194-M197 PolarHBondContact O-N 2.81Å; M197-I200 HydrophobicContact CE-CD1 4.25Å; M197-I200 PolarHBondContact O-N 3.37Å; M197-A201 WeakPolarHBondContact O-CB 3.41Å; M197-A201 PolarHBondContact O-N 3.46Å; M197-P380 HydrophobicContact CB-CG 4.18Å; M197-P380 HydrophobicContact SD-CB 3.81Å; M197-P380 HydrophobicContact SD-CG 4.33Å
198	A	93.6	Very high	93.3	Very high	29 Å²	29	32.5 Å²	32.5	24%	0.24	17%	0.172	C	C	.	.	H	α-helix	trans	-63.7	-43	176.1	0	0	0	0	0	111.8	L194 S195 I200 A201 G202 V239 A240	L194-A198 WeakPolarHBondContact O-CB 3.3Å; L194-A198 PolarHBondContact O-N 3.03Å; S195-A198 PolarHBondContact O-N 2.88Å; A198-I200 PolarHBondContact O-N 3.39Å; A198-A201 PolarHBondContact O-N 3.15Å; A198-G202 PolarHBondContact O-N 3.17Å; A198-V239 HydrophobicContact CB-CB 3.99Å; A198-V239 HydrophobicContact CB-CG1 4.22Å; A198-A240 HydrophobicContact CB-CB 4.12Å; A198-A240 VanDerWaalsContact O-CA 3.23Å; A198-A240 WeakPolarHBondContact O-CA 3.28Å; A198-A240 VanDerWaalsContact O-CB 3.29Å; A198-A240 WeakPolarHBondContact O-CB 3.36Å
199	N	95	Very high	93.9	Very high	77 Å²	77	32.5 Å²	32.5	41%	0.412	17%	0.172	S	C	.	.	H	α-helix	trans	-58.3	-48.5	175.6	-174.9	8.8	0	0	0	111.1	S195 A201 G202 Y203 V239 A243	S195-N199 WeakPolarHBondContact O-CB 3.5Å; S195-N199 PolarHBondContact O-N 3.24Å; N199-A201 PolarHBondContact O-N 3.27Å; N199-G202 PolarHBondContact O-N 3.28Å; N199-Y203 PolarHBondContact O-N 3.24Å; N199-V239 HydrophobicContact CB-CG1 3.88Å; N199-A243 WeakPolarHBondContact O-CB 3.43Å; N199-A243 WeakPolarHBondContact OD1-CB 3.39Å
200	I	96.5	Very high	94.4	Very high	9 Å²	9	27.4 Å²	27.4	5%	0.046	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-42.3	177.3	-65.4	173.8	0	0	0	111.5	S196 M197 A198 G202 Y203 K204 L383 Q386 S387 L390	S196-I200 WeakPolarHBondContact O-CG1 3.35Å; S196-I200 PolarHBondContact O-N 3.23Å; M197-I200 HydrophobicContact CE-CD1 4.25Å; M197-I200 PolarHBondContact O-N 3.37Å; A198-I200 PolarHBondContact O-N 3.39Å; I200-G202 VanDerWaalsContact C-N 3.33Å; I200-G202 PolarHBondContact O-N 2.88Å; I200-Y203 PolarHBondContact O-N 3.03Å; I200-K204 VanDerWaalsContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CB 3.46Å; I200-K204 PolarHBondContact O-N 3.3Å; I200-L383 HydrophobicContact CG2-CB 4.09Å; I200-L383 HydrophobicContact CG2-CD2 4.49Å; I200-Q386 HydrophobicContact CD1-CB 4.37Å; I200-Q386 HydrophobicContact CD1-CG 4.14Å; I200-Q386 HydrophobicContact CG1-CG 4.49Å; I200-S387 WeakPolarHBondContact CD1-OG 3.21Å; I200-L390 HydrophobicContact CD1-CD1 3.91Å; I200-L390 HydrophobicContact CD1-CG 4.48Å; I200-L390 HydrophobicContact CG1-CD1 4.21Å
201	A	96.4	Very high	94.9	Very high	13 Å²	13	30.1 Å²	30.1	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-41.8	177.5	0	0	0	0	0	111.7	M197 A198 N199 K204 A205 L348 F379 P380	M197-A201 WeakPolarHBondContact O-CB 3.41Å; M197-A201 PolarHBondContact O-N 3.46Å; A198-A201 PolarHBondContact O-N 3.15Å; N199-A201 PolarHBondContact O-N 3.27Å; A201-K204 PolarHBondContact O-N 3.06Å; A201-A205 VanDerWaalsContact O-CB 3.29Å; A201-A205 WeakPolarHBondContact O-CB 3.43Å; A201-A205 PolarHBondContact O-N 3.47Å; A201-L348 HydrophobicContact CB-CD1 4.38Å; A201-L348 HydrophobicContact CB-CD2 4.36Å; A201-F379 HydrophobicContact CB-CB 4.03Å; A201-P380 HydrophobicContact CB-CG 4.49Å
202	G	96.2	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-47.1	175.4	0	0	0	0	0	113.2	A198 N199 I200 V206 A240	A198-G202 PolarHBondContact O-N 3.17Å; N199-G202 PolarHBondContact O-N 3.28Å; I200-G202 VanDerWaalsContact C-N 3.33Å; I200-G202 PolarHBondContact O-N 2.88Å; G202-V206 PolarHBondContact O-N 2.78Å; G202-A240 VanDerWaalsContact CA-O 3.27Å; G202-A240 WeakPolarHBondContact CA-O 3.23Å
203	Y	97.5	Very high	95.5	Very high	104 Å²	104	31.2 Å²	31.2	41%	0.408	17%	0.172	S	C	.	.	H	α-helix	trans	-59.1	-50.2	172.9	173.1	-91.4	0	0	0	111.4	N199 I200 A205 V206 I207 T247 L383	N199-Y203 PolarHBondContact O-N 3.24Å; I200-Y203 PolarHBondContact O-N 3.03Å; Y203-A205 VanDerWaalsContact C-N 3.33Å; Y203-A205 PolarHBondContact O-N 3.48Å; Y203-V206 PolarHBondContact O-N 3.38Å; Y203-V206 VanDerWaalsContact O-N 3.16Å; Y203-I207 HydrophobicContact CD1-CG1 4.15Å; Y203-I207 HydrophobicContact CE1-CD1 4.38Å; Y203-I207 HydrophobicContact CE1-CG1 3.64Å; Y203-I207 HydrophobicContact CE2-CD1 4.4Å; Y203-I207 HydrophobicContact CE2-CG1 4.38Å; Y203-I207 PolarHBondContact O-N 3.47Å; Y203-T247 HydrophobicContact CD2-CG2 3.6Å; Y203-T247 WeakPolarHBondContact CD2-OG1 3.3Å; Y203-T247 HydrophobicContact CE2-CG2 3.86Å; Y203-T247 HydrophobicContact CG-CG2 4.48Å; Y203-L383 HydrophobicContact CD1-CD1 3.87Å; Y203-L383 HydrophobicContact CE1-CD1 3.67Å
204	K	97.2	Very high	95.5	Very high	29 Å²	29	34.9 Å²	34.9	13%	0.126	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-34.8	-175.7	-171.4	52.8	166.1	155.3	0	112	I200 A201 V206 I207 E208 F379 R382 L383	I200-K204 VanDerWaalsContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CB 3.46Å; I200-K204 PolarHBondContact O-N 3.3Å; A201-K204 PolarHBondContact O-N 3.06Å; K204-V206 VanDerWaalsContact C-N 3.28Å; K204-V206 PolarHBondContact O-N 2.99Å; K204-I207 HydrophobicContact CD-CB 4.48Å; K204-I207 PolarHBondContact O-N 3.47Å; K204-E208 HydrophobicContact CD-CG 4.21Å; K204-E208 WeakPolarHBondContact CE-OE1 3.41Å; K204-E208 HydrophobicContact CG-CG 4.25Å; K204-E208 IonicContact NZ-OE1 3.94Å; K204-E208 PolarHBondContact NZ-OE1 3.3Å; K204-E208 WeakPolarHBondContact O-CG 3.28Å; K204-E208 PolarHBondContact O-N 2.97Å; K204-F379 HydrophobicContact CB-CD1 4.34Å; K204-F379 HydrophobicContact CG-CD1 4.1Å; K204-R382 VanDerWaalsContact CE-CB 3.45Å; K204-R382 WeakPolarHBondContact CE-O 3.33Å; K204-R382 HydrophobicContact CG-CB 4.38Å; K204-L383 HydrophobicContact CD-CD1 4.19Å
205	A	97.1	Very high	95.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.1	-44	172.7	0	0	0	0	0	112.1	A201 Y203 A209 I317 V346 L348 F379	A201-A205 VanDerWaalsContact O-CB 3.29Å; A201-A205 WeakPolarHBondContact O-CB 3.43Å; A201-A205 PolarHBondContact O-N 3.47Å; Y203-A205 VanDerWaalsContact C-N 3.33Å; Y203-A205 PolarHBondContact O-N 3.48Å; A205-A209 VanDerWaalsContact O-CB 3.27Å; A205-A209 WeakPolarHBondContact O-CB 3.38Å; A205-A209 PolarHBondContact O-N 3.33Å; A205-I317 HydrophobicContact CB-CD1 4.39Å; A205-I317 HydrophobicContact CB-CG2 4.12Å; A205-V346 HydrophobicContact CB-CG1 3.84Å; A205-L348 HydrophobicContact CB-CD1 4.15Å; A205-L348 HydrophobicContact CB-CD2 3.96Å; A205-L348 HydrophobicContact CB-CG 4.23Å; A205-F379 HydrophobicContact CB-CE1 4.47Å
206	V	97.4	Very high	95.8	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-40.5	178.8	179.8	0	0	0	0	111.4	G202 Y203 K204 A209 A210 F217 A244 T247 A248 M251 I317	G202-V206 PolarHBondContact O-N 2.78Å; Y203-V206 PolarHBondContact O-N 3.38Å; Y203-V206 VanDerWaalsContact O-N 3.16Å; K204-V206 VanDerWaalsContact C-N 3.28Å; K204-V206 PolarHBondContact O-N 2.99Å; V206-A209 PolarHBondContact O-N 3.18Å; V206-A210 WeakPolarHBondContact O-CB 3.41Å; V206-A210 PolarHBondContact O-N 2.78Å; V206-F217 HydrophobicContact CG1-CE2 3.85Å; V206-A244 HydrophobicContact CG2-CB 3.87Å; V206-A244 WeakPolarHBondContact CG2-O 3.45Å; V206-T247 HydrophobicContact CB-CG2 3.9Å; V206-T247 HydrophobicContact CG1-CG2 3.83Å; V206-T247 HydrophobicContact CG2-CG2 4.39Å; V206-A248 HydrophobicContact CG1-CB 4.19Å; V206-A248 HydrophobicContact CG2-CB 4.34Å; V206-M251 HydrophobicContact CG1-SD 3.89Å; V206-I317 HydrophobicContact CG2-CD1 3.74Å
207	I	97.2	Very high	95.9	Very high	52 Å²	52	44.7 Å²	44.7	27%	0.267	24%	0.24	S	C	.	.	H	α-helix	trans	-67.3	-43	177.6	-59	-55	0	0	0	111.7	Y203 K204 A209 A210 N211 M251	Y203-I207 HydrophobicContact CD1-CG1 4.15Å; Y203-I207 HydrophobicContact CE1-CD1 4.38Å; Y203-I207 HydrophobicContact CE1-CG1 3.64Å; Y203-I207 HydrophobicContact CE2-CD1 4.4Å; Y203-I207 HydrophobicContact CE2-CG1 4.38Å; Y203-I207 PolarHBondContact O-N 3.47Å; K204-I207 HydrophobicContact CD-CB 4.48Å; K204-I207 PolarHBondContact O-N 3.47Å; I207-A209 VanDerWaalsContact C-N 3.32Å; I207-A210 PolarHBondContact O-N 3.45Å; I207-N211 WeakPolarHBondContact O-CB 3.22Å; I207-N211 PolarHBondContact O-N 2.87Å; I207-M251 HydrophobicContact CD1-SD 4.09Å
208	E	96.2	Very high	95.9	Very high	20 Å²	20	47.1 Å²	47.1	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-41.3	174.4	-67.7	-62.4	160	0	0	110.7	K204 N211 S212 I374 F379	K204-E208 HydrophobicContact CD-CG 4.21Å; K204-E208 WeakPolarHBondContact CE-OE1 3.41Å; K204-E208 HydrophobicContact CG-CG 4.25Å; K204-E208 IonicContact NZ-OE1 3.94Å; K204-E208 PolarHBondContact NZ-OE1 3.3Å; K204-E208 WeakPolarHBondContact O-CG 3.28Å; K204-E208 PolarHBondContact O-N 2.97Å; E208-N211 PolarHBondContact O-N 2.84Å; E208-S212 PolarHBondContact O-N 2.92Å; E208-S212 PolarHBondContact O-OG 3.26Å; E208-I374 HydrophobicContact CB-CD1 4Å; E208-F379 HydrophobicContact CB-CE1 4.49Å; E208-F379 HydrophobicContact CG-CE1 4.17Å
209	A	96.8	Very high	95.8	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-46.4	174.4	0	0	0	0	0	112	A205 V206 I207 N211 S212 F213 I315 V344 V346	A205-A209 VanDerWaalsContact O-CB 3.27Å; A205-A209 WeakPolarHBondContact O-CB 3.38Å; A205-A209 PolarHBondContact O-N 3.33Å; V206-A209 PolarHBondContact O-N 3.18Å; I207-A209 VanDerWaalsContact C-N 3.32Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 3.48Å; A209-S212 PolarHBondContact O-N 3.38Å; A209-F213 WeakPolarHBondContact O-CB 3.43Å; A209-F213 PolarHBondContact O-N 2.95Å; A209-I315 HydrophobicContact CB-CD1 4.13Å; A209-I315 HydrophobicContact CB-CG2 3.8Å; A209-V344 HydrophobicContact CB-CG1 4.29Å; A209-V346 HydrophobicContact CB-CG2 3.88Å
210	A	95.8	Very high	95.7	Very high	29 Å²	29	47.6 Å²	47.6	24%	0.24	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-36.5	178.2	0	0	0	0	0	112.6	V206 I207 F217 M251	V206-A210 WeakPolarHBondContact O-CB 3.41Å; V206-A210 PolarHBondContact O-N 2.78Å; I207-A210 PolarHBondContact O-N 3.45Å; A210-F217 HydrophobicContact CB-CE1 3.85Å; A210-F217 HydrophobicContact CB-CE2 4.25Å; A210-F217 HydrophobicContact CB-CZ 3.69Å; A210-M251 HydrophobicContact CB-CE 3.9Å
211	N	95.7	Very high	95.5	Very high	133 Å²	133	54 Å²	54	71%	0.711	29%	0.291	S	S	*	.	H	α-helix	trans	-70.5	-32.7	177.9	-173.8	66.6	0	0	0	112.5	I207 E208 A209	I207-N211 WeakPolarHBondContact O-CB 3.22Å; I207-N211 PolarHBondContact O-N 2.87Å; E208-N211 PolarHBondContact O-N 2.84Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 3.48Å
212	S	95.5	Very high	95.3	Very high	28 Å²	28	56.6 Å²	56.6	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-86	-25.3	176.6	-66.8	0	0	0	0	113.7	E208 A209 I372	E208-S212 PolarHBondContact O-N 2.92Å; E208-S212 PolarHBondContact O-OG 3.26Å; A209-S212 PolarHBondContact O-N 3.38Å; S212-I372 WeakPolarHBondContact O-CD1 3.49Å
213	F	96.4	Very high	95.1	Very high	17 Å²	17	62.2 Å²	62.2	8%	0.075	35%	0.353	C	S	.	.			trans	-80.9	122.9	-176.1	-172	-123.4	0	0	0	111.8	A209 R215 F217 A230 D314 I315 G342 V344	A209-F213 WeakPolarHBondContact O-CB 3.43Å; A209-F213 PolarHBondContact O-N 2.95Å; F213-R215 HydrophobicContact CD1-CB 4.17Å; F213-R215 VanDerWaalsContact CD1-O 3.32Å; F213-R215 WeakPolarHBondContact CD1-O 3.37Å; F213-R215 HydrophobicContact CE1-CB 3.61Å; F213-R215 HydrophobicContact CE1-CG 4.41Å; F213-R215 HydrophobicContact CZ-CB 3.94Å; F213-R215 HydrophobicContact CZ-CG 4.26Å; F213-R215 PolarHBondContact O-N 3.07Å; F213-F217 HydrophobicContact CB-CE1 4.44Å; F213-F217 HydrophobicContact CD1-CD1 4.19Å; F213-F217 AromaticContact CD1-CE1 3.96Å; F213-F217 HydrophobicContact CD1-CE1 3.96Å; F213-A230 HydrophobicContact CE1-CB 3.92Å; F213-D314 HydrophobicContact CE1-CB 4.34Å; F213-D314 HydrophobicContact CE2-CB 3.8Å; F213-D314 HydrophobicContact CZ-CB 3.5Å; F213-I315 HydrophobicContact CB-CD1 4.12Å; F213-I315 HydrophobicContact CD1-CD1 4.07Å; F213-I315 HydrophobicContact CD2-CG1 4.38Å; F213-I315 HydrophobicContact CG-CD1 4.01Å; F213-I315 HydrophobicContact CG-CG1 4.33Å; F213-G342 VanDerWaalsContact CD2-O 3.3Å; F213-G342 WeakPolarHBondContact CD2-O 3.47Å; F213-V344 HydrophobicContact CB-CG2 3.81Å; F213-V344 HydrophobicContact CD2-CG2 4.09Å; F213-V344 HydrophobicContact CG-CG2 4.42Å
214	G	93.2	Very high	94.8	Very high	78 Å²	78	62.2 Å²	62.2	80%	0.804	37%	0.374	S	S	*	.	S	Bend	trans	-76.1	13.8	-174.1	0	0	0	0	0	116.6
215	R	94.2	Very high	94.5	Very high	165 Å²	165	62.5 Å²	62.5	62%	0.623	39%	0.385	S	S	*	.	S	Bend	trans	-137.8	164.1	-177.5	-55.8	180	-177.6	-178.3	1.1	111.9	F213	F213-R215 HydrophobicContact CD1-CB 4.17Å; F213-R215 VanDerWaalsContact CD1-O 3.32Å; F213-R215 WeakPolarHBondContact CD1-O 3.37Å; F213-R215 HydrophobicContact CE1-CB 3.61Å; F213-R215 HydrophobicContact CE1-CG 4.41Å; F213-R215 HydrophobicContact CZ-CB 3.94Å; F213-R215 HydrophobicContact CZ-CG 4.26Å; F213-R215 PolarHBondContact O-N 3.07Å
216	F	95.3	Very high	94.3	Very high	126 Å²	126	70.1 Å²	70.1	55%	0.553	42%	0.418	S	S	*	.			trans	-67.9	141.7	176.9	-60.3	-49.7	0	0	0	112.5	V227	F216-V227 HydrophobicContact CD2-CG1 4.3Å
217	F	95.8	Very high	94.1	Very high	13 Å²	13	72.8 Å²	72.8	6%	0.057	43%	0.434	C	S	.	.	S	Bend	trans	-72.8	-46.3	166.6	-84.8	33.6	0	0	0	110.7	V206 A210 F213 P229 A230 I232 M251 A253 I315	V206-F217 HydrophobicContact CG1-CE2 3.85Å; A210-F217 HydrophobicContact CB-CE1 3.85Å; A210-F217 HydrophobicContact CB-CE2 4.25Å; A210-F217 HydrophobicContact CB-CZ 3.69Å; F213-F217 HydrophobicContact CB-CE1 4.44Å; F213-F217 HydrophobicContact CD1-CD1 4.19Å; F213-F217 AromaticContact CD1-CE1 3.96Å; F213-F217 HydrophobicContact CD1-CE1 3.96Å; F217-P229 CarbonylContact O-C 3.57Å; F217-P229 VanDerWaalsContact O-CA 3.24Å; F217-P229 WeakPolarHBondContact O-CA 3.39Å; F217-P229 WeakPolarHBondContact O-CB 3.41Å; F217-A230 HydrophobicContact CD1-CB 4.13Å; F217-A230 HydrophobicContact CG-CB 4.39Å; F217-A230 PolarHBondContact O-N 3.4Å; F217-I232 HydrophobicContact CD2-CD1 3.8Å; F217-I232 HydrophobicContact CE1-CD1 4.39Å; F217-I232 HydrophobicContact CE2-CD1 3.27Å; F217-I232 HydrophobicContact CZ-CD1 3.63Å; F217-M251 HydrophobicContact CB-CB 4.43Å; F217-M251 HydrophobicContact CD2-CB 3.91Å; F217-M251 HydrophobicContact CD2-CE 4.24Å; F217-M251 HydrophobicContact CD2-SD 4.46Å; F217-M251 HydrophobicContact CE2-CE 4.47Å; F217-A253 HydrophobicContact CB-CB 4.33Å; F217-A253 HydrophobicContact CD2-CB 4Å; F217-A253 HydrophobicContact CG-CB 4.37Å; F217-I315 HydrophobicContact CD1-CD1 4.39Å; F217-I315 HydrophobicContact CE1-CD1 3.29Å; F217-I315 HydrophobicContact CE2-CD1 4.38Å; F217-I315 HydrophobicContact CZ-CD1 3.29Å
218	T	94.1	Very high	94	Very high	67 Å²	67	74.6 Å²	74.6	41%	0.411	45%	0.449	S	S	.	.	S	Bend	trans	-75.8	124.5	-179.7	-39.3	0	0	0	0	110.6	M251	T218-M251 PolarHBondContact OG1-O 3.32Å
219	G	91.7	Very high	94	Very high	29 Å²	29	75.6 Å²	75.6	30%	0.299	46%	0.458	S	S	.	.			trans	-70.2	137.8	169.4	0	0	0	0	0	110.9	V227	G219-V227 CarbonylContact C-O 3.04Å; G219-V227 VanDerWaalsContact CA-O 3.23Å; G219-V227 WeakPolarHBondContact CA-O 3.5Å
220	Q	92.8	Very high	94	Very high	86 Å²	86	75.7 Å²	75.7	40%	0.402	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.1	-179.1	-62.6	178.3	7	0	0	109.9	T222 V227	Q220-T222 HydrophobicContact CB-CG2 4.2Å; Q220-V227 PolarHBondContact N-O 3.3Å; Q220-V227 PolarHBondContact O-N 3.06Å
221	I	93.1	Very high	94.1	Very high	144 Å²	144	77 Å²	77	74%	0.738	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.2	167.9	-60.1	175.1	0	0	0	106.1	K226	I221-K226 HydrophobicContact CG1-CB 4.4Å; I221-K226 HydrophobicContact CG1-CD 4.46Å; I221-K226 HydrophobicContact CG1-CG 4.08Å
222	T	92.3	Very high	94.2	Very high	67 Å²	67	70.8 Å²	70.8	41%	0.411	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	171	-179.9	71.2	0	0	0	0	109.8	Q220 A224 G225	Q220-T222 HydrophobicContact CB-CG2 4.2Å; T222-A224 PolarHBondContact O-N 2.79Å; T222-A224 VanDerWaalsContact O-N 3.14Å; T222-A224 PolarHBondContact OG1-N 3.43Å; T222-G225 PolarHBondContact N-O 2.8Å; T222-G225 PolarHBondContact O-N 2.9Å; T222-G225 PolarHBondContact OG1-O 2.91Å
223	A	91	Very high	94.3	Very high	119 Å²	119	69.4 Å²	69.4	98%	0.983	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.3	172.9	0	0	0	0	0	113	G225	A223-G225 VanDerWaalsContact C-N 3.31Å
224	A	91.2	Very high	94.4	Very high	103 Å²	103	68.6 Å²	68.6	85%	0.851	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.2	178.1	0	0	0	0	0	113.9	T222	T222-A224 PolarHBondContact O-N 2.79Å; T222-A224 VanDerWaalsContact O-N 3.14Å; T222-A224 PolarHBondContact OG1-N 3.43Å
225	G	91.4	Very high	94.5	Very high	35 Å²	35	65 Å²	65	36%	0.361	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	125.7	178.2	178.4	0	0	0	0	0	114.1	T222 A223	T222-G225 PolarHBondContact N-O 2.8Å; T222-G225 PolarHBondContact O-N 2.9Å; T222-G225 PolarHBondContact OG1-O 2.91Å; A223-G225 VanDerWaalsContact C-N 3.31Å
226	K	93.6	Very high	94.4	Very high	160 Å²	160	57.7 Å²	57.7	70%	0.696	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	117	177.5	177.6	175.9	-179.3	-179.3	0	109.9	I221	I221-K226 HydrophobicContact CG1-CB 4.4Å; I221-K226 HydrophobicContact CG1-CD 4.46Å; I221-K226 HydrophobicContact CG1-CG 4.08Å
227	V	93.5	Very high	94	Very high	56 Å²	56	51.8 Å²	51.8	34%	0.339	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.2	170	-175.9	0	0	0	0	108.1	F216 G219 Q220	F216-V227 HydrophobicContact CD2-CG1 4.3Å; G219-V227 CarbonylContact C-O 3.04Å; G219-V227 VanDerWaalsContact CA-O 3.23Å; G219-V227 WeakPolarHBondContact CA-O 3.5Å; Q220-V227 PolarHBondContact N-O 3.3Å; Q220-V227 PolarHBondContact O-N 3.06Å
228	P	94.8	Very high	93.7	Very high	90 Å²	90	52.5 Å²	52.5	58%	0.584	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-70.4	150.6	177.6	30.4	-34.5	0	0	0	111.1
229	P	96.2	Very high	93.5	Very high	41 Å²	41	52.2 Å²	52.2	27%	0.266	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-66.5	151.7	172.1	29.4	-34.5	0	0	0	111.1	F217 I254	F217-P229 CarbonylContact O-C 3.57Å; F217-P229 VanDerWaalsContact O-CA 3.24Å; F217-P229 WeakPolarHBondContact O-CA 3.39Å; F217-P229 WeakPolarHBondContact O-CB 3.41Å; P229-I254 HydrophobicContact CB-CG1 4.31Å; P229-I254 HydrophobicContact CG-CD1 3.62Å; P229-I254 HydrophobicContact CG-CG1 3.81Å
230	A	97.3	Very high	93.7	Very high	3 Å²	3	51.5 Å²	51.5	3%	0.025	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-65	142.7	172.5	0	0	0	0	0	110.7	F213 F217 A253 I254	F213-A230 HydrophobicContact CE1-CB 3.92Å; F217-A230 HydrophobicContact CD1-CB 4.13Å; F217-A230 HydrophobicContact CG-CB 4.39Å; F217-A230 PolarHBondContact O-N 3.4Å; A230-A253 WeakPolarHBondContact O-CB 3.21Å; A230-I254 PolarHBondContact O-N 3.47Å
231	K	97.8	Very high	93.8	Very high	58 Å²	58	47.4 Å²	47.4	25%	0.252	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.7	172.7	-70.3	-179.7	177.2	-176.9	0	109.7	I254 E312 I313 D314 I315	K231-I254 WeakPolarHBondContact CA-O 3.49Å; K231-E312 IonicContact NZ-OE2 3.82Å; K231-E312 PolarHBondContact NZ-OE2 3.1Å; K231-I313 HydrophobicContact CB-CB 4.43Å; K231-I313 HydrophobicContact CB-CG2 4.36Å; K231-D314 PolarHBondContact N-OD2 2.86Å; K231-D314 PolarHBondContact O-N 3.15Å; K231-I315 PolarHBondContact O-N 2.92Å
232	I	97.8	Very high	93.9	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	-176.4	-52.1	-169	0	0	0	109.4	F217 V234 A248 A253 I254 V255 R256 I315 I317	F217-I232 HydrophobicContact CD2-CD1 3.8Å; F217-I232 HydrophobicContact CE1-CD1 4.39Å; F217-I232 HydrophobicContact CE2-CD1 3.27Å; F217-I232 HydrophobicContact CZ-CD1 3.63Å; I232-V234 HydrophobicContact CG2-CG2 4.44Å; I232-A248 HydrophobicContact CD1-CB 3.93Å; I232-A253 HydrophobicContact CD1-CB 3.66Å; I232-A253 HydrophobicContact CG1-CB 3.9Å; I232-I254 PolarHBondContact N-O 3Å; I232-V255 WeakPolarHBondContact O-CA 3.29Å; I232-R256 PolarHBondContact O-N 2.88Å; I232-I315 CarbonylContact C-O 3.54Å; I232-I315 WeakPolarHBondContact CA-O 3.47Å; I232-I315 HydrophobicContact CB-CB 4.44Å; I232-I315 HydrophobicContact CD1-CB 4.4Å; I232-I315 HydrophobicContact CD1-CD1 3.95Å; I232-I315 HydrophobicContact CG1-CB 4.02Å; I232-I315 HydrophobicContact CG1-CD1 4.27Å; I232-I315 HydrophobicContact CG2-CB 4.15Å; I232-I315 HydrophobicContact CG2-CG2 4.12Å; I232-I317 HydrophobicContact CG2-CD1 4.29Å; I232-I317 HydrophobicContact CG2-CG1 4.49Å
233	M	97.7	Very high	94	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.7	171.7	-171.6	167.2	71.8	0	0	110.9	I235 R256 L276 F306 Q309 I313 I315 L316 I317	M233-I235 HydrophobicContact CE-CD1 3.97Å; M233-I235 HydrophobicContact CE-CG1 4.22Å; M233-I235 HydrophobicContact CG-CG1 4.45Å; M233-R256 CarbonylContact C-O 3.6Å; M233-R256 VanDerWaalsContact CA-O 3.26Å; M233-R256 WeakPolarHBondContact CA-O 3.26Å; M233-L276 HydrophobicContact SD-CD1 4.2Å; M233-F306 HydrophobicContact CE-CD1 4.18Å; M233-F306 HydrophobicContact SD-CD1 4.4Å; M233-Q309 HydrophobicContact CE-CB 4.06Å; M233-Q309 HydrophobicContact SD-CB 3.42Å; M233-Q309 WeakPolarHBondContact SD-CB 3.36Å; M233-Q309 HydrophobicContact SD-CG 3.8Å; M233-I313 HydrophobicContact CB-CD1 3.52Å; M233-I313 HydrophobicContact CB-CG2 4.17Å; M233-I313 HydrophobicContact CE-CD1 3.66Å; M233-I313 HydrophobicContact CG-CD1 4.44Å; M233-I313 HydrophobicContact SD-CD1 4.22Å; M233-I315 PolarHBondContact N-O 2.69Å; M233-L316 HydrophobicContact CE-CD1 3.52Å; M233-L316 HydrophobicContact CE-CG 4.17Å; M233-L316 WeakPolarHBondContact O-CA 3.43Å; M233-I317 PolarHBondContact O-N 3.5Å
234	V	97.5	Very high	94.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.6	174.6	-175.6	0	0	0	0	109.6	I232 A244 I245 V255 R256 A257 F258 I317	I232-V234 HydrophobicContact CG2-CG2 4.44Å; V234-A244 HydrophobicContact CG1-CB 4.43Å; V234-A244 HydrophobicContact CG2-CB 4.31Å; V234-I245 HydrophobicContact CB-CD1 4.42Å; V234-I245 HydrophobicContact CB-CG1 3.98Å; V234-I245 HydrophobicContact CG1-CD1 4.48Å; V234-I245 HydrophobicContact CG1-CG1 4.22Å; V234-I245 HydrophobicContact CG2-CG1 3.85Å; V234-V255 HydrophobicContact CG2-CG1 4.17Å; V234-R256 PolarHBondContact N-O 3.34Å; V234-A257 HydrophobicContact CB-CB 4.35Å; V234-A257 VanDerWaalsContact O-CA 3.26Å; V234-A257 WeakPolarHBondContact O-CA 3.48Å; V234-F258 PolarHBondContact O-N 2.93Å; V234-I317 CarbonylContact C-O 3.57Å; V234-I317 WeakPolarHBondContact CA-O 3.47Å; V234-I317 HydrophobicContact CG2-CB 4.46Å
235	I	95.6	Very high	94.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.8	177.9	-56.1	176.2	0	0	0	108.7	M233 F306 L316 I317 T319 L330 I331	M233-I235 HydrophobicContact CE-CD1 3.97Å; M233-I235 HydrophobicContact CE-CG1 4.22Å; M233-I235 HydrophobicContact CG-CG1 4.45Å; I235-F306 HydrophobicContact CD1-CD1 4.23Å; I235-F306 HydrophobicContact CD1-CD2 4.33Å; I235-F306 HydrophobicContact CD1-CE1 4.08Å; I235-F306 HydrophobicContact CD1-CE2 4.16Å; I235-F306 HydrophobicContact CD1-CG 4.37Å; I235-F306 HydrophobicContact CD1-CZ 4.04Å; I235-F306 HydrophobicContact CG1-CE1 4.14Å; I235-F306 HydrophobicContact CG1-CZ 4.24Å; I235-F306 HydrophobicContact CG2-CE1 4.5Å; I235-F306 HydrophobicContact CG2-CE2 4.35Å; I235-F306 HydrophobicContact CG2-CZ 3.85Å; I235-L316 HydrophobicContact CD1-CD1 4.21Å; I235-L316 HydrophobicContact CD1-CD2 4.31Å; I235-L316 HydrophobicContact CD1-CG 4.38Å; I235-I317 PolarHBondContact N-O 3.39Å; I235-T319 WeakPolarHBondContact O-CA 3.29Å; I235-T319 WeakPolarHBondContact O-CB 3.34Å; I235-T319 PolarHBondContact O-N 3.22Å; I235-T319 PolarHBondContact O-OG1 3.16Å; I235-L330 HydrophobicContact CG2-CD1 3.67Å; I235-I331 HydrophobicContact CD1-CD1 3.75Å; I235-I331 HydrophobicContact CD1-CG1 4.14Å
236	G	91.1	Very high	94.8	Very high	11 Å²	11	28.2 Å²	28.2	11%	0.113	17%	0.169	C	C	.	.			trans	89.6	125.6	-170.5	0	0	0	0	0	111.7	G241 F258 T319	G236-G241 VanDerWaalsContact O-CA 3.28Å; G236-G241 WeakPolarHBondContact O-CA 3.44Å; G236-F258 WeakPolarHBondContact CA-O 3.28Å; G236-F258 PolarHBondContact N-O 3.06Å; G236-T319 WeakPolarHBondContact CA-OG1 3.43Å; G236-T319 PolarHBondContact O-OG1 3.01Å; G236-T319 VanDerWaalsContact O-OG1 3.07Å
237	G	87.2	Confident	94.9	Very high	2 Å²	2	21.7 Å²	21.7	2%	0.021	14%	0.142	C	C	.	.			trans	-109.5	46.4	173.9	0	0	0	0	0	111.5	D259 R261	G237-D259 WeakPolarHBondContact CA-OD2 3.37Å; G237-D259 PolarHBondContact N-OD2 3.12Å; G237-R261 VanDerWaalsContact C-NH2 3.29Å; G237-R261 PolarHBondContact O-NH2 3.36Å
238	G	89.1	Confident	95.1	Very high	28 Å²	28	19 Å²	19	29%	0.289	13%	0.126	S	C	.	.	S	Bend	trans	-74.1	-168.4	160.6	0	0	0	0	0	111.4	A240 G241 L242	G238-A240 VanDerWaalsContact C-N 3.32Å; G238-A240 PolarHBondContact O-N 3.04Å; G238-G241 PolarHBondContact O-N 3.21Å; G238-G241 VanDerWaalsContact O-N 3.11Å; G238-L242 WeakPolarHBondContact O-CG 3.49Å; G238-L242 PolarHBondContact O-N 3.18Å
239	V	91.8	Very high	95.1	Very high	61 Å²	61	18.7 Å²	18.7	37%	0.37	12%	0.115	S	C	.	.	H	α-helix	trans	-58.8	-41.8	-179.9	-176.8	0	0	0	0	112.2	S195 A198 N199 A243	S195-V239 VanDerWaalsContact O-CG1 3.31Å; S195-V239 WeakPolarHBondContact O-CG1 3.19Å; A198-V239 HydrophobicContact CB-CB 3.99Å; A198-V239 HydrophobicContact CB-CG1 4.22Å; N199-V239 HydrophobicContact CB-CG1 3.88Å; V239-A243 VanDerWaalsContact O-CB 3.28Å; V239-A243 WeakPolarHBondContact O-CB 3.1Å; V239-A243 PolarHBondContact O-N 2.94Å
240	A	94.4	Very high	95	Very high	15 Å²	15	23.8 Å²	23.8	12%	0.124	14%	0.14	C	C	.	.	H	α-helix	trans	-66.1	-40.6	175.6	0	0	0	0	0	112.5	A198 G202 G238 A243 A244 T319 L348	A198-A240 HydrophobicContact CB-CB 4.12Å; A198-A240 VanDerWaalsContact O-CA 3.23Å; A198-A240 WeakPolarHBondContact O-CA 3.28Å; A198-A240 VanDerWaalsContact O-CB 3.29Å; A198-A240 WeakPolarHBondContact O-CB 3.36Å; G202-A240 VanDerWaalsContact CA-O 3.27Å; G202-A240 WeakPolarHBondContact CA-O 3.23Å; G238-A240 VanDerWaalsContact C-N 3.32Å; G238-A240 PolarHBondContact O-N 3.04Å; A240-A243 PolarHBondContact O-N 2.9Å; A240-A244 WeakPolarHBondContact O-CB 3.29Å; A240-A244 PolarHBondContact O-N 3.47Å; A240-T319 HydrophobicContact CB-CG2 4.37Å; A240-L348 HydrophobicContact CB-CD1 3.93Å
241	G	94.9	Very high	94.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-50.6	177.5	0	0	0	0	0	112.5	G236 G238 A243 A244 I245	G236-G241 VanDerWaalsContact O-CA 3.28Å; G236-G241 WeakPolarHBondContact O-CA 3.44Å; G238-G241 PolarHBondContact O-N 3.21Å; G238-G241 VanDerWaalsContact O-N 3.11Å; G241-A243 VanDerWaalsContact C-N 3.31Å; G241-A243 PolarHBondContact O-N 3.11Å; G241-A244 WeakPolarHBondContact O-CB 3.29Å; G241-A244 PolarHBondContact O-N 2.83Å; G241-A244 VanDerWaalsContact O-N 3.16Å; G241-I245 VanDerWaalsContact O-CG1 3.25Å; G241-I245 WeakPolarHBondContact O-CG1 3.5Å; G241-I245 PolarHBondContact O-N 3.41Å
242	L	94.7	Very high	94.7	Very high	39 Å²	39	25.3 Å²	25.3	20%	0.204	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-38.1	177.8	-66.2	172.4	0	0	0	112	G238 I245 G246 Q267 V268 L271	G238-L242 WeakPolarHBondContact O-CG 3.49Å; G238-L242 PolarHBondContact O-N 3.18Å; L242-I245 HydrophobicContact CD2-CD1 4.46Å; L242-I245 PolarHBondContact O-N 2.85Å; L242-G246 PolarHBondContact O-N 3.45Å; L242-Q267 HydrophobicContact CD1-CB 4.44Å; L242-Q267 HydrophobicContact CD2-CB 3.97Å; L242-V268 HydrophobicContact CD2-CG2 4.26Å; L242-L271 HydrophobicContact CB-CD1 4.13Å; L242-L271 HydrophobicContact CD2-CD1 3.82Å
243	A	96	Very high	94.7	Very high	12 Å²	12	25.5 Å²	25.5	10%	0.099	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-41.9	173.9	0	0	0	0	0	112.3	N199 V239 A240 G241 T247	N199-A243 WeakPolarHBondContact O-CB 3.43Å; N199-A243 WeakPolarHBondContact OD1-CB 3.39Å; V239-A243 VanDerWaalsContact O-CB 3.28Å; V239-A243 WeakPolarHBondContact O-CB 3.1Å; V239-A243 PolarHBondContact O-N 2.94Å; A240-A243 PolarHBondContact O-N 2.9Å; G241-A243 VanDerWaalsContact C-N 3.31Å; G241-A243 PolarHBondContact O-N 3.11Å; A243-T247 WeakPolarHBondContact O-CB 3.41Å; A243-T247 PolarHBondContact O-N 3.43Å; A243-T247 PolarHBondContact O-OG1 3.13Å
244	A	97.3	Very high	94.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-43.8	174.5	0	0	0	0	0	111.4	V206 V234 A240 G241 T247 A248 I317	V206-A244 HydrophobicContact CG2-CB 3.87Å; V206-A244 WeakPolarHBondContact CG2-O 3.45Å; V234-A244 HydrophobicContact CG1-CB 4.43Å; V234-A244 HydrophobicContact CG2-CB 4.31Å; A240-A244 WeakPolarHBondContact O-CB 3.29Å; A240-A244 PolarHBondContact O-N 3.47Å; G241-A244 WeakPolarHBondContact O-CB 3.29Å; G241-A244 PolarHBondContact O-N 2.83Å; G241-A244 VanDerWaalsContact O-N 3.16Å; A244-T247 PolarHBondContact O-N 3.21Å; A244-A248 WeakPolarHBondContact O-CB 3.46Å; A244-A248 PolarHBondContact O-N 2.93Å; A244-I317 HydrophobicContact CB-CD1 4.18Å; A244-I317 HydrophobicContact CB-CG2 4.41Å
245	I	97.1	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-53.2	177.4	-69	164.6	0	0	0	111	V234 G241 L242 T247 A248 K249 V255 A257 V268 L271 A273	V234-I245 HydrophobicContact CB-CD1 4.42Å; V234-I245 HydrophobicContact CB-CG1 3.98Å; V234-I245 HydrophobicContact CG1-CD1 4.48Å; V234-I245 HydrophobicContact CG1-CG1 4.22Å; V234-I245 HydrophobicContact CG2-CG1 3.85Å; G241-I245 VanDerWaalsContact O-CG1 3.25Å; G241-I245 WeakPolarHBondContact O-CG1 3.5Å; G241-I245 PolarHBondContact O-N 3.41Å; L242-I245 HydrophobicContact CD2-CD1 4.46Å; L242-I245 PolarHBondContact O-N 2.85Å; I245-T247 VanDerWaalsContact C-N 3.33Å; I245-T247 PolarHBondContact O-N 2.86Å; I245-A248 PolarHBondContact O-N 3.39Å; I245-K249 VanDerWaalsContact O-CB 3.28Å; I245-K249 WeakPolarHBondContact O-CB 3.16Å; I245-K249 PolarHBondContact O-N 3.43Å; I245-V255 HydrophobicContact CB-CG1 4.25Å; I245-V255 HydrophobicContact CG1-CG1 3.9Å; I245-V255 HydrophobicContact CG2-CG1 4.08Å; I245-A257 HydrophobicContact CD1-CB 3.49Å; I245-A257 VanDerWaalsContact CD1-CB 3.49Å; I245-A257 HydrophobicContact CG1-CB 4.18Å; I245-V268 HydrophobicContact CD1-CG1 4.46Å; I245-V268 HydrophobicContact CD1-CG2 3.9Å; I245-L271 HydrophobicContact CB-CD1 4.37Å; I245-L271 HydrophobicContact CG2-CB 3.86Å; I245-L271 HydrophobicContact CG2-CD1 4.06Å; I245-A273 HydrophobicContact CG2-CB 3.56Å
246	G	94.4	Very high	94.7	Very high	14 Å²	14	30.5 Å²	30.5	14%	0.144	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-42.3	-179.8	0	0	0	0	0	112.3	L242 N250	L242-G246 PolarHBondContact O-N 3.45Å; G246-N250 WeakPolarHBondContact O-CB 3.36Å; G246-N250 PolarHBondContact O-N 3.07Å; G246-N250 PolarHBondContact O-ND2 2.69Å
247	T	96.7	Very high	94.9	Very high	22 Å²	22	30 Å²	30	14%	0.135	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-48.8	178.8	-53.1	0	0	0	0	111.4	Y203 V206 A243 A244 I245 K249 N250 M251	Y203-T247 HydrophobicContact CD2-CG2 3.6Å; Y203-T247 WeakPolarHBondContact CD2-OG1 3.3Å; Y203-T247 HydrophobicContact CE2-CG2 3.86Å; Y203-T247 HydrophobicContact CG-CG2 4.48Å; V206-T247 HydrophobicContact CB-CG2 3.9Å; V206-T247 HydrophobicContact CG1-CG2 3.83Å; V206-T247 HydrophobicContact CG2-CG2 4.39Å; A243-T247 WeakPolarHBondContact O-CB 3.41Å; A243-T247 PolarHBondContact O-N 3.43Å; A243-T247 PolarHBondContact O-OG1 3.13Å; A244-T247 PolarHBondContact O-N 3.21Å; I245-T247 VanDerWaalsContact C-N 3.33Å; I245-T247 PolarHBondContact O-N 2.86Å; T247-K249 PolarHBondContact O-N 2.65Å; T247-N250 PolarHBondContact O-N 3.24Å; T247-M251 HydrophobicContact CG2-SD 4.24Å; T247-M251 WeakPolarHBondContact O-CG 3.38Å; T247-M251 PolarHBondContact O-N 2.91Å
248	A	96.9	Very high	95.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-41.9	179.4	0	0	0	0	0	112.5	V206 I232 A244 I245 M251 G252 A253 V255	V206-A248 HydrophobicContact CG1-CB 4.19Å; V206-A248 HydrophobicContact CG2-CB 4.34Å; I232-A248 HydrophobicContact CD1-CB 3.93Å; A244-A248 WeakPolarHBondContact O-CB 3.46Å; A244-A248 PolarHBondContact O-N 2.93Å; I245-A248 PolarHBondContact O-N 3.39Å; A248-M251 PolarHBondContact O-N 2.91Å; A248-G252 PolarHBondContact O-N 2.74Å; A248-A253 WeakPolarHBondContact O-CB 3.47Å; A248-A253 PolarHBondContact O-N 3.39Å; A248-V255 HydrophobicContact CB-CG2 3.58Å
249	K	95.1	Very high	95.4	Very high	84 Å²	84	29.5 Å²	29.5	37%	0.365	17%	0.167	S	C	.	.	H	α-helix	trans	-63.9	-44.6	177.5	-172.6	72.5	-177.9	-170.3	0	111.5	I245 T247 M251 G252 V255 L271 G272	I245-K249 VanDerWaalsContact O-CB 3.28Å; I245-K249 WeakPolarHBondContact O-CB 3.16Å; I245-K249 PolarHBondContact O-N 3.43Å; T247-K249 PolarHBondContact O-N 2.65Å; K249-M251 PolarHBondContact O-N 3.09Å; K249-G252 PolarHBondContact O-N 3.15Å; K249-V255 HydrophobicContact CB-CG2 4.25Å; K249-L271 WeakPolarHBondContact CG-O 3.4Å; K249-G272 VanDerWaalsContact CE-O 3.22Å; K249-G272 WeakPolarHBondContact CE-O 3.46Å; K249-G272 PolarHBondContact NZ-O 3.03Å
250	N	93.8	Very high	95.2	Very high	147 Å²	147	27.9 Å²	27.9	79%	0.786	16%	0.157	S	C	*	.	H	α-helix	trans	-65.7	-25.3	177.1	-72.3	-18	0	0	0	112.9	G246 T247 G252	G246-N250 WeakPolarHBondContact O-CB 3.36Å; G246-N250 PolarHBondContact O-N 3.07Å; G246-N250 PolarHBondContact O-ND2 2.69Å; T247-N250 PolarHBondContact O-N 3.24Å; N250-G252 VanDerWaalsContact C-N 3.26Å; N250-G252 PolarHBondContact O-N 3.37Å
251	M	95.9	Very high	94.6	Very high	63 Å²	63	29.4 Å²	29.4	31%	0.31	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	1.9	171.7	-68.4	-179.5	69.8	0	0	113.7	V206 I207 A210 F217 T218 T247 A248 K249	V206-M251 HydrophobicContact CG1-SD 3.89Å; I207-M251 HydrophobicContact CD1-SD 4.09Å; A210-M251 HydrophobicContact CB-CE 3.9Å; F217-M251 HydrophobicContact CB-CB 4.43Å; F217-M251 HydrophobicContact CD2-CB 3.91Å; F217-M251 HydrophobicContact CD2-CE 4.24Å; F217-M251 HydrophobicContact CD2-SD 4.46Å; F217-M251 HydrophobicContact CE2-CE 4.47Å; T218-M251 PolarHBondContact OG1-O 3.32Å; T247-M251 HydrophobicContact CG2-SD 4.24Å; T247-M251 WeakPolarHBondContact O-CG 3.38Å; T247-M251 PolarHBondContact O-N 2.91Å; A248-M251 PolarHBondContact O-N 2.91Å; K249-M251 PolarHBondContact O-N 3.09Å
252	G	93.9	Very high	93.9	Very high	31 Å²	31	32.9 Å²	32.9	32%	0.32	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	12.8	172.9	0	0	0	0	0	115.7	A248 K249 N250	A248-G252 PolarHBondContact O-N 2.74Å; K249-G252 PolarHBondContact O-N 3.15Å; N250-G252 VanDerWaalsContact C-N 3.26Å; N250-G252 PolarHBondContact O-N 3.37Å
253	A	96.9	Very high	93.1	Very high	4 Å²	4	34 Å²	34	3%	0.033	20%	0.203	C	C	.	.			trans	-79.3	158.2	174.3	0	0	0	0	0	112.3	F217 A230 I232 A248	F217-A253 HydrophobicContact CB-CB 4.33Å; F217-A253 HydrophobicContact CD2-CB 4Å; F217-A253 HydrophobicContact CG-CB 4.37Å; A230-A253 WeakPolarHBondContact O-CB 3.21Å; I232-A253 HydrophobicContact CD1-CB 3.66Å; I232-A253 HydrophobicContact CG1-CB 3.9Å; A248-A253 WeakPolarHBondContact O-CB 3.47Å; A248-A253 PolarHBondContact O-N 3.39Å
254	I	96.6	Very high	92.6	Very high	71 Å²	71	33.5 Å²	33.5	36%	0.364	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	117.2	165.6	-61.8	175.2	0	0	0	107.3	P229 A230 K231 I232	P229-I254 HydrophobicContact CB-CG1 4.31Å; P229-I254 HydrophobicContact CG-CD1 3.62Å; P229-I254 HydrophobicContact CG-CG1 3.81Å; A230-I254 PolarHBondContact O-N 3.47Å; K231-I254 WeakPolarHBondContact CA-O 3.49Å; I232-I254 PolarHBondContact N-O 3Å
255	V	97.5	Very high	92.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.5	-177.6	-171.8	0	0	0	0	110.1	I232 V234 I245 A248 K249 A273 E274	I232-V255 WeakPolarHBondContact O-CA 3.29Å; V234-V255 HydrophobicContact CG2-CG1 4.17Å; I245-V255 HydrophobicContact CB-CG1 4.25Å; I245-V255 HydrophobicContact CG1-CG1 3.9Å; I245-V255 HydrophobicContact CG2-CG1 4.08Å; A248-V255 HydrophobicContact CB-CG2 3.58Å; K249-V255 HydrophobicContact CB-CG2 4.25Å; V255-A273 HydrophobicContact CB-CB 3.91Å; V255-A273 HydrophobicContact CG1-CB 3.97Å; V255-A273 WeakPolarHBondContact O-CA 3.35Å; V255-A273 WeakPolarHBondContact O-CB 3.43Å; V255-E274 PolarHBondContact O-N 2.81Å
256	R	97.4	Very high	91.7	Very high	34 Å²	34	44 Å²	44	13%	0.128	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.7	169.6	-61.5	179.8	171.1	160.8	2.5	107.9	I232 M233 V234 E274 L276 Q309 E312	I232-R256 PolarHBondContact O-N 2.88Å; M233-R256 CarbonylContact C-O 3.6Å; M233-R256 VanDerWaalsContact CA-O 3.26Å; M233-R256 WeakPolarHBondContact CA-O 3.26Å; V234-R256 PolarHBondContact N-O 3.34Å; R256-E274 CarbonylContact C-O 3.57Å; R256-E274 WeakPolarHBondContact CA-O 3.29Å; R256-E274 HydrophobicContact CG-CB 4.2Å; R256-E274 WeakPolarHBondContact CG-OE2 2.97Å; R256-E274 IonicContact CZ-OE2 2.8Å; R256-E274 IonicContact NE-OE2 3.25Å; R256-E274 PolarHBondContact NE-OE2 3.05Å; R256-L276 HydrophobicContact CB-CD1 4.09Å; R256-L276 HydrophobicContact CB-CD2 4.48Å; R256-L276 HydrophobicContact CB-CG 4.25Å; R256-Q309 VanDerWaalsContact CD-OE1 3.23Å; R256-E312 IonicContact CZ-OE2 2.76Å; R256-E312 IonicContact NH1-OE2 2.87Å; R256-E312 PolarHBondContact NH1-OE2 2.93Å; R256-E312 IonicContact NH2-OE2 3.91Å
257	A	96.2	Very high	91.4	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.7	179.7	0	0	0	0	0	112	V234 I245 V268 E274 L276	V234-A257 HydrophobicContact CB-CB 4.35Å; V234-A257 VanDerWaalsContact O-CA 3.26Å; V234-A257 WeakPolarHBondContact O-CA 3.48Å; I245-A257 HydrophobicContact CD1-CB 3.49Å; I245-A257 VanDerWaalsContact CD1-CB 3.49Å; I245-A257 HydrophobicContact CG1-CB 4.18Å; A257-V268 HydrophobicContact CB-CG1 3.77Å; A257-V268 HydrophobicContact CB-CG2 4.14Å; A257-E274 PolarHBondContact N-O 2.84Å; A257-L276 PolarHBondContact O-N 2.7Å
258	F	94.4	Very high	91.1	Very high	5 Å²	5	46.7 Å²	46.7	2%	0.022	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.3	176.6	178.9	-94	0	0	0	109.8	V234 G236 T260 L276 V278 F298 E302 L305 F306	V234-F258 PolarHBondContact O-N 2.93Å; G236-F258 WeakPolarHBondContact CA-O 3.28Å; G236-F258 PolarHBondContact N-O 3.06Å; F258-T260 HydrophobicContact CE1-CG2 4.11Å; F258-T260 HydrophobicContact CZ-CG2 4.44Å; F258-L276 HydrophobicContact CB-CB 4.39Å; F258-L276 HydrophobicContact CD2-CB 4.29Å; F258-L276 VanDerWaalsContact CD2-O 3.31Å; F258-L276 WeakPolarHBondContact CD2-O 2.99Å; F258-V278 HydrophobicContact CE2-CG1 3.81Å; F258-V278 HydrophobicContact CE2-CG2 4.49Å; F258-V278 HydrophobicContact CZ-CG1 4.09Å; F258-F298 HydrophobicContact CZ-CE1 4.18Å; F258-F298 HydrophobicContact CZ-CZ 4.08Å; F258-E302 HydrophobicContact CE1-CG 3.87Å; F258-E302 VanDerWaalsContact CE1-OE1 3.23Å; F258-E302 WeakPolarHBondContact CE1-OE1 3.46Å; F258-E302 HydrophobicContact CZ-CG 4.09Å; F258-L305 HydrophobicContact CD2-CD2 3.78Å; F258-L305 HydrophobicContact CE2-CD2 4Å; F258-F306 HydrophobicContact CB-CE1 4.03Å; F258-F306 AromaticContact CD1-CE1 3.76Å; F258-F306 HydrophobicContact CD1-CE1 3.76Å; F258-F306 AromaticContact CD1-CZ 3.52Å; F258-F306 HydrophobicContact CD1-CZ 3.52Å; F258-F306 HydrophobicContact CE1-CE1 4.4Å; F258-F306 AromaticContact CE1-CZ 3.92Å; F258-F306 HydrophobicContact CE1-CZ 3.92Å; F258-F306 AromaticContact CG-CE1 3.88Å; F258-F306 HydrophobicContact CG-CE1 3.88Å; F258-F306 HydrophobicContact CG-CZ 4.14Å
259	D	91.4	Very high	90.8	Very high	14 Å²	14	51.2 Å²	51.2	8%	0.075	28%	0.275	C	S	.	.			trans	-145	147.9	169.6	-165.7	-70	0	0	0	108.4	G237 R261 V264 F275	G237-D259 WeakPolarHBondContact CA-OD2 3.37Å; G237-D259 PolarHBondContact N-OD2 3.12Å; D259-R261 VanDerWaalsContact C-N 3.26Å; D259-R261 PolarHBondContact O-N 3.5Å; D259-R261 VanDerWaalsContact OD1-CB 3.25Å; D259-R261 WeakPolarHBondContact OD1-CB 3.18Å; D259-R261 WeakPolarHBondContact OD1-CG 3.36Å; D259-R261 IonicContact OD1-CZ 3.75Å; D259-R261 PolarHBondContact OD1-N 3.09Å; D259-R261 IonicContact OD1-NE 3.86Å; D259-R261 PolarHBondContact OD1-NE 2.96Å; D259-R261 IonicContact OD1-NH2 2.79Å; D259-R261 IonicContact OD2-CZ 2.64Å; D259-R261 IonicContact OD2-NE 2.65Å; D259-R261 IonicContact OD2-NH2 3.11Å; D259-R261 PolarHBondContact OD2-NH2 3.31Å; D259-V264 HydrophobicContact CB-CB 4.05Å; D259-V264 HydrophobicContact CB-CG1 3.8Å; D259-V264 HydrophobicContact CB-CG2 4.37Å; D259-F275 HydrophobicContact CB-CE2 4.22Å; D259-F275 WeakPolarHBondContact O-CZ 3.21Å
260	T	87.3	Confident	90.4	Very high	27 Å²	27	51.8 Å²	51.8	17%	0.166	29%	0.29	C	S	.	.	S	Bend	trans	-76.1	-14.1	179.5	57.6	0	0	0	0	113.1	F258 G284 A291 M294 F298	F258-T260 HydrophobicContact CE1-CG2 4.11Å; F258-T260 HydrophobicContact CZ-CG2 4.44Å; T260-G284 PolarHBondContact O-N 2.84Å; T260-A291 WeakPolarHBondContact OG1-CB 3.38Å; T260-M294 HydrophobicContact CG2-CG 4.24Å; T260-F298 HydrophobicContact CG2-CE1 3.77Å; T260-F298 HydrophobicContact CG2-CZ 4.04Å
261	R	83.2	Confident	90.2	Very high	48 Å²	48	48 Å²	48	18%	0.181	27%	0.269	C	S	.	.			trans	-92.1	126.2	-179.5	-60	168.6	-66.4	155	8.7	110.8	G237 D259 A263 V264 G289	G237-R261 VanDerWaalsContact C-NH2 3.29Å; G237-R261 PolarHBondContact O-NH2 3.36Å; D259-R261 VanDerWaalsContact C-N 3.26Å; D259-R261 PolarHBondContact O-N 3.5Å; D259-R261 VanDerWaalsContact OD1-CB 3.25Å; D259-R261 WeakPolarHBondContact OD1-CB 3.18Å; D259-R261 WeakPolarHBondContact OD1-CG 3.36Å; D259-R261 IonicContact OD1-CZ 3.75Å; D259-R261 PolarHBondContact OD1-N 3.09Å; D259-R261 IonicContact OD1-NE 3.86Å; D259-R261 PolarHBondContact OD1-NE 2.96Å; D259-R261 IonicContact OD1-NH2 2.79Å; D259-R261 IonicContact OD2-CZ 2.64Å; D259-R261 IonicContact OD2-NE 2.65Å; D259-R261 IonicContact OD2-NH2 3.11Å; D259-R261 PolarHBondContact OD2-NH2 3.31Å; R261-A263 VanDerWaalsContact C-N 3.33Å; R261-A263 PolarHBondContact O-N 2.86Å; R261-V264 HydrophobicContact CB-CG2 3.9Å; R261-V264 VanDerWaalsContact NH2-CG2 3.35Å; R261-V264 WeakPolarHBondContact O-CB 3.34Å; R261-V264 PolarHBondContact O-N 2.67Å; R261-G289 PolarHBondContact NH1-O 2.96Å
262	A	79.4	Confident	89.9	Confident	73 Å²	73	46.7 Å²	46.7	60%	0.603	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-34.5	179.9	0	0	0	0	0	113.1	V264 K265	A262-V264 PolarHBondContact O-N 2.66Å; A262-V264 VanDerWaalsContact O-N 3.09Å; A262-K265 VanDerWaalsContact O-CB 3.29Å; A262-K265 WeakPolarHBondContact O-CB 3.45Å; A262-K265 PolarHBondContact O-N 2.85Å; A262-K265 VanDerWaalsContact O-N 3.07Å
263	A	78.6	Confident	89.9	Confident	62 Å²	62	45.6 Å²	45.6	51%	0.512	26%	0.26	S	S	.	.	H	α-helix	trans	-59.6	-21.8	178.7	0	0	0	0	0	114.2	R261 K265	R261-A263 VanDerWaalsContact C-N 3.33Å; R261-A263 PolarHBondContact O-N 2.86Å; A263-K265 VanDerWaalsContact C-N 3.35Å
264	V	85.5	Confident	89.8	Confident	2 Å²	2	50 Å²	50	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-80.1	-20.7	-179	178.5	0	0	0	0	111.6	D259 R261 A262 E266 Q267 V268 F275	D259-V264 HydrophobicContact CB-CB 4.05Å; D259-V264 HydrophobicContact CB-CG1 3.8Å; D259-V264 HydrophobicContact CB-CG2 4.37Å; R261-V264 HydrophobicContact CB-CG2 3.9Å; R261-V264 VanDerWaalsContact NH2-CG2 3.35Å; R261-V264 WeakPolarHBondContact O-CB 3.34Å; R261-V264 PolarHBondContact O-N 2.67Å; A262-V264 PolarHBondContact O-N 2.66Å; A262-V264 VanDerWaalsContact O-N 3.09Å; V264-E266 PolarHBondContact O-N 3.36Å; V264-Q267 WeakPolarHBondContact O-CB 3.37Å; V264-Q267 PolarHBondContact O-N 3.37Å; V264-Q267 VanDerWaalsContact O-N 3.13Å; V264-V268 HydrophobicContact CG1-CG2 3.81Å; V264-V268 WeakPolarHBondContact O-CG2 3.31Å; V264-V268 PolarHBondContact O-N 2.97Å; V264-F275 HydrophobicContact CG1-CE2 4.49Å
265	K	89.7	Confident	89.7	Confident	65 Å²	65	48 Å²	48	28%	0.283	27%	0.268	S	S	.	.	H	α-helix	trans	-56.3	-53.3	179.9	177.9	173.5	177.4	174.3	0	112	A262 A263 Q267 V268 E269 F275 E277	A262-K265 VanDerWaalsContact O-CB 3.29Å; A262-K265 WeakPolarHBondContact O-CB 3.45Å; A262-K265 PolarHBondContact O-N 2.85Å; A262-K265 VanDerWaalsContact O-N 3.07Å; A263-K265 VanDerWaalsContact C-N 3.35Å; K265-Q267 PolarHBondContact O-N 3.05Å; K265-V268 PolarHBondContact O-N 3.46Å; K265-E269 WeakPolarHBondContact CE-OE1 3.47Å; K265-E269 HydrophobicContact CG-CG 4.49Å; K265-E269 WeakPolarHBondContact O-CG 3.47Å; K265-E269 PolarHBondContact O-N 2.81Å; K265-F275 HydrophobicContact CB-CD1 3.9Å; K265-F275 HydrophobicContact CB-CD2 4.11Å; K265-F275 HydrophobicContact CB-CE1 3.97Å; K265-F275 HydrophobicContact CB-CE2 4.17Å; K265-F275 HydrophobicContact CB-CG 3.96Å; K265-F275 HydrophobicContact CB-CZ 4.09Å; K265-F275 HydrophobicContact CD-CD1 3.91Å; K265-F275 HydrophobicContact CD-CE1 4.35Å; K265-F275 HydrophobicContact CD-CG 4.44Å; K265-F275 HydrophobicContact CG-CB 4.02Å; K265-F275 HydrophobicContact CG-CD1 3.71Å; K265-F275 HydrophobicContact CG-CD2 4.37Å; K265-F275 HydrophobicContact CG-CE1 4.25Å; K265-F275 HydrophobicContact CG-CG 3.77Å; K265-E277 IonicContact NZ-OE1 2.69Å; K265-E277 PolarHBondContact NZ-OE1 3.21Å
266	E	85.1	Confident	89.5	Confident	155 Å²	155	48.3 Å²	48.3	72%	0.724	27%	0.27	S	S	*	.	H	α-helix	trans	-59.9	-36.2	178.7	-66.4	-177.7	177	0	0	111.3	V264 S270	V264-E266 PolarHBondContact O-N 3.36Å; E266-S270 VanDerWaalsContact O-CB 3.23Å; E266-S270 WeakPolarHBondContact O-CB 3.13Å; E266-S270 PolarHBondContact O-N 3.27Å; E266-S270 PolarHBondContact O-OG 2.92Å
267	Q	87.9	Confident	89	Confident	91 Å²	91	51.9 Å²	51.9	43%	0.425	29%	0.288	S	S	.	.	H	α-helix	trans	-67.4	-44.7	177.7	-61.7	179.1	-13.8	0	0	111.8	L242 V264 K265 S270 L271	L242-Q267 HydrophobicContact CD1-CB 4.44Å; L242-Q267 HydrophobicContact CD2-CB 3.97Å; V264-Q267 WeakPolarHBondContact O-CB 3.37Å; V264-Q267 PolarHBondContact O-N 3.37Å; V264-Q267 VanDerWaalsContact O-N 3.13Å; K265-Q267 PolarHBondContact O-N 3.05Å; Q267-S270 PolarHBondContact O-N 3.1Å; Q267-S270 PolarHBondContact O-OG 2.92Å; Q267-L271 WeakPolarHBondContact O-CG 2.88Å; Q267-L271 PolarHBondContact O-N 3.26Å
268	V	90.6	Very high	88.5	Confident	1 Å²	1	53 Å²	53	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-46.3	177.2	169.2	0	0	0	0	111.2	L242 I245 A257 V264 K265 S270 L271 G272 A273 F275	L242-V268 HydrophobicContact CD2-CG2 4.26Å; I245-V268 HydrophobicContact CD1-CG1 4.46Å; I245-V268 HydrophobicContact CD1-CG2 3.9Å; A257-V268 HydrophobicContact CB-CG1 3.77Å; A257-V268 HydrophobicContact CB-CG2 4.14Å; V264-V268 HydrophobicContact CG1-CG2 3.81Å; V264-V268 WeakPolarHBondContact O-CG2 3.31Å; V264-V268 PolarHBondContact O-N 2.97Å; K265-V268 PolarHBondContact O-N 3.46Å; V268-S270 VanDerWaalsContact C-N 3.35Å; V268-S270 PolarHBondContact O-N 2.93Å; V268-L271 PolarHBondContact O-N 2.92Å; V268-G272 PolarHBondContact O-N 3.46Å; V268-A273 HydrophobicContact CG1-CB 3.68Å; V268-A273 PolarHBondContact O-N 3.33Å; V268-F275 HydrophobicContact CB-CD2 3.95Å; V268-F275 HydrophobicContact CG1-CB 4.13Å; V268-F275 HydrophobicContact CG1-CD2 4.09Å; V268-F275 HydrophobicContact CG2-CD2 3.99Å; V268-F275 HydrophobicContact CG2-CE2 4.46Å
269	E	91	Very high	87.8	Confident	96 Å²	96	58.2 Å²	58.2	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-66.3	-36.9	179	-70.8	177.1	167.1	0	0	111.5	K265 L271 G272 F275	K265-E269 WeakPolarHBondContact CE-OE1 3.47Å; K265-E269 HydrophobicContact CG-CG 4.49Å; K265-E269 WeakPolarHBondContact O-CG 3.47Å; K265-E269 PolarHBondContact O-N 2.81Å; E269-L271 PolarHBondContact O-N 3.22Å; E269-G272 WeakPolarHBondContact O-CA 3.46Å; E269-G272 PolarHBondContact O-N 3.32Å; E269-F275 HydrophobicContact CG-CB 4.4Å
270	S	86.6	Confident	87.2	Confident	95 Å²	95	60 Å²	60	66%	0.664	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-27.6	175.1	77.7	0	0	0	0	113.3	E266 Q267 V268 G272	E266-S270 VanDerWaalsContact O-CB 3.23Å; E266-S270 WeakPolarHBondContact O-CB 3.13Å; E266-S270 PolarHBondContact O-N 3.27Å; E266-S270 PolarHBondContact O-OG 2.92Å; Q267-S270 PolarHBondContact O-N 3.1Å; Q267-S270 PolarHBondContact O-OG 2.92Å; V268-S270 VanDerWaalsContact C-N 3.35Å; V268-S270 PolarHBondContact O-N 2.93Å; S270-G272 VanDerWaalsContact C-N 3.28Å
271	L	90.1	Very high	86.6	Confident	67 Å²	67	68.2 Å²	68.2	35%	0.351	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	1.6	173	-65.4	175.1	0	0	0	112.7	L242 I245 K249 Q267 V268 E269	L242-L271 HydrophobicContact CB-CD1 4.13Å; L242-L271 HydrophobicContact CD2-CD1 3.82Å; I245-L271 HydrophobicContact CB-CD1 4.37Å; I245-L271 HydrophobicContact CG2-CB 3.86Å; I245-L271 HydrophobicContact CG2-CD1 4.06Å; K249-L271 WeakPolarHBondContact CG-O 3.4Å; Q267-L271 WeakPolarHBondContact O-CG 2.88Å; Q267-L271 PolarHBondContact O-N 3.26Å; V268-L271 PolarHBondContact O-N 2.92Å; E269-L271 PolarHBondContact O-N 3.22Å
272	G	88.5	Confident	86.4	Confident	36 Å²	36	68.7 Å²	68.7	37%	0.371	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	21	176.7	0	0	0	0	0	114.9	K249 V268 E269 S270	K249-G272 VanDerWaalsContact CE-O 3.22Å; K249-G272 WeakPolarHBondContact CE-O 3.46Å; K249-G272 PolarHBondContact NZ-O 3.03Å; V268-G272 PolarHBondContact O-N 3.46Å; E269-G272 WeakPolarHBondContact O-CA 3.46Å; E269-G272 PolarHBondContact O-N 3.32Å; S270-G272 VanDerWaalsContact C-N 3.28Å
273	A	93.7	Very high	86	Confident	8 Å²	8	68.6 Å²	68.6	7%	0.066	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-97.4	154.4	173.8	0	0	0	0	0	111.9	I245 V255 V268	I245-A273 HydrophobicContact CG2-CB 3.56Å; V255-A273 HydrophobicContact CB-CB 3.91Å; V255-A273 HydrophobicContact CG1-CB 3.97Å; V255-A273 WeakPolarHBondContact O-CA 3.35Å; V255-A273 WeakPolarHBondContact O-CB 3.43Å; V268-A273 HydrophobicContact CG1-CB 3.68Å; V268-A273 PolarHBondContact O-N 3.33Å
274	E	95.3	Very high	85.5	Confident	96 Å²	96	65.8 Å²	65.8	45%	0.449	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.6	174.9	-178.8	-174.4	175.2	0	0	109.2	V255 R256 A257 L276	V255-E274 PolarHBondContact O-N 2.81Å; R256-E274 CarbonylContact C-O 3.57Å; R256-E274 WeakPolarHBondContact CA-O 3.29Å; R256-E274 HydrophobicContact CG-CB 4.2Å; R256-E274 WeakPolarHBondContact CG-OE2 2.97Å; R256-E274 IonicContact CZ-OE2 2.8Å; R256-E274 IonicContact NE-OE2 3.25Å; R256-E274 PolarHBondContact NE-OE2 3.05Å; A257-E274 PolarHBondContact N-O 2.84Å; E274-L276 HydrophobicContact CG-CD2 4.4Å
275	F	93.7	Very high	84.7	Confident	29 Å²	29	71.4 Å²	71.4	13%	0.127	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119.4	173.6	-169.2	-96.2	0	0	0	110	D259 V264 K265 V268 E269 E277	D259-F275 HydrophobicContact CB-CE2 4.22Å; D259-F275 WeakPolarHBondContact O-CZ 3.21Å; V264-F275 HydrophobicContact CG1-CE2 4.49Å; K265-F275 HydrophobicContact CB-CD1 3.9Å; K265-F275 HydrophobicContact CB-CD2 4.11Å; K265-F275 HydrophobicContact CB-CE1 3.97Å; K265-F275 HydrophobicContact CB-CE2 4.17Å; K265-F275 HydrophobicContact CB-CG 3.96Å; K265-F275 HydrophobicContact CB-CZ 4.09Å; K265-F275 HydrophobicContact CD-CD1 3.91Å; K265-F275 HydrophobicContact CD-CE1 4.35Å; K265-F275 HydrophobicContact CD-CG 4.44Å; K265-F275 HydrophobicContact CG-CB 4.02Å; K265-F275 HydrophobicContact CG-CD1 3.71Å; K265-F275 HydrophobicContact CG-CD2 4.37Å; K265-F275 HydrophobicContact CG-CE1 4.25Å; K265-F275 HydrophobicContact CG-CG 3.77Å; V268-F275 HydrophobicContact CB-CD2 3.95Å; V268-F275 HydrophobicContact CG1-CB 4.13Å; V268-F275 HydrophobicContact CG1-CD2 4.09Å; V268-F275 HydrophobicContact CG2-CD2 3.99Å; V268-F275 HydrophobicContact CG2-CE2 4.46Å; E269-F275 HydrophobicContact CG-CB 4.4Å; F275-E277 HydrophobicContact CD1-CG 4Å; F275-E277 HydrophobicContact CE1-CG 4.18Å
276	L	93	Very high	83.5	Confident	9 Å²	9	69.8 Å²	69.8	5%	0.047	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-84.6	135.9	178.7	-60.2	177.1	0	0	0	110.1	M233 R256 A257 F258 E274 L305 Q309	M233-L276 HydrophobicContact SD-CD1 4.2Å; R256-L276 HydrophobicContact CB-CD1 4.09Å; R256-L276 HydrophobicContact CB-CD2 4.48Å; R256-L276 HydrophobicContact CB-CG 4.25Å; A257-L276 PolarHBondContact O-N 2.7Å; F258-L276 HydrophobicContact CB-CB 4.39Å; F258-L276 HydrophobicContact CD2-CB 4.29Å; F258-L276 VanDerWaalsContact CD2-O 3.31Å; F258-L276 WeakPolarHBondContact CD2-O 2.99Å; E274-L276 HydrophobicContact CG-CD2 4.4Å; L276-L305 HydrophobicContact CB-CD2 4.1Å; L276-Q309 HydrophobicContact CD1-CG 3.82Å
277	E	88	Confident	82.3	Confident	110 Å²	110	66.8 Å²	66.8	51%	0.514	39%	0.387	S	S	.	.			trans	-115.9	146.5	177.1	-66	-176	-159	0	0	110.8	K265 F275	K265-E277 IonicContact NZ-OE1 2.69Å; K265-E277 PolarHBondContact NZ-OE1 3.21Å; F275-E277 HydrophobicContact CD1-CG 4Å; F275-E277 HydrophobicContact CE1-CG 4.18Å
278	V	86.1	Confident	81	Confident	23 Å²	23	64.7 Å²	64.7	14%	0.139	39%	0.39	C	S	.	.			trans	-91.2	154.3	168.9	-73	0	0	0	0	110.4	F258 V280 F298 A301 E302 L305	F258-V278 HydrophobicContact CE2-CG1 3.81Å; F258-V278 HydrophobicContact CE2-CG2 4.49Å; F258-V278 HydrophobicContact CZ-CG1 4.09Å; V278-V280 WeakPolarHBondContact CG2-O 3.49Å; V278-V280 PolarHBondContact O-N 3.43Å; V278-F298 HydrophobicContact CG2-CD2 4.01Å; V278-F298 HydrophobicContact CG2-CE1 4.48Å; V278-F298 HydrophobicContact CG2-CE2 3.37Å; V278-F298 HydrophobicContact CG2-CZ 3.64Å; V278-A301 HydrophobicContact CB-CB 4.41Å; V278-A301 HydrophobicContact CG1-CB 4.49Å; V278-E302 HydrophobicContact CG1-CB 4.37Å; V278-L305 HydrophobicContact CG1-CB 4.42Å; V278-L305 HydrophobicContact CG1-CD2 3.87Å
279	S	79.5	Confident	79.6	Confident	115 Å²	115	66.8 Å²	66.8	80%	0.804	41%	0.411	S	S	*	.	S	Bend	trans	-66.2	-23.9	179	51.6	0	0	0	0	113.7
280	V	79	Confident	78.3	Confident	51 Å²	51	65.7 Å²	65.7	31%	0.309	40%	0.403	S	S	.	.	S	Bend	trans	-90.3	113.9	-179.7	-176.6	0	0	0	0	109.8	V278 E282 A301	V278-V280 WeakPolarHBondContact CG2-O 3.49Å; V278-V280 PolarHBondContact O-N 3.43Å; V280-E282 PolarHBondContact O-N 3.01Å; V280-A301 HydrophobicContact CG2-CB 3.96Å
281	K	74.6	Confident	77.6	Confident	200 Å²	200	62.8 Å²	62.8	87%	0.87	39%	0.385	S	S	*	.			trans	-84.7	101.4	177.5	-68.8	-171.9	177.2	-177.1	0	111
282	E	77.7	Confident	76.8	Confident	59 Å²	59	63.8 Å²	63.8	28%	0.276	39%	0.386	S	S	.	.			trans	-131.5	137	171.7	-170.9	-172.9	160	0	0	109.9	V280 G284 K292 M294 S295 F298	V280-E282 PolarHBondContact O-N 3.01Å; E282-G284 PolarHBondContact O-N 3.41Å; E282-K292 IonicContact OE1-NZ 2.98Å; E282-K292 PolarHBondContact OE1-NZ 3.46Å; E282-M294 HydrophobicContact CB-CE 3.68Å; E282-M294 HydrophobicContact CG-CE 3.71Å; E282-S295 WeakPolarHBondContact OE2-CB 3.36Å; E282-S295 PolarHBondContact OE2-N 2.91Å; E282-S295 PolarHBondContact OE2-OG 3.17Å; E282-F298 HydrophobicContact CB-CD2 3.93Å; E282-F298 HydrophobicContact CB-CE2 4.45Å
283	A	71.9	Confident	76.1	Confident	71 Å²	71	68.7 Å²	68.7	59%	0.587	40%	0.4	S	S	*	.			trans	-77.3	113.4	178.8	0	0	0	0	0	111.3	K292	A283-K292 WeakPolarHBondContact O-CE 3.47Å; A283-K292 PolarHBondContact O-NZ 3.28Å
284	G	68.4	Low	75.5	Confident	2 Å²	2	69.3 Å²	69.3	2%	0.021	40%	0.402	C	S	.	.			trans	-88.4	7.1	-178.6	0	0	0	0	0	116.5	T260 E282 A291 K292 M294	T260-G284 PolarHBondContact O-N 2.84Å; E282-G284 PolarHBondContact O-N 3.41Å; G284-A291 WeakPolarHBondContact O-CA 3.46Å; G284-K292 PolarHBondContact O-N 3.23Å; G284-M294 VanDerWaalsContact CA-SD 3.52Å
285	E	69	Low	74.9	Confident	120 Å²	120	66.5 Å²	66.5	56%	0.561	39%	0.393	S	S	*	.	B	Isolated β-bridge	trans	-70.9	127.2	-177.4	-65.5	174	-179.7	0	0	112.1
286	G	63.7	Low	74.5	Confident	31 Å²	31	72.1 Å²	72.1	32%	0.32	42%	0.417	S	S	.	.			trans	-115.9	179.6	172.4	0	0	0	0	0	112.4	Y290	G286-Y290 CarbonylContact C-O 3.57Å; G286-Y290 WeakPolarHBondContact CA-O 3.31Å; G286-Y290 PolarHBondContact N-O 2.94Å
287	A	61.1	Low	74.1	Confident	93 Å²	93	77.6 Å²	77.6	77%	0.769	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-68.4	145	-178.7	0	0	0	0	0	112.4	G289 Y290	A287-G289 VanDerWaalsContact C-N 3.28Å; A287-G289 PolarHBondContact O-N 3.17Å; A287-Y290 PolarHBondContact O-N 2.85Å
288	G	58.9	Low	74	Confident	47 Å²	47	72.7 Å²	72.7	49%	0.485	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	67	22.2	175.5	0	0	0	0	0	115.2	Y290	G288-Y290 VanDerWaalsContact C-N 3.34Å
289	G	61	Low	74	Confident	44 Å²	44	75 Å²	75	45%	0.454	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	81.8	5.3	-179.5	0	0	0	0	0	115.1	R261 A287	R261-G289 PolarHBondContact NH1-O 2.96Å; A287-G289 VanDerWaalsContact C-N 3.28Å; A287-G289 PolarHBondContact O-N 3.17Å
290	Y	65.3	Low	74.4	Confident	74 Å²	74	75 Å²	75	29%	0.29	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-82.7	161.2	174.7	-67.7	-76	0	0	0	112.1	R184 G286 A287 G288 P323	R184-Y290 PolarHBondContact NH1-OH 2.98Å; R184-Y290 VanDerWaalsContact NH1-OH 3.13Å; R184-Y290 PolarHBondContact NH2-OH 3.41Å; G286-Y290 CarbonylContact C-O 3.57Å; G286-Y290 WeakPolarHBondContact CA-O 3.31Å; G286-Y290 PolarHBondContact N-O 2.94Å; A287-Y290 PolarHBondContact O-N 2.85Å; G288-Y290 VanDerWaalsContact C-N 3.34Å; Y290-P323 HydrophobicContact CD1-CG 4.07Å; Y290-P323 HydrophobicContact CE1-CG 3.32Å; Y290-P323 HydrophobicContact CE2-CG 4.41Å; Y290-P323 VanDerWaalsContact CZ-CG 3.5Å; Y290-P323 WeakPolarHBondContact OH-CG 3.3Å
291	A	70.6	Confident	74.9	Confident	34 Å²	34	73.5 Å²	73.5	28%	0.281	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-81.2	148.9	171.2	0	0	0	0	0	111	T260 G284	T260-A291 WeakPolarHBondContact OG1-CB 3.38Å; G284-A291 WeakPolarHBondContact O-CA 3.46Å
292	K	73.9	Confident	75.6	Confident	87 Å²	87	64.6 Å²	64.6	38%	0.378	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-87.8	164.2	166.6	73.7	178.2	-161.7	-169.1	0	110.8	E282 A283 G284 M294	E282-K292 IonicContact OE1-NZ 2.98Å; E282-K292 PolarHBondContact OE1-NZ 3.46Å; A283-K292 WeakPolarHBondContact O-CE 3.47Å; A283-K292 PolarHBondContact O-NZ 3.28Å; G284-K292 PolarHBondContact O-N 3.23Å; K292-M294 HydrophobicContact CG-SD 4.15Å
293	E	74.5	Confident	76.2	Confident	140 Å²	140	64 Å²	64	65%	0.654	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-70.7	129.8	170.7	-161.4	165.1	167.2	0	0	109.4	K325	E293-K325 IonicContact OE2-NZ 3.96Å; E293-K325 PolarHBondContact OE2-NZ 2.65Å
294	M	80	Confident	77.2	Confident	21 Å²	21	63.5 Å²	63.5	10%	0.103	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-92.2	163.3	-171.3	-59.4	-58.5	-71.6	0	0	112.2	T260 E282 G284 K292 F298 I299	T260-M294 HydrophobicContact CG2-CG 4.24Å; E282-M294 HydrophobicContact CB-CE 3.68Å; E282-M294 HydrophobicContact CG-CE 3.71Å; G284-M294 VanDerWaalsContact CA-SD 3.52Å; K292-M294 HydrophobicContact CG-SD 4.15Å; M294-F298 HydrophobicContact CB-CB 4.04Å; M294-F298 HydrophobicContact CB-CD1 3.61Å; M294-F298 HydrophobicContact CB-CE1 4.33Å; M294-F298 HydrophobicContact CB-CG 3.96Å; M294-F298 HydrophobicContact CE-CB 4.45Å; M294-F298 HydrophobicContact CE-CD1 3.88Å; M294-F298 HydrophobicContact CE-CD2 3.53Å; M294-F298 HydrophobicContact CE-CE1 3.94Å; M294-F298 HydrophobicContact CE-CE2 3.57Å; M294-F298 HydrophobicContact CE-CG 3.68Å; M294-F298 HydrophobicContact CE-CZ 3.79Å; M294-F298 HydrophobicContact CG-CD1 3.71Å; M294-F298 HydrophobicContact CG-CE1 3.92Å; M294-F298 HydrophobicContact CG-CG 4.3Å; M294-I299 HydrophobicContact CB-CG1 4.43Å
295	S	82.5	Confident	78.3	Confident	37 Å²	37	64.5 Å²	64.5	26%	0.259	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-60.5	157.2	174	63.5	0	0	0	0	112.6	E282 E297 F298 I299	E282-S295 WeakPolarHBondContact OE2-CB 3.36Å; E282-S295 PolarHBondContact OE2-N 2.91Å; E282-S295 PolarHBondContact OE2-OG 3.17Å; S295-E297 WeakPolarHBondContact CB-OE2 3.36Å; S295-E297 PolarHBondContact O-N 2.96Å; S295-F298 WeakPolarHBondContact O-CB 3.18Å; S295-F298 PolarHBondContact O-N 2.99Å; S295-F298 WeakPolarHBondContact OG-CB 3.34Å; S295-F298 PolarHBondContact OG-N 3.01Å; S295-I299 WeakPolarHBondContact O-CG1 3.35Å; S295-I299 PolarHBondContact O-N 3.21Å
296	K	85	Confident	79.5	Confident	147 Å²	147	58.8 Å²	58.8	64%	0.639	34%	0.344	S	S	*	.	H	α-helix	trans	-61.8	-37.7	178.9	-171.1	-175.6	174.9	-164.3	0	111.1	I299 E300	K296-I299 PolarHBondContact O-N 3.46Å; K296-E300 VanDerWaalsContact CE-OE1 3.29Å; K296-E300 WeakPolarHBondContact CE-OE1 3.33Å; K296-E300 IonicContact NZ-OE1 2.64Å; K296-E300 WeakPolarHBondContact O-CG 3.45Å; K296-E300 PolarHBondContact O-N 3.1Å
297	E	85	Confident	81	Confident	123 Å²	123	58.9 Å²	58.9	58%	0.575	34%	0.341	S	S	*	.	H	α-helix	trans	-63.1	-41	176.9	-63	72.9	-161.7	0	0	111.5	S295 E300 A301	S295-E297 WeakPolarHBondContact CB-OE2 3.36Å; S295-E297 PolarHBondContact O-N 2.96Å; E297-E300 PolarHBondContact O-N 2.79Å; E297-A301 PolarHBondContact O-N 2.94Å; E297-A301 VanDerWaalsContact O-N 3.11Å
298	F	86.4	Confident	82.6	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.035	33%	0.333	C	S	.	.	H	α-helix	trans	-64.7	-44.6	174.3	-173.3	-80.1	0	0	0	111.3	F258 T260 V278 E282 M294 S295 E300 A301 E302	F258-F298 HydrophobicContact CZ-CE1 4.18Å; F258-F298 HydrophobicContact CZ-CZ 4.08Å; T260-F298 HydrophobicContact CG2-CE1 3.77Å; T260-F298 HydrophobicContact CG2-CZ 4.04Å; V278-F298 HydrophobicContact CG2-CD2 4.01Å; V278-F298 HydrophobicContact CG2-CE1 4.48Å; V278-F298 HydrophobicContact CG2-CE2 3.37Å; V278-F298 HydrophobicContact CG2-CZ 3.64Å; E282-F298 HydrophobicContact CB-CD2 3.93Å; E282-F298 HydrophobicContact CB-CE2 4.45Å; M294-F298 HydrophobicContact CB-CB 4.04Å; M294-F298 HydrophobicContact CB-CD1 3.61Å; M294-F298 HydrophobicContact CB-CE1 4.33Å; M294-F298 HydrophobicContact CB-CG 3.96Å; M294-F298 HydrophobicContact CE-CB 4.45Å; M294-F298 HydrophobicContact CE-CD1 3.88Å; M294-F298 HydrophobicContact CE-CD2 3.53Å; M294-F298 HydrophobicContact CE-CE1 3.94Å; M294-F298 HydrophobicContact CE-CE2 3.57Å; M294-F298 HydrophobicContact CE-CG 3.68Å; M294-F298 HydrophobicContact CE-CZ 3.79Å; M294-F298 HydrophobicContact CG-CD1 3.71Å; M294-F298 HydrophobicContact CG-CE1 3.92Å; M294-F298 HydrophobicContact CG-CG 4.3Å; S295-F298 WeakPolarHBondContact O-CB 3.18Å; S295-F298 PolarHBondContact O-N 2.99Å; S295-F298 WeakPolarHBondContact OG-CB 3.34Å; S295-F298 PolarHBondContact OG-N 3.01Å; F298-E300 VanDerWaalsContact C-N 3.35Å; F298-E300 PolarHBondContact O-N 2.9Å; F298-A301 PolarHBondContact O-N 3.41Å; F298-E302 HydrophobicContact CD1-CB 4.46Å; F298-E302 HydrophobicContact CE1-CB 4.41Å; F298-E302 VanDerWaalsContact O-CB 3.28Å; F298-E302 WeakPolarHBondContact O-CB 3.31Å; F298-E302 PolarHBondContact O-N 2.87Å
299	I	85.1	Confident	84.3	Confident	70 Å²	70	59.1 Å²	59.1	36%	0.359	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-41.9	177.9	-66.2	168	0	0	0	110.7	M294 S295 K296 A301 E302 M303	M294-I299 HydrophobicContact CB-CG1 4.43Å; S295-I299 WeakPolarHBondContact O-CG1 3.35Å; S295-I299 PolarHBondContact O-N 3.21Å; K296-I299 PolarHBondContact O-N 3.46Å; I299-A301 PolarHBondContact O-N 2.83Å; I299-E302 PolarHBondContact O-N 3.4Å; I299-M303 HydrophobicContact CG2-CG 4.2Å; I299-M303 WeakPolarHBondContact O-CB 3.45Å; I299-M303 WeakPolarHBondContact O-CG 3.31Å; I299-M303 PolarHBondContact O-N 3.36Å
300	E	87.9	Confident	85.9	Confident	116 Å²	116	57 Å²	57	54%	0.542	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-41.8	176.4	-75	177.5	-171.1	0	0	111.9	K296 E297 F298 A304	K296-E300 VanDerWaalsContact CE-OE1 3.29Å; K296-E300 WeakPolarHBondContact CE-OE1 3.33Å; K296-E300 IonicContact NZ-OE1 2.64Å; K296-E300 WeakPolarHBondContact O-CG 3.45Å; K296-E300 PolarHBondContact O-N 3.1Å; E297-E300 PolarHBondContact O-N 2.79Å; F298-E300 VanDerWaalsContact C-N 3.35Å; F298-E300 PolarHBondContact O-N 2.9Å; E300-A304 WeakPolarHBondContact O-CB 3.31Å; E300-A304 PolarHBondContact O-N 3.37Å
301	A	89.4	Confident	87.3	Confident	19 Å²	19	60 Å²	60	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-40.8	175.6	0	0	0	0	0	112.8	V278 V280 E297 F298 I299 A304 L305	V278-A301 HydrophobicContact CB-CB 4.41Å; V278-A301 HydrophobicContact CG1-CB 4.49Å; V280-A301 HydrophobicContact CG2-CB 3.96Å; E297-A301 PolarHBondContact O-N 2.94Å; E297-A301 VanDerWaalsContact O-N 3.11Å; F298-A301 PolarHBondContact O-N 3.41Å; I299-A301 PolarHBondContact O-N 2.83Å; A301-A304 PolarHBondContact O-N 3Å; A301-L305 PolarHBondContact O-N 3.26Å
302	E	90.2	Very high	88.4	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.065	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-47.5	174.6	177.3	-178.2	-157.5	0	0	111	F258 V278 F298 I299 A304 L305 F306	F258-E302 HydrophobicContact CE1-CG 3.87Å; F258-E302 VanDerWaalsContact CE1-OE1 3.23Å; F258-E302 WeakPolarHBondContact CE1-OE1 3.46Å; F258-E302 HydrophobicContact CZ-CG 4.09Å; V278-E302 HydrophobicContact CG1-CB 4.37Å; F298-E302 HydrophobicContact CD1-CB 4.46Å; F298-E302 HydrophobicContact CE1-CB 4.41Å; F298-E302 VanDerWaalsContact O-CB 3.28Å; F298-E302 WeakPolarHBondContact O-CB 3.31Å; F298-E302 PolarHBondContact O-N 2.87Å; I299-E302 PolarHBondContact O-N 3.4Å; E302-A304 VanDerWaalsContact C-N 3.33Å; E302-A304 PolarHBondContact O-N 3.33Å; E302-L305 WeakPolarHBondContact O-CB 3.25Å; E302-L305 PolarHBondContact O-N 3.24Å; E302-F306 HydrophobicContact CG-CD2 4Å; E302-F306 HydrophobicContact CG-CE1 4.33Å; E302-F306 HydrophobicContact CG-CE2 3.3Å; E302-F306 HydrophobicContact CG-CZ 3.49Å; E302-F306 VanDerWaalsContact CG-CZ 3.49Å; E302-F306 WeakPolarHBondContact O-CG 3.37Å; E302-F306 PolarHBondContact O-N 2.64Å; E302-F306 WeakPolarHBondContact OE1-CE2 3.41Å; E302-F306 WeakPolarHBondContact OE1-CZ 3.2Å
303	M	90.2	Very high	89.5	Confident	46 Å²	46	58.2 Å²	58.2	23%	0.227	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-38.2	176.6	-68.9	-66.2	-80.2	0	0	111.8	I299 F306 A307 M335	I299-M303 HydrophobicContact CG2-CG 4.2Å; I299-M303 WeakPolarHBondContact O-CB 3.45Å; I299-M303 WeakPolarHBondContact O-CG 3.31Å; I299-M303 PolarHBondContact O-N 3.36Å; M303-F306 PolarHBondContact O-N 2.79Å; M303-A307 WeakPolarHBondContact O-CB 3.25Å; M303-A307 PolarHBondContact O-N 3.46Å; M303-M335 HydrophobicContact CB-CE 4.07Å; M303-M335 HydrophobicContact CE-CE 3.57Å; M303-M335 HydrophobicContact CE-SD 4.28Å; M303-M335 WeakPolarHBondContact O-CE 3.44Å; M303-M335 HydrophobicContact SD-CE 4.05Å
304	A	92	Very high	90.6	Very high	61 Å²	61	52.2 Å²	52.2	50%	0.504	27%	0.266	S	S	.	.	H	α-helix	trans	-63.8	-43	175	0	0	0	0	0	112	E300 A301 E302 A307 Q308	E300-A304 WeakPolarHBondContact O-CB 3.31Å; E300-A304 PolarHBondContact O-N 3.37Å; A301-A304 PolarHBondContact O-N 3Å; E302-A304 VanDerWaalsContact C-N 3.33Å; E302-A304 PolarHBondContact O-N 3.33Å; A304-A307 PolarHBondContact O-N 3.43Å; A304-Q308 PolarHBondContact O-N 3.26Å; A304-Q308 VanDerWaalsContact O-N 3.08Å
305	L	92.9	Very high	91.4	Very high	23 Å²	23	51.2 Å²	51.2	12%	0.12	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-48	174.4	175.3	66.8	0	0	0	111.1	F258 L276 V278 A301 E302 A307 Q308 Q309	F258-L305 HydrophobicContact CD2-CD2 3.78Å; F258-L305 HydrophobicContact CE2-CD2 4Å; L276-L305 HydrophobicContact CB-CD2 4.1Å; V278-L305 HydrophobicContact CG1-CB 4.42Å; V278-L305 HydrophobicContact CG1-CD2 3.87Å; A301-L305 PolarHBondContact O-N 3.26Å; E302-L305 WeakPolarHBondContact O-CB 3.25Å; E302-L305 PolarHBondContact O-N 3.24Å; L305-A307 PolarHBondContact O-N 3.46Å; L305-Q308 PolarHBondContact O-N 2.87Å; L305-Q309 HydrophobicContact CD1-CG 4.34Å; L305-Q309 WeakPolarHBondContact O-CG 3.29Å; L305-Q309 PolarHBondContact O-N 2.84Å
306	F	94.9	Very high	92.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-40.2	178.5	-63.3	-24.2	0	0	0	112.6	M233 I235 F258 E302 M303 Q308 Q309 C310 L330 I331	M233-F306 HydrophobicContact CE-CD1 4.18Å; M233-F306 HydrophobicContact SD-CD1 4.4Å; I235-F306 HydrophobicContact CD1-CD1 4.23Å; I235-F306 HydrophobicContact CD1-CD2 4.33Å; I235-F306 HydrophobicContact CD1-CE1 4.08Å; I235-F306 HydrophobicContact CD1-CE2 4.16Å; I235-F306 HydrophobicContact CD1-CG 4.37Å; I235-F306 HydrophobicContact CD1-CZ 4.04Å; I235-F306 HydrophobicContact CG1-CE1 4.14Å; I235-F306 HydrophobicContact CG1-CZ 4.24Å; I235-F306 HydrophobicContact CG2-CE1 4.5Å; I235-F306 HydrophobicContact CG2-CE2 4.35Å; I235-F306 HydrophobicContact CG2-CZ 3.85Å; F258-F306 HydrophobicContact CB-CE1 4.03Å; F258-F306 AromaticContact CD1-CE1 3.76Å; F258-F306 HydrophobicContact CD1-CE1 3.76Å; F258-F306 AromaticContact CD1-CZ 3.52Å; F258-F306 HydrophobicContact CD1-CZ 3.52Å; F258-F306 HydrophobicContact CE1-CE1 4.4Å; F258-F306 AromaticContact CE1-CZ 3.92Å; F258-F306 HydrophobicContact CE1-CZ 3.92Å; F258-F306 AromaticContact CG-CE1 3.88Å; F258-F306 HydrophobicContact CG-CE1 3.88Å; F258-F306 HydrophobicContact CG-CZ 4.14Å; E302-F306 HydrophobicContact CG-CD2 4Å; E302-F306 HydrophobicContact CG-CE1 4.33Å; E302-F306 HydrophobicContact CG-CE2 3.3Å; E302-F306 HydrophobicContact CG-CZ 3.49Å; E302-F306 VanDerWaalsContact CG-CZ 3.49Å; E302-F306 WeakPolarHBondContact O-CG 3.37Å; E302-F306 PolarHBondContact O-N 2.64Å; E302-F306 WeakPolarHBondContact OE1-CE2 3.41Å; E302-F306 WeakPolarHBondContact OE1-CZ 3.2Å; M303-F306 PolarHBondContact O-N 2.79Å; F306-Q308 VanDerWaalsContact C-N 3.27Å; F306-Q308 PolarHBondContact O-N 3.04Å; F306-Q309 PolarHBondContact O-N 3.39Å; F306-C310 WeakPolarHBondContact O-CB 3.23Å; F306-C310 PolarHBondContact O-N 3.46Å; F306-C310 PolarHBondContact O-SG 3.03Å; F306-L330 HydrophobicContact CD2-CB 4.27Å; F306-L330 HydrophobicContact CE2-CB 3.98Å; F306-L330 HydrophobicContact CE2-CD1 4.35Å; F306-L330 HydrophobicContact CE2-CD2 4.49Å; F306-L330 HydrophobicContact CE2-CG 4.5Å; F306-I331 HydrophobicContact CB-CD1 4Å; F306-I331 HydrophobicContact CD2-CD1 4.2Å; F306-I331 HydrophobicContact CG-CD1 4.23Å
307	A	93.9	Very high	92.8	Very high	33 Å²	33	42.5 Å²	42.5	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-36	174.4	0	0	0	0	0	112.7	M303 A304 L305 M335	M303-A307 WeakPolarHBondContact O-CB 3.25Å; M303-A307 PolarHBondContact O-N 3.46Å; A304-A307 PolarHBondContact O-N 3.43Å; L305-A307 PolarHBondContact O-N 3.46Å; A307-M335 HydrophobicContact CB-CE 3.98Å; A307-M335 HydrophobicContact CB-CG 4.16Å
308	Q	94	Very high	93.3	Very high	126 Å²	126	36.6 Å²	36.6	59%	0.589	19%	0.191	S	C	*	.	H	α-helix	trans	-69.8	-46.1	175.4	-174.7	179.2	-4.5	0	0	111.3	A304 L305 F306 K311	A304-Q308 PolarHBondContact O-N 3.26Å; A304-Q308 VanDerWaalsContact O-N 3.08Å; L305-Q308 PolarHBondContact O-N 2.87Å; F306-Q308 VanDerWaalsContact C-N 3.27Å; F306-Q308 PolarHBondContact O-N 3.04Å; Q308-K311 PolarHBondContact O-N 3.29Å
309	Q	94.9	Very high	93.7	Very high	18 Å²	18	37.2 Å²	37.2	8%	0.084	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-40.6	-179.3	-67.6	-65.2	-31.2	0	0	112.6	M233 R256 L276 L305 F306 K311 E312 I313	M233-Q309 HydrophobicContact CE-CB 4.06Å; M233-Q309 HydrophobicContact SD-CB 3.42Å; M233-Q309 WeakPolarHBondContact SD-CB 3.36Å; M233-Q309 HydrophobicContact SD-CG 3.8Å; R256-Q309 VanDerWaalsContact CD-OE1 3.23Å; L276-Q309 HydrophobicContact CD1-CG 3.82Å; L305-Q309 HydrophobicContact CD1-CG 4.34Å; L305-Q309 WeakPolarHBondContact O-CG 3.29Å; L305-Q309 PolarHBondContact O-N 2.84Å; F306-Q309 PolarHBondContact O-N 3.39Å; Q309-K311 PolarHBondContact O-N 2.9Å; Q309-E312 PolarHBondContact O-N 3.32Å; Q309-I313 WeakPolarHBondContact O-CG1 3.36Å; Q309-I313 WeakPolarHBondContact O-CG2 3.41Å; Q309-I313 PolarHBondContact O-N 3.37Å; Q309-I313 VanDerWaalsContact O-N 3.11Å
310	C	95	Very high	93.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-56.1	-26.6	-179	-73.3	0	0	0	0	113.7	F306 E312 M335 M339	F306-C310 WeakPolarHBondContact O-CB 3.23Å; F306-C310 PolarHBondContact O-N 3.46Å; F306-C310 PolarHBondContact O-SG 3.03Å; C310-E312 VanDerWaalsContact C-N 3.32Å; C310-E312 PolarHBondContact O-N 3.47Å; C310-M335 HydrophobicContact CB-CB 4.39Å; C310-M339 HydrophobicContact CB-CG 4.18Å; C310-M339 WeakPolarHBondContact O-CG 3.13Å
311	K	94.1	Very high	93.8	Very high	138 Å²	138	33.7 Å²	33.7	60%	0.6	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-25.5	177	-65.2	176.5	-177.2	177.8	0	113.4	Q308 Q309	Q308-K311 PolarHBondContact O-N 3.29Å; Q309-K311 PolarHBondContact O-N 2.9Å
312	E	94.5	Very high	93.1	Very high	83 Å²	83	35.2 Å²	35.2	39%	0.388	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-35.4	-173.2	-69	-165.7	177.3	0	0	114.4	K231 R256 Q309 C310 K340	K231-E312 IonicContact NZ-OE2 3.82Å; K231-E312 PolarHBondContact NZ-OE2 3.1Å; R256-E312 IonicContact CZ-OE2 2.76Å; R256-E312 IonicContact NH1-OE2 2.87Å; R256-E312 PolarHBondContact NH1-OE2 2.93Å; R256-E312 IonicContact NH2-OE2 3.91Å; Q309-E312 PolarHBondContact O-N 3.32Å; C310-E312 VanDerWaalsContact C-N 3.32Å; C310-E312 PolarHBondContact O-N 3.47Å; E312-K340 WeakPolarHBondContact O-CE 3.17Å; E312-K340 PolarHBondContact O-NZ 3.31Å
313	I	96.7	Very high	92.1	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.			trans	-74.1	156.7	-174.7	66.4	179.5	0	0	0	111.1	K231 M233 Q309 L316 M339	K231-I313 HydrophobicContact CB-CB 4.43Å; K231-I313 HydrophobicContact CB-CG2 4.36Å; M233-I313 HydrophobicContact CB-CD1 3.52Å; M233-I313 HydrophobicContact CB-CG2 4.17Å; M233-I313 HydrophobicContact CE-CD1 3.66Å; M233-I313 HydrophobicContact CG-CD1 4.44Å; M233-I313 HydrophobicContact SD-CD1 4.22Å; Q309-I313 WeakPolarHBondContact O-CG1 3.36Å; Q309-I313 WeakPolarHBondContact O-CG2 3.41Å; Q309-I313 PolarHBondContact O-N 3.37Å; Q309-I313 VanDerWaalsContact O-N 3.11Å; I313-L316 HydrophobicContact CD1-CB 4.06Å; I313-L316 HydrophobicContact CD1-CD1 4.13Å; I313-L316 HydrophobicContact CD1-CG 4.45Å; I313-M339 HydrophobicContact CD1-CE 4.28Å; I313-M339 HydrophobicContact CG1-CE 3.98Å
314	D	97.3	Very high	91.1	Very high	13 Å²	13	38.9 Å²	38.9	7%	0.07	23%	0.229	C	C	.	.	S	Bend	trans	-106.3	-26.9	178.9	-47.8	-65.3	0	0	0	111.4	F213 K231 K340 S343 V344	F213-D314 HydrophobicContact CE1-CB 4.34Å; F213-D314 HydrophobicContact CE2-CB 3.8Å; F213-D314 HydrophobicContact CZ-CB 3.5Å; K231-D314 PolarHBondContact N-OD2 2.86Å; K231-D314 PolarHBondContact O-N 3.15Å; D314-K340 IonicContact OD1-NZ 2.67Å; D314-K340 PolarHBondContact OD1-NZ 2.85Å; D314-S343 CarbonylContact O-C 3.48Å; D314-S343 WeakPolarHBondContact O-CA 3.32Å; D314-S343 WeakPolarHBondContact O-CB 3.06Å; D314-V344 PolarHBondContact O-N 3.2Å
315	I	98	Very high	90.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.5	178.6	-57.1	173.6	0	0	0	110.2	A209 F213 F217 K231 I232 M233 I317 V344	A209-I315 HydrophobicContact CB-CD1 4.13Å; A209-I315 HydrophobicContact CB-CG2 3.8Å; F213-I315 HydrophobicContact CB-CD1 4.12Å; F213-I315 HydrophobicContact CD1-CD1 4.07Å; F213-I315 HydrophobicContact CD2-CG1 4.38Å; F213-I315 HydrophobicContact CG-CD1 4.01Å; F213-I315 HydrophobicContact CG-CG1 4.33Å; F217-I315 HydrophobicContact CD1-CD1 4.39Å; F217-I315 HydrophobicContact CE1-CD1 3.29Å; F217-I315 HydrophobicContact CE2-CD1 4.38Å; F217-I315 HydrophobicContact CZ-CD1 3.29Å; K231-I315 PolarHBondContact O-N 2.92Å; I232-I315 CarbonylContact C-O 3.54Å; I232-I315 WeakPolarHBondContact CA-O 3.47Å; I232-I315 HydrophobicContact CB-CB 4.44Å; I232-I315 HydrophobicContact CD1-CB 4.4Å; I232-I315 HydrophobicContact CD1-CD1 3.95Å; I232-I315 HydrophobicContact CG1-CB 4.02Å; I232-I315 HydrophobicContact CG1-CD1 4.27Å; I232-I315 HydrophobicContact CG2-CB 4.15Å; I232-I315 HydrophobicContact CG2-CG2 4.12Å; M233-I315 PolarHBondContact N-O 2.69Å; I315-I317 HydrophobicContact CG2-CG1 4.11Å; I315-V344 CarbonylContact C-O 3.54Å; I315-V344 VanDerWaalsContact CA-O 3.23Å; I315-V344 WeakPolarHBondContact CA-O 3.34Å; I315-V344 HydrophobicContact CG1-CB 4.28Å
316	L	97.9	Very high	90.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.9	173.3	-174.7	152.9	0	0	0	109.6	M233 I235 I313 I331 M339 V344 V345 V346 I356	M233-L316 HydrophobicContact CE-CD1 3.52Å; M233-L316 HydrophobicContact CE-CG 4.17Å; M233-L316 WeakPolarHBondContact O-CA 3.43Å; I235-L316 HydrophobicContact CD1-CD1 4.21Å; I235-L316 HydrophobicContact CD1-CD2 4.31Å; I235-L316 HydrophobicContact CD1-CG 4.38Å; I313-L316 HydrophobicContact CD1-CB 4.06Å; I313-L316 HydrophobicContact CD1-CD1 4.13Å; I313-L316 HydrophobicContact CD1-CG 4.45Å; L316-I331 HydrophobicContact CD1-CD1 3.61Å; L316-I331 HydrophobicContact CD1-CG1 3.87Å; L316-I331 HydrophobicContact CD2-CG1 4.19Å; L316-M339 HydrophobicContact CB-CE 4.36Å; L316-V344 PolarHBondContact N-O 3.4Å; L316-V345 HydrophobicContact CB-CG1 4.17Å; L316-V345 CarbonylContact O-C 3.56Å; L316-V345 WeakPolarHBondContact O-CA 3.46Å; L316-V346 PolarHBondContact O-N 2.57Å; L316-I356 HydrophobicContact CD2-CD1 4.12Å
317	I	97.9	Very high	89.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.4	174.9	-55.9	179.4	0	0	0	108.2	A205 V206 I232 M233 V234 I235 A244 I315 T319 V346 L348	A205-I317 HydrophobicContact CB-CD1 4.39Å; A205-I317 HydrophobicContact CB-CG2 4.12Å; V206-I317 HydrophobicContact CG2-CD1 3.74Å; I232-I317 HydrophobicContact CG2-CD1 4.29Å; I232-I317 HydrophobicContact CG2-CG1 4.49Å; M233-I317 PolarHBondContact O-N 3.5Å; V234-I317 CarbonylContact C-O 3.57Å; V234-I317 WeakPolarHBondContact CA-O 3.47Å; V234-I317 HydrophobicContact CG2-CB 4.46Å; I235-I317 PolarHBondContact N-O 3.39Å; A244-I317 HydrophobicContact CB-CD1 4.18Å; A244-I317 HydrophobicContact CB-CG2 4.41Å; I315-I317 HydrophobicContact CG2-CG1 4.11Å; I317-T319 HydrophobicContact CG2-CG2 4.18Å; I317-V346 WeakPolarHBondContact CA-O 3.34Å; I317-V346 HydrophobicContact CG1-CB 4.25Å; I317-V346 HydrophobicContact CG1-CG2 4.44Å; I317-L348 HydrophobicContact CG2-CD1 4.45Å
318	S	96.7	Very high	89.5	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.1	179.7	62.6	0	0	0	0	111.7	V346 D347 L348 N355	S318-V346 PolarHBondContact N-O 2.95Å; S318-D347 WeakPolarHBondContact OG-CA 3.48Å; S318-D347 PolarHBondContact OG-OD1 3.42Å; S318-L348 WeakPolarHBondContact O-CB 3.19Å; S318-L348 PolarHBondContact O-N 3.24Å; S318-N355 WeakPolarHBondContact CB-OD1 3.3Å; S318-N355 PolarHBondContact OG-OD1 3.33Å
319	T	94.3	Very high	89.4	Confident	21 Å²	21	44.9 Å²	44.9	13%	0.129	25%	0.252	C	S	.	.			trans	-129.5	7.9	-175.1	77	0	0	0	0	113.2	I235 G236 A240 I317 L321 L348	I235-T319 WeakPolarHBondContact O-CA 3.29Å; I235-T319 WeakPolarHBondContact O-CB 3.34Å; I235-T319 PolarHBondContact O-N 3.22Å; I235-T319 PolarHBondContact O-OG1 3.16Å; G236-T319 WeakPolarHBondContact CA-OG1 3.43Å; G236-T319 PolarHBondContact O-OG1 3.01Å; G236-T319 VanDerWaalsContact O-OG1 3.07Å; A240-T319 HydrophobicContact CB-CG2 4.37Å; I317-T319 HydrophobicContact CG2-CG2 4.18Å; T319-L321 PolarHBondContact O-N 2.86Å; T319-L348 HydrophobicContact CG2-CB 4.44Å; T319-L348 HydrophobicContact CG2-CD1 3.84Å; T319-L348 HydrophobicContact CG2-CG 4.44Å
320	A	89.8	Confident	89.3	Confident	22 Å²	22	44.6 Å²	44.6	18%	0.182	25%	0.251	C	S	.	.			trans	-72.3	105.1	-173.3	0	0	0	0	0	110.5	P328 L330 N355	A320-P328 HydrophobicContact CB-CG 4.2Å; A320-L330 HydrophobicContact CB-CD1 3.55Å; A320-N355 PolarHBondContact N-OD1 2.85Å; A320-N355 PolarHBondContact O-ND2 3.39Å; A320-N355 PolarHBondContact O-OD1 2.83Å
321	L	85.5	Confident	89.3	Confident	89 Å²	89	44.7 Å²	44.7	47%	0.466	25%	0.251	S	S	.	.			trans	-136.5	128.6	-177.6	-177.6	65.5	0	0	0	110.5	T319 A352	T319-L321 PolarHBondContact O-N 2.86Å; L321-A352 HydrophobicContact CD1-CB 3.36Å
322	I	75.4	Confident	89.3	Confident	51 Å²	51	39.6 Å²	39.6	26%	0.262	23%	0.233	S	C	.	.			trans	-107.8	118.2	171.7	-58.4	176.8	0	0	0	107.4	G324 K325	I322-G324 PolarHBondContact O-N 3.21Å; I322-K325 HydrophobicContact CB-CB 4.31Å; I322-K325 HydrophobicContact CG2-CB 4.34Å; I322-K325 HydrophobicContact CG2-CD 4.19Å; I322-K325 HydrophobicContact CG2-CG 4.39Å; I322-K325 PolarHBondContact O-N 3.01Å; I322-K325 VanDerWaalsContact O-N 3.15Å
323	P	68.3	Low	89.3	Confident	73 Å²	73	40.8 Å²	40.8	47%	0.474	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	132.3	-179.1	-24.5	31.5	0	0	0	112.5	Y290 K325	Y290-P323 HydrophobicContact CD1-CG 4.07Å; Y290-P323 HydrophobicContact CE1-CG 3.32Å; Y290-P323 HydrophobicContact CE2-CG 4.41Å; Y290-P323 VanDerWaalsContact CZ-CG 3.5Å; Y290-P323 WeakPolarHBondContact OH-CG 3.3Å; P323-K325 PolarHBondContact O-N 3.38Å
324	G	69.5	Low	89.1	Confident	65 Å²	65	49 Å²	49	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-7.8	178.2	0	0	0	0	0	115.7	I322	I322-G324 PolarHBondContact O-N 3.21Å
325	K	78.2	Confident	89	Confident	103 Å²	103	49 Å²	49	45%	0.448	27%	0.273	S	S	.	.	S	Bend	trans	-110.6	154.2	173.9	-70.2	-171.1	174.5	-175.4	0	110.9	E293 I322 P323	E293-K325 IonicContact OE2-NZ 3.96Å; E293-K325 PolarHBondContact OE2-NZ 2.65Å; I322-K325 HydrophobicContact CB-CB 4.31Å; I322-K325 HydrophobicContact CG2-CB 4.34Å; I322-K325 HydrophobicContact CG2-CD 4.19Å; I322-K325 HydrophobicContact CG2-CG 4.39Å; I322-K325 PolarHBondContact O-N 3.01Å; I322-K325 VanDerWaalsContact O-N 3.15Å; P323-K325 PolarHBondContact O-N 3.38Å
326	P	84.9	Confident	88.9	Confident	107 Å²	107	49.1 Å²	49.1	70%	0.695	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-56.5	145	165.6	-22.5	33.7	0	0	0	111.2	A352	P326-A352 WeakPolarHBondContact CA-O 3.48Å
327	A	88.3	Confident	88.7	Confident	8 Å²	8	54.1 Å²	54.1	7%	0.066	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-62.8	136	176.5	0	0	0	0	0	110.8	A349 A352	A327-A349 HydrophobicContact CB-CB 3.72Å; A327-A352 HydrophobicContact CB-CB 4.42Å; A327-A352 PolarHBondContact N-O 3.2Å
328	P	88.6	Confident	88.6	Confident	48 Å²	48	56.2 Å²	56.2	31%	0.312	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-66.8	138	179.4	27.4	-34.5	0	0	0	110.7	A320 L330 N355	A320-P328 HydrophobicContact CB-CG 4.2Å; P328-L330 HydrophobicContact CB-CD2 4.01Å; P328-L330 HydrophobicContact CB-CG 4.26Å; P328-L330 HydrophobicContact CG-CD1 4.32Å; P328-L330 HydrophobicContact CG-CD2 4.25Å; P328-L330 HydrophobicContact CG-CG 4.19Å; P328-L330 PolarHBondContact O-N 2.52Å; P328-L330 VanDerWaalsContact O-N 3.17Å; P328-N355 VanDerWaalsContact O-CA 3.27Å; P328-N355 WeakPolarHBondContact O-CA 3.26Å; P328-N355 PolarHBondContact O-ND2 3.11Å
329	K	91.9	Very high	88.5	Confident	103 Å²	103	56.6 Å²	56.6	45%	0.448	31%	0.313	S	S	.	.			trans	-80.3	93.6	175.8	-65	-59.9	-176	-173.9	0	110.1	G353 G354 N355 I356	K329-G353 PolarHBondContact NZ-O 2.96Å; K329-G354 WeakPolarHBondContact CD-O 3.46Å; K329-G354 WeakPolarHBondContact CE-O 3.37Å; K329-G354 PolarHBondContact NZ-O 3.37Å; K329-N355 CarbonylContact C-O 3.42Å; K329-N355 WeakPolarHBondContact CA-O 3.26Å; K329-I356 PolarHBondContact NZ-O 3.18Å
330	L	91.8	Very high	88.5	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.063	32%	0.323	C	S	.	.			trans	-96.1	-22.9	-175.5	-58.3	179.7	0	0	0	112.7	I235 F306 A320 P328 N355	I235-L330 HydrophobicContact CG2-CD1 3.67Å; F306-L330 HydrophobicContact CD2-CB 4.27Å; F306-L330 HydrophobicContact CE2-CB 3.98Å; F306-L330 HydrophobicContact CE2-CD1 4.35Å; F306-L330 HydrophobicContact CE2-CD2 4.49Å; F306-L330 HydrophobicContact CE2-CG 4.5Å; A320-L330 HydrophobicContact CB-CD1 3.55Å; P328-L330 HydrophobicContact CB-CD2 4.01Å; P328-L330 HydrophobicContact CB-CG 4.26Å; P328-L330 HydrophobicContact CG-CD1 4.32Å; P328-L330 HydrophobicContact CG-CD2 4.25Å; P328-L330 HydrophobicContact CG-CG 4.19Å; P328-L330 PolarHBondContact O-N 2.52Å; P328-L330 VanDerWaalsContact O-N 3.17Å; L330-N355 PolarHBondContact N-O 3.45Å
331	I	95.2	Very high	88.8	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-121.3	107.5	-178.4	-53.7	-63	0	0	0	109.3	I235 F306 L316 M335 V336 N355 I356 E357	I235-I331 HydrophobicContact CD1-CD1 3.75Å; I235-I331 HydrophobicContact CD1-CG1 4.14Å; F306-I331 HydrophobicContact CB-CD1 4Å; F306-I331 HydrophobicContact CD2-CD1 4.2Å; F306-I331 HydrophobicContact CG-CD1 4.23Å; L316-I331 HydrophobicContact CD1-CD1 3.61Å; L316-I331 HydrophobicContact CD1-CG1 3.87Å; L316-I331 HydrophobicContact CD2-CG1 4.19Å; I331-M335 HydrophobicContact CD1-SD 4.41Å; I331-M335 HydrophobicContact CG2-CB 4.04Å; I331-M335 HydrophobicContact CG2-SD 4.47Å; I331-V336 HydrophobicContact CG2-CG2 3.64Å; I331-N355 PolarHBondContact N-O 2.98Å; I331-I356 HydrophobicContact CB-CB 4.36Å; I331-I356 HydrophobicContact CB-CG1 4.13Å; I331-I356 HydrophobicContact CB-CG2 4.1Å; I331-I356 HydrophobicContact CG1-CG1 4.41Å; I331-I356 HydrophobicContact CG2-CG2 4.04Å; I331-E357 PolarHBondContact O-N 3.37Å
332	S	94.7	Very high	89.2	Confident	31 Å²	31	59.1 Å²	59.1	22%	0.217	33%	0.33	C	S	.	.			trans	-74.3	157.7	177.7	67.4	0	0	0	0	112.1	K334 M335 V336 E357	S332-K334 PolarHBondContact O-N 3.27Å; S332-M335 PolarHBondContact N-SD 3.01Å; S332-M335 VanDerWaalsContact N-SD 3.38Å; S332-M335 WeakPolarHBondContact O-CB 3.35Å; S332-M335 PolarHBondContact O-N 3.18Å; S332-M335 VanDerWaalsContact OG-CG 3.27Å; S332-M335 WeakPolarHBondContact OG-CG 3.41Å; S332-M335 PolarHBondContact OG-N 3.38Å; S332-M335 PolarHBondContact OG-SD 3.38Å; S332-V336 PolarHBondContact O-N 2.91Å; S332-E357 WeakPolarHBondContact CA-OE2 3.4Å
333	K	94.2	Very high	90.3	Very high	109 Å²	109	56.8 Å²	56.8	47%	0.474	32%	0.318	S	S	.	.	H	α-helix	trans	-51.8	-41.3	174	179.3	175.1	171.5	-179.2	0	112.4	M335 V336 E337 E357 T358	K333-M335 VanDerWaalsContact C-N 3.31Å; K333-M335 PolarHBondContact O-N 2.89Å; K333-V336 PolarHBondContact O-N 3.33Å; K333-E337 WeakPolarHBondContact CE-OE1 3.36Å; K333-E337 HydrophobicContact CG-CG 4.41Å; K333-E337 IonicContact NZ-OE1 2.69Å; K333-E337 WeakPolarHBondContact O-CB 3.36Å; K333-E337 WeakPolarHBondContact O-CG 3.27Å; K333-E337 PolarHBondContact O-N 3.04Å; K333-E357 PolarHBondContact N-OE2 3.13Å; K333-T358 HydrophobicContact CB-CG2 4.01Å; K333-T358 HydrophobicContact CD-CG2 4.46Å; K333-T358 HydrophobicContact CG-CG2 3.95Å
334	K	93.8	Very high	91.7	Very high	171 Å²	171	53.3 Å²	53.3	74%	0.743	30%	0.296	S	S	*	.	H	α-helix	trans	-63.2	-34	178.3	-173.1	178.7	179.5	-178.8	0	112.9	S332 S338	S332-K334 PolarHBondContact O-N 3.27Å; K334-S338 PolarHBondContact O-N 2.81Å
335	M	95.2	Very high	93	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.069	26%	0.264	C	S	.	.	H	α-helix	trans	-69.6	-44.8	176.3	-68	161.5	177.2	0	0	110.9	M303 A307 C310 I331 S332 K333 E337 S338 M339	M303-M335 HydrophobicContact CB-CE 4.07Å; M303-M335 HydrophobicContact CE-CE 3.57Å; M303-M335 HydrophobicContact CE-SD 4.28Å; M303-M335 WeakPolarHBondContact O-CE 3.44Å; M303-M335 HydrophobicContact SD-CE 4.05Å; A307-M335 HydrophobicContact CB-CE 3.98Å; A307-M335 HydrophobicContact CB-CG 4.16Å; C310-M335 HydrophobicContact CB-CB 4.39Å; I331-M335 HydrophobicContact CD1-SD 4.41Å; I331-M335 HydrophobicContact CG2-CB 4.04Å; I331-M335 HydrophobicContact CG2-SD 4.47Å; S332-M335 PolarHBondContact N-SD 3.01Å; S332-M335 VanDerWaalsContact N-SD 3.38Å; S332-M335 WeakPolarHBondContact O-CB 3.35Å; S332-M335 PolarHBondContact O-N 3.18Å; S332-M335 VanDerWaalsContact OG-CG 3.27Å; S332-M335 WeakPolarHBondContact OG-CG 3.41Å; S332-M335 PolarHBondContact OG-N 3.38Å; S332-M335 PolarHBondContact OG-SD 3.38Å; K333-M335 VanDerWaalsContact C-N 3.31Å; K333-M335 PolarHBondContact O-N 2.89Å; M335-E337 VanDerWaalsContact C-N 3.33Å; M335-E337 PolarHBondContact O-N 2.82Å; M335-S338 WeakPolarHBondContact O-CB 3.48Å; M335-S338 PolarHBondContact O-N 2.84Å; M335-S338 VanDerWaalsContact O-N 3.11Å; M335-S338 PolarHBondContact O-OG 2.79Å; M335-M339 PolarHBondContact O-N 2.99Å
336	V	94.5	Very high	93.9	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-42.8	175.6	-178	0	0	0	0	111.2	I331 S332 K333 S338 M339 I356 N369 V371	I331-V336 HydrophobicContact CG2-CG2 3.64Å; S332-V336 PolarHBondContact O-N 2.91Å; K333-V336 PolarHBondContact O-N 3.33Å; V336-S338 PolarHBondContact O-N 3.35Å; V336-M339 WeakPolarHBondContact O-CB 3.47Å; V336-M339 PolarHBondContact O-N 2.84Å; V336-M339 VanDerWaalsContact O-N 3.13Å; V336-I356 HydrophobicContact CG2-CG2 3.69Å; V336-N369 PolarHBondContact O-ND2 3.07Å; V336-V371 HydrophobicContact CG1-CB 4.2Å; V336-V371 HydrophobicContact CG1-CG1 3.93Å
337	E	94	Very high	94.5	Very high	104 Å²	104	40.2 Å²	40.2	49%	0.486	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-22.5	176.6	-75.6	174.8	170.6	0	0	113.2	K333 M335 N369	K333-E337 WeakPolarHBondContact CE-OE1 3.36Å; K333-E337 HydrophobicContact CG-CG 4.41Å; K333-E337 IonicContact NZ-OE1 2.69Å; K333-E337 WeakPolarHBondContact O-CB 3.36Å; K333-E337 WeakPolarHBondContact O-CG 3.27Å; K333-E337 PolarHBondContact O-N 3.04Å; M335-E337 VanDerWaalsContact C-N 3.33Å; M335-E337 PolarHBondContact O-N 2.82Å; E337-N369 VanDerWaalsContact CA-ND2 3.32Å; E337-N369 WeakPolarHBondContact CA-ND2 3.19Å
338	S	95	Very high	94.9	Very high	46 Å²	46	41.4 Å²	41.4	32%	0.322	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.2	177.6	77.9	0	0	0	0	114.9	K334 M335 V336	K334-S338 PolarHBondContact O-N 2.81Å; M335-S338 WeakPolarHBondContact O-CB 3.48Å; M335-S338 PolarHBondContact O-N 2.84Å; M335-S338 VanDerWaalsContact O-N 3.11Å; M335-S338 PolarHBondContact O-OG 2.79Å; V336-S338 PolarHBondContact O-N 3.35Å
339	M	96	Very high	95.1	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.034	20%	0.201	C	C	.	.	S	Bend	trans	-71.9	159.8	176.5	-59.7	-173.2	76.2	0	0	111.2	C310 I313 L316 M335 V336 V345 V371	C310-M339 HydrophobicContact CB-CG 4.18Å; C310-M339 WeakPolarHBondContact O-CG 3.13Å; I313-M339 HydrophobicContact CD1-CE 4.28Å; I313-M339 HydrophobicContact CG1-CE 3.98Å; L316-M339 HydrophobicContact CB-CE 4.36Å; M335-M339 PolarHBondContact O-N 2.99Å; V336-M339 WeakPolarHBondContact O-CB 3.47Å; V336-M339 PolarHBondContact O-N 2.84Å; V336-M339 VanDerWaalsContact O-N 3.13Å; M339-V345 HydrophobicContact CE-CG1 4.15Å; M339-V345 HydrophobicContact SD-CG1 3.56Å; M339-V345 VanDerWaalsContact SD-CG1 3.56Å; M339-V371 HydrophobicContact CB-CG2 4.07Å; M339-V371 HydrophobicContact SD-CG1 4.48Å
340	K	94.5	Very high	95.2	Very high	74 Å²	74	34.4 Å²	34.4	32%	0.322	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-67.1	145.9	177.7	-58.7	174.1	-157.6	148.8	0	110.7	E312 D314 G342 S343	E312-K340 WeakPolarHBondContact O-CE 3.17Å; E312-K340 PolarHBondContact O-NZ 3.31Å; D314-K340 IonicContact OD1-NZ 2.67Å; D314-K340 PolarHBondContact OD1-NZ 2.85Å; K340-G342 PolarHBondContact O-N 3.46Å; K340-S343 PolarHBondContact N-OG 3.04Å; K340-S343 VanDerWaalsContact O-CB 3.23Å; K340-S343 WeakPolarHBondContact O-CB 3.44Å; K340-S343 PolarHBondContact O-N 2.88Å; K340-S343 VanDerWaalsContact O-N 3.08Å; K340-S343 PolarHBondContact O-OG 2.98Å
341	P	94.8	Very high	95	Very high	91 Å²	91	40 Å²	40	59%	0.591	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	136.7	167.9	-27.1	36.2	0	0	0	111.8	S343 D370	P341-S343 VanDerWaalsContact C-N 3.34Å; P341-D370 HydrophobicContact CB-CB 4.09Å
342	G	94.5	Very high	94.6	Very high	21 Å²	21	41.6 Å²	41.6	22%	0.216	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	1.6	-174.3	0	0	0	0	0	115.2	F213 K340 D370	F213-G342 VanDerWaalsContact CD2-O 3.3Å; F213-G342 WeakPolarHBondContact CD2-O 3.47Å; K340-G342 PolarHBondContact O-N 3.46Å; G342-D370 WeakPolarHBondContact CA-O 3.28Å; G342-D370 PolarHBondContact N-O 3.4Å; G342-D370 PolarHBondContact N-OD2 2.81Å
343	S	97.4	Very high	94.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	23%	0.227	C	C	.	.			trans	-65.2	154.9	174.9	-59.2	0	0	0	0	111.4	D314 K340 P341 V371 I372	D314-S343 CarbonylContact O-C 3.48Å; D314-S343 WeakPolarHBondContact O-CA 3.32Å; D314-S343 WeakPolarHBondContact O-CB 3.06Å; K340-S343 PolarHBondContact N-OG 3.04Å; K340-S343 VanDerWaalsContact O-CB 3.23Å; K340-S343 WeakPolarHBondContact O-CB 3.44Å; K340-S343 PolarHBondContact O-N 2.88Å; K340-S343 VanDerWaalsContact O-N 3.08Å; K340-S343 PolarHBondContact O-OG 2.98Å; P341-S343 VanDerWaalsContact C-N 3.34Å; S343-V371 WeakPolarHBondContact O-CA 3.27Å; S343-I372 PolarHBondContact O-N 3.38Å
344	V	97.9	Very high	94.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.4	179.4	-172.5	0	0	0	0	110.8	A209 F213 D314 I315 L316 V346 I372 I374	A209-V344 HydrophobicContact CB-CG1 4.29Å; F213-V344 HydrophobicContact CB-CG2 3.81Å; F213-V344 HydrophobicContact CD2-CG2 4.09Å; F213-V344 HydrophobicContact CG-CG2 4.42Å; D314-V344 PolarHBondContact O-N 3.2Å; I315-V344 CarbonylContact C-O 3.54Å; I315-V344 VanDerWaalsContact CA-O 3.23Å; I315-V344 WeakPolarHBondContact CA-O 3.34Å; I315-V344 HydrophobicContact CG1-CB 4.28Å; L316-V344 PolarHBondContact N-O 3.4Å; V344-V346 HydrophobicContact CG1-CG2 4.03Å; V344-I372 WeakPolarHBondContact CA-O 3.49Å; V344-I372 HydrophobicContact CG1-CB 4.48Å; V344-I372 HydrophobicContact CG2-CB 4.29Å; V344-I372 HydrophobicContact CG2-CD1 4.33Å; V344-I374 HydrophobicContact CG1-CD1 3.75Å; V344-I374 HydrophobicContact CG1-CG1 4.07Å
345	V	97.6	Very high	94.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.1	172	-57.5	0	0	0	0	109.9	L316 M339 I356 V371 I372 H373 I374	L316-V345 HydrophobicContact CB-CG1 4.17Å; L316-V345 CarbonylContact O-C 3.56Å; L316-V345 WeakPolarHBondContact O-CA 3.46Å; M339-V345 HydrophobicContact CE-CG1 4.15Å; M339-V345 HydrophobicContact SD-CG1 3.56Å; M339-V345 VanDerWaalsContact SD-CG1 3.56Å; V345-I356 HydrophobicContact CB-CD1 3.64Å; V345-I356 HydrophobicContact CG1-CD1 4.47Å; V345-I356 HydrophobicContact CG2-CD1 3.85Å; V345-V371 HydrophobicContact CG1-CG1 3.91Å; V345-V371 HydrophobicContact CG2-CG1 4.26Å; V345-I372 PolarHBondContact N-O 2.88Å; V345-H373 HydrophobicContact CG2-CB 4.1Å; V345-H373 VanDerWaalsContact CG2-CD2 3.47Å; V345-H373 WeakPolarHBondContact CG2-CD2 3.27Å; V345-I374 PolarHBondContact O-N 3.21Å
346	V	97.8	Very high	94.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116	-178.5	-169.3	0	0	0	0	109.2	A205 A209 L316 I317 S318 V344 I374 F379	A205-V346 HydrophobicContact CB-CG1 3.84Å; A209-V346 HydrophobicContact CB-CG2 3.88Å; L316-V346 PolarHBondContact O-N 2.57Å; I317-V346 WeakPolarHBondContact CA-O 3.34Å; I317-V346 HydrophobicContact CG1-CB 4.25Å; I317-V346 HydrophobicContact CG1-CG2 4.44Å; S318-V346 PolarHBondContact N-O 2.95Å; V344-V346 HydrophobicContact CG1-CG2 4.03Å; V346-I374 HydrophobicContact CG1-CB 4.28Å; V346-I374 HydrophobicContact CG1-CG2 4.33Å; V346-I374 HydrophobicContact CG2-CB 4.23Å; V346-I374 HydrophobicContact CG2-CD1 4.16Å; V346-I374 HydrophobicContact CG2-CG1 4.48Å; V346-F379 HydrophobicContact CG1-CE1 3.97Å; V346-F379 HydrophobicContact CG1-CE2 4.48Å; V346-F379 HydrophobicContact CG1-CZ 3.53Å
347	D	97.1	Very high	94.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	95.4	-176.1	-166.5	-12.3	0	0	0	110.7	S318 A349 A350 G354 N355 I356 T359 I374	S318-D347 WeakPolarHBondContact OG-CA 3.48Å; S318-D347 PolarHBondContact OG-OD1 3.42Å; D347-A349 PolarHBondContact O-N 3.02Å; D347-A349 PolarHBondContact OD1-N 3.43Å; D347-A349 VanDerWaalsContact OD1-N 3.1Å; D347-A350 WeakPolarHBondContact O-CB 3.48Å; D347-A350 PolarHBondContact O-N 3.06Å; D347-G354 VanDerWaalsContact OD2-C 3.24Å; D347-G354 WeakPolarHBondContact OD2-CA 3.36Å; D347-N355 VanDerWaalsContact CG-N 3.33Å; D347-N355 PolarHBondContact OD1-N 2.85Å; D347-N355 PolarHBondContact OD2-N 3.03Å; D347-I356 HydrophobicContact CB-CD1 4.15Å; D347-I356 HydrophobicContact CB-CG1 4.3Å; D347-I356 PolarHBondContact OD2-N 2.77Å; D347-I356 VanDerWaalsContact OD2-N 3.12Å; D347-T359 HydrophobicContact CB-CG2 4.09Å; D347-T359 WeakPolarHBondContact CB-OG1 3.42Å; D347-T359 WeakPolarHBondContact OD2-CB 3.46Å; D347-T359 PolarHBondContact OD2-OG1 2.64Å; D347-I374 PolarHBondContact N-O 3.07Å
348	L	95.3	Very high	94.1	Very high	33 Å²	33	29.9 Å²	29.9	17%	0.173	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.4	177.8	-69	-171.1	0	0	0	112.8	A201 A205 A240 I317 S318 T319 F379	A201-L348 HydrophobicContact CB-CD1 4.38Å; A201-L348 HydrophobicContact CB-CD2 4.36Å; A205-L348 HydrophobicContact CB-CD1 4.15Å; A205-L348 HydrophobicContact CB-CD2 3.96Å; A205-L348 HydrophobicContact CB-CG 4.23Å; A240-L348 HydrophobicContact CB-CD1 3.93Å; I317-L348 HydrophobicContact CG2-CD1 4.45Å; S318-L348 WeakPolarHBondContact O-CB 3.19Å; S318-L348 PolarHBondContact O-N 3.24Å; T319-L348 HydrophobicContact CG2-CB 4.44Å; T319-L348 HydrophobicContact CG2-CD1 3.84Å; T319-L348 HydrophobicContact CG2-CG 4.44Å; L348-F379 HydrophobicContact CD2-CD1 4.13Å; L348-F379 HydrophobicContact CD2-CD2 3.4Å; L348-F379 VanDerWaalsContact CD2-CD2 3.4Å; L348-F379 HydrophobicContact CD2-CE1 4.12Å; L348-F379 HydrophobicContact CD2-CE2 3.38Å; L348-F379 HydrophobicContact CD2-CG 3.79Å; L348-F379 HydrophobicContact CD2-CZ 3.77Å
349	A	93.8	Very high	94.1	Very high	2 Å²	2	28.5 Å²	28.5	2%	0.017	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	9.6	178.2	0	0	0	0	0	113	A327 D347 E351 A352 G354 N355	A327-A349 HydrophobicContact CB-CB 3.72Å; D347-A349 PolarHBondContact O-N 3.02Å; D347-A349 PolarHBondContact OD1-N 3.43Å; D347-A349 VanDerWaalsContact OD1-N 3.1Å; A349-E351 PolarHBondContact O-N 2.79Å; A349-E351 VanDerWaalsContact O-N 3.15Å; A349-A352 PolarHBondContact O-N 2.65Å; A349-G354 WeakPolarHBondContact O-CA 3.47Å; A349-G354 PolarHBondContact O-N 3.07Å; A349-N355 VanDerWaalsContact CB-OD1 3.31Å; A349-N355 WeakPolarHBondContact CB-OD1 3.4Å
350	A	93.2	Very high	94	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-54.5	-34.1	-175.7	0	0	0	0	0	113.9	D347 A352 G353 T359 P361 G375 T377	D347-A350 WeakPolarHBondContact O-CB 3.48Å; D347-A350 PolarHBondContact O-N 3.06Å; A350-A352 VanDerWaalsContact C-N 3.27Å; A350-A352 PolarHBondContact O-N 2.98Å; A350-G353 PolarHBondContact O-N 2.93Å; A350-T359 HydrophobicContact CB-CG2 3.85Å; A350-P361 HydrophobicContact CB-CB 4.49Å; A350-P361 WeakPolarHBondContact O-CG 3.41Å; A350-G375 WeakPolarHBondContact CB-O 3.46Å; A350-T377 HydrophobicContact CB-CG2 4.19Å
351	E	88.2	Confident	94	Very high	130 Å²	130	34.6 Å²	34.6	61%	0.607	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-64.4	-30.7	178.5	-172.5	171.4	-156.6	0	0	112.6	R137 A349 T377	R137-E351 IonicContact NH2-OE1 3.61Å; A349-E351 PolarHBondContact O-N 2.79Å; A349-E351 VanDerWaalsContact O-N 3.15Å; E351-T377 HydrophobicContact CB-CG2 4.1Å
352	A	86.5	Confident	93.8	Very high	34 Å²	34	32 Å²	32	28%	0.281	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-100.8	22.3	178.9	0	0	0	0	0	113.1	L321 P326 A327 A349 A350	L321-A352 HydrophobicContact CD1-CB 3.36Å; P326-A352 WeakPolarHBondContact CA-O 3.48Å; A327-A352 HydrophobicContact CB-CB 4.42Å; A327-A352 PolarHBondContact N-O 3.2Å; A349-A352 PolarHBondContact O-N 2.65Å; A350-A352 VanDerWaalsContact C-N 3.27Å; A350-A352 PolarHBondContact O-N 2.98Å
353	G	86.6	Confident	93.7	Very high	38 Å²	38	36 Å²	36	39%	0.392	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.9	-14.8	178.8	0	0	0	0	0	114.9	K329 A350	K329-G353 PolarHBondContact NZ-O 2.96Å; A350-G353 PolarHBondContact O-N 2.93Å
354	G	91.8	Very high	93.6	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.			trans	80.6	145.8	175.2	0	0	0	0	0	115	K329 D347 A349 I356	K329-G354 WeakPolarHBondContact CD-O 3.46Å; K329-G354 WeakPolarHBondContact CE-O 3.37Å; K329-G354 PolarHBondContact NZ-O 3.37Å; D347-G354 VanDerWaalsContact OD2-C 3.24Å; D347-G354 WeakPolarHBondContact OD2-CA 3.36Å; A349-G354 WeakPolarHBondContact O-CA 3.47Å; A349-G354 PolarHBondContact O-N 3.07Å; G354-I356 VanDerWaalsContact C-N 3.35Å
355	N	94.6	Very high	93.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-79	-19.3	175.5	-60.6	128.2	0	0	0	113.9	S318 A320 P328 K329 L330 I331 D347 A349	S318-N355 WeakPolarHBondContact CB-OD1 3.3Å; S318-N355 PolarHBondContact OG-OD1 3.33Å; A320-N355 PolarHBondContact N-OD1 2.85Å; A320-N355 PolarHBondContact O-ND2 3.39Å; A320-N355 PolarHBondContact O-OD1 2.83Å; P328-N355 VanDerWaalsContact O-CA 3.27Å; P328-N355 WeakPolarHBondContact O-CA 3.26Å; P328-N355 PolarHBondContact O-ND2 3.11Å; K329-N355 CarbonylContact C-O 3.42Å; K329-N355 WeakPolarHBondContact CA-O 3.26Å; L330-N355 PolarHBondContact N-O 3.45Å; I331-N355 PolarHBondContact N-O 2.98Å; D347-N355 VanDerWaalsContact CG-N 3.33Å; D347-N355 PolarHBondContact OD1-N 2.85Å; D347-N355 PolarHBondContact OD2-N 3.03Å; A349-N355 VanDerWaalsContact CB-OD1 3.31Å; A349-N355 WeakPolarHBondContact CB-OD1 3.4Å
356	I	95.3	Very high	93.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-101.1	132.5	-177.1	-44.6	179.4	0	0	0	108.5	L316 K329 I331 V336 V345 D347 G354 T358 T359	L316-I356 HydrophobicContact CD2-CD1 4.12Å; K329-I356 PolarHBondContact NZ-O 3.18Å; I331-I356 HydrophobicContact CB-CB 4.36Å; I331-I356 HydrophobicContact CB-CG1 4.13Å; I331-I356 HydrophobicContact CB-CG2 4.1Å; I331-I356 HydrophobicContact CG1-CG1 4.41Å; I331-I356 HydrophobicContact CG2-CG2 4.04Å; V336-I356 HydrophobicContact CG2-CG2 3.69Å; V345-I356 HydrophobicContact CB-CD1 3.64Å; V345-I356 HydrophobicContact CG1-CD1 4.47Å; V345-I356 HydrophobicContact CG2-CD1 3.85Å; D347-I356 HydrophobicContact CB-CD1 4.15Å; D347-I356 HydrophobicContact CB-CG1 4.3Å; D347-I356 PolarHBondContact OD2-N 2.77Å; D347-I356 VanDerWaalsContact OD2-N 3.12Å; G354-I356 VanDerWaalsContact C-N 3.35Å; I356-T358 WeakPolarHBondContact CG2-OG1 3.34Å; I356-T358 PolarHBondContact O-N 2.95Å; I356-T359 WeakPolarHBondContact CB-OG1 3.32Å; I356-T359 PolarHBondContact O-N 3.31Å
357	E	94.2	Very high	93.1	Very high	117 Å²	117	46.4 Å²	46.4	55%	0.547	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-31.5	-177.8	-169.6	179.6	-177.9	0	0	112.3	I331 S332 K333	I331-E357 PolarHBondContact O-N 3.37Å; S332-E357 WeakPolarHBondContact CA-OE2 3.4Å; K333-E357 PolarHBondContact N-OE2 3.13Å
358	T	94.4	Very high	92.7	Very high	31 Å²	31	55 Å²	55	19%	0.19	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	1.1	-178.4	51.9	0	0	0	0	113.5	K333 I356 R360 Y365 H373	K333-T358 HydrophobicContact CB-CG2 4.01Å; K333-T358 HydrophobicContact CD-CG2 4.46Å; K333-T358 HydrophobicContact CG-CG2 3.95Å; I356-T358 WeakPolarHBondContact CG2-OG1 3.34Å; I356-T358 PolarHBondContact O-N 2.95Å; T358-R360 PolarHBondContact O-N 2.65Å; T358-Y365 WeakPolarHBondContact CB-OH 3.33Å; T358-Y365 PolarHBondContact O-OH 3.34Å; T358-H373 PolarHBondContact OG1-CD2 2.91Å; T358-H373 VanDerWaalsContact OG1-CD2 3.31Å; T358-H373 PolarHBondContact OG1-NE2 3.48Å
359	T	94.6	Very high	92.5	Very high	18 Å²	18	55.3 Å²	55.3	11%	0.11	30%	0.303	C	S	.	.			trans	-62	132.3	179.2	-70.6	0	0	0	0	111.7	D347 A350 I356	D347-T359 HydrophobicContact CB-CG2 4.09Å; D347-T359 WeakPolarHBondContact CB-OG1 3.42Å; D347-T359 WeakPolarHBondContact OD2-CB 3.46Å; D347-T359 PolarHBondContact OD2-OG1 2.64Å; A350-T359 HydrophobicContact CB-CG2 3.85Å; I356-T359 WeakPolarHBondContact CB-OG1 3.32Å; I356-T359 PolarHBondContact O-N 3.31Å
360	R	94.8	Very high	92.5	Very high	134 Å²	134	59.2 Å²	59.2	51%	0.506	32%	0.324	S	S	.	.			trans	-107.9	101.4	168.6	-65.4	-179.4	-172.2	175.5	2.7	108.4	T358 G362 Q363 Y365	T358-R360 PolarHBondContact O-N 2.65Å; R360-G362 PolarHBondContact O-N 2.96Å; R360-Q363 HydrophobicContact CB-CB 4.12Å; R360-Q363 PolarHBondContact O-N 2.95Å; R360-Q363 VanDerWaalsContact O-N 3.07Å; R360-Y365 HydrophobicContact CB-CD1 4.13Å; R360-Y365 HydrophobicContact CB-CE1 3.94Å; R360-Y365 HydrophobicContact CG-CD1 4.07Å; R360-Y365 HydrophobicContact CG-CE1 3.61Å
361	P	92.9	Very high	92.6	Very high	74 Å²	74	59.2 Å²	59.2	48%	0.481	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	134	-175.7	-27.4	35.5	0	0	0	112.7	A350 Q363 G375 T377	A350-P361 HydrophobicContact CB-CB 4.49Å; A350-P361 WeakPolarHBondContact O-CG 3.41Å; P361-Q363 VanDerWaalsContact C-N 3.28Å; P361-Q363 PolarHBondContact O-N 3.38Å; P361-G375 CarbonylContact C-O 3.56Å; P361-T377 HydrophobicContact CB-CG2 4.14Å
362	G	91.5	Very high	93.1	Very high	38 Å²	38	54.2 Å²	54.2	39%	0.392	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-6.4	-177.8	0	0	0	0	0	115.2	R360 G375	R360-G362 PolarHBondContact O-N 2.96Å; G362-G375 PolarHBondContact N-O 3.33Å
363	Q	92.9	Very high	93.6	Very high	103 Å²	103	52.7 Å²	52.7	48%	0.481	29%	0.288	S	S	.	.			trans	-114.3	149.9	-173.9	-60.5	-176.7	7	0	0	112.6	R360 P361 G375	R360-Q363 HydrophobicContact CB-CB 4.12Å; R360-Q363 PolarHBondContact O-N 2.95Å; R360-Q363 VanDerWaalsContact O-N 3.07Å; P361-Q363 VanDerWaalsContact C-N 3.28Å; P361-Q363 PolarHBondContact O-N 3.38Å; Q363-G375 PolarHBondContact O-N 2.72Å
364	M	94.6	Very high	94.1	Very high	87 Å²	87	51 Å²	51	43%	0.429	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.6	160.3	178.6	-83.9	-76.5	0	0	108.2	I372 H373 I374 Y376	M364-I372 HydrophobicContact CG-CG2 4.15Å; M364-I372 HydrophobicContact SD-CG2 4.07Å; M364-H373 WeakPolarHBondContact CA-O 3.31Å; M364-H373 WeakPolarHBondContact CG-O 3.37Å; M364-I374 HydrophobicContact CG-CG1 4.13Å; M364-Y376 HydrophobicContact CB-CE1 3.76Å; M364-Y376 VanDerWaalsContact CB-OH 3.28Å; M364-Y376 WeakPolarHBondContact CB-OH 3.4Å
365	Y	96.4	Very high	94.2	Very high	36 Å²	36	51 Å²	51	14%	0.141	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	160.1	-179.5	79.1	-86.1	0	0	0	111.1	T358 R360 H373	T358-Y365 WeakPolarHBondContact CB-OH 3.33Å; T358-Y365 PolarHBondContact O-OH 3.34Å; R360-Y365 HydrophobicContact CB-CD1 4.13Å; R360-Y365 HydrophobicContact CB-CE1 3.94Å; R360-Y365 HydrophobicContact CG-CD1 4.07Å; R360-Y365 HydrophobicContact CG-CE1 3.61Å; Y365-H373 HydrophobicContact CD1-CB 3.84Å; Y365-H373 HydrophobicContact CE1-CB 3.54Å; Y365-H373 AromaticContact CE1-CG 3.85Å; Y365-H373 HydrophobicContact CG-CB 4.47Å; Y365-H373 AromaticContact CZ-CD2 3.93Å; Y365-H373 AromaticContact CZ-CG 3.71Å; Y365-H373 PolarHBondContact N-O 3.46Å; Y365-H373 VanDerWaalsContact N-O 3.09Å; Y365-H373 PolarHBondContact O-N 2.87Å
366	V	95.5	Very high	94.2	Very high	78 Å²	78	52.6 Å²	52.6	47%	0.473	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.9	176.5	-171.3	0	0	0	0	108.7	I372	V366-I372 HydrophobicContact CG2-CG1 4.22Å
367	S	91.6	Very high	94.1	Very high	20 Å²	20	55.4 Å²	55.4	14%	0.14	29%	0.294	C	S	.	.			trans	-76.1	168	176.5	57.1	0	0	0	0	111.8	N369 D370 V371	S367-N369 WeakPolarHBondContact CB-OD1 3.39Å; S367-N369 PolarHBondContact O-N 3.35Å; S367-N369 PolarHBondContact OG-OD1 3.15Å; S367-D370 PolarHBondContact O-N 2.6Å; S367-V371 PolarHBondContact N-O 3.45Å; S367-V371 WeakPolarHBondContact OG-CB 3.49Å; S367-V371 PolarHBondContact OG-N 2.91Å; S367-V371 PolarHBondContact OG-O 3.16Å; S367-V371 VanDerWaalsContact OG-O 3.04Å
368	N	89.1	Confident	94	Very high	180 Å²	180	51.6 Å²	51.6	96%	0.963	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22	-179.5	-64.8	-7.2	0	0	0	113.9
369	N	89.9	Confident	94	Very high	40 Å²	40	50.4 Å²	50.4	21%	0.214	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	18.7	176.5	71	-51.3	0	0	0	113.5	V336 E337 S367 V371	V336-N369 PolarHBondContact O-ND2 3.07Å; E337-N369 VanDerWaalsContact CA-ND2 3.32Å; E337-N369 WeakPolarHBondContact CA-ND2 3.19Å; S367-N369 WeakPolarHBondContact CB-OD1 3.39Å; S367-N369 PolarHBondContact O-N 3.35Å; S367-N369 PolarHBondContact OG-OD1 3.15Å; N369-V371 VanDerWaalsContact C-N 3.32Å; N369-V371 WeakPolarHBondContact ND2-CG2 3.42Å; N369-V371 PolarHBondContact O-N 3.33Å
370	D	93.6	Very high	94	Very high	85 Å²	85	50.5 Å²	50.5	46%	0.455	27%	0.271	S	S	.	.	S	Bend	trans	64.1	31	176.9	-162.2	38.8	0	0	0	114.1	P341 G342 S367	P341-D370 HydrophobicContact CB-CB 4.09Å; G342-D370 WeakPolarHBondContact CA-O 3.28Å; G342-D370 PolarHBondContact N-O 3.4Å; G342-D370 PolarHBondContact N-OD2 2.81Å; S367-D370 PolarHBondContact O-N 2.6Å
371	V	96.2	Very high	94	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-99.1	126.3	172.8	176.1	0	0	0	0	109.5	V336 M339 S343 V345 S367 N369 H373	V336-V371 HydrophobicContact CG1-CB 4.2Å; V336-V371 HydrophobicContact CG1-CG1 3.93Å; M339-V371 HydrophobicContact CB-CG2 4.07Å; M339-V371 HydrophobicContact SD-CG1 4.48Å; S343-V371 WeakPolarHBondContact O-CA 3.27Å; V345-V371 HydrophobicContact CG1-CG1 3.91Å; V345-V371 HydrophobicContact CG2-CG1 4.26Å; S367-V371 PolarHBondContact N-O 3.45Å; S367-V371 WeakPolarHBondContact OG-CB 3.49Å; S367-V371 PolarHBondContact OG-N 2.91Å; S367-V371 PolarHBondContact OG-O 3.16Å; S367-V371 VanDerWaalsContact OG-O 3.04Å; N369-V371 VanDerWaalsContact C-N 3.32Å; N369-V371 WeakPolarHBondContact ND2-CG2 3.42Å; N369-V371 PolarHBondContact O-N 3.33Å; V371-H373 PolarHBondContact O-ND1 3.18Å
372	I	97.4	Very high	94.1	Very high	25 Å²	25	44.7 Å²	44.7	13%	0.128	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.2	-177.3	-53.8	171.4	0	0	0	108.6	S212 S343 V344 V345 M364 V366 I374	S212-I372 WeakPolarHBondContact O-CD1 3.49Å; S343-I372 PolarHBondContact O-N 3.38Å; V344-I372 WeakPolarHBondContact CA-O 3.49Å; V344-I372 HydrophobicContact CG1-CB 4.48Å; V344-I372 HydrophobicContact CG2-CB 4.29Å; V344-I372 HydrophobicContact CG2-CD1 4.33Å; V345-I372 PolarHBondContact N-O 2.88Å; M364-I372 HydrophobicContact CG-CG2 4.15Å; M364-I372 HydrophobicContact SD-CG2 4.07Å; V366-I372 HydrophobicContact CG2-CG1 4.22Å; I372-I374 HydrophobicContact CG2-CG1 4.38Å
373	H	97.2	Very high	94.3	Very high	3 Å²	3	45 Å²	45	1%	0.014	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.1	178.4	-68.4	62.5	0	0	0	109.8	V345 T358 M364 Y365 V371	V345-H373 HydrophobicContact CG2-CB 4.1Å; V345-H373 VanDerWaalsContact CG2-CD2 3.47Å; V345-H373 WeakPolarHBondContact CG2-CD2 3.27Å; T358-H373 PolarHBondContact OG1-CD2 2.91Å; T358-H373 VanDerWaalsContact OG1-CD2 3.31Å; T358-H373 PolarHBondContact OG1-NE2 3.48Å; M364-H373 WeakPolarHBondContact CA-O 3.31Å; M364-H373 WeakPolarHBondContact CG-O 3.37Å; Y365-H373 HydrophobicContact CD1-CB 3.84Å; Y365-H373 HydrophobicContact CE1-CB 3.54Å; Y365-H373 AromaticContact CE1-CG 3.85Å; Y365-H373 HydrophobicContact CG-CB 4.47Å; Y365-H373 AromaticContact CZ-CD2 3.93Å; Y365-H373 AromaticContact CZ-CG 3.71Å; Y365-H373 PolarHBondContact N-O 3.46Å; Y365-H373 VanDerWaalsContact N-O 3.09Å; Y365-H373 PolarHBondContact O-N 2.87Å; V371-H373 PolarHBondContact O-ND1 3.18Å
374	I	97	Very high	94.4	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	99.9	175.3	-52.8	-175	0	0	0	108.2	E208 V344 V345 V346 D347 M364 I372 Y376 F379	E208-I374 HydrophobicContact CB-CD1 4Å; V344-I374 HydrophobicContact CG1-CD1 3.75Å; V344-I374 HydrophobicContact CG1-CG1 4.07Å; V345-I374 PolarHBondContact O-N 3.21Å; V346-I374 HydrophobicContact CG1-CB 4.28Å; V346-I374 HydrophobicContact CG1-CG2 4.33Å; V346-I374 HydrophobicContact CG2-CB 4.23Å; V346-I374 HydrophobicContact CG2-CD1 4.16Å; V346-I374 HydrophobicContact CG2-CG1 4.48Å; D347-I374 PolarHBondContact N-O 3.07Å; M364-I374 HydrophobicContact CG-CG1 4.13Å; I372-I374 HydrophobicContact CG2-CG1 4.38Å; I374-Y376 HydrophobicContact CG2-CD2 3.45Å; I374-Y376 VanDerWaalsContact CG2-CD2 3.45Å; I374-Y376 HydrophobicContact CG2-CE2 3.66Å; I374-Y376 HydrophobicContact CG2-CG 4.09Å; I374-F379 HydrophobicContact CG2-CE1 4.28Å; I374-F379 HydrophobicContact CG2-CZ 3.9Å
375	G	95.1	Very high	94.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.01	21%	0.21	C	C	.	.			trans	-110.2	29.5	-179.4	0	0	0	0	0	113.6	A350 P361 G362 Q363	A350-G375 WeakPolarHBondContact CB-O 3.46Å; P361-G375 CarbonylContact C-O 3.56Å; G362-G375 PolarHBondContact N-O 3.33Å; Q363-G375 PolarHBondContact O-N 2.72Å
376	Y	94.8	Very high	94.4	Very high	32 Å²	32	42.1 Å²	42.1	13%	0.125	22%	0.224	C	C	.	.			trans	-58.8	140	-179.3	-61	-38.7	0	0	0	111.6	M364 I374 F379 R382	M364-Y376 HydrophobicContact CB-CE1 3.76Å; M364-Y376 VanDerWaalsContact CB-OH 3.28Å; M364-Y376 WeakPolarHBondContact CB-OH 3.4Å; I374-Y376 HydrophobicContact CG2-CD2 3.45Å; I374-Y376 VanDerWaalsContact CG2-CD2 3.45Å; I374-Y376 HydrophobicContact CG2-CE2 3.66Å; I374-Y376 HydrophobicContact CG2-CG 4.09Å; Y376-F379 HydrophobicContact CD2-CE1 4.39Å; Y376-F379 HydrophobicContact CD2-CZ 4.42Å; Y376-F379 WeakPolarHBondContact O-CD2 3.4Å; Y376-F379 WeakPolarHBondContact O-CE2 3.46Å; Y376-R382 VanDerWaalsContact CD2-CZ 3.5Å
377	T	92.7	Very high	94.5	Very high	59 Å²	59	38.4 Å²	38.4	36%	0.362	20%	0.201	S	C	.	.	S	Bend	trans	-101.4	1.1	178.2	52.6	0	0	0	0	112.4	A350 E351 P361	A350-T377 HydrophobicContact CB-CG2 4.19Å; E351-T377 HydrophobicContact CB-CG2 4.1Å; P361-T377 HydrophobicContact CB-CG2 4.14Å
378	D	92.9	Very high	94.7	Very high	38 Å²	38	37.4 Å²	37.4	20%	0.203	20%	0.195	C	C	.	.			trans	-124.8	29.9	-170.2	69.5	-27	0	0	0	112.6	P380 S381 R382	D378-P380 VanDerWaalsContact C-N 3.34Å; D378-S381 WeakPolarHBondContact O-CA 3.33Å; D378-S381 WeakPolarHBondContact O-CB 3.39Å; D378-S381 PolarHBondContact O-N 3.32Å; D378-R382 PolarHBondContact O-N 2.94Å; D378-R382 IonicContact OD1-CZ 3.85Å; D378-R382 IonicContact OD1-NE 3.2Å; D378-R382 PolarHBondContact OD1-NE 3.06Å; D378-R382 IonicContact OD1-NH2 3.63Å; D378-R382 PolarHBondContact OD1-NH2 3.4Å; D378-R382 IonicContact OD2-NE 2.65Å; D378-R382 IonicContact OD2-NH2 2.8Å
379	F	94.5	Very high	95	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.026	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-47.4	-46.4	-178	-78.2	-84.3	0	0	0	114.1	A201 K204 A205 E208 V346 L348 I374 Y376 S381 R382	A201-F379 HydrophobicContact CB-CB 4.03Å; K204-F379 HydrophobicContact CB-CD1 4.34Å; K204-F379 HydrophobicContact CG-CD1 4.1Å; A205-F379 HydrophobicContact CB-CE1 4.47Å; E208-F379 HydrophobicContact CB-CE1 4.49Å; E208-F379 HydrophobicContact CG-CE1 4.17Å; V346-F379 HydrophobicContact CG1-CE1 3.97Å; V346-F379 HydrophobicContact CG1-CE2 4.48Å; V346-F379 HydrophobicContact CG1-CZ 3.53Å; L348-F379 HydrophobicContact CD2-CD1 4.13Å; L348-F379 HydrophobicContact CD2-CD2 3.4Å; L348-F379 VanDerWaalsContact CD2-CD2 3.4Å; L348-F379 HydrophobicContact CD2-CE1 4.12Å; L348-F379 HydrophobicContact CD2-CE2 3.38Å; L348-F379 HydrophobicContact CD2-CG 3.79Å; L348-F379 HydrophobicContact CD2-CZ 3.77Å; I374-F379 HydrophobicContact CG2-CE1 4.28Å; I374-F379 HydrophobicContact CG2-CZ 3.9Å; Y376-F379 HydrophobicContact CD2-CE1 4.39Å; Y376-F379 HydrophobicContact CD2-CZ 4.42Å; Y376-F379 WeakPolarHBondContact O-CD2 3.4Å; Y376-F379 WeakPolarHBondContact O-CE2 3.46Å; F379-S381 VanDerWaalsContact C-N 3.29Å; F379-S381 PolarHBondContact O-N 2.83Å; F379-R382 PolarHBondContact O-N 3.06Å
380	P	94.2	Very high	95.2	Very high	20 Å²	20	30.8 Å²	30.8	13%	0.13	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-64.6	-29.7	175.3	-22.8	35.1	0	0	0	114.1	M197 A201 D378 R382 L383 S387	M197-P380 HydrophobicContact CB-CG 4.18Å; M197-P380 HydrophobicContact SD-CB 3.81Å; M197-P380 HydrophobicContact SD-CG 4.33Å; A201-P380 HydrophobicContact CB-CG 4.49Å; D378-P380 VanDerWaalsContact C-N 3.34Å; P380-R382 PolarHBondContact O-N 3.47Å; P380-L383 CarbonylContact O-C 3.6Å; P380-L383 PolarHBondContact O-N 3.11Å; P380-S387 WeakPolarHBondContact O-CB 3.47Å; P380-S387 PolarHBondContact O-OG 2.94Å
381	S	95	Very high	95.4	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.021	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-68.9	-25.2	176.8	-162.2	0	0	0	0	112	G75 Q77 D378 F379 L383 P384	G75-S381 PolarHBondContact O-OG 3.36Å; Q77-S381 WeakPolarHBondContact CB-OG 3.44Å; Q77-S381 PolarHBondContact N-OG 3.38Å; Q77-S381 PolarHBondContact OE1-O 3.42Å; D378-S381 WeakPolarHBondContact O-CA 3.33Å; D378-S381 WeakPolarHBondContact O-CB 3.39Å; D378-S381 PolarHBondContact O-N 3.32Å; F379-S381 VanDerWaalsContact C-N 3.29Å; F379-S381 PolarHBondContact O-N 2.83Å; S381-L383 PolarHBondContact O-N 3.19Å; S381-P384 WeakPolarHBondContact O-CB 3.48Å; S381-P384 VanDerWaalsContact O-CD 3.29Å; S381-P384 WeakPolarHBondContact O-CD 3.47Å
382	R	94.4	Very high	95.4	Very high	82 Å²	82	26.8 Å²	26.8	31%	0.309	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-80.1	-3.5	176.2	-62.1	173.1	176.6	-94.4	-11.2	113.9	K204 Y376 D378 F379 P380 P384	K204-R382 VanDerWaalsContact CE-CB 3.45Å; K204-R382 WeakPolarHBondContact CE-O 3.33Å; K204-R382 HydrophobicContact CG-CB 4.38Å; Y376-R382 VanDerWaalsContact CD2-CZ 3.5Å; D378-R382 PolarHBondContact O-N 2.94Å; D378-R382 IonicContact OD1-CZ 3.85Å; D378-R382 IonicContact OD1-NE 3.2Å; D378-R382 PolarHBondContact OD1-NE 3.06Å; D378-R382 IonicContact OD1-NH2 3.63Å; D378-R382 PolarHBondContact OD1-NH2 3.4Å; D378-R382 IonicContact OD2-NE 2.65Å; D378-R382 IonicContact OD2-NH2 2.8Å; F379-R382 PolarHBondContact O-N 3.06Å; P380-R382 PolarHBondContact O-N 3.47Å; R382-P384 VanDerWaalsContact C-CD 3.49Å
383	L	95	Very high	95.2	Very high	45 Å²	45	28.3 Å²	28.3	24%	0.236	15%	0.147	C	C	.	.	S	Bend	trans	-132.7	58.6	170.7	-150.6	141	0	0	0	109.1	I200 Y203 K204 P380 S381 T385 Q386 S387	I200-L383 HydrophobicContact CG2-CB 4.09Å; I200-L383 HydrophobicContact CG2-CD2 4.49Å; Y203-L383 HydrophobicContact CD1-CD1 3.87Å; Y203-L383 HydrophobicContact CE1-CD1 3.67Å; K204-L383 HydrophobicContact CD-CD1 4.19Å; P380-L383 CarbonylContact O-C 3.6Å; P380-L383 PolarHBondContact O-N 3.11Å; S381-L383 PolarHBondContact O-N 3.19Å; L383-T385 PolarHBondContact O-N 2.92Å; L383-Q386 HydrophobicContact CD2-CB 3.18Å; L383-Q386 HydrophobicContact CD2-CG 4.11Å; L383-Q386 PolarHBondContact O-N 3.19Å; L383-S387 WeakPolarHBondContact O-CB 3.32Å; L383-S387 PolarHBondContact O-N 2.85Å; L383-S387 VanDerWaalsContact O-N 3.15Å; L383-S387 PolarHBondContact O-OG 3.23Å; L383-S387 VanDerWaalsContact O-OG 3.08Å
384	P	95.5	Very high	95.1	Very high	17 Å²	17	28.6 Å²	28.6	11%	0.11	15%	0.149	C	C	.	.	H	α-helix	trans	-69.8	-31.5	-157.9	28.2	-34.7	0	0	0	113	Q77 R78 A106 S381 R382 S388	Q77-P384 HydrophobicContact CB-CB 3.75Å; Q77-P384 HydrophobicContact CB-CG 4.11Å; Q77-P384 WeakPolarHBondContact O-CB 3.13Å; R78-P384 HydrophobicContact CG-CB 4.31Å; A106-P384 HydrophobicContact CB-CB 4.25Å; S381-P384 WeakPolarHBondContact O-CB 3.48Å; S381-P384 VanDerWaalsContact O-CD 3.29Å; S381-P384 WeakPolarHBondContact O-CD 3.47Å; R382-P384 VanDerWaalsContact C-CD 3.49Å; P384-S388 WeakPolarHBondContact O-CB 3.48Å; P384-S388 PolarHBondContact O-N 2.79Å; P384-S388 PolarHBondContact O-OG 3.4Å
385	T	96.1	Very high	95	Very high	56 Å²	56	28.6 Å²	28.6	34%	0.344	15%	0.149	S	C	.	.	H	α-helix	trans	-64	-49.4	179.8	-47.4	0	0	0	0	112.2	A106 F108 L383 T389	A106-T385 WeakPolarHBondContact O-CB 3.48Å; A106-T385 PolarHBondContact O-OG1 3.26Å; F108-T385 HydrophobicContact CE1-CG2 3.97Å; F108-T385 HydrophobicContact CE2-CG2 4.4Å; F108-T385 HydrophobicContact CZ-CG2 3.66Å; L383-T385 PolarHBondContact O-N 2.92Å; T385-T389 WeakPolarHBondContact O-CB 3.4Å; T385-T389 PolarHBondContact O-N 3.11Å; T385-T389 PolarHBondContact O-OG1 3.41Å
386	Q	95.3	Very high	94.9	Very high	92 Å²	92	29 Å²	29	43%	0.43	15%	0.151	S	C	.	.	H	α-helix	trans	-68.5	-42.4	177.8	-167.4	64.7	30.1	0	0	110.9	I200 L383 S388 T389 L390	I200-Q386 HydrophobicContact CD1-CB 4.37Å; I200-Q386 HydrophobicContact CD1-CG 4.14Å; I200-Q386 HydrophobicContact CG1-CG 4.49Å; L383-Q386 HydrophobicContact CD2-CB 3.18Å; L383-Q386 HydrophobicContact CD2-CG 4.11Å; L383-Q386 PolarHBondContact O-N 3.19Å; Q386-S388 VanDerWaalsContact C-N 3.34Å; Q386-S388 PolarHBondContact O-N 3.22Å; Q386-T389 PolarHBondContact O-N 2.94Å; Q386-L390 HydrophobicContact CG-CG 4.44Å; Q386-L390 PolarHBondContact O-N 2.97Å
387	S	96.2	Very high	94.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-46.8	177.7	-64.6	0	0	0	0	111.7	R78 I200 P380 L383 T389 Y391	R78-S387 VanDerWaalsContact CD-CB 3.4Å; I200-S387 WeakPolarHBondContact CD1-OG 3.21Å; P380-S387 WeakPolarHBondContact O-CB 3.47Å; P380-S387 PolarHBondContact O-OG 2.94Å; L383-S387 WeakPolarHBondContact O-CB 3.32Å; L383-S387 PolarHBondContact O-N 2.85Å; L383-S387 VanDerWaalsContact O-N 3.15Å; L383-S387 PolarHBondContact O-OG 3.23Å; L383-S387 VanDerWaalsContact O-OG 3.08Å; S387-T389 VanDerWaalsContact C-N 3.35Å; S387-T389 PolarHBondContact O-N 3.16Å; S387-Y391 WeakPolarHBondContact O-CB 3.43Å; S387-Y391 PolarHBondContact O-N 2.92Å
388	S	96.7	Very high	94.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.3	-39.9	177.3	-55.7	0	0	0	0	111.5	R78 V79 P384 Q386 A392	R78-S388 WeakPolarHBondContact CA-OG 3.42Å; V79-S388 PolarHBondContact N-OG 3.39Å; V79-S388 WeakPolarHBondContact O-CB 3.39Å; V79-S388 PolarHBondContact O-OG 3.42Å; P384-S388 WeakPolarHBondContact O-CB 3.48Å; P384-S388 PolarHBondContact O-N 2.79Å; P384-S388 PolarHBondContact O-OG 3.4Å; Q386-S388 VanDerWaalsContact C-N 3.34Å; Q386-S388 PolarHBondContact O-N 3.22Å; S388-A392 WeakPolarHBondContact O-CB 3.33Å; S388-A392 PolarHBondContact O-N 3.41Å
389	T	95.2	Very high	94.7	Very high	39 Å²	39	27.7 Å²	27.7	24%	0.239	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-48	178.9	-57.6	0	0	0	0	112.3	T385 Q386 S387 N393	T385-T389 WeakPolarHBondContact O-CB 3.4Å; T385-T389 PolarHBondContact O-N 3.11Å; T385-T389 PolarHBondContact O-OG1 3.41Å; Q386-T389 PolarHBondContact O-N 2.94Å; S387-T389 VanDerWaalsContact C-N 3.35Å; S387-T389 PolarHBondContact O-N 3.16Å; T389-N393 PolarHBondContact O-N 2.71Å; T389-N393 PolarHBondContact O-ND2 3.46Å
390	L	94.7	Very high	94.4	Very high	41 Å²	41	29.8 Å²	29.8	22%	0.215	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-43.2	177.8	-65.7	-169.1	0	0	0	111.4	I200 Q386 A392 N393 N394	I200-L390 HydrophobicContact CD1-CD1 3.91Å; I200-L390 HydrophobicContact CD1-CG 4.48Å; I200-L390 HydrophobicContact CG1-CD1 4.21Å; Q386-L390 HydrophobicContact CG-CG 4.44Å; Q386-L390 PolarHBondContact O-N 2.97Å; L390-A392 PolarHBondContact O-N 3.43Å; L390-N393 WeakPolarHBondContact O-CB 3.35Å; L390-N393 PolarHBondContact O-N 2.89Å; L390-N394 PolarHBondContact O-N 2.93Å; L390-N394 PolarHBondContact O-ND2 3.32Å; L390-N394 VanDerWaalsContact O-ND2 3.11Å
391	Y	96.8	Very high	94.2	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-41.8	177.8	-171.5	-114.8	0	0	0	112.2	A80 K135 V136 F156 M179 A193 S387 N393 N394 I395	A80-Y391 HydrophobicContact CB-CE1 4.36Å; K135-Y391 PolarHBondContact O-OH 2.99Å; V136-Y391 HydrophobicContact CB-CE1 4.1Å; V136-Y391 HydrophobicContact CG1-CE1 4.2Å; V136-Y391 HydrophobicContact CG2-CD1 4.08Å; V136-Y391 HydrophobicContact CG2-CE1 3.9Å; V136-Y391 PolarHBondContact O-OH 2.82Å; F156-Y391 HydrophobicContact CD2-CE2 4.13Å; F156-Y391 HydrophobicContact CE2-CD2 4.14Å; F156-Y391 AromaticContact CE2-CE2 3.47Å; F156-Y391 HydrophobicContact CE2-CE2 3.47Å; F156-Y391 VanDerWaalsContact CE2-CE2 3.47Å; F156-Y391 HydrophobicContact CZ-CD2 4.41Å; F156-Y391 AromaticContact CZ-CE2 3.81Å; F156-Y391 HydrophobicContact CZ-CE2 3.81Å; M179-Y391 HydrophobicContact CB-CE2 4.43Å; M179-Y391 HydrophobicContact CG-CE2 4.32Å; A193-Y391 HydrophobicContact CB-CD2 3.88Å; A193-Y391 HydrophobicContact CB-CE2 3.8Å; S387-Y391 WeakPolarHBondContact O-CB 3.43Å; S387-Y391 PolarHBondContact O-N 2.92Å; Y391-N393 PolarHBondContact O-N 3.16Å; Y391-N394 WeakPolarHBondContact O-CB 3.23Å; Y391-N394 PolarHBondContact O-N 3.12Å; Y391-I395 HydrophobicContact CD1-CD1 3.68Å; Y391-I395 HydrophobicContact CD1-CG1 4.47Å; Y391-I395 HydrophobicContact CE1-CD1 3.1Å; Y391-I395 HydrophobicContact CE1-CG1 4.11Å; Y391-I395 HydrophobicContact CE2-CD1 4.09Å; Y391-I395 HydrophobicContact CE2-CG1 4.3Å; Y391-I395 HydrophobicContact CG-CD1 4.37Å; Y391-I395 PolarHBondContact O-N 2.96Å
392	A	96.1	Very high	93.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-42.2	173.2	0	0	0	0	0	112.2	A80 L81 V85 S388 L390 N394 S396	A80-A392 WeakPolarHBondContact O-CA 3.45Å; L81-A392 HydrophobicContact CD1-CB 4.38Å; V85-A392 HydrophobicContact CB-CB 3.97Å; V85-A392 HydrophobicContact CG1-CB 4.19Å; V85-A392 HydrophobicContact CG2-CB 3.8Å; S388-A392 WeakPolarHBondContact O-CB 3.33Å; S388-A392 PolarHBondContact O-N 3.41Å; L390-A392 PolarHBondContact O-N 3.43Å; A392-N394 VanDerWaalsContact C-N 3.33Å; A392-N394 PolarHBondContact O-N 3.01Å; A392-S396 VanDerWaalsContact O-CB 3.28Å; A392-S396 WeakPolarHBondContact O-CB 3.46Å; A392-S396 PolarHBondContact O-N 2.83Å; A392-S396 PolarHBondContact O-OG 3.36Å
393	N	94	Very high	93	Very high	57 Å²	57	28.2 Å²	28.2	31%	0.305	16%	0.156	S	C	.	.	H	α-helix	trans	-61.2	-41.1	173.9	-79.1	-36.3	0	0	0	112	V85 T389 L390 Y391 S396 K397	V85-N393 VanDerWaalsContact CG2-OD1 3.29Å; V85-N393 WeakPolarHBondContact CG2-OD1 3.47Å; T389-N393 PolarHBondContact O-N 2.71Å; T389-N393 PolarHBondContact O-ND2 3.46Å; L390-N393 WeakPolarHBondContact O-CB 3.35Å; L390-N393 PolarHBondContact O-N 2.89Å; Y391-N393 PolarHBondContact O-N 3.16Å; N393-S396 WeakPolarHBondContact CA-OG 3.17Å; N393-S396 PolarHBondContact O-OG 3.06Å; N393-S396 VanDerWaalsContact O-OG 3.06Å; N393-K397 WeakPolarHBondContact O-CB 3.18Å; N393-K397 VanDerWaalsContact O-CG 3.26Å; N393-K397 WeakPolarHBondContact O-CG 3.21Å; N393-K397 PolarHBondContact O-N 3.47Å
394	N	94.9	Very high	91.9	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.053	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-52.3	178.1	-63.4	-31.5	0	0	0	111.4	M179 V190 F191 A193 S196 L390 Y391 A392 S396 K397 F398	M179-N394 HydrophobicContact CE-CB 4.26Å; V190-N394 PolarHBondContact O-OD1 3.41Å; F191-N394 HydrophobicContact CB-CB 4.39Å; F191-N394 VanDerWaalsContact CB-O 3.23Å; F191-N394 WeakPolarHBondContact CB-O 3.41Å; A193-N394 HydrophobicContact CB-CB 4.49Å; S196-N394 VanDerWaalsContact CB-ND2 3.31Å; S196-N394 WeakPolarHBondContact CB-ND2 2.89Å; S196-N394 PolarHBondContact OG-ND2 3.24Å; L390-N394 PolarHBondContact O-N 2.93Å; L390-N394 PolarHBondContact O-ND2 3.32Å; L390-N394 VanDerWaalsContact O-ND2 3.11Å; Y391-N394 WeakPolarHBondContact O-CB 3.23Å; Y391-N394 PolarHBondContact O-N 3.12Å; A392-N394 VanDerWaalsContact C-N 3.33Å; A392-N394 PolarHBondContact O-N 3.01Å; N394-S396 VanDerWaalsContact C-N 3.35Å; N394-S396 PolarHBondContact O-N 3.24Å; N394-K397 PolarHBondContact O-N 3.4Å; N394-F398 WeakPolarHBondContact O-CB 3.32Å; N394-F398 PolarHBondContact O-N 2.95Å
395	I	94.1	Very high	90.9	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-45.5	179.2	-72.8	176.8	0	0	0	110.9	A80 L134 I154 M179 Y391 F398 L399	A80-I395 HydrophobicContact CB-CD1 4.5Å; L134-I395 HydrophobicContact CD1-CG2 3.85Å; L134-I395 HydrophobicContact CD2-CG2 3.67Å; L134-I395 HydrophobicContact CG-CG2 4.23Å; I154-I395 HydrophobicContact CG2-CG1 4.39Å; I154-I395 HydrophobicContact CG2-CG2 4.36Å; M179-I395 HydrophobicContact CE-CG1 4.11Å; M179-I395 HydrophobicContact CG-CG1 4.3Å; M179-I395 HydrophobicContact SD-CG1 4.1Å; Y391-I395 HydrophobicContact CD1-CD1 3.68Å; Y391-I395 HydrophobicContact CD1-CG1 4.47Å; Y391-I395 HydrophobicContact CE1-CD1 3.1Å; Y391-I395 HydrophobicContact CE1-CG1 4.11Å; Y391-I395 HydrophobicContact CE2-CD1 4.09Å; Y391-I395 HydrophobicContact CE2-CG1 4.3Å; Y391-I395 HydrophobicContact CG-CD1 4.37Å; Y391-I395 PolarHBondContact O-N 2.96Å; I395-F398 PolarHBondContact O-N 2.85Å; I395-L399 VanDerWaalsContact O-CB 3.23Å; I395-L399 WeakPolarHBondContact O-CB 3.3Å; I395-L399 PolarHBondContact O-N 3.28Å
396	S	92.6	Very high	90.2	Very high	8 Å²	8	36.9 Å²	36.9	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-41.4	-177.8	57.4	0	0	0	0	112.5	V85 A392 N393 N394 L399 L400	V85-S396 VanDerWaalsContact CG1-OG 3.28Å; V85-S396 WeakPolarHBondContact CG1-OG 3.35Å; A392-S396 VanDerWaalsContact O-CB 3.28Å; A392-S396 WeakPolarHBondContact O-CB 3.46Å; A392-S396 PolarHBondContact O-N 2.83Å; A392-S396 PolarHBondContact O-OG 3.36Å; N393-S396 WeakPolarHBondContact CA-OG 3.17Å; N393-S396 PolarHBondContact O-OG 3.06Å; N393-S396 VanDerWaalsContact O-OG 3.06Å; N394-S396 VanDerWaalsContact C-N 3.35Å; N394-S396 PolarHBondContact O-N 3.24Å; S396-L399 PolarHBondContact O-N 2.92Å; S396-L400 WeakPolarHBondContact O-CB 3.48Å; S396-L400 VanDerWaalsContact O-CG 3.22Å; S396-L400 WeakPolarHBondContact O-CG 3.39Å; S396-L400 PolarHBondContact O-N 2.8Å
397	K	91.6	Very high	89.8	Confident	103 Å²	103	34.2 Å²	34.2	45%	0.448	19%	0.185	S	C	.	.	H	α-helix	trans	-65.4	-41.7	175.3	-73.9	175.9	-179.1	179.3	0	112	V190 F191 N393 N394 L400 S401	V190-K397 HydrophobicContact CB-CD 4.25Å; V190-K397 HydrophobicContact CG2-CD 4.48Å; V190-K397 WeakPolarHBondContact O-CD 3.32Å; F191-K397 HydrophobicContact CB-CB 4.28Å; F191-K397 HydrophobicContact CD1-CB 4.38Å; N393-K397 WeakPolarHBondContact O-CB 3.18Å; N393-K397 VanDerWaalsContact O-CG 3.26Å; N393-K397 WeakPolarHBondContact O-CG 3.21Å; N393-K397 PolarHBondContact O-N 3.47Å; N394-K397 PolarHBondContact O-N 3.4Å; K397-L400 PolarHBondContact O-N 3.33Å; K397-S401 WeakPolarHBondContact O-CB 3.23Å; K397-S401 PolarHBondContact O-N 3.01Å; K397-S401 PolarHBondContact O-OG 2.81Å
398	F	93	Very high	89.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-47.3	174.3	176.4	-113.3	0	0	0	111.5	I154 F177 M179 F191 N394 I395 L400 S401 I402 V416 A420	I154-F398 HydrophobicContact CD1-CD1 4.44Å; I154-F398 HydrophobicContact CD1-CE1 4.47Å; I154-F398 HydrophobicContact CG2-CD1 4.31Å; I154-F398 HydrophobicContact CG2-CE1 4.43Å; F177-F398 HydrophobicContact CB-CE1 3.83Å; F177-F398 HydrophobicContact CB-CZ 4.24Å; F177-F398 AromaticContact CD1-CE1 4Å; F177-F398 HydrophobicContact CD1-CE1 4Å; F177-F398 AromaticContact CD1-CZ 3.66Å; F177-F398 HydrophobicContact CD1-CZ 3.66Å; F177-F398 HydrophobicContact CE1-CZ 4.25Å; F177-F398 AromaticContact CG-CE1 3.94Å; F177-F398 HydrophobicContact CG-CE1 3.94Å; F177-F398 HydrophobicContact CG-CZ 4.1Å; M179-F398 HydrophobicContact SD-CD1 3.92Å; M179-F398 HydrophobicContact SD-CE1 4.43Å; M179-F398 HydrophobicContact SD-CG 4.47Å; F191-F398 HydrophobicContact CB-CB 3.91Å; F191-F398 HydrophobicContact CD2-CB 4.3Å; F191-F398 HydrophobicContact CD2-CD2 4.12Å; F191-F398 HydrophobicContact CE2-CD2 4.26Å; F191-F398 HydrophobicContact CG-CB 4.01Å; N394-F398 WeakPolarHBondContact O-CB 3.32Å; N394-F398 PolarHBondContact O-N 2.95Å; I395-F398 PolarHBondContact O-N 2.85Å; F398-L400 VanDerWaalsContact C-N 3.29Å; F398-L400 PolarHBondContact O-N 3.5Å; F398-S401 WeakPolarHBondContact CA-OG 3.42Å; F398-S401 PolarHBondContact O-N 3.39Å; F398-S401 PolarHBondContact O-OG 3.38Å; F398-I402 HydrophobicContact CD1-CD1 4.12Å; F398-I402 HydrophobicContact CE1-CD1 3.68Å; F398-I402 HydrophobicContact CE1-CG1 4.24Å; F398-I402 HydrophobicContact CE2-CD1 4.49Å; F398-I402 HydrophobicContact CE2-CG1 4.17Å; F398-I402 HydrophobicContact CZ-CD1 3.86Å; F398-I402 HydrophobicContact CZ-CG1 3.97Å; F398-I402 WeakPolarHBondContact O-CG1 3.31Å; F398-I402 PolarHBondContact O-N 2.98Å; F398-I402 VanDerWaalsContact O-N 3.15Å; F398-V416 HydrophobicContact CD2-CG1 4.06Å; F398-V416 HydrophobicContact CE2-CG1 3.87Å; F398-A420 HydrophobicContact CE1-CB 4.4Å; F398-A420 HydrophobicContact CE2-CB 3.75Å; F398-A420 HydrophobicContact CZ-CB 3.45Å; F398-A420 VanDerWaalsContact CZ-CB 3.45Å
399	L	92.2	Very high	89.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-42.5	177.4	175.5	60.7	0	0	0	111.9	I66 L89 F94 I132 I154 I395 S396 S401 F408	I66-L399 HydrophobicContact CD1-CD2 3.69Å; L89-L399 HydrophobicContact CD2-CD2 4.26Å; F94-L399 HydrophobicContact CE2-CD2 4.3Å; F94-L399 HydrophobicContact CZ-CD1 4.49Å; F94-L399 HydrophobicContact CZ-CD2 4.09Å; F94-L399 HydrophobicContact CZ-CG 4.21Å; I132-L399 HydrophobicContact CD1-CD1 3.92Å; I154-L399 HydrophobicContact CD1-CD1 4.18Å; I395-L399 VanDerWaalsContact O-CB 3.23Å; I395-L399 WeakPolarHBondContact O-CB 3.3Å; I395-L399 PolarHBondContact O-N 3.28Å; S396-L399 PolarHBondContact O-N 2.92Å; L399-S401 VanDerWaalsContact C-N 3.28Å; L399-S401 PolarHBondContact O-N 2.62Å; L399-F408 HydrophobicContact CD1-CD2 3.95Å; L399-F408 HydrophobicContact CD1-CE2 3.68Å
400	L	89.6	Confident	88.9	Confident	50 Å²	50	38.7 Å²	38.7	26%	0.262	20%	0.2	S	C	.	.	H	α-helix	trans	-74.5	-15.4	177.8	-68	173.7	0	0	0	113.5	Y61 L89 K92 F94 S396 K397 F398	Y61-L400 HydrophobicContact CD2-CD2 4.47Å; Y61-L400 HydrophobicContact CE2-CD2 3.72Å; L89-L400 HydrophobicContact CD2-CD1 4.49Å; L89-L400 HydrophobicContact CD2-CG 4.39Å; K92-L400 HydrophobicContact CB-CD2 4.3Å; K92-L400 HydrophobicContact CG-CD1 4.37Å; K92-L400 HydrophobicContact CG-CD2 4.06Å; F94-L400 HydrophobicContact CE2-CD2 4.12Å; S396-L400 WeakPolarHBondContact O-CB 3.48Å; S396-L400 VanDerWaalsContact O-CG 3.22Å; S396-L400 WeakPolarHBondContact O-CG 3.39Å; S396-L400 PolarHBondContact O-N 2.8Å; K397-L400 PolarHBondContact O-N 3.33Å; F398-L400 VanDerWaalsContact C-N 3.29Å; F398-L400 PolarHBondContact O-N 3.5Å
401	S	88.4	Confident	88.5	Confident	47 Å²	47	39.8 Å²	39.8	33%	0.329	21%	0.206	S	C	.	.	H	α-helix	trans	-92.4	-20.8	178	72.4	0	0	0	0	114.3	K397 F398 L399 G403	K397-S401 WeakPolarHBondContact O-CB 3.23Å; K397-S401 PolarHBondContact O-N 3.01Å; K397-S401 PolarHBondContact O-OG 2.81Å; F398-S401 WeakPolarHBondContact CA-OG 3.42Å; F398-S401 PolarHBondContact O-N 3.39Å; F398-S401 PolarHBondContact O-OG 3.38Å; L399-S401 VanDerWaalsContact C-N 3.28Å; L399-S401 PolarHBondContact O-N 2.62Å; S401-G403 VanDerWaalsContact C-N 3.25Å; S401-G403 PolarHBondContact O-N 3.13Å
402	I	86.6	Confident	88.1	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	22%	0.221	C	C	.	.	S	Bend	trans	-59	-37.3	-177	-71.8	164.2	0	0	0	111.7	F177 F398 F408 Y409 I410 T417	F177-I402 HydrophobicContact CD2-CD1 4.43Å; F177-I402 HydrophobicContact CE1-CD1 4.29Å; F177-I402 HydrophobicContact CE2-CD1 4.12Å; F177-I402 HydrophobicContact CZ-CD1 4.04Å; F177-I402 HydrophobicContact CZ-CG2 4.45Å; F398-I402 HydrophobicContact CD1-CD1 4.12Å; F398-I402 HydrophobicContact CE1-CD1 3.68Å; F398-I402 HydrophobicContact CE1-CG1 4.24Å; F398-I402 HydrophobicContact CE2-CD1 4.49Å; F398-I402 HydrophobicContact CE2-CG1 4.17Å; F398-I402 HydrophobicContact CZ-CD1 3.86Å; F398-I402 HydrophobicContact CZ-CG1 3.97Å; F398-I402 WeakPolarHBondContact O-CG1 3.31Å; F398-I402 PolarHBondContact O-N 2.98Å; F398-I402 VanDerWaalsContact O-N 3.15Å; I402-F408 HydrophobicContact CB-CE2 4.35Å; I402-F408 HydrophobicContact CD1-CE2 4.07Å; I402-F408 HydrophobicContact CG2-CE2 4.01Å; I402-F408 HydrophobicContact CG2-CZ 4.34Å; I402-Y409 CarbonylContact C-O 3.49Å; I402-Y409 VanDerWaalsContact C-O 3.32Å; I402-Y409 WeakPolarHBondContact CG2-O 3.47Å; I402-I410 HydrophobicContact CG2-CG1 4.14Å; I402-T417 HydrophobicContact CG2-CG2 4.13Å
403	G	78.8	Confident	87.5	Confident	21 Å²	21	50.7 Å²	50.7	22%	0.216	26%	0.259	C	S	.	.	S	Bend	trans	-116.4	-173.7	-172.9	0	0	0	0	0	115.7	S401 H407 Y409	S401-G403 VanDerWaalsContact C-N 3.25Å; S401-G403 PolarHBondContact O-N 3.13Å; G403-H407 CarbonylContact C-O 3.46Å; G403-H407 WeakPolarHBondContact CA-O 3.47Å; G403-Y409 VanDerWaalsContact CA-O 3.3Å; G403-Y409 WeakPolarHBondContact CA-O 3.48Å
404	A	71.9	Confident	87.1	Confident	45 Å²	45	49.2 Å²	49.2	37%	0.372	25%	0.251	S	S	.	.	S	Bend	trans	-78.4	170.9	174.3	0	0	0	0	0	111.3	D406 H407	A404-D406 PolarHBondContact O-N 3.08Å; A404-H407 PolarHBondContact N-O 3.32Å; A404-H407 PolarHBondContact O-N 3.45Å
405	K	74.1	Confident	86.7	Confident	183 Å²	183	52.2 Å²	52.2	80%	0.796	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	116.9	-179.9	-168.8	177.2	177.6	-178.9	0	111.4	H407	K405-H407 PolarHBondContact O-N 3.2Å; K405-H407 PolarHBondContact O-ND1 3.09Å
406	D	82.2	Confident	86.4	Confident	72 Å²	72	52.2 Å²	52.2	39%	0.385	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	13.4	179.1	-49.2	-42	0	0	0	116.5	Y61 A404	Y61-D406 HydrophobicContact CD2-CB 4.44Å; Y61-D406 VanDerWaalsContact CE2-CA 3.46Å; Y61-D406 PolarHBondContact N-O 3.39Å; A404-D406 PolarHBondContact O-N 3.08Å
407	H	87	Confident	86.3	Confident	36 Å²	36	51.9 Å²	51.9	17%	0.167	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134	-178.7	-67.7	68.9	0	0	0	111.9	P56 I59 G403 A404 K405	P56-H407 VanDerWaalsContact CG-CE1 3.5Å; P56-H407 WeakPolarHBondContact CG-CE1 3.42Å; I59-H407 WeakPolarHBondContact O-CA 3.31Å; G403-H407 CarbonylContact C-O 3.46Å; G403-H407 WeakPolarHBondContact CA-O 3.47Å; A404-H407 PolarHBondContact N-O 3.32Å; A404-H407 PolarHBondContact O-N 3.45Å; K405-H407 PolarHBondContact O-N 3.2Å; K405-H407 PolarHBondContact O-ND1 3.09Å
408	F	89.6	Confident	86.3	Confident	19 Å²	19	49.1 Å²	49.1	8%	0.083	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.5	173.1	-172	-99.7	0	0	0	109.9	G58 I59 Y61 L64 I132 T152 L399 I402 I410	G58-F408 CarbonylContact C-O 3.18Å; G58-F408 WeakPolarHBondContact CA-O 2.94Å; I59-F408 PolarHBondContact N-O 3.32Å; I59-F408 PolarHBondContact O-N 3.19Å; Y61-F408 HydrophobicContact CD1-CB 4.12Å; Y61-F408 HydrophobicContact CE1-CB 3.88Å; Y61-F408 VanDerWaalsContact CE1-N 3.32Å; L64-F408 HydrophobicContact CD1-CB 3.41Å; L64-F408 VanDerWaalsContact CD1-CB 3.41Å; L64-F408 HydrophobicContact CD1-CD1 4.24Å; L64-F408 HydrophobicContact CD1-CG 3.93Å; I132-F408 HydrophobicContact CD1-CD2 4.32Å; I132-F408 HydrophobicContact CD1-CE2 4.21Å; I132-F408 HydrophobicContact CD1-CZ 4.45Å; T152-F408 HydrophobicContact CG2-CZ 4.4Å; L399-F408 HydrophobicContact CD1-CD2 3.95Å; L399-F408 HydrophobicContact CD1-CE2 3.68Å; I402-F408 HydrophobicContact CB-CE2 4.35Å; I402-F408 HydrophobicContact CD1-CE2 4.07Å; I402-F408 HydrophobicContact CG2-CE2 4.01Å; I402-F408 HydrophobicContact CG2-CZ 4.34Å; F408-I410 HydrophobicContact CE1-CD1 4.33Å; F408-I410 HydrophobicContact CE1-CG1 4.1Å; F408-I410 HydrophobicContact CZ-CG1 4.23Å
409	Y	89.2	Confident	86.1	Confident	83 Å²	83	49.4 Å²	49.4	33%	0.325	25%	0.254	S	S	.	.			trans	-145.8	127.7	178.2	174.8	-103.3	0	0	0	108.2	K57 I402 G403 D411	K57-Y409 HydrophobicContact CB-CD1 4.27Å; K57-Y409 HydrophobicContact CB-CD2 3.86Å; K57-Y409 HydrophobicContact CB-CE1 4.47Å; K57-Y409 HydrophobicContact CB-CE2 4.06Å; K57-Y409 HydrophobicContact CB-CG 3.97Å; K57-Y409 HydrophobicContact CD-CE1 4.26Å; K57-Y409 HydrophobicContact CD-CE2 4.34Å; K57-Y409 WeakPolarHBondContact O-CB 3.36Å; I402-Y409 CarbonylContact C-O 3.49Å; I402-Y409 VanDerWaalsContact C-O 3.32Å; I402-Y409 WeakPolarHBondContact CG2-O 3.47Å; G403-Y409 VanDerWaalsContact CA-O 3.3Å; G403-Y409 WeakPolarHBondContact CA-O 3.48Å; Y409-D411 HydrophobicContact CD1-CB 4.03Å; Y409-D411 HydrophobicContact CE1-CB 3.89Å; Y409-D411 PolarHBondContact O-N 3.15Å
410	I	90.1	Very high	86.1	Confident	31 Å²	31	49.4 Å²	49.4	16%	0.159	25%	0.254	C	S	.	.			trans	-85.1	99.1	179.7	-58.2	176.2	0	0	0	108.1	T175 F177 I402 F408 L412 T417 I421	T175-I410 HydrophobicContact CG2-CD1 3.69Å; F177-I410 HydrophobicContact CE2-CD1 4.16Å; F177-I410 HydrophobicContact CZ-CD1 3.9Å; F177-I410 HydrophobicContact CZ-CG1 4.05Å; F177-I410 HydrophobicContact CZ-CG2 4.19Å; I402-I410 HydrophobicContact CG2-CG1 4.14Å; F408-I410 HydrophobicContact CE1-CD1 4.33Å; F408-I410 HydrophobicContact CE1-CG1 4.1Å; F408-I410 HydrophobicContact CZ-CG1 4.23Å; I410-L412 HydrophobicContact CG2-CD2 4.17Å; I410-T417 HydrophobicContact CG2-CG2 3.83Å; I410-I421 HydrophobicContact CG2-CD1 3.98Å
411	D	86.4	Confident	86.4	Confident	63 Å²	63	47 Å²	47	34%	0.337	24%	0.242	S	C	.	.			trans	-85.9	113.7	173.8	-163.7	-3.1	0	0	0	110.7	Y409 E413 D414 T417	Y409-D411 HydrophobicContact CD1-CB 4.03Å; Y409-D411 HydrophobicContact CE1-CB 3.89Å; Y409-D411 PolarHBondContact O-N 3.15Å; D411-E413 VanDerWaalsContact C-N 3.29Å; D411-E413 PolarHBondContact OD1-N 3.37Å; D411-E413 VanDerWaalsContact OD1-N 3.15Å; D411-D414 HydrophobicContact CB-CB 4.39Å; D411-D414 PolarHBondContact O-N 3Å; D411-T417 WeakPolarHBondContact O-CB 3.27Å; D411-T417 WeakPolarHBondContact O-CG2 3.45Å
412	L	87.2	Confident	86.7	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.325	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.8	179.7	-65.7	177.9	0	0	0	113	I410 D414 I421 K424 M429	I410-L412 HydrophobicContact CG2-CD2 4.17Å; L412-D414 VanDerWaalsContact C-N 3.29Å; L412-I421 HydrophobicContact CD2-CG2 4.29Å; L412-K424 HydrophobicContact CD1-CD 4.28Å; L412-M429 HydrophobicContact CD1-CE 4.18Å; L412-M429 HydrophobicContact CD2-CE 4.37Å
413	E	84.9	Confident	87.1	Confident	169 Å²	169	44.7 Å²	44.7	79%	0.79	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.9	172	-60.5	-62.5	139.6	0	0	111.8	D411 D415	D411-E413 VanDerWaalsContact C-N 3.29Å; D411-E413 PolarHBondContact OD1-N 3.37Å; D411-E413 VanDerWaalsContact OD1-N 3.15Å; E413-D415 PolarHBondContact O-N 2.92Å
414	D	85.7	Confident	87.7	Confident	26 Å²	26	46.2 Å²	46.2	14%	0.139	23%	0.226	C	C	.	.	S	Bend	trans	-79.7	113.8	175	175.9	53.9	0	0	0	110.9	R187 D411 L412 V416 T417 R418	R187-D414 IonicContact CZ-OD1 3.06Å; R187-D414 IonicContact NH1-OD1 2.83Å; R187-D414 PolarHBondContact NH1-OD1 2.9Å; R187-D414 IonicContact NH2-OD1 3.98Å; R187-D414 PolarHBondContact NH2-OD1 2.74Å; D411-D414 HydrophobicContact CB-CB 4.39Å; D411-D414 PolarHBondContact O-N 3Å; L412-D414 VanDerWaalsContact C-N 3.29Å; D414-V416 PolarHBondContact O-N 2.85Å; D414-V416 VanDerWaalsContact O-N 3.07Å; D414-V416 WeakPolarHBondContact OD2-CB 3.29Å; D414-T417 PolarHBondContact O-N 3.25Å; D414-T417 VanDerWaalsContact O-N 3.09Å; D414-T417 WeakPolarHBondContact OD2-CB 3.46Å; D414-T417 PolarHBondContact OD2-N 3.01Å; D414-T417 PolarHBondContact OD2-OG1 2.86Å; D414-R418 WeakPolarHBondContact O-CB 3.44Å; D414-R418 PolarHBondContact O-N 3.31Å
415	D	85.4	Confident	88.6	Confident	73 Å²	73	49.8 Å²	49.8	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-54.1	-34.3	-176.7	-43.4	-62	0	0	0	113.8	R187 E413 G419 I435	R187-D415 IonicContact CZ-OD2 3.46Å; R187-D415 VanDerWaalsContact NH2-N 3.11Å; R187-D415 IonicContact NH2-OD2 2.93Å; R187-D415 PolarHBondContact NH2-OD2 2.8Å; E413-D415 PolarHBondContact O-N 2.92Å; D415-G419 WeakPolarHBondContact O-CA 3.5Å; D415-G419 PolarHBondContact O-N 2.8Å; D415-I435 HydrophobicContact CB-CD1 4.15Å
416	V	88.1	Confident	89.3	Confident	2 Å²	2	42 Å²	42	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-68.5	-51.6	179.7	171.3	0	0	0	0	110.1	P183 I185 R187 A188 F191 F398 D414 G419 A420	P183-V416 HydrophobicContact CG-CG2 4.41Å; I185-V416 HydrophobicContact CD1-CG2 3.8Å; I185-V416 HydrophobicContact CG1-CG2 4.41Å; R187-V416 HydrophobicContact CG-CG2 4.24Å; A188-V416 HydrophobicContact CB-CG2 4.01Å; F191-V416 HydrophobicContact CD2-CG1 4.43Å; F191-V416 HydrophobicContact CE2-CB 4.44Å; F191-V416 HydrophobicContact CE2-CG1 3.3Å; F191-V416 HydrophobicContact CE2-CG2 4.3Å; F191-V416 HydrophobicContact CZ-CB 4.26Å; F191-V416 HydrophobicContact CZ-CG1 3.4Å; F191-V416 VanDerWaalsContact CZ-CG1 3.4Å; F191-V416 HydrophobicContact CZ-CG2 3.96Å; F398-V416 HydrophobicContact CD2-CG1 4.06Å; F398-V416 HydrophobicContact CE2-CG1 3.87Å; D414-V416 PolarHBondContact O-N 2.85Å; D414-V416 VanDerWaalsContact O-N 3.07Å; D414-V416 WeakPolarHBondContact OD2-CB 3.29Å; V416-G419 PolarHBondContact O-N 2.84Å; V416-A420 WeakPolarHBondContact O-CB 3.5Å; V416-A420 PolarHBondContact O-N 2.81Å
417	T	90.2	Very high	89.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-43.6	178.8	-59.3	0	0	0	0	110.9	F177 I402 I410 D411 D414 A420 I421	F177-T417 HydrophobicContact CE1-CG2 4Å; F177-T417 HydrophobicContact CZ-CG2 4.46Å; I402-T417 HydrophobicContact CG2-CG2 4.13Å; I410-T417 HydrophobicContact CG2-CG2 3.83Å; D411-T417 WeakPolarHBondContact O-CB 3.27Å; D411-T417 WeakPolarHBondContact O-CG2 3.45Å; D414-T417 PolarHBondContact O-N 3.25Å; D414-T417 VanDerWaalsContact O-N 3.09Å; D414-T417 WeakPolarHBondContact OD2-CB 3.46Å; D414-T417 PolarHBondContact OD2-N 3.01Å; D414-T417 PolarHBondContact OD2-OG1 2.86Å; T417-A420 PolarHBondContact O-N 2.8Å; T417-I421 WeakPolarHBondContact O-CB 3.38Å; T417-I421 WeakPolarHBondContact O-CG2 3.49Å; T417-I421 PolarHBondContact O-N 3.38Å; T417-I421 VanDerWaalsContact O-N 3.12Å
418	R	91.2	Very high	90	Very high	46 Å²	46	48 Å²	48	17%	0.174	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-35.9	176.4	179.4	60.1	-168.3	95.3	-8	113	D414 M429 P433	D414-R418 WeakPolarHBondContact O-CB 3.44Å; D414-R418 PolarHBondContact O-N 3.31Å; R418-M429 VanDerWaalsContact CZ-O 3.26Å; R418-M429 PolarHBondContact NH1-O 3.06Å; R418-M429 PolarHBondContact NH2-O 2.91Å; R418-P433 HydrophobicContact CG-CG 4.41Å; R418-P433 VanDerWaalsContact CZ-CD 3.49Å
419	G	90	Very high	90.1	Very high	6 Å²	6	48.8 Å²	48.8	6%	0.062	24%	0.239	C	C	.	.	H	α-helix	trans	-68.8	-42.2	176.8	0	0	0	0	0	112.6	C181 D415 V416	C181-G419 CarbonylContact O-C 3.44Å; D415-G419 WeakPolarHBondContact O-CA 3.5Å; D415-G419 PolarHBondContact O-N 2.8Å; V416-G419 PolarHBondContact O-N 2.84Å
420	A	92.7	Very high	90.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-79.9	-24.4	-176.1	0	0	0	0	0	114.4	F177 G178 V182 F398 V416 T417 V422	F177-A420 CarbonylContact C-O 3.6Å; F177-A420 WeakPolarHBondContact CA-O 3.08Å; F177-A420 HydrophobicContact CD1-CB 4.21Å; G178-A420 PolarHBondContact N-O 2.82Å; V182-A420 HydrophobicContact CG2-CB 4.15Å; F398-A420 HydrophobicContact CE1-CB 4.4Å; F398-A420 HydrophobicContact CE2-CB 3.75Å; F398-A420 HydrophobicContact CZ-CB 3.45Å; F398-A420 VanDerWaalsContact CZ-CB 3.45Å; V416-A420 WeakPolarHBondContact O-CB 3.5Å; V416-A420 PolarHBondContact O-N 2.81Å; T417-A420 PolarHBondContact O-N 2.8Å; A420-V422 PolarHBondContact O-N 3.46Å
421	I	94.6	Very high	89.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124	-176.8	-162.6	167.7	0	0	0	112.4	T175 F177 I410 L412 T417 L423 K424 M429	T175-I421 HydrophobicContact CG2-CD1 4.23Å; F177-I421 HydrophobicContact CD1-CB 3.83Å; F177-I421 HydrophobicContact CD1-CG1 4.18Å; F177-I421 HydrophobicContact CE1-CB 3.67Å; F177-I421 HydrophobicContact CE1-CD1 4Å; F177-I421 HydrophobicContact CE1-CG1 3.9Å; F177-I421 HydrophobicContact CZ-CD1 4.03Å; F177-I421 HydrophobicContact CZ-CG1 4.3Å; I410-I421 HydrophobicContact CG2-CD1 3.98Å; L412-I421 HydrophobicContact CD2-CG2 4.29Å; T417-I421 WeakPolarHBondContact O-CB 3.38Å; T417-I421 WeakPolarHBondContact O-CG2 3.49Å; T417-I421 PolarHBondContact O-N 3.38Å; T417-I421 VanDerWaalsContact O-N 3.12Å; I421-L423 WeakPolarHBondContact CG1-O 3.31Å; I421-K424 HydrophobicContact CD1-CB 3.83Å; I421-K424 HydrophobicContact CD1-CD 4.5Å; I421-K424 HydrophobicContact CD1-CG 4.24Å; I421-M429 HydrophobicContact CG2-CB 4.03Å; I421-M429 HydrophobicContact CG2-CG 4.44Å
422	V	94.3	Very high	89.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-47.1	177.9	-178.5	0	0	0	0	111.1	P159 V166 V176 A420 M429 W430	P159-V422 HydrophobicContact CB-CG1 3.9Å; P159-V422 HydrophobicContact CG-CG1 4.45Å; P159-V422 HydrophobicContact CG-CG2 4.28Å; V166-V422 HydrophobicContact CG1-CG1 4.12Å; V166-V422 HydrophobicContact CG2-CG1 4.48Å; V176-V422 HydrophobicContact CG1-CB 4.48Å; V176-V422 PolarHBondContact O-N 3.31Å; A420-V422 PolarHBondContact O-N 3.46Å; V422-M429 PolarHBondContact O-N 3.22Å; V422-W430 HydrophobicContact CG1-CB 4.09Å; V422-W430 PolarHBondContact O-N 3.44Å
423	L	95	Very high	89.7	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.5	176.6	-67	169.4	0	0	0	109.9	V166 M169 A170 T175 V176 I421 Q427 M428	V166-L423 HydrophobicContact CG1-CD1 4.1Å; V166-L423 HydrophobicContact CG1-CD2 4.11Å; V166-L423 HydrophobicContact CG1-CG 4.14Å; M169-L423 HydrophobicContact CB-CD1 3.71Å; A170-L423 HydrophobicContact CB-CD1 4.12Å; A170-L423 HydrophobicContact CB-CD2 3.87Å; T175-L423 CarbonylContact C-O 3.46Å; T175-L423 VanDerWaalsContact CA-O 3.27Å; T175-L423 WeakPolarHBondContact CA-O 3.45Å; V176-L423 HydrophobicContact CB-CB 4.06Å; V176-L423 HydrophobicContact CB-CD1 4.39Å; V176-L423 HydrophobicContact CB-CG 4.5Å; V176-L423 HydrophobicContact CG2-CB 4.11Å; V176-L423 HydrophobicContact CG2-CD1 3.87Å; V176-L423 HydrophobicContact CG2-CG 4.44Å; V176-L423 PolarHBondContact N-O 2.86Å; V176-L423 PolarHBondContact O-N 2.85Å; I421-L423 WeakPolarHBondContact CG1-O 3.31Å; L423-Q427 CarbonylContact C-O 3.53Å; L423-Q427 VanDerWaalsContact CA-O 3.28Å; L423-Q427 WeakPolarHBondContact CA-O 3.23Å; L423-M428 HydrophobicContact CD2-SD 3.89Å
424	K	92.7	Very high	89.2	Confident	53 Å²	53	53.4 Å²	53.4	23%	0.23	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111.3	168.2	-175.3	179.2	-179.6	-64.9	0	108.8	L412 I421 G426 Q427 M429	L412-K424 HydrophobicContact CD1-CD 4.28Å; I421-K424 HydrophobicContact CD1-CB 3.83Å; I421-K424 HydrophobicContact CD1-CD 4.5Å; I421-K424 HydrophobicContact CD1-CG 4.24Å; K424-G426 PolarHBondContact O-N 3Å; K424-G426 VanDerWaalsContact O-N 3.11Å; K424-Q427 PolarHBondContact N-O 3.05Å; K424-Q427 WeakPolarHBondContact O-CB 3.37Å; K424-Q427 PolarHBondContact O-N 3.49Å; K424-M429 HydrophobicContact CB-CG 3.82Å; K424-M429 HydrophobicContact CB-SD 4.4Å
425	E	90	Very high	88.4	Confident	121 Å²	121	55.2 Å²	55.2	57%	0.565	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	34.7	-179	-61	160.8	-129.5	0	0	113	L174 T175	L174-E425 PolarHBondContact O-N 3.11Å; T175-E425 PolarHBondContact OG1-N 2.82Å; T175-E425 VanDerWaalsContact OG1-N 3.08Å
426	G	88.7	Confident	87	Confident	20 Å²	20	60.5 Å²	60.5	21%	0.206	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	85	-7.5	-175.6	0	0	0	0	0	116.3	L174 K424	L174-G426 PolarHBondContact O-N 3.01Å; K424-G426 PolarHBondContact O-N 3Å; K424-G426 VanDerWaalsContact O-N 3.11Å
427	Q	92	Very high	85.1	Confident	136 Å²	136	66.9 Å²	66.9	64%	0.636	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.8	173.3	-61.7	-175.5	-3.4	0	0	110.9	L423 K424 M429	L423-Q427 CarbonylContact C-O 3.53Å; L423-Q427 VanDerWaalsContact CA-O 3.28Å; L423-Q427 WeakPolarHBondContact CA-O 3.23Å; K424-Q427 PolarHBondContact N-O 3.05Å; K424-Q427 WeakPolarHBondContact O-CB 3.37Å; K424-Q427 PolarHBondContact O-N 3.49Å; Q427-M429 PolarHBondContact O-N 2.9Å
428	M	92.2	Very high	82.7	Confident	98 Å²	98	72.5 Å²	72.5	48%	0.483	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	119	178.5	-167	65.8	173.1	0	0	110.9	V166 L423 W430	V166-M428 HydrophobicContact CG1-CE 4.04Å; V166-M428 HydrophobicContact CG1-SD 3.73Å; L423-M428 HydrophobicContact CD2-SD 3.89Å; M428-W430 HydrophobicContact CE-CB 3.91Å; M428-W430 HydrophobicContact CE-CD2 4.41Å; M428-W430 HydrophobicContact CE-CE3 3.73Å
429	M	91.5	Very high	80.1	Confident	35 Å²	35	75.3 Å²	75.3	17%	0.172	40%	0.396	C	S	.	.			trans	-109.1	-14.4	179	-61.1	-57.8	-65.5	0	0	112.8	L412 R418 I421 V422 K424 Q427	L412-M429 HydrophobicContact CD1-CE 4.18Å; L412-M429 HydrophobicContact CD2-CE 4.37Å; R418-M429 VanDerWaalsContact CZ-O 3.26Å; R418-M429 PolarHBondContact NH1-O 3.06Å; R418-M429 PolarHBondContact NH2-O 2.91Å; I421-M429 HydrophobicContact CG2-CB 4.03Å; I421-M429 HydrophobicContact CG2-CG 4.44Å; V422-M429 PolarHBondContact O-N 3.22Å; K424-M429 HydrophobicContact CB-CG 3.82Å; K424-M429 HydrophobicContact CB-SD 4.4Å; Q427-M429 PolarHBondContact O-N 2.9Å
430	W	88.7	Confident	77.5	Confident	80 Å²	80	80.1 Å²	80.1	30%	0.303	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-89.3	142.7	176.3	-177.9	95.4	0	0	0	111.2	P159 A160 V422 M428	P159-W430 HydrophobicContact CB-CD2 4.07Å; P159-W430 HydrophobicContact CB-CE3 4.43Å; P159-W430 HydrophobicContact CB-CG 4.24Å; P159-W430 HydrophobicContact CG-CD2 3.88Å; P159-W430 HydrophobicContact CG-CG 3.9Å; P159-W430 HydrophobicContact CG-CZ2 4.27Å; A160-W430 HydrophobicContact CB-CH2 3.74Å; A160-W430 HydrophobicContact CB-CZ2 3.88Å; V422-W430 HydrophobicContact CG1-CB 4.09Å; V422-W430 PolarHBondContact O-N 3.44Å; M428-W430 HydrophobicContact CE-CB 3.91Å; M428-W430 HydrophobicContact CE-CD2 4.41Å; M428-W430 HydrophobicContact CE-CE3 3.73Å
431	P	87.1	Confident	74.8	Confident	89 Å²	89	84.9 Å²	84.9	58%	0.578	46%	0.457	S	S	*	.	S	Bend	cis	-76.7	153.5	-0.3	31.5	-35.1	0	0	0	113.3
432	P	84.9	Confident	71.9	Confident	54 Å²	54	90.8 Å²	90.8	35%	0.351	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-69.2	154.6	175.7	30.3	-34.8	0	0	0	111.6
433	P	83.5	Confident	69	Low	82 Å²	82	95.2 Å²	95.2	53%	0.532	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-60.4	151.7	169.8	27.7	-33.9	0	0	0	110.2	R418 I435	R418-P433 HydrophobicContact CG-CG 4.41Å; R418-P433 VanDerWaalsContact CZ-CD 3.49Å; P433-I435 PolarHBondContact O-N 3.04Å
434	K	75.7	Confident	66.1	Low	200 Å²	200	98.8 Å²	98.8	87%	0.87	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-63.5	120.5	175.4	-167.2	179.8	-177.8	-175	0	108.2	E436	K434-E436 PolarHBondContact O-N 3.04Å
435	I	68.8	Low	63.3	Low	63 Å²	63	101.6 Å²	101.6	32%	0.323	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-65.6	117.6	173.9	-58.8	171.8	0	0	0	106.5	P183 D415 P433 E437	P183-I435 HydrophobicContact CB-CD1 3.71Å; P183-I435 HydrophobicContact CG-CD1 4.23Å; D415-I435 HydrophobicContact CB-CD1 4.15Å; P433-I435 PolarHBondContact O-N 3.04Å; I435-E437 VanDerWaalsContact C-N 3.26Å; I435-E437 PolarHBondContact O-N 3.32Å
436	E	55.1	Low	60.7	Low	185 Å²	185	104.6 Å²	104.6	86%	0.864	60%	0.596	S	S	*	*			trans	-69.2	92.7	167.6	-69.8	-172.2	176.1	0	0	106.8	K434	K434-E436 PolarHBondContact O-N 3.04Å
437	E	49.4	Very low	58.3	Low	136 Å²	136	109.4 Å²	109.4	64%	0.636	62%	0.624	S	S	*	*			trans	-55.3	125.5	166.4	-71	-177.9	-176.4	0	0	106.5	I435 S439	I435-E437 VanDerWaalsContact C-N 3.26Å; I435-E437 PolarHBondContact O-N 3.32Å; E437-S439 PolarHBondContact O-N 3.07Å
438	P	39.6	Very low	55.6	Low	118 Å²	118	107.8 Å²	107.8	77%	0.766	62%	0.623	S	S	*	*			trans	-52.1	123.6	170.1	20.9	-29.3	0	0	0	105.8	P440	P438-P440 VanDerWaalsContact O-N 3.11Å
439	S	35.4	Very low	52.8	Low	105 Å²	105	107.2 Å²	107.2	73%	0.734	63%	0.634	S	S	*	*			trans	-43.2	127.9	-179.7	-51.1	0	0	0	0	107	E437	E437-S439 PolarHBondContact O-N 3.07Å
440	P	35.5	Very low	50.3	Low	107 Å²	107	111.7 Å²	111.7	70%	0.695	66%	0.663	S	S	*	*			trans	-48.6	123.1	-177	17.9	-29.3	0	0	0	105.7	P438 P442	P438-P440 VanDerWaalsContact O-N 3.11Å; P440-P442 VanDerWaalsContact O-N 3.08Å
441	P	35.5	Very low	47.8	Very low	99 Å²	99	110.8 Å²	110.8	64%	0.643	67%	0.672	S	S	*	*			trans	-49.6	130	179.2	19	-29.3	0	0	0	105.2	A443	P441-A443 VanDerWaalsContact O-CA 3.26Å; P441-A443 WeakPolarHBondContact O-CA 3.32Å; P441-A443 PolarHBondContact O-N 3.28Å
442	P	34.3	Very low	45.6	Very low	125 Å²	125	111.8 Å²	111.8	81%	0.812	68%	0.679	S	S	*	*	S	Bend	trans	-43.8	115.1	-170.1	16.3	-30.4	0	0	0	106.6	P440 A444	P440-P442 VanDerWaalsContact O-N 3.08Å; P442-A444 PolarHBondContact O-N 3.4Å
443	A	34.3	Very low	44.2	Very low	92 Å²	92	114.1 Å²	114.1	76%	0.76	69%	0.694	S	S	*	*			trans	-32.2	106.1	-155.1	0	0	0	0	0	108.7	P441	P441-A443 VanDerWaalsContact O-CA 3.26Å; P441-A443 WeakPolarHBondContact O-CA 3.32Å; P441-A443 PolarHBondContact O-N 3.28Å
444	A	34.4	Very low	43.1	Very low	76 Å²	76	115.9 Å²	115.9	63%	0.628	71%	0.706	S	S	*	*			trans	-44.9	119.5	-179.9	0	0	0	0	0	104.5	P442 K446	P442-A444 PolarHBondContact O-N 3.4Å; A444-K446 PolarHBondContact O-N 2.9Å
445	P	33.7	Very low	42.8	Very low	113 Å²	113	114.3 Å²	114.3	73%	0.734	70%	0.702	S	S	*	*			trans	-48.6	117.2	-167.3	15.7	-28.7	0	0	0	105.2
446	K	35	Very low	43.1	Very low	183 Å²	183	114.2 Å²	114.2	80%	0.796	71%	0.705	S	S	*	*			trans	-34	123.8	-175.6	-79.8	-177.7	175.3	-176	0	105.6	A444 V448	A444-K446 PolarHBondContact O-N 2.9Å; K446-V448 VanDerWaalsContact C-N 3.32Å; K446-V448 WeakPolarHBondContact O-CA 3.18Å; K446-V448 PolarHBondContact O-N 3.07Å
447	P	37.6	Very low	44.7	Very low	121 Å²	121	110.3 Å²	110.3	79%	0.786	69%	0.69	S	S	*	*			trans	-42.7	109.1	-173.9	17.2	-30.3	0	0	0	105.1	A449	P447-A449 VanDerWaalsContact C-N 3.27Å; P447-A449 WeakPolarHBondContact O-CA 3.46Å; P447-A449 PolarHBondContact O-N 2.79Å
448	V	35.1	Very low	46.6	Very low	102 Å²	102	111.1 Å²	111.1	62%	0.618	69%	0.688	S	S	*	*			trans	-48.6	105.2	-154.8	172.5	0	0	0	0	104.2	K446 V450 A451	K446-V448 VanDerWaalsContact C-N 3.32Å; K446-V448 WeakPolarHBondContact O-CA 3.18Å; K446-V448 PolarHBondContact O-N 3.07Å; V448-V450 VanDerWaalsContact O-CA 3.23Å; V448-V450 WeakPolarHBondContact O-CA 3.32Å; V448-V450 PolarHBondContact O-N 2.81Å; V448-A451 HydrophobicContact CG1-CB 3.96Å
449	A	34.7	Very low	49.2	Very low	87 Å²	87	112.4 Å²	112.4	72%	0.719	68%	0.682	S	S	*	*			trans	-58.6	104.9	-177.4	0	0	0	0	0	101.5	P447 A451	P447-A449 VanDerWaalsContact C-N 3.27Å; P447-A449 WeakPolarHBondContact O-CA 3.46Å; P447-A449 PolarHBondContact O-N 2.79Å; A449-A451 VanDerWaalsContact C-N 3.3Å; A449-A451 VanDerWaalsContact O-CA 3.25Å; A449-A451 WeakPolarHBondContact O-CA 3.29Å; A449-A451 PolarHBondContact O-N 3.17Å
450	V	39.1	Very low	51.8	Low	129 Å²	129	111.7 Å²	111.7	78%	0.782	67%	0.668	S	S	*	*			trans	-33.1	101.4	-152.6	172.8	0	0	0	0	106.3	V448	V448-V450 VanDerWaalsContact O-CA 3.23Å; V448-V450 WeakPolarHBondContact O-CA 3.32Å; V448-V450 PolarHBondContact O-N 2.81Å
451	A	35.9	Very low	54.4	Low	60 Å²	60	110.1 Å²	110.1	50%	0.496	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-50.5	120.8	-169.2	0	0	0	0	0	103.9	V448 A449	V448-A451 HydrophobicContact CG1-CB 3.96Å; A449-A451 VanDerWaalsContact C-N 3.3Å; A449-A451 VanDerWaalsContact O-CA 3.25Å; A449-A451 WeakPolarHBondContact O-CA 3.29Å; A449-A451 PolarHBondContact O-N 3.17Å
452	P	41.4	Very low	57.2	Low	111 Å²	111	109.7 Å²	109.7	72%	0.721	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-48	123.7	-169.9	15.6	-28.9	0	0	0	105.3
453	P	53.9	Low	60.1	Low	103 Å²	103	108.4 Å²	108.4	67%	0.669	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-46.8	127.2	-168.8	15.6	-29.4	0	0	0	106.7	E455	P453-E455 PolarHBondContact O-N 2.89Å; P453-E455 VanDerWaalsContact O-N 3.11Å
454	P	60.9	Low	62.9	Low	119 Å²	119	110.5 Å²	110.5	77%	0.773	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-46.2	128.3	-171.1	17.2	-31.1	0	0	0	107.8
455	E	68.5	Low	65.7	Low	167 Å²	167	112 Å²	112	78%	0.78	62%	0.616	S	S	*	*			trans	-45.2	120.5	-169.9	-75	-169.9	174.2	0	0	108.6	P453 N457	P453-E455 PolarHBondContact O-N 2.89Å; P453-E455 VanDerWaalsContact O-N 3.11Å; E455-N457 PolarHBondContact O-N 3.07Å
456	P	75.5	Confident	68.7	Low	60 Å²	60	109 Å²	109	39%	0.39	60%	0.601	S	S	.	*			trans	-58.2	132.4	-173.3	21.2	-30.3	0	0	0	107.5	Y458	P456-Y458 HydrophobicContact CG-CD1 4.47Å; P456-Y458 HydrophobicContact CG-CE1 3.98Å; P456-Y458 WeakPolarHBondContact O-CD2 3.46Å; P456-Y458 PolarHBondContact O-N 3.24Å
457	N	88.8	Confident	71.6	Confident	104 Å²	104	102.2 Å²	102.2	56%	0.556	58%	0.583	S	S	*	*			trans	-64.1	93.6	172.3	-179.8	-31.3	0	0	0	107.6	E455 F459 M460 E461	E455-N457 PolarHBondContact O-N 3.07Å; N457-F459 PolarHBondContact O-N 2.87Å; N457-F459 VanDerWaalsContact O-N 3.16Å; N457-F459 WeakPolarHBondContact OD1-CB 3.46Å; N457-F459 PolarHBondContact OD1-N 2.91Å; N457-M460 HydrophobicContact CB-CB 4.04Å; N457-M460 PolarHBondContact O-N 2.88Å; N457-M460 PolarHBondContact OD1-N 3.38Å; N457-E461 PolarHBondContact O-N 3.38Å
458	Y	90.2	Very high	74.3	Confident	153 Å²	153	101.2 Å²	101.2	60%	0.6	58%	0.575	S	S	*	*	H	α-helix	trans	-57.5	-31.8	-173.8	-66	-72.4	0	0	0	112	P456 T462	P456-Y458 HydrophobicContact CG-CD1 4.47Å; P456-Y458 HydrophobicContact CG-CE1 3.98Å; P456-Y458 WeakPolarHBondContact O-CD2 3.46Å; P456-Y458 PolarHBondContact O-N 3.24Å; Y458-T462 WeakPolarHBondContact O-CB 3.35Å; Y458-T462 PolarHBondContact O-N 3.18Å; Y458-T462 PolarHBondContact O-OG1 2.86Å
459	F	93.5	Very high	77.2	Confident	145 Å²	145	103.9 Å²	103.9	64%	0.636	58%	0.575	S	S	*	*	H	α-helix	trans	-64.9	-48.9	173.6	174.9	-97.1	0	0	0	111.4	N457 E461 T462 M463	N457-F459 PolarHBondContact O-N 2.87Å; N457-F459 VanDerWaalsContact O-N 3.16Å; N457-F459 WeakPolarHBondContact OD1-CB 3.46Å; N457-F459 PolarHBondContact OD1-N 2.91Å; F459-E461 PolarHBondContact O-N 3.05Å; F459-T462 PolarHBondContact O-N 3.37Å; F459-M463 HydrophobicContact CD1-CE 4.34Å; F459-M463 HydrophobicContact CE1-CE 3.29Å; F459-M463 HydrophobicContact CE1-SD 4.41Å; F459-M463 HydrophobicContact CE2-CE 4.35Å; F459-M463 HydrophobicContact CZ-CE 3.3Å; F459-M463 VanDerWaalsContact O-CB 3.26Å; F459-M463 WeakPolarHBondContact O-CB 3.28Å; F459-M463 PolarHBondContact O-N 2.86Å
460	M	90.8	Very high	80.2	Confident	90 Å²	90	103.6 Å²	103.6	44%	0.443	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-37.5	178.4	-175.9	59.7	102.7	0	0	111.9	N457 M463 K464	N457-M460 HydrophobicContact CB-CB 4.04Å; N457-M460 PolarHBondContact O-N 2.88Å; N457-M460 PolarHBondContact OD1-N 3.38Å; M460-M463 HydrophobicContact SD-SD 4.37Å; M460-K464 HydrophobicContact CG-CD 4.44Å; M460-K464 WeakPolarHBondContact O-CB 3.38Å; M460-K464 VanDerWaalsContact O-CG 3.26Å; M460-K464 WeakPolarHBondContact O-CG 3.48Å; M460-K464 PolarHBondContact O-N 2.89Å; M460-K464 HydrophobicContact SD-CG 4.49Å
461	E	89.5	Confident	82.8	Confident	74 Å²	74	100.3 Å²	100.3	35%	0.346	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-44.8	174.2	-166.3	-172.8	154.8	0	0	111.5	N457 F459 K464 K465	N457-E461 PolarHBondContact O-N 3.38Å; F459-E461 PolarHBondContact O-N 3.05Å; E461-K464 PolarHBondContact O-N 3.11Å; E461-K465 WeakPolarHBondContact O-CG 3.45Å; E461-K465 PolarHBondContact O-N 2.98Å; E461-K465 WeakPolarHBondContact OE1-CE 3.46Å; E461-K465 IonicContact OE1-NZ 3.6Å; E461-K465 PolarHBondContact OE1-NZ 2.9Å
462	T	94	Very high	85.5	Confident	89 Å²	89	99.1 Å²	99.1	55%	0.546	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-42.3	176	-57.4	0	0	0	0	111.1	Y458 F459 K465 A466	Y458-T462 WeakPolarHBondContact O-CB 3.35Å; Y458-T462 PolarHBondContact O-N 3.18Å; Y458-T462 PolarHBondContact O-OG1 2.86Å; F459-T462 PolarHBondContact O-N 3.37Å; T462-K465 PolarHBondContact O-N 3.2Å; T462-A466 VanDerWaalsContact O-CB 3.25Å; T462-A466 WeakPolarHBondContact O-CB 3.45Å; T462-A466 PolarHBondContact O-N 3.26Å
463	M	95.9	Very high	88	Confident	98 Å²	98	100.2 Å²	100.2	48%	0.483	54%	0.541	S	S	.	.	H	α-helix	trans	-61.7	-43.9	175.1	-179.7	-177.1	-78.3	0	0	111.4	F459 M460 G467	F459-M463 HydrophobicContact CD1-CE 4.34Å; F459-M463 HydrophobicContact CE1-CE 3.29Å; F459-M463 HydrophobicContact CE1-SD 4.41Å; F459-M463 HydrophobicContact CE2-CE 4.35Å; F459-M463 HydrophobicContact CZ-CE 3.3Å; F459-M463 VanDerWaalsContact O-CB 3.26Å; F459-M463 WeakPolarHBondContact O-CB 3.28Å; F459-M463 PolarHBondContact O-N 2.86Å; M460-M463 HydrophobicContact SD-SD 4.37Å; M463-G467 PolarHBondContact O-N 3.1Å
464	K	93.1	Very high	90	Very high	137 Å²	137	97.2 Å²	97.2	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-44.2	175.1	-76.7	175.1	-179.7	-179.4	0	111.8	M460 E461 T468	M460-K464 HydrophobicContact CG-CD 4.44Å; M460-K464 WeakPolarHBondContact O-CB 3.38Å; M460-K464 VanDerWaalsContact O-CG 3.26Å; M460-K464 WeakPolarHBondContact O-CG 3.48Å; M460-K464 PolarHBondContact O-N 2.89Å; M460-K464 HydrophobicContact SD-CG 4.49Å; E461-K464 PolarHBondContact O-N 3.11Å; K464-T468 WeakPolarHBondContact O-CB 3.25Å; K464-T468 PolarHBondContact O-N 3.2Å; K464-T468 PolarHBondContact O-OG1 2.89Å
465	K	92.9	Very high	91.5	Very high	106 Å²	106	95.7 Å²	95.7	46%	0.461	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-52.9	175.8	-75	176.2	-175.8	168.7	0	110.9	E461 T462 G467 T468 Y469	E461-K465 WeakPolarHBondContact O-CG 3.45Å; E461-K465 PolarHBondContact O-N 2.98Å; E461-K465 WeakPolarHBondContact OE1-CE 3.46Å; E461-K465 IonicContact OE1-NZ 3.6Å; E461-K465 PolarHBondContact OE1-NZ 2.9Å; T462-K465 PolarHBondContact O-N 3.2Å; K465-G467 VanDerWaalsContact C-N 3.33Å; K465-G467 PolarHBondContact O-N 2.97Å; K465-T468 WeakPolarHBondContact O-CB 3.37Å; K465-T468 PolarHBondContact O-N 2.91Å; K465-T468 VanDerWaalsContact O-N 3.12Å; K465-Y469 HydrophobicContact CB-CD2 4.49Å; K465-Y469 HydrophobicContact CB-CE2 4.32Å; K465-Y469 WeakPolarHBondContact O-CD2 3.28Å; K465-Y469 PolarHBondContact O-N 3.39Å
466	A	96.7	Very high	92.6	Very high	51 Å²	51	93.1 Å²	93.1	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-56.1	-47.5	177.3	0	0	0	0	0	111.2	T462 T468 Y469 S470	T462-A466 VanDerWaalsContact O-CB 3.25Å; T462-A466 WeakPolarHBondContact O-CB 3.45Å; T462-A466 PolarHBondContact O-N 3.26Å; A466-T468 VanDerWaalsContact C-N 3.34Å; A466-T468 PolarHBondContact O-N 2.86Å; A466-Y469 PolarHBondContact O-N 3.18Å; A466-S470 WeakPolarHBondContact O-CB 3.49Å; A466-S470 PolarHBondContact O-N 2.86Å; A466-S470 PolarHBondContact O-OG 3.43Å
467	G	96.4	Very high	93.4	Very high	41 Å²	41	95.2 Å²	95.2	42%	0.423	52%	0.515	S	S	.	.	H	α-helix	trans	-59.7	-40.6	175.7	0	0	0	0	0	113.3	M463 K465 A471	M463-G467 PolarHBondContact O-N 3.1Å; K465-G467 VanDerWaalsContact C-N 3.33Å; K465-G467 PolarHBondContact O-N 2.97Å; G467-A471 WeakPolarHBondContact O-CB 3.38Å; G467-A471 PolarHBondContact O-N 3.5Å
468	T	93.7	Very high	93.5	Very high	100 Å²	100	91.8 Å²	91.8	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-65.5	-45.3	176.8	-54.2	0	0	0	0	111.4	K464 K465 A466 A471 G472	K464-T468 WeakPolarHBondContact O-CB 3.25Å; K464-T468 PolarHBondContact O-N 3.2Å; K464-T468 PolarHBondContact O-OG1 2.89Å; K465-T468 WeakPolarHBondContact O-CB 3.37Å; K465-T468 PolarHBondContact O-N 2.91Å; K465-T468 VanDerWaalsContact O-N 3.12Å; A466-T468 VanDerWaalsContact C-N 3.34Å; A466-T468 PolarHBondContact O-N 2.86Å; T468-A471 PolarHBondContact O-N 3.49Å; T468-G472 PolarHBondContact O-N 3.47Å
469	Y	95.5	Very high	93.5	Very high	158 Å²	158	87.8 Å²	87.8	62%	0.62	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-43	176.1	-71.6	-62.9	0	0	0	112.2	K465 A466 A471 G472 F473	K465-Y469 HydrophobicContact CB-CD2 4.49Å; K465-Y469 HydrophobicContact CB-CE2 4.32Å; K465-Y469 WeakPolarHBondContact O-CD2 3.28Å; K465-Y469 PolarHBondContact O-N 3.39Å; A466-Y469 PolarHBondContact O-N 3.18Å; Y469-A471 VanDerWaalsContact C-N 3.32Å; Y469-A471 PolarHBondContact O-N 2.67Å; Y469-G472 PolarHBondContact O-N 3Å; Y469-G472 VanDerWaalsContact O-N 3.17Å; Y469-F473 WeakPolarHBondContact O-CD2 3.36Å; Y469-F473 PolarHBondContact O-N 2.8Å
470	S	97.1	Very high	93.2	Very high	80 Å²	80	83.3 Å²	83.3	56%	0.559	49%	0.487	S	S	*	.	H	α-helix	trans	-60	-41	175	-66	0	0	0	0	111.8	A466 G474	A466-S470 WeakPolarHBondContact O-CB 3.49Å; A466-S470 PolarHBondContact O-N 2.86Å; A466-S470 PolarHBondContact O-OG 3.43Å; S470-G474 PolarHBondContact O-N 3.02Å
471	A	94.9	Very high	93.1	Very high	60 Å²	60	88.7 Å²	88.7	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-41.9	174	0	0	0	0	0	112	G467 T468 Y469 G474 T475	G467-A471 WeakPolarHBondContact O-CB 3.38Å; G467-A471 PolarHBondContact O-N 3.5Å; T468-A471 PolarHBondContact O-N 3.49Å; Y469-A471 VanDerWaalsContact C-N 3.32Å; Y469-A471 PolarHBondContact O-N 2.67Å; A471-G474 PolarHBondContact O-N 3.11Å; A471-T475 WeakPolarHBondContact O-CB 3.46Å; A471-T475 PolarHBondContact O-N 3.25Å; A471-T475 PolarHBondContact O-OG1 3.14Å
472	G	92.6	Very high	92.8	Very high	35 Å²	35	90.5 Å²	90.5	36%	0.361	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-53.6	174.9	0	0	0	0	0	112.7	T468 Y469 G474 T475 I476	T468-G472 PolarHBondContact O-N 3.47Å; Y469-G472 PolarHBondContact O-N 3Å; Y469-G472 VanDerWaalsContact O-N 3.17Å; G472-G474 VanDerWaalsContact C-N 3.33Å; G472-G474 PolarHBondContact O-N 2.76Å; G472-T475 WeakPolarHBondContact O-CB 3.26Å; G472-T475 PolarHBondContact O-N 3.34Å; G472-T475 VanDerWaalsContact O-N 3.16Å; G472-I476 WeakPolarHBondContact O-CG1 3.38Å; G472-I476 PolarHBondContact O-N 3Å; G472-I476 VanDerWaalsContact O-N 3.09Å
473	F	94.4	Very high	92.5	Very high	135 Å²	135	87.6 Å²	87.6	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-39.5	176.8	-69.4	-53.3	0	0	0	112.3	Y469 T475 I476 I477	Y469-F473 WeakPolarHBondContact O-CD2 3.36Å; Y469-F473 PolarHBondContact O-N 2.8Å; F473-T475 VanDerWaalsContact C-N 3.31Å; F473-T475 PolarHBondContact O-N 3.04Å; F473-I476 HydrophobicContact CD1-CD1 4.44Å; F473-I476 PolarHBondContact O-N 3.28Å; F473-I477 WeakPolarHBondContact O-CG1 3.27Å; F473-I477 PolarHBondContact O-N 3.43Å
474	G	95.8	Very high	92	Very high	40 Å²	40	85.5 Å²	85.5	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-39.2	174.1	0	0	0	0	0	112.6	S470 A471 G472 I477 G478	S470-G474 PolarHBondContact O-N 3.02Å; A471-G474 PolarHBondContact O-N 3.11Å; G472-G474 VanDerWaalsContact C-N 3.33Å; G472-G474 PolarHBondContact O-N 2.76Å; G474-I477 PolarHBondContact O-N 2.85Å; G474-G478 PolarHBondContact O-N 3.27Å
475	T	91.4	Very high	91.6	Very high	87 Å²	87	82.4 Å²	82.4	53%	0.534	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-41.8	175.9	-56.1	0	0	0	0	111.4	A471 G472 F473 G478 L479	A471-T475 WeakPolarHBondContact O-CB 3.46Å; A471-T475 PolarHBondContact O-N 3.25Å; A471-T475 PolarHBondContact O-OG1 3.14Å; G472-T475 WeakPolarHBondContact O-CB 3.26Å; G472-T475 PolarHBondContact O-N 3.34Å; G472-T475 VanDerWaalsContact O-N 3.16Å; F473-T475 VanDerWaalsContact C-N 3.31Å; F473-T475 PolarHBondContact O-N 3.04Å; T475-G478 PolarHBondContact O-N 2.99Å; T475-L479 WeakPolarHBondContact O-CG 3.48Å; T475-L479 PolarHBondContact O-N 3.28Å
476	I	91.2	Very high	91.4	Very high	112 Å²	112	81.2 Å²	81.2	57%	0.574	49%	0.492	S	S	*	.	H	α-helix	trans	-61.9	-45.6	176.8	-65.5	167.7	0	0	0	110.8	G472 F473 G478 L479 G480	G472-I476 WeakPolarHBondContact O-CG1 3.38Å; G472-I476 PolarHBondContact O-N 3Å; G472-I476 VanDerWaalsContact O-N 3.09Å; F473-I476 HydrophobicContact CD1-CD1 4.44Å; F473-I476 PolarHBondContact O-N 3.28Å; I476-G478 VanDerWaalsContact C-N 3.31Å; I476-G478 PolarHBondContact O-N 2.93Å; I476-L479 PolarHBondContact O-N 3.1Å; I476-G480 PolarHBondContact O-N 3.2Å
477	I	93.2	Very high	91	Very high	104 Å²	104	80.3 Å²	80.3	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-42.7	175.2	-66.9	169.6	0	0	0	110.4	F473 G474 L479 G480 Y481	F473-I477 WeakPolarHBondContact O-CG1 3.27Å; F473-I477 PolarHBondContact O-N 3.43Å; G474-I477 PolarHBondContact O-N 2.85Å; I477-L479 PolarHBondContact O-N 3.08Å; I477-G480 WeakPolarHBondContact O-CA 3.47Å; I477-G480 PolarHBondContact O-N 3.17Å; I477-G480 VanDerWaalsContact O-N 3.08Å; I477-Y481 HydrophobicContact CG2-CD2 3.89Å; I477-Y481 HydrophobicContact CG2-CE2 3.6Å; I477-Y481 WeakPolarHBondContact O-CD2 3.4Å; I477-Y481 PolarHBondContact O-N 3.4Å; I477-Y481 VanDerWaalsContact O-N 3.08Å
478	G	91.1	Very high	90.6	Very high	32 Å²	32	79.6 Å²	79.6	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-59.6	-43.6	176.1	0	0	0	0	0	113.4	G474 T475 I476 G480 Y481 I482	G474-G478 PolarHBondContact O-N 3.27Å; T475-G478 PolarHBondContact O-N 2.99Å; I476-G478 VanDerWaalsContact C-N 3.31Å; I476-G478 PolarHBondContact O-N 2.93Å; G478-G480 PolarHBondContact O-N 3.06Å; G478-Y481 PolarHBondContact O-N 2.8Å; G478-I482 PolarHBondContact O-N 2.7Å
479	L	88.9	Confident	90.4	Very high	69 Å²	69	77.4 Å²	77.4	36%	0.361	46%	0.459	S	S	.	.	H	α-helix	trans	-60.4	-35.7	172.7	-72	174.8	0	0	0	111.8	T475 I476 I477 I482 S483 F488	T475-L479 WeakPolarHBondContact O-CG 3.48Å; T475-L479 PolarHBondContact O-N 3.28Å; I476-L479 PolarHBondContact O-N 3.1Å; I477-L479 PolarHBondContact O-N 3.08Å; L479-I482 HydrophobicContact CD2-CD1 4.12Å; L479-I482 WeakPolarHBondContact O-CG1 3.43Å; L479-I482 PolarHBondContact O-N 3.03Å; L479-S483 PolarHBondContact O-N 3.11Å; L479-F488 HydrophobicContact CD2-CZ 4.4Å
480	G	88.8	Confident	90.2	Very high	51 Å²	51	73 Å²	73	53%	0.526	45%	0.451	S	S	.	.	H	α-helix	trans	-62.5	-41.6	173.3	0	0	0	0	0	113.4	I476 I477 G478 I482 S483	I476-G480 PolarHBondContact O-N 3.2Å; I477-G480 WeakPolarHBondContact O-CA 3.47Å; I477-G480 PolarHBondContact O-N 3.17Å; I477-G480 VanDerWaalsContact O-N 3.08Å; G478-G480 PolarHBondContact O-N 3.06Å; G480-I482 VanDerWaalsContact C-N 3.34Å; G480-I482 PolarHBondContact O-N 3.11Å; G480-S483 WeakPolarHBondContact O-CB 3.43Å; G480-S483 PolarHBondContact O-N 3.32Å
481	Y	87.8	Confident	90	Very high	204 Å²	204	69.4 Å²	69.4	80%	0.8	43%	0.425	S	S	*	.	H	α-helix	trans	-67.8	-30.4	178.3	-84.2	-74.4	0	0	0	114	I477 G478	I477-Y481 HydrophobicContact CG2-CD2 3.89Å; I477-Y481 HydrophobicContact CG2-CE2 3.6Å; I477-Y481 WeakPolarHBondContact O-CD2 3.4Å; I477-Y481 PolarHBondContact O-N 3.4Å; I477-Y481 VanDerWaalsContact O-N 3.08Å; G478-Y481 PolarHBondContact O-N 2.8Å
482	I	84.3	Confident	89.8	Confident	111 Å²	111	68.1 Å²	68.1	57%	0.569	41%	0.412	S	S	*	.	H	α-helix	trans	-95.8	-2.7	179.6	68.1	171	0	0	0	113.2	G478 L479 G480 P484	G478-I482 PolarHBondContact O-N 2.7Å; L479-I482 HydrophobicContact CD2-CD1 4.12Å; L479-I482 WeakPolarHBondContact O-CG1 3.43Å; L479-I482 PolarHBondContact O-N 3.03Å; G480-I482 VanDerWaalsContact C-N 3.34Å; G480-I482 PolarHBondContact O-N 3.11Å; I482-P484 WeakPolarHBondContact O-CD 3.5Å
483	S	86.6	Confident	89.9	Confident	29 Å²	29	70.5 Å²	70.5	20%	0.203	42%	0.42	C	S	.	.			trans	-64.4	120.8	-178.6	-179.6	0	0	0	0	110.2	L479 G480 N485 F488 S489	L479-S483 PolarHBondContact O-N 3.11Å; G480-S483 WeakPolarHBondContact O-CB 3.43Å; G480-S483 PolarHBondContact O-N 3.32Å; S483-N485 PolarHBondContact OG-O 3.39Å; S483-N485 VanDerWaalsContact OG-O 3.05Å; S483-F488 WeakPolarHBondContact OG-CD1 3.23Å; S483-S489 PolarHBondContact OG-OG 2.83Å
484	P	85.4	Confident	89.9	Confident	54 Å²	54	65.7 Å²	65.7	35%	0.351	40%	0.401	S	S	.	.			trans	-78.9	-27.2	-177.8	29.7	-34.7	0	0	0	113	I482 F488 A725 V728	I482-P484 WeakPolarHBondContact O-CD 3.5Å; P484-F488 HydrophobicContact CG-CB 4.25Å; P484-A725 VanDerWaalsContact CB-CA 3.47Å; P484-A725 HydrophobicContact CB-CB 3.67Å; P484-A725 HydrophobicContact CG-CB 4.08Å; P484-V728 HydrophobicContact CG-CB 4.34Å; P484-V728 HydrophobicContact CG-CG2 3.7Å
485	N	86	Confident	89.9	Confident	71 Å²	71	67 Å²	67	38%	0.38	40%	0.396	S	S	.	.	S	Bend	trans	-159.4	173.4	-172.9	61.7	32.1	0	0	0	111.9	S483 A487 F488 S489	S483-N485 PolarHBondContact OG-O 3.39Å; S483-N485 VanDerWaalsContact OG-O 3.05Å; N485-A487 VanDerWaalsContact C-N 3.28Å; N485-A487 PolarHBondContact O-N 3.37Å; N485-A487 WeakPolarHBondContact OD1-CB 3.4Å; N485-A487 PolarHBondContact OD1-N 3.29Å; N485-F488 PolarHBondContact OD1-N 2.89Å; N485-S489 PolarHBondContact O-OG 2.67Å
486	A	88.6	Confident	90	Very high	81 Å²	81	64.4 Å²	64.4	67%	0.669	39%	0.387	S	S	*	.	H	α-helix	trans	-66.4	-28.9	178.5	0	0	0	0	0	113.2	S489 S490	A486-S489 PolarHBondContact O-N 2.94Å; A486-S490 PolarHBondContact O-N 3.26Å
487	A	86.5	Confident	90.2	Very high	32 Å²	32	64.3 Å²	64.3	26%	0.264	39%	0.387	S	S	.	.	H	α-helix	trans	-63.5	-46.1	179.7	0	0	0	0	0	111.4	N485 S489 S490 M491	N485-A487 VanDerWaalsContact C-N 3.28Å; N485-A487 PolarHBondContact O-N 3.37Å; N485-A487 WeakPolarHBondContact OD1-CB 3.4Å; N485-A487 PolarHBondContact OD1-N 3.29Å; A487-S489 VanDerWaalsContact C-N 3.3Å; A487-S489 PolarHBondContact O-N 3.43Å; A487-S490 WeakPolarHBondContact O-CB 3.24Å; A487-S490 PolarHBondContact O-N 3.27Å; A487-S490 VanDerWaalsContact O-N 3.13Å; A487-M491 WeakPolarHBondContact O-CB 3.48Å; A487-M491 PolarHBondContact O-N 3.32Å
488	F	88.7	Confident	90.4	Very high	27 Å²	27	59.8 Å²	59.8	12%	0.118	37%	0.365	C	S	.	.	H	α-helix	trans	-58.4	-42.2	174.2	178.8	-104.2	0	0	0	112.4	L479 S483 P484 N485 M491 C492 V728 F854	L479-F488 HydrophobicContact CD2-CZ 4.4Å; S483-F488 WeakPolarHBondContact OG-CD1 3.23Å; P484-F488 HydrophobicContact CG-CB 4.25Å; N485-F488 PolarHBondContact OD1-N 2.89Å; F488-M491 PolarHBondContact O-N 2.93Å; F488-C492 VanDerWaalsContact CE1-SG 3.57Å; F488-C492 VanDerWaalsContact CZ-SG 3.51Å; F488-C492 WeakPolarHBondContact O-CB 3.29Å; F488-C492 PolarHBondContact O-N 2.99Å; F488-C492 PolarHBondContact O-SG 2.78Å; F488-V728 HydrophobicContact CD2-CG1 3.6Å; F488-V728 HydrophobicContact CE2-CG1 3.52Å; F488-V728 HydrophobicContact CZ-CG1 4.4Å; F488-F854 HydrophobicContact CD2-CD1 4.14Å; F488-F854 HydrophobicContact CD2-CE1 4.27Å; F488-F854 HydrophobicContact CE2-CD1 4.03Å; F488-F854 HydrophobicContact CE2-CE1 4.02Å
489	S	90.2	Very high	90.6	Very high	54 Å²	54	59.1 Å²	59.1	38%	0.378	36%	0.358	S	S	.	.	H	α-helix	trans	-65.2	-39.3	177.1	-58.4	0	0	0	0	112.1	S483 N485 A486 A487 T493	S483-S489 PolarHBondContact OG-OG 2.83Å; N485-S489 PolarHBondContact O-OG 2.67Å; A486-S489 PolarHBondContact O-N 2.94Å; A487-S489 VanDerWaalsContact C-N 3.3Å; A487-S489 PolarHBondContact O-N 3.43Å; S489-T493 PolarHBondContact O-N 3.14Å; S489-T493 VanDerWaalsContact O-N 3.08Å; S489-T493 PolarHBondContact O-OG1 3.26Å
490	S	91.7	Very high	90.9	Very high	65 Å²	65	60.6 Å²	60.6	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-47.8	173.4	-168.1	0	0	0	0	110.9	A486 A487 C492 T493 T494	A486-S490 PolarHBondContact O-N 3.26Å; A487-S490 WeakPolarHBondContact O-CB 3.24Å; A487-S490 PolarHBondContact O-N 3.27Å; A487-S490 VanDerWaalsContact O-N 3.13Å; S490-C492 VanDerWaalsContact C-N 3.34Å; S490-C492 PolarHBondContact O-N 2.8Å; S490-T493 CarbonylContact O-C 3.59Å; S490-T493 WeakPolarHBondContact O-CA 3.32Å; S490-T493 VanDerWaalsContact O-CB 3.26Å; S490-T493 WeakPolarHBondContact O-CB 3.49Å; S490-T493 PolarHBondContact O-N 2.79Å; S490-T494 PolarHBondContact O-N 3.42Å; S490-T494 PolarHBondContact O-OG1 3.08Å
491	M	91.3	Very high	91.3	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.02	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-40.4	177.9	-165.9	62.7	63.7	0	0	112.1	A487 F488 T493 T494 F495 F854 D857 T862	A487-M491 WeakPolarHBondContact O-CB 3.48Å; A487-M491 PolarHBondContact O-N 3.32Å; F488-M491 PolarHBondContact O-N 2.93Å; M491-T493 VanDerWaalsContact C-N 3.28Å; M491-T493 PolarHBondContact O-N 2.91Å; M491-T494 PolarHBondContact O-N 3.13Å; M491-F495 WeakPolarHBondContact O-CB 3.23Å; M491-F495 PolarHBondContact O-N 3.12Å; M491-F854 HydrophobicContact CB-CD1 4.07Å; M491-F854 HydrophobicContact CB-CE1 3.81Å; M491-F854 HydrophobicContact CG-CD1 3.46Å; M491-F854 VanDerWaalsContact CG-CD1 3.46Å; M491-F854 HydrophobicContact CG-CE1 3.41Å; M491-F854 VanDerWaalsContact CG-CE1 3.41Å; M491-F854 HydrophobicContact CG-CG 4.19Å; M491-F854 HydrophobicContact CG-CZ 4.09Å; M491-D857 VanDerWaalsContact CE-C 3.44Å; M491-D857 VanDerWaalsContact CE-OD1 3.26Å; M491-D857 WeakPolarHBondContact CE-OD1 2.9Å; M491-T862 HydrophobicContact CG-CG2 4.29Å; M491-T862 VanDerWaalsContact SD-CB 3.57Å; M491-T862 HydrophobicContact SD-CG2 3.8Å; M491-T862 PolarHBondContact SD-OG1 2.89Å
492	C	92.3	Very high	91.6	Very high	33 Å²	33	51.5 Å²	51.5	22%	0.223	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-37.2	172.6	-72.8	0	0	0	0	112.1	F488 S490 G496	F488-C492 VanDerWaalsContact CE1-SG 3.57Å; F488-C492 VanDerWaalsContact CZ-SG 3.51Å; F488-C492 WeakPolarHBondContact O-CB 3.29Å; F488-C492 PolarHBondContact O-N 2.99Å; F488-C492 PolarHBondContact O-SG 2.78Å; S490-C492 VanDerWaalsContact C-N 3.34Å; S490-C492 PolarHBondContact O-N 2.8Å; C492-G496 PolarHBondContact O-N 3.07Å
493	T	93.9	Very high	92.1	Very high	85 Å²	85	51.9 Å²	51.9	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-49.8	176.1	-56.7	0	0	0	0	110.6	S489 S490 M491 F495 G496 L497	S489-T493 PolarHBondContact O-N 3.14Å; S489-T493 VanDerWaalsContact O-N 3.08Å; S489-T493 PolarHBondContact O-OG1 3.26Å; S490-T493 CarbonylContact O-C 3.59Å; S490-T493 WeakPolarHBondContact O-CA 3.32Å; S490-T493 VanDerWaalsContact O-CB 3.26Å; S490-T493 WeakPolarHBondContact O-CB 3.49Å; S490-T493 PolarHBondContact O-N 2.79Å; M491-T493 VanDerWaalsContact C-N 3.28Å; M491-T493 PolarHBondContact O-N 2.91Å; T493-F495 VanDerWaalsContact C-N 3.33Å; T493-F495 PolarHBondContact O-N 2.77Å; T493-G496 PolarHBondContact O-N 3.1Å; T493-L497 HydrophobicContact CG2-CD1 4.17Å; T493-L497 WeakPolarHBondContact O-CG 3.42Å; T493-L497 PolarHBondContact O-N 2.7Å
494	T	94	Very high	92.5	Very high	34 Å²	34	56.5 Å²	56.5	21%	0.209	33%	0.334	C	S	.	.	H	α-helix	trans	-56.9	-46.6	175	-60	0	0	0	0	111	S490 M491 L497 A498 D859 V863	S490-T494 PolarHBondContact O-N 3.42Å; S490-T494 PolarHBondContact O-OG1 3.08Å; M491-T494 PolarHBondContact O-N 3.13Å; T494-L497 PolarHBondContact O-N 3.12Å; T494-A498 WeakPolarHBondContact O-CB 3.38Å; T494-A498 PolarHBondContact O-N 2.84Å; T494-D859 HydrophobicContact CG2-CB 4.43Å; T494-D859 PolarHBondContact OG1-OD1 3.06Å; T494-V863 HydrophobicContact CG2-CG2 3.45Å; T494-V863 VanDerWaalsContact CG2-CG2 3.45Å
495	F	95.1	Very high	92.9	Very high	67 Å²	67	55 Å²	55	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-58.4	-48.3	176.4	173.3	-106.7	0	0	0	112.4	M491 T493 A498 G499 W847 C850 F854 T862 A866	M491-F495 WeakPolarHBondContact O-CB 3.23Å; M491-F495 PolarHBondContact O-N 3.12Å; T493-F495 VanDerWaalsContact C-N 3.33Å; T493-F495 PolarHBondContact O-N 2.77Å; F495-A498 PolarHBondContact O-N 3.23Å; F495-G499 PolarHBondContact O-N 2.91Å; F495-W847 HydrophobicContact CE2-CE3 4.22Å; F495-W847 AromaticContact CE2-CZ3 3.8Å; F495-W847 HydrophobicContact CE2-CZ3 3.8Å; F495-W847 HydrophobicContact CZ-CE3 4.47Å; F495-W847 AromaticContact CZ-CZ3 3.97Å; F495-W847 HydrophobicContact CZ-CZ3 3.97Å; F495-C850 HydrophobicContact CD2-CB 4.49Å; F495-C850 HydrophobicContact CE2-CB 4.26Å; F495-F854 HydrophobicContact CB-CE2 4.33Å; F495-F854 HydrophobicContact CB-CZ 3.92Å; F495-F854 HydrophobicContact CD1-CZ 4.44Å; F495-F854 HydrophobicContact CD2-CE2 4.18Å; F495-F854 HydrophobicContact CG-CE2 4.13Å; F495-F854 HydrophobicContact CG-CZ 4.07Å; F495-T862 HydrophobicContact CB-CG2 3.64Å; F495-T862 HydrophobicContact CD2-CG2 4.08Å; F495-T862 HydrophobicContact CG-CG2 4.35Å; F495-A866 HydrophobicContact CD2-CB 4.1Å; F495-A866 HydrophobicContact CE2-CB 4.22Å
496	G	94.2	Very high	93.3	Very high	34 Å²	34	51.7 Å²	51.7	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-46.3	179.2	0	0	0	0	0	112.5	C492 T493 G499 I500	C492-G496 PolarHBondContact O-N 3.07Å; T493-G496 PolarHBondContact O-N 3.1Å; G496-G499 PolarHBondContact O-N 3.33Å; G496-I500 WeakPolarHBondContact O-CG1 3.1Å; G496-I500 PolarHBondContact O-N 3.27Å; G496-I500 VanDerWaalsContact O-N 3.15Å
497	L	96.7	Very high	93.5	Very high	109 Å²	109	53 Å²	53	57%	0.571	29%	0.294	S	S	*	.	H	α-helix	trans	-65.3	-44.6	176.8	-68.1	175.3	0	0	0	111.7	T493 T494 G499 I500 V501	T493-L497 HydrophobicContact CG2-CD1 4.17Å; T493-L497 WeakPolarHBondContact O-CG 3.42Å; T493-L497 PolarHBondContact O-N 2.7Å; T494-L497 PolarHBondContact O-N 3.12Å; L497-G499 VanDerWaalsContact C-N 3.31Å; L497-G499 PolarHBondContact O-N 3.14Å; L497-I500 PolarHBondContact O-N 2.83Å; L497-V501 WeakPolarHBondContact O-CG2 3.44Å; L497-V501 PolarHBondContact O-N 2.97Å
498	A	96.2	Very high	93.8	Very high	9 Å²	9	53.5 Å²	53.5	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-36.6	177.2	0	0	0	0	0	112.4	T494 F495 V501 G502 V863 A866	T494-A498 WeakPolarHBondContact O-CB 3.38Å; T494-A498 PolarHBondContact O-N 2.84Å; F495-A498 PolarHBondContact O-N 3.23Å; A498-V501 PolarHBondContact O-N 3.3Å; A498-G502 PolarHBondContact O-N 2.92Å; A498-V863 HydrophobicContact CB-CB 4.15Å; A498-V863 HydrophobicContact CB-CG1 4.01Å; A498-V863 HydrophobicContact CB-CG2 4.07Å; A498-A866 HydrophobicContact CB-CB 3.84Å
499	G	95	Very high	93.9	Very high	18 Å²	18	52.5 Å²	52.5	19%	0.186	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-42.7	173.1	0	0	0	0	0	112.6	F495 G496 L497 G502 Y503	F495-G499 PolarHBondContact O-N 2.91Å; G496-G499 PolarHBondContact O-N 3.33Å; L497-G499 VanDerWaalsContact C-N 3.31Å; L497-G499 PolarHBondContact O-N 3.14Å; G499-G502 PolarHBondContact O-N 2.81Å; G499-Y503 WeakPolarHBondContact O-CB 3.11Å; G499-Y503 PolarHBondContact O-N 3.48Å
500	I	95.7	Very high	93.9	Very high	101 Å²	101	51.5 Å²	51.5	52%	0.518	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-44.6	175.4	-66	167.1	0	0	0	110.8	G496 L497 G502 Y503 H504	G496-I500 WeakPolarHBondContact O-CG1 3.1Å; G496-I500 PolarHBondContact O-N 3.27Å; G496-I500 VanDerWaalsContact O-N 3.15Å; L497-I500 PolarHBondContact O-N 2.83Å; I500-G502 VanDerWaalsContact C-N 3.34Å; I500-G502 PolarHBondContact O-N 3.38Å; I500-Y503 WeakPolarHBondContact O-CB 3.41Å; I500-Y503 PolarHBondContact O-N 3.26Å; I500-H504 PolarHBondContact O-CD2 3.46Å; I500-H504 PolarHBondContact O-N 2.86Å
501	V	96.3	Very high	93.7	Very high	63 Å²	63	50.9 Å²	50.9	38%	0.382	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-46.6	175.4	169.8	0	0	0	0	110.4	L497 A498 Y503 H504 T505 V623	L497-V501 WeakPolarHBondContact O-CG2 3.44Å; L497-V501 PolarHBondContact O-N 2.97Å; A498-V501 PolarHBondContact O-N 3.3Å; V501-Y503 VanDerWaalsContact C-N 3.35Å; V501-Y503 PolarHBondContact O-N 2.72Å; V501-H504 PolarHBondContact O-N 2.83Å; V501-T505 VanDerWaalsContact O-CB 3.24Å; V501-T505 WeakPolarHBondContact O-CB 3.47Å; V501-T505 PolarHBondContact O-N 3.41Å; V501-T505 PolarHBondContact O-OG1 3.27Å; V501-V623 HydrophobicContact CG1-CB 4.48Å; V501-V623 HydrophobicContact CG1-CG1 3.62Å; V501-V623 HydrophobicContact CG1-CG2 3.94Å
502	G	95	Very high	93.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-40.8	177.3	0	0	0	0	0	112.8	A498 G499 I500 V506	A498-G502 PolarHBondContact O-N 2.92Å; G499-G502 PolarHBondContact O-N 2.81Å; I500-G502 VanDerWaalsContact C-N 3.34Å; I500-G502 PolarHBondContact O-N 3.38Å; G502-V506 WeakPolarHBondContact O-CB 3.4Å; G502-V506 WeakPolarHBondContact O-CG2 3.41Å; G502-V506 PolarHBondContact O-N 3.19Å; G502-V506 VanDerWaalsContact O-N 3.09Å
503	Y	94.8	Very high	93.3	Very high	119 Å²	119	49.6 Å²	49.6	47%	0.467	28%	0.277	S	S	.	.	H	α-helix	trans	-57.6	-54.7	175.2	178.5	-91	0	0	0	111.8	G499 I500 V501 W507 I874	G499-Y503 WeakPolarHBondContact O-CB 3.11Å; G499-Y503 PolarHBondContact O-N 3.48Å; I500-Y503 WeakPolarHBondContact O-CB 3.41Å; I500-Y503 PolarHBondContact O-N 3.26Å; V501-Y503 VanDerWaalsContact C-N 3.35Å; V501-Y503 PolarHBondContact O-N 2.72Å; Y503-W507 AromaticContact CD1-CD1 4Å; Y503-W507 AromaticContact CD2-NE1 3.88Å; Y503-W507 AromaticContact CE1-CD1 3.7Å; Y503-W507 AromaticContact CE1-NE1 3.96Å; Y503-W507 AromaticContact CE2-CD1 3.72Å; Y503-W507 AromaticContact CE2-NE1 3.26Å; Y503-W507 VanDerWaalsContact CE2-NE1 3.26Å; Y503-W507 AromaticContact CZ-CD1 3.55Å; Y503-W507 AromaticContact CZ-NE1 3.3Å; Y503-W507 VanDerWaalsContact CZ-NE1 3.3Å; Y503-W507 VanDerWaalsContact O-CD1 3.22Å; Y503-W507 PolarHBondContact O-N 3.16Å; Y503-W507 PolarHBondContact OH-NE1 3.26Å; Y503-I874 HydrophobicContact CD2-CD1 3.92Å; Y503-I874 HydrophobicContact CD2-CG1 4.48Å; Y503-I874 HydrophobicContact CG-CD1 4.4Å
504	H	95.1	Very high	93	Very high	127 Å²	127	46.5 Å²	46.5	59%	0.588	26%	0.256	S	S	*	.	H	α-helix	trans	-68.6	-37.7	-177.9	-78.3	-73.3	0	0	0	112.9	I500 V501 G508	I500-H504 PolarHBondContact O-CD2 3.46Å; I500-H504 PolarHBondContact O-N 2.86Å; V501-H504 PolarHBondContact O-N 2.83Å; H504-G508 PolarHBondContact O-N 3.34Å
505	T	94.5	Very high	92.6	Very high	22 Å²	22	45.5 Å²	45.5	14%	0.135	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-42.5	-178.7	-57.4	0	0	0	0	111.3	V501 G508 L626 A627	V501-T505 VanDerWaalsContact O-CB 3.24Å; V501-T505 WeakPolarHBondContact O-CB 3.47Å; V501-T505 PolarHBondContact O-N 3.41Å; V501-T505 PolarHBondContact O-OG1 3.27Å; T505-G508 PolarHBondContact O-N 3.43Å; T505-L626 HydrophobicContact CG2-CB 3.69Å; T505-A627 HydrophobicContact CG2-CB 3.85Å; T505-A627 VanDerWaalsContact CG2-N 3.35Å
506	V	93	Very high	92.3	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-73.3	-39.5	-177.2	173.3	0	0	0	0	111.9	G502 G508 V509 L517 L626 I874	G502-V506 WeakPolarHBondContact O-CB 3.4Å; G502-V506 WeakPolarHBondContact O-CG2 3.41Å; G502-V506 PolarHBondContact O-N 3.19Å; G502-V506 VanDerWaalsContact O-N 3.09Å; V506-G508 PolarHBondContact O-N 2.89Å; V506-V509 WeakPolarHBondContact O-CB 3.34Å; V506-V509 PolarHBondContact O-N 2.91Å; V506-L517 HydrophobicContact CG1-CD2 4Å; V506-L626 HydrophobicContact CG2-CD2 3.92Å; V506-I874 HydrophobicContact CB-CD1 3.9Å; V506-I874 HydrophobicContact CG1-CB 3.95Å; V506-I874 HydrophobicContact CG1-CD1 4.04Å; V506-I874 HydrophobicContact CG1-CG2 3.87Å
507	W	93.5	Very high	92.2	Very high	108 Å²	108	40.7 Å²	40.7	41%	0.409	22%	0.22	S	C	.	.	H	α-helix	trans	-61.7	-25.1	173.9	-84.8	113.6	0	0	0	113.1	Y503 V509 I874 Y877 I878	Y503-W507 AromaticContact CD1-CD1 4Å; Y503-W507 AromaticContact CD2-NE1 3.88Å; Y503-W507 AromaticContact CE1-CD1 3.7Å; Y503-W507 AromaticContact CE1-NE1 3.96Å; Y503-W507 AromaticContact CE2-CD1 3.72Å; Y503-W507 AromaticContact CE2-NE1 3.26Å; Y503-W507 VanDerWaalsContact CE2-NE1 3.26Å; Y503-W507 AromaticContact CZ-CD1 3.55Å; Y503-W507 AromaticContact CZ-NE1 3.3Å; Y503-W507 VanDerWaalsContact CZ-NE1 3.3Å; Y503-W507 VanDerWaalsContact O-CD1 3.22Å; Y503-W507 PolarHBondContact O-N 3.16Å; Y503-W507 PolarHBondContact OH-NE1 3.26Å; W507-V509 VanDerWaalsContact C-N 3.33Å; W507-I874 HydrophobicContact CD2-CG2 4.11Å; W507-I874 HydrophobicContact CG-CG2 4.49Å; W507-I874 HydrophobicContact CZ2-CG2 4.12Å; W507-Y877 HydrophobicContact CH2-CD1 4.22Å; W507-Y877 HydrophobicContact CH2-CE1 4.26Å; W507-Y877 HydrophobicContact CZ2-CD1 4.22Å; W507-Y877 HydrophobicContact CZ2-CE1 4.38Å; W507-I878 HydrophobicContact CE3-CD1 4.38Å; W507-I878 HydrophobicContact CH2-CD1 4.23Å; W507-I878 HydrophobicContact CH2-CG1 3.91Å; W507-I878 HydrophobicContact CZ3-CD1 3.92Å; W507-I878 HydrophobicContact CZ3-CG1 4.02Å
508	G	92	Very high	91.8	Very high	43 Å²	43	37.2 Å²	37.2	44%	0.443	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.7	175	0	0	0	0	0	114.9	H504 T505 V506 S630	H504-G508 PolarHBondContact O-N 3.34Å; T505-G508 PolarHBondContact O-N 3.43Å; V506-G508 PolarHBondContact O-N 2.89Å; G508-S630 VanDerWaalsContact O-CA 3.24Å; G508-S630 WeakPolarHBondContact O-CA 3.5Å; G508-S630 WeakPolarHBondContact O-CB 3.4Å
509	V	92.6	Very high	91.4	Very high	6 Å²	6	36.9 Å²	36.9	4%	0.036	20%	0.198	C	C	.	.	S	Bend	trans	-71.3	134.5	179.5	172.7	0	0	0	0	110.2	V506 W507 L513 L517 L629	V506-V509 WeakPolarHBondContact O-CB 3.34Å; V506-V509 PolarHBondContact O-N 2.91Å; W507-V509 VanDerWaalsContact C-N 3.33Å; V509-L513 HydrophobicContact CG1-CB 4.29Å; V509-L517 HydrophobicContact CB-CD2 4.29Å; V509-L517 HydrophobicContact CG1-CB 4.36Å; V509-L517 HydrophobicContact CG1-CD2 4.12Å; V509-L517 HydrophobicContact CG2-CD1 4.34Å; V509-L517 HydrophobicContact CG2-CD2 4.18Å; V509-L629 HydrophobicContact CG1-CB 4Å; V509-L629 HydrophobicContact CG2-CB 4.14Å
510	T	89.5	Confident	91.3	Very high	33 Å²	33	36 Å²	36	20%	0.202	19%	0.19	C	C	.	.			trans	-62	132.6	176.3	-42	0	0	0	0	109.8	A512 L513 L629 S630	T510-A512 HydrophobicContact CG2-CB 3.94Å; T510-A512 PolarHBondContact O-N 2.8Å; T510-L513 WeakPolarHBondContact O-CA 3.29Å; T510-L513 PolarHBondContact O-N 2.65Å; T510-L629 PolarHBondContact N-O 3.3Å; T510-S630 PolarHBondContact OG1-O 2.75Å
511	P	86.4	Confident	91.2	Very high	52 Å²	52	31.2 Å²	31.2	34%	0.338	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-54.8	-28.5	178.3	-29.8	37.2	0	0	0	114.2	L513 H514 E986	P511-L513 PolarHBondContact O-N 3.18Å; P511-H514 PolarHBondContact O-N 2.89Å; P511-E986 HydrophobicContact CB-CG 4.38Å; P511-E986 WeakPolarHBondContact CB-OE1 3.26Å
512	A	85.1	Confident	90.9	Very high	9 Å²	9	28.2 Å²	28.2	7%	0.074	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-55.3	-30.1	172.5	0	0	0	0	0	113.8	T510 Q632 N971	T510-A512 HydrophobicContact CG2-CB 3.94Å; T510-A512 PolarHBondContact O-N 2.8Å; A512-Q632 VanDerWaalsContact CB-NE2 3.32Å; A512-N971 WeakPolarHBondContact CA-ND2 3.36Å; A512-N971 PolarHBondContact O-ND2 3.47Å
513	L	90.2	Very high	90.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-108.3	12.8	-170.7	-62.5	175.2	0	0	0	113.7	V509 T510 P511 S515 P516 L517 L572 F575 L629 Q632 C635	V509-L513 HydrophobicContact CG1-CB 4.29Å; T510-L513 WeakPolarHBondContact O-CA 3.29Å; T510-L513 PolarHBondContact O-N 2.65Å; P511-L513 PolarHBondContact O-N 3.18Å; L513-S515 VanDerWaalsContact C-N 3.29Å; L513-S515 PolarHBondContact O-N 3.21Å; L513-P516 HydrophobicContact CB-CG 4.45Å; L513-P516 HydrophobicContact CD2-CG 4.03Å; L513-P516 VanDerWaalsContact O-CD 3.23Å; L513-P516 WeakPolarHBondContact O-CD 3.21Å; L513-L517 WeakPolarHBondContact O-CB 3.44Å; L513-L517 PolarHBondContact O-N 2.83Å; L513-L572 HydrophobicContact CD2-CD2 4.18Å; L513-F575 HydrophobicContact CD2-CD2 4.02Å; L513-F575 HydrophobicContact CD2-CE2 3.85Å; L513-F575 HydrophobicContact CD2-CZ 4.2Å; L513-L629 HydrophobicContact CD1-CB 4.46Å; L513-L629 WeakPolarHBondContact CD1-O 3.16Å; L513-Q632 HydrophobicContact CD1-CG 4.29Å; L513-Q632 HydrophobicContact CD2-CG 4.42Å; L513-Q632 HydrophobicContact CG-CG 4.43Å; L513-C635 HydrophobicContact CD1-CB 3.9Å
514	H	88.1	Confident	90.8	Very high	20 Å²	20	22.6 Å²	22.6	9%	0.093	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-34.4	176.5	-73.5	176.1	0	0	0	113.9	P511 L517 M518 L875	P511-H514 PolarHBondContact O-N 2.89Å; H514-L517 WeakPolarHBondContact O-CB 3.42Å; H514-L517 PolarHBondContact O-N 3.4Å; H514-M518 PolarHBondContact O-N 3.28Å; H514-L875 HydrophobicContact CB-CD2 3.91Å
515	S	85.2	Confident	90.8	Very high	14 Å²	14	16.5 Å²	16.5	10%	0.098	10%	0.097	C	C	.	.	H	α-helix	trans	-70.3	-47	176.5	-56.2	0	0	0	0	111.6	L513 L517 M518 S519 M571	L513-S515 VanDerWaalsContact C-N 3.29Å; L513-S515 PolarHBondContact O-N 3.21Å; S515-L517 VanDerWaalsContact C-N 3.28Å; S515-L517 PolarHBondContact O-N 3.18Å; S515-M518 PolarHBondContact O-N 3.5Å; S515-S519 PolarHBondContact O-N 3.43Å; S515-S519 VanDerWaalsContact O-N 3.12Å; S515-M571 VanDerWaalsContact CB-CE 3.49Å
516	P	89.2	Confident	90.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-53.9	-38.8	166	-28.4	33	0	0	0	114.5	L513 M518 S519 V520 M571 L572 F575 L629	L513-P516 HydrophobicContact CB-CG 4.45Å; L513-P516 HydrophobicContact CD2-CG 4.03Å; L513-P516 VanDerWaalsContact O-CD 3.23Å; L513-P516 WeakPolarHBondContact O-CD 3.21Å; P516-M518 PolarHBondContact O-N 3.02Å; P516-S519 CarbonylContact O-C 3.58Å; P516-S519 WeakPolarHBondContact O-CB 3.4Å; P516-S519 PolarHBondContact O-N 2.93Å; P516-S519 VanDerWaalsContact O-N 3.12Å; P516-V520 WeakPolarHBondContact O-CG2 3.33Å; P516-V520 PolarHBondContact O-N 2.82Å; P516-M571 HydrophobicContact CG-CB 4.22Å; P516-M571 HydrophobicContact CG-CE 4.15Å; P516-L572 HydrophobicContact CB-CD2 3.64Å; P516-L572 HydrophobicContact CB-CG 4.46Å; P516-L572 HydrophobicContact CG-CD2 3.93Å; P516-F575 HydrophobicContact CG-CE2 4.31Å; P516-L629 HydrophobicContact CB-CD2 3.9Å
517	L	91.9	Very high	90.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-44.2	176.3	172.7	65.1	0	0	0	112.2	V506 V509 L513 H514 S515 S519 V520 T521 L626 L629 L875	V506-L517 HydrophobicContact CG1-CD2 4Å; V509-L517 HydrophobicContact CB-CD2 4.29Å; V509-L517 HydrophobicContact CG1-CB 4.36Å; V509-L517 HydrophobicContact CG1-CD2 4.12Å; V509-L517 HydrophobicContact CG2-CD1 4.34Å; V509-L517 HydrophobicContact CG2-CD2 4.18Å; L513-L517 WeakPolarHBondContact O-CB 3.44Å; L513-L517 PolarHBondContact O-N 2.83Å; H514-L517 WeakPolarHBondContact O-CB 3.42Å; H514-L517 PolarHBondContact O-N 3.4Å; S515-L517 VanDerWaalsContact C-N 3.28Å; S515-L517 PolarHBondContact O-N 3.18Å; L517-S519 VanDerWaalsContact C-N 3.28Å; L517-S519 PolarHBondContact O-N 3.4Å; L517-V520 PolarHBondContact O-N 2.96Å; L517-T521 HydrophobicContact CD1-CG2 4.15Å; L517-T521 WeakPolarHBondContact O-CB 3.49Å; L517-T521 WeakPolarHBondContact O-CG2 3.41Å; L517-T521 PolarHBondContact O-N 2.88Å; L517-T521 PolarHBondContact O-OG1 3.28Å; L517-L626 HydrophobicContact CD1-CB 4.39Å; L517-L626 HydrophobicContact CD1-CD2 3.76Å; L517-L626 HydrophobicContact CD1-CG 3.56Å; L517-L629 HydrophobicContact CB-CD2 3.91Å; L517-L875 HydrophobicContact CD2-CD1 4.02Å; L517-L875 HydrophobicContact CD2-CD2 4.24Å; L517-L875 HydrophobicContact CD2-CG 4.3Å; L517-L875 HydrophobicContact CG-CD1 4.42Å
518	M	87.8	Confident	90.7	Very high	36 Å²	36	10.2 Å²	10.2	18%	0.177	7%	0.07	C	C	.	.	H	α-helix	trans	-60.5	-39.2	173	-70.8	-173.6	-71.9	0	0	111.7	H514 S515 P516 T521 N522 T839 L875	H514-M518 PolarHBondContact O-N 3.28Å; S515-M518 PolarHBondContact O-N 3.5Å; P516-M518 PolarHBondContact O-N 3.02Å; M518-T521 WeakPolarHBondContact CA-OG1 3.47Å; M518-T521 PolarHBondContact O-OG1 2.94Å; M518-N522 WeakPolarHBondContact O-CB 3.25Å; M518-N522 PolarHBondContact O-N 3.37Å; M518-T839 HydrophobicContact SD-CG2 3.66Å; M518-L875 HydrophobicContact CG-CD1 3.61Å; M518-L875 HydrophobicContact SD-CD1 4.41Å
519	S	88.9	Confident	90.8	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.007	5%	0.049	C	C	.	.	H	α-helix	trans	-66.9	-43.7	176.5	-172.9	0	0	0	0	112.6	S515 P516 L517 N522 A523 G564 I567 T568	S515-S519 PolarHBondContact O-N 3.43Å; S515-S519 VanDerWaalsContact O-N 3.12Å; P516-S519 CarbonylContact O-C 3.58Å; P516-S519 WeakPolarHBondContact O-CB 3.4Å; P516-S519 PolarHBondContact O-N 2.93Å; P516-S519 VanDerWaalsContact O-N 3.12Å; L517-S519 VanDerWaalsContact C-N 3.28Å; L517-S519 PolarHBondContact O-N 3.4Å; S519-N522 PolarHBondContact O-N 3.4Å; S519-A523 WeakPolarHBondContact O-CB 3.31Å; S519-A523 PolarHBondContact O-N 2.72Å; S519-G564 PolarHBondContact OG-O 2.84Å; S519-I567 WeakPolarHBondContact OG-CG2 3.46Å; S519-T568 VanDerWaalsContact C-OG1 3.31Å; S519-T568 VanDerWaalsContact CB-OG1 3.28Å; S519-T568 WeakPolarHBondContact CB-OG1 3.25Å; S519-T568 PolarHBondContact OG-N 3.39Å; S519-T568 PolarHBondContact OG-OG1 2.8Å
520	V	92.4	Very high	90.8	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-62.7	-47.7	176.8	171.6	0	0	0	0	111	P516 L517 N522 A523 I524 T568 A625 L626 L629	P516-V520 WeakPolarHBondContact O-CG2 3.33Å; P516-V520 PolarHBondContact O-N 2.82Å; L517-V520 PolarHBondContact O-N 2.96Å; V520-N522 VanDerWaalsContact C-N 3.29Å; V520-N522 PolarHBondContact O-N 3.48Å; V520-A523 WeakPolarHBondContact O-CB 3.42Å; V520-A523 PolarHBondContact O-N 2.84Å; V520-A523 VanDerWaalsContact O-N 3.09Å; V520-I524 HydrophobicContact CG1-CD1 3.6Å; V520-I524 HydrophobicContact CG1-CG1 4.25Å; V520-I524 VanDerWaalsContact O-CG1 3.32Å; V520-I524 WeakPolarHBondContact O-CG1 3.4Å; V520-I524 PolarHBondContact O-N 3.17Å; V520-T568 HydrophobicContact CG2-CG2 3.33Å; V520-T568 PolarHBondContact N-OG1 3.25Å; V520-A625 HydrophobicContact CG1-CB 4.22Å; V520-L626 HydrophobicContact CG1-CD1 3.81Å; V520-L629 HydrophobicContact CG2-CD1 4.11Å; V520-L629 HydrophobicContact CG2-CD2 4.23Å
521	T	93.4	Very high	90.9	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-62.5	-38.3	179.3	46.5	0	0	0	0	111.8	L517 M518 I524 S525 L626 N842 I868	L517-T521 HydrophobicContact CD1-CG2 4.15Å; L517-T521 WeakPolarHBondContact O-CB 3.49Å; L517-T521 WeakPolarHBondContact O-CG2 3.41Å; L517-T521 PolarHBondContact O-N 2.88Å; L517-T521 PolarHBondContact O-OG1 3.28Å; M518-T521 WeakPolarHBondContact CA-OG1 3.47Å; M518-T521 PolarHBondContact O-OG1 2.94Å; T521-I524 PolarHBondContact O-N 3.11Å; T521-S525 WeakPolarHBondContact O-CB 3.34Å; T521-S525 PolarHBondContact O-N 2.93Å; T521-S525 PolarHBondContact O-OG 2.94Å; T521-L626 HydrophobicContact CG2-CD1 4.23Å; T521-L626 HydrophobicContact CG2-CD2 3.97Å; T521-L626 HydrophobicContact CG2-CG 4.38Å; T521-N842 PolarHBondContact OG1-ND2 2.97Å; T521-I868 HydrophobicContact CG2-CG1 4.34Å
522	N	90.6	Very high	91.3	Very high	1 Å²	1	3.9 Å²	3.9	1%	0.005	2%	0.022	C	C	.	.	H	α-helix	trans	-69.2	-32.3	172.6	179.2	81.4	0	0	0	113.6	M518 S519 V520 S525 F697 H698	M518-N522 WeakPolarHBondContact O-CB 3.25Å; M518-N522 PolarHBondContact O-N 3.37Å; S519-N522 PolarHBondContact O-N 3.4Å; V520-N522 VanDerWaalsContact C-N 3.29Å; V520-N522 PolarHBondContact O-N 3.48Å; N522-S525 WeakPolarHBondContact CA-OG 3.45Å; N522-S525 PolarHBondContact O-OG 3.07Å; N522-F697 WeakPolarHBondContact ND2-CB 3.3Å; N522-F697 VanDerWaalsContact ND2-CD2 3.27Å; N522-F697 WeakPolarHBondContact ND2-CD2 3.21Å; N522-F697 WeakPolarHBondContact OD1-CB 3.32Å; N522-H698 PolarHBondContact OD1-CD2 3.23Å; N522-H698 PolarHBondContact OD1-N 3.29Å
523	A	92.9	Very high	91.8	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-67	-45.8	173.7	0	0	0	0	0	111.1	S519 V520 G526 F565	S519-A523 WeakPolarHBondContact O-CB 3.31Å; S519-A523 PolarHBondContact O-N 2.72Å; V520-A523 WeakPolarHBondContact O-CB 3.42Å; V520-A523 PolarHBondContact O-N 2.84Å; V520-A523 VanDerWaalsContact O-N 3.09Å; A523-G526 PolarHBondContact O-N 2.89Å; A523-F565 HydrophobicContact CB-CD1 3.95Å; A523-F565 HydrophobicContact CB-CD2 3.93Å; A523-F565 HydrophobicContact CB-CE1 4.02Å; A523-F565 HydrophobicContact CB-CE2 4Å; A523-F565 HydrophobicContact CB-CG 3.89Å; A523-F565 HydrophobicContact CB-CZ 4.04Å
524	I	95.3	Very high	92	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-68.1	-35.3	179.3	-65.3	173.3	0	0	0	111	V520 T521 G526 I527 F565 C622 A625 L626 V646 V864 I868	V520-I524 HydrophobicContact CG1-CD1 3.6Å; V520-I524 HydrophobicContact CG1-CG1 4.25Å; V520-I524 VanDerWaalsContact O-CG1 3.32Å; V520-I524 WeakPolarHBondContact O-CG1 3.4Å; V520-I524 PolarHBondContact O-N 3.17Å; T521-I524 PolarHBondContact O-N 3.11Å; I524-G526 PolarHBondContact O-N 3.23Å; I524-I527 HydrophobicContact CG2-CD1 4.24Å; I524-I527 VanDerWaalsContact O-CB 3.25Å; I524-I527 WeakPolarHBondContact O-CB 3.25Å; I524-I527 WeakPolarHBondContact O-CG1 3.49Å; I524-I527 PolarHBondContact O-N 3.17Å; I524-F565 HydrophobicContact CG1-CZ 4.3Å; I524-C622 HydrophobicContact CD1-CB 4.3Å; I524-C622 HydrophobicContact CG2-CB 4.3Å; I524-A625 HydrophobicContact CD1-CB 3.87Å; I524-L626 HydrophobicContact CD1-CD1 3.83Å; I524-V646 HydrophobicContact CG1-CG2 4.33Å; I524-V864 HydrophobicContact CG2-CG1 3.42Å; I524-V864 VanDerWaalsContact CG2-CG1 3.42Å; I524-V864 HydrophobicContact CG2-CG2 4.46Å; I524-I868 HydrophobicContact CG2-CD1 4.2Å
525	S	93.6	Very high	92.3	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.032	C	C	.	.	G	3₁₀ helix	trans	-63	-15.5	177.7	70.5	0	0	0	0	113.7	T521 N522 I527 T528 V701	T521-S525 WeakPolarHBondContact O-CB 3.34Å; T521-S525 PolarHBondContact O-N 2.93Å; T521-S525 PolarHBondContact O-OG 2.94Å; N522-S525 WeakPolarHBondContact CA-OG 3.45Å; N522-S525 PolarHBondContact O-OG 3.07Å; S525-I527 PolarHBondContact O-N 3.06Å; S525-I527 VanDerWaalsContact O-N 3.09Å; S525-T528 PolarHBondContact O-N 3.49Å; S525-T528 PolarHBondContact O-OG1 3.31Å; S525-T528 VanDerWaalsContact O-OG1 3.05Å; S525-V701 WeakPolarHBondContact OG-CG2 3.32Å
526	G	92.4	Very high	92.7	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.03	C	C	.	.	G	3₁₀ helix	trans	-58.5	-11.3	165.6	0	0	0	0	0	114.4	A523 I524 T528 A529 S557	A523-G526 PolarHBondContact O-N 2.89Å; I524-G526 PolarHBondContact O-N 3.23Å; G526-T528 PolarHBondContact O-N 3.18Å; G526-T528 VanDerWaalsContact O-N 3.11Å; G526-A529 VanDerWaalsContact O-CB 3.26Å; G526-A529 WeakPolarHBondContact O-CB 3.12Å; G526-A529 PolarHBondContact O-N 3.31Å; G526-S557 WeakPolarHBondContact O-CB 3.35Å
527	I	94.2	Very high	92.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	-60.3	-11.9	169.8	-83	175.8	0	0	0	113.3	I524 S525 A529 A530 V646 A649 L860 L861 V864	I524-I527 HydrophobicContact CG2-CD1 4.24Å; I524-I527 VanDerWaalsContact O-CB 3.25Å; I524-I527 WeakPolarHBondContact O-CB 3.25Å; I524-I527 WeakPolarHBondContact O-CG1 3.49Å; I524-I527 PolarHBondContact O-N 3.17Å; S525-I527 PolarHBondContact O-N 3.06Å; S525-I527 VanDerWaalsContact O-N 3.09Å; I527-A529 PolarHBondContact O-N 3.1Å; I527-A530 HydrophobicContact CG2-CB 4.39Å; I527-A530 WeakPolarHBondContact O-CA 3.36Å; I527-A530 VanDerWaalsContact O-CB 3.25Å; I527-A530 WeakPolarHBondContact O-CB 3.43Å; I527-A530 PolarHBondContact O-N 3.3Å; I527-V646 HydrophobicContact CD1-CG2 3.9Å; I527-V646 HydrophobicContact CG1-CB 4.45Å; I527-V646 HydrophobicContact CG1-CG1 4.2Å; I527-V646 HydrophobicContact CG1-CG2 3.99Å; I527-A649 HydrophobicContact CD1-CB 3.91Å; I527-A649 HydrophobicContact CG1-CB 4.16Å; I527-L860 HydrophobicContact CD1-CD1 4.45Å; I527-L860 HydrophobicContact CG2-CD2 4.43Å; I527-L861 HydrophobicContact CG2-CD2 3.38Å; I527-V864 HydrophobicContact CD1-CG1 4.29Å; I527-V864 HydrophobicContact CD1-CG2 4.03Å
528	T	93.4	Very high	92.9	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-50.1	-24.2	161.8	42	0	0	0	0	112.4	S525 G526 A530 G531 A532 S557 V701 L849 E852	S525-T528 PolarHBondContact O-N 3.49Å; S525-T528 PolarHBondContact O-OG1 3.31Å; S525-T528 VanDerWaalsContact O-OG1 3.05Å; G526-T528 PolarHBondContact O-N 3.18Å; G526-T528 VanDerWaalsContact O-N 3.11Å; T528-A530 VanDerWaalsContact C-N 3.3Å; T528-A530 PolarHBondContact O-N 3.41Å; T528-G531 PolarHBondContact O-N 2.9Å; T528-A532 PolarHBondContact O-N 2.83Å; T528-S557 WeakPolarHBondContact CB-OG 3.32Å; T528-S557 VanDerWaalsContact OG1-CB 3.32Å; T528-S557 WeakPolarHBondContact OG1-CB 3.33Å; T528-S557 PolarHBondContact OG1-OG 3.47Å; T528-V701 HydrophobicContact CG2-CG1 3.78Å; T528-L849 HydrophobicContact CG2-CD1 4.41Å; T528-L849 HydrophobicContact CG2-CD2 3.38Å; T528-L849 HydrophobicContact CG2-CG 3.75Å; T528-E852 WeakPolarHBondContact CG2-OE1 3.48Å
529	A	94.4	Very high	93.1	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59.9	-35.1	169.9	0	0	0	0	0	113.2	G526 I527 A532 L533 S557 I561 M650	G526-A529 VanDerWaalsContact O-CB 3.26Å; G526-A529 WeakPolarHBondContact O-CB 3.12Å; G526-A529 PolarHBondContact O-N 3.31Å; I527-A529 PolarHBondContact O-N 3.1Å; A529-A532 PolarHBondContact O-N 3.45Å; A529-L533 WeakPolarHBondContact O-CB 3.45Å; A529-L533 WeakPolarHBondContact O-CG 3.17Å; A529-L533 PolarHBondContact O-N 3.28Å; A529-S557 PolarHBondContact N-OG 2.94Å; A529-I561 HydrophobicContact CB-CD1 4.32Å; A529-M650 HydrophobicContact CB-CE 3.6Å; A529-M650 HydrophobicContact CB-SD 3.76Å
530	A	92.7	Very high	93.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.9	-43.6	175.6	0	0	0	0	0	111.3	I527 T528 A532 L533 L534 M650 T653 L861	I527-A530 HydrophobicContact CG2-CB 4.39Å; I527-A530 WeakPolarHBondContact O-CA 3.36Å; I527-A530 VanDerWaalsContact O-CB 3.25Å; I527-A530 WeakPolarHBondContact O-CB 3.43Å; I527-A530 PolarHBondContact O-N 3.3Å; T528-A530 VanDerWaalsContact C-N 3.3Å; T528-A530 PolarHBondContact O-N 3.41Å; A530-A532 PolarHBondContact O-N 3.09Å; A530-L533 PolarHBondContact O-N 3.37Å; A530-L534 PolarHBondContact O-N 2.83Å; A530-M650 HydrophobicContact CB-SD 4.23Å; A530-T653 HydrophobicContact CB-CG2 4.41Å; A530-T653 WeakPolarHBondContact O-CG2 3.23Å; A530-L861 HydrophobicContact CB-CD2 4.34Å
531	G	91.3	Very high	93.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-47.6	172	0	0	0	0	0	111.5	T528 L533 L534 M856	T528-G531 PolarHBondContact O-N 2.9Å; G531-L533 VanDerWaalsContact C-N 3.35Å; G531-L533 PolarHBondContact O-N 3.5Å; G531-L534 PolarHBondContact O-N 3.44Å; G531-M856 VanDerWaalsContact CA-SD 3.55Å; G531-M856 VanDerWaalsContact O-CE 3.27Å; G531-M856 WeakPolarHBondContact O-CE 3.48Å
532	A	94.9	Very high	93.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-40.4	177.3	0	0	0	0	0	113.3	T528 A529 A530 L534 L535 M536 A553 C554	T528-A532 PolarHBondContact O-N 2.83Å; A529-A532 PolarHBondContact O-N 3.45Å; A530-A532 PolarHBondContact O-N 3.09Å; A532-L534 VanDerWaalsContact C-N 3.28Å; A532-L534 PolarHBondContact O-N 3.21Å; A532-L535 PolarHBondContact O-N 3.23Å; A532-L535 VanDerWaalsContact O-N 3.07Å; A532-M536 WeakPolarHBondContact O-CG 3.49Å; A532-M536 PolarHBondContact O-N 2.94Å; A532-A553 HydrophobicContact CB-CB 3.74Å; A532-C554 HydrophobicContact CB-CB 3.85Å
533	L	95.2	Very high	93.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.6	-37.7	178.4	-79.7	170.6	0	0	0	112.5	A529 A530 G531 L535 M536 M650 T653 I654 L657 M667 I671	A529-L533 WeakPolarHBondContact O-CB 3.45Å; A529-L533 WeakPolarHBondContact O-CG 3.17Å; A529-L533 PolarHBondContact O-N 3.28Å; A530-L533 PolarHBondContact O-N 3.37Å; G531-L533 VanDerWaalsContact C-N 3.35Å; G531-L533 PolarHBondContact O-N 3.5Å; L533-L535 PolarHBondContact O-N 3.14Å; L533-M536 HydrophobicContact CD2-SD 3.87Å; L533-M536 PolarHBondContact O-N 2.78Å; L533-M536 VanDerWaalsContact O-N 3.16Å; L533-M650 HydrophobicContact CD1-CE 3.34Å; L533-M650 HydrophobicContact CD1-SD 4.03Å; L533-M650 HydrophobicContact CG-CE 4.26Å; L533-T653 HydrophobicContact CB-CG2 3.84Å; L533-T653 HydrophobicContact CD1-CG2 4.29Å; L533-I654 HydrophobicContact CD1-CD1 4.28Å; L533-I654 HydrophobicContact CD1-CG1 3.84Å; L533-I654 HydrophobicContact CD2-CG1 4.45Å; L533-L657 VanDerWaalsContact O-CD1 3.31Å; L533-L657 WeakPolarHBondContact O-CD1 3.46Å; L533-M667 HydrophobicContact CD2-CB 3.74Å; L533-M667 HydrophobicContact CD2-CE 4.19Å; L533-M667 HydrophobicContact CD2-CG 3.51Å; L533-M667 HydrophobicContact CD2-SD 3.8Å; L533-I671 HydrophobicContact CD1-CD1 4.42Å; L533-I671 HydrophobicContact CD2-CD1 4.36Å
534	L	93.4	Very high	93.6	Very high	55 Å²	55	35.4 Å²	35.4	29%	0.288	19%	0.191	S	C	.	.	H	α-helix	trans	-62.3	-22.9	177.8	-67	172.1	0	0	0	113.1	A530 G531 A532 T653 L657 M856	A530-L534 PolarHBondContact O-N 2.83Å; G531-L534 PolarHBondContact O-N 3.44Å; A532-L534 VanDerWaalsContact C-N 3.28Å; A532-L534 PolarHBondContact O-N 3.21Å; L534-T653 HydrophobicContact CD2-CG2 3.77Å; L534-T653 HydrophobicContact CG-CG2 3.83Å; L534-L657 HydrophobicContact CD2-CD1 4.28Å; L534-L657 HydrophobicContact CD2-CD2 3.88Å; L534-L657 HydrophobicContact CD2-CG 4.1Å; L534-M856 HydrophobicContact CB-SD 4.31Å; L534-M856 HydrophobicContact CD1-CB 4.43Å; L534-M856 HydrophobicContact CD1-SD 3.73Å
535	L	94.3	Very high	93.5	Very high	19 Å²	19	40 Å²	40	10%	0.099	22%	0.219	C	C	.	.	H	α-helix	trans	-103.7	-4.3	179.7	-57	176	0	0	0	113.2	A532 L533 A550 T708 A711 N712 M856	A532-L535 PolarHBondContact O-N 3.23Å; A532-L535 VanDerWaalsContact O-N 3.07Å; L533-L535 PolarHBondContact O-N 3.14Å; L535-A550 HydrophobicContact CB-CB 3.64Å; L535-T708 HydrophobicContact CD1-CG2 3.81Å; L535-T708 WeakPolarHBondContact CD1-O 3.32Å; L535-A711 HydrophobicContact CD1-CB 3.9Å; L535-N712 HydrophobicContact CD1-CB 3.75Å; L535-N712 HydrophobicContact CD2-CB 4.1Å; L535-N712 WeakPolarHBondContact CD2-OD1 3.5Å; L535-M856 HydrophobicContact CD1-CE 3.61Å; L535-M856 HydrophobicContact CD2-CE 4.31Å; L535-M856 HydrophobicContact CG-CE 3.8Å
536	M	95.4	Very high	93.5	Very high	11 Å²	11	40.8 Å²	40.8	5%	0.054	22%	0.224	C	C	.	.			trans	-73.5	138.3	174.2	-73.1	-178.1	66.4	0	0	109.8	A532 L533 A550 C554 L663 Q666 M667	A532-M536 WeakPolarHBondContact O-CG 3.49Å; A532-M536 PolarHBondContact O-N 2.94Å; L533-M536 HydrophobicContact CD2-SD 3.87Å; L533-M536 PolarHBondContact O-N 2.78Å; L533-M536 VanDerWaalsContact O-N 3.16Å; M536-A550 HydrophobicContact CG-CB 3.88Å; M536-C554 HydrophobicContact SD-CB 3.65Å; M536-L663 HydrophobicContact CB-CD1 4.41Å; M536-Q666 HydrophobicContact CE-CG 3.82Å; M536-M667 HydrophobicContact CB-CE 3.92Å; M536-M667 HydrophobicContact CE-CB 4.33Å; M536-M667 HydrophobicContact CE-CG 3.77Å; M536-M667 HydrophobicContact SD-CG 4.08Å
537	G	92.9	Very high	93.7	Very high	11 Å²	11	42.5 Å²	42.5	11%	0.113	23%	0.232	C	C	.	.			trans	-160.8	-176.6	179.1	0	0	0	0	0	110.6	Q547	G537-Q547 PolarHBondContact O-OE1 3.42Å
538	G	91.7	Very high	93.8	Very high	28 Å²	28	45 Å²	45	29%	0.289	25%	0.25	S	C	.	.	S	Bend	trans	101	-141.3	-173.7	0	0	0	0	0	111.3
539	Q	91.5	Very high	94	Very high	129 Å²	129	46.8 Å²	46.8	60%	0.603	26%	0.259	S	S	*	.	S	Bend	trans	-124.3	-118	178.9	-66.2	-175.5	-8.7	0	0	109.5	M541 E662 L663 Q666	Q539-M541 PolarHBondContact N-O 3.38Å; Q539-E662 HydrophobicContact CB-CB 3.94Å; Q539-E662 CarbonylContact O-C 3.33Å; Q539-L663 WeakPolarHBondContact O-CA 3.37Å; Q539-L663 PolarHBondContact O-N 3.16Å; Q539-Q666 PolarHBondContact O-OE1 3.12Å
540	Y	93.2	Very high	94	Very high	145 Å²	145	46.8 Å²	46.8	57%	0.569	26%	0.259	S	S	*	.	S	Bend	trans	-71.4	-24.4	171.4	-71	-72.6	0	0	0	112.7	E662 A665	Y540-E662 HydrophobicContact CD1-CB 4.36Å; Y540-E662 HydrophobicContact CD2-CB 3.98Å; Y540-E662 HydrophobicContact CD2-CG 3.91Å; Y540-E662 HydrophobicContact CE1-CB 4.32Å; Y540-E662 HydrophobicContact CE1-CG 4.44Å; Y540-E662 HydrophobicContact CE2-CB 3.94Å; Y540-E662 HydrophobicContact CE2-CG 3.44Å; Y540-E662 VanDerWaalsContact CE2-CG 3.44Å; Y540-E662 HydrophobicContact CG-CB 4.2Å; Y540-A665 HydrophobicContact CD1-CB 4.11Å; Y540-A665 HydrophobicContact CE1-CB 3.89Å
541	M	93.6	Very high	94.2	Very high	145 Å²	145	47.3 Å²	47.3	71%	0.714	26%	0.263	S	S	*	.	S	Bend	trans	-129.8	148.5	179.6	-65	-63.2	-119.1	0	0	109.3	Q539	Q539-M541 PolarHBondContact N-O 3.38Å
542	P	93.6	Very high	94.4	Very high	41 Å²	41	51 Å²	51	27%	0.266	28%	0.282	S	S	.	.			trans	-64.2	139.2	174.5	27.8	-34.3	0	0	0	110.4	Q547 S548	P542-Q547 HydrophobicContact CB-CB 3.58Å; P542-S548 WeakPolarHBondContact CG-OG 3.45Å
543	T	93.1	Very high	94.5	Very high	114 Å²	114	51 Å²	51	70%	0.699	28%	0.282	S	S	*	.			trans	-99.7	-17.1	179.9	60.9	0	0	0	0	112.9	Q547	T543-Q547 PolarHBondContact OG1-OE1 3.27Å
544	S	94.7	Very high	94.6	Very high	45 Å²	45	51 Å²	51	32%	0.315	28%	0.282	S	S	.	.	S	Bend	trans	-126.6	163.5	-179.9	72.3	0	0	0	0	112.8	P546 Q547 S548	S544-P546 WeakPolarHBondContact OG-CD 3.17Å; S544-Q547 PolarHBondContact O-N 2.85Å; S544-Q547 VanDerWaalsContact OG-CD 3.25Å; S544-Q547 VanDerWaalsContact OG-CG 3.24Å; S544-Q547 WeakPolarHBondContact OG-CG 3.26Å; S544-S548 PolarHBondContact O-N 3.37Å; S544-S548 VanDerWaalsContact O-N 3.08Å; S544-S548 PolarHBondContact O-OG 3.35Å
545	V	94.4	Very high	94.7	Very high	96 Å²	96	50.8 Å²	50.8	58%	0.582	28%	0.279	S	S	*	.	H	α-helix	trans	-58.9	-47.3	176.5	177.1	0	0	0	0	111.7	Q547 S548 L549 L714	V545-Q547 VanDerWaalsContact C-N 3.32Å; V545-Q547 PolarHBondContact O-N 3.13Å; V545-S548 WeakPolarHBondContact O-CB 2.99Å; V545-S548 PolarHBondContact O-N 3.07Å; V545-L549 HydrophobicContact CG1-CD1 4.17Å; V545-L549 HydrophobicContact CG1-CG 4.28Å; V545-L549 WeakPolarHBondContact O-CG 3.38Å; V545-L549 PolarHBondContact O-N 3.23Å; V545-L714 HydrophobicContact CG1-CD1 4.34Å
546	P	94.1	Very high	94.8	Very high	17 Å²	17	50.9 Å²	50.9	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-42.9	177.6	-26	35.4	0	0	0	113.3	S544 S548 L549 A550 A711 L714 V715	S544-P546 WeakPolarHBondContact OG-CD 3.17Å; P546-S548 VanDerWaalsContact C-N 3.27Å; P546-S548 PolarHBondContact O-N 3.43Å; P546-L549 PolarHBondContact O-N 2.69Å; P546-A550 VanDerWaalsContact O-CB 3.31Å; P546-A550 WeakPolarHBondContact O-CB 3.36Å; P546-A550 PolarHBondContact O-N 3.1Å; P546-A711 HydrophobicContact CB-CB 4.3Å; P546-L714 HydrophobicContact CB-CB 4.38Å; P546-L714 HydrophobicContact CG-CB 3.51Å; P546-L714 HydrophobicContact CG-CD1 3.92Å; P546-L714 HydrophobicContact CG-CG 4.36Å; P546-V715 HydrophobicContact CB-CG2 3.66Å; P546-V715 HydrophobicContact CG-CG2 4.17Å
547	Q	96.1	Very high	94.8	Very high	37 Å²	37	50.3 Å²	50.3	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-65.5	-32.5	178.4	-66	169.4	-3.5	0	0	112	G537 P542 T543 S544 V545 S551	G537-Q547 PolarHBondContact O-OE1 3.42Å; P542-Q547 HydrophobicContact CB-CB 3.58Å; T543-Q547 PolarHBondContact OG1-OE1 3.27Å; S544-Q547 PolarHBondContact O-N 2.85Å; S544-Q547 VanDerWaalsContact OG-CD 3.25Å; S544-Q547 VanDerWaalsContact OG-CG 3.24Å; S544-Q547 WeakPolarHBondContact OG-CG 3.26Å; V545-Q547 VanDerWaalsContact C-N 3.32Å; V545-Q547 PolarHBondContact O-N 3.13Å; Q547-S551 WeakPolarHBondContact O-CB 3.44Å; Q547-S551 PolarHBondContact O-N 3.47Å; Q547-S551 PolarHBondContact O-OG 3.09Å
548	S	96.4	Very high	94.9	Very high	53 Å²	53	49.9 Å²	49.9	37%	0.371	27%	0.272	S	S	.	.	H	α-helix	trans	-70.4	-43.5	175.3	-57.4	0	0	0	0	111.5	P542 S544 V545 P546 S551 L552	P542-S548 WeakPolarHBondContact CG-OG 3.45Å; S544-S548 PolarHBondContact O-N 3.37Å; S544-S548 VanDerWaalsContact O-N 3.08Å; S544-S548 PolarHBondContact O-OG 3.35Å; V545-S548 WeakPolarHBondContact O-CB 2.99Å; V545-S548 PolarHBondContact O-N 3.07Å; P546-S548 VanDerWaalsContact C-N 3.27Å; P546-S548 PolarHBondContact O-N 3.43Å; S548-S551 PolarHBondContact O-N 3.19Å; S548-L552 WeakPolarHBondContact O-CB 3.22Å; S548-L552 PolarHBondContact O-N 3.02Å
549	L	96.2	Very high	95.1	Very high	36 Å²	36	49.2 Å²	49.2	19%	0.188	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-43.4	174.9	-63.1	176.9	0	0	0	111.2	V545 P546 L552 A553 L707 I710 A711 L714	V545-L549 HydrophobicContact CG1-CD1 4.17Å; V545-L549 HydrophobicContact CG1-CG 4.28Å; V545-L549 WeakPolarHBondContact O-CG 3.38Å; V545-L549 PolarHBondContact O-N 3.23Å; P546-L549 PolarHBondContact O-N 2.69Å; L549-L552 PolarHBondContact O-N 3.39Å; L549-A553 WeakPolarHBondContact O-CB 3.46Å; L549-A553 PolarHBondContact O-N 3.44Å; L549-L707 HydrophobicContact CD2-CD2 3.81Å; L549-I710 HydrophobicContact CD1-CB 4.47Å; L549-I710 HydrophobicContact CD1-CG2 3.92Å; L549-A711 HydrophobicContact CB-CB 3.92Å; L549-A711 HydrophobicContact CD1-CB 4.32Å; L549-L714 HydrophobicContact CD1-CD1 4.42Å
550	A	96	Very high	95.2	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-44.4	175.1	0	0	0	0	0	112.1	L535 M536 P546 L552 A553 C554	L535-A550 HydrophobicContact CB-CB 3.64Å; M536-A550 HydrophobicContact CG-CB 3.88Å; P546-A550 VanDerWaalsContact O-CB 3.31Å; P546-A550 WeakPolarHBondContact O-CB 3.36Å; P546-A550 PolarHBondContact O-N 3.1Å; A550-L552 VanDerWaalsContact C-N 3.29Å; A550-L552 PolarHBondContact O-N 3.48Å; A550-A553 PolarHBondContact O-N 2.82Å; A550-C554 WeakPolarHBondContact O-CB 3.39Å; A550-C554 PolarHBondContact O-N 3.18Å
551	S	96.5	Very high	95.2	Very high	12 Å²	12	37.5 Å²	37.5	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-38.7	175.9	-59.4	0	0	0	0	112	Q547 S548 F555 Q666	Q547-S551 WeakPolarHBondContact O-CB 3.44Å; Q547-S551 PolarHBondContact O-N 3.47Å; Q547-S551 PolarHBondContact O-OG 3.09Å; S548-S551 PolarHBondContact O-N 3.19Å; S551-F555 WeakPolarHBondContact O-CB 3.42Å; S551-F555 PolarHBondContact O-N 2.76Å; S551-Q666 PolarHBondContact OG-NE2 3.45Å
552	L	96.3	Very high	95.2	Very high	78 Å²	78	31.1 Å²	31.1	41%	0.408	18%	0.184	S	C	.	.	H	α-helix	trans	-68.8	-43.7	176.2	-178.7	60.5	0	0	0	111.7	S548 L549 A550 F555 I556 L707	S548-L552 WeakPolarHBondContact O-CB 3.22Å; S548-L552 PolarHBondContact O-N 3.02Å; L549-L552 PolarHBondContact O-N 3.39Å; A550-L552 VanDerWaalsContact C-N 3.29Å; A550-L552 PolarHBondContact O-N 3.48Å; L552-F555 HydrophobicContact CD1-CD1 4.38Å; L552-F555 PolarHBondContact O-N 3.28Å; L552-I556 HydrophobicContact CD1-CD1 3.83Å; L552-I556 HydrophobicContact CD1-CG1 4.17Å; L552-I556 HydrophobicContact CG-CD1 3.83Å; L552-I556 WeakPolarHBondContact O-CB 3.46Å; L552-I556 VanDerWaalsContact O-CG1 3.27Å; L552-I556 WeakPolarHBondContact O-CG1 3.48Å; L552-I556 PolarHBondContact O-N 3.03Å; L552-L707 HydrophobicContact CB-CD1 4.4Å; L552-L707 HydrophobicContact CD2-CD1 3.79Å; L552-L707 HydrophobicContact CG-CD1 3.89Å
553	A	96.3	Very high	95.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.8	-49	174.9	0	0	0	0	0	110.8	A532 L549 A550 F555 I556 S557 A704 L707	A532-A553 HydrophobicContact CB-CB 3.74Å; L549-A553 WeakPolarHBondContact O-CB 3.46Å; L549-A553 PolarHBondContact O-N 3.44Å; A550-A553 PolarHBondContact O-N 2.82Å; A553-F555 VanDerWaalsContact C-N 3.35Å; A553-F555 PolarHBondContact O-N 3.28Å; A553-I556 PolarHBondContact O-N 3.36Å; A553-S557 WeakPolarHBondContact O-CB 3.46Å; A553-S557 PolarHBondContact O-N 3.13Å; A553-S557 PolarHBondContact O-OG 3.37Å; A553-A704 HydrophobicContact CB-CB 4.21Å; A553-L707 HydrophobicContact CB-CB 4.15Å
554	C	96.3	Very high	95	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58	-44.9	176.9	-175.4	0	0	0	0	112.2	A532 M536 A550 S558	A532-C554 HydrophobicContact CB-CB 3.85Å; M536-C554 HydrophobicContact SD-CB 3.65Å; A550-C554 WeakPolarHBondContact O-CB 3.39Å; A550-C554 PolarHBondContact O-N 3.18Å; C554-S558 WeakPolarHBondContact O-CB 3.13Å; C554-S558 PolarHBondContact O-N 3Å; C554-S558 PolarHBondContact O-OG 3.47Å
555	F	96.7	Very high	95	Very high	49 Å²	49	22.3 Å²	22.3	22%	0.215	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-49.2	176.3	168.8	-105.4	0	0	0	112.2	S551 L552 A553 S558 I559 C670 L673 I677	S551-F555 WeakPolarHBondContact O-CB 3.42Å; S551-F555 PolarHBondContact O-N 2.76Å; L552-F555 HydrophobicContact CD1-CD1 4.38Å; L552-F555 PolarHBondContact O-N 3.28Å; A553-F555 VanDerWaalsContact C-N 3.35Å; A553-F555 PolarHBondContact O-N 3.28Å; F555-S558 PolarHBondContact O-N 2.88Å; F555-I559 HydrophobicContact CE1-CD1 4.06Å; F555-I559 HydrophobicContact CZ-CD1 4.16Å; F555-I559 PolarHBondContact O-N 3.25Å; F555-C670 HydrophobicContact CB-CB 4.37Å; F555-L673 HydrophobicContact CD2-CB 4.35Å; F555-L673 HydrophobicContact CD2-CD2 4.36Å; F555-L673 HydrophobicContact CD2-CG 4.48Å; F555-L673 HydrophobicContact CE2-CB 4.05Å; F555-L673 HydrophobicContact CE2-CD2 3.77Å; F555-L673 HydrophobicContact CE2-CG 3.77Å; F555-I677 HydrophobicContact CE2-CD1 3.92Å; F555-I677 HydrophobicContact CZ-CD1 3.68Å
556	I	95.3	Very high	95	Very high	21 Å²	21	20 Å²	20	11%	0.108	11%	0.11	C	C	.	.	H	α-helix	trans	-65.2	-45.9	-179.1	-69	170.7	0	0	0	110.9	L552 A553 S558 I559 F700 V703 L707	L552-I556 HydrophobicContact CD1-CD1 3.83Å; L552-I556 HydrophobicContact CD1-CG1 4.17Å; L552-I556 HydrophobicContact CG-CD1 3.83Å; L552-I556 WeakPolarHBondContact O-CB 3.46Å; L552-I556 VanDerWaalsContact O-CG1 3.27Å; L552-I556 WeakPolarHBondContact O-CG1 3.48Å; L552-I556 PolarHBondContact O-N 3.03Å; A553-I556 PolarHBondContact O-N 3.36Å; I556-S558 PolarHBondContact O-N 2.91Å; I556-I559 VanDerWaalsContact O-CB 3.29Å; I556-I559 WeakPolarHBondContact O-CB 3.49Å; I556-I559 PolarHBondContact O-N 3.28Å; I556-I559 VanDerWaalsContact O-N 3.07Å; I556-F700 HydrophobicContact CG2-CB 3.43Å; I556-F700 VanDerWaalsContact CG2-CB 3.43Å; I556-F700 HydrophobicContact CG2-CD1 4Å; I556-F700 HydrophobicContact CG2-CG 3.87Å; I556-F700 WeakPolarHBondContact CG2-O 3.47Å; I556-V703 HydrophobicContact CD1-CG1 4.02Å; I556-V703 HydrophobicContact CG2-CG1 3.99Å; I556-L707 HydrophobicContact CD1-CD1 4.31Å
557	S	95.5	Very high	94.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.2	-35.3	177	-63.6	0	0	0	0	112.2	G526 T528 A529 A553 I559 N560 I561 A704	G526-S557 WeakPolarHBondContact O-CB 3.35Å; T528-S557 WeakPolarHBondContact CB-OG 3.32Å; T528-S557 VanDerWaalsContact OG1-CB 3.32Å; T528-S557 WeakPolarHBondContact OG1-CB 3.33Å; T528-S557 PolarHBondContact OG1-OG 3.47Å; A529-S557 PolarHBondContact N-OG 2.94Å; A553-S557 WeakPolarHBondContact O-CB 3.46Å; A553-S557 PolarHBondContact O-N 3.13Å; A553-S557 PolarHBondContact O-OG 3.37Å; S557-I559 VanDerWaalsContact C-N 3.29Å; S557-I559 PolarHBondContact O-N 3.11Å; S557-N560 WeakPolarHBondContact O-CB 3.34Å; S557-N560 PolarHBondContact O-N 3.46Å; S557-N560 VanDerWaalsContact O-N 3.1Å; S557-I561 PolarHBondContact O-N 2.91Å; S557-A704 VanDerWaalsContact OG-CB 3.26Å; S557-A704 WeakPolarHBondContact OG-CB 3.22Å
558	S	95.7	Very high	94.6	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.014	10%	0.097	C	C	.	.	H	α-helix	trans	-67.4	-26.9	176.9	-60.6	0	0	0	0	113.2	C554 F555 I556 N560 I561 G562 I671 G675	C554-S558 WeakPolarHBondContact O-CB 3.13Å; C554-S558 PolarHBondContact O-N 3Å; C554-S558 PolarHBondContact O-OG 3.47Å; F555-S558 PolarHBondContact O-N 2.88Å; I556-S558 PolarHBondContact O-N 2.91Å; S558-N560 VanDerWaalsContact C-N 3.31Å; S558-I561 PolarHBondContact O-N 2.86Å; S558-G562 PolarHBondContact O-N 2.82Å; S558-G562 VanDerWaalsContact O-N 3.1Å; S558-I671 WeakPolarHBondContact OG-CA 3.37Å; S558-G675 VanDerWaalsContact O-CA 3.31Å; S558-G675 WeakPolarHBondContact O-CA 3.27Å; S558-G675 PolarHBondContact O-N 2.86Å
559	I	95.4	Very high	94.4	Very high	13 Å²	13	16.9 Å²	16.9	7%	0.067	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-42.1	170.4	-59.7	171.3	0	0	0	110.2	F555 I556 S557 G563 G674 I677 G678 F697 F700	F555-I559 HydrophobicContact CE1-CD1 4.06Å; F555-I559 HydrophobicContact CZ-CD1 4.16Å; F555-I559 PolarHBondContact O-N 3.25Å; I556-I559 VanDerWaalsContact O-CB 3.29Å; I556-I559 WeakPolarHBondContact O-CB 3.49Å; I556-I559 PolarHBondContact O-N 3.28Å; I556-I559 VanDerWaalsContact O-N 3.07Å; S557-I559 VanDerWaalsContact C-N 3.29Å; S557-I559 PolarHBondContact O-N 3.11Å; I559-G563 PolarHBondContact O-N 3.29Å; I559-G674 WeakPolarHBondContact CA-O 3.44Å; I559-G674 WeakPolarHBondContact CG1-O 3.48Å; I559-I677 HydrophobicContact CD1-CG2 4.41Å; I559-I677 HydrophobicContact CG1-CB 4.47Å; I559-I677 HydrophobicContact CG1-CG2 4.43Å; I559-I677 HydrophobicContact CG2-CG2 4.5Å; I559-G678 WeakPolarHBondContact O-CA 3.28Å; I559-F697 HydrophobicContact CG2-CE1 4.3Å; I559-F700 HydrophobicContact CG2-CD2 4.13Å; I559-F700 HydrophobicContact CG2-CE2 3.93Å
560	N	92.9	Very high	94.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.6	-40.5	177.9	-77.2	-13.8	0	0	0	112.6	S557 S558 G564 F697 F700 V701	S557-N560 WeakPolarHBondContact O-CB 3.34Å; S557-N560 PolarHBondContact O-N 3.46Å; S557-N560 VanDerWaalsContact O-N 3.1Å; S558-N560 VanDerWaalsContact C-N 3.31Å; N560-G564 WeakPolarHBondContact O-CA 3.46Å; N560-G564 PolarHBondContact O-N 3.13Å; N560-F697 PolarHBondContact ND2-O 3Å; N560-F697 WeakPolarHBondContact OD1-CA 3.25Å; N560-F697 WeakPolarHBondContact OD1-CB 3.41Å; N560-F697 WeakPolarHBondContact OD1-CD1 3.42Å; N560-F697 WeakPolarHBondContact OD1-CG 3.32Å; N560-F697 PolarHBondContact OD1-O 3.49Å; N560-F700 WeakPolarHBondContact ND2-CB 3.28Å; N560-F700 WeakPolarHBondContact OD1-CD2 3.41Å; N560-V701 WeakPolarHBondContact ND2-CG2 3.46Å; N560-V701 PolarHBondContact ND2-N 2.74Å
561	I	94.7	Very high	93.8	Very high	29 Å²	29	19.3 Å²	19.3	15%	0.149	10%	0.095	C	C	.	.	H	α-helix	trans	-59.2	-56.4	176.1	-61.6	175.3	0	0	0	109.8	A529 S557 S558 G563 F565 V646	A529-I561 HydrophobicContact CB-CD1 4.32Å; S557-I561 PolarHBondContact O-N 2.91Å; S558-I561 PolarHBondContact O-N 2.86Å; I561-G563 PolarHBondContact O-N 3.5Å; I561-F565 HydrophobicContact CG2-CD2 3.99Å; I561-F565 HydrophobicContact CG2-CE2 4.13Å; I561-F565 WeakPolarHBondContact O-CD2 3.11Å; I561-F565 PolarHBondContact O-N 2.97Å; I561-V646 HydrophobicContact CD1-CG1 3.85Å; I561-V646 HydrophobicContact CG1-CG1 4.16Å; I561-V646 HydrophobicContact CG2-CG1 4.04Å
562	G	92.7	Very high	93.6	Very high	11 Å²	11	18.7 Å²	18.7	11%	0.113	9%	0.091	C	C	.	.	H	α-helix	trans	-64	-41.1	-177.1	0	0	0	0	0	113.1	S558 L679	S558-G562 PolarHBondContact O-N 2.82Å; S558-G562 VanDerWaalsContact O-N 3.1Å; G562-L679 VanDerWaalsContact O-CD2 3.28Å; G562-L679 WeakPolarHBondContact O-CD2 3.37Å
563	G	91.7	Very high	93.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-72.9	-47.3	-179.9	0	0	0	0	0	113.2	I559 I561 L566 I567 G678 A682	I559-G563 PolarHBondContact O-N 3.29Å; I561-G563 PolarHBondContact O-N 3.5Å; G563-L566 PolarHBondContact O-N 3.29Å; G563-I567 WeakPolarHBondContact O-CD1 3.42Å; G563-I567 VanDerWaalsContact O-CG1 3.27Å; G563-I567 WeakPolarHBondContact O-CG1 3.38Å; G563-I567 PolarHBondContact O-N 3.07Å; G563-I567 VanDerWaalsContact O-N 3.07Å; G563-G678 WeakPolarHBondContact CA-O 3.42Å; G563-A682 WeakPolarHBondContact O-CB 3.47Å
564	G	91.7	Very high	93.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-48.8	-174.3	0	0	0	0	0	112.9	S519 N560 L566 I567 T568	S519-G564 PolarHBondContact OG-O 2.84Å; N560-G564 WeakPolarHBondContact O-CA 3.46Å; N560-G564 PolarHBondContact O-N 3.13Å; G564-L566 VanDerWaalsContact C-N 3.34Å; G564-L566 PolarHBondContact O-N 3.33Å; G564-I567 PolarHBondContact O-N 2.9Å; G564-T568 WeakPolarHBondContact O-CB 3.23Å; G564-T568 PolarHBondContact O-N 3.23Å; G564-T568 PolarHBondContact O-OG1 3.42Å
565	F	94.5	Very high	92.7	Very high	14 Å²	14	20.8 Å²	20.8	6%	0.061	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-36.7	-179	-80.9	-61	0	0	0	113.1	A523 I524 I561 Q569 N639 G642 M643 V646	A523-F565 HydrophobicContact CB-CD1 3.95Å; A523-F565 HydrophobicContact CB-CD2 3.93Å; A523-F565 HydrophobicContact CB-CE1 4.02Å; A523-F565 HydrophobicContact CB-CE2 4Å; A523-F565 HydrophobicContact CB-CG 3.89Å; A523-F565 HydrophobicContact CB-CZ 4.04Å; I524-F565 HydrophobicContact CG1-CZ 4.3Å; I561-F565 HydrophobicContact CG2-CD2 3.99Å; I561-F565 HydrophobicContact CG2-CE2 4.13Å; I561-F565 WeakPolarHBondContact O-CD2 3.11Å; I561-F565 PolarHBondContact O-N 2.97Å; F565-Q569 WeakPolarHBondContact O-CB 2.95Å; F565-Q569 PolarHBondContact O-N 3.41Å; F565-N639 WeakPolarHBondContact CD1-OD1 3.29Å; F565-G642 VanDerWaalsContact CE1-C 3.49Å; F565-G642 VanDerWaalsContact CZ-C 3.41Å; F565-G642 WeakPolarHBondContact CZ-O 3.27Å; F565-M643 HydrophobicContact CB-CE 4.13Å; F565-M643 HydrophobicContact CB-CG 4.39Å; F565-M643 HydrophobicContact CD1-CE 4.17Å; F565-M643 HydrophobicContact CD1-CG 3.48Å; F565-M643 VanDerWaalsContact CD1-CG 3.48Å; F565-M643 HydrophobicContact CD2-CG 4.31Å; F565-M643 HydrophobicContact CE1-CB 4.46Å; F565-M643 HydrophobicContact CE1-CG 3.75Å; F565-M643 HydrophobicContact CG-CE 4.43Å; F565-M643 HydrophobicContact CG-CG 3.81Å; F565-M643 HydrophobicContact CZ-CG 4.28Å; F565-V646 HydrophobicContact CE2-CB 3.96Å; F565-V646 HydrophobicContact CE2-CG1 4.29Å; F565-V646 HydrophobicContact CE2-CG2 3.7Å; F565-V646 HydrophobicContact CZ-CB 4.16Å; F565-V646 HydrophobicContact CZ-CG2 3.6Å
566	L	93.7	Very high	92.5	Very high	49 Å²	49	22.8 Å²	22.8	26%	0.257	11%	0.11	S	C	.	.	H	α-helix	trans	-69.4	-41.3	176.9	-178.5	61.4	0	0	0	111.9	G563 G564 Q569 R570 L679 A682 K683	G563-L566 PolarHBondContact O-N 3.29Å; G564-L566 VanDerWaalsContact C-N 3.34Å; G564-L566 PolarHBondContact O-N 3.33Å; L566-Q569 PolarHBondContact O-N 3Å; L566-R570 VanDerWaalsContact O-CG 3.31Å; L566-R570 WeakPolarHBondContact O-CG 3.29Å; L566-R570 PolarHBondContact O-N 2.99Å; L566-L679 HydrophobicContact CB-CD2 3.99Å; L566-L679 HydrophobicContact CD2-CD2 3.95Å; L566-L679 WeakPolarHBondContact CD2-O 3.22Å; L566-L679 HydrophobicContact CG-CD2 4.48Å; L566-A682 HydrophobicContact CB-CB 4.03Å; L566-A682 HydrophobicContact CD2-CB 3.87Å; L566-A682 HydrophobicContact CG-CB 4.17Å; L566-K683 HydrophobicContact CD2-CB 4.01Å
567	I	90	Very high	92.1	Very high	2 Å²	2	25 Å²	25	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-48.3	174.7	-69.9	164.4	0	0	0	110.2	S519 G563 G564 Q569 R570 M571 A682 L690 L693 F697	S519-I567 WeakPolarHBondContact OG-CG2 3.46Å; G563-I567 WeakPolarHBondContact O-CD1 3.42Å; G563-I567 VanDerWaalsContact O-CG1 3.27Å; G563-I567 WeakPolarHBondContact O-CG1 3.38Å; G563-I567 PolarHBondContact O-N 3.07Å; G563-I567 VanDerWaalsContact O-N 3.07Å; G564-I567 PolarHBondContact O-N 2.9Å; I567-Q569 VanDerWaalsContact C-N 3.29Å; I567-Q569 PolarHBondContact O-N 3.11Å; I567-R570 PolarHBondContact O-N 3.45Å; I567-M571 HydrophobicContact CG2-CG 4.19Å; I567-M571 HydrophobicContact CG2-SD 3.75Å; I567-M571 VanDerWaalsContact O-CG 3.29Å; I567-M571 WeakPolarHBondContact O-CG 3.35Å; I567-M571 PolarHBondContact O-N 2.61Å; I567-A682 HydrophobicContact CD1-CB 4.15Å; I567-A682 HydrophobicContact CG1-CB 3.71Å; I567-L690 HydrophobicContact CB-CD2 4.49Å; I567-L690 HydrophobicContact CD1-CD2 4.5Å; I567-L690 HydrophobicContact CG1-CD2 4.27Å; I567-L690 HydrophobicContact CG2-CD1 4.47Å; I567-L690 HydrophobicContact CG2-CD2 3.47Å; I567-L690 VanDerWaalsContact CG2-CD2 3.47Å; I567-L693 HydrophobicContact CD1-CD2 3.34Å; I567-L693 HydrophobicContact CD1-CG 4.01Å; I567-L693 HydrophobicContact CG1-CD2 4.31Å; I567-F697 HydrophobicContact CD1-CD2 4.31Å; I567-F697 HydrophobicContact CD1-CE2 3.57Å; I567-F697 HydrophobicContact CD1-CZ 4.4Å
568	T	91.9	Very high	91.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55	-49.5	177.6	-61.7	0	0	0	0	110.3	S519 V520 G564 R570 M571 L572 N639	S519-T568 VanDerWaalsContact C-OG1 3.31Å; S519-T568 VanDerWaalsContact CB-OG1 3.28Å; S519-T568 WeakPolarHBondContact CB-OG1 3.25Å; S519-T568 PolarHBondContact OG-N 3.39Å; S519-T568 PolarHBondContact OG-OG1 2.8Å; V520-T568 HydrophobicContact CG2-CG2 3.33Å; V520-T568 PolarHBondContact N-OG1 3.25Å; G564-T568 WeakPolarHBondContact O-CB 3.23Å; G564-T568 PolarHBondContact O-N 3.23Å; G564-T568 PolarHBondContact O-OG1 3.42Å; T568-R570 VanDerWaalsContact C-N 3.35Å; T568-R570 PolarHBondContact O-N 2.83Å; T568-M571 WeakPolarHBondContact O-CB 3.5Å; T568-M571 PolarHBondContact O-N 2.71Å; T568-M571 VanDerWaalsContact O-N 3.1Å; T568-L572 HydrophobicContact CG2-CD1 3.77Å; T568-L572 HydrophobicContact CG2-CG 4.15Å; T568-L572 VanDerWaalsContact O-CG 3.29Å; T568-L572 WeakPolarHBondContact O-CG 3.43Å; T568-L572 PolarHBondContact O-N 3.03Å; T568-N639 HydrophobicContact CG2-CB 4.14Å; T568-N639 VanDerWaalsContact CG2-OD1 3.22Å; T568-N639 WeakPolarHBondContact CG2-OD1 3.46Å
569	Q	93.2	Very high	91.4	Very high	39 Å²	39	37.3 Å²	37.3	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-48.6	179.6	-172.6	58.6	38.7	0	0	111.4	F565 L566 I567 M571 L572 D573 N639	F565-Q569 WeakPolarHBondContact O-CB 2.95Å; F565-Q569 PolarHBondContact O-N 3.41Å; L566-Q569 PolarHBondContact O-N 3Å; I567-Q569 VanDerWaalsContact C-N 3.29Å; I567-Q569 PolarHBondContact O-N 3.11Å; Q569-M571 VanDerWaalsContact C-N 3.28Å; Q569-M571 PolarHBondContact O-N 3.25Å; Q569-L572 PolarHBondContact O-N 3.21Å; Q569-D573 VanDerWaalsContact NE2-CG 3.25Å; Q569-D573 PolarHBondContact NE2-OD1 2.64Å; Q569-D573 PolarHBondContact NE2-OD2 2.91Å; Q569-D573 WeakPolarHBondContact O-CB 3.49Å; Q569-D573 VanDerWaalsContact O-CG 3.27Å; Q569-D573 PolarHBondContact O-N 3.2Å; Q569-N639 PolarHBondContact N-ND2 3.06Å; Q569-N639 PolarHBondContact OE1-ND2 3.08Å
570	R	90.7	Very high	91.1	Very high	80 Å²	80	38 Å²	38	30%	0.302	20%	0.199	S	C	.	.	H	α-helix	trans	-57.9	-40.8	176.4	-71.2	177.2	66.8	-160.8	-3.6	112.1	L566 I567 T568 M574 A682 I685	L566-R570 VanDerWaalsContact O-CG 3.31Å; L566-R570 WeakPolarHBondContact O-CG 3.29Å; L566-R570 PolarHBondContact O-N 2.99Å; I567-R570 PolarHBondContact O-N 3.45Å; T568-R570 VanDerWaalsContact C-N 3.35Å; T568-R570 PolarHBondContact O-N 2.83Å; R570-M574 WeakPolarHBondContact O-CE 3.19Å; R570-M574 WeakPolarHBondContact O-CG 3.41Å; R570-M574 PolarHBondContact O-N 3.35Å; R570-A682 PolarHBondContact NH1-O 3.4Å; R570-I685 PolarHBondContact NH1-O 2.59Å; R570-I685 PolarHBondContact NH2-O 3.13Å
571	M	88.9	Confident	91.1	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.03	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-43.4	178.5	-69	176.6	83	0	0	112.9	S515 P516 I567 T568 Q569 M574 F575 L690 V972	S515-M571 VanDerWaalsContact CB-CE 3.49Å; P516-M571 HydrophobicContact CG-CB 4.22Å; P516-M571 HydrophobicContact CG-CE 4.15Å; I567-M571 HydrophobicContact CG2-CG 4.19Å; I567-M571 HydrophobicContact CG2-SD 3.75Å; I567-M571 VanDerWaalsContact O-CG 3.29Å; I567-M571 WeakPolarHBondContact O-CG 3.35Å; I567-M571 PolarHBondContact O-N 2.61Å; T568-M571 WeakPolarHBondContact O-CB 3.5Å; T568-M571 PolarHBondContact O-N 2.71Å; T568-M571 VanDerWaalsContact O-N 3.1Å; Q569-M571 VanDerWaalsContact C-N 3.28Å; Q569-M571 PolarHBondContact O-N 3.25Å; M571-M574 VanDerWaalsContact CA-CE 3.45Å; M571-M574 HydrophobicContact CB-CE 4.32Å; M571-M574 HydrophobicContact CG-CE 4.27Å; M571-F575 VanDerWaalsContact O-CD2 3.32Å; M571-F575 WeakPolarHBondContact O-CD2 3.16Å; M571-L690 HydrophobicContact CE-CD1 3.96Å; M571-L690 HydrophobicContact CG-CD1 3.65Å; M571-L690 HydrophobicContact SD-CD1 3.75Å; M571-V972 HydrophobicContact CE-CG1 4.11Å; M571-V972 HydrophobicContact CE-CG2 3.83Å; M571-V972 HydrophobicContact CG-CG1 4.38Å
572	L	92.2	Very high	91	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-72.6	-36	-178.4	-64.1	180	0	0	0	112.2	L513 P516 T568 Q569 M574 F575 C635 N639	L513-L572 HydrophobicContact CD2-CD2 4.18Å; P516-L572 HydrophobicContact CB-CD2 3.64Å; P516-L572 HydrophobicContact CB-CG 4.46Å; P516-L572 HydrophobicContact CG-CD2 3.93Å; T568-L572 HydrophobicContact CG2-CD1 3.77Å; T568-L572 HydrophobicContact CG2-CG 4.15Å; T568-L572 VanDerWaalsContact O-CG 3.29Å; T568-L572 WeakPolarHBondContact O-CG 3.43Å; T568-L572 PolarHBondContact O-N 3.03Å; Q569-L572 PolarHBondContact O-N 3.21Å; L572-M574 PolarHBondContact O-N 3.27Å; L572-F575 PolarHBondContact O-N 3.44Å; L572-F575 VanDerWaalsContact O-N 3.11Å; L572-C635 HydrophobicContact CD1-CB 4.34Å; L572-C635 VanDerWaalsContact CD1-O 3.28Å; L572-C635 WeakPolarHBondContact CD1-O 3.29Å; L572-C635 HydrophobicContact CD2-CB 3.73Å; L572-N639 HydrophobicContact CD1-CB 3.79Å
573	D	92	Very high	91	Very high	72 Å²	72	48.2 Å²	48.2	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-24.4	178.2	-72.6	-25.6	0	0	0	112.7	Q569 F575 K576	Q569-D573 VanDerWaalsContact NE2-CG 3.25Å; Q569-D573 PolarHBondContact NE2-OD1 2.64Å; Q569-D573 PolarHBondContact NE2-OD2 2.91Å; Q569-D573 WeakPolarHBondContact O-CB 3.49Å; Q569-D573 VanDerWaalsContact O-CG 3.27Å; Q569-D573 PolarHBondContact O-N 3.2Å; D573-F575 VanDerWaalsContact C-N 3.27Å; D573-F575 PolarHBondContact O-N 3.49Å; D573-K576 WeakPolarHBondContact O-CB 3.4Å; D573-K576 PolarHBondContact O-N 2.86Å
574	M	88.7	Confident	91.1	Very high	40 Å²	40	54.5 Å²	54.5	20%	0.197	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.5	174	-70.9	-176.5	-76.1	0	0	113.4	R570 M571 L572 K576 V687 V972 A975 E976	R570-M574 WeakPolarHBondContact O-CE 3.19Å; R570-M574 WeakPolarHBondContact O-CG 3.41Å; R570-M574 PolarHBondContact O-N 3.35Å; M571-M574 VanDerWaalsContact CA-CE 3.45Å; M571-M574 HydrophobicContact CB-CE 4.32Å; M571-M574 HydrophobicContact CG-CE 4.27Å; L572-M574 PolarHBondContact O-N 3.27Å; M574-K576 VanDerWaalsContact C-N 3.29Å; M574-V687 HydrophobicContact CE-CB 4.35Å; M574-V687 HydrophobicContact CE-CG1 3.68Å; M574-V687 HydrophobicContact CE-CG2 3.66Å; M574-V687 HydrophobicContact SD-CB 4.49Å; M574-V687 HydrophobicContact SD-CG1 4.12Å; M574-V687 HydrophobicContact SD-CG2 3.69Å; M574-V972 HydrophobicContact CE-CG1 3.38Å; M574-V972 HydrophobicContact SD-CG1 4.42Å; M574-A975 HydrophobicContact CB-CB 4.22Å; M574-E976 HydrophobicContact SD-CB 3.52Å; M574-E976 VanDerWaalsContact SD-CB 3.52Å; M574-E976 HydrophobicContact SD-CG 3.75Å
575	F	89.5	Confident	91.2	Very high	10 Å²	10	56.5 Å²	56.5	4%	0.044	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.4	176.2	-71	-80.9	0	0	0	113.2	L513 P516 M571 L572 D573 R577 N971 V972 A975	L513-F575 HydrophobicContact CD2-CD2 4.02Å; L513-F575 HydrophobicContact CD2-CE2 3.85Å; L513-F575 HydrophobicContact CD2-CZ 4.2Å; P516-F575 HydrophobicContact CG-CE2 4.31Å; M571-F575 VanDerWaalsContact O-CD2 3.32Å; M571-F575 WeakPolarHBondContact O-CD2 3.16Å; L572-F575 PolarHBondContact O-N 3.44Å; L572-F575 VanDerWaalsContact O-N 3.11Å; D573-F575 VanDerWaalsContact C-N 3.27Å; D573-F575 PolarHBondContact O-N 3.49Å; F575-R577 PolarHBondContact O-N 3.35Å; F575-N971 HydrophobicContact CE1-CB 4.36Å; F575-N971 HydrophobicContact CZ-CB 4.24Å; F575-V972 HydrophobicContact CE2-CG2 4.12Å; F575-V972 HydrophobicContact CZ-CG2 4.07Å; F575-A975 HydrophobicContact CD1-CB 3.85Å; F575-A975 HydrophobicContact CE1-CB 3.85Å; F575-A975 HydrophobicContact CG-CB 4.25Å; F575-A975 HydrophobicContact CZ-CB 4.26Å
576	K	90.9	Very high	91.2	Very high	90 Å²	90	62.8 Å²	62.8	39%	0.391	32%	0.32	S	S	.	.			trans	-72.4	121.4	178	-174.5	177.1	179	176.6	0	109.9	D573 M574	D573-K576 WeakPolarHBondContact O-CB 3.4Å; D573-K576 PolarHBondContact O-N 2.86Å; M574-K576 VanDerWaalsContact C-N 3.29Å
577	R	88.3	Confident	91.4	Very high	67 Å²	67	65 Å²	65	25%	0.253	33%	0.331	S	S	.	.			trans	-80.9	147.6	177.1	-59.9	175.2	-64.4	-172.7	1.6	109.9	F575 T579 D580 Y981 D982	F575-R577 PolarHBondContact O-N 3.35Å; R577-T579 PolarHBondContact O-N 3.14Å; R577-T579 VanDerWaalsContact O-N 3.1Å; R577-D580 WeakPolarHBondContact CB-OD2 3.47Å; R577-D580 IonicContact CZ-OD1 3.21Å; R577-D580 PolarHBondContact N-OD2 3.05Å; R577-D580 IonicContact NE-OD1 3.36Å; R577-D580 PolarHBondContact NE-OD1 2.82Å; R577-D580 IonicContact NE-OD2 3.03Å; R577-D580 IonicContact NH2-OD1 2.81Å; R577-D580 PolarHBondContact NH2-OD1 2.86Å; R577-D580 WeakPolarHBondContact O-CB 3.43Å; R577-D580 PolarHBondContact O-N 3.19Å; R577-Y981 HydrophobicContact CG-CD1 4.22Å; R577-Y981 HydrophobicContact CG-CE1 4.01Å; R577-Y981 VanDerWaalsContact CZ-OH 3.26Å; R577-Y981 PolarHBondContact NH2-OH 2.85Å; R577-D982 IonicContact NH1-OD1 3.83Å
578	P	87.1	Confident	91.7	Very high	140 Å²	140	68.9 Å²	68.9	91%	0.909	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.3	172	-24.6	34.4	0	0	0	113.8
579	T	89.2	Confident	91.8	Very high	121 Å²	121	73.2 Å²	73.2	74%	0.742	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-3.4	179.7	57.9	0	0	0	0	114	R577	R577-T579 PolarHBondContact O-N 3.14Å; R577-T579 VanDerWaalsContact O-N 3.1Å
580	D	89.2	Confident	92	Very high	27 Å²	27	75.5 Å²	75.5	14%	0.144	39%	0.389	C	S	.	.	S	Bend	trans	-70.4	149	177.3	-72.1	-26	0	0	0	110.7	R577	R577-D580 WeakPolarHBondContact CB-OD2 3.47Å; R577-D580 IonicContact CZ-OD1 3.21Å; R577-D580 PolarHBondContact N-OD2 3.05Å; R577-D580 IonicContact NE-OD1 3.36Å; R577-D580 PolarHBondContact NE-OD1 2.82Å; R577-D580 IonicContact NE-OD2 3.03Å; R577-D580 IonicContact NH2-OD1 2.81Å; R577-D580 PolarHBondContact NH2-OD1 2.86Å; R577-D580 WeakPolarHBondContact O-CB 3.43Å; R577-D580 PolarHBondContact O-N 3.19Å
581	P	92.7	Very high	92.3	Very high	99 Å²	99	74.7 Å²	74.7	64%	0.643	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-55.8	149.4	173.2	-24.6	34.3	0	0	0	112.3	E583	P581-E583 PolarHBondContact O-N 2.85Å
582	P	92.7	Very high	92.6	Very high	96 Å²	96	75.4 Å²	75.4	62%	0.623	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-56.7	129.5	171.7	-23.7	33.6	0	0	0	111.4
583	E	91.7	Very high	92.8	Very high	60 Å²	60	78.4 Å²	78.4	28%	0.28	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-101.8	135.5	178.5	-59.6	-172.3	156.2	0	0	110.9	P581 N585 R636	P581-E583 PolarHBondContact O-N 2.85Å; E583-N585 PolarHBondContact O-N 2.72Å; E583-N585 PolarHBondContact OE2-ND2 3.03Å; E583-R636 VanDerWaalsContact CD-NH2 3.28Å; E583-R636 IonicContact OE1-CZ 2.65Å; E583-R636 VanDerWaalsContact OE1-CZ 3.23Å; E583-R636 IonicContact OE1-NE 3.47Å; E583-R636 PolarHBondContact OE1-NE 2.96Å; E583-R636 IonicContact OE1-NH2 2.72Å; E583-R636 PolarHBondContact OE1-NH2 2.85Å; E583-R636 IonicContact OE2-CZ 3.99Å; E583-R636 IonicContact OE2-NE 3.89Å; E583-R636 PolarHBondContact OE2-NE 3.23Å; E583-R636 IonicContact OE2-NH2 3Å; E583-R636 PolarHBondContact OE2-NH2 2.95Å
584	Y	95.2	Very high	93.1	Very high	132 Å²	132	79.9 Å²	79.9	52%	0.518	44%	0.437	S	S	.	.			trans	-104.5	56.7	-177.2	-55.3	-78.4	0	0	0	110.9	Y586 L587	Y584-Y586 AromaticContact CD1-CE1 3.77Å; Y584-Y586 HydrophobicContact CD1-CE1 3.77Å; Y584-Y586 AromaticContact CD1-CZ 3.87Å; Y584-Y586 VanDerWaalsContact CD1-OH 3.29Å; Y584-Y586 WeakPolarHBondContact CD1-OH 3.36Å; Y584-Y586 HydrophobicContact CG-CE1 4.35Å; Y584-Y586 PolarHBondContact O-N 3.02Å; Y584-Y586 VanDerWaalsContact O-N 3.08Å; Y584-L587 WeakPolarHBondContact O-CB 3.23Å; Y584-L587 WeakPolarHBondContact O-CG 3.45Å; Y584-L587 PolarHBondContact O-N 3.27Å
585	N	93.2	Very high	93.4	Very high	42 Å²	42	80.6 Å²	80.6	23%	0.225	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-58.2	-24.8	-174.7	-74.4	-47.8	0	0	0	113.8	E583 L587 Y588	E583-N585 PolarHBondContact O-N 2.72Å; E583-N585 PolarHBondContact OE2-ND2 3.03Å; N585-L587 PolarHBondContact O-N 3.34Å; N585-Y588 HydrophobicContact CB-CD2 4.44Å; N585-Y588 WeakPolarHBondContact O-CB 3.43Å; N585-Y588 VanDerWaalsContact O-CD2 3.27Å; N585-Y588 WeakPolarHBondContact O-CD2 3.31Å; N585-Y588 PolarHBondContact O-N 3.23Å; N585-Y588 VanDerWaalsContact O-N 3.13Å
586	Y	95	Very high	93.7	Very high	147 Å²	147	83 Å²	83	58%	0.576	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-62.9	-21	173.6	64	-95.5	0	0	0	113	Y584 Y588 T589	Y584-Y586 AromaticContact CD1-CE1 3.77Å; Y584-Y586 HydrophobicContact CD1-CE1 3.77Å; Y584-Y586 AromaticContact CD1-CZ 3.87Å; Y584-Y586 VanDerWaalsContact CD1-OH 3.29Å; Y584-Y586 WeakPolarHBondContact CD1-OH 3.36Å; Y584-Y586 HydrophobicContact CG-CE1 4.35Å; Y584-Y586 PolarHBondContact O-N 3.02Å; Y584-Y586 VanDerWaalsContact O-N 3.08Å; Y586-Y588 PolarHBondContact O-N 3.47Å; Y586-T589 WeakPolarHBondContact O-CB 3.28Å; Y586-T589 VanDerWaalsContact O-CG2 3.29Å; Y586-T589 WeakPolarHBondContact O-CG2 3.13Å; Y586-T589 PolarHBondContact O-N 2.93Å; Y586-T589 PolarHBondContact O-OG1 2.89Å
587	L	97.2	Very high	93.9	Very high	94 Å²	94	80.8 Å²	80.8	49%	0.492	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-64.2	-22.4	175.2	-66.1	177.3	0	0	0	112.4	Y584 N585 T589 V590 P591	Y584-L587 WeakPolarHBondContact O-CB 3.23Å; Y584-L587 WeakPolarHBondContact O-CG 3.45Å; Y584-L587 PolarHBondContact O-N 3.27Å; N585-L587 PolarHBondContact O-N 3.34Å; L587-T589 PolarHBondContact O-N 3.28Å; L587-V590 VanDerWaalsContact O-CB 3.32Å; L587-V590 WeakPolarHBondContact O-CB 3.43Å; L587-V590 WeakPolarHBondContact O-CG2 3.36Å; L587-V590 PolarHBondContact O-N 2.88Å; L587-P591 WeakPolarHBondContact O-CD 3.44Å
588	Y	95.7	Very high	94.2	Very high	85 Å²	85	79.5 Å²	79.5	33%	0.333	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-70.5	-7	173.4	-59.8	-62	0	0	0	113.2	N585 Y586 V590 P591 A592 L637 N640	N585-Y588 HydrophobicContact CB-CD2 4.44Å; N585-Y588 WeakPolarHBondContact O-CB 3.43Å; N585-Y588 VanDerWaalsContact O-CD2 3.27Å; N585-Y588 WeakPolarHBondContact O-CD2 3.31Å; N585-Y588 PolarHBondContact O-N 3.23Å; N585-Y588 VanDerWaalsContact O-N 3.13Å; Y586-Y588 PolarHBondContact O-N 3.47Å; Y588-V590 PolarHBondContact O-N 2.95Å; Y588-P591 WeakPolarHBondContact O-CD 3.31Å; Y588-P591 VanDerWaalsContact O-CG 3.3Å; Y588-P591 WeakPolarHBondContact O-CG 3.42Å; Y588-A592 PolarHBondContact O-N 3.38Å; Y588-L637 HydrophobicContact CD1-CD1 3.9Å; Y588-L637 HydrophobicContact CE1-CD1 3.46Å; Y588-L637 VanDerWaalsContact CE1-CD1 3.46Å; Y588-L637 HydrophobicContact CE2-CD1 4.47Å; Y588-N640 HydrophobicContact CD2-CB 4.27Å; Y588-N640 WeakPolarHBondContact CD2-ND2 3.38Å; Y588-N640 HydrophobicContact CG-CB 4.26Å
589	T	94.7	Very high	94.6	Very high	91 Å²	91	73.4 Å²	73.4	56%	0.558	42%	0.422	S	S	*	.	H	α-helix	trans	-70.3	-21.5	166.8	69	0	0	0	0	112.1	Y586 L587 A592 A593	Y586-T589 WeakPolarHBondContact O-CB 3.28Å; Y586-T589 VanDerWaalsContact O-CG2 3.29Å; Y586-T589 WeakPolarHBondContact O-CG2 3.13Å; Y586-T589 PolarHBondContact O-N 2.93Å; Y586-T589 PolarHBondContact O-OG1 2.89Å; L587-T589 PolarHBondContact O-N 3.28Å; T589-A592 PolarHBondContact O-N 3.49Å; T589-A593 VanDerWaalsContact O-CB 3.25Å; T589-A593 WeakPolarHBondContact O-CB 3.45Å; T589-A593 PolarHBondContact O-N 3.41Å
590	V	97.2	Very high	94.8	Very high	87 Å²	87	69.3 Å²	69.3	53%	0.527	40%	0.403	S	S	.	.	H	α-helix	trans	-63.2	-57.7	176.5	178.1	0	0	0	0	111.3	L587 Y588 A592 A593 V594	L587-V590 VanDerWaalsContact O-CB 3.32Å; L587-V590 WeakPolarHBondContact O-CB 3.43Å; L587-V590 WeakPolarHBondContact O-CG2 3.36Å; L587-V590 PolarHBondContact O-N 2.88Å; Y588-V590 PolarHBondContact O-N 2.95Å; V590-A592 VanDerWaalsContact C-N 3.25Å; V590-A592 PolarHBondContact O-N 3.36Å; V590-A593 PolarHBondContact O-N 3.34Å; V590-V594 WeakPolarHBondContact O-CG2 3.46Å; V590-V594 PolarHBondContact O-N 3.26Å
591	P	96.7	Very high	95.1	Very high	62 Å²	62	75.5 Å²	75.5	40%	0.403	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-33.5	175.8	23.1	-33	0	0	0	112.4	L587 Y588 V594 F595 I644	L587-P591 WeakPolarHBondContact O-CD 3.44Å; Y588-P591 WeakPolarHBondContact O-CD 3.31Å; Y588-P591 VanDerWaalsContact O-CG 3.3Å; Y588-P591 WeakPolarHBondContact O-CG 3.42Å; P591-V594 PolarHBondContact O-N 3.22Å; P591-F595 WeakPolarHBondContact O-CB 3.43Å; P591-F595 PolarHBondContact O-N 2.81Å; P591-I644 HydrophobicContact CG-CD1 4.36Å
592	A	96.1	Very high	95.2	Very high	21 Å²	21	71 Å²	71	17%	0.174	40%	0.398	C	S	.	.	H	α-helix	trans	-60.6	-47.8	173.9	0	0	0	0	0	112.2	Y588 T589 V590 F595 L596 I644	Y588-A592 PolarHBondContact O-N 3.38Å; T589-A592 PolarHBondContact O-N 3.49Å; V590-A592 VanDerWaalsContact C-N 3.25Å; V590-A592 PolarHBondContact O-N 3.36Å; A592-F595 PolarHBondContact O-N 2.8Å; A592-L596 WeakPolarHBondContact O-CB 3.32Å; A592-L596 WeakPolarHBondContact O-CG 3.29Å; A592-L596 PolarHBondContact O-N 2.59Å; A592-I644 HydrophobicContact CB-CD1 4.02Å; A592-I644 HydrophobicContact CB-CG1 3.7Å
593	A	96.8	Very high	95.1	Very high	64 Å²	64	68.8 Å²	68.8	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-38.6	179.2	0	0	0	0	0	112	T589 V590 G597	T589-A593 VanDerWaalsContact O-CB 3.25Å; T589-A593 WeakPolarHBondContact O-CB 3.45Å; T589-A593 PolarHBondContact O-N 3.41Å; V590-A593 PolarHBondContact O-N 3.34Å; A593-G597 VanDerWaalsContact O-CA 3.27Å; A593-G597 WeakPolarHBondContact O-CA 3.23Å; A593-G597 PolarHBondContact O-N 3.49Å
594	V	96.9	Very high	95.2	Very high	103 Å²	103	75.2 Å²	75.2	62%	0.624	40%	0.403	S	S	*	.	H	α-helix	trans	-65	-43.9	174.1	172.5	0	0	0	0	110.8	V590 P591 G598	V590-V594 WeakPolarHBondContact O-CG2 3.46Å; V590-V594 PolarHBondContact O-N 3.26Å; P591-V594 PolarHBondContact O-N 3.22Å; V594-G598 WeakPolarHBondContact O-CA 3.23Å; V594-G598 PolarHBondContact O-N 3.06Å
595	F	96.5	Very high	95.1	Very high	54 Å²	54	71.9 Å²	71.9	24%	0.237	40%	0.397	C	S	.	.	H	α-helix	trans	-66.8	-52.8	-179.1	-176.5	-127.1	0	0	0	112	P591 A592 Y599 I644	P591-F595 WeakPolarHBondContact O-CB 3.43Å; P591-F595 PolarHBondContact O-N 2.81Å; A592-F595 PolarHBondContact O-N 2.8Å; F595-Y599 WeakPolarHBondContact O-CB 3.39Å; F595-Y599 PolarHBondContact O-N 2.95Å; F595-I644 HydrophobicContact CD1-CG2 3.85Å; F595-I644 HydrophobicContact CE1-CG2 4.44Å
596	L	95.3	Very high	95	Very high	61 Å²	61	77.8 Å²	77.8	32%	0.319	42%	0.42	S	S	.	.	H	α-helix	trans	-71	-39.4	-179.9	-65.9	174.2	0	0	0	112.5	A592 Y599 G600 A647 A651	A592-L596 WeakPolarHBondContact O-CB 3.32Å; A592-L596 WeakPolarHBondContact O-CG 3.29Å; A592-L596 PolarHBondContact O-N 2.59Å; L596-Y599 PolarHBondContact O-N 3.45Å; L596-G600 PolarHBondContact O-N 2.97Å; L596-A647 HydrophobicContact CD1-CB 4.19Å; L596-A651 HydrophobicContact CD2-CB 3.82Å
597	G	94.8	Very high	94.9	Very high	44 Å²	44	74 Å²	74	45%	0.454	41%	0.413	S	S	.	.	H	α-helix	trans	-68.9	-40.4	176.6	0	0	0	0	0	112.3	A593 G600 Y601	A593-G597 VanDerWaalsContact O-CA 3.27Å; A593-G597 WeakPolarHBondContact O-CA 3.23Å; A593-G597 PolarHBondContact O-N 3.49Å; G597-G600 PolarHBondContact O-N 3.08Å; G597-Y601 WeakPolarHBondContact O-CB 3.26Å; G597-Y601 PolarHBondContact O-N 2.92Å
598	G	94.8	Very high	94.4	Very high	40 Å²	40	74.6 Å²	74.6	41%	0.412	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.1	0	0	0	0	0	112.1	V594 Y601 G602	V594-G598 WeakPolarHBondContact O-CA 3.23Å; V594-G598 PolarHBondContact O-N 3.06Å; G598-Y601 PolarHBondContact O-N 3.28Å; G598-G602 PolarHBondContact O-N 3.01Å
599	Y	95.4	Very high	94.1	Very high	12 Å²	12	76.4 Å²	76.4	5%	0.047	43%	0.433	C	S	.	.	H	α-helix	trans	-60.3	-49.2	171.6	175.9	-106.6	0	0	0	111.8	F595 L596 Y601 G602 L603 I610 N611 C614 A651 S652 G655	F595-Y599 WeakPolarHBondContact O-CB 3.39Å; F595-Y599 PolarHBondContact O-N 2.95Å; L596-Y599 PolarHBondContact O-N 3.45Å; Y599-Y601 VanDerWaalsContact C-N 3.32Å; Y599-Y601 PolarHBondContact O-N 2.94Å; Y599-G602 PolarHBondContact O-N 3.14Å; Y599-G602 VanDerWaalsContact O-N 3.12Å; Y599-L603 HydrophobicContact CD1-CD1 4.06Å; Y599-L603 HydrophobicContact CD1-CG 4.46Å; Y599-L603 HydrophobicContact CE1-CD1 3.31Å; Y599-L603 HydrophobicContact CE1-CG 3.87Å; Y599-L603 HydrophobicContact CE2-CD1 4.36Å; Y599-L603 HydrophobicContact CE2-CD2 4.28Å; Y599-L603 HydrophobicContact CE2-CG 4.03Å; Y599-L603 VanDerWaalsContact CZ-CD1 3.46Å; Y599-L603 PolarHBondContact O-N 3.32Å; Y599-L603 WeakPolarHBondContact OH-CD1 3.37Å; Y599-L603 WeakPolarHBondContact OH-CD2 3.17Å; Y599-I610 HydrophobicContact CD2-CD1 4.47Å; Y599-I610 HydrophobicContact CD2-CG1 3.78Å; Y599-I610 HydrophobicContact CE2-CG1 4.08Å; Y599-I610 HydrophobicContact CE2-CG2 4.38Å; Y599-N611 WeakPolarHBondContact CE2-OD1 2.92Å; Y599-N611 PolarHBondContact OH-OD1 3.39Å; Y599-C614 HydrophobicContact CD2-CB 3.57Å; Y599-C614 HydrophobicContact CE2-CB 3.85Å; Y599-C614 HydrophobicContact CG-CB 4.4Å; Y599-A651 HydrophobicContact CD1-CB 4.35Å; Y599-A651 HydrophobicContact CE1-CB 4.39Å; Y599-A651 WeakPolarHBondContact CE1-O 3.49Å; Y599-S652 VanDerWaalsContact CZ-CA 3.49Å; Y599-S652 VanDerWaalsContact OH-CA 3.31Å; Y599-S652 WeakPolarHBondContact OH-CA 3.5Å; Y599-S652 PolarHBondContact OH-O 3.37Å; Y599-G655 WeakPolarHBondContact OH-CA 3.44Å
600	G	93.8	Very high	94	Very high	34 Å²	34	73.8 Å²	73.8	35%	0.351	42%	0.416	S	S	.	.	H	α-helix	trans	-60.3	-39.1	177.8	0	0	0	0	0	113.3	L596 G597 Y604	L596-G600 PolarHBondContact O-N 2.97Å; G597-G600 PolarHBondContact O-N 3.08Å; G600-Y604 WeakPolarHBondContact O-CB 3.5Å; G600-Y604 PolarHBondContact O-N 2.82Å
601	Y	94.7	Very high	93.7	Very high	158 Å²	158	71.7 Å²	71.7	62%	0.62	40%	0.401	S	S	*	.	H	α-helix	trans	-67.4	-40.7	173.3	-176.5	-100.3	0	0	0	112.1	G597 G598 Y599 Y604 T605	G597-Y601 WeakPolarHBondContact O-CB 3.26Å; G597-Y601 PolarHBondContact O-N 2.92Å; G598-Y601 PolarHBondContact O-N 3.28Å; Y599-Y601 VanDerWaalsContact C-N 3.32Å; Y599-Y601 PolarHBondContact O-N 2.94Å; Y601-Y604 PolarHBondContact O-N 3.47Å; Y601-T605 HydrophobicContact CD1-CG2 4.31Å; Y601-T605 HydrophobicContact CD2-CG2 4.49Å; Y601-T605 HydrophobicContact CE1-CG2 3.84Å; Y601-T605 HydrophobicContact CE2-CG2 4.04Å; Y601-T605 WeakPolarHBondContact O-CB 3.16Å; Y601-T605 WeakPolarHBondContact O-CG2 3.45Å; Y601-T605 PolarHBondContact O-N 2.76Å; Y601-T605 PolarHBondContact O-OG1 2.87Å
602	G	94	Very high	93.4	Very high	5 Å²	5	71.7 Å²	71.7	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-61.5	-41.9	174.6	0	0	0	0	0	112.9	G598 Y599 T605 K606 V607	G598-G602 PolarHBondContact O-N 3.01Å; Y599-G602 PolarHBondContact O-N 3.14Å; Y599-G602 VanDerWaalsContact O-N 3.12Å; G602-T605 CarbonylContact O-C 3.59Å; G602-T605 PolarHBondContact O-N 3.28Å; G602-T605 PolarHBondContact O-OG1 3.42Å; G602-K606 PolarHBondContact O-N 2.67Å; G602-V607 PolarHBondContact O-N 3.33Å
603	L	92.2	Very high	93.2	Very high	49 Å²	49	75.9 Å²	75.9	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-61.5	-48	170.6	-78.4	-179.7	0	0	0	112	Y599 T605 K606 I610	Y599-L603 HydrophobicContact CD1-CD1 4.06Å; Y599-L603 HydrophobicContact CD1-CG 4.46Å; Y599-L603 HydrophobicContact CE1-CD1 3.31Å; Y599-L603 HydrophobicContact CE1-CG 3.87Å; Y599-L603 HydrophobicContact CE2-CD1 4.36Å; Y599-L603 HydrophobicContact CE2-CD2 4.28Å; Y599-L603 HydrophobicContact CE2-CG 4.03Å; Y599-L603 VanDerWaalsContact CZ-CD1 3.46Å; Y599-L603 PolarHBondContact O-N 3.32Å; Y599-L603 WeakPolarHBondContact OH-CD1 3.37Å; Y599-L603 WeakPolarHBondContact OH-CD2 3.17Å; L603-T605 VanDerWaalsContact C-N 3.25Å; L603-T605 PolarHBondContact O-N 3.42Å; L603-K606 PolarHBondContact O-N 3.32Å; L603-I610 HydrophobicContact CD2-CG2 4.12Å
604	Y	92.6	Very high	93.1	Very high	195 Å²	195	73.1 Å²	73.1	77%	0.765	40%	0.398	S	S	*	.	H	α-helix	trans	-59.6	-38.2	179.9	177.1	-102.8	0	0	0	112.3	G600 Y601 K606	G600-Y604 WeakPolarHBondContact O-CB 3.5Å; G600-Y604 PolarHBondContact O-N 2.82Å; Y601-Y604 PolarHBondContact O-N 3.47Å; Y604-K606 VanDerWaalsContact C-N 3.34Å
605	T	94.2	Very high	93	Very high	61 Å²	61	69.6 Å²	69.6	37%	0.374	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.5	178	51.7	0	0	0	0	113.8	Y601 G602 L603 V607	Y601-T605 HydrophobicContact CD1-CG2 4.31Å; Y601-T605 HydrophobicContact CD2-CG2 4.49Å; Y601-T605 HydrophobicContact CE1-CG2 3.84Å; Y601-T605 HydrophobicContact CE2-CG2 4.04Å; Y601-T605 WeakPolarHBondContact O-CB 3.16Å; Y601-T605 WeakPolarHBondContact O-CG2 3.45Å; Y601-T605 PolarHBondContact O-N 2.76Å; Y601-T605 PolarHBondContact O-OG1 2.87Å; G602-T605 CarbonylContact O-C 3.59Å; G602-T605 PolarHBondContact O-N 3.28Å; G602-T605 PolarHBondContact O-OG1 3.42Å; L603-T605 VanDerWaalsContact C-N 3.25Å; L603-T605 PolarHBondContact O-N 3.42Å; T605-V607 VanDerWaalsContact C-N 3.33Å; T605-V607 PolarHBondContact O-N 3.49Å; T605-V607 WeakPolarHBondContact OG1-CG2 3.2Å
606	K	91	Very high	92.9	Very high	166 Å²	166	71.5 Å²	71.5	72%	0.722	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	43.5	-179.2	-56.4	-170.9	175.8	-165.3	0	113.6	G602 L603 Y604 P608	G602-K606 PolarHBondContact O-N 2.67Å; L603-K606 PolarHBondContact O-N 3.32Å; Y604-K606 VanDerWaalsContact C-N 3.34Å; K606-P608 WeakPolarHBondContact O-CD 3.47Å
607	V	92.5	Very high	93	Very high	69 Å²	69	69.6 Å²	69.6	42%	0.418	38%	0.381	S	S	.	.			trans	-62.4	126.2	176	177.1	0	0	0	0	109.4	G602 T605 I610	G602-V607 PolarHBondContact O-N 3.33Å; T605-V607 VanDerWaalsContact C-N 3.33Å; T605-V607 PolarHBondContact O-N 3.49Å; T605-V607 WeakPolarHBondContact OG1-CG2 3.2Å; V607-I610 HydrophobicContact CB-CB 4.34Å; V607-I610 WeakPolarHBondContact O-CG2 3.39Å
608	P	87.5	Confident	93.1	Very high	105 Å²	105	67.5 Å²	67.5	68%	0.682	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	147.1	174.4	-22.6	32.9	0	0	0	111.5	K606 I610	K606-P608 WeakPolarHBondContact O-CD 3.47Å; P608-I610 PolarHBondContact O-N 3.41Å; P608-I610 VanDerWaalsContact O-N 3.07Å
609	E	87.9	Confident	93.1	Very high	124 Å²	124	65.9 Å²	65.9	58%	0.579	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	8.6	176.5	-54	-54.2	142.1	0	0	116.9	N611 S612 L613	E609-N611 VanDerWaalsContact C-N 3.25Å; E609-N611 PolarHBondContact O-N 2.93Å; E609-S612 PolarHBondContact O-N 3.19Å; E609-S612 PolarHBondContact OE2-OG 2.94Å; E609-L613 PolarHBondContact O-N 3.01Å
610	I	92.7	Very high	93.2	Very high	36 Å²	36	70.5 Å²	70.5	19%	0.185	37%	0.367	C	S	.	.	H	α-helix	trans	-60.2	-35.2	-178.1	-168.6	60.9	0	0	0	112.7	Y599 L603 V607 P608 C614	Y599-I610 HydrophobicContact CD2-CD1 4.47Å; Y599-I610 HydrophobicContact CD2-CG1 3.78Å; Y599-I610 HydrophobicContact CE2-CG1 4.08Å; Y599-I610 HydrophobicContact CE2-CG2 4.38Å; L603-I610 HydrophobicContact CD2-CG2 4.12Å; V607-I610 HydrophobicContact CB-CB 4.34Å; V607-I610 WeakPolarHBondContact O-CG2 3.39Å; P608-I610 PolarHBondContact O-N 3.41Å; P608-I610 VanDerWaalsContact O-N 3.07Å; I610-C614 WeakPolarHBondContact O-CB 3.47Å; I610-C614 PolarHBondContact O-N 3.24Å
611	N	91.2	Very high	93.4	Very high	43 Å²	43	69.5 Å²	69.5	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-68.4	-50	178	-63.6	-33.1	0	0	0	111.3	Y599 E609 L613 C614 Y615 S652 A656	Y599-N611 WeakPolarHBondContact CE2-OD1 2.92Å; Y599-N611 PolarHBondContact OH-OD1 3.39Å; E609-N611 VanDerWaalsContact C-N 3.25Å; E609-N611 PolarHBondContact O-N 2.93Å; N611-L613 VanDerWaalsContact C-N 3.33Å; N611-L613 PolarHBondContact O-N 3.33Å; N611-C614 PolarHBondContact O-N 3.1Å; N611-C614 VanDerWaalsContact O-N 3.14Å; N611-Y615 PolarHBondContact O-N 2.87Å; N611-S652 PolarHBondContact O-OG 3.31Å; N611-A656 HydrophobicContact CB-CB 4.4Å
612	S	89.9	Confident	93.5	Very high	61 Å²	61	62 Å²	62	43%	0.427	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-44.6	178.6	-43.4	0	0	0	0	111.3	E609 Y615 L616	E609-S612 PolarHBondContact O-N 3.19Å; E609-S612 PolarHBondContact OE2-OG 2.94Å; S612-Y615 WeakPolarHBondContact O-CB 3.2Å; S612-Y615 PolarHBondContact O-N 3.5Å; S612-L616 PolarHBondContact O-N 2.87Å
613	L	93.5	Very high	93.6	Very high	110 Å²	110	62.9 Å²	62.9	58%	0.576	33%	0.33	S	S	*	.	H	α-helix	trans	-71.4	-31.8	177.2	-68.8	176.8	0	0	0	112.8	E609 N611 L616 G617	E609-L613 PolarHBondContact O-N 3.01Å; N611-L613 VanDerWaalsContact C-N 3.33Å; N611-L613 PolarHBondContact O-N 3.33Å; L613-L616 PolarHBondContact O-N 3.12Å; L613-G617 PolarHBondContact O-N 2.82Å
614	C	94.7	Very high	93.8	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.034	33%	0.327	C	S	.	.	H	α-helix	trans	-68.1	-39.5	172.8	-166.2	0	0	0	0	111.4	Y599 I610 N611 L616 G617 A618	Y599-C614 HydrophobicContact CD2-CB 3.57Å; Y599-C614 HydrophobicContact CE2-CB 3.85Å; Y599-C614 HydrophobicContact CG-CB 4.4Å; I610-C614 WeakPolarHBondContact O-CB 3.47Å; I610-C614 PolarHBondContact O-N 3.24Å; N611-C614 PolarHBondContact O-N 3.1Å; N611-C614 VanDerWaalsContact O-N 3.14Å; C614-L616 VanDerWaalsContact C-N 3.34Å; C614-L616 PolarHBondContact O-N 3.37Å; C614-G617 PolarHBondContact O-N 2.97Å; C614-A618 VanDerWaalsContact O-CB 3.29Å; C614-A618 WeakPolarHBondContact O-CB 3.29Å; C614-A618 PolarHBondContact O-N 3.15Å
615	Y	94.5	Very high	94	Very high	30 Å²	30	52.1 Å²	52.1	12%	0.118	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-42.2	171	-72.9	-20.2	0	0	0	112.6	N611 S612 A618 S619 S652 T653 L860	N611-Y615 PolarHBondContact O-N 2.87Å; S612-Y615 WeakPolarHBondContact O-CB 3.2Å; S612-Y615 PolarHBondContact O-N 3.5Å; Y615-A618 PolarHBondContact O-N 3.05Å; Y615-S619 VanDerWaalsContact O-CB 3.3Å; Y615-S619 WeakPolarHBondContact O-CB 3.5Å; Y615-S619 PolarHBondContact O-N 2.61Å; Y615-S619 PolarHBondContact O-OG 3.01Å; Y615-S652 WeakPolarHBondContact CD1-OG 3.14Å; Y615-S652 VanDerWaalsContact CE1-CB 3.48Å; Y615-S652 VanDerWaalsContact CE1-OG 3.28Å; Y615-S652 WeakPolarHBondContact CE1-OG 3.21Å; Y615-T653 WeakPolarHBondContact OH-CA 3.29Å; Y615-T653 PolarHBondContact OH-OG1 2.99Å; Y615-T653 VanDerWaalsContact OH-OG1 3.12Å; Y615-L860 HydrophobicContact CD1-CB 4.14Å; Y615-L860 HydrophobicContact CD1-CD2 3.87Å; Y615-L860 HydrophobicContact CE1-CD2 4.15Å; Y615-L860 HydrophobicContact CG-CB 4.05Å
616	L	94.6	Very high	94.1	Very high	94 Å²	94	49.2 Å²	49.2	49%	0.492	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-48.3	172.4	178.1	61.8	0	0	0	111.5	S612 L613 C614 A618 S619 L620	S612-L616 PolarHBondContact O-N 2.87Å; L613-L616 PolarHBondContact O-N 3.12Å; C614-L616 VanDerWaalsContact C-N 3.34Å; C614-L616 PolarHBondContact O-N 3.37Å; L616-A618 VanDerWaalsContact C-N 3.35Å; L616-A618 PolarHBondContact O-N 3.19Å; L616-S619 WeakPolarHBondContact O-CB 3.34Å; L616-S619 PolarHBondContact O-N 3.23Å; L616-L620 HydrophobicContact CD1-CD1 4.27Å; L616-L620 HydrophobicContact CD1-CG 4.19Å; L616-L620 HydrophobicContact CG-CD1 4.18Å; L616-L620 HydrophobicContact CG-CG 4.49Å; L616-L620 WeakPolarHBondContact O-CG 3.33Å; L616-L620 PolarHBondContact O-N 3.23Å
617	G	96	Very high	94.4	Very high	21 Å²	21	43.2 Å²	43.2	22%	0.216	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-43.3	177.7	0	0	0	0	0	112.9	L613 C614 L620 A621	L613-G617 PolarHBondContact O-N 2.82Å; C614-G617 PolarHBondContact O-N 2.97Å; G617-L620 PolarHBondContact O-N 3.14Å; G617-A621 WeakPolarHBondContact O-CB 3.33Å; G617-A621 PolarHBondContact O-N 3.18Å
618	A	96.7	Very high	94.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-41.9	175.4	0	0	0	0	0	111.8	C614 Y615 L616 A621 C622 G645 A649 L860	C614-A618 VanDerWaalsContact O-CB 3.29Å; C614-A618 WeakPolarHBondContact O-CB 3.29Å; C614-A618 PolarHBondContact O-N 3.15Å; Y615-A618 PolarHBondContact O-N 3.05Å; L616-A618 VanDerWaalsContact C-N 3.35Å; L616-A618 PolarHBondContact O-N 3.19Å; A618-A621 PolarHBondContact O-N 2.83Å; A618-C622 PolarHBondContact O-N 3.12Å; A618-C622 PolarHBondContact O-SG 3.08Å; A618-G645 WeakPolarHBondContact CB-O 3.42Å; A618-G645 WeakPolarHBondContact O-CA 2.91Å; A618-A649 HydrophobicContact CB-CB 4.25Å; A618-L860 HydrophobicContact CB-CD1 3.97Å
619	S	96.1	Very high	94.8	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-46.4	176.1	-61.2	0	0	0	0	111.9	Y615 L616 A621 C622 V623 L860	Y615-S619 VanDerWaalsContact O-CB 3.3Å; Y615-S619 WeakPolarHBondContact O-CB 3.5Å; Y615-S619 PolarHBondContact O-N 2.61Å; Y615-S619 PolarHBondContact O-OG 3.01Å; L616-S619 WeakPolarHBondContact O-CB 3.34Å; L616-S619 PolarHBondContact O-N 3.23Å; S619-A621 VanDerWaalsContact C-N 3.32Å; S619-A621 PolarHBondContact O-N 3.01Å; S619-C622 WeakPolarHBondContact O-CB 3.29Å; S619-C622 PolarHBondContact O-N 3.22Å; S619-C622 VanDerWaalsContact O-N 3.14Å; S619-V623 WeakPolarHBondContact O-CG2 3.46Å; S619-V623 PolarHBondContact O-N 3.13Å; S619-L860 WeakPolarHBondContact OG-CD1 3.38Å
620	L	97	Very high	95.1	Very high	108 Å²	108	32.4 Å²	32.4	57%	0.565	20%	0.199	S	C	*	.	H	α-helix	trans	-63.8	-37.6	176.6	-69.4	175.9	0	0	0	111.9	L616 G617 C622 V623 G624	L616-L620 HydrophobicContact CD1-CD1 4.27Å; L616-L620 HydrophobicContact CD1-CG 4.19Å; L616-L620 HydrophobicContact CG-CD1 4.18Å; L616-L620 HydrophobicContact CG-CG 4.49Å; L616-L620 WeakPolarHBondContact O-CG 3.33Å; L616-L620 PolarHBondContact O-N 3.23Å; G617-L620 PolarHBondContact O-N 3.14Å; L620-C622 VanDerWaalsContact C-N 3.35Å; L620-V623 PolarHBondContact O-N 3.04Å; L620-G624 PolarHBondContact O-N 2.81Å
621	A	97.3	Very high	95	Very high	13 Å²	13	32.4 Å²	32.4	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-38.3	173.1	0	0	0	0	0	111.7	G617 A618 S619 G624 A625 L641 I644	G617-A621 WeakPolarHBondContact O-CB 3.33Å; G617-A621 PolarHBondContact O-N 3.18Å; A618-A621 PolarHBondContact O-N 2.83Å; S619-A621 VanDerWaalsContact C-N 3.32Å; S619-A621 PolarHBondContact O-N 3.01Å; A621-G624 CarbonylContact O-C 3.44Å; A621-G624 PolarHBondContact O-N 3.22Å; A621-A625 PolarHBondContact O-N 3.06Å; A621-L641 WeakPolarHBondContact CB-O 3.47Å; A621-L641 CarbonylContact O-C 3.46Å; A621-I644 HydrophobicContact CB-CG2 4.47Å
622	C	96.9	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-39.2	173.2	-66	0	0	0	0	112.7	I524 A618 S619 L620 A625 L626 V864 L867	I524-C622 HydrophobicContact CD1-CB 4.3Å; I524-C622 HydrophobicContact CG2-CB 4.3Å; A618-C622 PolarHBondContact O-N 3.12Å; A618-C622 PolarHBondContact O-SG 3.08Å; S619-C622 WeakPolarHBondContact O-CB 3.29Å; S619-C622 PolarHBondContact O-N 3.22Å; S619-C622 VanDerWaalsContact O-N 3.14Å; L620-C622 VanDerWaalsContact C-N 3.35Å; C622-A625 WeakPolarHBondContact O-CB 3.35Å; C622-A625 PolarHBondContact O-N 2.91Å; C622-L626 PolarHBondContact O-N 3.1Å; C622-V864 HydrophobicContact CB-CG2 4.11Å; C622-L867 HydrophobicContact CB-CD2 4.42Å
623	V	96.8	Very high	94.9	Very high	25 Å²	25	33 Å²	33	15%	0.152	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-46.8	171.5	172.3	0	0	0	0	110.4	V501 S619 L620 A625 L626 A627 L867	V501-V623 HydrophobicContact CG1-CB 4.48Å; V501-V623 HydrophobicContact CG1-CG1 3.62Å; V501-V623 HydrophobicContact CG1-CG2 3.94Å; S619-V623 WeakPolarHBondContact O-CG2 3.46Å; S619-V623 PolarHBondContact O-N 3.13Å; L620-V623 PolarHBondContact O-N 3.04Å; V623-A625 PolarHBondContact O-N 3.5Å; V623-L626 PolarHBondContact O-N 2.97Å; V623-L626 VanDerWaalsContact O-N 3.15Å; V623-A627 WeakPolarHBondContact O-CB 3.32Å; V623-A627 PolarHBondContact O-N 3.18Å; V623-L867 HydrophobicContact CG2-CD2 4.11Å
624	G	96.8	Very high	95	Very high	17 Å²	17	30.1 Å²	30.1	18%	0.175	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-29.9	174.4	0	0	0	0	0	112.9	L620 A621 A627 G628	L620-G624 PolarHBondContact O-N 2.81Å; A621-G624 CarbonylContact O-C 3.44Å; A621-G624 PolarHBondContact O-N 3.22Å; G624-A627 PolarHBondContact O-N 3.25Å; G624-G628 PolarHBondContact O-N 3.03Å
625	A	97	Very high	95	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-47.4	175.6	0	0	0	0	0	111.7	V520 I524 A621 C622 V623 L629 G638 G642	V520-A625 HydrophobicContact CG1-CB 4.22Å; I524-A625 HydrophobicContact CD1-CB 3.87Å; A621-A625 PolarHBondContact O-N 3.06Å; C622-A625 WeakPolarHBondContact O-CB 3.35Å; C622-A625 PolarHBondContact O-N 2.91Å; V623-A625 PolarHBondContact O-N 3.5Å; A625-L629 WeakPolarHBondContact O-CD1 3.03Å; A625-G638 WeakPolarHBondContact CA-O 3.49Å; A625-G638 VanDerWaalsContact CB-O 3.26Å; A625-G638 WeakPolarHBondContact CB-O 3.32Å; A625-G638 VanDerWaalsContact O-CA 3.31Å; A625-G638 WeakPolarHBondContact O-CA 3.19Å; A625-G642 VanDerWaalsContact CB-CA 3.44Å
626	L	95.9	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-73.8	-41.2	177.1	-85.1	68.4	0	0	0	111.8	T505 V506 L517 V520 T521 I524 C622 V623 G628 L629 L867	T505-L626 HydrophobicContact CG2-CB 3.69Å; V506-L626 HydrophobicContact CG2-CD2 3.92Å; L517-L626 HydrophobicContact CD1-CB 4.39Å; L517-L626 HydrophobicContact CD1-CD2 3.76Å; L517-L626 HydrophobicContact CD1-CG 3.56Å; V520-L626 HydrophobicContact CG1-CD1 3.81Å; T521-L626 HydrophobicContact CG2-CD1 4.23Å; T521-L626 HydrophobicContact CG2-CD2 3.97Å; T521-L626 HydrophobicContact CG2-CG 4.38Å; I524-L626 HydrophobicContact CD1-CD1 3.83Å; C622-L626 PolarHBondContact O-N 3.1Å; V623-L626 PolarHBondContact O-N 2.97Å; V623-L626 VanDerWaalsContact O-N 3.15Å; L626-G628 PolarHBondContact O-N 2.99Å; L626-L629 WeakPolarHBondContact O-CB 3.2Å; L626-L629 PolarHBondContact O-N 3.13Å; L626-L867 HydrophobicContact CD1-CD2 4.11Å; L626-L867 HydrophobicContact CD2-CD1 3.73Å; L626-L867 HydrophobicContact CD2-CD2 4.22Å; L626-L867 HydrophobicContact CD2-CG 3.75Å
627	A	96.3	Very high	95	Very high	41 Å²	41	26.7 Å²	26.7	34%	0.339	17%	0.173	S	C	.	.	H	α-helix	trans	-60.4	-34.7	177.9	0	0	0	0	0	112.1	T505 V623 G624 L629 S630	T505-A627 HydrophobicContact CG2-CB 3.85Å; T505-A627 VanDerWaalsContact CG2-N 3.35Å; V623-A627 WeakPolarHBondContact O-CB 3.32Å; V623-A627 PolarHBondContact O-N 3.18Å; G624-A627 PolarHBondContact O-N 3.25Å; A627-L629 PolarHBondContact O-N 2.89Å; A627-S630 VanDerWaalsContact O-CB 3.27Å; A627-S630 WeakPolarHBondContact O-CB 3.49Å; A627-S630 PolarHBondContact O-N 3.4Å; A627-S630 VanDerWaalsContact O-N 3.09Å; A627-S630 PolarHBondContact O-OG 2.99Å
628	G	95.5	Very high	95.1	Very high	8 Å²	8	25.7 Å²	25.7	8%	0.082	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.7	-21.4	175.1	0	0	0	0	0	113.9	G624 L626 S630 T634 C635	G624-G628 PolarHBondContact O-N 3.03Å; L626-G628 PolarHBondContact O-N 2.99Å; G628-S630 PolarHBondContact O-N 3.19Å; G628-T634 CarbonylContact O-C 3.43Å; G628-T634 WeakPolarHBondContact O-CB 3.45Å; G628-T634 PolarHBondContact O-OG1 2.91Å; G628-C635 VanDerWaalsContact O-CA 3.27Å; G628-C635 WeakPolarHBondContact O-CA 3.29Å; G628-C635 PolarHBondContact O-N 3.42Å; G628-C635 VanDerWaalsContact O-N 3.15Å
629	L	94.3	Very high	95	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-82.7	6.7	175.7	-78.5	77.8	0	0	0	113.4	V509 T510 L513 P516 L517 V520 A625 L626 A627 S631	V509-L629 HydrophobicContact CG1-CB 4Å; V509-L629 HydrophobicContact CG2-CB 4.14Å; T510-L629 PolarHBondContact N-O 3.3Å; L513-L629 HydrophobicContact CD1-CB 4.46Å; L513-L629 WeakPolarHBondContact CD1-O 3.16Å; P516-L629 HydrophobicContact CB-CD2 3.9Å; L517-L629 HydrophobicContact CB-CD2 3.91Å; V520-L629 HydrophobicContact CG2-CD1 4.11Å; V520-L629 HydrophobicContact CG2-CD2 4.23Å; A625-L629 WeakPolarHBondContact O-CD1 3.03Å; L626-L629 WeakPolarHBondContact O-CB 3.2Å; L626-L629 PolarHBondContact O-N 3.13Å; A627-L629 PolarHBondContact O-N 2.89Å; L629-S631 PolarHBondContact O-N 2.99Å
630	S	92.7	Very high	95.1	Very high	63 Å²	63	26.7 Å²	26.7	44%	0.441	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-68	-15.6	173.1	56.2	0	0	0	0	114.6	G508 T510 A627 G628	G508-S630 VanDerWaalsContact O-CA 3.24Å; G508-S630 WeakPolarHBondContact O-CA 3.5Å; G508-S630 WeakPolarHBondContact O-CB 3.4Å; T510-S630 PolarHBondContact OG1-O 2.75Å; A627-S630 VanDerWaalsContact O-CB 3.27Å; A627-S630 WeakPolarHBondContact O-CB 3.49Å; A627-S630 PolarHBondContact O-N 3.4Å; A627-S630 VanDerWaalsContact O-N 3.09Å; A627-S630 PolarHBondContact O-OG 2.99Å; G628-S630 PolarHBondContact O-N 3.19Å
631	S	91.4	Very high	95.1	Very high	35 Å²	35	23.8 Å²	23.8	25%	0.245	15%	0.153	C	C	.	.	S	Bend	trans	-147.4	147.7	174.5	172	0	0	0	0	111.2	L629 T633 T634 C635	L629-S631 PolarHBondContact O-N 2.99Å; S631-T633 PolarHBondContact O-N 3.49Å; S631-T633 PolarHBondContact OG-N 3.04Å; S631-T633 VanDerWaalsContact OG-N 3.12Å; S631-T633 PolarHBondContact OG-OG1 2.83Å; S631-T634 PolarHBondContact O-N 3.14Å; S631-T634 PolarHBondContact O-OG1 3.49Å; S631-C635 WeakPolarHBondContact O-CB 3.32Å; S631-C635 PolarHBondContact O-N 3.04Å
632	Q	89.4	Confident	95.1	Very high	27 Å²	27	23.2 Å²	23.2	13%	0.126	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.3	171.8	-68.7	82.9	-20.6	0	0	112.2	A512 L513 C635 R636 Y981	A512-Q632 VanDerWaalsContact CB-NE2 3.32Å; L513-Q632 HydrophobicContact CD1-CG 4.29Å; L513-Q632 HydrophobicContact CD2-CG 4.42Å; L513-Q632 HydrophobicContact CG-CG 4.43Å; Q632-C635 PolarHBondContact O-SG 2.83Å; Q632-R636 PolarHBondContact O-NH1 3.36Å; Q632-Y981 HydrophobicContact CB-CE2 4.49Å; Q632-Y981 HydrophobicContact CG-CD2 4.34Å; Q632-Y981 HydrophobicContact CG-CG 4.37Å
633	T	90.3	Very high	95.1	Very high	90 Å²	90	26.4 Å²	26.4	55%	0.552	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-29	176.8	56.7	0	0	0	0	112.8	S631	S631-T633 PolarHBondContact O-N 3.49Å; S631-T633 PolarHBondContact OG-N 3.04Å; S631-T633 VanDerWaalsContact OG-N 3.12Å; S631-T633 PolarHBondContact OG-OG1 2.83Å
634	T	94.4	Very high	95.1	Very high	49 Å²	49	26.2 Å²	26.2	30%	0.301	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-6.4	-177.8	54.6	0	0	0	0	113.2	G628 S631 R636 L637 G638	G628-T634 CarbonylContact O-C 3.43Å; G628-T634 WeakPolarHBondContact O-CB 3.45Å; G628-T634 PolarHBondContact O-OG1 2.91Å; S631-T634 PolarHBondContact O-N 3.14Å; S631-T634 PolarHBondContact O-OG1 3.49Å; T634-R636 VanDerWaalsContact C-N 3.26Å; T634-R636 PolarHBondContact O-N 3.11Å; T634-L637 VanDerWaalsContact O-CB 3.31Å; T634-L637 WeakPolarHBondContact O-CB 3.39Å; T634-L637 PolarHBondContact O-N 3.28Å; T634-G638 PolarHBondContact O-N 2.99Å; T634-G638 VanDerWaalsContact O-N 3.12Å
635	C	94.2	Very high	95.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-33.4	-171.3	65.2	0	0	0	0	113.7	L513 L572 G628 S631 Q632 G638 N639	L513-C635 HydrophobicContact CD1-CB 3.9Å; L572-C635 HydrophobicContact CD1-CB 4.34Å; L572-C635 VanDerWaalsContact CD1-O 3.28Å; L572-C635 WeakPolarHBondContact CD1-O 3.29Å; L572-C635 HydrophobicContact CD2-CB 3.73Å; G628-C635 VanDerWaalsContact O-CA 3.27Å; G628-C635 WeakPolarHBondContact O-CA 3.29Å; G628-C635 PolarHBondContact O-N 3.42Å; G628-C635 VanDerWaalsContact O-N 3.15Å; S631-C635 WeakPolarHBondContact O-CB 3.32Å; S631-C635 PolarHBondContact O-N 3.04Å; Q632-C635 PolarHBondContact O-SG 2.83Å; C635-G638 PolarHBondContact O-N 3.31Å; C635-N639 PolarHBondContact O-N 3.31Å; C635-N639 VanDerWaalsContact O-N 3.16Å
636	R	95.2	Very high	95.1	Very high	7 Å²	7	25.6 Å²	25.6	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-67.3	-39.6	176.1	-76	79.7	88.2	174.7	10.2	111.7	E583 Q632 T634 G638 N639 N640	E583-R636 VanDerWaalsContact CD-NH2 3.28Å; E583-R636 IonicContact OE1-CZ 2.65Å; E583-R636 VanDerWaalsContact OE1-CZ 3.23Å; E583-R636 IonicContact OE1-NE 3.47Å; E583-R636 PolarHBondContact OE1-NE 2.96Å; E583-R636 IonicContact OE1-NH2 2.72Å; E583-R636 PolarHBondContact OE1-NH2 2.85Å; E583-R636 IonicContact OE2-CZ 3.99Å; E583-R636 IonicContact OE2-NE 3.89Å; E583-R636 PolarHBondContact OE2-NE 3.23Å; E583-R636 IonicContact OE2-NH2 3Å; E583-R636 PolarHBondContact OE2-NH2 2.95Å; Q632-R636 PolarHBondContact O-NH1 3.36Å; T634-R636 VanDerWaalsContact C-N 3.26Å; T634-R636 PolarHBondContact O-N 3.11Å; R636-G638 VanDerWaalsContact C-N 3.28Å; R636-G638 PolarHBondContact O-N 3.5Å; R636-N639 PolarHBondContact O-N 2.83Å; R636-N640 PolarHBondContact O-N 3.45Å; R636-N640 VanDerWaalsContact O-N 3.12Å; R636-N640 PolarHBondContact O-ND2 2.9Å; R636-N640 VanDerWaalsContact O-ND2 3.1Å
637	L	95.8	Very high	95.1	Very high	51 Å²	51	27.5 Å²	27.5	27%	0.267	17%	0.17	S	C	.	.	H	α-helix	trans	-58.4	-43.1	170.8	166.8	67.4	0	0	0	110.4	Y588 T634 N639 N640 L641	Y588-L637 HydrophobicContact CD1-CD1 3.9Å; Y588-L637 HydrophobicContact CE1-CD1 3.46Å; Y588-L637 VanDerWaalsContact CE1-CD1 3.46Å; Y588-L637 HydrophobicContact CE2-CD1 4.47Å; T634-L637 VanDerWaalsContact O-CB 3.31Å; T634-L637 WeakPolarHBondContact O-CB 3.39Å; T634-L637 PolarHBondContact O-N 3.28Å; L637-N639 PolarHBondContact O-N 2.7Å; L637-N640 PolarHBondContact O-N 2.89Å; L637-L641 HydrophobicContact CD1-CD1 3.91Å; L637-L641 HydrophobicContact CD1-CD2 4.3Å; L637-L641 HydrophobicContact CD1-CG 3.81Å; L637-L641 HydrophobicContact CG-CD1 3.92Å; L637-L641 HydrophobicContact CG-CG 4.24Å; L637-L641 WeakPolarHBondContact O-CG 3.28Å; L637-L641 PolarHBondContact O-N 3.34Å
638	G	96.2	Very high	95.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-54.6	-48.5	175.5	0	0	0	0	0	112.5	A625 T634 C635 R636 N640 L641 G642	A625-G638 WeakPolarHBondContact CA-O 3.49Å; A625-G638 VanDerWaalsContact CB-O 3.26Å; A625-G638 WeakPolarHBondContact CB-O 3.32Å; A625-G638 VanDerWaalsContact O-CA 3.31Å; A625-G638 WeakPolarHBondContact O-CA 3.19Å; T634-G638 PolarHBondContact O-N 2.99Å; T634-G638 VanDerWaalsContact O-N 3.12Å; C635-G638 PolarHBondContact O-N 3.31Å; R636-G638 VanDerWaalsContact C-N 3.28Å; R636-G638 PolarHBondContact O-N 3.5Å; G638-N640 PolarHBondContact O-N 3.35Å; G638-L641 PolarHBondContact O-N 2.98Å; G638-G642 PolarHBondContact O-N 3.36Å
639	N	96.6	Very high	95.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-43.1	177.6	-161.9	35	0	0	0	112.6	F565 T568 Q569 L572 C635 R636 L637 G642 M643	F565-N639 WeakPolarHBondContact CD1-OD1 3.29Å; T568-N639 HydrophobicContact CG2-CB 4.14Å; T568-N639 VanDerWaalsContact CG2-OD1 3.22Å; T568-N639 WeakPolarHBondContact CG2-OD1 3.46Å; Q569-N639 PolarHBondContact N-ND2 3.06Å; Q569-N639 PolarHBondContact OE1-ND2 3.08Å; L572-N639 HydrophobicContact CD1-CB 3.79Å; C635-N639 PolarHBondContact O-N 3.31Å; C635-N639 VanDerWaalsContact O-N 3.16Å; R636-N639 PolarHBondContact O-N 2.83Å; L637-N639 PolarHBondContact O-N 2.7Å; N639-G642 PolarHBondContact O-N 2.65Å; N639-M643 VanDerWaalsContact ND2-CE 3.26Å; N639-M643 WeakPolarHBondContact ND2-CE 3.46Å; N639-M643 WeakPolarHBondContact O-CG 3.33Å; N639-M643 PolarHBondContact O-N 3.19Å
640	N	97.1	Very high	95.1	Very high	26 Å²	26	26 Å²	26	14%	0.139	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-42.6	177.6	-70.3	-44.9	0	0	0	112.4	Y588 R636 L637 G638 G642 M643 I644	Y588-N640 HydrophobicContact CD2-CB 4.27Å; Y588-N640 WeakPolarHBondContact CD2-ND2 3.38Å; Y588-N640 HydrophobicContact CG-CB 4.26Å; R636-N640 PolarHBondContact O-N 3.45Å; R636-N640 VanDerWaalsContact O-N 3.12Å; R636-N640 PolarHBondContact O-ND2 2.9Å; R636-N640 VanDerWaalsContact O-ND2 3.1Å; L637-N640 PolarHBondContact O-N 2.89Å; G638-N640 PolarHBondContact O-N 3.35Å; N640-G642 VanDerWaalsContact C-N 3.3Å; N640-G642 PolarHBondContact O-N 3.48Å; N640-M643 PolarHBondContact O-N 3.49Å; N640-I644 VanDerWaalsContact O-CG1 3.31Å; N640-I644 WeakPolarHBondContact O-CG1 3.38Å; N640-I644 PolarHBondContact O-N 3.07Å
641	L	97.5	Very high	95.1	Very high	48 Å²	48	24.6 Å²	24.6	25%	0.251	15%	0.146	S	C	.	.	H	α-helix	trans	-62.6	-38.4	175.1	-70.5	176.1	0	0	0	111.6	A621 L637 G638 M643 I644 G645	A621-L641 WeakPolarHBondContact CB-O 3.47Å; A621-L641 CarbonylContact O-C 3.46Å; L637-L641 HydrophobicContact CD1-CD1 3.91Å; L637-L641 HydrophobicContact CD1-CD2 4.3Å; L637-L641 HydrophobicContact CD1-CG 3.81Å; L637-L641 HydrophobicContact CG-CD1 3.92Å; L637-L641 HydrophobicContact CG-CG 4.24Å; L637-L641 WeakPolarHBondContact O-CG 3.28Å; L637-L641 PolarHBondContact O-N 3.34Å; G638-L641 PolarHBondContact O-N 2.98Å; L641-M643 PolarHBondContact O-N 3.18Å; L641-I644 HydrophobicContact CD2-CD1 4.5Å; L641-I644 PolarHBondContact O-N 3.35Å; L641-G645 PolarHBondContact O-N 2.68Å
642	G	96.8	Very high	95.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-44.2	173.4	0	0	0	0	0	112.5	F565 A625 G638 N639 N640 G645 V646	F565-G642 VanDerWaalsContact CE1-C 3.49Å; F565-G642 VanDerWaalsContact CZ-C 3.41Å; F565-G642 WeakPolarHBondContact CZ-O 3.27Å; A625-G642 VanDerWaalsContact CB-CA 3.44Å; G638-G642 PolarHBondContact O-N 3.36Å; N639-G642 PolarHBondContact O-N 2.65Å; N640-G642 VanDerWaalsContact C-N 3.3Å; N640-G642 PolarHBondContact O-N 3.48Å; G642-G645 PolarHBondContact O-N 3.3Å; G642-V646 WeakPolarHBondContact O-CG2 3.44Å; G642-V646 PolarHBondContact O-N 2.92Å
643	M	97	Very high	95.5	Very high	68 Å²	68	21.6 Å²	21.6	34%	0.335	13%	0.128	S	C	.	.	H	α-helix	trans	-63	-42.1	175.7	-65.6	-174.9	-153.1	0	0	111.9	F565 N639 N640 L641 G645 A647	F565-M643 HydrophobicContact CB-CE 4.13Å; F565-M643 HydrophobicContact CB-CG 4.39Å; F565-M643 HydrophobicContact CD1-CE 4.17Å; F565-M643 HydrophobicContact CD1-CG 3.48Å; F565-M643 VanDerWaalsContact CD1-CG 3.48Å; F565-M643 HydrophobicContact CD2-CG 4.31Å; F565-M643 HydrophobicContact CE1-CB 4.46Å; F565-M643 HydrophobicContact CE1-CG 3.75Å; F565-M643 HydrophobicContact CG-CE 4.43Å; F565-M643 HydrophobicContact CG-CG 3.81Å; F565-M643 HydrophobicContact CZ-CG 4.28Å; N639-M643 VanDerWaalsContact ND2-CE 3.26Å; N639-M643 WeakPolarHBondContact ND2-CE 3.46Å; N639-M643 WeakPolarHBondContact O-CG 3.33Å; N639-M643 PolarHBondContact O-N 3.19Å; N640-M643 PolarHBondContact O-N 3.49Å; L641-M643 PolarHBondContact O-N 3.18Å; M643-G645 VanDerWaalsContact C-N 3.33Å; M643-A647 WeakPolarHBondContact O-CB 3.47Å; M643-A647 PolarHBondContact O-N 2.92Å
644	I	97.2	Very high	95.7	Very high	20 Å²	20	18.7 Å²	18.7	10%	0.103	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-43.4	175.7	-66.9	168.6	0	0	0	110.5	P591 A592 F595 A621 N640 L641 A647 G648	P591-I644 HydrophobicContact CG-CD1 4.36Å; A592-I644 HydrophobicContact CB-CD1 4.02Å; A592-I644 HydrophobicContact CB-CG1 3.7Å; F595-I644 HydrophobicContact CD1-CG2 3.85Å; F595-I644 HydrophobicContact CE1-CG2 4.44Å; A621-I644 HydrophobicContact CB-CG2 4.47Å; N640-I644 VanDerWaalsContact O-CG1 3.31Å; N640-I644 WeakPolarHBondContact O-CG1 3.38Å; N640-I644 PolarHBondContact O-N 3.07Å; L641-I644 HydrophobicContact CD2-CD1 4.5Å; L641-I644 PolarHBondContact O-N 3.35Å; I644-A647 PolarHBondContact O-N 3.45Å; I644-G648 PolarHBondContact O-N 3.48Å
645	G	96.6	Very high	95.5	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.6	-51.2	178.3	0	0	0	0	0	112.6	A618 L641 G642 M643 G648 A649	A618-G645 WeakPolarHBondContact CB-O 3.42Å; A618-G645 WeakPolarHBondContact O-CA 2.91Å; L641-G645 PolarHBondContact O-N 2.68Å; G642-G645 PolarHBondContact O-N 3.3Å; M643-G645 VanDerWaalsContact C-N 3.33Å; G645-G648 PolarHBondContact O-N 3.07Å; G645-A649 WeakPolarHBondContact O-CB 3.31Å; G645-A649 PolarHBondContact O-N 3.4Å
646	V	96.6	Very high	95.4	Very high	4 Å²	4	19 Å²	19	2%	0.024	12%	0.118	C	C	.	.	H	α-helix	trans	-66	-39.8	178.5	177.6	0	0	0	0	111.6	I524 I527 I561 F565 G642 A649 M650	I524-V646 HydrophobicContact CG1-CG2 4.33Å; I527-V646 HydrophobicContact CD1-CG2 3.9Å; I527-V646 HydrophobicContact CG1-CB 4.45Å; I527-V646 HydrophobicContact CG1-CG1 4.2Å; I527-V646 HydrophobicContact CG1-CG2 3.99Å; I561-V646 HydrophobicContact CD1-CG1 3.85Å; I561-V646 HydrophobicContact CG1-CG1 4.16Å; I561-V646 HydrophobicContact CG2-CG1 4.04Å; F565-V646 HydrophobicContact CE2-CB 3.96Å; F565-V646 HydrophobicContact CE2-CG1 4.29Å; F565-V646 HydrophobicContact CE2-CG2 3.7Å; F565-V646 HydrophobicContact CZ-CB 4.16Å; F565-V646 HydrophobicContact CZ-CG2 3.6Å; G642-V646 WeakPolarHBondContact O-CG2 3.44Å; G642-V646 PolarHBondContact O-N 2.92Å; V646-A649 WeakPolarHBondContact O-CB 2.92Å; V646-A649 PolarHBondContact O-N 2.96Å; V646-M650 HydrophobicContact CG1-CG 4.4Å; V646-M650 VanDerWaalsContact O-CG 3.25Å; V646-M650 WeakPolarHBondContact O-CG 3.38Å; V646-M650 PolarHBondContact O-N 2.89Å
647	A	96.1	Very high	95.2	Very high	41 Å²	41	21.7 Å²	21.7	34%	0.339	13%	0.132	S	C	.	.	H	α-helix	trans	-63.4	-43.8	175.9	0	0	0	0	0	111.9	L596 M643 I644 M650 A651	L596-A647 HydrophobicContact CD1-CB 4.19Å; M643-A647 WeakPolarHBondContact O-CB 3.47Å; M643-A647 PolarHBondContact O-N 2.92Å; I644-A647 PolarHBondContact O-N 3.45Å; A647-M650 PolarHBondContact O-N 3.12Å; A647-A651 VanDerWaalsContact O-CB 3.26Å; A647-A651 WeakPolarHBondContact O-CB 3.32Å; A647-A651 PolarHBondContact O-N 2.8Å
648	G	95.6	Very high	94.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-42.1	175.9	0	0	0	0	0	112.9	I644 G645 A651 S652	I644-G648 PolarHBondContact O-N 3.48Å; G645-G648 PolarHBondContact O-N 3.07Å; G648-A651 PolarHBondContact O-N 3.12Å; G648-S652 WeakPolarHBondContact O-CB 3.34Å; G648-S652 PolarHBondContact O-N 3.25Å
649	A	95.1	Very high	94.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-55	-54.9	173.2	0	0	0	0	0	111.9	I527 A618 G645 V646 A651 S652 T653 L860	I527-A649 HydrophobicContact CD1-CB 3.91Å; I527-A649 HydrophobicContact CG1-CB 4.16Å; A618-A649 HydrophobicContact CB-CB 4.25Å; G645-A649 WeakPolarHBondContact O-CB 3.31Å; G645-A649 PolarHBondContact O-N 3.4Å; V646-A649 WeakPolarHBondContact O-CB 2.92Å; V646-A649 PolarHBondContact O-N 2.96Å; A649-A651 PolarHBondContact O-N 2.75Å; A649-S652 PolarHBondContact O-N 3.25Å; A649-T653 PolarHBondContact O-N 3.06Å; A649-T653 PolarHBondContact O-OG1 3.35Å; A649-T653 VanDerWaalsContact O-OG1 3.09Å; A649-L860 HydrophobicContact CB-CD1 4.24Å; A649-L860 HydrophobicContact CB-CD2 3.29Å; A649-L860 HydrophobicContact CB-CG 4.35Å
650	M	94.5	Very high	94.7	Very high	18 Å²	18	30.1 Å²	30.1	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-43.7	-179.2	-64.4	-61	-72.8	0	0	111.8	A529 A530 L533 V646 A647 S652 T653 I654 I671	A529-M650 HydrophobicContact CB-CE 3.6Å; A529-M650 HydrophobicContact CB-SD 3.76Å; A530-M650 HydrophobicContact CB-SD 4.23Å; L533-M650 HydrophobicContact CD1-CE 3.34Å; L533-M650 HydrophobicContact CD1-SD 4.03Å; L533-M650 HydrophobicContact CG-CE 4.26Å; V646-M650 HydrophobicContact CG1-CG 4.4Å; V646-M650 VanDerWaalsContact O-CG 3.25Å; V646-M650 WeakPolarHBondContact O-CG 3.38Å; V646-M650 PolarHBondContact O-N 2.89Å; A647-M650 PolarHBondContact O-N 3.12Å; M650-S652 VanDerWaalsContact C-N 3.34Å; M650-S652 PolarHBondContact O-N 3.43Å; M650-T653 PolarHBondContact O-N 3.38Å; M650-I654 WeakPolarHBondContact O-CB 3.2Å; M650-I654 VanDerWaalsContact O-CG1 3.26Å; M650-I654 WeakPolarHBondContact O-CG1 3.32Å; M650-I654 PolarHBondContact O-N 2.92Å; M650-I671 HydrophobicContact CE-CD1 3.5Å; M650-I671 HydrophobicContact CE-CG1 3.94Å
651	A	94.5	Very high	94.6	Very high	32 Å²	32	37.4 Å²	37.4	26%	0.264	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-42.9	176.8	0	0	0	0	0	111.6	L596 Y599 A647 G648 A649 I654 G655	L596-A651 HydrophobicContact CD2-CB 3.82Å; Y599-A651 HydrophobicContact CD1-CB 4.35Å; Y599-A651 HydrophobicContact CE1-CB 4.39Å; Y599-A651 WeakPolarHBondContact CE1-O 3.49Å; A647-A651 VanDerWaalsContact O-CB 3.26Å; A647-A651 WeakPolarHBondContact O-CB 3.32Å; A647-A651 PolarHBondContact O-N 2.8Å; G648-A651 PolarHBondContact O-N 3.12Å; A649-A651 PolarHBondContact O-N 2.75Å; A651-I654 PolarHBondContact O-N 3.33Å; A651-G655 PolarHBondContact O-N 2.83Å
652	S	93.7	Very high	94.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-41.2	179.5	-171.2	0	0	0	0	112.6	Y599 N611 Y615 G648 A649 M650 G655 A656	Y599-S652 VanDerWaalsContact CZ-CA 3.49Å; Y599-S652 VanDerWaalsContact OH-CA 3.31Å; Y599-S652 WeakPolarHBondContact OH-CA 3.5Å; Y599-S652 PolarHBondContact OH-O 3.37Å; N611-S652 PolarHBondContact O-OG 3.31Å; Y615-S652 WeakPolarHBondContact CD1-OG 3.14Å; Y615-S652 VanDerWaalsContact CE1-CB 3.48Å; Y615-S652 VanDerWaalsContact CE1-OG 3.28Å; Y615-S652 WeakPolarHBondContact CE1-OG 3.21Å; G648-S652 WeakPolarHBondContact O-CB 3.34Å; G648-S652 PolarHBondContact O-N 3.25Å; A649-S652 PolarHBondContact O-N 3.25Å; M650-S652 VanDerWaalsContact C-N 3.34Å; M650-S652 PolarHBondContact O-N 3.43Å; S652-G655 PolarHBondContact O-N 3.4Å; S652-A656 VanDerWaalsContact O-CB 3.26Å; S652-A656 WeakPolarHBondContact O-CB 3.46Å; S652-A656 PolarHBondContact O-N 2.81Å
653	T	93.7	Very high	94.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-44.2	176.8	-59.7	0	0	0	0	112.2	A530 L533 L534 Y615 A649 M650 G655 A656 L657	A530-T653 HydrophobicContact CB-CG2 4.41Å; A530-T653 WeakPolarHBondContact O-CG2 3.23Å; L533-T653 HydrophobicContact CB-CG2 3.84Å; L533-T653 HydrophobicContact CD1-CG2 4.29Å; L534-T653 HydrophobicContact CD2-CG2 3.77Å; L534-T653 HydrophobicContact CG-CG2 3.83Å; Y615-T653 WeakPolarHBondContact OH-CA 3.29Å; Y615-T653 PolarHBondContact OH-OG1 2.99Å; Y615-T653 VanDerWaalsContact OH-OG1 3.12Å; A649-T653 PolarHBondContact O-N 3.06Å; A649-T653 PolarHBondContact O-OG1 3.35Å; A649-T653 VanDerWaalsContact O-OG1 3.09Å; M650-T653 PolarHBondContact O-N 3.38Å; T653-G655 VanDerWaalsContact C-N 3.33Å; T653-G655 PolarHBondContact O-N 3.41Å; T653-A656 PolarHBondContact O-N 3.31Å; T653-L657 HydrophobicContact CG2-CD1 4.5Å; T653-L657 WeakPolarHBondContact O-CG 3.41Å; T653-L657 PolarHBondContact O-N 3.18Å
654	I	94.2	Very high	94.4	Very high	29 Å²	29	38.7 Å²	38.7	15%	0.149	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-43.1	176	-68	168.8	0	0	0	110.5	L533 M650 A651 L657 P659 L664 I671	L533-I654 HydrophobicContact CD1-CD1 4.28Å; L533-I654 HydrophobicContact CD1-CG1 3.84Å; L533-I654 HydrophobicContact CD2-CG1 4.45Å; M650-I654 WeakPolarHBondContact O-CB 3.2Å; M650-I654 VanDerWaalsContact O-CG1 3.26Å; M650-I654 WeakPolarHBondContact O-CG1 3.32Å; M650-I654 PolarHBondContact O-N 2.92Å; A651-I654 PolarHBondContact O-N 3.33Å; I654-L657 PolarHBondContact O-N 2.88Å; I654-P659 HydrophobicContact CG2-CG 4.2Å; I654-P659 WeakPolarHBondContact O-CD 3.33Å; I654-L664 HydrophobicContact CG2-CD1 3.61Å; I654-I671 HydrophobicContact CD1-CD1 4.25Å
655	G	92.3	Very high	94.4	Very high	13 Å²	13	39.3 Å²	39.3	13%	0.134	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-39	-179.9	0	0	0	0	0	113.5	Y599 A651 S652 T653 L657 E658	Y599-G655 WeakPolarHBondContact OH-CA 3.44Å; A651-G655 PolarHBondContact O-N 2.83Å; S652-G655 PolarHBondContact O-N 3.4Å; T653-G655 VanDerWaalsContact C-N 3.33Å; T653-G655 PolarHBondContact O-N 3.41Å; G655-L657 VanDerWaalsContact C-N 3.26Å; G655-L657 PolarHBondContact O-N 3.04Å; G655-E658 PolarHBondContact O-N 3.26Å
656	A	90.3	Very high	94.4	Very high	43 Å²	43	39.8 Å²	39.8	36%	0.355	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-27.2	176.4	0	0	0	0	0	113.7	N611 S652 T653	N611-A656 HydrophobicContact CB-CB 4.4Å; S652-A656 VanDerWaalsContact O-CB 3.26Å; S652-A656 WeakPolarHBondContact O-CB 3.46Å; S652-A656 PolarHBondContact O-N 2.81Å; T653-A656 PolarHBondContact O-N 3.31Å
657	L	91	Very high	94.4	Very high	63 Å²	63	39.6 Å²	39.6	33%	0.33	22%	0.224	S	C	.	.	H	α-helix	trans	-83.6	-17.4	-179	-70.8	170.6	0	0	0	114.1	L533 L534 T653 I654 G655 P659 M667	L533-L657 VanDerWaalsContact O-CD1 3.31Å; L533-L657 WeakPolarHBondContact O-CD1 3.46Å; L534-L657 HydrophobicContact CD2-CD1 4.28Å; L534-L657 HydrophobicContact CD2-CD2 3.88Å; L534-L657 HydrophobicContact CD2-CG 4.1Å; T653-L657 HydrophobicContact CG2-CD1 4.5Å; T653-L657 WeakPolarHBondContact O-CG 3.41Å; T653-L657 PolarHBondContact O-N 3.18Å; I654-L657 PolarHBondContact O-N 2.88Å; G655-L657 VanDerWaalsContact C-N 3.26Å; G655-L657 PolarHBondContact O-N 3.04Å; L657-P659 VanDerWaalsContact C-N 3.35Å; L657-M667 HydrophobicContact CD1-CE 3.75Å
658	E	90.7	Very high	94.4	Very high	148 Å²	148	41.6 Å²	41.6	69%	0.692	23%	0.228	S	C	*	.			trans	41	54.4	-171.5	-61.8	-170.5	168.7	0	0	113.3	G655	G655-E658 PolarHBondContact O-N 3.26Å
659	P	93.1	Very high	94.4	Very high	29 Å²	29	45.9 Å²	45.9	19%	0.188	26%	0.255	C	S	.	.			trans	-65.1	151.8	-169.5	27.5	-36	0	0	0	112.5	I654 L657 L663 L664 M667	I654-P659 HydrophobicContact CG2-CG 4.2Å; I654-P659 WeakPolarHBondContact O-CD 3.33Å; L657-P659 VanDerWaalsContact C-N 3.35Å; P659-L663 HydrophobicContact CB-CB 4.14Å; P659-L663 HydrophobicContact CB-CD2 3.92Å; P659-L663 HydrophobicContact CB-CG 4.01Å; P659-L664 HydrophobicContact CB-CB 4.38Å; P659-L664 HydrophobicContact CG-CB 4.04Å; P659-L664 HydrophobicContact CG-CD1 4.06Å; P659-M667 HydrophobicContact CB-CE 4.49Å; P659-M667 HydrophobicContact CB-SD 4.25Å; P659-M667 HydrophobicContact CG-SD 4.27Å
660	S	94.8	Very high	94.5	Very high	51 Å²	51	47 Å²	47	36%	0.357	26%	0.262	S	S	.	.			trans	-60.1	159.7	168.8	81.6	0	0	0	0	110.8	E662 L663 L664	S660-E662 VanDerWaalsContact CB-OE2 3.24Å; S660-E662 WeakPolarHBondContact CB-OE2 3.15Å; S660-E662 PolarHBondContact O-N 3.41Å; S660-E662 PolarHBondContact OG-OE2 3.27Å; S660-L663 PolarHBondContact O-N 3.19Å; S660-L663 PolarHBondContact OG-N 3.01Å; S660-L664 WeakPolarHBondContact O-CB 3.08Å; S660-L664 PolarHBondContact O-N 3.09Å
661	K	95.1	Very high	94.5	Very high	178 Å²	178	48 Å²	48	77%	0.774	27%	0.267	S	S	*	.	H	α-helix	trans	-58.1	-35.4	-179.8	-65.8	179.3	-177.4	175.3	0	111.7	A665	K661-A665 WeakPolarHBondContact O-CB 3.33Å; K661-A665 PolarHBondContact O-N 3.33Å; K661-A665 VanDerWaalsContact O-N 3.07Å
662	E	95.9	Very high	94.6	Very high	64 Å²	64	49.7 Å²	49.7	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-48.1	178.6	-55.5	75.3	-161.5	0	0	111.1	Q539 Y540 S660 A665 Q666	Q539-E662 HydrophobicContact CB-CB 3.94Å; Q539-E662 CarbonylContact O-C 3.33Å; Y540-E662 HydrophobicContact CD1-CB 4.36Å; Y540-E662 HydrophobicContact CD2-CB 3.98Å; Y540-E662 HydrophobicContact CD2-CG 3.91Å; Y540-E662 HydrophobicContact CE1-CB 4.32Å; Y540-E662 HydrophobicContact CE1-CG 4.44Å; Y540-E662 HydrophobicContact CE2-CB 3.94Å; Y540-E662 HydrophobicContact CE2-CG 3.44Å; Y540-E662 VanDerWaalsContact CE2-CG 3.44Å; Y540-E662 HydrophobicContact CG-CB 4.2Å; S660-E662 VanDerWaalsContact CB-OE2 3.24Å; S660-E662 WeakPolarHBondContact CB-OE2 3.15Å; S660-E662 PolarHBondContact O-N 3.41Å; S660-E662 PolarHBondContact OG-OE2 3.27Å; E662-A665 WeakPolarHBondContact O-CB 3.38Å; E662-A665 PolarHBondContact O-N 3.23Å; E662-Q666 PolarHBondContact O-N 3.2Å
663	L	95.6	Very high	94.8	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-39.9	178.2	179.1	59.1	0	0	0	111.7	M536 Q539 P659 S660 A665 Q666 M667	M536-L663 HydrophobicContact CB-CD1 4.41Å; Q539-L663 WeakPolarHBondContact O-CA 3.37Å; Q539-L663 PolarHBondContact O-N 3.16Å; P659-L663 HydrophobicContact CB-CB 4.14Å; P659-L663 HydrophobicContact CB-CD2 3.92Å; P659-L663 HydrophobicContact CB-CG 4.01Å; S660-L663 PolarHBondContact O-N 3.19Å; S660-L663 PolarHBondContact OG-N 3.01Å; L663-A665 VanDerWaalsContact C-N 3.27Å; L663-A665 PolarHBondContact O-N 2.77Å; L663-Q666 WeakPolarHBondContact O-CB 3.37Å; L663-Q666 PolarHBondContact O-N 3.12Å; L663-Q666 VanDerWaalsContact O-N 3.13Å; L663-M667 HydrophobicContact CD1-CE 4.12Å; L663-M667 HydrophobicContact CD1-CG 4.46Å; L663-M667 HydrophobicContact CD2-CE 3.94Å; L663-M667 HydrophobicContact CG-CE 3.82Å; L663-M667 HydrophobicContact CG-SD 4.31Å; L663-M667 WeakPolarHBondContact O-CG 3.41Å; L663-M667 PolarHBondContact O-N 3.21Å
664	L	96	Very high	94.9	Very high	58 Å²	58	54.4 Å²	54.4	30%	0.304	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-41	173.8	-177.3	61.2	0	0	0	110.9	I654 P659 S660 Q666 M667 L668	I654-L664 HydrophobicContact CG2-CD1 3.61Å; P659-L664 HydrophobicContact CB-CB 4.38Å; P659-L664 HydrophobicContact CG-CB 4.04Å; P659-L664 HydrophobicContact CG-CD1 4.06Å; S660-L664 WeakPolarHBondContact O-CB 3.08Å; S660-L664 PolarHBondContact O-N 3.09Å; L664-Q666 VanDerWaalsContact C-N 3.35Å; L664-M667 PolarHBondContact O-N 3.39Å; L664-L668 HydrophobicContact CD1-CD1 4.2Å; L664-L668 HydrophobicContact CD1-CG 4.16Å; L664-L668 HydrophobicContact CG-CD1 4.01Å; L664-L668 HydrophobicContact CG-CG 4.38Å; L664-L668 WeakPolarHBondContact O-CB 3.2Å; L664-L668 VanDerWaalsContact O-CG 3.26Å; L664-L668 WeakPolarHBondContact O-CG 3.33Å; L664-L668 PolarHBondContact O-N 2.88Å
665	A	96.7	Very high	95	Very high	33 Å²	33	53.7 Å²	53.7	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-40	174.8	0	0	0	0	0	112	Y540 K661 E662 L663 T669	Y540-A665 HydrophobicContact CD1-CB 4.11Å; Y540-A665 HydrophobicContact CE1-CB 3.89Å; K661-A665 WeakPolarHBondContact O-CB 3.33Å; K661-A665 PolarHBondContact O-N 3.33Å; K661-A665 VanDerWaalsContact O-N 3.07Å; E662-A665 WeakPolarHBondContact O-CB 3.38Å; E662-A665 PolarHBondContact O-N 3.23Å; L663-A665 VanDerWaalsContact C-N 3.27Å; L663-A665 PolarHBondContact O-N 2.77Å; A665-T669 VanDerWaalsContact O-CB 3.28Å; A665-T669 WeakPolarHBondContact O-CB 3.46Å; A665-T669 PolarHBondContact O-N 3.1Å; A665-T669 PolarHBondContact O-OG1 3.22Å
666	Q	96.7	Very high	95.2	Very high	10 Å²	10	56.5 Å²	56.5	5%	0.047	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-51.4	173.2	-179.7	-172.5	-20	0	0	111.3	M536 Q539 S551 E662 L663 L664 L668 T669 C670	M536-Q666 HydrophobicContact CE-CG 3.82Å; Q539-Q666 PolarHBondContact O-OE1 3.12Å; S551-Q666 PolarHBondContact OG-NE2 3.45Å; E662-Q666 PolarHBondContact O-N 3.2Å; L663-Q666 WeakPolarHBondContact O-CB 3.37Å; L663-Q666 PolarHBondContact O-N 3.12Å; L663-Q666 VanDerWaalsContact O-N 3.13Å; L664-Q666 VanDerWaalsContact C-N 3.35Å; Q666-L668 PolarHBondContact O-N 3.04Å; Q666-T669 WeakPolarHBondContact O-CB 3.28Å; Q666-T669 PolarHBondContact O-N 2.69Å; Q666-C670 PolarHBondContact O-N 3.46Å
667	M	96.6	Very high	95.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-56.8	-51.2	178.7	-69.2	173.8	169	0	0	111.8	L533 M536 L657 P659 L663 L664 T669 C670 I671	L533-M667 HydrophobicContact CD2-CB 3.74Å; L533-M667 HydrophobicContact CD2-CE 4.19Å; L533-M667 HydrophobicContact CD2-CG 3.51Å; L533-M667 HydrophobicContact CD2-SD 3.8Å; M536-M667 HydrophobicContact CB-CE 3.92Å; M536-M667 HydrophobicContact CE-CB 4.33Å; M536-M667 HydrophobicContact CE-CG 3.77Å; M536-M667 HydrophobicContact SD-CG 4.08Å; L657-M667 HydrophobicContact CD1-CE 3.75Å; P659-M667 HydrophobicContact CB-CE 4.49Å; P659-M667 HydrophobicContact CB-SD 4.25Å; P659-M667 HydrophobicContact CG-SD 4.27Å; L663-M667 HydrophobicContact CD1-CE 4.12Å; L663-M667 HydrophobicContact CD1-CG 4.46Å; L663-M667 HydrophobicContact CD2-CE 3.94Å; L663-M667 HydrophobicContact CG-CE 3.82Å; L663-M667 HydrophobicContact CG-SD 4.31Å; L663-M667 WeakPolarHBondContact O-CG 3.41Å; L663-M667 PolarHBondContact O-N 3.21Å; L664-M667 PolarHBondContact O-N 3.39Å; M667-T669 VanDerWaalsContact C-N 3.27Å; M667-T669 PolarHBondContact O-N 2.7Å; M667-C670 PolarHBondContact O-N 3.46Å; M667-I671 WeakPolarHBondContact O-CG1 3.4Å; M667-I671 PolarHBondContact O-N 3.04Å
668	L	96.3	Very high	95.6	Very high	83 Å²	83	54.4 Å²	54.4	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-32.8	179.3	-68.7	177	0	0	0	112.3	L664 Q666 S672	L664-L668 HydrophobicContact CD1-CD1 4.2Å; L664-L668 HydrophobicContact CD1-CG 4.16Å; L664-L668 HydrophobicContact CG-CD1 4.01Å; L664-L668 HydrophobicContact CG-CG 4.38Å; L664-L668 WeakPolarHBondContact O-CB 3.2Å; L664-L668 VanDerWaalsContact O-CG 3.26Å; L664-L668 WeakPolarHBondContact O-CG 3.33Å; L664-L668 PolarHBondContact O-N 2.88Å; Q666-L668 PolarHBondContact O-N 3.04Å; L668-S672 WeakPolarHBondContact O-CB 3.34Å; L668-S672 PolarHBondContact O-N 3.27Å; L668-S672 PolarHBondContact O-OG 2.95Å
669	T	96.3	Very high	95.8	Very high	91 Å²	91	51.3 Å²	51.3	56%	0.558	29%	0.29	S	S	*	.	H	α-helix	trans	-66.9	-47.5	175.8	-61.5	0	0	0	0	111.1	A665 Q666 M667 I671 S672 L673	A665-T669 VanDerWaalsContact O-CB 3.28Å; A665-T669 WeakPolarHBondContact O-CB 3.46Å; A665-T669 PolarHBondContact O-N 3.1Å; A665-T669 PolarHBondContact O-OG1 3.22Å; Q666-T669 WeakPolarHBondContact O-CB 3.28Å; Q666-T669 PolarHBondContact O-N 2.69Å; M667-T669 VanDerWaalsContact C-N 3.27Å; M667-T669 PolarHBondContact O-N 2.7Å; T669-I671 PolarHBondContact O-N 2.85Å; T669-S672 PolarHBondContact O-N 3.47Å; T669-L673 VanDerWaalsContact O-CB 3.27Å; T669-L673 WeakPolarHBondContact O-CB 3.35Å; T669-L673 PolarHBondContact O-N 3.41Å
670	C	95.7	Very high	96	Very high	22 Å²	22	52.1 Å²	52.1	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-48.3	175.5	-75.3	0	0	0	0	111.5	F555 Q666 M667 G674	F555-C670 HydrophobicContact CB-CB 4.37Å; Q666-C670 PolarHBondContact O-N 3.46Å; M667-C670 PolarHBondContact O-N 3.46Å; C670-G674 PolarHBondContact O-N 3.2Å
671	I	96.2	Very high	95.9	Very high	39 Å²	39	52.9 Å²	52.9	20%	0.2	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-48.7	179.8	-65.7	165.5	0	0	0	111.2	L533 S558 M650 I654 M667 T669 G675	L533-I671 HydrophobicContact CD1-CD1 4.42Å; L533-I671 HydrophobicContact CD2-CD1 4.36Å; S558-I671 WeakPolarHBondContact OG-CA 3.37Å; M650-I671 HydrophobicContact CE-CD1 3.5Å; M650-I671 HydrophobicContact CE-CG1 3.94Å; I654-I671 HydrophobicContact CD1-CD1 4.25Å; M667-I671 WeakPolarHBondContact O-CG1 3.4Å; M667-I671 PolarHBondContact O-N 3.04Å; T669-I671 PolarHBondContact O-N 2.85Å; I671-G675 PolarHBondContact O-N 2.77Å
672	S	96.5	Very high	95.6	Very high	69 Å²	69	44.4 Å²	44.4	48%	0.483	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-41.8	-175.8	-59.6	0	0	0	0	112	L668 T669 S676	L668-S672 WeakPolarHBondContact O-CB 3.34Å; L668-S672 PolarHBondContact O-N 3.27Å; L668-S672 PolarHBondContact O-OG 2.95Å; T669-S672 PolarHBondContact O-N 3.47Å; S672-S676 WeakPolarHBondContact O-CB 3.28Å; S672-S676 PolarHBondContact O-N 3.08Å; S672-S676 PolarHBondContact O-OG 3.48Å
673	L	96.9	Very high	95.4	Very high	98 Å²	98	49.2 Å²	49.2	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-68.6	-47.5	179.2	-171.2	68.1	0	0	0	111	F555 T669 S676 I677	F555-L673 HydrophobicContact CD2-CB 4.35Å; F555-L673 HydrophobicContact CD2-CD2 4.36Å; F555-L673 HydrophobicContact CD2-CG 4.48Å; F555-L673 HydrophobicContact CE2-CB 4.05Å; F555-L673 HydrophobicContact CE2-CD2 3.77Å; F555-L673 HydrophobicContact CE2-CG 3.77Å; T669-L673 VanDerWaalsContact O-CB 3.27Å; T669-L673 WeakPolarHBondContact O-CB 3.35Å; T669-L673 PolarHBondContact O-N 3.41Å; L673-S676 PolarHBondContact O-N 3.37Å; L673-I677 HydrophobicContact CG-CD1 4.26Å; L673-I677 WeakPolarHBondContact O-CG1 3.44Å; L673-I677 PolarHBondContact O-N 2.88Å
674	G	95.7	Very high	95.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-50.7	177.5	0	0	0	0	0	111.5	I559 C670 S676 I677 G678	I559-G674 WeakPolarHBondContact CA-O 3.44Å; I559-G674 WeakPolarHBondContact CG1-O 3.48Å; C670-G674 PolarHBondContact O-N 3.2Å; G674-S676 VanDerWaalsContact C-N 3.33Å; G674-S676 PolarHBondContact O-N 2.89Å; G674-I677 PolarHBondContact O-N 2.91Å; G674-G678 PolarHBondContact O-N 3.48Å
675	G	95.9	Very high	94.8	Very high	14 Å²	14	57.3 Å²	57.3	14%	0.144	31%	0.309	C	S	.	.	H	α-helix	trans	-58	-41.9	177.2	0	0	0	0	0	113.1	S558 I671 I677 G678 L679	S558-G675 VanDerWaalsContact O-CA 3.31Å; S558-G675 WeakPolarHBondContact O-CA 3.27Å; S558-G675 PolarHBondContact O-N 2.86Å; I671-G675 PolarHBondContact O-N 2.77Å; G675-I677 PolarHBondContact O-N 3.36Å; G675-G678 PolarHBondContact O-N 2.69Å; G675-L679 WeakPolarHBondContact O-CB 3.49Å; G675-L679 VanDerWaalsContact O-CG 3.28Å; G675-L679 WeakPolarHBondContact O-CG 3.4Å; G675-L679 PolarHBondContact O-N 3.08Å
676	S	97	Very high	94.2	Very high	72 Å²	72	59.8 Å²	59.8	50%	0.503	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.3	-63.4	0	0	0	0	112.6	S672 L673 G674 A680	S672-S676 WeakPolarHBondContact O-CB 3.28Å; S672-S676 PolarHBondContact O-N 3.08Å; S672-S676 PolarHBondContact O-OG 3.48Å; L673-S676 PolarHBondContact O-N 3.37Å; G674-S676 VanDerWaalsContact C-N 3.33Å; G674-S676 PolarHBondContact O-N 2.89Å; S676-A680 WeakPolarHBondContact O-CB 3.23Å; S676-A680 PolarHBondContact O-N 2.99Å
677	I	96.2	Very high	93.3	Very high	63 Å²	63	59.7 Å²	59.7	32%	0.323	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-46.1	174.7	-69.2	166.5	0	0	0	110.1	F555 I559 L673 G674 G675 L679 A680 I681	F555-I677 HydrophobicContact CE2-CD1 3.92Å; F555-I677 HydrophobicContact CZ-CD1 3.68Å; I559-I677 HydrophobicContact CD1-CG2 4.41Å; I559-I677 HydrophobicContact CG1-CB 4.47Å; I559-I677 HydrophobicContact CG1-CG2 4.43Å; I559-I677 HydrophobicContact CG2-CG2 4.5Å; L673-I677 HydrophobicContact CG-CD1 4.26Å; L673-I677 WeakPolarHBondContact O-CG1 3.44Å; L673-I677 PolarHBondContact O-N 2.88Å; G674-I677 PolarHBondContact O-N 2.91Å; G675-I677 PolarHBondContact O-N 3.36Å; I677-L679 PolarHBondContact O-N 3.26Å; I677-A680 PolarHBondContact O-N 3Å; I677-I681 HydrophobicContact CG2-CD1 3.74Å; I677-I681 HydrophobicContact CG2-CG1 4.41Å; I677-I681 WeakPolarHBondContact O-CG1 3.42Å; I677-I681 PolarHBondContact O-N 2.7Å
678	G	94.1	Very high	92.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-55.2	-49.9	175.8	0	0	0	0	0	112.4	I559 G563 G674 G675 A680 I681 A682	I559-G678 WeakPolarHBondContact O-CA 3.28Å; G563-G678 WeakPolarHBondContact CA-O 3.42Å; G674-G678 PolarHBondContact O-N 3.48Å; G675-G678 PolarHBondContact O-N 2.69Å; G678-A680 PolarHBondContact O-N 3.3Å; G678-I681 PolarHBondContact O-N 3.01Å; G678-A682 VanDerWaalsContact O-CB 3.29Å; G678-A682 WeakPolarHBondContact O-CB 3.49Å; G678-A682 PolarHBondContact O-N 3.34Å
679	L	95.2	Very high	91.5	Very high	82 Å²	82	59.9 Å²	59.9	43%	0.429	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-43.1	176	-72.6	168.3	0	0	0	112.1	G562 L566 G675 I677 A682 K683	G562-L679 VanDerWaalsContact O-CD2 3.28Å; G562-L679 WeakPolarHBondContact O-CD2 3.37Å; L566-L679 HydrophobicContact CB-CD2 3.99Å; L566-L679 HydrophobicContact CD2-CD2 3.95Å; L566-L679 WeakPolarHBondContact CD2-O 3.22Å; L566-L679 HydrophobicContact CG-CD2 4.48Å; G675-L679 WeakPolarHBondContact O-CB 3.49Å; G675-L679 VanDerWaalsContact O-CG 3.28Å; G675-L679 WeakPolarHBondContact O-CG 3.4Å; G675-L679 PolarHBondContact O-N 3.08Å; I677-L679 PolarHBondContact O-N 3.26Å; L679-A682 PolarHBondContact O-N 2.99Å; L679-K683 WeakPolarHBondContact O-CB 3.26Å; L679-K683 PolarHBondContact O-N 2.96Å
680	A	96	Very high	90.6	Very high	46 Å²	46	56.1 Å²	56.1	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-64.6	-40.7	179.6	0	0	0	0	0	112.4	S676 I677 G678 R684	S676-A680 WeakPolarHBondContact O-CB 3.23Å; S676-A680 PolarHBondContact O-N 2.99Å; I677-A680 PolarHBondContact O-N 3Å; G678-A680 PolarHBondContact O-N 3.3Å; A680-R684 WeakPolarHBondContact O-CG 3.47Å
681	I	92.9	Very high	89.6	Confident	67 Å²	67	56.5 Å²	56.5	34%	0.344	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-51.6	176	-66.8	167.9	0	0	0	109.9	I677 G678 K683 R684 I685 L693	I677-I681 HydrophobicContact CG2-CD1 3.74Å; I677-I681 HydrophobicContact CG2-CG1 4.41Å; I677-I681 WeakPolarHBondContact O-CG1 3.42Å; I677-I681 PolarHBondContact O-N 2.7Å; G678-I681 PolarHBondContact O-N 3.01Å; I681-K683 VanDerWaalsContact C-N 3.27Å; I681-K683 PolarHBondContact O-N 3.44Å; I681-R684 PolarHBondContact O-N 3.31Å; I681-R684 VanDerWaalsContact O-N 3.14Å; I681-I685 PolarHBondContact O-N 2.88Å; I681-L693 HydrophobicContact CG2-CD1 3.8Å; I681-L693 HydrophobicContact CG2-CD2 4.18Å
682	A	90.2	Very high	89	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-30.7	-177.7	0	0	0	0	0	113.6	G563 L566 I567 R570 G678 L679	G563-A682 WeakPolarHBondContact O-CB 3.47Å; L566-A682 HydrophobicContact CB-CB 4.03Å; L566-A682 HydrophobicContact CD2-CB 3.87Å; L566-A682 HydrophobicContact CG-CB 4.17Å; I567-A682 HydrophobicContact CD1-CB 4.15Å; I567-A682 HydrophobicContact CG1-CB 3.71Å; R570-A682 PolarHBondContact NH1-O 3.4Å; G678-A682 VanDerWaalsContact O-CB 3.29Å; G678-A682 WeakPolarHBondContact O-CB 3.49Å; G678-A682 PolarHBondContact O-N 3.34Å; L679-A682 PolarHBondContact O-N 2.99Å
683	K	91.6	Very high	88.5	Confident	165 Å²	165	52.6 Å²	52.6	72%	0.717	27%	0.269	S	S	*	.	H	α-helix	trans	-72.6	-30.5	177	-171.2	172.2	-178.9	175.7	0	113.3	L566 L679 I681	L566-K683 HydrophobicContact CD2-CB 4.01Å; L679-K683 WeakPolarHBondContact O-CB 3.26Å; L679-K683 PolarHBondContact O-N 2.96Å; I681-K683 VanDerWaalsContact C-N 3.27Å; I681-K683 PolarHBondContact O-N 3.44Å
684	R	91.2	Very high	87.7	Confident	219 Å²	219	48.4 Å²	48.4	83%	0.826	25%	0.248	S	C	*	.	H	α-helix	trans	-87.8	-19.2	-172.7	-71.2	178.5	-178.2	-173.7	2.6	113.9	A680 I681	A680-R684 WeakPolarHBondContact O-CG 3.47Å; I681-R684 PolarHBondContact O-N 3.31Å; I681-R684 VanDerWaalsContact O-N 3.14Å
685	I	86.4	Confident	87.2	Confident	31 Å²	31	48.5 Å²	48.5	16%	0.159	25%	0.248	C	C	.	.			trans	-80.4	144.7	-172.5	-153.6	162.9	0	0	0	112.9	R570 I681 D689 L690 L693	R570-I685 PolarHBondContact NH1-O 2.59Å; R570-I685 PolarHBondContact NH2-O 3.13Å; I681-I685 PolarHBondContact O-N 2.88Å; I685-D689 HydrophobicContact CD1-CB 3.87Å; I685-D689 HydrophobicContact CG1-CB 3.64Å; I685-L690 HydrophobicContact CG2-CD2 4.06Å; I685-L693 HydrophobicContact CB-CD2 4.29Å; I685-L693 HydrophobicContact CD1-CB 3.6Å; I685-L693 HydrophobicContact CD1-CD1 4.44Å; I685-L693 HydrophobicContact CD1-CD2 3.57Å; I685-L693 HydrophobicContact CD1-CG 4.07Å; I685-L693 HydrophobicContact CG2-CD2 3.82Å
686	E	84.5	Confident	87	Confident	85 Å²	85	48.5 Å²	48.5	40%	0.397	25%	0.247	S	C	.	.			trans	-78.7	156.5	171.4	-64.8	-171.4	166	0	0	111	T688 D689 R942	E686-T688 VanDerWaalsContact C-N 3.28Å; E686-T688 PolarHBondContact O-N 3.18Å; E686-D689 PolarHBondContact O-N 3.49Å; E686-D689 VanDerWaalsContact O-N 3.1Å; E686-R942 IonicContact OE1-NH1 3.23Å; E686-R942 IonicContact OE1-NH2 3.4Å; E686-R942 IonicContact OE2-CZ 3.57Å; E686-R942 IonicContact OE2-NH1 3.83Å; E686-R942 IonicContact OE2-NH2 3.8Å; E686-R942 PolarHBondContact OE2-NH2 3.17Å
687	V	77.1	Confident	86.5	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.048	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-67.7	-29.9	-176.4	176.5	0	0	0	0	112	M574 D689 L690 Q969 V972 L973 E976	M574-V687 HydrophobicContact CE-CB 4.35Å; M574-V687 HydrophobicContact CE-CG1 3.68Å; M574-V687 HydrophobicContact CE-CG2 3.66Å; M574-V687 HydrophobicContact SD-CB 4.49Å; M574-V687 HydrophobicContact SD-CG1 4.12Å; M574-V687 HydrophobicContact SD-CG2 3.69Å; V687-D689 PolarHBondContact O-N 3.43Å; V687-L690 HydrophobicContact CB-CD1 4.25Å; V687-L690 HydrophobicContact CG1-CD1 3.78Å; V687-L690 WeakPolarHBondContact O-CB 3.46Å; V687-L690 WeakPolarHBondContact O-CD1 2.93Å; V687-L690 WeakPolarHBondContact O-CG 3.24Å; V687-L690 PolarHBondContact O-N 3.24Å; V687-Q969 PolarHBondContact O-NE2 3.46Å; V687-V972 HydrophobicContact CG1-CG1 3.67Å; V687-L973 HydrophobicContact CG1-CD2 3.99Å; V687-E976 WeakPolarHBondContact CB-OE2 3.41Å
688	T	75.1	Confident	86.2	Confident	32 Å²	32	42.2 Å²	42.2	20%	0.196	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-63.3	-26	174.2	50.8	0	0	0	0	112.7	E686 Q969 L973	E686-T688 VanDerWaalsContact C-N 3.28Å; E686-T688 PolarHBondContact O-N 3.18Å; T688-Q969 PolarHBondContact O-NE2 3.36Å; T688-L973 HydrophobicContact CG2-CD2 3.78Å
689	D	81.4	Confident	86.1	Confident	55 Å²	55	42.3 Å²	42.3	29%	0.294	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-95.5	5.9	-174.3	-71.2	-16.7	0	0	0	113.6	I685 E686 V687 Q692 L693	I685-D689 HydrophobicContact CD1-CB 3.87Å; I685-D689 HydrophobicContact CG1-CB 3.64Å; E686-D689 PolarHBondContact O-N 3.49Å; E686-D689 VanDerWaalsContact O-N 3.1Å; V687-D689 PolarHBondContact O-N 3.43Å; D689-Q692 VanDerWaalsContact CA-OE1 3.24Å; D689-Q692 WeakPolarHBondContact O-CG 3.4Å; D689-Q692 PolarHBondContact O-OE1 3.31Å; D689-Q692 PolarHBondContact OD1-NE2 3.37Å; D689-L693 PolarHBondContact O-N 2.99Å
690	L	76.8	Confident	86	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-41.6	-179.4	-67.6	175	0	0	0	114.3	I567 M571 I685 V687 Q692 L693 V694	I567-L690 HydrophobicContact CB-CD2 4.49Å; I567-L690 HydrophobicContact CD1-CD2 4.5Å; I567-L690 HydrophobicContact CG1-CD2 4.27Å; I567-L690 HydrophobicContact CG2-CD1 4.47Å; I567-L690 HydrophobicContact CG2-CD2 3.47Å; I567-L690 VanDerWaalsContact CG2-CD2 3.47Å; M571-L690 HydrophobicContact CE-CD1 3.96Å; M571-L690 HydrophobicContact CG-CD1 3.65Å; M571-L690 HydrophobicContact SD-CD1 3.75Å; I685-L690 HydrophobicContact CG2-CD2 4.06Å; V687-L690 HydrophobicContact CB-CD1 4.25Å; V687-L690 HydrophobicContact CG1-CD1 3.78Å; V687-L690 WeakPolarHBondContact O-CB 3.46Å; V687-L690 WeakPolarHBondContact O-CD1 2.93Å; V687-L690 WeakPolarHBondContact O-CG 3.24Å; V687-L690 PolarHBondContact O-N 3.24Å; L690-Q692 VanDerWaalsContact C-N 3.32Å; L690-Q692 PolarHBondContact O-N 3.47Å; L690-L693 PolarHBondContact O-N 2.84Å; L690-L693 VanDerWaalsContact O-N 3.11Å; L690-V694 WeakPolarHBondContact O-CG2 3.27Å; L690-V694 PolarHBondContact O-N 3.21Å
691	P	75.1	Confident	85.8	Confident	29 Å²	29	39 Å²	39	19%	0.188	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-40.7	-177.5	-24.2	34	0	0	0	113	L693 V694 A695 L754 I838 Q969	P691-L693 VanDerWaalsContact C-N 3.35Å; P691-V694 PolarHBondContact O-N 3.04Å; P691-A695 PolarHBondContact O-N 3.01Å; P691-L754 HydrophobicContact CB-CD1 4.33Å; P691-I838 HydrophobicContact CB-CD1 4.4Å; P691-Q969 VanDerWaalsContact CD-NE2 3.35Å; P691-Q969 VanDerWaalsContact CG-CD 3.46Å
692	Q	82.8	Confident	85.8	Confident	14 Å²	14	35.8 Å²	35.8	7%	0.065	17%	0.166	C	C	.	.	H	α-helix	trans	-68.9	-35.5	177	64.5	-97.5	37.7	0	0	111.6	D689 L690 A695 A696 F751 L754	D689-Q692 VanDerWaalsContact CA-OE1 3.24Å; D689-Q692 WeakPolarHBondContact O-CG 3.4Å; D689-Q692 PolarHBondContact O-OE1 3.31Å; D689-Q692 PolarHBondContact OD1-NE2 3.37Å; L690-Q692 VanDerWaalsContact C-N 3.32Å; L690-Q692 PolarHBondContact O-N 3.47Å; Q692-A695 WeakPolarHBondContact O-CB 3.21Å; Q692-A695 PolarHBondContact O-N 3.27Å; Q692-A696 PolarHBondContact O-N 3.03Å; Q692-F751 HydrophobicContact CB-CD2 3.79Å; Q692-F751 HydrophobicContact CB-CE2 4.18Å; Q692-F751 HydrophobicContact CG-CD2 4.4Å; Q692-F751 HydrophobicContact CG-CE2 4.31Å; Q692-F751 VanDerWaalsContact O-CD2 3.32Å; Q692-F751 WeakPolarHBondContact O-CD2 3.4Å; Q692-L754 HydrophobicContact CB-CB 3.93Å
693	L	85.5	Confident	86	Confident	12 Å²	12	37.2 Å²	37.2	6%	0.063	18%	0.175	C	C	.	.	H	α-helix	trans	-69.1	-39.2	177.3	-174.7	59	0	0	0	112	I567 I681 I685 D689 L690 P691 A695 A696 F697	I567-L693 HydrophobicContact CD1-CD2 3.34Å; I567-L693 HydrophobicContact CD1-CG 4.01Å; I567-L693 HydrophobicContact CG1-CD2 4.31Å; I681-L693 HydrophobicContact CG2-CD1 3.8Å; I681-L693 HydrophobicContact CG2-CD2 4.18Å; I685-L693 HydrophobicContact CB-CD2 4.29Å; I685-L693 HydrophobicContact CD1-CB 3.6Å; I685-L693 HydrophobicContact CD1-CD1 4.44Å; I685-L693 HydrophobicContact CD1-CD2 3.57Å; I685-L693 HydrophobicContact CD1-CG 4.07Å; I685-L693 HydrophobicContact CG2-CD2 3.82Å; D689-L693 PolarHBondContact O-N 2.99Å; L690-L693 PolarHBondContact O-N 2.84Å; L690-L693 VanDerWaalsContact O-N 3.11Å; P691-L693 VanDerWaalsContact C-N 3.35Å; L693-A695 VanDerWaalsContact C-N 3.31Å; L693-A695 PolarHBondContact O-N 2.91Å; L693-A696 PolarHBondContact O-N 3.44Å; L693-F697 HydrophobicContact CD1-CD1 4.05Å; L693-F697 HydrophobicContact CD1-CE1 3.6Å; L693-F697 HydrophobicContact CD1-CE2 4.16Å; L693-F697 HydrophobicContact CD1-CZ 3.68Å; L693-F697 HydrophobicContact CD2-CE2 4.12Å; L693-F697 HydrophobicContact CD2-CZ 4.07Å; L693-F697 HydrophobicContact CG-CD2 4.19Å; L693-F697 HydrophobicContact CG-CE1 4.22Å; L693-F697 HydrophobicContact CG-CE2 3.85Å; L693-F697 HydrophobicContact CG-CZ 3.86Å; L693-F697 WeakPolarHBondContact O-CG 3.31Å; L693-F697 PolarHBondContact O-N 3.04Å
694	V	81.5	Confident	86.2	Confident	11 Å²	11	29.3 Å²	29.3	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-59.1	-45.1	171.4	172.4	0	0	0	0	110.3	L690 P691 A696 F697 H698 I838	L690-V694 WeakPolarHBondContact O-CG2 3.27Å; L690-V694 PolarHBondContact O-N 3.21Å; P691-V694 PolarHBondContact O-N 3.04Å; V694-A696 PolarHBondContact O-N 3.1Å; V694-F697 PolarHBondContact O-N 2.74Å; V694-H698 PolarHBondContact O-N 3Å; V694-H698 VanDerWaalsContact O-N 3.1Å; V694-I838 HydrophobicContact CG1-CG2 3.99Å
695	A	85.2	Confident	86.3	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-58.8	-46.8	173.5	0	0	0	0	0	111.5	P691 Q692 L693 F697 H698 S699 S747 A750 F751 I838	P691-A695 PolarHBondContact O-N 3.01Å; Q692-A695 WeakPolarHBondContact O-CB 3.21Å; Q692-A695 PolarHBondContact O-N 3.27Å; L693-A695 VanDerWaalsContact C-N 3.31Å; L693-A695 PolarHBondContact O-N 2.91Å; A695-F697 VanDerWaalsContact C-N 3.32Å; A695-F697 PolarHBondContact O-N 2.69Å; A695-H698 PolarHBondContact O-N 3.28Å; A695-S699 PolarHBondContact O-N 3.3Å; A695-S747 VanDerWaalsContact O-CB 3.25Å; A695-S747 WeakPolarHBondContact O-CB 3.39Å; A695-A750 HydrophobicContact CB-CB 4.27Å; A695-F751 HydrophobicContact CB-CB 4.27Å; A695-I838 HydrophobicContact CB-CD1 4.39Å; A695-I838 HydrophobicContact CB-CG1 4.17Å
696	A	90.3	Very high	86.6	Confident	15 Å²	15	18 Å²	18	12%	0.124	10%	0.099	C	C	.	.	H	α-helix	trans	-60.1	-41	177.8	0	0	0	0	0	112.4	Q692 L693 V694 S699 F700 F751	Q692-A696 PolarHBondContact O-N 3.03Å; L693-A696 PolarHBondContact O-N 3.44Å; V694-A696 PolarHBondContact O-N 3.1Å; A696-S699 VanDerWaalsContact O-CB 3.31Å; A696-S699 WeakPolarHBondContact O-CB 3.27Å; A696-S699 PolarHBondContact O-N 3.49Å; A696-S699 VanDerWaalsContact O-N 3.13Å; A696-S699 PolarHBondContact O-OG 3.06Å; A696-F700 PolarHBondContact O-N 3.42Å; A696-F751 HydrophobicContact CB-CD2 3.96Å; A696-F751 HydrophobicContact CB-CE2 4.43Å; A696-F751 HydrophobicContact CB-CG 4.34Å
697	F	88.2	Confident	87.1	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.009	9%	0.087	C	C	.	.	H	α-helix	trans	-68.7	-34.2	-180	-72.8	-13.8	0	0	0	113.9	N522 I559 N560 I567 L693 V694 A695 S699 F700 V701	N522-F697 WeakPolarHBondContact ND2-CB 3.3Å; N522-F697 VanDerWaalsContact ND2-CD2 3.27Å; N522-F697 WeakPolarHBondContact ND2-CD2 3.21Å; N522-F697 WeakPolarHBondContact OD1-CB 3.32Å; I559-F697 HydrophobicContact CG2-CE1 4.3Å; N560-F697 PolarHBondContact ND2-O 3Å; N560-F697 WeakPolarHBondContact OD1-CA 3.25Å; N560-F697 WeakPolarHBondContact OD1-CB 3.41Å; N560-F697 WeakPolarHBondContact OD1-CD1 3.42Å; N560-F697 WeakPolarHBondContact OD1-CG 3.32Å; N560-F697 PolarHBondContact OD1-O 3.49Å; I567-F697 HydrophobicContact CD1-CD2 4.31Å; I567-F697 HydrophobicContact CD1-CE2 3.57Å; I567-F697 HydrophobicContact CD1-CZ 4.4Å; L693-F697 HydrophobicContact CD1-CD1 4.05Å; L693-F697 HydrophobicContact CD1-CE1 3.6Å; L693-F697 HydrophobicContact CD1-CE2 4.16Å; L693-F697 HydrophobicContact CD1-CZ 3.68Å; L693-F697 HydrophobicContact CD2-CE2 4.12Å; L693-F697 HydrophobicContact CD2-CZ 4.07Å; L693-F697 HydrophobicContact CG-CD2 4.19Å; L693-F697 HydrophobicContact CG-CE1 4.22Å; L693-F697 HydrophobicContact CG-CE2 3.85Å; L693-F697 HydrophobicContact CG-CZ 3.86Å; L693-F697 WeakPolarHBondContact O-CG 3.31Å; L693-F697 PolarHBondContact O-N 3.04Å; V694-F697 PolarHBondContact O-N 2.74Å; A695-F697 VanDerWaalsContact C-N 3.32Å; A695-F697 PolarHBondContact O-N 2.69Å; F697-S699 PolarHBondContact O-N 3.27Å; F697-F700 AromaticContact CD1-CD2 3.71Å; F697-F700 HydrophobicContact CD1-CD2 3.71Å; F697-F700 AromaticContact CD1-CE2 3.72Å; F697-F700 HydrophobicContact CD1-CE2 3.72Å; F697-F700 HydrophobicContact CE1-CD2 4.34Å; F697-F700 HydrophobicContact CE1-CE2 4.03Å; F697-F700 WeakPolarHBondContact O-CB 3.11Å; F697-F700 PolarHBondContact O-N 3.49Å; F697-V701 PolarHBondContact O-N 2.93Å
698	H	88.4	Confident	88	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.4	-32.6	170.4	-64.1	157.3	0	0	0	112.2	N522 V694 A695 F700 V701 G702 S747 N842	N522-H698 PolarHBondContact OD1-CD2 3.23Å; N522-H698 PolarHBondContact OD1-N 3.29Å; V694-H698 PolarHBondContact O-N 3Å; V694-H698 VanDerWaalsContact O-N 3.1Å; A695-H698 PolarHBondContact O-N 3.28Å; H698-F700 VanDerWaalsContact C-N 3.26Å; H698-F700 PolarHBondContact O-N 3.41Å; H698-V701 PolarHBondContact O-N 3.48Å; H698-G702 PolarHBondContact O-N 3.39Å; H698-S747 WeakPolarHBondContact CB-OG 3.2Å; H698-N842 VanDerWaalsContact CE1-CB 3.45Å; H698-N842 WeakPolarHBondContact CE1-CB 3.46Å; H698-N842 PolarHBondContact NE2-OD1 3.21Å
699	S	92.6	Very high	88.9	Confident	2 Å²	2	13.4 Å²	13.4	1%	0.014	8%	0.075	C	C	.	.	H	α-helix	trans	-62.8	-36.8	176.2	83.2	0	0	0	0	111.8	A695 A696 F697 G702 V703 F744	A695-S699 PolarHBondContact O-N 3.3Å; A696-S699 VanDerWaalsContact O-CB 3.31Å; A696-S699 WeakPolarHBondContact O-CB 3.27Å; A696-S699 PolarHBondContact O-N 3.49Å; A696-S699 VanDerWaalsContact O-N 3.13Å; A696-S699 PolarHBondContact O-OG 3.06Å; F697-S699 PolarHBondContact O-N 3.27Å; S699-G702 PolarHBondContact O-N 3.36Å; S699-V703 WeakPolarHBondContact O-CG1 3.37Å; S699-V703 PolarHBondContact O-N 2.92Å; S699-F744 WeakPolarHBondContact CB-O 3.38Å; S699-F744 WeakPolarHBondContact O-CD2 3.44Å
700	F	93	Very high	89.5	Confident	58 Å²	58	12.7 Å²	12.7	25%	0.254	7%	0.071	S	C	.	.	H	α-helix	trans	-65.4	-37.5	175.6	-65.1	-24.7	0	0	0	112.4	I556 I559 N560 A696 F697 H698 V703 A704	I556-F700 HydrophobicContact CG2-CB 3.43Å; I556-F700 VanDerWaalsContact CG2-CB 3.43Å; I556-F700 HydrophobicContact CG2-CD1 4Å; I556-F700 HydrophobicContact CG2-CG 3.87Å; I556-F700 WeakPolarHBondContact CG2-O 3.47Å; I559-F700 HydrophobicContact CG2-CD2 4.13Å; I559-F700 HydrophobicContact CG2-CE2 3.93Å; N560-F700 WeakPolarHBondContact ND2-CB 3.28Å; N560-F700 WeakPolarHBondContact OD1-CD2 3.41Å; A696-F700 PolarHBondContact O-N 3.42Å; F697-F700 AromaticContact CD1-CD2 3.71Å; F697-F700 HydrophobicContact CD1-CD2 3.71Å; F697-F700 AromaticContact CD1-CE2 3.72Å; F697-F700 HydrophobicContact CD1-CE2 3.72Å; F697-F700 HydrophobicContact CE1-CD2 4.34Å; F697-F700 HydrophobicContact CE1-CE2 4.03Å; F697-F700 WeakPolarHBondContact O-CB 3.11Å; F697-F700 PolarHBondContact O-N 3.49Å; H698-F700 VanDerWaalsContact C-N 3.26Å; H698-F700 PolarHBondContact O-N 3.41Å; F700-V703 WeakPolarHBondContact O-CG1 3.31Å; F700-A704 VanDerWaalsContact O-CB 3.23Å; F700-A704 WeakPolarHBondContact O-CB 3.5Å; F700-A704 PolarHBondContact O-N 2.88Å
701	V	92.3	Very high	90.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.3	-47.8	173.2	-169.9	0	0	0	0	110.6	S525 T528 N560 F697 H698 V703 A704 A705	S525-V701 WeakPolarHBondContact OG-CG2 3.32Å; T528-V701 HydrophobicContact CG2-CG1 3.78Å; N560-V701 WeakPolarHBondContact ND2-CG2 3.46Å; N560-V701 PolarHBondContact ND2-N 2.74Å; F697-V701 PolarHBondContact O-N 2.93Å; H698-V701 PolarHBondContact O-N 3.48Å; V701-V703 PolarHBondContact O-N 2.83Å; V701-A704 PolarHBondContact O-N 3.18Å; V701-A705 WeakPolarHBondContact O-CB 3.16Å; V701-A705 PolarHBondContact O-N 3.1Å
702	G	92.2	Very high	91.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.8	-42.5	-177.3	0	0	0	0	0	113	H698 S699 A706 G740	H698-G702 PolarHBondContact O-N 3.39Å; S699-G702 PolarHBondContact O-N 3.36Å; G702-A706 PolarHBondContact O-N 3.43Å; G702-A706 VanDerWaalsContact O-N 3.13Å; G702-G740 CarbonylContact C-O 3.54Å; G702-G740 WeakPolarHBondContact CA-O 3.48Å; G702-G740 CarbonylContact O-C 3.36Å; G702-G740 WeakPolarHBondContact O-CA 3.41Å
703	V	94.4	Very high	91.7	Very high	30 Å²	30	10.5 Å²	10.5	18%	0.182	6%	0.058	C	C	.	.	H	α-helix	trans	-70.6	-40.3	176.2	71.1	0	0	0	0	111.7	I556 S699 F700 V701 A705 A706 L707 F744	I556-V703 HydrophobicContact CD1-CG1 4.02Å; I556-V703 HydrophobicContact CG2-CG1 3.99Å; S699-V703 WeakPolarHBondContact O-CG1 3.37Å; S699-V703 PolarHBondContact O-N 2.92Å; F700-V703 WeakPolarHBondContact O-CG1 3.31Å; V701-V703 PolarHBondContact O-N 2.83Å; V703-A705 VanDerWaalsContact C-N 3.31Å; V703-A705 PolarHBondContact O-N 3.42Å; V703-A706 PolarHBondContact O-N 3.02Å; V703-L707 HydrophobicContact CG2-CD1 4.11Å; V703-L707 HydrophobicContact CG2-CG 4.29Å; V703-L707 WeakPolarHBondContact O-CB 3.15Å; V703-L707 WeakPolarHBondContact O-CG 3.47Å; V703-L707 PolarHBondContact O-N 3.4Å; V703-F744 HydrophobicContact CB-CD2 3.8Å; V703-F744 HydrophobicContact CB-CE2 4.18Å; V703-F744 HydrophobicContact CB-CG 4.16Å; V703-F744 HydrophobicContact CG1-CD2 4.38Å
704	A	95.2	Very high	92.1	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-58.8	-44.9	175.7	0	0	0	0	0	110.9	A553 S557 F700 V701 L707 T708	A553-A704 HydrophobicContact CB-CB 4.21Å; S557-A704 VanDerWaalsContact OG-CB 3.26Å; S557-A704 WeakPolarHBondContact OG-CB 3.22Å; F700-A704 VanDerWaalsContact O-CB 3.23Å; F700-A704 WeakPolarHBondContact O-CB 3.5Å; F700-A704 PolarHBondContact O-N 2.88Å; V701-A704 PolarHBondContact O-N 3.18Å; A704-L707 PolarHBondContact O-N 3.1Å; A704-T708 WeakPolarHBondContact O-CB 3.5Å; A704-T708 PolarHBondContact O-N 3.37Å; A704-T708 PolarHBondContact O-OG1 3.35Å
705	A	93.7	Very high	92.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.6	-45.3	178.1	0	0	0	0	0	113.4	V701 V703 L707 T708 C709 A848 E852	V701-A705 WeakPolarHBondContact O-CB 3.16Å; V701-A705 PolarHBondContact O-N 3.1Å; V703-A705 VanDerWaalsContact C-N 3.31Å; V703-A705 PolarHBondContact O-N 3.42Å; A705-L707 VanDerWaalsContact C-N 3.32Å; A705-L707 PolarHBondContact O-N 3.4Å; A705-T708 PolarHBondContact O-N 3.04Å; A705-C709 PolarHBondContact O-N 2.82Å; A705-C709 PolarHBondContact O-SG 2.86Å; A705-A848 HydrophobicContact CB-CB 3.92Å; A705-E852 WeakPolarHBondContact CA-OE1 3.31Å; A705-E852 WeakPolarHBondContact CB-OE1 3.25Å
706	A	94.1	Very high	92.8	Very high	13 Å²	13	16.9 Å²	16.9	11%	0.107	9%	0.092	C	C	.	.	H	α-helix	trans	-61.5	-41.2	175.6	0	0	0	0	0	112	G702 V703 C709 I710 T737	G702-A706 PolarHBondContact O-N 3.43Å; G702-A706 VanDerWaalsContact O-N 3.13Å; V703-A706 PolarHBondContact O-N 3.02Å; A706-C709 PolarHBondContact O-N 3.5Å; A706-I710 WeakPolarHBondContact O-CD1 3.48Å; A706-I710 VanDerWaalsContact O-CG1 3.26Å; A706-I710 WeakPolarHBondContact O-CG1 3.44Å; A706-I710 PolarHBondContact O-N 3.06Å; A706-T737 HydrophobicContact CB-CG2 4.47Å
707	L	95.2	Very high	92.7	Very high	27 Å²	27	19.5 Å²	19.5	14%	0.141	10%	0.099	C	C	.	.	H	α-helix	trans	-65	-44	176.5	-68.4	172.4	0	0	0	111.8	L549 L552 A553 I556 V703 A704 A705 I710 A711	L549-L707 HydrophobicContact CD2-CD2 3.81Å; L552-L707 HydrophobicContact CB-CD1 4.4Å; L552-L707 HydrophobicContact CD2-CD1 3.79Å; L552-L707 HydrophobicContact CG-CD1 3.89Å; A553-L707 HydrophobicContact CB-CB 4.15Å; I556-L707 HydrophobicContact CD1-CD1 4.31Å; V703-L707 HydrophobicContact CG2-CD1 4.11Å; V703-L707 HydrophobicContact CG2-CG 4.29Å; V703-L707 WeakPolarHBondContact O-CB 3.15Å; V703-L707 WeakPolarHBondContact O-CG 3.47Å; V703-L707 PolarHBondContact O-N 3.4Å; A704-L707 PolarHBondContact O-N 3.1Å; A705-L707 VanDerWaalsContact C-N 3.32Å; A705-L707 PolarHBondContact O-N 3.4Å; L707-I710 PolarHBondContact O-N 3.41Å; L707-A711 VanDerWaalsContact O-CB 3.24Å; L707-A711 WeakPolarHBondContact O-CB 3.38Å; L707-A711 PolarHBondContact O-N 3.02Å
708	T	94.9	Very high	92.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.6	-43	177.3	-59.1	0	0	0	0	111.1	L535 A704 A705 A711 N712 E852 M855 M856	L535-T708 HydrophobicContact CD1-CG2 3.81Å; L535-T708 WeakPolarHBondContact CD1-O 3.32Å; A704-T708 WeakPolarHBondContact O-CB 3.5Å; A704-T708 PolarHBondContact O-N 3.37Å; A704-T708 PolarHBondContact O-OG1 3.35Å; A705-T708 PolarHBondContact O-N 3.04Å; T708-A711 PolarHBondContact O-N 2.87Å; T708-N712 WeakPolarHBondContact O-CB 3.48Å; T708-N712 PolarHBondContact O-N 2.92Å; T708-E852 HydrophobicContact CG2-CG 4.39Å; T708-M855 HydrophobicContact CG2-CE 4.12Å; T708-M856 HydrophobicContact CG2-CE 3.35Å
709	C	94.2	Very high	92.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-49.6	175.1	-68.9	0	0	0	0	111.7	A705 A706 A711 N712 Y713 L733 T737	A705-C709 PolarHBondContact O-N 2.82Å; A705-C709 PolarHBondContact O-SG 2.86Å; A706-C709 PolarHBondContact O-N 3.5Å; C709-A711 VanDerWaalsContact C-N 3.28Å; C709-A711 PolarHBondContact O-N 3.47Å; C709-N712 PolarHBondContact O-N 3.36Å; C709-Y713 PolarHBondContact O-N 3.32Å; C709-L733 HydrophobicContact CB-CD2 3.98Å; C709-L733 WeakPolarHBondContact O-CD2 3.39Å; C709-T737 VanDerWaalsContact CB-OG1 3.29Å; C709-T737 WeakPolarHBondContact CB-OG1 3.37Å
710	I	93.6	Very high	92	Very high	41 Å²	41	28.8 Å²	28.8	21%	0.21	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-39.2	179.4	-65.9	165.2	0	0	0	111	L549 A706 L707 L714 T737	L549-I710 HydrophobicContact CD1-CB 4.47Å; L549-I710 HydrophobicContact CD1-CG2 3.92Å; A706-I710 WeakPolarHBondContact O-CD1 3.48Å; A706-I710 VanDerWaalsContact O-CG1 3.26Å; A706-I710 WeakPolarHBondContact O-CG1 3.44Å; A706-I710 PolarHBondContact O-N 3.06Å; L707-I710 PolarHBondContact O-N 3.41Å; I710-L714 WeakPolarHBondContact O-CG 3.37Å; I710-L714 PolarHBondContact O-N 2.69Å; I710-T737 HydrophobicContact CD1-CG2 4.45Å; I710-T737 HydrophobicContact CG1-CG2 4.47Å
711	A	94.5	Very high	91.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-48	175.4	0	0	0	0	0	111.7	L535 P546 L549 L707 T708 C709 Y713 L714 V715	L535-A711 HydrophobicContact CD1-CB 3.9Å; P546-A711 HydrophobicContact CB-CB 4.3Å; L549-A711 HydrophobicContact CB-CB 3.92Å; L549-A711 HydrophobicContact CD1-CB 4.32Å; L707-A711 VanDerWaalsContact O-CB 3.24Å; L707-A711 WeakPolarHBondContact O-CB 3.38Å; L707-A711 PolarHBondContact O-N 3.02Å; T708-A711 PolarHBondContact O-N 2.87Å; C709-A711 VanDerWaalsContact C-N 3.28Å; C709-A711 PolarHBondContact O-N 3.47Å; A711-Y713 PolarHBondContact O-N 2.89Å; A711-L714 WeakPolarHBondContact O-CB 3.38Å; A711-L714 PolarHBondContact O-N 3.09Å; A711-V715 WeakPolarHBondContact O-CG2 3.23Å; A711-V715 PolarHBondContact O-N 2.89Å; A711-V715 VanDerWaalsContact O-N 3.14Å
712	N	93.6	Very high	90.4	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.043	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-35.9	-178	-166.4	41.2	0	0	0	112.3	L535 T708 C709 L714 V715 E716 L733 M855	L535-N712 HydrophobicContact CD1-CB 3.75Å; L535-N712 HydrophobicContact CD2-CB 4.1Å; L535-N712 WeakPolarHBondContact CD2-OD1 3.5Å; T708-N712 WeakPolarHBondContact O-CB 3.48Å; T708-N712 PolarHBondContact O-N 2.92Å; C709-N712 PolarHBondContact O-N 3.36Å; N712-L714 VanDerWaalsContact C-N 3.27Å; N712-L714 PolarHBondContact O-N 3.5Å; N712-V715 PolarHBondContact O-N 3.23Å; N712-V715 VanDerWaalsContact O-N 3.15Å; N712-E716 WeakPolarHBondContact O-CB 3.41Å; N712-E716 PolarHBondContact O-N 2.95Å; N712-L733 HydrophobicContact CB-CD2 4.04Å; N712-M855 HydrophobicContact CB-CE 3.8Å; N712-M855 HydrophobicContact CB-SD 3.84Å; N712-M855 WeakPolarHBondContact ND2-CG 3.41Å; N712-M855 PolarHBondContact ND2-SD 3.06Å; N712-M855 VanDerWaalsContact ND2-SD 3.37Å
713	Y	93.3	Very high	89.8	Confident	1 Å²	1	38.1 Å²	38.1	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-56.8	-42.5	172.7	177.1	-98.4	0	0	0	112	C709 A711 Y717 F720 L733 Y786 L792 G795 L796 L799	C709-Y713 PolarHBondContact O-N 3.32Å; A711-Y713 PolarHBondContact O-N 2.89Å; Y713-Y717 HydrophobicContact CE1-CD2 4.48Å; Y713-Y717 WeakPolarHBondContact O-CA 3.29Å; Y713-Y717 VanDerWaalsContact O-CB 3.3Å; Y713-Y717 WeakPolarHBondContact O-CB 3.27Å; Y713-Y717 PolarHBondContact O-N 3.23Å; Y713-F720 AromaticContact CD2-CE2 3.47Å; Y713-F720 HydrophobicContact CD2-CE2 3.47Å; Y713-F720 VanDerWaalsContact CD2-CE2 3.47Å; Y713-F720 AromaticContact CD2-CZ 3.87Å; Y713-F720 HydrophobicContact CD2-CZ 3.87Å; Y713-F720 HydrophobicContact CE2-CD2 4.13Å; Y713-F720 AromaticContact CE2-CE2 3.42Å; Y713-F720 HydrophobicContact CE2-CE2 3.42Å; Y713-F720 VanDerWaalsContact CE2-CE2 3.42Å; Y713-F720 HydrophobicContact CE2-CZ 4.2Å; Y713-F720 HydrophobicContact CG-CE2 4.38Å; Y713-L733 HydrophobicContact CD2-CD1 4.23Å; Y713-Y786 HydrophobicContact CD2-CE2 4.12Å; Y713-Y786 VanDerWaalsContact CD2-OH 3.28Å; Y713-Y786 WeakPolarHBondContact CD2-OH 3.45Å; Y713-Y786 AromaticContact CE2-CE2 3.74Å; Y713-Y786 HydrophobicContact CE2-CE2 3.74Å; Y713-L792 HydrophobicContact CE1-CD1 3.84Å; Y713-G795 WeakPolarHBondContact OH-CA 3.47Å; Y713-L796 HydrophobicContact CD1-CD2 3.61Å; Y713-L796 HydrophobicContact CD1-CG 4.23Å; Y713-L796 HydrophobicContact CE1-CD2 3.79Å; Y713-L796 HydrophobicContact CE1-CG 3.87Å; Y713-L799 HydrophobicContact CD1-CD1 3.7Å; Y713-L799 HydrophobicContact CD2-CD1 3.86Å; Y713-L799 HydrophobicContact CE1-CD1 4.38Å; Y713-L799 HydrophobicContact CG-CD1 3.41Å; Y713-L799 VanDerWaalsContact CG-CD1 3.41Å
714	L	93.1	Very high	88.8	Confident	45 Å²	45	42.1 Å²	42.1	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-69.3	-31.5	178.3	-72.4	169.4	0	0	0	113.1	V545 P546 L549 I710 A711 N712 L792 L796	V545-L714 HydrophobicContact CG1-CD1 4.34Å; P546-L714 HydrophobicContact CB-CB 4.38Å; P546-L714 HydrophobicContact CG-CB 3.51Å; P546-L714 HydrophobicContact CG-CD1 3.92Å; P546-L714 HydrophobicContact CG-CG 4.36Å; L549-L714 HydrophobicContact CD1-CD1 4.42Å; I710-L714 WeakPolarHBondContact O-CG 3.37Å; I710-L714 PolarHBondContact O-N 2.69Å; A711-L714 WeakPolarHBondContact O-CB 3.38Å; A711-L714 PolarHBondContact O-N 3.09Å; N712-L714 VanDerWaalsContact C-N 3.27Å; N712-L714 PolarHBondContact O-N 3.5Å; L714-L792 HydrophobicContact CD2-CD1 4.28Å; L714-L796 HydrophobicContact CD2-CD1 3.84Å; L714-L796 HydrophobicContact CD2-CD2 3.71Å; L714-L796 HydrophobicContact CD2-CG 4.27Å; L714-L796 HydrophobicContact CG-CD2 4.09Å
715	V	91.6	Very high	87.7	Confident	60 Å²	60	42.7 Å²	42.7	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-75	-45.6	177.5	173.1	0	0	0	0	110.9	P546 A711 N712 P718	P546-V715 HydrophobicContact CB-CG2 3.66Å; P546-V715 HydrophobicContact CG-CG2 4.17Å; A711-V715 WeakPolarHBondContact O-CG2 3.23Å; A711-V715 PolarHBondContact O-N 2.89Å; A711-V715 VanDerWaalsContact O-N 3.14Å; N712-V715 PolarHBondContact O-N 3.23Å; N712-V715 VanDerWaalsContact O-N 3.15Å; V715-P718 VanDerWaalsContact O-CD 3.31Å; V715-P718 WeakPolarHBondContact O-CD 3.22Å
716	E	89.4	Confident	86.9	Confident	52 Å²	52	43.4 Å²	43.4	24%	0.243	26%	0.257	C	S	.	.	H	α-helix	trans	-86	-7.2	-176.4	-66.6	-58	156.5	0	0	114.1	N712 P718 H719 F720	N712-E716 WeakPolarHBondContact O-CB 3.41Å; N712-E716 PolarHBondContact O-N 2.95Å; E716-P718 VanDerWaalsContact C-N 3.32Å; E716-H719 PolarHBondContact O-N 2.93Å; E716-H719 IonicContact OE2-CE1 3.7Å; E716-H719 IonicContact OE2-CG 3.61Å; E716-H719 IonicContact OE2-ND1 2.77Å; E716-H719 PolarHBondContact OE2-ND1 3.49Å; E716-F720 HydrophobicContact CB-CE1 4.08Å; E716-F720 HydrophobicContact CB-CZ 3.9Å; E716-F720 PolarHBondContact O-N 3.28Å
717	Y	89.2	Confident	86.4	Confident	70 Å²	70	45 Å²	45	28%	0.275	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-46.7	-48.2	179.3	176.8	-101.8	0	0	0	114.2	Y713 H719 F720 D790 L792	Y713-Y717 HydrophobicContact CE1-CD2 4.48Å; Y713-Y717 WeakPolarHBondContact O-CA 3.29Å; Y713-Y717 VanDerWaalsContact O-CB 3.3Å; Y713-Y717 WeakPolarHBondContact O-CB 3.27Å; Y713-Y717 PolarHBondContact O-N 3.23Å; Y717-H719 PolarHBondContact O-N 3Å; Y717-F720 VanDerWaalsContact CA-CD2 3.48Å; Y717-F720 HydrophobicContact CD2-CD2 4.12Å; Y717-F720 PolarHBondContact O-N 3.35Å; Y717-D790 VanDerWaalsContact CE2-O 3.24Å; Y717-D790 WeakPolarHBondContact CE2-O 3.19Å; Y717-D790 PolarHBondContact OH-O 3.42Å; Y717-L792 HydrophobicContact CD1-CB 4.3Å; Y717-L792 HydrophobicContact CD1-CD1 3.87Å; Y717-L792 HydrophobicContact CD1-CD2 4.45Å; Y717-L792 HydrophobicContact CD1-CG 4.43Å; Y717-L792 HydrophobicContact CD2-CB 4.13Å; Y717-L792 HydrophobicContact CD2-CD1 3.58Å; Y717-L792 HydrophobicContact CD2-CG 4.44Å; Y717-L792 HydrophobicContact CE1-CB 3.8Å; Y717-L792 HydrophobicContact CE1-CD1 4.25Å; Y717-L792 HydrophobicContact CE1-CD2 4.44Å; Y717-L792 HydrophobicContact CE1-CG 4.38Å; Y717-L792 VanDerWaalsContact CE2-CA 3.43Å; Y717-L792 HydrophobicContact CE2-CB 3.63Å; Y717-L792 HydrophobicContact CE2-CD1 4.02Å; Y717-L792 HydrophobicContact CE2-CG 4.42Å; Y717-L792 HydrophobicContact CG-CB 4.45Å; Y717-L792 HydrophobicContact CG-CD1 3.52Å; Y717-L792 HydrophobicContact CG-CG 4.47Å; Y717-L792 VanDerWaalsContact CZ-CB 3.46Å; Y717-L792 PolarHBondContact OH-N 3.37Å
718	P	86.5	Confident	85.8	Confident	87 Å²	87	45 Å²	45	57%	0.565	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-63.4	-23.6	-179.9	-20.8	34.8	0	0	0	113.7	V715 E716	V715-P718 VanDerWaalsContact O-CD 3.31Å; V715-P718 WeakPolarHBondContact O-CD 3.22Å; E716-P718 VanDerWaalsContact C-N 3.32Å
719	H	85.6	Confident	85.4	Confident	92 Å²	92	46.8 Å²	46.8	43%	0.426	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-91.1	-17.9	-175.6	-53.2	123.2	0	0	0	113.3	E716 Y717 A721 S722 D723 L726	E716-H719 PolarHBondContact O-N 2.93Å; E716-H719 IonicContact OE2-CE1 3.7Å; E716-H719 IonicContact OE2-CG 3.61Å; E716-H719 IonicContact OE2-ND1 2.77Å; E716-H719 PolarHBondContact OE2-ND1 3.49Å; Y717-H719 PolarHBondContact O-N 3Å; H719-A721 PolarHBondContact O-N 3.29Å; H719-A721 VanDerWaalsContact O-N 3.14Å; H719-S722 WeakPolarHBondContact CA-OG 3.21Å; H719-S722 PolarHBondContact O-N 3.15Å; H719-S722 PolarHBondContact O-OG 3.44Å; H719-D723 PolarHBondContact O-N 3.33Å; H719-L726 VanDerWaalsContact C-CD1 3.48Å; H719-L726 HydrophobicContact CB-CD1 3.61Å; H719-L726 WeakPolarHBondContact O-CD1 3.39Å
720	F	82.9	Confident	85.1	Confident	20 Å²	20	47.2 Å²	47.2	9%	0.088	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.9	-179.4	-69.1	-41.6	0	0	0	113.5	Y713 E716 Y717 L726 K730 L733	Y713-F720 AromaticContact CD2-CE2 3.47Å; Y713-F720 HydrophobicContact CD2-CE2 3.47Å; Y713-F720 VanDerWaalsContact CD2-CE2 3.47Å; Y713-F720 AromaticContact CD2-CZ 3.87Å; Y713-F720 HydrophobicContact CD2-CZ 3.87Å; Y713-F720 HydrophobicContact CE2-CD2 4.13Å; Y713-F720 AromaticContact CE2-CE2 3.42Å; Y713-F720 HydrophobicContact CE2-CE2 3.42Å; Y713-F720 VanDerWaalsContact CE2-CE2 3.42Å; Y713-F720 HydrophobicContact CE2-CZ 4.2Å; Y713-F720 HydrophobicContact CG-CE2 4.38Å; E716-F720 HydrophobicContact CB-CE1 4.08Å; E716-F720 HydrophobicContact CB-CZ 3.9Å; E716-F720 PolarHBondContact O-N 3.28Å; Y717-F720 VanDerWaalsContact CA-CD2 3.48Å; Y717-F720 HydrophobicContact CD2-CD2 4.12Å; Y717-F720 PolarHBondContact O-N 3.35Å; F720-L726 HydrophobicContact CD1-CB 3.53Å; F720-L726 HydrophobicContact CD1-CD1 3.86Å; F720-L726 HydrophobicContact CD1-CG 4.31Å; F720-L726 HydrophobicContact CE1-CB 3.91Å; F720-L726 HydrophobicContact CE1-CD1 4.35Å; F720-K730 HydrophobicContact CD1-CD 3.96Å; F720-K730 HydrophobicContact CD1-CG 3.72Å; F720-K730 HydrophobicContact CD2-CD 4.29Å; F720-K730 HydrophobicContact CD2-CG 4.36Å; F720-K730 HydrophobicContact CE1-CD 4.27Å; F720-K730 HydrophobicContact CE1-CG 3.52Å; F720-K730 HydrophobicContact CE2-CG 4.21Å; F720-K730 HydrophobicContact CG-CD 4.01Å; F720-K730 HydrophobicContact CG-CG 4.18Å; F720-K730 HydrophobicContact CZ-CG 3.8Å; F720-L733 HydrophobicContact CE1-CD1 4.5Å; F720-L733 HydrophobicContact CZ-CD1 3.9Å
721	A	75.4	Confident	85	Confident	96 Å²	96	47.3 Å²	47.3	79%	0.793	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-25.4	177.4	0	0	0	0	0	113.3	H719	H719-A721 PolarHBondContact O-N 3.29Å; H719-A721 VanDerWaalsContact O-N 3.14Å
722	S	76.6	Confident	84.9	Confident	89 Å²	89	47.8 Å²	47.8	62%	0.622	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-24.9	-174.4	51	0	0	0	0	114.2	H719	H719-S722 WeakPolarHBondContact CA-OG 3.21Å; H719-S722 PolarHBondContact O-N 3.15Å; H719-S722 PolarHBondContact O-OG 3.44Å
723	D	79.4	Confident	84.9	Confident	70 Å²	70	47.4 Å²	47.4	37%	0.374	29%	0.289	S	S	.	.			trans	-125.4	102.2	-176.1	-174.6	3.3	0	0	0	111.6	H719 A725 L726	H719-D723 PolarHBondContact O-N 3.33Å; D723-A725 PolarHBondContact O-N 3.29Å; D723-A725 VanDerWaalsContact O-N 3.08Å; D723-A725 WeakPolarHBondContact OD1-CB 3.45Å; D723-A725 PolarHBondContact OD1-N 3.29Å; D723-L726 HydrophobicContact CB-CD1 3.91Å; D723-L726 HydrophobicContact CB-CG 3.91Å; D723-L726 WeakPolarHBondContact O-CB 3.49Å; D723-L726 PolarHBondContact O-N 2.85Å
724	P	72.2	Confident	84.9	Confident	114 Å²	114	47.5 Å²	47.5	74%	0.74	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.4	174.4	-24.9	34.1	0	0	0	113.8	L726 A727	P724-L726 PolarHBondContact O-N 3.45Å; P724-A727 WeakPolarHBondContact O-CB 3.38Å; P724-A727 PolarHBondContact O-N 3.24Å
725	A	72.6	Confident	85	Confident	12 Å²	12	49 Å²	49	10%	0.099	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-25	177.9	0	0	0	0	0	112.9	P484 D723 A727 V728	P484-A725 VanDerWaalsContact CB-CA 3.47Å; P484-A725 HydrophobicContact CB-CB 3.67Å; P484-A725 HydrophobicContact CG-CB 4.08Å; D723-A725 PolarHBondContact O-N 3.29Å; D723-A725 VanDerWaalsContact O-N 3.08Å; D723-A725 WeakPolarHBondContact OD1-CB 3.45Å; D723-A725 PolarHBondContact OD1-N 3.29Å; A725-A727 PolarHBondContact O-N 2.85Å; A725-A727 VanDerWaalsContact O-N 3.16Å; A725-V728 PolarHBondContact O-N 2.98Å
726	L	77.8	Confident	85.2	Confident	14 Å²	14	46.1 Å²	46.1	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-72	-4.8	178.6	-60.2	175.3	0	0	0	113.5	H719 F720 D723 P724 V728 N729 K730	H719-L726 VanDerWaalsContact C-CD1 3.48Å; H719-L726 HydrophobicContact CB-CD1 3.61Å; H719-L726 WeakPolarHBondContact O-CD1 3.39Å; F720-L726 HydrophobicContact CD1-CB 3.53Å; F720-L726 HydrophobicContact CD1-CD1 3.86Å; F720-L726 HydrophobicContact CD1-CG 4.31Å; F720-L726 HydrophobicContact CE1-CB 3.91Å; F720-L726 HydrophobicContact CE1-CD1 4.35Å; D723-L726 HydrophobicContact CB-CD1 3.91Å; D723-L726 HydrophobicContact CB-CG 3.91Å; D723-L726 WeakPolarHBondContact O-CB 3.49Å; D723-L726 PolarHBondContact O-N 2.85Å; P724-L726 PolarHBondContact O-N 3.45Å; L726-V728 VanDerWaalsContact C-N 3.26Å; L726-V728 PolarHBondContact O-N 2.88Å; L726-N729 HydrophobicContact CB-CB 4.48Å; L726-N729 HydrophobicContact CD2-CB 4.17Å; L726-N729 WeakPolarHBondContact CD2-ND2 3.24Å; L726-N729 CarbonylContact O-C 3.58Å; L726-N729 WeakPolarHBondContact O-CB 3.23Å; L726-N729 PolarHBondContact O-N 3.21Å; L726-N729 VanDerWaalsContact O-N 3.16Å; L726-K730 PolarHBondContact O-N 2.92Å
727	A	81.8	Confident	85.5	Confident	47 Å²	47	43.6 Å²	43.6	39%	0.388	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-37.7	169.4	0	0	0	0	0	111.8	P724 A725 K730 C731 M787	P724-A727 WeakPolarHBondContact O-CB 3.38Å; P724-A727 PolarHBondContact O-N 3.24Å; A725-A727 PolarHBondContact O-N 2.85Å; A725-A727 VanDerWaalsContact O-N 3.16Å; A727-K730 PolarHBondContact O-N 3.38Å; A727-C731 PolarHBondContact O-N 3.46Å; A727-M787 HydrophobicContact CB-CE 4.43Å; A727-M787 WeakPolarHBondContact O-CE 3.43Å
728	V	83.9	Confident	85.8	Confident	28 Å²	28	42.6 Å²	42.6	17%	0.17	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-40.9	173.2	174.4	0	0	0	0	110.5	P484 F488 A725 L726 K730 C731 A732	P484-V728 HydrophobicContact CG-CB 4.34Å; P484-V728 HydrophobicContact CG-CG2 3.7Å; F488-V728 HydrophobicContact CD2-CG1 3.6Å; F488-V728 HydrophobicContact CE2-CG1 3.52Å; F488-V728 HydrophobicContact CZ-CG1 4.4Å; A725-V728 PolarHBondContact O-N 2.98Å; L726-V728 VanDerWaalsContact C-N 3.26Å; L726-V728 PolarHBondContact O-N 2.88Å; V728-K730 PolarHBondContact O-N 3.33Å; V728-C731 WeakPolarHBondContact O-CB 3.35Å; V728-C731 PolarHBondContact O-N 2.93Å; V728-C731 VanDerWaalsContact O-N 3.13Å; V728-A732 PolarHBondContact O-N 3.12Å
729	N	86	Confident	86.3	Confident	36 Å²	36	40 Å²	40	19%	0.193	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-42	176.5	-67.2	6.8	0	0	0	111.2	L726 C731 A732 L733 M855	L726-N729 HydrophobicContact CB-CB 4.48Å; L726-N729 HydrophobicContact CD2-CB 4.17Å; L726-N729 WeakPolarHBondContact CD2-ND2 3.24Å; L726-N729 CarbonylContact O-C 3.58Å; L726-N729 WeakPolarHBondContact O-CB 3.23Å; L726-N729 PolarHBondContact O-N 3.21Å; L726-N729 VanDerWaalsContact O-N 3.16Å; N729-C731 VanDerWaalsContact C-N 3.31Å; N729-C731 PolarHBondContact O-N 3.11Å; N729-A732 PolarHBondContact O-N 2.9Å; N729-L733 WeakPolarHBondContact O-CB 3.25Å; N729-L733 WeakPolarHBondContact O-CD1 3.32Å; N729-L733 WeakPolarHBondContact O-CG 3.31Å; N729-L733 PolarHBondContact O-N 3.16Å; N729-M855 PolarHBondContact ND2-O 2.8Å
730	K	89.1	Confident	86.7	Confident	10 Å²	10	35.7 Å²	35.7	4%	0.043	23%	0.226	C	C	.	.	H	α-helix	trans	-54.7	-47.3	171.2	-79.1	-177	79.8	-179.1	0	110.4	F720 L726 A727 V728 L733 F734 Y786 M787 S789 D790	F720-K730 HydrophobicContact CD1-CD 3.96Å; F720-K730 HydrophobicContact CD1-CG 3.72Å; F720-K730 HydrophobicContact CD2-CD 4.29Å; F720-K730 HydrophobicContact CD2-CG 4.36Å; F720-K730 HydrophobicContact CE1-CD 4.27Å; F720-K730 HydrophobicContact CE1-CG 3.52Å; F720-K730 HydrophobicContact CE2-CG 4.21Å; F720-K730 HydrophobicContact CG-CD 4.01Å; F720-K730 HydrophobicContact CG-CG 4.18Å; F720-K730 HydrophobicContact CZ-CG 3.8Å; L726-K730 PolarHBondContact O-N 2.92Å; A727-K730 PolarHBondContact O-N 3.38Å; V728-K730 PolarHBondContact O-N 3.33Å; K730-L733 WeakPolarHBondContact O-CB 3.27Å; K730-L733 PolarHBondContact O-N 3.39Å; K730-F734 PolarHBondContact O-N 3.41Å; K730-F734 VanDerWaalsContact O-N 3.14Å; K730-Y786 HydrophobicContact CB-CE1 3.74Å; K730-Y786 HydrophobicContact CG-CE1 4.38Å; K730-Y786 PolarHBondContact NZ-O 3.27Å; K730-Y786 WeakPolarHBondContact O-CE1 3.43Å; K730-Y786 PolarHBondContact O-OH 3.36Å; K730-M787 HydrophobicContact CB-SD 4.02Å; K730-S789 PolarHBondContact NZ-O 2.91Å; K730-D790 IonicContact NZ-OD1 3.58Å; K730-D790 PolarHBondContact NZ-OD1 2.87Å
731	C	90.5	Very high	87.3	Confident	42 Å²	42	34.9 Å²	34.9	28%	0.284	22%	0.223	S	C	.	.	H	α-helix	trans	-62.1	-47.8	177.7	-170.6	0	0	0	0	112	A727 V728 N729 L733 F734 L735 M787	A727-C731 PolarHBondContact O-N 3.46Å; V728-C731 WeakPolarHBondContact O-CB 3.35Å; V728-C731 PolarHBondContact O-N 2.93Å; V728-C731 VanDerWaalsContact O-N 3.13Å; N729-C731 VanDerWaalsContact C-N 3.31Å; N729-C731 PolarHBondContact O-N 3.11Å; C731-L733 VanDerWaalsContact C-N 3.33Å; C731-L733 PolarHBondContact O-N 3.43Å; C731-F734 PolarHBondContact O-N 3.41Å; C731-L735 WeakPolarHBondContact O-CG 3.41Å; C731-L735 PolarHBondContact O-N 3.35Å; C731-M787 HydrophobicContact CB-SD 4.45Å
732	A	92	Very high	88.3	Confident	10 Å²	10	30.7 Å²	30.7	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-41	178.2	0	0	0	0	0	112.3	V728 N729 F734 L735 G736 F854 M855	V728-A732 PolarHBondContact O-N 3.12Å; N729-A732 PolarHBondContact O-N 2.9Å; A732-F734 PolarHBondContact O-N 3.5Å; A732-L735 PolarHBondContact O-N 3.42Å; A732-G736 PolarHBondContact O-N 3.23Å; A732-F854 HydrophobicContact CB-CB 4.25Å; A732-M855 HydrophobicContact CB-CB 4.07Å
733	L	93.4	Very high	89.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56	-48.5	173.4	-79.1	161.9	0	0	0	112.4	C709 N712 Y713 F720 N729 K730 C731 T737 M855	C709-L733 HydrophobicContact CB-CD2 3.98Å; C709-L733 WeakPolarHBondContact O-CD2 3.39Å; N712-L733 HydrophobicContact CB-CD2 4.04Å; Y713-L733 HydrophobicContact CD2-CD1 4.23Å; F720-L733 HydrophobicContact CE1-CD1 4.5Å; F720-L733 HydrophobicContact CZ-CD1 3.9Å; N729-L733 WeakPolarHBondContact O-CB 3.25Å; N729-L733 WeakPolarHBondContact O-CD1 3.32Å; N729-L733 WeakPolarHBondContact O-CG 3.31Å; N729-L733 PolarHBondContact O-N 3.16Å; K730-L733 WeakPolarHBondContact O-CB 3.27Å; K730-L733 PolarHBondContact O-N 3.39Å; C731-L733 VanDerWaalsContact C-N 3.33Å; C731-L733 PolarHBondContact O-N 3.43Å; L733-T737 WeakPolarHBondContact O-CB 3.38Å; L733-T737 PolarHBondContact O-N 3.12Å; L733-T737 PolarHBondContact O-OG1 3.39Å; L733-M855 HydrophobicContact CD2-CG 4.07Å; L733-M855 HydrophobicContact CD2-SD 3.12Å; L733-M855 WeakPolarHBondContact CD2-SD 3.32Å; L733-M855 HydrophobicContact CG-CG 3.96Å; L733-M855 HydrophobicContact CG-SD 3.59Å; L733-M855 VanDerWaalsContact CG-SD 3.59Å
734	F	95	Very high	89.9	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-65.9	-45.8	180	-172.1	-79.5	0	0	0	111.2	K730 C731 A732 T737 F738 N779 A782 L783 Y786 L799 T802	K730-F734 PolarHBondContact O-N 3.41Å; K730-F734 VanDerWaalsContact O-N 3.14Å; C731-F734 PolarHBondContact O-N 3.41Å; A732-F734 PolarHBondContact O-N 3.5Å; F734-T737 PolarHBondContact O-N 3.35Å; F734-F738 WeakPolarHBondContact O-CB 3.36Å; F734-F738 PolarHBondContact O-N 2.86Å; F734-N779 WeakPolarHBondContact CZ-O 3.44Å; F734-A782 HydrophobicContact CE2-CB 4.17Å; F734-A782 HydrophobicContact CZ-CB 4.01Å; F734-L783 HydrophobicContact CB-CD1 3.92Å; F734-L783 HydrophobicContact CD1-CB 4Å; F734-L783 HydrophobicContact CD1-CD1 3.68Å; F734-L783 HydrophobicContact CD1-CG 4.26Å; F734-L783 HydrophobicContact CD2-CD1 4.2Å; F734-L783 HydrophobicContact CE1-CB 3.65Å; F734-L783 HydrophobicContact CE1-CD1 4.25Å; F734-L783 HydrophobicContact CE1-CG 4.39Å; F734-L783 HydrophobicContact CE2-CB 4.24Å; F734-L783 HydrophobicContact CG-CB 4.45Å; F734-L783 HydrophobicContact CG-CD1 3.66Å; F734-L783 HydrophobicContact CZ-CB 3.77Å; F734-Y786 HydrophobicContact CB-CD1 4.17Å; F734-Y786 HydrophobicContact CB-CE1 4.07Å; F734-Y786 AromaticContact CD2-CD1 3.96Å; F734-Y786 HydrophobicContact CD2-CD1 3.96Å; F734-Y786 HydrophobicContact CD2-CD2 4.48Å; F734-Y786 AromaticContact CD2-CG 3.94Å; F734-Y786 HydrophobicContact CD2-CG 3.94Å; F734-Y786 HydrophobicContact CG-CD1 4.42Å; F734-L799 HydrophobicContact CB-CD2 4.39Å; F734-L799 HydrophobicContact CD2-CD2 4.25Å; F734-T802 HydrophobicContact CD2-CG2 4.04Å; F734-T802 HydrophobicContact CE1-CG2 4.42Å; F734-T802 HydrophobicContact CE2-CG2 3.78Å; F734-T802 HydrophobicContact CG-CG2 4.48Å; F734-T802 VanDerWaalsContact CZ-CB 3.46Å; F734-T802 HydrophobicContact CZ-CG2 3.99Å
735	L	94.7	Very high	91	Very high	75 Å²	75	21.4 Å²	21.4	39%	0.393	12%	0.123	S	C	.	.	H	α-helix	trans	-65.3	-42.2	179.3	-67.5	177.2	0	0	0	111.9	C731 A732 T737 F738 I739	C731-L735 WeakPolarHBondContact O-CG 3.41Å; C731-L735 PolarHBondContact O-N 3.35Å; A732-L735 PolarHBondContact O-N 3.42Å; L735-T737 PolarHBondContact O-N 3.45Å; L735-F738 PolarHBondContact O-N 3.18Å; L735-I739 WeakPolarHBondContact O-CB 3.14Å; L735-I739 VanDerWaalsContact O-CG1 3.22Å; L735-I739 WeakPolarHBondContact O-CG1 3.33Å; L735-I739 PolarHBondContact O-N 3.3Å
736	G	94.8	Very high	92	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-42.9	175.2	0	0	0	0	0	112.1	A732 G740	A732-G736 PolarHBondContact O-N 3.23Å; G736-G740 PolarHBondContact O-N 2.91Å
737	T	96.1	Very high	92.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.7	-42.7	175.2	-52.9	0	0	0	0	111.9	A706 C709 I710 L733 F734 L735 G741 T802 A803	A706-T737 HydrophobicContact CB-CG2 4.47Å; C709-T737 VanDerWaalsContact CB-OG1 3.29Å; C709-T737 WeakPolarHBondContact CB-OG1 3.37Å; I710-T737 HydrophobicContact CD1-CG2 4.45Å; I710-T737 HydrophobicContact CG1-CG2 4.47Å; L733-T737 WeakPolarHBondContact O-CB 3.38Å; L733-T737 PolarHBondContact O-N 3.12Å; L733-T737 PolarHBondContact O-OG1 3.39Å; F734-T737 PolarHBondContact O-N 3.35Å; L735-T737 PolarHBondContact O-N 3.45Å; T737-G741 PolarHBondContact O-N 2.92Å; T737-T802 HydrophobicContact CG2-CG2 3.81Å; T737-A803 HydrophobicContact CG2-CB 3.84Å
738	F	96.3	Very high	93.3	Very high	48 Å²	48	20.8 Å²	20.8	21%	0.211	11%	0.111	C	C	.	.	H	α-helix	trans	-62.3	-52.7	176.7	174.2	-97.3	0	0	0	111.8	F734 L735 G740 G741 V742 N779 S806 M809	F734-F738 WeakPolarHBondContact O-CB 3.36Å; F734-F738 PolarHBondContact O-N 2.86Å; L735-F738 PolarHBondContact O-N 3.18Å; F738-G740 VanDerWaalsContact C-N 3.32Å; F738-G740 PolarHBondContact O-N 3.41Å; F738-G741 PolarHBondContact O-N 3.49Å; F738-V742 HydrophobicContact CE1-CG2 4.44Å; F738-V742 HydrophobicContact CZ-CG2 4.38Å; F738-V742 WeakPolarHBondContact O-CG2 3.32Å; F738-V742 PolarHBondContact O-N 3.02Å; F738-V742 VanDerWaalsContact O-N 3.13Å; F738-N779 HydrophobicContact CD2-CB 4.15Å; F738-N779 HydrophobicContact CE2-CB 3.96Å; F738-S806 VanDerWaalsContact O-CB 3.23Å; F738-S806 WeakPolarHBondContact O-CB 3.19Å; F738-S806 PolarHBondContact O-OG 3.49Å; F738-M809 HydrophobicContact CE1-CE 4.23Å; F738-M809 HydrophobicContact CE2-CE 3.72Å; F738-M809 HydrophobicContact CZ-CE 3.34Å; F738-M809 HydrophobicContact CZ-SD 4.35Å
739	I	95.6	Very high	93.8	Very high	34 Å²	34	21.4 Å²	21.4	17%	0.174	11%	0.112	C	C	.	.	H	α-helix	trans	-63.5	-42.1	-179.2	-63.1	167.5	0	0	0	109.9	L735 V742 T743 Y844 W847 A848	L735-I739 WeakPolarHBondContact O-CB 3.14Å; L735-I739 VanDerWaalsContact O-CG1 3.22Å; L735-I739 WeakPolarHBondContact O-CG1 3.33Å; L735-I739 PolarHBondContact O-N 3.3Å; I739-V742 PolarHBondContact O-N 2.98Å; I739-T743 VanDerWaalsContact O-CB 3.28Å; I739-T743 WeakPolarHBondContact O-CB 3.43Å; I739-T743 PolarHBondContact O-N 3.21Å; I739-T743 PolarHBondContact O-OG1 3.13Å; I739-Y844 WeakPolarHBondContact CG2-O 3.19Å; I739-W847 HydrophobicContact CD1-CB 4.19Å; I739-A848 HydrophobicContact CB-CB 4.39Å; I739-A848 HydrophobicContact CG2-CB 3.91Å
740	G	94.7	Very high	93.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.1	-46.3	175.8	0	0	0	0	0	113.1	G702 G736 F738 T743 F744	G702-G740 CarbonylContact C-O 3.54Å; G702-G740 WeakPolarHBondContact CA-O 3.48Å; G702-G740 CarbonylContact O-C 3.36Å; G702-G740 WeakPolarHBondContact O-CA 3.41Å; G736-G740 PolarHBondContact O-N 2.91Å; F738-G740 VanDerWaalsContact C-N 3.32Å; F738-G740 PolarHBondContact O-N 3.41Å; G740-T743 PolarHBondContact O-N 2.81Å; G740-F744 VanDerWaalsContact O-CB 3.31Å; G740-F744 WeakPolarHBondContact O-CB 3.38Å; G740-F744 PolarHBondContact O-N 3.17Å
741	G	95.7	Very high	94	Very high	3 Å²	3	22 Å²	22	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-65.4	-42.9	178.5	0	0	0	0	0	114.1	T737 F738 T743 T745 S806	T737-G741 PolarHBondContact O-N 2.92Å; F738-G741 PolarHBondContact O-N 3.49Å; G741-T743 VanDerWaalsContact C-N 3.32Å; G741-T743 PolarHBondContact O-N 3.24Å; G741-T745 PolarHBondContact O-N 3Å; G741-T745 PolarHBondContact O-OG1 3.25Å; G741-S806 WeakPolarHBondContact CA-OG 3.47Å
742	V	95.4	Very high	93.9	Very high	8 Å²	8	20.3 Å²	20.3	5%	0.048	10%	0.103	C	C	.	.	H	α-helix	trans	-60.6	-45.1	172.6	179.8	0	0	0	0	110.3	F738 I739 G746 M809 Y844	F738-V742 HydrophobicContact CE1-CG2 4.44Å; F738-V742 HydrophobicContact CZ-CG2 4.38Å; F738-V742 WeakPolarHBondContact O-CG2 3.32Å; F738-V742 PolarHBondContact O-N 3.02Å; F738-V742 VanDerWaalsContact O-N 3.13Å; I739-V742 PolarHBondContact O-N 2.98Å; V742-G746 WeakPolarHBondContact O-CA 3.15Å; V742-G746 PolarHBondContact O-N 2.68Å; V742-M809 HydrophobicContact CG2-CE 3.32Å; V742-Y844 HydrophobicContact CG1-CD2 4.07Å; V742-Y844 HydrophobicContact CG1-CE2 4.01Å
743	T	95	Very high	93.6	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.8	-45	-176.4	-56.8	0	0	0	0	111.1	I739 G740 G741 S747 Y844	I739-T743 VanDerWaalsContact O-CB 3.28Å; I739-T743 WeakPolarHBondContact O-CB 3.43Å; I739-T743 PolarHBondContact O-N 3.21Å; I739-T743 PolarHBondContact O-OG1 3.13Å; G740-T743 PolarHBondContact O-N 2.81Å; G741-T743 VanDerWaalsContact C-N 3.32Å; G741-T743 PolarHBondContact O-N 3.24Å; T743-S747 WeakPolarHBondContact O-CB 3.16Å; T743-S747 PolarHBondContact O-N 3.07Å; T743-S747 PolarHBondContact O-OG 2.89Å; T743-Y844 VanDerWaalsContact OG1-CB 3.26Å; T743-Y844 WeakPolarHBondContact OG1-CB 3.49Å
744	F	95.6	Very high	93.1	Very high	65 Å²	65	20.8 Å²	20.8	29%	0.285	10%	0.103	S	C	.	.	H	α-helix	trans	-57	-59.5	179	171.6	-122.9	0	0	0	111.5	S699 V703 G740 L748	S699-F744 WeakPolarHBondContact CB-O 3.38Å; S699-F744 WeakPolarHBondContact O-CD2 3.44Å; V703-F744 HydrophobicContact CB-CD2 3.8Å; V703-F744 HydrophobicContact CB-CE2 4.18Å; V703-F744 HydrophobicContact CB-CG 4.16Å; V703-F744 HydrophobicContact CG1-CD2 4.38Å; G740-F744 VanDerWaalsContact O-CB 3.31Å; G740-F744 WeakPolarHBondContact O-CB 3.38Å; G740-F744 PolarHBondContact O-N 3.17Å; F744-L748 HydrophobicContact CD2-CD1 4.09Å; F744-L748 HydrophobicContact CD2-CG 4.5Å; F744-L748 HydrophobicContact CE1-CD1 4.14Å; F744-L748 HydrophobicContact CE2-CD1 3.54Å; F744-L748 HydrophobicContact CE2-CG 4.25Å; F744-L748 HydrophobicContact CZ-CD1 3.56Å; F744-L748 WeakPolarHBondContact O-CG 3.31Å; F744-L748 PolarHBondContact O-N 3.41Å; F744-L748 VanDerWaalsContact O-N 3.13Å
745	T	95.8	Very high	92.5	Very high	14 Å²	14	24.9 Å²	24.9	9%	0.086	12%	0.123	C	C	.	.	H	α-helix	trans	-74.2	-39.5	-174	53	0	0	0	0	113.7	G741 S747 L748 M749 S807 G810 V811	G741-T745 PolarHBondContact O-N 3Å; G741-T745 PolarHBondContact O-OG1 3.25Å; T745-S747 VanDerWaalsContact C-N 3.27Å; T745-S747 PolarHBondContact O-N 3.34Å; T745-L748 PolarHBondContact O-N 3.29Å; T745-M749 WeakPolarHBondContact O-CG 3.48Å; T745-M749 PolarHBondContact O-N 2.97Å; T745-S807 WeakPolarHBondContact CB-O 3.39Å; T745-S807 VanDerWaalsContact CG2-CB 3.46Å; T745-S807 WeakPolarHBondContact OG1-CA 3.41Å; T745-S807 PolarHBondContact OG1-O 3.24Å; T745-G810 WeakPolarHBondContact OG1-CA 3.26Å; T745-V811 HydrophobicContact CG2-CG2 4.3Å
746	G	93.2	Very high	91.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-42.1	175.6	0	0	0	0	0	111.2	V742 M749 A750 T814 L841	V742-G746 WeakPolarHBondContact O-CA 3.15Å; V742-G746 PolarHBondContact O-N 2.68Å; G746-M749 PolarHBondContact O-N 2.87Å; G746-A750 WeakPolarHBondContact O-CB 3.31Å; G746-A750 PolarHBondContact O-N 3.34Å; G746-T814 VanDerWaalsContact CA-OG1 3.28Å; G746-T814 WeakPolarHBondContact CA-OG1 3.2Å; G746-L841 VanDerWaalsContact C-CD1 3.42Å
747	S	93.3	Very high	91.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.4	-39.6	178.6	-67.6	0	0	0	0	112.6	A695 H698 T743 T745 A750 F751	A695-S747 VanDerWaalsContact O-CB 3.25Å; A695-S747 WeakPolarHBondContact O-CB 3.39Å; H698-S747 WeakPolarHBondContact CB-OG 3.2Å; T743-S747 WeakPolarHBondContact O-CB 3.16Å; T743-S747 PolarHBondContact O-N 3.07Å; T743-S747 PolarHBondContact O-OG 2.89Å; T745-S747 VanDerWaalsContact C-N 3.27Å; T745-S747 PolarHBondContact O-N 3.34Å; S747-A750 PolarHBondContact O-N 3.14Å; S747-F751 WeakPolarHBondContact O-CB 3.42Å; S747-F751 PolarHBondContact O-N 3.27Å
748	L	94.2	Very high	90.9	Very high	60 Å²	60	32.3 Å²	32.3	31%	0.314	18%	0.175	S	C	.	.	H	α-helix	trans	-63.8	-39.6	173.5	-72.5	177.3	0	0	0	112.4	F744 T745 F751 G752	F744-L748 HydrophobicContact CD2-CD1 4.09Å; F744-L748 HydrophobicContact CD2-CG 4.5Å; F744-L748 HydrophobicContact CE1-CD1 4.14Å; F744-L748 HydrophobicContact CE2-CD1 3.54Å; F744-L748 HydrophobicContact CE2-CG 4.25Å; F744-L748 HydrophobicContact CZ-CD1 3.56Å; F744-L748 WeakPolarHBondContact O-CG 3.31Å; F744-L748 PolarHBondContact O-N 3.41Å; F744-L748 VanDerWaalsContact O-N 3.13Å; T745-L748 PolarHBondContact O-N 3.29Å; L748-F751 PolarHBondContact O-N 2.95Å; L748-G752 PolarHBondContact O-N 3.31Å
749	M	92.5	Very high	89.9	Confident	40 Å²	40	34.5 Å²	34.5	20%	0.197	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-40.6	176	-67	-52.6	95.8	0	0	111.5	T745 G746 G752 K753 L758 V811 T814 M815	T745-M749 WeakPolarHBondContact O-CG 3.48Å; T745-M749 PolarHBondContact O-N 2.97Å; G746-M749 PolarHBondContact O-N 2.87Å; M749-G752 PolarHBondContact O-N 3.07Å; M749-K753 WeakPolarHBondContact O-CB 3.21Å; M749-K753 WeakPolarHBondContact O-CG 3.27Å; M749-K753 PolarHBondContact O-N 3.21Å; M749-L758 HydrophobicContact CE-CD1 4.41Å; M749-L758 HydrophobicContact SD-CD1 3.83Å; M749-V811 HydrophobicContact CG-CB 4.35Å; M749-V811 HydrophobicContact CG-CG1 4.26Å; M749-V811 HydrophobicContact CG-CG2 4.15Å; M749-V811 HydrophobicContact SD-CG1 4.15Å; M749-V811 HydrophobicContact SD-CG2 4.4Å; M749-T814 HydrophobicContact CB-CG2 3.64Å; M749-M815 HydrophobicContact CB-SD 4.4Å; M749-M815 HydrophobicContact CG-CG 4.16Å; M749-M815 HydrophobicContact CG-SD 4.32Å; M749-M815 HydrophobicContact SD-CG 4.11Å; M749-M815 HydrophobicContact SD-SD 3.9Å
750	A	89.1	Confident	88.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-46.2	174.5	0	0	0	0	0	111.5	A695 G746 S747 K753 L754 T814 M834	A695-A750 HydrophobicContact CB-CB 4.27Å; G746-A750 WeakPolarHBondContact O-CB 3.31Å; G746-A750 PolarHBondContact O-N 3.34Å; S747-A750 PolarHBondContact O-N 3.14Å; A750-K753 PolarHBondContact O-N 3.26Å; A750-L754 WeakPolarHBondContact O-CB 3.36Å; A750-L754 WeakPolarHBondContact O-CG 3.49Å; A750-L754 PolarHBondContact O-N 3.06Å; A750-T814 HydrophobicContact CB-CG2 4.35Å; A750-M834 HydrophobicContact CB-CG 4.27Å; A750-M834 HydrophobicContact CB-SD 3.61Å
751	F	90.2	Very high	87.2	Confident	60 Å²	60	34.3 Å²	34.3	26%	0.263	19%	0.19	S	C	.	.	H	α-helix	trans	-56	-52.8	172.5	168.2	-101.5	0	0	0	111.6	Q692 A695 A696 S747 L748 K753 L754 Q755 I757	Q692-F751 HydrophobicContact CB-CD2 3.79Å; Q692-F751 HydrophobicContact CB-CE2 4.18Å; Q692-F751 HydrophobicContact CG-CD2 4.4Å; Q692-F751 HydrophobicContact CG-CE2 4.31Å; Q692-F751 VanDerWaalsContact O-CD2 3.32Å; Q692-F751 WeakPolarHBondContact O-CD2 3.4Å; A695-F751 HydrophobicContact CB-CB 4.27Å; A696-F751 HydrophobicContact CB-CD2 3.96Å; A696-F751 HydrophobicContact CB-CE2 4.43Å; A696-F751 HydrophobicContact CB-CG 4.34Å; S747-F751 WeakPolarHBondContact O-CB 3.42Å; S747-F751 PolarHBondContact O-N 3.27Å; L748-F751 PolarHBondContact O-N 2.95Å; F751-K753 VanDerWaalsContact C-N 3.29Å; F751-K753 PolarHBondContact O-N 3.45Å; F751-L754 PolarHBondContact O-N 3.24Å; F751-Q755 HydrophobicContact CE2-CB 4.41Å; F751-Q755 HydrophobicContact CZ-CB 4.38Å; F751-Q755 HydrophobicContact CZ-CG 4.29Å; F751-Q755 VanDerWaalsContact O-CB 3.32Å; F751-Q755 WeakPolarHBondContact O-CB 3.45Å; F751-Q755 PolarHBondContact O-N 3.01Å; F751-I757 HydrophobicContact CE1-CD1 4.13Å
752	G	89.9	Confident	86.2	Confident	5 Å²	5	34.8 Å²	34.8	5%	0.052	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-38.1	-178	0	0	0	0	0	113	L748 M749 G756 I757 L758	L748-G752 PolarHBondContact O-N 3.31Å; M749-G752 PolarHBondContact O-N 3.07Å; G752-G756 PolarHBondContact O-N 2.9Å; G752-I757 PolarHBondContact O-N 3Å; G752-L758 PolarHBondContact O-N 2.86Å
753	K	85.3	Confident	85.5	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.022	21%	0.212	C	C	.	.	H	α-helix	trans	-71.5	-39.5	176	-75.9	-171.9	173.3	-156.2	0	113	M749 A750 F751 G756 L758 A761 M815 I817 M834	M749-K753 WeakPolarHBondContact O-CB 3.21Å; M749-K753 WeakPolarHBondContact O-CG 3.27Å; M749-K753 PolarHBondContact O-N 3.21Å; A750-K753 PolarHBondContact O-N 3.26Å; F751-K753 VanDerWaalsContact C-N 3.29Å; F751-K753 PolarHBondContact O-N 3.45Å; K753-G756 PolarHBondContact O-N 3.19Å; K753-L758 HydrophobicContact CG-CB 4Å; K753-L758 HydrophobicContact CG-CD1 4.43Å; K753-A761 PolarHBondContact NZ-O 2.93Å; K753-M815 VanDerWaalsContact CE-SD 3.57Å; K753-M815 PolarHBondContact NZ-O 3.02Å; K753-I817 PolarHBondContact NZ-O 3.39Å; K753-M834 HydrophobicContact CB-CE 4.05Å; K753-M834 HydrophobicContact CD-CE 3.42Å; K753-M834 VanDerWaalsContact CD-CE 3.42Å; K753-M834 HydrophobicContact CG-CE 4.35Å
754	L	82.3	Confident	84.8	Confident	15 Å²	15	41 Å²	41	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-71.4	-39.6	179.1	-72.3	171	0	0	0	112.5	P691 Q692 A750 F751 G756 R831 M834 I838	P691-L754 HydrophobicContact CB-CD1 4.33Å; Q692-L754 HydrophobicContact CB-CB 3.93Å; A750-L754 WeakPolarHBondContact O-CB 3.36Å; A750-L754 WeakPolarHBondContact O-CG 3.49Å; A750-L754 PolarHBondContact O-N 3.06Å; F751-L754 PolarHBondContact O-N 3.24Å; L754-G756 PolarHBondContact O-N 3.13Å; L754-R831 HydrophobicContact CD2-CG 4.38Å; L754-M834 HydrophobicContact CD1-CG 4.03Å; L754-M834 HydrophobicContact CD2-CB 4.11Å; L754-M834 HydrophobicContact CD2-CG 3.97Å; L754-M834 HydrophobicContact CG-CG 3.82Å; L754-I838 HydrophobicContact CD1-CD1 3.51Å; L754-I838 HydrophobicContact CD1-CG1 4.49Å
755	Q	83.3	Confident	84.3	Confident	90 Å²	90	41.8 Å²	41.8	42%	0.421	24%	0.236	S	C	.	.	H	α-helix	trans	-71.2	-16.5	177	-166.5	61.3	18.6	0	0	112.6	F751 I757	F751-Q755 HydrophobicContact CE2-CB 4.41Å; F751-Q755 HydrophobicContact CZ-CB 4.38Å; F751-Q755 HydrophobicContact CZ-CG 4.29Å; F751-Q755 VanDerWaalsContact O-CB 3.32Å; F751-Q755 WeakPolarHBondContact O-CB 3.45Å; F751-Q755 PolarHBondContact O-N 3.01Å; Q755-I757 HydrophobicContact CB-CD1 4.23Å; Q755-I757 HydrophobicContact CB-CG1 4.18Å; Q755-I757 HydrophobicContact CG-CD1 3.95Å; Q755-I757 HydrophobicContact CG-CG1 4Å
756	G	80.1	Confident	83.8	Confident	56 Å²	56	47.3 Å²	47.3	58%	0.577	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	13.7	-178.2	0	0	0	0	0	114.4	G752 K753 L754	G752-G756 PolarHBondContact O-N 2.9Å; K753-G756 PolarHBondContact O-N 3.19Å; L754-G756 PolarHBondContact O-N 3.13Å
757	I	87.1	Confident	83.3	Confident	122 Å²	122	49.8 Å²	49.8	63%	0.626	30%	0.298	S	S	*	.	S	Bend	trans	-71.3	-40.4	172.2	-58.4	171.1	0	0	0	109.5	F751 G752 Q755	F751-I757 HydrophobicContact CE1-CD1 4.13Å; G752-I757 PolarHBondContact O-N 3Å; Q755-I757 HydrophobicContact CB-CD1 4.23Å; Q755-I757 HydrophobicContact CB-CG1 4.18Å; Q755-I757 HydrophobicContact CG-CD1 3.95Å; Q755-I757 HydrophobicContact CG-CG1 4Å
758	L	84.9	Confident	83	Confident	54 Å²	54	52.2 Å²	52.2	28%	0.283	31%	0.307	S	S	.	.	S	Bend	trans	-97.7	146.3	173.4	-63.8	172.9	0	0	0	110.1	M749 G752 K753 S760 M815	M749-L758 HydrophobicContact CE-CD1 4.41Å; M749-L758 HydrophobicContact SD-CD1 3.83Å; G752-L758 PolarHBondContact O-N 2.86Å; K753-L758 HydrophobicContact CG-CB 4Å; K753-L758 HydrophobicContact CG-CD1 4.43Å; L758-S760 PolarHBondContact O-N 3.31Å; L758-M815 HydrophobicContact CD1-SD 4.08Å
759	N	75	Confident	82.6	Confident	94 Å²	94	53.6 Å²	53.6	50%	0.503	31%	0.311	S	S	.	.			trans	-61.2	125.2	169.6	-170.4	-20.5	0	0	0	108.6	A761	N759-A761 PolarHBondContact O-N 3.47Å; N759-A761 WeakPolarHBondContact OD1-CB 3.39Å; N759-A761 PolarHBondContact OD1-N 3.43Å
760	S	67.4	Low	82.6	Confident	26 Å²	26	55.1 Å²	55.1	18%	0.182	33%	0.331	C	S	.	.			trans	-77	-4.2	-173.7	47.3	0	0	0	0	112.8	L758 L830	L758-S760 PolarHBondContact O-N 3.31Å; S760-L830 WeakPolarHBondContact O-CD2 3.45Å; S760-L830 WeakPolarHBondContact OG-CB 3.2Å; S760-L830 WeakPolarHBondContact OG-CD1 3.48Å; S760-L830 WeakPolarHBondContact OG-CG 3.22Å
761	A	66.5	Low	82.7	Confident	4 Å²	4	58.7 Å²	58.7	3%	0.033	35%	0.349	C	S	.	.	S	Bend	trans	-61	149	170.1	0	0	0	0	0	112	K753 N759 V763 F821 L830	K753-A761 PolarHBondContact NZ-O 2.93Å; N759-A761 PolarHBondContact O-N 3.47Å; N759-A761 WeakPolarHBondContact OD1-CB 3.39Å; N759-A761 PolarHBondContact OD1-N 3.43Å; A761-V763 PolarHBondContact O-N 3.17Å; A761-F821 HydrophobicContact CB-CB 4.42Å; A761-F821 HydrophobicContact CB-CD2 3.98Å; A761-L830 VanDerWaalsContact CA-CD2 3.45Å; A761-L830 HydrophobicContact CB-CD1 4.42Å; A761-L830 HydrophobicContact CB-CD2 4.14Å
762	A	73.7	Confident	82.7	Confident	13 Å²	13	56.8 Å²	56.8	11%	0.107	34%	0.342	C	S	.	.			trans	-67	121.1	169.1	0	0	0	0	0	109.8	L764 A816 G818 G819	A762-L764 HydrophobicContact CB-CD2 3.99Å; A762-L764 HydrophobicContact CB-CG 4.3Å; A762-L764 PolarHBondContact O-N 3.46Å; A762-A816 VanDerWaalsContact CB-O 3.28Å; A762-A816 WeakPolarHBondContact CB-O 3.41Å; A762-G818 WeakPolarHBondContact CB-O 2.96Å; A762-G819 PolarHBondContact N-O 3.34Å; A762-G819 VanDerWaalsContact N-O 3.1Å
763	V	81.5	Confident	82.8	Confident	70 Å²	70	60.4 Å²	60.4	42%	0.424	36%	0.363	S	S	.	.			trans	-90.4	98.6	173.4	-179.1	0	0	0	0	107.2	A761 M815	A761-V763 PolarHBondContact O-N 3.17Å; V763-M815 HydrophobicContact CB-CE 4.18Å; V763-M815 HydrophobicContact CG2-CE 3.69Å; V763-M815 PolarHBondContact N-O 2.67Å
764	L	80.7	Confident	83.3	Confident	67 Å²	67	61.9 Å²	61.9	35%	0.351	38%	0.379	S	S	.	.			trans	-92	103.2	-177.1	-57.3	-178.5	0	0	0	110.1	A762 A816 K820	A762-L764 HydrophobicContact CB-CD2 3.99Å; A762-L764 HydrophobicContact CB-CG 4.3Å; A762-L764 PolarHBondContact O-N 3.46Å; L764-A816 HydrophobicContact CD2-CB 4.34Å; L764-K820 HydrophobicContact CD1-CG 4.41Å
765	L	84	Confident	83.9	Confident	82 Å²	82	61.9 Å²	61.9	43%	0.429	38%	0.38	S	S	.	.			trans	-67.9	139.2	172.9	-66.2	169	0	0	0	110.8	G767 R768 L771 T812	L765-G767 PolarHBondContact O-N 3.38Å; L765-R768 HydrophobicContact CB-CB 4.38Å; L765-R768 WeakPolarHBondContact O-CB 3.38Å; L765-R768 PolarHBondContact O-N 3.15Å; L765-L771 HydrophobicContact CD1-CD2 3.92Å; L765-T812 HydrophobicContact CD1-CG2 4.26Å
766	P	85.1	Confident	84.3	Confident	130 Å²	130	60.6 Å²	60.6	84%	0.844	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	129.2	168.9	-22.6	33.1	0	0	0	110.4	R768	P766-R768 VanDerWaalsContact C-N 3.33Å; P766-R768 PolarHBondContact O-N 2.98Å
767	G	84.1	Confident	85.1	Confident	53 Å²	53	63 Å²	63	55%	0.546	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	21.7	-179.4	0	0	0	0	0	115.5	L765 H769 A770 L771	L765-G767 PolarHBondContact O-N 3.38Å; G767-H769 PolarHBondContact O-N 3.01Å; G767-A770 WeakPolarHBondContact O-CA 3.26Å; G767-A770 WeakPolarHBondContact O-CB 3.5Å; G767-A770 PolarHBondContact O-N 3.32Å; G767-L771 PolarHBondContact O-N 3.37Å
768	R	85.5	Confident	85.5	Confident	51 Å²	51	59.2 Å²	59.2	19%	0.192	36%	0.364	C	S	.	.	H	α-helix	trans	-47.4	-36.7	-176.7	69.7	-178.4	-170.6	-110.8	9.5	115.6	L765 P766 L771 N772 L892 G893	L765-R768 HydrophobicContact CB-CB 4.38Å; L765-R768 WeakPolarHBondContact O-CB 3.38Å; L765-R768 PolarHBondContact O-N 3.15Å; P766-R768 VanDerWaalsContact C-N 3.33Å; P766-R768 PolarHBondContact O-N 2.98Å; R768-L771 PolarHBondContact O-N 3.01Å; R768-N772 WeakPolarHBondContact O-CB 3.49Å; R768-N772 PolarHBondContact O-N 3.4Å; R768-N772 PolarHBondContact O-ND2 3.35Å; R768-L892 PolarHBondContact NH2-O 2.99Å; R768-L892 VanDerWaalsContact NH2-O 3.11Å; R768-G893 PolarHBondContact NH2-O 3.29Å; R768-G893 VanDerWaalsContact NH2-O 3.12Å
769	H	86.9	Confident	86	Confident	88 Å²	88	57 Å²	57	41%	0.407	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-43.4	179.3	-62.1	-65.4	0	0	0	111	G767 L771 N772 T773	G767-H769 PolarHBondContact O-N 3.01Å; H769-L771 VanDerWaalsContact C-N 3.32Å; H769-L771 PolarHBondContact O-N 2.86Å; H769-N772 PolarHBondContact O-N 3.05Å; H769-T773 WeakPolarHBondContact O-CB 3.28Å; H769-T773 PolarHBondContact O-N 3.42Å; H769-T773 PolarHBondContact O-OG1 2.73Å
770	A	91.4	Very high	86.9	Confident	73 Å²	73	57.4 Å²	57.4	60%	0.603	35%	0.354	S	S	*	.	H	α-helix	trans	-62.9	-39.7	174.2	0	0	0	0	0	111.6	G767 G774	G767-A770 WeakPolarHBondContact O-CA 3.26Å; G767-A770 WeakPolarHBondContact O-CB 3.5Å; G767-A770 PolarHBondContact O-N 3.32Å; A770-G774 PolarHBondContact O-N 3.02Å
771	L	91.9	Very high	88.2	Confident	74 Å²	74	58.3 Å²	58.3	39%	0.387	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-52.2	174.2	179	64.8	0	0	0	111.5	L765 G767 R768 H769 G774 L775 T812	L765-L771 HydrophobicContact CD1-CD2 3.92Å; G767-L771 PolarHBondContact O-N 3.37Å; R768-L771 PolarHBondContact O-N 3.01Å; H769-L771 VanDerWaalsContact C-N 3.32Å; H769-L771 PolarHBondContact O-N 2.86Å; L771-G774 PolarHBondContact O-N 3.06Å; L771-L775 HydrophobicContact CG-CD1 4.25Å; L771-L775 WeakPolarHBondContact O-CG 3.49Å; L771-L775 PolarHBondContact O-N 3.31Å; L771-T812 HydrophobicContact CD2-CG2 3.87Å
772	N	90.6	Very high	89.6	Confident	20 Å²	20	58.6 Å²	58.6	11%	0.107	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-41.5	-178.9	-71.2	-18.1	0	0	0	111.8	R768 H769 G774 L775 T776 T812	R768-N772 WeakPolarHBondContact O-CB 3.49Å; R768-N772 PolarHBondContact O-N 3.4Å; R768-N772 PolarHBondContact O-ND2 3.35Å; H769-N772 PolarHBondContact O-N 3.05Å; N772-G774 VanDerWaalsContact C-N 3.32Å; N772-G774 PolarHBondContact O-N 3.2Å; N772-L775 PolarHBondContact O-N 3.09Å; N772-T776 PolarHBondContact O-N 2.67Å; N772-T776 PolarHBondContact O-OG1 3.47Å; N772-T776 VanDerWaalsContact O-OG1 3.07Å; N772-T812 PolarHBondContact OD1-OG1 2.85Å
773	T	91.9	Very high	90.5	Very high	82 Å²	82	59.6 Å²	59.6	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-60.5	-42.2	172.5	-62.5	0	0	0	0	111.3	H769 T776 L777	H769-T773 WeakPolarHBondContact O-CB 3.28Å; H769-T773 PolarHBondContact O-N 3.42Å; H769-T773 PolarHBondContact O-OG1 2.73Å; T773-T776 PolarHBondContact O-N 3.4Å; T773-L777 HydrophobicContact CG2-CD1 4.01Å; T773-L777 HydrophobicContact CG2-CG 4.38Å; T773-L777 WeakPolarHBondContact O-CB 3.23Å; T773-L777 WeakPolarHBondContact O-CG 3.37Å; T773-L777 PolarHBondContact O-N 3.36Å
774	G	95.4	Very high	91.1	Very high	35 Å²	35	58.4 Å²	58.4	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-60.7	-44.1	174.5	0	0	0	0	0	112.6	A770 L771 N772 L777 A778	A770-G774 PolarHBondContact O-N 3.02Å; L771-G774 PolarHBondContact O-N 3.06Å; N772-G774 VanDerWaalsContact C-N 3.32Å; N772-G774 PolarHBondContact O-N 3.2Å; G774-L777 PolarHBondContact O-N 3.42Å; G774-A778 VanDerWaalsContact O-CB 3.26Å; G774-A778 WeakPolarHBondContact O-CB 3.44Å; G774-A778 PolarHBondContact O-N 3.13Å
775	L	94.7	Very high	91.7	Very high	16 Å²	16	62.5 Å²	62.5	8%	0.084	39%	0.386	C	S	.	.	H	α-helix	trans	-62.7	-41	175.4	-69.7	170.2	0	0	0	111.8	L771 N772 A778 N779 L805 V808 M809	L771-L775 HydrophobicContact CG-CD1 4.25Å; L771-L775 WeakPolarHBondContact O-CG 3.49Å; L771-L775 PolarHBondContact O-N 3.31Å; N772-L775 PolarHBondContact O-N 3.09Å; L775-A778 PolarHBondContact O-N 2.96Å; L775-N779 PolarHBondContact O-N 3.2Å; L775-N779 PolarHBondContact O-ND2 3.05Å; L775-L805 HydrophobicContact CD2-CD2 3.82Å; L775-V808 HydrophobicContact CD1-CG1 3.95Å; L775-V808 HydrophobicContact CD2-CG1 4.22Å; L775-M809 HydrophobicContact CB-CB 4.49Å; L775-M809 HydrophobicContact CD1-CB 4.1Å; L775-M809 HydrophobicContact CD1-CG 4.42Å
776	T	92.7	Very high	92.1	Very high	62 Å²	62	58.6 Å²	58.6	38%	0.38	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-48.8	175.1	-57.5	0	0	0	0	111.7	N772 T773 A778 N779 L780	N772-T776 PolarHBondContact O-N 2.67Å; N772-T776 PolarHBondContact O-OG1 3.47Å; N772-T776 VanDerWaalsContact O-OG1 3.07Å; T773-T776 PolarHBondContact O-N 3.4Å; T776-A778 VanDerWaalsContact C-N 3.31Å; T776-A778 PolarHBondContact O-N 2.68Å; T776-N779 PolarHBondContact O-N 3.35Å; T776-L780 HydrophobicContact CG2-CD1 4.41Å; T776-L780 WeakPolarHBondContact O-CG 3.36Å; T776-L780 PolarHBondContact O-N 3.12Å
777	L	95.9	Very high	92.3	Very high	108 Å²	108	55.9 Å²	55.9	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-63.1	-37.5	178.1	-70.2	174	0	0	0	112	T773 G774 L780 G781	T773-L777 HydrophobicContact CG2-CD1 4.01Å; T773-L777 HydrophobicContact CG2-CG 4.38Å; T773-L777 WeakPolarHBondContact O-CB 3.23Å; T773-L777 WeakPolarHBondContact O-CG 3.37Å; T773-L777 PolarHBondContact O-N 3.36Å; G774-L777 PolarHBondContact O-N 3.42Å; L777-L780 PolarHBondContact O-N 2.88Å; L777-G781 PolarHBondContact O-N 2.98Å
778	A	96.3	Very high	92.5	Very high	42 Å²	42	57.9 Å²	57.9	35%	0.347	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-40.6	174.9	0	0	0	0	0	111.9	G774 L775 T776 G781 A782 L805	G774-A778 VanDerWaalsContact O-CB 3.26Å; G774-A778 WeakPolarHBondContact O-CB 3.44Å; G774-A778 PolarHBondContact O-N 3.13Å; L775-A778 PolarHBondContact O-N 2.96Å; T776-A778 VanDerWaalsContact C-N 3.31Å; T776-A778 PolarHBondContact O-N 2.68Å; A778-G781 PolarHBondContact O-N 2.96Å; A778-A782 WeakPolarHBondContact O-CB 3.43Å; A778-A782 PolarHBondContact O-N 3.01Å; A778-L805 HydrophobicContact CB-CD1 3.88Å; A778-L805 HydrophobicContact CB-CD2 4.46Å
779	N	95.5	Very high	92.6	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.032	35%	0.346	C	S	.	.	H	α-helix	trans	-66	-41	173.8	-81.7	-73.5	0	0	0	112.4	F734 F738 L775 T776 G781 A782 L783 T802 L805	F734-N779 WeakPolarHBondContact CZ-O 3.44Å; F738-N779 HydrophobicContact CD2-CB 4.15Å; F738-N779 HydrophobicContact CE2-CB 3.96Å; L775-N779 PolarHBondContact O-N 3.2Å; L775-N779 PolarHBondContact O-ND2 3.05Å; T776-N779 PolarHBondContact O-N 3.35Å; N779-G781 VanDerWaalsContact C-N 3.34Å; N779-A782 PolarHBondContact O-N 3.48Å; N779-L783 WeakPolarHBondContact O-CB 3.35Å; N779-L783 PolarHBondContact O-N 2.9Å; N779-T802 WeakPolarHBondContact OD1-CA 3.35Å; N779-T802 PolarHBondContact OD1-OG1 3.49Å; N779-T802 VanDerWaalsContact OD1-OG1 3.05Å; N779-L805 VanDerWaalsContact ND2-CB 3.34Å; N779-L805 WeakPolarHBondContact ND2-CB 3.34Å
780	L	94	Very high	92.4	Very high	103 Å²	103	57 Å²	57	54%	0.539	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-39.3	175	-69.6	174.4	0	0	0	112	T776 L777 L783 G784	T776-L780 HydrophobicContact CG2-CD1 4.41Å; T776-L780 WeakPolarHBondContact O-CG 3.36Å; T776-L780 PolarHBondContact O-N 3.12Å; L777-L780 PolarHBondContact O-N 2.88Å; L780-L783 PolarHBondContact O-N 2.86Å; L780-G784 PolarHBondContact O-N 3.19Å
781	G	94.8	Very high	92.3	Very high	45 Å²	45	56.7 Å²	56.7	46%	0.464	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-43.5	173.1	0	0	0	0	0	112.5	L777 A778 N779 L783 G784 W785	L777-G781 PolarHBondContact O-N 2.98Å; A778-G781 PolarHBondContact O-N 2.96Å; N779-G781 VanDerWaalsContact C-N 3.34Å; G781-L783 VanDerWaalsContact C-N 3.33Å; G781-L783 PolarHBondContact O-N 3.02Å; G781-G784 PolarHBondContact O-N 3.47Å; G781-W785 PolarHBondContact O-N 3.03Å
782	A	94.4	Very high	92.2	Very high	10 Å²	10	55.6 Å²	55.6	8%	0.083	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-38.7	175	0	0	0	0	0	111.9	F734 A778 N779 W785 Y786 N798	F734-A782 HydrophobicContact CE2-CB 4.17Å; F734-A782 HydrophobicContact CZ-CB 4.01Å; A778-A782 WeakPolarHBondContact O-CB 3.43Å; A778-A782 PolarHBondContact O-N 3.01Å; N779-A782 PolarHBondContact O-N 3.48Å; A782-W785 PolarHBondContact O-N 2.91Å; A782-Y786 WeakPolarHBondContact O-CB 3Å; A782-Y786 PolarHBondContact O-N 3.11Å; A782-N798 PolarHBondContact O-OD1 3.33Å
783	L	93.8	Very high	92.3	Very high	34 Å²	34	60 Å²	60	18%	0.178	36%	0.357	C	S	.	.	H	α-helix	trans	-62.2	-46.5	172.1	177.1	59.7	0	0	0	111.1	F734 N779 L780 G781 W785 Y786 M787	F734-L783 HydrophobicContact CB-CD1 3.92Å; F734-L783 HydrophobicContact CD1-CB 4Å; F734-L783 HydrophobicContact CD1-CD1 3.68Å; F734-L783 HydrophobicContact CD1-CG 4.26Å; F734-L783 HydrophobicContact CD2-CD1 4.2Å; F734-L783 HydrophobicContact CE1-CB 3.65Å; F734-L783 HydrophobicContact CE1-CD1 4.25Å; F734-L783 HydrophobicContact CE1-CG 4.39Å; F734-L783 HydrophobicContact CE2-CB 4.24Å; F734-L783 HydrophobicContact CG-CB 4.45Å; F734-L783 HydrophobicContact CG-CD1 3.66Å; F734-L783 HydrophobicContact CZ-CB 3.77Å; N779-L783 WeakPolarHBondContact O-CB 3.35Å; N779-L783 PolarHBondContact O-N 2.9Å; L780-L783 PolarHBondContact O-N 2.86Å; G781-L783 VanDerWaalsContact C-N 3.33Å; G781-L783 PolarHBondContact O-N 3.02Å; L783-W785 VanDerWaalsContact C-N 3.34Å; L783-W785 PolarHBondContact O-N 3.42Å; L783-Y786 HydrophobicContact CD1-CD1 4.43Å; L783-Y786 PolarHBondContact O-N 2.91Å; L783-M787 HydrophobicContact CD1-CG 3.9Å; L783-M787 HydrophobicContact CD1-SD 4.48Å; L783-M787 HydrophobicContact CG-CG 4.45Å; L783-M787 WeakPolarHBondContact O-CB 3.44Å; L783-M787 VanDerWaalsContact O-CG 3.27Å; L783-M787 WeakPolarHBondContact O-CG 3.22Å; L783-M787 PolarHBondContact O-N 2.88Å
784	G	92.7	Very high	92.3	Very high	45 Å²	45	58.5 Å²	58.5	46%	0.464	35%	0.346	S	S	.	.	H	α-helix	trans	-59.9	-41.3	177.5	0	0	0	0	0	113.1	L780 G781 S788	L780-G784 PolarHBondContact O-N 3.19Å; G781-G784 PolarHBondContact O-N 3.47Å; G784-S788 WeakPolarHBondContact O-CB 3.21Å; G784-S788 PolarHBondContact O-N 3.5Å; G784-S788 PolarHBondContact O-OG 2.9Å
785	W	93.6	Very high	92.1	Very high	154 Å²	154	56.9 Å²	56.9	58%	0.583	33%	0.329	S	S	*	.	H	α-helix	trans	-67.5	-48.3	174	-166.5	-35.5	0	0	0	111.1	G781 A782 L783 M787 S788 S789 I794	G781-W785 PolarHBondContact O-N 3.03Å; A782-W785 PolarHBondContact O-N 2.91Å; L783-W785 VanDerWaalsContact C-N 3.34Å; L783-W785 PolarHBondContact O-N 3.42Å; W785-M787 PolarHBondContact O-N 3.2Å; W785-S788 PolarHBondContact O-N 3.21Å; W785-S788 PolarHBondContact O-OG 3.09Å; W785-S789 PolarHBondContact O-N 2.69Å; W785-I794 HydrophobicContact CG-CG2 4.45Å
786	Y	92.3	Very high	92	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-37.9	179.1	173.1	-97.7	0	0	0	112.7	Y713 K730 F734 A782 L783 N798 L799	Y713-Y786 HydrophobicContact CD2-CE2 4.12Å; Y713-Y786 VanDerWaalsContact CD2-OH 3.28Å; Y713-Y786 WeakPolarHBondContact CD2-OH 3.45Å; Y713-Y786 AromaticContact CE2-CE2 3.74Å; Y713-Y786 HydrophobicContact CE2-CE2 3.74Å; K730-Y786 HydrophobicContact CB-CE1 3.74Å; K730-Y786 HydrophobicContact CG-CE1 4.38Å; K730-Y786 PolarHBondContact NZ-O 3.27Å; K730-Y786 WeakPolarHBondContact O-CE1 3.43Å; K730-Y786 PolarHBondContact O-OH 3.36Å; F734-Y786 HydrophobicContact CB-CD1 4.17Å; F734-Y786 HydrophobicContact CB-CE1 4.07Å; F734-Y786 AromaticContact CD2-CD1 3.96Å; F734-Y786 HydrophobicContact CD2-CD1 3.96Å; F734-Y786 HydrophobicContact CD2-CD2 4.48Å; F734-Y786 AromaticContact CD2-CG 3.94Å; F734-Y786 HydrophobicContact CD2-CG 3.94Å; F734-Y786 HydrophobicContact CG-CD1 4.42Å; A782-Y786 WeakPolarHBondContact O-CB 3Å; A782-Y786 PolarHBondContact O-N 3.11Å; L783-Y786 HydrophobicContact CD1-CD1 4.43Å; L783-Y786 PolarHBondContact O-N 2.91Å; Y786-N798 HydrophobicContact CD2-CB 4.09Å; Y786-N798 HydrophobicContact CG-CB 4.39Å; Y786-L799 HydrophobicContact CD2-CG 4.39Å; Y786-L799 HydrophobicContact CE2-CD1 4.21Å; Y786-L799 HydrophobicContact CE2-CD2 4.16Å; Y786-L799 HydrophobicContact CE2-CG 3.88Å
787	M	89.8	Confident	92.1	Very high	73 Å²	73	58.9 Å²	58.9	36%	0.36	35%	0.346	S	S	.	.	H	α-helix	trans	-77.5	-21.4	177.2	-66.6	-58.2	-66	0	0	113.7	A727 K730 C731 L783 W785	A727-M787 HydrophobicContact CB-CE 4.43Å; A727-M787 WeakPolarHBondContact O-CE 3.43Å; K730-M787 HydrophobicContact CB-SD 4.02Å; C731-M787 HydrophobicContact CB-SD 4.45Å; L783-M787 HydrophobicContact CD1-CG 3.9Å; L783-M787 HydrophobicContact CD1-SD 4.48Å; L783-M787 HydrophobicContact CG-CG 4.45Å; L783-M787 WeakPolarHBondContact O-CB 3.44Å; L783-M787 VanDerWaalsContact O-CG 3.27Å; L783-M787 WeakPolarHBondContact O-CG 3.22Å; L783-M787 PolarHBondContact O-N 2.88Å; W785-M787 PolarHBondContact O-N 3.2Å
788	S	88.8	Confident	92	Very high	95 Å²	95	54.4 Å²	54.4	66%	0.664	32%	0.323	S	S	*	.	H	α-helix	trans	-92.4	-5.1	-177.9	70.1	0	0	0	0	114.6	G784 W785	G784-S788 WeakPolarHBondContact O-CB 3.21Å; G784-S788 PolarHBondContact O-N 3.5Å; G784-S788 PolarHBondContact O-OG 2.9Å; W785-S788 PolarHBondContact O-N 3.21Å; W785-S788 PolarHBondContact O-OG 3.09Å
789	S	86.3	Confident	91.9	Very high	21 Å²	21	52.5 Å²	52.5	15%	0.147	31%	0.307	C	S	.	.			trans	-128.9	141.4	-178.4	-172.7	0	0	0	0	112.2	K730 W785 D791 I794	K730-S789 PolarHBondContact NZ-O 2.91Å; W785-S789 PolarHBondContact O-N 2.69Å; S789-D791 PolarHBondContact OG-N 2.88Å; S789-I794 WeakPolarHBondContact OG-CD1 3.37Å
790	D	83.3	Confident	91.8	Very high	99 Å²	99	54 Å²	54	53%	0.529	32%	0.324	S	S	.	.			trans	-107.9	10.6	173.9	-58.7	-42.8	0	0	0	112.3	Y717 K730	Y717-D790 VanDerWaalsContact CE2-O 3.24Å; Y717-D790 WeakPolarHBondContact CE2-O 3.19Å; Y717-D790 PolarHBondContact OH-O 3.42Å; K730-D790 IonicContact NZ-OD1 3.58Å; K730-D790 PolarHBondContact NZ-OD1 2.87Å
791	D	89.6	Confident	91.8	Very high	66 Å²	66	50.7 Å²	50.7	35%	0.353	31%	0.311	S	S	.	.			trans	-74.9	130	173.2	179.7	-94.6	0	0	0	110.7	S789 N793 I794 G795	S789-D791 PolarHBondContact OG-N 2.88Å; D791-N793 VanDerWaalsContact C-N 3.3Å; D791-N793 PolarHBondContact O-N 3.43Å; D791-N793 WeakPolarHBondContact OD1-CA 3.3Å; D791-N793 VanDerWaalsContact OD1-CB 3.27Å; D791-N793 WeakPolarHBondContact OD1-CB 3.27Å; D791-N793 PolarHBondContact OD1-N 2.95Å; D791-I794 HydrophobicContact CB-CB 4.06Å; D791-I794 HydrophobicContact CB-CD1 3.95Å; D791-I794 HydrophobicContact CB-CG1 4.03Å; D791-I794 PolarHBondContact O-N 3.35Å; D791-I794 PolarHBondContact OD1-N 2.96Å; D791-G795 PolarHBondContact O-N 3.14Å
792	L	89.6	Confident	91.9	Very high	51 Å²	51	48.5 Å²	48.5	27%	0.267	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-44.1	-178.9	-179.5	63	0	0	0	112.1	Y713 L714 Y717 G795 L796	Y713-L792 HydrophobicContact CE1-CD1 3.84Å; L714-L792 HydrophobicContact CD2-CD1 4.28Å; Y717-L792 HydrophobicContact CD1-CB 4.3Å; Y717-L792 HydrophobicContact CD1-CD1 3.87Å; Y717-L792 HydrophobicContact CD1-CD2 4.45Å; Y717-L792 HydrophobicContact CD1-CG 4.43Å; Y717-L792 HydrophobicContact CD2-CB 4.13Å; Y717-L792 HydrophobicContact CD2-CD1 3.58Å; Y717-L792 HydrophobicContact CD2-CG 4.44Å; Y717-L792 HydrophobicContact CE1-CB 3.8Å; Y717-L792 HydrophobicContact CE1-CD1 4.25Å; Y717-L792 HydrophobicContact CE1-CD2 4.44Å; Y717-L792 HydrophobicContact CE1-CG 4.38Å; Y717-L792 VanDerWaalsContact CE2-CA 3.43Å; Y717-L792 HydrophobicContact CE2-CB 3.63Å; Y717-L792 HydrophobicContact CE2-CD1 4.02Å; Y717-L792 HydrophobicContact CE2-CG 4.42Å; Y717-L792 HydrophobicContact CG-CB 4.45Å; Y717-L792 HydrophobicContact CG-CD1 3.52Å; Y717-L792 HydrophobicContact CG-CG 4.47Å; Y717-L792 VanDerWaalsContact CZ-CB 3.46Å; Y717-L792 PolarHBondContact OH-N 3.37Å; L792-G795 PolarHBondContact O-N 3.35Å; L792-L796 HydrophobicContact CD1-CD1 4.04Å; L792-L796 HydrophobicContact CD1-CG 4.17Å; L792-L796 HydrophobicContact CG-CD1 4.01Å; L792-L796 HydrophobicContact CG-CG 4.46Å; L792-L796 WeakPolarHBondContact O-CB 3.23Å; L792-L796 WeakPolarHBondContact O-CG 3.34Å; L792-L796 PolarHBondContact O-N 3.45Å
793	N	92.4	Very high	91.9	Very high	112 Å²	112	49.1 Å²	49.1	60%	0.599	29%	0.294	S	S	*	.	H	α-helix	trans	-70.7	-39.2	-175	-57.1	-61.1	0	0	0	110.4	D791 A797	D791-N793 VanDerWaalsContact C-N 3.3Å; D791-N793 PolarHBondContact O-N 3.43Å; D791-N793 WeakPolarHBondContact OD1-CA 3.3Å; D791-N793 VanDerWaalsContact OD1-CB 3.27Å; D791-N793 WeakPolarHBondContact OD1-CB 3.27Å; D791-N793 PolarHBondContact OD1-N 2.95Å; N793-A797 WeakPolarHBondContact O-CB 3.45Å; N793-A797 PolarHBondContact O-N 2.9Å
794	I	91.9	Very high	92	Very high	52 Å²	52	52.9 Å²	52.9	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-44.4	173.9	-67.7	178.4	0	0	0	110.5	W785 S789 D791 A797 N798	W785-I794 HydrophobicContact CG-CG2 4.45Å; S789-I794 WeakPolarHBondContact OG-CD1 3.37Å; D791-I794 HydrophobicContact CB-CB 4.06Å; D791-I794 HydrophobicContact CB-CD1 3.95Å; D791-I794 HydrophobicContact CB-CG1 4.03Å; D791-I794 PolarHBondContact O-N 3.35Å; D791-I794 PolarHBondContact OD1-N 2.96Å; I794-A797 PolarHBondContact O-N 3.49Å; I794-N798 WeakPolarHBondContact CG2-ND2 3.33Å; I794-N798 WeakPolarHBondContact O-CB 3.43Å; I794-N798 PolarHBondContact O-N 2.82Å; I794-N798 PolarHBondContact O-ND2 2.9Å
795	G	91.2	Very high	92.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-47.4	179.1	0	0	0	0	0	112.7	Y713 D791 L792 A797 N798 L799	Y713-G795 WeakPolarHBondContact OH-CA 3.47Å; D791-G795 PolarHBondContact O-N 3.14Å; L792-G795 PolarHBondContact O-N 3.35Å; G795-A797 PolarHBondContact O-N 2.95Å; G795-N798 PolarHBondContact O-N 2.88Å; G795-L799 WeakPolarHBondContact O-CG 3.37Å; G795-L799 PolarHBondContact O-N 3.4Å
796	L	92.7	Very high	92.3	Very high	55 Å²	55	45.3 Å²	45.3	29%	0.288	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-40	174.7	-71.4	176.8	0	0	0	112.7	Y713 L714 L792 N798 L799 G800	Y713-L796 HydrophobicContact CD1-CD2 3.61Å; Y713-L796 HydrophobicContact CD1-CG 4.23Å; Y713-L796 HydrophobicContact CE1-CD2 3.79Å; Y713-L796 HydrophobicContact CE1-CG 3.87Å; L714-L796 HydrophobicContact CD2-CD1 3.84Å; L714-L796 HydrophobicContact CD2-CD2 3.71Å; L714-L796 HydrophobicContact CD2-CG 4.27Å; L714-L796 HydrophobicContact CG-CD2 4.09Å; L792-L796 HydrophobicContact CD1-CD1 4.04Å; L792-L796 HydrophobicContact CD1-CG 4.17Å; L792-L796 HydrophobicContact CG-CD1 4.01Å; L792-L796 HydrophobicContact CG-CG 4.46Å; L792-L796 WeakPolarHBondContact O-CB 3.23Å; L792-L796 WeakPolarHBondContact O-CG 3.34Å; L792-L796 PolarHBondContact O-N 3.45Å; L796-N798 VanDerWaalsContact C-N 3.32Å; L796-N798 PolarHBondContact O-N 2.82Å; L796-L799 PolarHBondContact O-N 2.81Å; L796-G800 PolarHBondContact O-N 3.18Å
797	A	94.4	Very high	92.5	Very high	64 Å²	64	46.6 Å²	46.6	53%	0.529	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-41.1	176.5	0	0	0	0	0	111.1	N793 I794 G795 A801	N793-A797 WeakPolarHBondContact O-CB 3.45Å; N793-A797 PolarHBondContact O-N 2.9Å; I794-A797 PolarHBondContact O-N 3.49Å; G795-A797 PolarHBondContact O-N 2.95Å; A797-A801 WeakPolarHBondContact O-CB 3.25Å; A797-A801 PolarHBondContact O-N 3.24Å
798	N	94.5	Very high	92.8	Very high	15 Å²	15	46 Å²	46	8%	0.08	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-36.9	176.8	-76.8	-62.4	0	0	0	112.7	A782 Y786 I794 G795 L796 A801 T802	A782-N798 PolarHBondContact O-OD1 3.33Å; Y786-N798 HydrophobicContact CD2-CB 4.09Å; Y786-N798 HydrophobicContact CG-CB 4.39Å; I794-N798 WeakPolarHBondContact CG2-ND2 3.33Å; I794-N798 WeakPolarHBondContact O-CB 3.43Å; I794-N798 PolarHBondContact O-N 2.82Å; I794-N798 PolarHBondContact O-ND2 2.9Å; G795-N798 PolarHBondContact O-N 2.88Å; L796-N798 VanDerWaalsContact C-N 3.32Å; L796-N798 PolarHBondContact O-N 2.82Å; N798-A801 PolarHBondContact O-N 3.11Å; N798-T802 WeakPolarHBondContact O-CG2 3.39Å; N798-T802 PolarHBondContact O-N 3.45Å
799	L	93.8	Very high	93	Very high	1 Å²	1	42 Å²	42	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-41.2	172.1	-73.7	178.7	0	0	0	111.9	Y713 F734 Y786 G795 L796 T802 A803	Y713-L799 HydrophobicContact CD1-CD1 3.7Å; Y713-L799 HydrophobicContact CD2-CD1 3.86Å; Y713-L799 HydrophobicContact CE1-CD1 4.38Å; Y713-L799 HydrophobicContact CG-CD1 3.41Å; Y713-L799 VanDerWaalsContact CG-CD1 3.41Å; F734-L799 HydrophobicContact CB-CD2 4.39Å; F734-L799 HydrophobicContact CD2-CD2 4.25Å; Y786-L799 HydrophobicContact CD2-CG 4.39Å; Y786-L799 HydrophobicContact CE2-CD1 4.21Å; Y786-L799 HydrophobicContact CE2-CD2 4.16Å; Y786-L799 HydrophobicContact CE2-CG 3.88Å; G795-L799 WeakPolarHBondContact O-CG 3.37Å; G795-L799 PolarHBondContact O-N 3.4Å; L796-L799 PolarHBondContact O-N 2.81Å; L799-T802 HydrophobicContact CD2-CG2 4.41Å; L799-T802 WeakPolarHBondContact O-CG2 3.43Å; L799-A803 WeakPolarHBondContact O-CB 3.28Å; L799-A803 PolarHBondContact O-N 3.27Å
800	G	94.1	Very high	93.3	Very high	38 Å²	38	41 Å²	41	39%	0.392	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-40.3	172.3	0	0	0	0	0	112.3	L796 A803 L804	L796-G800 PolarHBondContact O-N 3.18Å; G800-A803 PolarHBondContact O-N 2.87Å; G800-L804 WeakPolarHBondContact O-CB 3.49Å; G800-L804 PolarHBondContact O-N 3.11Å
801	A	94.7	Very high	93.7	Very high	33 Å²	33	38.7 Å²	38.7	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-47	176.1	0	0	0	0	0	111.3	A797 N798 L804 L805	A797-A801 WeakPolarHBondContact O-CB 3.25Å; A797-A801 PolarHBondContact O-N 3.24Å; N798-A801 PolarHBondContact O-N 3.11Å; A801-L804 PolarHBondContact O-N 3.37Å; A801-L805 VanDerWaalsContact O-CB 3.29Å; A801-L805 WeakPolarHBondContact O-CB 3.49Å; A801-L805 WeakPolarHBondContact O-CG 3.16Å; A801-L805 PolarHBondContact O-N 2.88Å
802	T	96.1	Very high	93.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-41.8	176.4	-174.6	0	0	0	0	111.2	F734 T737 N779 N798 L799 L804 L805 S806	F734-T802 HydrophobicContact CD2-CG2 4.04Å; F734-T802 HydrophobicContact CE1-CG2 4.42Å; F734-T802 HydrophobicContact CE2-CG2 3.78Å; F734-T802 HydrophobicContact CG-CG2 4.48Å; F734-T802 VanDerWaalsContact CZ-CB 3.46Å; F734-T802 HydrophobicContact CZ-CG2 3.99Å; T737-T802 HydrophobicContact CG2-CG2 3.81Å; N779-T802 WeakPolarHBondContact OD1-CA 3.35Å; N779-T802 PolarHBondContact OD1-OG1 3.49Å; N779-T802 VanDerWaalsContact OD1-OG1 3.05Å; N798-T802 WeakPolarHBondContact O-CG2 3.39Å; N798-T802 PolarHBondContact O-N 3.45Å; L799-T802 HydrophobicContact CD2-CG2 4.41Å; L799-T802 WeakPolarHBondContact O-CG2 3.43Å; T802-L804 VanDerWaalsContact C-N 3.3Å; T802-L804 PolarHBondContact O-N 2.66Å; T802-L805 PolarHBondContact O-N 2.88Å; T802-S806 WeakPolarHBondContact O-CB 3.34Å; T802-S806 PolarHBondContact O-N 3.23Å; T802-S806 PolarHBondContact O-OG 2.93Å
803	A	95.1	Very high	93.7	Very high	22 Å²	22	35.9 Å²	35.9	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-57.4	-42.9	174.7	0	0	0	0	0	111.9	T737 L799 G800 S806 S807	T737-A803 HydrophobicContact CG2-CB 3.84Å; L799-A803 WeakPolarHBondContact O-CB 3.28Å; L799-A803 PolarHBondContact O-N 3.27Å; G800-A803 PolarHBondContact O-N 2.87Å; A803-S806 PolarHBondContact O-OG 2.94Å; A803-S807 WeakPolarHBondContact O-CB 3.42Å; A803-S807 PolarHBondContact O-N 2.78Å; A803-S807 VanDerWaalsContact O-N 3.11Å; A803-S807 PolarHBondContact O-OG 3Å
804	L	95.9	Very high	93.6	Very high	114 Å²	114	30.8 Å²	30.8	60%	0.597	20%	0.195	S	C	*	.	H	α-helix	trans	-70.6	-50.1	177.1	-179.9	63.1	0	0	0	112.5	G800 A801 T802 S807 V808	G800-L804 WeakPolarHBondContact O-CB 3.49Å; G800-L804 PolarHBondContact O-N 3.11Å; A801-L804 PolarHBondContact O-N 3.37Å; T802-L804 VanDerWaalsContact C-N 3.3Å; T802-L804 PolarHBondContact O-N 2.66Å; L804-S807 WeakPolarHBondContact O-CB 3.42Å; L804-S807 PolarHBondContact O-N 3.34Å; L804-V808 HydrophobicContact CD1-CG2 4.42Å; L804-V808 WeakPolarHBondContact O-CG2 3.34Å; L804-V808 PolarHBondContact O-N 2.83Å
805	L	96.5	Very high	93.3	Very high	40 Å²	40	30 Å²	30	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-43.4	-176.6	-69	170.6	0	0	0	111.4	L775 A778 N779 A801 T802 V808 M809	L775-L805 HydrophobicContact CD2-CD2 3.82Å; A778-L805 HydrophobicContact CB-CD1 3.88Å; A778-L805 HydrophobicContact CB-CD2 4.46Å; N779-L805 VanDerWaalsContact ND2-CB 3.34Å; N779-L805 WeakPolarHBondContact ND2-CB 3.34Å; A801-L805 VanDerWaalsContact O-CB 3.29Å; A801-L805 WeakPolarHBondContact O-CB 3.49Å; A801-L805 WeakPolarHBondContact O-CG 3.16Å; A801-L805 PolarHBondContact O-N 2.88Å; T802-L805 PolarHBondContact O-N 2.88Å; L805-V808 PolarHBondContact O-N 3.46Å; L805-M809 WeakPolarHBondContact O-CB 3.32Å; L805-M809 PolarHBondContact O-N 2.94Å
806	S	96	Very high	92.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-38.7	174.3	63.8	0	0	0	0	112.1	F738 G741 T802 A803 M809 G810	F738-S806 VanDerWaalsContact O-CB 3.23Å; F738-S806 WeakPolarHBondContact O-CB 3.19Å; F738-S806 PolarHBondContact O-OG 3.49Å; G741-S806 WeakPolarHBondContact CA-OG 3.47Å; T802-S806 WeakPolarHBondContact O-CB 3.34Å; T802-S806 PolarHBondContact O-N 3.23Å; T802-S806 PolarHBondContact O-OG 2.93Å; A803-S806 PolarHBondContact O-OG 2.94Å; S806-M809 WeakPolarHBondContact O-CB 3.42Å; S806-M809 PolarHBondContact O-N 3.48Å; S806-G810 PolarHBondContact O-N 2.69Å
807	S	95.6	Very high	92.3	Very high	26 Å²	26	27.8 Å²	27.8	18%	0.182	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-45.1	173.3	-71.5	0	0	0	0	112.2	T745 A803 L804 M809 G810 V811	T745-S807 WeakPolarHBondContact CB-O 3.39Å; T745-S807 VanDerWaalsContact CG2-CB 3.46Å; T745-S807 WeakPolarHBondContact OG1-CA 3.41Å; T745-S807 PolarHBondContact OG1-O 3.24Å; A803-S807 WeakPolarHBondContact O-CB 3.42Å; A803-S807 PolarHBondContact O-N 2.78Å; A803-S807 VanDerWaalsContact O-N 3.11Å; A803-S807 PolarHBondContact O-OG 3Å; L804-S807 WeakPolarHBondContact O-CB 3.42Å; L804-S807 PolarHBondContact O-N 3.34Å; S807-M809 VanDerWaalsContact C-N 3.28Å; S807-M809 PolarHBondContact O-N 3.13Å; S807-G810 PolarHBondContact O-N 3.38Å; S807-V811 WeakPolarHBondContact O-CG2 3.44Å; S807-V811 PolarHBondContact O-N 2.99Å; S807-V811 VanDerWaalsContact O-N 3.11Å
808	V	95.6	Very high	90.8	Very high	60 Å²	60	25.8 Å²	25.8	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-61.6	-42.1	174.1	173.4	0	0	0	0	110.2	L775 L804 L805 G810 V811 T812	L775-V808 HydrophobicContact CD1-CG1 3.95Å; L775-V808 HydrophobicContact CD2-CG1 4.22Å; L804-V808 HydrophobicContact CD1-CG2 4.42Å; L804-V808 WeakPolarHBondContact O-CG2 3.34Å; L804-V808 PolarHBondContact O-N 2.83Å; L805-V808 PolarHBondContact O-N 3.46Å; V808-G810 PolarHBondContact O-N 2.83Å; V808-V811 PolarHBondContact O-N 2.86Å; V808-T812 HydrophobicContact CG1-CG2 4.13Å; V808-T812 WeakPolarHBondContact O-CG2 3.33Å; V808-T812 PolarHBondContact O-N 3.29Å; V808-T812 PolarHBondContact O-OG1 3.43Å
809	M	93.1	Very high	88.7	Confident	12 Å²	12	26 Å²	26	6%	0.059	17%	0.17	C	C	.	.	H	α-helix	trans	-62.9	-41.3	178.1	-165.4	-179.7	69.3	0	0	112.4	F738 V742 L775 L805 S806 S807 V811 T812 M813	F738-M809 HydrophobicContact CE1-CE 4.23Å; F738-M809 HydrophobicContact CE2-CE 3.72Å; F738-M809 HydrophobicContact CZ-CE 3.34Å; F738-M809 HydrophobicContact CZ-SD 4.35Å; V742-M809 HydrophobicContact CG2-CE 3.32Å; L775-M809 HydrophobicContact CB-CB 4.49Å; L775-M809 HydrophobicContact CD1-CB 4.1Å; L775-M809 HydrophobicContact CD1-CG 4.42Å; L805-M809 WeakPolarHBondContact O-CB 3.32Å; L805-M809 PolarHBondContact O-N 2.94Å; S806-M809 WeakPolarHBondContact O-CB 3.42Å; S806-M809 PolarHBondContact O-N 3.48Å; S807-M809 VanDerWaalsContact C-N 3.28Å; S807-M809 PolarHBondContact O-N 3.13Å; M809-V811 VanDerWaalsContact C-N 3.32Å; M809-V811 PolarHBondContact O-N 3.29Å; M809-T812 WeakPolarHBondContact CA-OG1 3.25Å; M809-T812 PolarHBondContact O-N 3.38Å; M809-T812 PolarHBondContact O-OG1 3.25Å; M809-T812 VanDerWaalsContact O-OG1 3.11Å; M809-M813 HydrophobicContact CE-SD 4.36Å; M809-M813 HydrophobicContact CG-CG 4.21Å; M809-M813 HydrophobicContact CG-SD 3.66Å; M809-M813 VanDerWaalsContact O-CB 3.31Å; M809-M813 WeakPolarHBondContact O-CB 3.46Å; M809-M813 VanDerWaalsContact O-CG 3.28Å; M809-M813 WeakPolarHBondContact O-CG 3.26Å; M809-M813 PolarHBondContact O-N 2.93Å; M809-M813 HydrophobicContact SD-SD 4.19Å
810	G	92.5	Very high	86.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-40.2	174.7	0	0	0	0	0	112.4	T745 S806 S807 V808 T814	T745-G810 WeakPolarHBondContact OG1-CA 3.26Å; S806-G810 PolarHBondContact O-N 2.69Å; S807-G810 PolarHBondContact O-N 3.38Å; V808-G810 PolarHBondContact O-N 2.83Å; G810-T814 VanDerWaalsContact O-CB 3.26Å; G810-T814 WeakPolarHBondContact O-CB 3.42Å; G810-T814 PolarHBondContact O-N 3.28Å; G810-T814 VanDerWaalsContact O-N 3.17Å; G810-T814 PolarHBondContact O-OG1 3.42Å
811	V	93	Very high	83.9	Confident	51 Å²	51	38.3 Å²	38.3	31%	0.309	21%	0.213	S	C	.	.	H	α-helix	trans	-64.6	-53.7	172.6	176.4	0	0	0	0	111.5	T745 M749 S807 V808 M809 M813 T814 M815	T745-V811 HydrophobicContact CG2-CG2 4.3Å; M749-V811 HydrophobicContact CG-CB 4.35Å; M749-V811 HydrophobicContact CG-CG1 4.26Å; M749-V811 HydrophobicContact CG-CG2 4.15Å; M749-V811 HydrophobicContact SD-CG1 4.15Å; M749-V811 HydrophobicContact SD-CG2 4.4Å; S807-V811 WeakPolarHBondContact O-CG2 3.44Å; S807-V811 PolarHBondContact O-N 2.99Å; S807-V811 VanDerWaalsContact O-N 3.11Å; V808-V811 PolarHBondContact O-N 2.86Å; M809-V811 VanDerWaalsContact C-N 3.32Å; M809-V811 PolarHBondContact O-N 3.29Å; V811-M813 PolarHBondContact O-N 3.37Å; V811-T814 PolarHBondContact O-N 3.28Å; V811-M815 HydrophobicContact CG1-CG 4.01Å; V811-M815 WeakPolarHBondContact O-CB 3.36Å; V811-M815 WeakPolarHBondContact O-CG 3.21Å; V811-M815 PolarHBondContact O-N 2.91Å
812	T	90.8	Very high	81.3	Confident	19 Å²	19	42.4 Å²	42.4	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-41.2	-173.3	56.8	0	0	0	0	112	L765 L771 N772 V808 M809 A816	L765-T812 HydrophobicContact CD1-CG2 4.26Å; L771-T812 HydrophobicContact CD2-CG2 3.87Å; N772-T812 PolarHBondContact OD1-OG1 2.85Å; V808-T812 HydrophobicContact CG1-CG2 4.13Å; V808-T812 WeakPolarHBondContact O-CG2 3.33Å; V808-T812 PolarHBondContact O-N 3.29Å; V808-T812 PolarHBondContact O-OG1 3.43Å; M809-T812 WeakPolarHBondContact CA-OG1 3.25Å; M809-T812 PolarHBondContact O-N 3.38Å; M809-T812 PolarHBondContact O-OG1 3.25Å; M809-T812 VanDerWaalsContact O-OG1 3.11Å; T812-A816 WeakPolarHBondContact O-CB 3.44Å; T812-A816 PolarHBondContact O-N 3.39Å
813	M	88.4	Confident	78.4	Confident	39 Å²	39	46.4 Å²	46.4	19%	0.192	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-48.2	178	-69.2	178.6	64.6	0	0	111.2	M809 V811 M815 A816 I817 I891	M809-M813 HydrophobicContact CE-SD 4.36Å; M809-M813 HydrophobicContact CG-CG 4.21Å; M809-M813 HydrophobicContact CG-SD 3.66Å; M809-M813 VanDerWaalsContact O-CB 3.31Å; M809-M813 WeakPolarHBondContact O-CB 3.46Å; M809-M813 VanDerWaalsContact O-CG 3.28Å; M809-M813 WeakPolarHBondContact O-CG 3.26Å; M809-M813 PolarHBondContact O-N 2.93Å; M809-M813 HydrophobicContact SD-SD 4.19Å; V811-M813 PolarHBondContact O-N 3.37Å; M813-M815 PolarHBondContact O-N 3.13Å; M813-A816 PolarHBondContact O-N 3.15Å; M813-I817 WeakPolarHBondContact O-CG1 3.36Å; M813-I891 HydrophobicContact CE-CG2 3.31Å
814	T	89.2	Confident	75.6	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-71	-35.6	-176.4	-52.9	0	0	0	0	112.5	G746 M749 A750 G810 V811 A816 I817 M834 V837	G746-T814 VanDerWaalsContact CA-OG1 3.28Å; G746-T814 WeakPolarHBondContact CA-OG1 3.2Å; M749-T814 HydrophobicContact CB-CG2 3.64Å; A750-T814 HydrophobicContact CB-CG2 4.35Å; G810-T814 VanDerWaalsContact O-CB 3.26Å; G810-T814 WeakPolarHBondContact O-CB 3.42Å; G810-T814 PolarHBondContact O-N 3.28Å; G810-T814 VanDerWaalsContact O-N 3.17Å; G810-T814 PolarHBondContact O-OG1 3.42Å; V811-T814 PolarHBondContact O-N 3.28Å; T814-A816 VanDerWaalsContact C-N 3.27Å; T814-A816 PolarHBondContact O-N 2.95Å; T814-I817 PolarHBondContact O-N 3.35Å; T814-I817 VanDerWaalsContact O-N 3.16Å; T814-M834 HydrophobicContact CG2-SD 4.32Å; T814-V837 HydrophobicContact CG2-CG1 4Å
815	M	87	Confident	72.6	Confident	34 Å²	34	50.4 Å²	50.4	17%	0.167	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-29.5	177.6	-73.9	-61.6	-69.5	0	0	112.9	M749 K753 L758 V763 V811 M813 I817	M749-M815 HydrophobicContact CB-SD 4.4Å; M749-M815 HydrophobicContact CG-CG 4.16Å; M749-M815 HydrophobicContact CG-SD 4.32Å; M749-M815 HydrophobicContact SD-CG 4.11Å; M749-M815 HydrophobicContact SD-SD 3.9Å; K753-M815 VanDerWaalsContact CE-SD 3.57Å; K753-M815 PolarHBondContact NZ-O 3.02Å; L758-M815 HydrophobicContact CD1-SD 4.08Å; V763-M815 HydrophobicContact CB-CE 4.18Å; V763-M815 HydrophobicContact CG2-CE 3.69Å; V763-M815 PolarHBondContact N-O 2.67Å; V811-M815 HydrophobicContact CG1-CG 4.01Å; V811-M815 WeakPolarHBondContact O-CB 3.36Å; V811-M815 WeakPolarHBondContact O-CG 3.21Å; V811-M815 PolarHBondContact O-N 2.91Å; M813-M815 PolarHBondContact O-N 3.13Å; M815-I817 PolarHBondContact O-N 2.88Å
816	A	83.2	Confident	69.3	Low	6 Å²	6	54.1 Å²	54.1	5%	0.05	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.3	175.5	0	0	0	0	0	113.7	A762 L764 T812 M813 T814	A762-A816 VanDerWaalsContact CB-O 3.28Å; A762-A816 WeakPolarHBondContact CB-O 3.41Å; L764-A816 HydrophobicContact CD2-CB 4.34Å; T812-A816 WeakPolarHBondContact O-CB 3.44Å; T812-A816 PolarHBondContact O-N 3.39Å; M813-A816 PolarHBondContact O-N 3.15Å; T814-A816 VanDerWaalsContact C-N 3.27Å; T814-A816 PolarHBondContact O-N 2.95Å
817	I	78.5	Confident	66.2	Low	5 Å²	5	61.3 Å²	61.3	3%	0.026	35%	0.345	C	S	.	.			trans	-88.8	126.1	179.9	-60.1	169.6	0	0	0	109.7	K753 M813 T814 M815 D833 V837	K753-I817 PolarHBondContact NZ-O 3.39Å; M813-I817 WeakPolarHBondContact O-CG1 3.36Å; T814-I817 PolarHBondContact O-N 3.35Å; T814-I817 VanDerWaalsContact O-N 3.16Å; M815-I817 PolarHBondContact O-N 2.88Å; I817-D833 HydrophobicContact CG2-CB 3.87Å; I817-V837 HydrophobicContact CB-CG2 4.19Å; I817-V837 HydrophobicContact CD1-CG2 3.36Å; I817-V837 HydrophobicContact CG1-CG2 4.33Å; I817-V837 HydrophobicContact CG2-CG2 3.73Å
818	G	62.9	Low	63.2	Low	21 Å²	21	64.3 Å²	64.3	22%	0.216	36%	0.362	C	S	.	.	S	Bend	trans	144.8	167.6	-176.1	0	0	0	0	0	112.6	A762	A762-G818 WeakPolarHBondContact CB-O 2.96Å
819	G	49.9	Very low	60.6	Low	20 Å²	20	64.2 Å²	64.2	21%	0.206	36%	0.355	C	S	.	.			trans	-68.4	146.9	176.1	0	0	0	0	0	112.4	A762 F821	A762-G819 PolarHBondContact N-O 3.34Å; A762-G819 VanDerWaalsContact N-O 3.1Å; G819-F821 PolarHBondContact O-N 3.2Å
820	K	48.2	Very low	58.1	Low	150 Å²	150	65.5 Å²	65.5	65%	0.652	36%	0.362	S	S	*	.			trans	-56.8	136.8	173.9	-91.4	-176.2	177.5	176.8	0	110.7	L764 N822	L764-K820 HydrophobicContact CD1-CG 4.41Å; K820-N822 PolarHBondContact O-N 2.95Å
821	F	39.3	Very low	56.2	Low	148 Å²	148	71.2 Å²	71.2	65%	0.649	38%	0.383	S	S	*	.			trans	-65	105.2	168.8	-163.3	-90.6	0	0	0	108.9	A761 G819	A761-F821 HydrophobicContact CB-CB 4.42Å; A761-F821 HydrophobicContact CB-CD2 3.98Å; G819-F821 PolarHBondContact O-N 3.2Å
822	N	40.3	Very low	54.6	Low	119 Å²	119	70.8 Å²	70.8	64%	0.636	39%	0.385	S	S	*	.			trans	-114.7	121.8	165.6	-125.3	-7.7	0	0	0	106.9	K820 Q824 R829	K820-N822 PolarHBondContact O-N 2.95Å; N822-Q824 PolarHBondContact O-N 3.11Å; N822-R829 PolarHBondContact O-NH1 3.39Å
823	A	35.6	Very low	53.8	Low	83 Å²	83	70.2 Å²	70.2	69%	0.686	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-9	-167.3	0	0	0	0	0	115.4
824	Q	35.1	Very low	53.5	Low	180 Å²	180	68.7 Å²	68.7	84%	0.841	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-2.2	-167.1	-133.3	84.1	10	0	0	117.8	N822	N822-Q824 PolarHBondContact O-N 3.11Å
825	A	33.9	Very low	53	Low	41 Å²	41	70.5 Å²	70.5	34%	0.339	39%	0.385	S	S	.	.			trans	-138	124.2	171.5	0	0	0	0	0	113.8	R829	A825-R829 VanDerWaalsContact N-NH1 3.13Å; A825-R829 VanDerWaalsContact O-CD 3.23Å; A825-R829 WeakPolarHBondContact O-CD 3.25Å; A825-R829 VanDerWaalsContact O-CZ 3.32Å; A825-R829 PolarHBondContact O-NE 2.88Å; A825-R829 PolarHBondContact O-NH1 2.84Å
826	T	27.8	Very low	52.9	Low	118 Å²	118	68.9 Å²	68.9	72%	0.724	38%	0.378	S	S	*	.			trans	-101.1	140.1	-167.3	-44.4	0	0	0	0	109.3
827	L	31	Very low	53.1	Low	151 Å²	151	69 Å²	69	79%	0.791	38%	0.378	S	S	*	.	S	Bend	trans	87.5	-8.6	154.1	-92.6	147.5	0	0	0	122.9
828	V	32.6	Very low	53.6	Low	89 Å²	89	69 Å²	69	54%	0.539	38%	0.378	S	S	.	.	S	Bend	trans	-145	66	169.2	-173.6	0	0	0	0	111.2
829	R	39.5	Very low	54.8	Low	57 Å²	57	68.1 Å²	68.1	22%	0.215	37%	0.368	C	S	.	.			trans	-118.9	-6.3	-168	-95.1	-171	170	174.3	-10.8	118.1	N822 A825	N822-R829 PolarHBondContact O-NH1 3.39Å; A825-R829 VanDerWaalsContact N-NH1 3.13Å; A825-R829 VanDerWaalsContact O-CD 3.23Å; A825-R829 WeakPolarHBondContact O-CD 3.25Å; A825-R829 VanDerWaalsContact O-CZ 3.32Å; A825-R829 PolarHBondContact O-NE 2.88Å; A825-R829 PolarHBondContact O-NH1 2.84Å
830	L	42.3	Very low	56.8	Low	40 Å²	40	67.8 Å²	67.8	21%	0.209	36%	0.362	C	S	.	.	S	Bend	trans	-143.8	21.9	-143.3	-63.3	165.8	0	0	0	117.1	S760 A761	S760-L830 WeakPolarHBondContact O-CD2 3.45Å; S760-L830 WeakPolarHBondContact OG-CB 3.2Å; S760-L830 WeakPolarHBondContact OG-CD1 3.48Å; S760-L830 WeakPolarHBondContact OG-CG 3.22Å; A761-L830 VanDerWaalsContact CA-CD2 3.45Å; A761-L830 HydrophobicContact CB-CD1 4.42Å; A761-L830 HydrophobicContact CB-CD2 4.14Å
831	R	52.4	Low	58.9	Low	120 Å²	120	60.9 Å²	60.9	45%	0.453	33%	0.332	S	S	.	.			trans	-114.9	-9.2	-178.8	-62.1	-175.3	-163.4	-167.2	-3	116.3	L754 D833 M834 P835 Y936	L754-R831 HydrophobicContact CD2-CG 4.38Å; R831-D833 PolarHBondContact O-N 2.87Å; R831-M834 PolarHBondContact O-N 3Å; R831-P835 WeakPolarHBondContact O-CD 3.44Å; R831-Y936 PolarHBondContact NH1-OH 3.49Å
832	A	58.6	Low	61.4	Low	41 Å²	41	53.9 Å²	53.9	34%	0.339	30%	0.301	S	S	.	.	S	Bend	trans	-71.2	-38	-161.5	0	0	0	0	0	115.1	P835 Y1046	A832-P835 WeakPolarHBondContact O-CD 3.48Å; A832-Y1046 HydrophobicContact CB-CD1 3.66Å; A832-Y1046 HydrophobicContact CB-CD2 3.6Å; A832-Y1046 HydrophobicContact CB-CE1 3.67Å; A832-Y1046 HydrophobicContact CB-CE2 3.62Å; A832-Y1046 HydrophobicContact CB-CG 3.6Å
833	D	74.4	Confident	64	Low	7 Å²	7	48.5 Å²	48.5	4%	0.037	27%	0.273	C	S	.	.	S	Bend	trans	-86.7	-16.9	-179.2	-66.6	2.7	0	0	0	113.3	I817 R831 V836 M883 R885 V890 Y1046	I817-D833 HydrophobicContact CG2-CB 3.87Å; R831-D833 PolarHBondContact O-N 2.87Å; D833-V836 WeakPolarHBondContact O-CB 3.34Å; D833-V836 PolarHBondContact O-N 2.99Å; D833-M883 WeakPolarHBondContact OD1-CE 3.24Å; D833-R885 IonicContact OD1-NH1 2.83Å; D833-R885 PolarHBondContact OD1-NH1 2.67Å; D833-R885 IonicContact OD2-CZ 2.66Å; D833-R885 IonicContact OD2-NH1 3.85Å; D833-R885 PolarHBondContact OD2-NH1 2.99Å; D833-R885 IonicContact OD2-NH2 2.92Å; D833-R885 PolarHBondContact OD2-NH2 2.95Å; D833-V890 HydrophobicContact CB-CG1 4.14Å; D833-Y1046 PolarHBondContact OD1-OH 3.08Å; D833-Y1046 PolarHBondContact OD2-OH 3.39Å
834	M	81.2	Confident	66.8	Low	7 Å²	7	48.3 Å²	48.3	3%	0.034	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-36.7	-174.6	-164.7	57.8	60.2	0	0	113.6	A750 K753 L754 T814 R831 V836 V837 I838	A750-M834 HydrophobicContact CB-CG 4.27Å; A750-M834 HydrophobicContact CB-SD 3.61Å; K753-M834 HydrophobicContact CB-CE 4.05Å; K753-M834 HydrophobicContact CD-CE 3.42Å; K753-M834 VanDerWaalsContact CD-CE 3.42Å; K753-M834 HydrophobicContact CG-CE 4.35Å; L754-M834 HydrophobicContact CD1-CG 4.03Å; L754-M834 HydrophobicContact CD2-CB 4.11Å; L754-M834 HydrophobicContact CD2-CG 3.97Å; L754-M834 HydrophobicContact CG-CG 3.82Å; T814-M834 HydrophobicContact CG2-SD 4.32Å; R831-M834 PolarHBondContact O-N 3Å; M834-V836 PolarHBondContact O-N 3.31Å; M834-V837 WeakPolarHBondContact O-CA 3.26Å; M834-V837 WeakPolarHBondContact O-CB 3.34Å; M834-V837 PolarHBondContact O-N 3.44Å; M834-V837 HydrophobicContact SD-CB 4Å; M834-V837 HydrophobicContact SD-CG1 4.43Å; M834-V837 HydrophobicContact SD-CG2 4.06Å; M834-I838 PolarHBondContact O-N 2.86Å
835	P	80.4	Confident	69.5	Low	43 Å²	43	39.8 Å²	39.8	28%	0.279	22%	0.215	S	C	.	.	H	α-helix	trans	-54.5	-35.2	170.7	-32.4	39.5	0	0	0	114.7	R831 A832 V837 I838 T839 M879	R831-P835 WeakPolarHBondContact O-CD 3.44Å; A832-P835 WeakPolarHBondContact O-CD 3.48Å; P835-V837 VanDerWaalsContact C-N 3.3Å; P835-V837 PolarHBondContact O-N 3.06Å; P835-I838 WeakPolarHBondContact O-CB 3.35Å; P835-I838 PolarHBondContact O-N 3.04Å; P835-T839 PolarHBondContact O-N 2.7Å; P835-T839 PolarHBondContact O-OG1 3.13Å; P835-M879 HydrophobicContact CB-CE 3.33Å; P835-M879 HydrophobicContact CB-SD 4.31Å; P835-M879 HydrophobicContact CG-CE 4.42Å
836	V	84.4	Confident	72.4	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-38	175	-179.5	0	0	0	0	110.6	D833 M834 I838 T839 V840 M879 L887 V890	D833-V836 WeakPolarHBondContact O-CB 3.34Å; D833-V836 PolarHBondContact O-N 2.99Å; M834-V836 PolarHBondContact O-N 3.31Å; V836-I838 VanDerWaalsContact C-N 3.33Å; V836-T839 WeakPolarHBondContact CA-OG1 3.4Å; V836-T839 PolarHBondContact O-N 3.42Å; V836-T839 PolarHBondContact O-OG1 3.01Å; V836-V840 HydrophobicContact CG1-CG2 4.38Å; V836-V840 VanDerWaalsContact O-CG2 3.22Å; V836-V840 WeakPolarHBondContact O-CG2 3.1Å; V836-V840 PolarHBondContact O-N 3.18Å; V836-M879 HydrophobicContact CG2-CB 3.92Å; V836-M879 HydrophobicContact CG2-CE 4.35Å; V836-L887 HydrophobicContact CG1-CD1 3.9Å; V836-V890 HydrophobicContact CB-CG1 4.07Å; V836-V890 HydrophobicContact CG1-CG1 3.98Å; V836-V890 HydrophobicContact CG2-CG1 4.46Å
837	V	87.6	Confident	75.6	Confident	8 Å²	8	35.9 Å²	35.9	5%	0.048	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-42.8	175.4	-172.6	0	0	0	0	110.5	T814 I817 M834 P835 T839 V840 L841	T814-V837 HydrophobicContact CG2-CG1 4Å; I817-V837 HydrophobicContact CB-CG2 4.19Å; I817-V837 HydrophobicContact CD1-CG2 3.36Å; I817-V837 HydrophobicContact CG1-CG2 4.33Å; I817-V837 HydrophobicContact CG2-CG2 3.73Å; M834-V837 WeakPolarHBondContact O-CA 3.26Å; M834-V837 WeakPolarHBondContact O-CB 3.34Å; M834-V837 PolarHBondContact O-N 3.44Å; M834-V837 HydrophobicContact SD-CB 4Å; M834-V837 HydrophobicContact SD-CG1 4.43Å; M834-V837 HydrophobicContact SD-CG2 4.06Å; P835-V837 VanDerWaalsContact C-N 3.3Å; P835-V837 PolarHBondContact O-N 3.06Å; V837-T839 VanDerWaalsContact C-N 3.32Å; V837-T839 PolarHBondContact O-N 3.25Å; V837-V840 PolarHBondContact O-N 2.81Å; V837-L841 HydrophobicContact CG1-CD1 3.68Å; V837-L841 HydrophobicContact CG1-CG 4.17Å; V837-L841 WeakPolarHBondContact O-CB 3.39Å; V837-L841 WeakPolarHBondContact O-CG 3.45Å; V837-L841 PolarHBondContact O-N 3.43Å
838	I	87.7	Confident	78.6	Confident	6 Å²	6	28.7 Å²	28.7	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-43.6	177.3	-64	165.8	0	0	0	110.9	P691 V694 A695 L754 M834 P835 V836 L841 N842	P691-I838 HydrophobicContact CB-CD1 4.4Å; V694-I838 HydrophobicContact CG1-CG2 3.99Å; A695-I838 HydrophobicContact CB-CD1 4.39Å; A695-I838 HydrophobicContact CB-CG1 4.17Å; L754-I838 HydrophobicContact CD1-CD1 3.51Å; L754-I838 HydrophobicContact CD1-CG1 4.49Å; M834-I838 PolarHBondContact O-N 2.86Å; P835-I838 WeakPolarHBondContact O-CB 3.35Å; P835-I838 PolarHBondContact O-N 3.04Å; V836-I838 VanDerWaalsContact C-N 3.33Å; I838-L841 PolarHBondContact O-N 3.4Å; I838-N842 WeakPolarHBondContact O-CB 3.31Å; I838-N842 PolarHBondContact O-N 3.38Å
839	T	89.7	Confident	81.5	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-70.6	-34.6	179.7	55.6	0	0	0	0	112.6	M518 P835 V836 V837 N842 S843 G872 L875 S876 M879	M518-T839 HydrophobicContact SD-CG2 3.66Å; P835-T839 PolarHBondContact O-N 2.7Å; P835-T839 PolarHBondContact O-OG1 3.13Å; V836-T839 WeakPolarHBondContact CA-OG1 3.4Å; V836-T839 PolarHBondContact O-N 3.42Å; V836-T839 PolarHBondContact O-OG1 3.01Å; V837-T839 VanDerWaalsContact C-N 3.32Å; V837-T839 PolarHBondContact O-N 3.25Å; T839-N842 WeakPolarHBondContact O-CB 3.28Å; T839-N842 PolarHBondContact O-N 2.88Å; T839-S843 PolarHBondContact O-N 3.23Å; T839-G872 CarbonylContact O-C 3.54Å; T839-G872 VanDerWaalsContact O-CA 3.25Å; T839-G872 WeakPolarHBondContact O-CA 3.44Å; T839-L875 HydrophobicContact CG2-CB 3.75Å; T839-L875 HydrophobicContact CG2-CD1 4.4Å; T839-S876 VanDerWaalsContact C-OG 3.23Å; T839-S876 VanDerWaalsContact CB-OG 3.24Å; T839-S876 WeakPolarHBondContact CB-OG 3.44Å; T839-S876 WeakPolarHBondContact OG1-CA 3.36Å; T839-S876 PolarHBondContact OG1-OG 3.02Å; T839-M879 HydrophobicContact CG2-SD 3.96Å
840	V	91.9	Very high	84.2	Confident	13 Å²	13	22 Å²	22	8%	0.079	11%	0.107	C	C	.	.	H	α-helix	trans	-65.9	-45.7	173.8	171.4	0	0	0	0	110.5	V836 V837 N842 S843 Y844 S876 L887 I891	V836-V840 HydrophobicContact CG1-CG2 4.38Å; V836-V840 VanDerWaalsContact O-CG2 3.22Å; V836-V840 WeakPolarHBondContact O-CG2 3.1Å; V836-V840 PolarHBondContact O-N 3.18Å; V837-V840 PolarHBondContact O-N 2.81Å; V840-N842 VanDerWaalsContact C-N 3.3Å; V840-N842 PolarHBondContact O-N 3.42Å; V840-S843 WeakPolarHBondContact O-CA 3.45Å; V840-S843 VanDerWaalsContact O-CB 3.22Å; V840-S843 WeakPolarHBondContact O-CB 3.31Å; V840-S843 PolarHBondContact O-N 2.77Å; V840-S843 VanDerWaalsContact O-N 3.13Å; V840-Y844 HydrophobicContact CG1-CD1 4.45Å; V840-Y844 HydrophobicContact CG1-CE1 3.98Å; V840-Y844 HydrophobicContact CG1-CE2 4.06Å; V840-Y844 WeakPolarHBondContact O-CD1 3.45Å; V840-Y844 PolarHBondContact O-N 2.85Å; V840-S876 WeakPolarHBondContact CG2-OG 3.36Å; V840-S876 PolarHBondContact N-OG 2.85Å; V840-S876 VanDerWaalsContact N-OG 3.17Å; V840-L887 HydrophobicContact CG2-CD1 3.71Å; V840-I891 HydrophobicContact CG1-CD1 4.2Å; V840-I891 HydrophobicContact CG2-CD1 4.13Å
841	L	92.2	Very high	86.6	Confident	6 Å²	6	20.5 Å²	20.5	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-68.6	-31.2	177.9	-63.7	170.1	0	0	0	111.8	G746 V837 I838 S843 Y844 S845	G746-L841 VanDerWaalsContact C-CD1 3.42Å; V837-L841 HydrophobicContact CG1-CD1 3.68Å; V837-L841 HydrophobicContact CG1-CG 4.17Å; V837-L841 WeakPolarHBondContact O-CB 3.39Å; V837-L841 WeakPolarHBondContact O-CG 3.45Å; V837-L841 PolarHBondContact O-N 3.43Å; I838-L841 PolarHBondContact O-N 3.4Å; L841-S843 VanDerWaalsContact C-N 3.35Å; L841-Y844 HydrophobicContact CD2-CD2 4.16Å; L841-Y844 PolarHBondContact O-N 3.21Å; L841-S845 PolarHBondContact O-N 3.07Å
842	N	91.4	Very high	88.5	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.1	-46.6	168.6	-168.3	13.8	0	0	0	110.6	T521 H698 I838 T839 V840 Y844 S845 G846	T521-N842 PolarHBondContact OG1-ND2 2.97Å; H698-N842 VanDerWaalsContact CE1-CB 3.45Å; H698-N842 WeakPolarHBondContact CE1-CB 3.46Å; H698-N842 PolarHBondContact NE2-OD1 3.21Å; I838-N842 WeakPolarHBondContact O-CB 3.31Å; I838-N842 PolarHBondContact O-N 3.38Å; T839-N842 WeakPolarHBondContact O-CB 3.28Å; T839-N842 PolarHBondContact O-N 2.88Å; V840-N842 VanDerWaalsContact C-N 3.3Å; V840-N842 PolarHBondContact O-N 3.42Å; N842-Y844 VanDerWaalsContact C-N 3.31Å; N842-Y844 PolarHBondContact O-N 2.83Å; N842-S845 WeakPolarHBondContact O-CB 3.28Å; N842-S845 PolarHBondContact O-N 3.38Å; N842-S845 VanDerWaalsContact O-N 3.15Å; N842-S845 PolarHBondContact O-OG 2.67Å; N842-G846 PolarHBondContact O-N 3.18Å
843	S	94.2	Very high	90.2	Very high	7 Å²	7	12.8 Å²	12.8	5%	0.049	6%	0.062	C	C	.	.	H	α-helix	trans	-57	-46	175.2	-169.5	0	0	0	0	111.2	T839 V840 L841 S845 G846 W847 G869	T839-S843 PolarHBondContact O-N 3.23Å; V840-S843 WeakPolarHBondContact O-CA 3.45Å; V840-S843 VanDerWaalsContact O-CB 3.22Å; V840-S843 WeakPolarHBondContact O-CB 3.31Å; V840-S843 PolarHBondContact O-N 2.77Å; V840-S843 VanDerWaalsContact O-N 3.13Å; L841-S843 VanDerWaalsContact C-N 3.35Å; S843-S845 VanDerWaalsContact C-N 3.31Å; S843-S845 PolarHBondContact O-N 3.45Å; S843-G846 WeakPolarHBondContact O-CA 3.47Å; S843-G846 PolarHBondContact O-N 2.94Å; S843-W847 PolarHBondContact O-N 3.18Å; S843-W847 PolarHBondContact O-NE1 2.84Å; S843-W847 PolarHBondContact OG-NE1 3Å; S843-G869 WeakPolarHBondContact CB-O 3.18Å; S843-G869 WeakPolarHBondContact O-CA 3.39Å; S843-G869 PolarHBondContact OG-O 3.48Å
844	Y	94.4	Very high	91	Very high	79 Å²	79	14.4 Å²	14.4	31%	0.31	7%	0.069	S	C	.	.	H	α-helix	trans	-62.1	-37.5	177.8	-69.3	0.4	0	0	0	112.6	I739 V742 T743 V840 L841 N842 G846 W847 A848	I739-Y844 WeakPolarHBondContact CG2-O 3.19Å; V742-Y844 HydrophobicContact CG1-CD2 4.07Å; V742-Y844 HydrophobicContact CG1-CE2 4.01Å; T743-Y844 VanDerWaalsContact OG1-CB 3.26Å; T743-Y844 WeakPolarHBondContact OG1-CB 3.49Å; V840-Y844 HydrophobicContact CG1-CD1 4.45Å; V840-Y844 HydrophobicContact CG1-CE1 3.98Å; V840-Y844 HydrophobicContact CG1-CE2 4.06Å; V840-Y844 WeakPolarHBondContact O-CD1 3.45Å; V840-Y844 PolarHBondContact O-N 2.85Å; L841-Y844 HydrophobicContact CD2-CD2 4.16Å; L841-Y844 PolarHBondContact O-N 3.21Å; N842-Y844 VanDerWaalsContact C-N 3.31Å; N842-Y844 PolarHBondContact O-N 2.83Å; Y844-G846 VanDerWaalsContact C-N 3.25Å; Y844-G846 PolarHBondContact O-N 3.01Å; Y844-W847 PolarHBondContact O-N 3.34Å; Y844-A848 WeakPolarHBondContact O-CB 3.31Å; Y844-A848 PolarHBondContact O-N 3.49Å
845	S	92.7	Very high	91.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.3	-35.6	173.6	85.2	0	0	0	0	112.7	L841 N842 S843 L849	L841-S845 PolarHBondContact O-N 3.07Å; N842-S845 WeakPolarHBondContact O-CB 3.28Å; N842-S845 PolarHBondContact O-N 3.38Å; N842-S845 VanDerWaalsContact O-N 3.15Å; N842-S845 PolarHBondContact O-OG 2.67Å; S843-S845 VanDerWaalsContact C-N 3.31Å; S843-S845 PolarHBondContact O-N 3.45Å; S845-L849 PolarHBondContact O-N 3.03Å
846	G	93.8	Very high	91.8	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-69.6	-42.3	173	0	0	0	0	0	113.2	N842 S843 Y844 A848 L849 C850 G865	N842-G846 PolarHBondContact O-N 3.18Å; S843-G846 WeakPolarHBondContact O-CA 3.47Å; S843-G846 PolarHBondContact O-N 2.94Å; Y844-G846 VanDerWaalsContact C-N 3.25Å; Y844-G846 PolarHBondContact O-N 3.01Å; G846-A848 VanDerWaalsContact C-N 3.32Å; G846-A848 PolarHBondContact O-N 3.13Å; G846-L849 WeakPolarHBondContact O-CB 3.45Å; G846-L849 PolarHBondContact O-N 3.39Å; G846-C850 PolarHBondContact O-N 2.94Å; G846-G865 CarbonylContact C-O 3.33Å; G846-G865 WeakPolarHBondContact CA-O 3.44Å; G846-G865 CarbonylContact O-C 3.57Å; G846-G865 WeakPolarHBondContact O-CA 3.26Å
847	W	95.3	Very high	92	Very high	77 Å²	77	18.4 Å²	18.4	29%	0.292	9%	0.088	S	C	.	.	H	α-helix	trans	-69.1	-29.7	177.2	-54.1	126.2	0	0	0	113	F495 I739 S843 Y844 C850 A851	F495-W847 HydrophobicContact CE2-CE3 4.22Å; F495-W847 AromaticContact CE2-CZ3 3.8Å; F495-W847 HydrophobicContact CE2-CZ3 3.8Å; F495-W847 HydrophobicContact CZ-CE3 4.47Å; F495-W847 AromaticContact CZ-CZ3 3.97Å; F495-W847 HydrophobicContact CZ-CZ3 3.97Å; I739-W847 HydrophobicContact CD1-CB 4.19Å; S843-W847 PolarHBondContact O-N 3.18Å; S843-W847 PolarHBondContact O-NE1 2.84Å; S843-W847 PolarHBondContact OG-NE1 3Å; Y844-W847 PolarHBondContact O-N 3.34Å; W847-C850 PolarHBondContact O-N 3.47Å; W847-A851 PolarHBondContact O-N 2.97Å
848	A	94.2	Very high	92.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.1	-42.2	169.9	0	0	0	0	0	111.4	A705 I739 Y844 G846 C850 A851 E852	A705-A848 HydrophobicContact CB-CB 3.92Å; I739-A848 HydrophobicContact CB-CB 4.39Å; I739-A848 HydrophobicContact CG2-CB 3.91Å; Y844-A848 WeakPolarHBondContact O-CB 3.31Å; Y844-A848 PolarHBondContact O-N 3.49Å; G846-A848 VanDerWaalsContact C-N 3.32Å; G846-A848 PolarHBondContact O-N 3.13Å; A848-C850 PolarHBondContact O-N 3.45Å; A848-A851 WeakPolarHBondContact O-CB 3.45Å; A848-A851 PolarHBondContact O-N 3.5Å; A848-A851 VanDerWaalsContact O-N 3.14Å; A848-E852 PolarHBondContact O-N 3.09Å
849	L	94.2	Very high	92.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-38.7	172.6	-86.7	165.3	0	0	0	113	T528 S845 G846 A851 E852 G853 L861 V864 I868	T528-L849 HydrophobicContact CG2-CD1 4.41Å; T528-L849 HydrophobicContact CG2-CD2 3.38Å; T528-L849 HydrophobicContact CG2-CG 3.75Å; S845-L849 PolarHBondContact O-N 3.03Å; G846-L849 WeakPolarHBondContact O-CB 3.45Å; G846-L849 PolarHBondContact O-N 3.39Å; L849-A851 VanDerWaalsContact C-N 3.33Å; L849-E852 PolarHBondContact O-N 3.3Å; L849-G853 PolarHBondContact O-N 2.93Å; L849-L861 HydrophobicContact CD2-CD2 4.13Å; L849-V864 HydrophobicContact CD1-CG1 4.47Å; L849-I868 HydrophobicContact CD1-CD1 3.81Å
850	C	94.9	Very high	92.6	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.034	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-42.1	171.5	-66.8	0	0	0	0	111.7	F495 G846 W847 A848 E852 G853 F854 A866	F495-C850 HydrophobicContact CD2-CB 4.49Å; F495-C850 HydrophobicContact CE2-CB 4.26Å; G846-C850 PolarHBondContact O-N 2.94Å; W847-C850 PolarHBondContact O-N 3.47Å; A848-C850 PolarHBondContact O-N 3.45Å; C850-E852 VanDerWaalsContact C-N 3.33Å; C850-E852 PolarHBondContact O-N 3.49Å; C850-G853 PolarHBondContact O-N 3.46Å; C850-G853 VanDerWaalsContact O-N 3.13Å; C850-F854 WeakPolarHBondContact O-CD2 3.12Å; C850-F854 PolarHBondContact O-N 2.87Å; C850-A866 PolarHBondContact SG-N 2.92Å
851	A	93.3	Very high	92.7	Very high	9 Å²	9	20.7 Å²	20.7	7%	0.074	10%	0.099	C	C	.	.	H	α-helix	trans	-61.9	-40.7	176.7	0	0	0	0	0	111.6	W847 A848 L849 M855	W847-A851 PolarHBondContact O-N 2.97Å; A848-A851 WeakPolarHBondContact O-CB 3.45Å; A848-A851 PolarHBondContact O-N 3.5Å; A848-A851 VanDerWaalsContact O-N 3.14Å; L849-A851 VanDerWaalsContact C-N 3.33Å; A851-M855 WeakPolarHBondContact O-CB 3.26Å; A851-M855 PolarHBondContact O-N 3.46Å
852	E	93.1	Very high	92.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.6	-41.5	170.6	-73.8	-178.7	-145.6	0	0	112.3	T528 A705 T708 A848 L849 C850 M855 M856 L861	T528-E852 WeakPolarHBondContact CG2-OE1 3.48Å; A705-E852 WeakPolarHBondContact CA-OE1 3.31Å; A705-E852 WeakPolarHBondContact CB-OE1 3.25Å; T708-E852 HydrophobicContact CG2-CG 4.39Å; A848-E852 PolarHBondContact O-N 3.09Å; L849-E852 PolarHBondContact O-N 3.3Å; C850-E852 VanDerWaalsContact C-N 3.33Å; C850-E852 PolarHBondContact O-N 3.49Å; E852-M855 HydrophobicContact CG-CE 4.47Å; E852-M855 PolarHBondContact O-N 3.48Å; E852-M856 WeakPolarHBondContact O-CB 3.46Å; E852-M856 WeakPolarHBondContact O-CG 3.22Å; E852-M856 PolarHBondContact O-N 3.42Å; E852-L861 HydrophobicContact CB-CD1 4.08Å
853	G	92.8	Very high	93.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-46.2	177.5	0	0	0	0	0	113.5	L849 C850 M855 M856 D857 N858 T862	L849-G853 PolarHBondContact O-N 2.93Å; C850-G853 PolarHBondContact O-N 3.46Å; C850-G853 VanDerWaalsContact O-N 3.13Å; G853-M855 VanDerWaalsContact C-N 3.3Å; G853-M855 PolarHBondContact O-N 3.4Å; G853-M856 PolarHBondContact O-N 3.43Å; G853-D857 WeakPolarHBondContact O-CA 3.49Å; G853-D857 PolarHBondContact O-N 3.36Å; G853-N858 PolarHBondContact O-N 3.28Å; G853-T862 WeakPolarHBondContact CA-OG1 3.47Å
854	F	92	Very high	93.2	Very high	40 Å²	40	21.1 Å²	21.1	18%	0.175	10%	0.102	C	C	.	.	H	α-helix	trans	-62.8	-38.2	173.1	-82.4	-71.2	0	0	0	112.2	F488 M491 F495 A732 C850	F488-F854 HydrophobicContact CD2-CD1 4.14Å; F488-F854 HydrophobicContact CD2-CE1 4.27Å; F488-F854 HydrophobicContact CE2-CD1 4.03Å; F488-F854 HydrophobicContact CE2-CE1 4.02Å; M491-F854 HydrophobicContact CB-CD1 4.07Å; M491-F854 HydrophobicContact CB-CE1 3.81Å; M491-F854 HydrophobicContact CG-CD1 3.46Å; M491-F854 VanDerWaalsContact CG-CD1 3.46Å; M491-F854 HydrophobicContact CG-CE1 3.41Å; M491-F854 VanDerWaalsContact CG-CE1 3.41Å; M491-F854 HydrophobicContact CG-CG 4.19Å; M491-F854 HydrophobicContact CG-CZ 4.09Å; F495-F854 HydrophobicContact CB-CE2 4.33Å; F495-F854 HydrophobicContact CB-CZ 3.92Å; F495-F854 HydrophobicContact CD1-CZ 4.44Å; F495-F854 HydrophobicContact CD2-CE2 4.18Å; F495-F854 HydrophobicContact CG-CE2 4.13Å; F495-F854 HydrophobicContact CG-CZ 4.07Å; A732-F854 HydrophobicContact CB-CB 4.25Å; C850-F854 WeakPolarHBondContact O-CD2 3.12Å; C850-F854 PolarHBondContact O-N 2.87Å
855	M	89.6	Confident	93.2	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.02	9%	0.087	C	C	.	.	H	α-helix	trans	-69.1	-34.7	-179.1	174	-171.1	80.6	0	0	113	T708 N712 N729 A732 L733 A851 E852 G853	T708-M855 HydrophobicContact CG2-CE 4.12Å; N712-M855 HydrophobicContact CB-CE 3.8Å; N712-M855 HydrophobicContact CB-SD 3.84Å; N712-M855 WeakPolarHBondContact ND2-CG 3.41Å; N712-M855 PolarHBondContact ND2-SD 3.06Å; N712-M855 VanDerWaalsContact ND2-SD 3.37Å; N729-M855 PolarHBondContact ND2-O 2.8Å; A732-M855 HydrophobicContact CB-CB 4.07Å; L733-M855 HydrophobicContact CD2-CG 4.07Å; L733-M855 HydrophobicContact CD2-SD 3.12Å; L733-M855 WeakPolarHBondContact CD2-SD 3.32Å; L733-M855 HydrophobicContact CG-CG 3.96Å; L733-M855 HydrophobicContact CG-SD 3.59Å; L733-M855 VanDerWaalsContact CG-SD 3.59Å; A851-M855 WeakPolarHBondContact O-CB 3.26Å; A851-M855 PolarHBondContact O-N 3.46Å; E852-M855 HydrophobicContact CG-CE 4.47Å; E852-M855 PolarHBondContact O-N 3.48Å; G853-M855 VanDerWaalsContact C-N 3.3Å; G853-M855 PolarHBondContact O-N 3.4Å
856	M	88.3	Confident	93.4	Very high	34 Å²	34	17.4 Å²	17.4	17%	0.167	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	6.9	-176.6	-63	-172.6	175.3	0	0	113.9	G531 L534 L535 T708 E852 G853 N858 L861	G531-M856 VanDerWaalsContact CA-SD 3.55Å; G531-M856 VanDerWaalsContact O-CE 3.27Å; G531-M856 WeakPolarHBondContact O-CE 3.48Å; L534-M856 HydrophobicContact CB-SD 4.31Å; L534-M856 HydrophobicContact CD1-CB 4.43Å; L534-M856 HydrophobicContact CD1-SD 3.73Å; L535-M856 HydrophobicContact CD1-CE 3.61Å; L535-M856 HydrophobicContact CD2-CE 4.31Å; L535-M856 HydrophobicContact CG-CE 3.8Å; T708-M856 HydrophobicContact CG2-CE 3.35Å; E852-M856 WeakPolarHBondContact O-CB 3.46Å; E852-M856 WeakPolarHBondContact O-CG 3.22Å; E852-M856 PolarHBondContact O-N 3.42Å; G853-M856 PolarHBondContact O-N 3.43Å; M856-N858 VanDerWaalsContact C-N 3.27Å; M856-N858 HydrophobicContact CB-CB 4.28Å; M856-N858 PolarHBondContact O-N 2.9Å; M856-L861 HydrophobicContact SD-CD1 4.32Å
857	D	88.7	Confident	93.5	Very high	98 Å²	98	17.5 Å²	17.5	52%	0.524	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	46.8	-172.2	-158.7	28.2	0	0	0	112.9	M491 G853	M491-D857 VanDerWaalsContact CE-C 3.44Å; M491-D857 VanDerWaalsContact CE-OD1 3.26Å; M491-D857 WeakPolarHBondContact CE-OD1 2.9Å; G853-D857 WeakPolarHBondContact O-CA 3.49Å; G853-D857 PolarHBondContact O-N 3.36Å
858	N	91.4	Very high	93.5	Very high	7 Å²	7	13.8 Å²	13.8	4%	0.037	7%	0.074	C	C	.	.			trans	-116.7	105.4	-172.3	-169.9	-37.7	0	0	0	112.3	G853 M856 L860 L861 T862	G853-N858 PolarHBondContact O-N 3.28Å; M856-N858 VanDerWaalsContact C-N 3.27Å; M856-N858 HydrophobicContact CB-CB 4.28Å; M856-N858 PolarHBondContact O-N 2.9Å; N858-L860 VanDerWaalsContact C-N 3.3Å; N858-L860 PolarHBondContact O-N 2.86Å; N858-L860 WeakPolarHBondContact OD1-CB 3.49Å; N858-L860 PolarHBondContact OD1-N 3.49Å; N858-L861 HydrophobicContact CB-CB 4.4Å; N858-L861 HydrophobicContact CB-CD1 4.08Å; N858-L861 HydrophobicContact CB-CG 4.1Å; N858-L861 PolarHBondContact O-N 2.82Å; N858-L861 PolarHBondContact OD1-N 3.45Å; N858-T862 PolarHBondContact O-N 2.79Å; N858-T862 PolarHBondContact O-OG1 3.47Å
859	D	92.7	Very high	93.5	Very high	69 Å²	69	13.8 Å²	13.8	37%	0.369	7%	0.074	S	C	.	.	H	α-helix	trans	-56.5	-39.1	-179	-78.4	-42.5	0	0	0	113	T494 L861 T862 V863	T494-D859 HydrophobicContact CG2-CB 4.43Å; T494-D859 PolarHBondContact OG1-OD1 3.06Å; D859-L861 PolarHBondContact O-N 3.48Å; D859-T862 PolarHBondContact O-N 3.43Å; D859-V863 VanDerWaalsContact O-CG2 3.26Å; D859-V863 WeakPolarHBondContact O-CG2 3.47Å; D859-V863 PolarHBondContact O-N 3.22Å
860	L	93.7	Very high	93.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.3	-48.8	-179	165.9	75.2	0	0	0	111.2	I527 Y615 A618 S619 A649 N858 T862 V863 V864	I527-L860 HydrophobicContact CD1-CD1 4.45Å; I527-L860 HydrophobicContact CG2-CD2 4.43Å; Y615-L860 HydrophobicContact CD1-CB 4.14Å; Y615-L860 HydrophobicContact CD1-CD2 3.87Å; Y615-L860 HydrophobicContact CE1-CD2 4.15Å; Y615-L860 HydrophobicContact CG-CB 4.05Å; A618-L860 HydrophobicContact CB-CD1 3.97Å; S619-L860 WeakPolarHBondContact OG-CD1 3.38Å; A649-L860 HydrophobicContact CB-CD1 4.24Å; A649-L860 HydrophobicContact CB-CD2 3.29Å; A649-L860 HydrophobicContact CB-CG 4.35Å; N858-L860 VanDerWaalsContact C-N 3.3Å; N858-L860 PolarHBondContact O-N 2.86Å; N858-L860 WeakPolarHBondContact OD1-CB 3.49Å; N858-L860 PolarHBondContact OD1-N 3.49Å; L860-T862 VanDerWaalsContact C-N 3.25Å; L860-T862 PolarHBondContact O-N 2.73Å; L860-V863 PolarHBondContact O-N 2.88Å; L860-V864 HydrophobicContact CD1-CG2 3.84Å; L860-V864 HydrophobicContact CG-CG2 4.5Å; L860-V864 VanDerWaalsContact O-CB 3.29Å; L860-V864 WeakPolarHBondContact O-CB 3.33Å; L860-V864 WeakPolarHBondContact O-CG2 3.33Å; L860-V864 PolarHBondContact O-N 3.21Å
861	L	94.9	Very high	93.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.5	-39.4	179.7	-63	-175.5	0	0	0	110.6	I527 A530 L849 E852 M856 N858 D859 G865	I527-L861 HydrophobicContact CG2-CD2 3.38Å; A530-L861 HydrophobicContact CB-CD2 4.34Å; L849-L861 HydrophobicContact CD2-CD2 4.13Å; E852-L861 HydrophobicContact CB-CD1 4.08Å; M856-L861 HydrophobicContact SD-CD1 4.32Å; N858-L861 HydrophobicContact CB-CB 4.4Å; N858-L861 HydrophobicContact CB-CD1 4.08Å; N858-L861 HydrophobicContact CB-CG 4.1Å; N858-L861 PolarHBondContact O-N 2.82Å; N858-L861 PolarHBondContact OD1-N 3.45Å; D859-L861 PolarHBondContact O-N 3.48Å; L861-G865 WeakPolarHBondContact O-CA 3.5Å; L861-G865 PolarHBondContact O-N 3.37Å
862	T	95	Very high	93.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.5	-47.5	177.5	-60.7	0	0	0	0	112.3	M491 F495 G853 N858 D859 L860 A866	M491-T862 HydrophobicContact CG-CG2 4.29Å; M491-T862 VanDerWaalsContact SD-CB 3.57Å; M491-T862 HydrophobicContact SD-CG2 3.8Å; M491-T862 PolarHBondContact SD-OG1 2.89Å; F495-T862 HydrophobicContact CB-CG2 3.64Å; F495-T862 HydrophobicContact CD2-CG2 4.08Å; F495-T862 HydrophobicContact CG-CG2 4.35Å; G853-T862 WeakPolarHBondContact CA-OG1 3.47Å; N858-T862 PolarHBondContact O-N 2.79Å; N858-T862 PolarHBondContact O-OG1 3.47Å; D859-T862 PolarHBondContact O-N 3.43Å; L860-T862 VanDerWaalsContact C-N 3.25Å; L860-T862 PolarHBondContact O-N 2.73Å; T862-A866 WeakPolarHBondContact O-CB 3.38Å; T862-A866 PolarHBondContact O-N 2.9Å
863	V	95.8	Very high	93.4	Very high	22 Å²	22	15.9 Å²	15.9	13%	0.133	9%	0.09	C	C	.	.	H	α-helix	trans	-64.1	-48.7	179.4	174.7	0	0	0	0	111	T494 A498 D859 L860 A866 L867	T494-V863 HydrophobicContact CG2-CG2 3.45Å; T494-V863 VanDerWaalsContact CG2-CG2 3.45Å; A498-V863 HydrophobicContact CB-CB 4.15Å; A498-V863 HydrophobicContact CB-CG1 4.01Å; A498-V863 HydrophobicContact CB-CG2 4.07Å; D859-V863 VanDerWaalsContact O-CG2 3.26Å; D859-V863 WeakPolarHBondContact O-CG2 3.47Å; D859-V863 PolarHBondContact O-N 3.22Å; L860-V863 PolarHBondContact O-N 2.88Å; V863-A866 PolarHBondContact O-N 3.27Å; V863-L867 WeakPolarHBondContact O-CB 3.4Å; V863-L867 PolarHBondContact O-N 2.88Å
864	V	95.7	Very high	93.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.4	-42.4	179.7	168.6	0	0	0	0	111.1	I524 I527 C622 L849 L860 A866 L867 I868	I524-V864 HydrophobicContact CG2-CG1 3.42Å; I524-V864 VanDerWaalsContact CG2-CG1 3.42Å; I524-V864 HydrophobicContact CG2-CG2 4.46Å; I527-V864 HydrophobicContact CD1-CG1 4.29Å; I527-V864 HydrophobicContact CD1-CG2 4.03Å; C622-V864 HydrophobicContact CB-CG2 4.11Å; L849-V864 HydrophobicContact CD1-CG1 4.47Å; L860-V864 HydrophobicContact CD1-CG2 3.84Å; L860-V864 HydrophobicContact CG-CG2 4.5Å; L860-V864 VanDerWaalsContact O-CB 3.29Å; L860-V864 WeakPolarHBondContact O-CB 3.33Å; L860-V864 WeakPolarHBondContact O-CG2 3.33Å; L860-V864 PolarHBondContact O-N 3.21Å; V864-A866 PolarHBondContact O-N 3.34Å; V864-L867 WeakPolarHBondContact O-CB 3.1Å; V864-L867 PolarHBondContact O-N 2.85Å; V864-I868 HydrophobicContact CG1-CD1 3.62Å; V864-I868 WeakPolarHBondContact O-CD1 3.33Å; V864-I868 WeakPolarHBondContact O-CG1 3.26Å; V864-I868 PolarHBondContact O-N 3.12Å
865	G	95.3	Very high	93.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.1	-45.2	176	0	0	0	0	0	112.2	G846 L861 L867 I868 G869	G846-G865 CarbonylContact C-O 3.33Å; G846-G865 WeakPolarHBondContact CA-O 3.44Å; G846-G865 CarbonylContact O-C 3.57Å; G846-G865 WeakPolarHBondContact O-CA 3.26Å; L861-G865 WeakPolarHBondContact O-CA 3.5Å; L861-G865 PolarHBondContact O-N 3.37Å; G865-L867 VanDerWaalsContact C-N 3.33Å; G865-L867 PolarHBondContact O-N 3.43Å; G865-I868 PolarHBondContact O-N 3.02Å; G865-G869 PolarHBondContact O-N 2.92Å
866	A	96.2	Very high	93.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66.2	-38.4	179.8	0	0	0	0	0	111.3	F495 A498 C850 T862 V863 V864 S870	F495-A866 HydrophobicContact CD2-CB 4.1Å; F495-A866 HydrophobicContact CE2-CB 4.22Å; A498-A866 HydrophobicContact CB-CB 3.84Å; C850-A866 PolarHBondContact SG-N 2.92Å; T862-A866 WeakPolarHBondContact O-CB 3.38Å; T862-A866 PolarHBondContact O-N 2.9Å; V863-A866 PolarHBondContact O-N 3.27Å; V864-A866 PolarHBondContact O-N 3.34Å; A866-S870 VanDerWaalsContact O-CB 3.25Å; A866-S870 WeakPolarHBondContact O-CB 3.49Å; A866-S870 PolarHBondContact O-N 2.72Å; A866-S870 PolarHBondContact O-OG 2.98Å
867	L	95.7	Very high	93.4	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-60.8	-49.6	175.1	-177	63.5	0	0	0	112.2	C622 V623 L626 V863 V864 G865 S871	C622-L867 HydrophobicContact CB-CD2 4.42Å; V623-L867 HydrophobicContact CG2-CD2 4.11Å; L626-L867 HydrophobicContact CD1-CD2 4.11Å; L626-L867 HydrophobicContact CD2-CD1 3.73Å; L626-L867 HydrophobicContact CD2-CD2 4.22Å; L626-L867 HydrophobicContact CD2-CG 3.75Å; V863-L867 WeakPolarHBondContact O-CB 3.4Å; V863-L867 PolarHBondContact O-N 2.88Å; V864-L867 WeakPolarHBondContact O-CB 3.1Å; V864-L867 PolarHBondContact O-N 2.85Å; G865-L867 VanDerWaalsContact C-N 3.33Å; G865-L867 PolarHBondContact O-N 3.43Å; L867-S871 WeakPolarHBondContact O-CB 3.43Å; L867-S871 PolarHBondContact O-N 3.45Å
868	I	95.3	Very high	93.3	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.9	-43.9	178.6	-65.8	159.5	0	0	0	110.8	T521 I524 L849 V864 G865 S870 S871 G872	T521-I868 HydrophobicContact CG2-CG1 4.34Å; I524-I868 HydrophobicContact CG2-CD1 4.2Å; L849-I868 HydrophobicContact CD1-CD1 3.81Å; V864-I868 HydrophobicContact CG1-CD1 3.62Å; V864-I868 WeakPolarHBondContact O-CD1 3.33Å; V864-I868 WeakPolarHBondContact O-CG1 3.26Å; V864-I868 PolarHBondContact O-N 3.12Å; G865-I868 PolarHBondContact O-N 3.02Å; I868-S870 VanDerWaalsContact C-N 3.33Å; I868-S870 PolarHBondContact O-N 3.46Å; I868-S871 WeakPolarHBondContact O-CB 3.37Å; I868-S871 PolarHBondContact O-N 2.93Å; I868-S871 VanDerWaalsContact O-N 3.13Å; I868-G872 PolarHBondContact O-N 3.02Å
869	G	94.8	Very high	93	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.5	-48.1	178.2	0	0	0	0	0	111.6	S843 G865 A873	S843-G869 WeakPolarHBondContact CB-O 3.18Å; S843-G869 WeakPolarHBondContact O-CA 3.39Å; S843-G869 PolarHBondContact OG-O 3.48Å; G865-G869 PolarHBondContact O-N 2.92Å; G869-A873 WeakPolarHBondContact O-CB 3.25Å; G869-A873 PolarHBondContact O-N 2.87Å; G869-A873 VanDerWaalsContact O-N 3.12Å
870	S	94.7	Very high	92.6	Very high	14 Å²	14	15.2 Å²	15.2	10%	0.098	8%	0.079	C	C	.	.	H	α-helix	trans	-64	-41	176.2	-55.5	0	0	0	0	111.7	A866 I868 A873 I874	A866-S870 VanDerWaalsContact O-CB 3.25Å; A866-S870 WeakPolarHBondContact O-CB 3.49Å; A866-S870 PolarHBondContact O-N 2.72Å; A866-S870 PolarHBondContact O-OG 2.98Å; I868-S870 VanDerWaalsContact C-N 3.33Å; I868-S870 PolarHBondContact O-N 3.46Å; S870-A873 PolarHBondContact O-N 2.9Å; S870-I874 WeakPolarHBondContact O-CG1 3.2Å; S870-I874 PolarHBondContact O-N 3.43Å
871	S	93.6	Very high	92.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-52	178.2	-173.6	0	0	0	0	112.9	L867 I868 A873 I874 L875	L867-S871 WeakPolarHBondContact O-CB 3.43Å; L867-S871 PolarHBondContact O-N 3.45Å; I868-S871 WeakPolarHBondContact O-CB 3.37Å; I868-S871 PolarHBondContact O-N 2.93Å; I868-S871 VanDerWaalsContact O-N 3.13Å; S871-A873 VanDerWaalsContact C-N 3.31Å; S871-A873 PolarHBondContact O-N 3.24Å; S871-I874 PolarHBondContact O-N 3.26Å; S871-L875 WeakPolarHBondContact O-CG 3.48Å; S871-L875 PolarHBondContact O-N 3.4Å
872	G	92	Very high	91.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-37.9	177.7	0	0	0	0	0	112.8	T839 I868 S876	T839-G872 CarbonylContact O-C 3.54Å; T839-G872 VanDerWaalsContact O-CA 3.25Å; T839-G872 WeakPolarHBondContact O-CA 3.44Å; I868-G872 PolarHBondContact O-N 3.02Å; G872-S876 WeakPolarHBondContact O-CB 3.42Å; G872-S876 PolarHBondContact O-N 2.79Å; G872-S876 PolarHBondContact O-OG 3.46Å
873	A	92.7	Very high	90.6	Very high	43 Å²	43	24.7 Å²	24.7	36%	0.355	13%	0.127	S	C	.	.	H	α-helix	trans	-65.9	-46	179	0	0	0	0	0	112.2	G869 S870 S871 S876 Y877	G869-A873 WeakPolarHBondContact O-CB 3.25Å; G869-A873 PolarHBondContact O-N 2.87Å; G869-A873 VanDerWaalsContact O-N 3.12Å; S870-A873 PolarHBondContact O-N 2.9Å; S871-A873 VanDerWaalsContact C-N 3.31Å; S871-A873 PolarHBondContact O-N 3.24Å; A873-S876 PolarHBondContact O-N 2.86Å; A873-Y877 PolarHBondContact O-N 3.07Å
874	I	92.5	Very high	90	Very high	11 Å²	11	25.1 Å²	25.1	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-45.5	178.8	-70.5	165.5	0	0	0	110.8	Y503 V506 W507 S870 S871 S876 Y877 I878	Y503-I874 HydrophobicContact CD2-CD1 3.92Å; Y503-I874 HydrophobicContact CD2-CG1 4.48Å; Y503-I874 HydrophobicContact CG-CD1 4.4Å; V506-I874 HydrophobicContact CB-CD1 3.9Å; V506-I874 HydrophobicContact CG1-CB 3.95Å; V506-I874 HydrophobicContact CG1-CD1 4.04Å; V506-I874 HydrophobicContact CG1-CG2 3.87Å; W507-I874 HydrophobicContact CD2-CG2 4.11Å; W507-I874 HydrophobicContact CG-CG2 4.49Å; W507-I874 HydrophobicContact CZ2-CG2 4.12Å; S870-I874 WeakPolarHBondContact O-CG1 3.2Å; S870-I874 PolarHBondContact O-N 3.43Å; S871-I874 PolarHBondContact O-N 3.26Å; I874-S876 VanDerWaalsContact C-N 3.31Å; I874-S876 PolarHBondContact O-N 3.19Å; I874-Y877 WeakPolarHBondContact O-CB 3.25Å; I874-Y877 PolarHBondContact O-N 2.93Å; I874-Y877 VanDerWaalsContact O-N 3.15Å; I874-I878 HydrophobicContact CG2-CD1 3.72Å; I874-I878 HydrophobicContact CG2-CG1 4.29Å; I874-I878 WeakPolarHBondContact O-CG1 3.35Å; I874-I878 PolarHBondContact O-N 3.36Å
875	L	89.6	Confident	89.2	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-43.9	176.2	-71.7	175.8	0	0	0	111.3	H514 L517 M518 T839 S871 Y877 I878 M879	H514-L875 HydrophobicContact CB-CD2 3.91Å; L517-L875 HydrophobicContact CD2-CD1 4.02Å; L517-L875 HydrophobicContact CD2-CD2 4.24Å; L517-L875 HydrophobicContact CD2-CG 4.3Å; L517-L875 HydrophobicContact CG-CD1 4.42Å; M518-L875 HydrophobicContact CG-CD1 3.61Å; M518-L875 HydrophobicContact SD-CD1 4.41Å; T839-L875 HydrophobicContact CG2-CB 3.75Å; T839-L875 HydrophobicContact CG2-CD1 4.4Å; S871-L875 WeakPolarHBondContact O-CG 3.48Å; S871-L875 PolarHBondContact O-N 3.4Å; L875-Y877 VanDerWaalsContact C-N 3.31Å; L875-Y877 PolarHBondContact O-N 3.26Å; L875-I878 PolarHBondContact O-N 3.38Å; L875-M879 VanDerWaalsContact O-CG 3.23Å; L875-M879 WeakPolarHBondContact O-CG 3.26Å; L875-M879 PolarHBondContact O-N 2.99Å
876	S	90.1	Very high	88.7	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-59.1	-42.5	175.8	-55.6	0	0	0	0	111.9	T839 V840 G872 A873 I874 C880	T839-S876 VanDerWaalsContact C-OG 3.23Å; T839-S876 VanDerWaalsContact CB-OG 3.24Å; T839-S876 WeakPolarHBondContact CB-OG 3.44Å; T839-S876 WeakPolarHBondContact OG1-CA 3.36Å; T839-S876 PolarHBondContact OG1-OG 3.02Å; V840-S876 WeakPolarHBondContact CG2-OG 3.36Å; V840-S876 PolarHBondContact N-OG 2.85Å; V840-S876 VanDerWaalsContact N-OG 3.17Å; G872-S876 WeakPolarHBondContact O-CB 3.42Å; G872-S876 PolarHBondContact O-N 2.79Å; G872-S876 PolarHBondContact O-OG 3.46Å; A873-S876 PolarHBondContact O-N 2.86Å; I874-S876 VanDerWaalsContact C-N 3.31Å; I874-S876 PolarHBondContact O-N 3.19Å; S876-C880 WeakPolarHBondContact O-CB 3.46Å; S876-C880 PolarHBondContact O-N 2.96Å; S876-C880 PolarHBondContact O-SG 3.11Å
877	Y	90.5	Very high	88.1	Confident	128 Å²	128	32.7 Å²	32.7	50%	0.502	17%	0.17	S	C	.	.	H	α-helix	trans	-64.5	-48	177	175.4	-97.2	0	0	0	112.3	W507 A873 I874 L875 M879 C880 K881	W507-Y877 HydrophobicContact CH2-CD1 4.22Å; W507-Y877 HydrophobicContact CH2-CE1 4.26Å; W507-Y877 HydrophobicContact CZ2-CD1 4.22Å; W507-Y877 HydrophobicContact CZ2-CE1 4.38Å; A873-Y877 PolarHBondContact O-N 3.07Å; I874-Y877 WeakPolarHBondContact O-CB 3.25Å; I874-Y877 PolarHBondContact O-N 2.93Å; I874-Y877 VanDerWaalsContact O-N 3.15Å; L875-Y877 VanDerWaalsContact C-N 3.31Å; L875-Y877 PolarHBondContact O-N 3.26Å; Y877-M879 VanDerWaalsContact C-N 3.3Å; Y877-M879 PolarHBondContact O-N 3.27Å; Y877-C880 PolarHBondContact O-N 3.33Å; Y877-K881 HydrophobicContact CE1-CD 4.11Å; Y877-K881 WeakPolarHBondContact O-CB 3.48Å; Y877-K881 PolarHBondContact O-N 3.15Å
878	I	86.9	Confident	87.4	Confident	32 Å²	32	35.4 Å²	35.4	16%	0.164	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-45.8	178.4	-69.6	169.6	0	0	0	110.2	W507 I874 L875 K881 A882	W507-I878 HydrophobicContact CE3-CD1 4.38Å; W507-I878 HydrophobicContact CH2-CD1 4.23Å; W507-I878 HydrophobicContact CH2-CG1 3.91Å; W507-I878 HydrophobicContact CZ3-CD1 3.92Å; W507-I878 HydrophobicContact CZ3-CG1 4.02Å; I874-I878 HydrophobicContact CG2-CD1 3.72Å; I874-I878 HydrophobicContact CG2-CG1 4.29Å; I874-I878 WeakPolarHBondContact O-CG1 3.35Å; I874-I878 PolarHBondContact O-N 3.36Å; L875-I878 PolarHBondContact O-N 3.38Å; I878-K881 PolarHBondContact O-N 2.59Å; I878-A882 WeakPolarHBondContact O-CB 3.34Å; I878-A882 PolarHBondContact O-N 2.83Å
879	M	84.3	Confident	86.6	Confident	57 Å²	57	36.7 Å²	36.7	28%	0.281	20%	0.2	S	C	.	.	H	α-helix	trans	-66.4	-43.1	179.8	-65.7	-174.5	73.2	0	0	112.5	P835 V836 T839 L875 Y877 K881 A882 M883	P835-M879 HydrophobicContact CB-CE 3.33Å; P835-M879 HydrophobicContact CB-SD 4.31Å; P835-M879 HydrophobicContact CG-CE 4.42Å; V836-M879 HydrophobicContact CG2-CB 3.92Å; V836-M879 HydrophobicContact CG2-CE 4.35Å; T839-M879 HydrophobicContact CG2-SD 3.96Å; L875-M879 VanDerWaalsContact O-CG 3.23Å; L875-M879 WeakPolarHBondContact O-CG 3.26Å; L875-M879 PolarHBondContact O-N 2.99Å; Y877-M879 VanDerWaalsContact C-N 3.3Å; Y877-M879 PolarHBondContact O-N 3.27Å; M879-K881 PolarHBondContact O-N 3.45Å; M879-A882 PolarHBondContact O-N 2.97Å; M879-M883 WeakPolarHBondContact O-CG 3.36Å; M879-M883 PolarHBondContact O-N 3.33Å
880	C	85.4	Confident	85.7	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.027	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-45	175.3	-73.8	0	0	0	0	111.7	S876 Y877 M883 N884 R885	S876-C880 WeakPolarHBondContact O-CB 3.46Å; S876-C880 PolarHBondContact O-N 2.96Å; S876-C880 PolarHBondContact O-SG 3.11Å; Y877-C880 PolarHBondContact O-N 3.33Å; C880-M883 PolarHBondContact O-N 3.45Å; C880-N884 PolarHBondContact O-N 2.87Å; C880-R885 CarbonylContact C-O 3.22Å; C880-R885 VanDerWaalsContact C-O 3.3Å; C880-R885 VanDerWaalsContact CB-O 3.3Å; C880-R885 WeakPolarHBondContact CB-O 3.38Å; C880-R885 PolarHBondContact O-N 3.36Å
881	K	85.4	Confident	84.9	Confident	135 Å²	135	37.3 Å²	37.3	59%	0.587	20%	0.202	S	C	*	.	H	α-helix	trans	-62.6	-42.8	177.2	-172.5	179.2	178.7	-176.8	0	111.8	Y877 I878 M879 M883 N884	Y877-K881 HydrophobicContact CE1-CD 4.11Å; Y877-K881 WeakPolarHBondContact O-CB 3.48Å; Y877-K881 PolarHBondContact O-N 3.15Å; I878-K881 PolarHBondContact O-N 2.59Å; M879-K881 PolarHBondContact O-N 3.45Å; K881-M883 PolarHBondContact O-N 2.85Å; K881-N884 PolarHBondContact O-N 3.26Å
882	A	80.5	Confident	84	Confident	29 Å²	29	41 Å²	41	24%	0.24	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-28.6	177.3	0	0	0	0	0	113.1	I878 M879	I878-A882 WeakPolarHBondContact O-CB 3.34Å; I878-A882 PolarHBondContact O-N 2.83Å; M879-A882 PolarHBondContact O-N 2.97Å
883	M	75.7	Confident	82.7	Confident	34 Å²	34	42.2 Å²	42.2	17%	0.167	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	0.7	176.5	-62.5	177.7	66.1	0	0	113.6	D833 M879 C880 K881 R885	D833-M883 WeakPolarHBondContact OD1-CE 3.24Å; M879-M883 WeakPolarHBondContact O-CG 3.36Å; M879-M883 PolarHBondContact O-N 3.33Å; C880-M883 PolarHBondContact O-N 3.45Å; K881-M883 PolarHBondContact O-N 2.85Å; M883-R885 PolarHBondContact O-N 3.06Å
884	N	82	Confident	81.3	Confident	32 Å²	32	41.8 Å²	41.8	17%	0.171	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	41.4	-169.2	-166.1	31.3	0	0	0	113.6	C880 K881 T897 V898 S899 A1022 G1023 M1024	C880-N884 PolarHBondContact O-N 2.87Å; K881-N884 PolarHBondContact O-N 3.26Å; N884-T897 HydrophobicContact CB-CG2 3.99Å; N884-T897 VanDerWaalsContact O-CA 3.31Å; N884-T897 WeakPolarHBondContact O-CA 3.44Å; N884-T897 WeakPolarHBondContact O-CB 3.43Å; N884-T897 WeakPolarHBondContact O-CG2 3.22Å; N884-V898 PolarHBondContact O-N 3.49Å; N884-S899 WeakPolarHBondContact ND2-CB 3.32Å; N884-S899 PolarHBondContact ND2-OG 2.96Å; N884-A1022 PolarHBondContact ND2-O 2.97Å; N884-G1023 WeakPolarHBondContact ND2-CA 3.29Å; N884-M1024 HydrophobicContact CB-CB 4.42Å
885	R	79.9	Confident	79.6	Confident	33 Å²	33	50 Å²	50	13%	0.125	27%	0.265	C	S	.	.			trans	-124.1	149.7	176.8	-70.5	177	71.9	-162.6	-0.6	110.1	D833 C880 M883 V890 G894 T897	D833-R885 IonicContact OD1-NH1 2.83Å; D833-R885 PolarHBondContact OD1-NH1 2.67Å; D833-R885 IonicContact OD2-CZ 2.66Å; D833-R885 IonicContact OD2-NH1 3.85Å; D833-R885 PolarHBondContact OD2-NH1 2.99Å; D833-R885 IonicContact OD2-NH2 2.92Å; D833-R885 PolarHBondContact OD2-NH2 2.95Å; C880-R885 CarbonylContact C-O 3.22Å; C880-R885 VanDerWaalsContact C-O 3.3Å; C880-R885 VanDerWaalsContact CB-O 3.3Å; C880-R885 WeakPolarHBondContact CB-O 3.38Å; C880-R885 PolarHBondContact O-N 3.36Å; M883-R885 PolarHBondContact O-N 3.06Å; R885-V890 HydrophobicContact CB-CG2 4.02Å; R885-G894 PolarHBondContact NH2-O 3.31Å; R885-T897 HydrophobicContact CG-CG2 4.35Å
886	S	84.8	Confident	78.2	Confident	54 Å²	54	50.2 Å²	50.2	38%	0.378	27%	0.268	S	S	.	.			trans	-83.2	151	171.7	67.5	0	0	0	0	110.8	A888 N889 V890	S886-A888 PolarHBondContact O-N 3.08Å; S886-N889 WeakPolarHBondContact O-CA 3.47Å; S886-N889 WeakPolarHBondContact O-CB 3.4Å; S886-N889 PolarHBondContact O-N 2.7Å; S886-N889 VanDerWaalsContact OG-CB 3.23Å; S886-N889 WeakPolarHBondContact OG-CB 3.38Å; S886-N889 PolarHBondContact OG-N 2.92Å; S886-V890 PolarHBondContact O-N 3.38Å
887	L	83.4	Confident	77	Confident	72 Å²	72	50.7 Å²	50.7	38%	0.377	27%	0.271	S	S	.	.	H	α-helix	trans	-55.2	-41.1	176.8	-176.2	65.3	0	0	0	112	V836 V840 N889 V890 I891	V836-L887 HydrophobicContact CG1-CD1 3.9Å; V840-L887 HydrophobicContact CG2-CD1 3.71Å; L887-N889 VanDerWaalsContact C-N 3.34Å; L887-N889 PolarHBondContact O-N 3.33Å; L887-V890 PolarHBondContact O-N 2.85Å; L887-I891 HydrophobicContact CD1-CD1 3.84Å; L887-I891 HydrophobicContact CD1-CG1 4.2Å; L887-I891 HydrophobicContact CD2-CD1 4.36Å; L887-I891 HydrophobicContact CG-CD1 3.8Å; L887-I891 HydrophobicContact CG-CG1 4.41Å; L887-I891 WeakPolarHBondContact O-CG1 3.18Å; L887-I891 PolarHBondContact O-N 2.91Å
888	A	81.9	Confident	76	Confident	59 Å²	59	49.4 Å²	49.4	49%	0.488	28%	0.276	S	S	.	.	H	α-helix	trans	-61.2	-41.7	175.5	0	0	0	0	0	112.1	S886 V890 L892	S886-A888 PolarHBondContact O-N 3.08Å; A888-V890 VanDerWaalsContact C-N 3.34Å; A888-V890 PolarHBondContact O-N 3.5Å; A888-L892 WeakPolarHBondContact O-CB 3.31Å; A888-L892 VanDerWaalsContact O-CG 3.31Å; A888-L892 WeakPolarHBondContact O-CG 3.29Å; A888-L892 PolarHBondContact O-N 3.32Å
889	N	77.2	Confident	75.3	Confident	27 Å²	27	51 Å²	51	14%	0.144	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-40.4	176.5	-175.9	-1.8	0	0	0	111.1	S886 L887 G893 G894 G896	S886-N889 WeakPolarHBondContact O-CA 3.47Å; S886-N889 WeakPolarHBondContact O-CB 3.4Å; S886-N889 PolarHBondContact O-N 2.7Å; S886-N889 VanDerWaalsContact OG-CB 3.23Å; S886-N889 WeakPolarHBondContact OG-CB 3.38Å; S886-N889 PolarHBondContact OG-N 2.92Å; L887-N889 VanDerWaalsContact C-N 3.34Å; L887-N889 PolarHBondContact O-N 3.33Å; N889-G893 PolarHBondContact O-N 3.41Å; N889-G894 PolarHBondContact O-N 3.42Å; N889-G894 WeakPolarHBondContact OD1-CA 3.3Å; N889-G894 PolarHBondContact OD1-N 3.01Å; N889-G894 PolarHBondContact OD1-O 3.19Å; N889-G894 VanDerWaalsContact OD1-O 3.12Å; N889-G896 PolarHBondContact ND2-O 3.31Å
890	V	75.8	Confident	74.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.7	-51.7	176.9	179.6	0	0	0	0	111.7	D833 V836 R885 S886 L887 A888 G893	D833-V890 HydrophobicContact CB-CG1 4.14Å; V836-V890 HydrophobicContact CB-CG1 4.07Å; V836-V890 HydrophobicContact CG1-CG1 3.98Å; V836-V890 HydrophobicContact CG2-CG1 4.46Å; R885-V890 HydrophobicContact CB-CG2 4.02Å; S886-V890 PolarHBondContact O-N 3.38Å; L887-V890 PolarHBondContact O-N 2.85Å; A888-V890 VanDerWaalsContact C-N 3.34Å; A888-V890 PolarHBondContact O-N 3.5Å; V890-G893 PolarHBondContact O-N 2.87Å
891	I	78.9	Confident	73.9	Confident	26 Å²	26	53.3 Å²	53.3	13%	0.133	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-36.8	-175.2	-65.1	177.1	0	0	0	112.3	M813 V840 L887 G893	M813-I891 HydrophobicContact CE-CG2 3.31Å; V840-I891 HydrophobicContact CG1-CD1 4.2Å; V840-I891 HydrophobicContact CG2-CD1 4.13Å; L887-I891 HydrophobicContact CD1-CD1 3.84Å; L887-I891 HydrophobicContact CD1-CG1 4.2Å; L887-I891 HydrophobicContact CD2-CD1 4.36Å; L887-I891 HydrophobicContact CG-CD1 3.8Å; L887-I891 HydrophobicContact CG-CG1 4.41Å; L887-I891 WeakPolarHBondContact O-CG1 3.18Å; L887-I891 PolarHBondContact O-N 2.91Å; I891-G893 VanDerWaalsContact C-N 3.32Å
892	L	74.4	Confident	73	Confident	78 Å²	78	50.3 Å²	50.3	41%	0.408	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.2	-178.2	-59.8	177.2	0	0	0	113.5	R768 A888	R768-L892 PolarHBondContact NH2-O 2.99Å; R768-L892 VanDerWaalsContact NH2-O 3.11Å; A888-L892 WeakPolarHBondContact O-CB 3.31Å; A888-L892 VanDerWaalsContact O-CG 3.31Å; A888-L892 WeakPolarHBondContact O-CG 3.29Å; A888-L892 PolarHBondContact O-N 3.32Å
893	G	64.8	Low	72.5	Confident	25 Å²	25	50.8 Å²	50.8	26%	0.258	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	42.8	178.4	0	0	0	0	0	113.2	R768 N889 V890 I891	R768-G893 PolarHBondContact NH2-O 3.29Å; R768-G893 VanDerWaalsContact NH2-O 3.12Å; N889-G893 PolarHBondContact O-N 3.41Å; V890-G893 PolarHBondContact O-N 2.87Å; I891-G893 VanDerWaalsContact C-N 3.32Å
894	G	63	Low	72.4	Confident	34 Å²	34	58.4 Å²	58.4	35%	0.351	36%	0.362	S	S	.	.			trans	-73.6	164.5	173.3	0	0	0	0	0	112.5	R885 N889	R885-G894 PolarHBondContact NH2-O 3.31Å; N889-G894 PolarHBondContact O-N 3.42Å; N889-G894 WeakPolarHBondContact OD1-CA 3.3Å; N889-G894 PolarHBondContact OD1-N 3.01Å; N889-G894 PolarHBondContact OD1-O 3.19Å; N889-G894 VanDerWaalsContact OD1-O 3.12Å
895	Y	57	Low	72	Confident	184 Å²	184	60.3 Å²	60.3	72%	0.722	38%	0.376	S	S	*	.			trans	-106.8	137.8	-176	-173.4	-95	0	0	0	110.4	I1020	Y895-I1020 HydrophobicContact CD2-CD1 4.13Å; Y895-I1020 HydrophobicContact CE1-CD1 4Å; Y895-I1020 HydrophobicContact CE1-CG1 4.18Å; Y895-I1020 HydrophobicContact CE2-CD1 3.55Å; Y895-I1020 VanDerWaalsContact CZ-CD1 3.47Å
896	G	60.4	Low	71.8	Confident	9 Å²	9	68 Å²	68	9%	0.093	41%	0.405	C	S	.	.	S	Bend	trans	87.1	174.2	177.1	0	0	0	0	0	115.9	N889	N889-G896 PolarHBondContact ND2-O 3.31Å
897	T	64.3	Low	71.3	Confident	13 Å²	13	73.7 Å²	73.7	8%	0.08	43%	0.425	C	S	.	.			trans	-86.4	171.2	167.7	54.7	0	0	0	0	111	N884 R885 S899 T900 I1020 A1022	N884-T897 HydrophobicContact CB-CG2 3.99Å; N884-T897 VanDerWaalsContact O-CA 3.31Å; N884-T897 WeakPolarHBondContact O-CA 3.44Å; N884-T897 WeakPolarHBondContact O-CB 3.43Å; N884-T897 WeakPolarHBondContact O-CG2 3.22Å; R885-T897 HydrophobicContact CG-CG2 4.35Å; T897-S899 PolarHBondContact O-N 3.16Å; T897-T900 PolarHBondContact N-OG1 3.23Å; T897-T900 PolarHBondContact OG1-N 3.19Å; T897-T900 PolarHBondContact OG1-OG1 3.07Å; T897-I1020 VanDerWaalsContact CG2-O 3.32Å; T897-I1020 WeakPolarHBondContact CG2-O 3.27Å; T897-I1020 PolarHBondContact N-O 2.85Å; T897-A1022 WeakPolarHBondContact CB-O 3.35Å; T897-A1022 PolarHBondContact OG1-O 3.34Å
898	V	69.1	Low	70.9	Confident	100 Å²	100	72.9 Å²	72.9	61%	0.606	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.1	174.4	-171.6	0	0	0	0	111.8	N884	N884-V898 PolarHBondContact O-N 3.49Å
899	S	73.6	Confident	70.4	Confident	65 Å²	65	75.8 Å²	75.8	46%	0.455	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-3.1	-174.4	-51.1	0	0	0	0	115.1	N884 T897 A901	N884-S899 WeakPolarHBondContact ND2-CB 3.32Å; N884-S899 PolarHBondContact ND2-OG 2.96Å; T897-S899 PolarHBondContact O-N 3.16Å; S899-A901 PolarHBondContact O-N 3.4Å
900	T	71.2	Confident	70.2	Confident	42 Å²	42	77.3 Å²	77.3	26%	0.258	46%	0.455	S	S	.	.			trans	-65.1	123.1	-179.6	-57.3	0	0	0	0	111.2	T897 G902 P1017 S1019	T897-T900 PolarHBondContact N-OG1 3.23Å; T897-T900 PolarHBondContact OG1-N 3.19Å; T897-T900 PolarHBondContact OG1-OG1 3.07Å; T900-G902 PolarHBondContact O-N 3.34Å; T900-P1017 WeakPolarHBondContact CA-O 3.4Å; T900-S1019 WeakPolarHBondContact CG2-O 3.5Å; T900-S1019 PolarHBondContact OG1-O 3.43Å
901	A	67.6	Low	70.5	Confident	68 Å²	68	83 Å²	83	56%	0.562	49%	0.49	S	S	*	.			trans	-80.2	13	-175.2	0	0	0	0	0	115.5	S899 G903 P1017	S899-A901 PolarHBondContact O-N 3.4Å; A901-G903 PolarHBondContact O-N 2.95Å; A901-G903 VanDerWaalsContact O-N 3.08Å; A901-P1017 HydrophobicContact CB-CB 4.32Å; A901-P1017 PolarHBondContact N-O 3.48Å
902	G	67.2	Low	70.9	Confident	73 Å²	73	84.6 Å²	84.6	75%	0.753	50%	0.497	S	S	*	.	S	Bend	trans	70.5	-3.6	174.8	0	0	0	0	0	116.5	T900	T900-G902 PolarHBondContact O-N 3.34Å
903	G	69.8	Low	71.6	Confident	38 Å²	38	84.1 Å²	84.1	39%	0.392	50%	0.497	S	S	.	.	S	Bend	trans	-80	-177.9	176.9	0	0	0	0	0	114.2	A901 N1018	A901-G903 PolarHBondContact O-N 2.95Å; A901-G903 VanDerWaalsContact O-N 3.08Å; G903-N1018 WeakPolarHBondContact CA-OD1 3.47Å; G903-N1018 PolarHBondContact N-OD1 3.14Å; G903-N1018 VanDerWaalsContact N-OD1 3.08Å
904	K	75.2	Confident	72.9	Confident	194 Å²	194	88.5 Å²	88.5	84%	0.843	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-76.8	134.5	171.4	-70.9	-175.4	179.7	-179.5	0	109.8	N1018	K904-N1018 WeakPolarHBondContact O-CB 3.49Å
905	P	72.7	Confident	74.3	Confident	73 Å²	73	88 Å²	88	47%	0.474	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-57.4	150.8	171.8	-23.2	33.1	0	0	0	111.9	D1016	P905-D1016 VanDerWaalsContact CA-OD2 3.31Å; P905-D1016 WeakPolarHBondContact CA-OD2 3.45Å
906	R	75.5	Confident	76	Confident	195 Å²	195	83.2 Å²	83.2	74%	0.736	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-63.4	133.7	178.8	-173.7	177.4	179.1	178.3	-0.3	110.8	D1016	R906-D1016 PolarHBondContact N-OD2 3.14Å
907	E	74.5	Confident	77.6	Confident	172 Å²	172	83.8 Å²	83.8	80%	0.804	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-67.7	134.6	172.8	-71.7	-172.2	173.1	0	0	110.8
908	I	75.3	Confident	79	Confident	56 Å²	56	89.5 Å²	89.5	29%	0.287	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-85.2	125.6	177.5	-60.1	-178.7	0	0	0	109.1	D1050 P1052 Y1055	I908-D1050 HydrophobicContact CD1-CB 3.25Å; I908-D1050 HydrophobicContact CG1-CB 4.47Å; I908-P1052 HydrophobicContact CD1-CG 4.23Å; I908-P1052 HydrophobicContact CG1-CG 4.45Å; I908-Y1055 HydrophobicContact CD1-CE2 4.31Å; I908-Y1055 HydrophobicContact CG2-CD1 4.36Å; I908-Y1055 HydrophobicContact CG2-CD2 3.33Å; I908-Y1055 HydrophobicContact CG2-CE2 3.54Å; I908-Y1055 HydrophobicContact CG2-CG 3.77Å
909	T	70.8	Confident	80.1	Confident	120 Å²	120	87 Å²	87	74%	0.736	50%	0.5	S	S	*	.			trans	-113.4	147.1	175.3	59.8	0	0	0	0	110.3
910	G	72.7	Confident	81	Confident	58 Å²	58	83.9 Å²	83.9	60%	0.598	48%	0.478	S	S	*	.	S	Bend	trans	120.2	175.1	178.1	0	0	0	0	0	114	Y1055	G910-Y1055 WeakPolarHBondContact O-CD1 3.43Å
911	T	82.7	Confident	82.2	Confident	120 Å²	120	81.9 Å²	81.9	74%	0.736	47%	0.466	S	S	*	.			trans	-116.3	138.5	174.7	54	0	0	0	0	109.1
912	H	86.6	Confident	83.4	Confident	60 Å²	60	82 Å²	82	28%	0.278	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-70.6	150.1	173.7	70.4	-75.5	0	0	0	110.9	L1042 F1054 Y1055 M1061	H912-L1042 HydrophobicContact CB-CD2 4.45Å; H912-L1042 WeakPolarHBondContact ND1-CD1 3.35Å; H912-F1054 WeakPolarHBondContact CA-O 3.43Å; H912-F1054 VanDerWaalsContact CB-O 3.31Å; H912-F1054 WeakPolarHBondContact CB-O 3.35Å; H912-Y1055 HydrophobicContact CB-CD1 4.47Å; H912-M1061 HydrophobicContact CB-CG 4.03Å
913	T	89.1	Confident	84.7	Confident	68 Å²	68	82.3 Å²	82.3	42%	0.417	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.1	170.4	-56.1	0	0	0	0	108.4	A1060 M1061	T913-A1060 CarbonylContact O-C 3.56Å; T913-A1060 WeakPolarHBondContact O-CA 3.48Å; T913-M1061 WeakPolarHBondContact O-CB 3.45Å; T913-M1061 PolarHBondContact O-N 2.92Å
914	E	92.1	Very high	85.9	Confident	117 Å²	117	80.5 Å²	80.5	55%	0.547	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.1	174	-169.9	172.4	-175.6	0	0	110.2	M1061	E914-M1061 WeakPolarHBondContact CA-O 3.44Å; E914-M1061 WeakPolarHBondContact CG-O 3.34Å
915	V	93.4	Very high	86.8	Confident	23 Å²	23	72.9 Å²	72.9	14%	0.139	39%	0.385	C	S	.	.			trans	-131.3	157.9	179.8	-68.2	0	0	0	0	111.7	W923 V1036 A1060 M1061 L1062	V915-W923 HydrophobicContact CG1-CH2 3.74Å; V915-W923 HydrophobicContact CG1-CZ3 4.06Å; V915-W923 HydrophobicContact CG2-CZ3 4.38Å; V915-V1036 HydrophobicContact CG2-CG1 4.5Å; V915-A1060 HydrophobicContact CB-CB 4.21Å; V915-A1060 HydrophobicContact CG1-CB 3.54Å; V915-A1060 HydrophobicContact CG2-CB 3.63Å; V915-M1061 PolarHBondContact N-O 3.45Å; V915-L1062 HydrophobicContact CG2-CB 4.42Å; V915-L1062 WeakPolarHBondContact O-CD1 3.35Å
916	D	92.9	Very high	87.8	Confident	84 Å²	84	75.8 Å²	75.8	45%	0.449	40%	0.397	S	S	.	.			trans	-91	174.4	173.5	62.1	27.6	0	0	0	112.8	E918 T919 T920	D916-E918 PolarHBondContact OD1-N 3.49Å; D916-T919 WeakPolarHBondContact OD1-CB 3.37Å; D916-T919 PolarHBondContact OD1-N 3.33Å; D916-T919 PolarHBondContact OD1-OG1 2.66Å; D916-T920 PolarHBondContact O-N 3.28Å; D916-T920 PolarHBondContact O-OG1 3Å
917	V	93.5	Very high	88.7	Confident	20 Å²	20	66.9 Å²	66.9	12%	0.121	37%	0.365	C	S	.	.	H	α-helix	trans	-66.1	-42.2	178.7	177.2	0	0	0	0	110.6	T919 T920 V921 L1062 E1072 L1073 A1076	V917-T919 PolarHBondContact O-N 2.74Å; V917-T920 WeakPolarHBondContact O-CB 3.33Å; V917-T920 PolarHBondContact O-N 3.21Å; V917-V921 HydrophobicContact CG1-CG2 4.35Å; V917-V921 WeakPolarHBondContact O-CG2 3.33Å; V917-V921 PolarHBondContact O-N 3.25Å; V917-L1062 HydrophobicContact CG2-CD1 4.13Å; V917-E1072 HydrophobicContact CG1-CB 4.15Å; V917-E1072 HydrophobicContact CG2-CB 4.18Å; V917-L1073 HydrophobicContact CG1-CD2 3.91Å; V917-L1073 HydrophobicContact CG1-CG 4.27Å; V917-A1076 HydrophobicContact CG1-CB 4.12Å
918	E	92.9	Very high	89.7	Confident	133 Å²	133	66.6 Å²	66.6	62%	0.621	36%	0.361	S	S	*	.	H	α-helix	trans	-63.1	-44.2	-174.7	-66.1	-173.6	178.4	0	0	112.7	D916 V921 D922 K1080	D916-E918 PolarHBondContact OD1-N 3.49Å; E918-V921 PolarHBondContact O-N 3.37Å; E918-D922 PolarHBondContact O-N 3.37Å; E918-K1080 PolarHBondContact O-NZ 3.33Å; E918-K1080 VanDerWaalsContact O-NZ 3.17Å
919	T	92.5	Very high	90.7	Very high	48 Å²	48	66.2 Å²	66.2	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-42.3	175.8	-54.8	0	0	0	0	110.8	D916 V917 V921 D922 W923	D916-T919 WeakPolarHBondContact OD1-CB 3.37Å; D916-T919 PolarHBondContact OD1-N 3.33Å; D916-T919 PolarHBondContact OD1-OG1 2.66Å; V917-T919 PolarHBondContact O-N 2.74Å; T919-V921 VanDerWaalsContact C-N 3.3Å; T919-V921 PolarHBondContact O-N 3.13Å; T919-D922 PolarHBondContact O-N 2.88Å; T919-W923 HydrophobicContact CG2-CD2 4.24Å; T919-W923 HydrophobicContact CG2-CH2 4.1Å; T919-W923 HydrophobicContact CG2-CZ2 3.74Å; T919-W923 HydrophobicContact CG2-CZ3 4.46Å; T919-W923 PolarHBondContact O-N 3.4Å
920	T	94	Very high	92	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.2	-41.8	176.4	-56.9	0	0	0	0	110.9	D916 V917 W923 L924 L1001 V1036 L1062 L1073	D916-T920 PolarHBondContact O-N 3.28Å; D916-T920 PolarHBondContact O-OG1 3Å; V917-T920 WeakPolarHBondContact O-CB 3.33Å; V917-T920 PolarHBondContact O-N 3.21Å; T920-W923 PolarHBondContact O-N 3.37Å; T920-L924 HydrophobicContact CG2-CD1 4.22Å; T920-L924 VanDerWaalsContact O-CG 3.31Å; T920-L924 WeakPolarHBondContact O-CG 3.46Å; T920-L924 PolarHBondContact O-N 3.48Å; T920-L1001 HydrophobicContact CG2-CD2 4.22Å; T920-V1036 HydrophobicContact CG2-CG1 4.06Å; T920-V1036 HydrophobicContact CG2-CG2 4.29Å; T920-L1062 HydrophobicContact CG2-CD2 4.41Å; T920-L1073 HydrophobicContact CG2-CD2 3.65Å
921	V	94.6	Very high	93.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-40.2	175.8	173.8	0	0	0	0	111.9	V917 E918 T919 W923 L924 L925 L1073 A1076 V1077 K1080	V917-V921 HydrophobicContact CG1-CG2 4.35Å; V917-V921 WeakPolarHBondContact O-CG2 3.33Å; V917-V921 PolarHBondContact O-N 3.25Å; E918-V921 PolarHBondContact O-N 3.37Å; T919-V921 VanDerWaalsContact C-N 3.3Å; T919-V921 PolarHBondContact O-N 3.13Å; V921-W923 VanDerWaalsContact C-N 3.32Å; V921-W923 PolarHBondContact O-N 3.35Å; V921-L924 PolarHBondContact O-N 3.5Å; V921-L925 HydrophobicContact CG1-CD1 3.81Å; V921-L925 HydrophobicContact CG1-CG 4.13Å; V921-L925 WeakPolarHBondContact O-CG 3.45Å; V921-L925 PolarHBondContact O-N 3.24Å; V921-L1073 HydrophobicContact CG2-CD2 3.88Å; V921-A1076 HydrophobicContact CG2-CB 3.75Å; V921-V1077 HydrophobicContact CB-CG2 4.31Å; V921-V1077 HydrophobicContact CG1-CB 4.45Å; V921-V1077 HydrophobicContact CG1-CG2 3.65Å; V921-V1077 HydrophobicContact CG2-CG2 3.84Å; V921-K1080 HydrophobicContact CG1-CD 3.76Å; V921-K1080 HydrophobicContact CG1-CG 4.49Å
922	D	93.6	Very high	93.9	Very high	69 Å²	69	52 Å²	52	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-62	-40.8	176.1	-76.4	-34.5	0	0	0	112	E918 T919 N926 K1080	E918-D922 PolarHBondContact O-N 3.37Å; T919-D922 PolarHBondContact O-N 2.88Å; D922-N926 WeakPolarHBondContact O-CB 3.1Å; D922-N926 PolarHBondContact O-N 2.87Å; D922-N926 VanDerWaalsContact O-N 3.1Å; D922-N926 PolarHBondContact O-ND2 3.33Å; D922-K1080 IonicContact OD1-NZ 2.8Å; D922-K1080 PolarHBondContact OD1-NZ 3.31Å; D922-K1080 IonicContact OD2-NZ 3.48Å; D922-K1080 PolarHBondContact OD2-NZ 2.87Å
923	W	94.9	Very high	94.4	Very high	80 Å²	80	49.2 Å²	49.2	30%	0.303	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-43.1	173.5	-66	-24.4	0	0	0	112.1	V915 T919 T920 V921 N926 A927 V999 Q1034 V1036 A1060	V915-W923 HydrophobicContact CG1-CH2 3.74Å; V915-W923 HydrophobicContact CG1-CZ3 4.06Å; V915-W923 HydrophobicContact CG2-CZ3 4.38Å; T919-W923 HydrophobicContact CG2-CD2 4.24Å; T919-W923 HydrophobicContact CG2-CH2 4.1Å; T919-W923 HydrophobicContact CG2-CZ2 3.74Å; T919-W923 HydrophobicContact CG2-CZ3 4.46Å; T919-W923 PolarHBondContact O-N 3.4Å; T920-W923 PolarHBondContact O-N 3.37Å; V921-W923 VanDerWaalsContact C-N 3.32Å; V921-W923 PolarHBondContact O-N 3.35Å; W923-N926 PolarHBondContact O-N 3.12Å; W923-A927 VanDerWaalsContact O-CB 3.31Å; W923-A927 WeakPolarHBondContact O-CB 3.23Å; W923-A927 PolarHBondContact O-N 3.46Å; W923-V999 HydrophobicContact CB-CG2 4.02Å; W923-Q1034 HydrophobicContact CD2-CG 4.14Å; W923-Q1034 HydrophobicContact CE3-CG 3.82Å; W923-Q1034 HydrophobicContact CH2-CG 4.22Å; W923-Q1034 HydrophobicContact CZ3-CG 3.87Å; W923-V1036 HydrophobicContact CE3-CG2 3.82Å; W923-V1036 HydrophobicContact CZ3-CG2 3.81Å; W923-A1060 HydrophobicContact CH2-CB 4.1Å; W923-A1060 HydrophobicContact CZ3-CB 3.94Å
924	L	94.9	Very high	94.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-40.5	178.9	-70	170.9	0	0	0	112.9	T920 V921 V930 V999 L1001 L1073	T920-L924 HydrophobicContact CG2-CD1 4.22Å; T920-L924 VanDerWaalsContact O-CG 3.31Å; T920-L924 WeakPolarHBondContact O-CG 3.46Å; T920-L924 PolarHBondContact O-N 3.48Å; V921-L924 PolarHBondContact O-N 3.5Å; L924-V930 HydrophobicContact CD2-CG1 3.86Å; L924-V930 HydrophobicContact CD2-CG2 4.21Å; L924-V999 HydrophobicContact CD2-CG1 3.95Å; L924-L1001 HydrophobicContact CD1-CD1 4.08Å; L924-L1001 HydrophobicContact CD1-CD2 4.46Å; L924-L1001 HydrophobicContact CD2-CD1 3.69Å; L924-L1001 HydrophobicContact CD2-CD2 4.23Å; L924-L1001 HydrophobicContact CD2-CG 3.98Å; L924-L1073 HydrophobicContact CD1-CD2 4.49Å
925	L	93.9	Very high	94.4	Very high	35 Å²	35	41 Å²	41	18%	0.183	21%	0.207	C	C	.	.	H	α-helix	trans	-75	-25	-179.9	-71.1	179.3	0	0	0	113.3	V921 L954 V1077 K1080 I1081	V921-L925 HydrophobicContact CG1-CD1 3.81Å; V921-L925 HydrophobicContact CG1-CG 4.13Å; V921-L925 WeakPolarHBondContact O-CG 3.45Å; V921-L925 PolarHBondContact O-N 3.24Å; L925-L954 HydrophobicContact CD2-CD2 4.14Å; L925-V1077 HydrophobicContact CD2-CG1 4.39Å; L925-K1080 HydrophobicContact CD1-CB 3.69Å; L925-K1080 HydrophobicContact CD1-CD 4.13Å; L925-I1081 HydrophobicContact CD2-CD1 4.37Å; L925-I1081 HydrophobicContact CD2-CG1 4.2Å
926	N	93.5	Very high	93.8	Very high	134 Å²	134	44.3 Å²	44.3	72%	0.717	22%	0.218	S	C	*	.	H	α-helix	trans	-92.2	-9	176.6	-69.9	-53.8	0	0	0	113.7	D922 W923	D922-N926 WeakPolarHBondContact O-CB 3.1Å; D922-N926 PolarHBondContact O-N 2.87Å; D922-N926 VanDerWaalsContact O-N 3.1Å; D922-N926 PolarHBondContact O-ND2 3.33Å; W923-N926 PolarHBondContact O-N 3.12Å
927	A	94.5	Very high	93.4	Very high	8 Å²	8	41.7 Å²	41.7	7%	0.066	21%	0.211	C	C	.	.			trans	-76.7	147.7	177.8	0	0	0	0	0	112.1	W923 V930 D998 V999	W923-A927 VanDerWaalsContact O-CB 3.31Å; W923-A927 WeakPolarHBondContact O-CB 3.23Å; W923-A927 PolarHBondContact O-N 3.46Å; A927-V930 HydrophobicContact CB-CG2 3.68Å; A927-D998 HydrophobicContact CB-CB 3.87Å; A927-V999 HydrophobicContact CB-CB 4.41Å; A927-V999 HydrophobicContact CB-CG2 3.9Å
928	K	95.4	Very high	93.2	Very high	165 Å²	165	40.8 Å²	40.8	72%	0.717	21%	0.205	S	C	*	.	S	Bend	trans	-95.9	-41	168.7	-65.1	-177.8	178.8	-179.1	0	111.2	N960 D998	K928-N960 PolarHBondContact O-N 3.05Å; K928-D998 WeakPolarHBondContact CA-OD2 3.26Å; K928-D998 WeakPolarHBondContact CB-OD2 3.29Å; K928-D998 PolarHBondContact N-OD2 2.87Å
929	N	96.8	Very high	92.8	Very high	48 Å²	48	34.6 Å²	34.6	26%	0.257	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	121.1	179.6	-66.4	-51.9	0	0	0	110.6	N960 D996 D998 V999	N929-N960 WeakPolarHBondContact OD1-CB 3.41Å; N929-N960 PolarHBondContact OD1-ND2 3.28Å; N929-N960 VanDerWaalsContact OD1-ND2 3.07Å; N929-D996 PolarHBondContact ND2-O 2.86Å; N929-D998 PolarHBondContact N-OD2 3.28Å; N929-D998 PolarHBondContact O-N 3.5Å; N929-V999 PolarHBondContact O-N 3.07Å
930	V	97.6	Very high	92.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130	177.1	-178.6	0	0	0	0	109.8	L924 A927 I959 N960 V961 R962 V999	L924-V930 HydrophobicContact CD2-CG1 3.86Å; L924-V930 HydrophobicContact CD2-CG2 4.21Å; A927-V930 HydrophobicContact CB-CG2 3.68Å; V930-I959 HydrophobicContact CG2-CG2 3.84Å; V930-N960 PolarHBondContact N-O 3.2Å; V930-V961 HydrophobicContact CB-CG1 4.38Å; V930-V961 HydrophobicContact CB-CG2 4.23Å; V930-V961 HydrophobicContact CG1-CG1 4.39Å; V930-V961 WeakPolarHBondContact O-CA 3.18Å; V930-R962 PolarHBondContact O-N 3.37Å; V930-V999 VanDerWaalsContact CA-O 3.29Å; V930-V999 WeakPolarHBondContact CA-O 3.45Å; V930-V999 HydrophobicContact CG2-CB 4.45Å
931	I	98	Very high	91.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.4	172	-63.9	175.2	0	0	0	109.4	V933 R962 I990 F994 T997 V999 V1000 L1001	I931-V933 HydrophobicContact CG2-CG2 4.17Å; I931-R962 CarbonylContact C-O 3.58Å; I931-R962 WeakPolarHBondContact CA-O 3.26Å; I931-I990 HydrophobicContact CB-CD1 4.5Å; I931-I990 HydrophobicContact CD1-CD1 3.86Å; I931-I990 HydrophobicContact CD1-CG1 3.9Å; I931-I990 HydrophobicContact CG1-CD1 4.08Å; I931-I990 HydrophobicContact CG2-CD1 3.63Å; I931-F994 HydrophobicContact CB-CE1 4.27Å; I931-F994 HydrophobicContact CD1-CD1 3.99Å; I931-F994 HydrophobicContact CD1-CE1 3.97Å; I931-F994 HydrophobicContact CG2-CE1 3.84Å; I931-F994 HydrophobicContact CG2-CZ 4.16Å; I931-T997 HydrophobicContact CB-CG2 4.13Å; I931-T997 HydrophobicContact CD1-CG2 3.92Å; I931-T997 WeakPolarHBondContact CD1-OG1 3.44Å; I931-T997 HydrophobicContact CG1-CG2 3.8Å; I931-V999 PolarHBondContact N-O 3.42Å; I931-V1000 HydrophobicContact CB-CG2 4.33Å; I931-V1000 CarbonylContact O-C 3.54Å; I931-V1000 VanDerWaalsContact O-CA 3.23Å; I931-V1000 WeakPolarHBondContact O-CA 3.24Å; I931-L1001 PolarHBondContact O-N 2.86Å
932	I	97.2	Very high	91.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.2	173.2	-54.9	-176.1	0	0	0	108.7	P934 I947 V951 V961 R962 F963 G964 L1001 I1003	I932-P934 VanDerWaalsContact O-CD 3.29Å; I932-P934 WeakPolarHBondContact O-CD 3.39Å; I932-I947 HydrophobicContact CD1-CG2 4.14Å; I932-V951 HydrophobicContact CD1-CG2 3.47Å; I932-V951 VanDerWaalsContact CD1-CG2 3.47Å; I932-V961 HydrophobicContact CD1-CG1 4.02Å; I932-V961 HydrophobicContact CG1-CG1 4.21Å; I932-R962 PolarHBondContact N-O 2.97Å; I932-F963 HydrophobicContact CB-CD1 3.77Å; I932-F963 HydrophobicContact CB-CE1 3.84Å; I932-F963 HydrophobicContact CB-CG 4.41Å; I932-F963 HydrophobicContact CD1-CE1 4.14Å; I932-F963 HydrophobicContact CD1-CZ 4.1Å; I932-F963 HydrophobicContact CG2-CD1 3.87Å; I932-F963 HydrophobicContact CG2-CE1 3.69Å; I932-F963 CarbonylContact O-C 3.3Å; I932-F963 VanDerWaalsContact O-CA 3.25Å; I932-F963 WeakPolarHBondContact O-CA 3.16Å; I932-G964 PolarHBondContact O-N 2.84Å; I932-L1001 CarbonylContact C-O 3.33Å; I932-L1001 WeakPolarHBondContact CA-O 3.48Å; I932-L1001 HydrophobicContact CD1-CD1 4.33Å; I932-L1001 HydrophobicContact CG1-CB 4.24Å; I932-L1001 HydrophobicContact CG1-CD1 4.2Å; I932-L1001 HydrophobicContact CG2-CB 4.47Å; I932-I1003 HydrophobicContact CG2-CD1 3.91Å; I932-I1003 HydrophobicContact CG2-CG1 4.4Å
933	V	96.4	Very high	91.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	95	175.3	179	0	0	0	0	109.2	I931 G964 F994 V1000 L1001 V1002 I1003 A1005 V1009 L1027 V1029	I931-V933 HydrophobicContact CG2-CG2 4.17Å; V933-G964 WeakPolarHBondContact CA-O 3.43Å; V933-F994 HydrophobicContact CG2-CE1 4.43Å; V933-F994 HydrophobicContact CG2-CZ 4.23Å; V933-V1000 HydrophobicContact CG2-CG1 4.01Å; V933-L1001 PolarHBondContact N-O 3.32Å; V933-V1002 HydrophobicContact CB-CG2 4.37Å; V933-I1003 PolarHBondContact O-N 3.42Å; V933-A1005 HydrophobicContact CG1-CB 4.36Å; V933-V1009 HydrophobicContact CG1-CG1 3.65Å; V933-L1027 HydrophobicContact CB-CD1 4.36Å; V933-L1027 HydrophobicContact CG1-CD1 3.4Å; V933-L1027 HydrophobicContact CG2-CD1 4.08Å; V933-V1029 HydrophobicContact CG2-CG1 3.82Å
934	P	93.5	Very high	91.4	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.9	179.6	32.9	-33	0	0	0	110.4	I932 L938 F963 G964 R965 L970 L974	I932-P934 VanDerWaalsContact O-CD 3.29Å; I932-P934 WeakPolarHBondContact O-CD 3.39Å; P934-L938 HydrophobicContact CB-CD1 4.05Å; P934-F963 HydrophobicContact CG-CD1 4.12Å; P934-G964 WeakPolarHBondContact CD-O 3.34Å; P934-R965 HydrophobicContact CG-CB 4.45Å; P934-L970 WeakPolarHBondContact O-CD1 3.26Å; P934-L974 HydrophobicContact CG-CD1 4.18Å
935	G	88.3	Confident	91.3	Very high	7 Å²	7	40.6 Å²	40.6	7%	0.072	21%	0.209	C	C	.	.			trans	-114.6	179.4	165.7	0	0	0	0	0	111.8	G937 L938 I1003 G1004	G935-G937 PolarHBondContact O-N 3.42Å; G935-G937 VanDerWaalsContact O-N 3.1Å; G935-L938 WeakPolarHBondContact O-CB 3.31Å; G935-L938 PolarHBondContact O-N 2.83Å; G935-L938 VanDerWaalsContact O-N 3.08Å; G935-I1003 PolarHBondContact N-O 2.84Å; G935-G1004 WeakPolarHBondContact CA-O 3.45Å
936	Y	80.5	Confident	91.4	Very high	94 Å²	94	39.2 Å²	39.2	37%	0.369	20%	0.202	S	C	.	.	H	α-helix	trans	-57.1	-29	178.3	-168.1	-104.5	0	0	0	113	R831 L938 C939 A940	R831-Y936 PolarHBondContact NH1-OH 3.49Å; Y936-L938 VanDerWaalsContact C-N 3.27Å; Y936-L938 PolarHBondContact O-N 2.87Å; Y936-C939 PolarHBondContact O-N 3.44Å; Y936-A940 HydrophobicContact CD1-CB 4.2Å; Y936-A940 HydrophobicContact CE1-CB 4.05Å; Y936-A940 WeakPolarHBondContact O-CB 3.24Å; Y936-A940 PolarHBondContact O-N 3.15Å
937	G	84.5	Confident	91.5	Very high	29 Å²	29	32.8 Å²	32.8	30%	0.299	17%	0.168	S	C	.	.	H	α-helix	trans	-61.5	-30.4	177.7	0	0	0	0	0	114.3	G935 A941 G1004	G935-G937 PolarHBondContact O-N 3.42Å; G935-G937 VanDerWaalsContact O-N 3.1Å; G937-A941 WeakPolarHBondContact O-CB 3.13Å; G937-A941 PolarHBondContact O-N 3.41Å; G937-G1004 PolarHBondContact N-O 3.37Å
938	L	89.9	Confident	91.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-48.6	175.3	174.9	151.6	0	0	0	110.6	P934 G935 Y936 A941 R942 A943 Q944 I947 I1003	P934-L938 HydrophobicContact CB-CD1 4.05Å; G935-L938 WeakPolarHBondContact O-CB 3.31Å; G935-L938 PolarHBondContact O-N 2.83Å; G935-L938 VanDerWaalsContact O-N 3.08Å; Y936-L938 VanDerWaalsContact C-N 3.27Å; Y936-L938 PolarHBondContact O-N 2.87Å; L938-A941 PolarHBondContact O-N 3.42Å; L938-R942 PolarHBondContact O-N 3.38Å; L938-A943 HydrophobicContact CG-CB 4.25Å; L938-A943 WeakPolarHBondContact O-CB 3.22Å; L938-A943 PolarHBondContact O-N 2.65Å; L938-Q944 HydrophobicContact CD2-CB 3.6Å; L938-I947 HydrophobicContact CD1-CG1 4.11Å; L938-I1003 HydrophobicContact CB-CB 4.43Å; L938-I1003 HydrophobicContact CB-CG2 3.98Å; L938-I1003 HydrophobicContact CD1-CB 3.92Å; L938-I1003 HydrophobicContact CD1-CD1 4.03Å; L938-I1003 HydrophobicContact CD1-CG2 3.87Å; L938-I1003 HydrophobicContact CG-CG2 4.29Å
939	C	84.4	Confident	91.4	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.027	16%	0.156	C	C	.	.	H	α-helix	trans	-72.7	-38.5	-178.3	-61.3	0	0	0	0	112.7	Y936 A941 R942 L970 L973	Y936-C939 PolarHBondContact O-N 3.44Å; C939-A941 PolarHBondContact O-N 3.2Å; C939-R942 PolarHBondContact O-N 2.92Å; C939-L970 VanDerWaalsContact SG-CD2 3.51Å; C939-L973 HydrophobicContact CB-CD1 3.7Å; C939-L973 VanDerWaalsContact SG-CD1 3.56Å
940	A	80.4	Confident	91.3	Very high	67 Å²	67	27.2 Å²	27.2	55%	0.554	14%	0.144	S	C	*	.	H	α-helix	trans	-61.3	-31.2	176.2	0	0	0	0	0	112.3	Y936 R942	Y936-A940 HydrophobicContact CD1-CB 4.2Å; Y936-A940 HydrophobicContact CE1-CB 4.05Å; Y936-A940 WeakPolarHBondContact O-CB 3.24Å; Y936-A940 PolarHBondContact O-N 3.15Å; A940-R942 VanDerWaalsContact C-N 3.33Å
941	A	87.1	Confident	91.2	Very high	23 Å²	23	27.5 Å²	27.5	19%	0.19	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-0.2	174.1	0	0	0	0	0	113.8	G937 L938 C939 A943 A1066 K1067	G937-A941 WeakPolarHBondContact O-CB 3.13Å; G937-A941 PolarHBondContact O-N 3.41Å; L938-A941 PolarHBondContact O-N 3.42Å; C939-A941 PolarHBondContact O-N 3.2Å; A941-A943 HydrophobicContact CB-CB 4.33Å; A941-A943 PolarHBondContact O-N 2.98Å; A941-A1066 HydrophobicContact CB-CB 3.94Å; A941-K1067 HydrophobicContact CB-CB 4.26Å; A941-K1067 WeakPolarHBondContact O-CB 3.06Å
942	R	87.8	Confident	91	Very high	126 Å²	126	30.1 Å²	30.1	48%	0.475	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	33.9	-170.5	-56.7	-174	-178.3	-148.8	-5.6	113.1	E686 L938 C939 A940 K1067	E686-R942 IonicContact OE1-NH1 3.23Å; E686-R942 IonicContact OE1-NH2 3.4Å; E686-R942 IonicContact OE2-CZ 3.57Å; E686-R942 IonicContact OE2-NH1 3.83Å; E686-R942 IonicContact OE2-NH2 3.8Å; E686-R942 PolarHBondContact OE2-NH2 3.17Å; L938-R942 PolarHBondContact O-N 3.38Å; C939-R942 PolarHBondContact O-N 2.92Å; A940-R942 VanDerWaalsContact C-N 3.33Å; R942-K1067 WeakPolarHBondContact O-CD 3.17Å
943	A	92.8	Very high	90.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.17	C	C	.	.			trans	-88.3	0.4	-176.8	0	0	0	0	0	113.6	L938 A941 Y945 P946 I947 A1066 K1067 C1070	L938-A943 HydrophobicContact CG-CB 4.25Å; L938-A943 WeakPolarHBondContact O-CB 3.22Å; L938-A943 PolarHBondContact O-N 2.65Å; A941-A943 HydrophobicContact CB-CB 4.33Å; A941-A943 PolarHBondContact O-N 2.98Å; A943-Y945 VanDerWaalsContact C-N 3.33Å; A943-Y945 PolarHBondContact O-N 3.23Å; A943-P946 VanDerWaalsContact O-CD 3.31Å; A943-P946 WeakPolarHBondContact O-CD 3.16Å; A943-P946 VanDerWaalsContact O-CG 3.32Å; A943-P946 WeakPolarHBondContact O-CG 3.42Å; A943-I947 WeakPolarHBondContact O-CG1 3.47Å; A943-I947 PolarHBondContact O-N 2.88Å; A943-A1066 HydrophobicContact CB-CB 4.28Å; A943-K1067 HydrophobicContact CB-CB 4.43Å; A943-K1067 HydrophobicContact CB-CD 4.29Å; A943-C1070 HydrophobicContact CB-CB 4.36Å
944	Q	91.3	Very high	90.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-35.3	176.4	63.1	-84.5	17.5	0	0	113.3	L938 I947 A948 A977	L938-Q944 HydrophobicContact CD2-CB 3.6Å; Q944-I947 PolarHBondContact O-N 3.07Å; Q944-A948 WeakPolarHBondContact O-CB 3.39Å; Q944-A948 PolarHBondContact O-N 3.38Å; Q944-A977 HydrophobicContact CB-CB 3.78Å; Q944-A977 HydrophobicContact CG-CB 3.66Å
945	Y	93.7	Very high	90.8	Very high	104 Å²	104	35.7 Å²	35.7	41%	0.408	19%	0.186	S	C	.	.	H	α-helix	trans	-65.7	-53.7	-179.2	-54	-77.9	0	0	0	113.6	A943 I947 A948 E949 E976 A977	A943-Y945 VanDerWaalsContact C-N 3.33Å; A943-Y945 PolarHBondContact O-N 3.23Å; Y945-I947 PolarHBondContact O-N 3.4Å; Y945-A948 PolarHBondContact O-N 3.29Å; Y945-E949 PolarHBondContact O-N 2.95Å; Y945-E949 VanDerWaalsContact O-N 3.16Å; Y945-E976 PolarHBondContact OH-OE1 3.14Å; Y945-E976 VanDerWaalsContact OH-OE1 3.14Å; Y945-A977 HydrophobicContact CD1-CB 4.19Å
946	P	95.3	Very high	91.1	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.039	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-30.5	176.7	25.1	-35.3	0	0	0	112.4	A943 E949 L950 K1067 C1070 D1071 L1074	A943-P946 VanDerWaalsContact O-CD 3.31Å; A943-P946 WeakPolarHBondContact O-CD 3.16Å; A943-P946 VanDerWaalsContact O-CG 3.32Å; A943-P946 WeakPolarHBondContact O-CG 3.42Å; P946-E949 PolarHBondContact O-N 3.07Å; P946-L950 WeakPolarHBondContact O-CB 3.45Å; P946-L950 PolarHBondContact O-N 3.4Å; P946-K1067 HydrophobicContact CG-CD 4.2Å; P946-C1070 HydrophobicContact CB-CB 4.27Å; P946-C1070 HydrophobicContact CG-CB 3.86Å; P946-D1071 VanDerWaalsContact CB-OD1 3.26Å; P946-D1071 WeakPolarHBondContact CB-OD1 3.4Å; P946-D1071 WeakPolarHBondContact CG-OD1 3.41Å; P946-L1074 HydrophobicContact CB-CD2 4.04Å
947	I	95.2	Very high	91.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-42.6	174.6	-72.7	-61.3	0	0	0	111.8	I932 L938 A943 Q944 Y945 E949 L950 V951 F963 I1003 C1070	I932-I947 HydrophobicContact CD1-CG2 4.14Å; L938-I947 HydrophobicContact CD1-CG1 4.11Å; A943-I947 WeakPolarHBondContact O-CG1 3.47Å; A943-I947 PolarHBondContact O-N 2.88Å; Q944-I947 PolarHBondContact O-N 3.07Å; Y945-I947 PolarHBondContact O-N 3.4Å; I947-E949 VanDerWaalsContact C-N 3.27Å; I947-E949 PolarHBondContact O-N 3.01Å; I947-L950 HydrophobicContact CD1-CD2 3.96Å; I947-L950 WeakPolarHBondContact O-CB 3.4Å; I947-L950 PolarHBondContact O-N 3.43Å; I947-V951 HydrophobicContact CG2-CG2 4.41Å; I947-V951 WeakPolarHBondContact O-CG2 3.38Å; I947-V951 PolarHBondContact O-N 3.3Å; I947-F963 HydrophobicContact CG2-CE1 3.82Å; I947-F963 HydrophobicContact CG2-CZ 3.75Å; I947-I1003 HydrophobicContact CD1-CD1 3.5Å; I947-I1003 HydrophobicContact CG1-CD1 3.93Å; I947-C1070 HydrophobicContact CD1-CB 4.02Å; I947-C1070 VanDerWaalsContact CD1-SG 3.51Å; I947-C1070 HydrophobicContact CG1-CB 4.03Å; I947-C1070 WeakPolarHBondContact CG1-SG 3.26Å
948	A	94	Very high	92	Very high	14 Å²	14	49.9 Å²	49.9	12%	0.116	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-40.8	175.3	0	0	0	0	0	111.7	Q944 Y945 V951 S952 A977 V979	Q944-A948 WeakPolarHBondContact O-CB 3.39Å; Q944-A948 PolarHBondContact O-N 3.38Å; Y945-A948 PolarHBondContact O-N 3.29Å; A948-V951 PolarHBondContact O-N 2.84Å; A948-S952 PolarHBondContact O-N 3.24Å; A948-A977 HydrophobicContact CB-CB 3.94Å; A948-A977 WeakPolarHBondContact CB-O 3.36Å; A948-V979 HydrophobicContact CB-CG2 3.66Å
949	E	94.8	Very high	92.2	Very high	90 Å²	90	50.5 Å²	50.5	42%	0.421	25%	0.247	S	C	.	.	H	α-helix	trans	-68.3	-39.7	175.5	-166.2	177.3	175.7	0	0	112.6	Y945 P946 I947 S952 T953 L1074 K1078	Y945-E949 PolarHBondContact O-N 2.95Å; Y945-E949 VanDerWaalsContact O-N 3.16Å; P946-E949 PolarHBondContact O-N 3.07Å; I947-E949 VanDerWaalsContact C-N 3.27Å; I947-E949 PolarHBondContact O-N 3.01Å; E949-S952 PolarHBondContact O-N 3.04Å; E949-T953 WeakPolarHBondContact O-CB 3.31Å; E949-T953 PolarHBondContact O-N 2.96Å; E949-T953 PolarHBondContact O-OG1 3.05Å; E949-L1074 HydrophobicContact CB-CD1 4.21Å; E949-L1074 HydrophobicContact CB-CD2 4.09Å; E949-L1074 HydrophobicContact CG-CD1 4.08Å; E949-L1074 HydrophobicContact CG-CD2 4.25Å; E949-L1074 WeakPolarHBondContact OE2-CD2 3.38Å; E949-K1078 VanDerWaalsContact OE1-CE 3.25Å; E949-K1078 WeakPolarHBondContact OE1-CE 3.37Å; E949-K1078 IonicContact OE1-NZ 3.79Å; E949-K1078 PolarHBondContact OE1-NZ 2.84Å; E949-K1078 IonicContact OE2-NZ 3.66Å
950	L	95.6	Very high	92.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-47	174	175.1	62.5	0	0	0	110.8	P946 I947 S952 T953 L954 L1073 L1074 V1077	P946-L950 WeakPolarHBondContact O-CB 3.45Å; P946-L950 PolarHBondContact O-N 3.4Å; I947-L950 HydrophobicContact CD1-CD2 3.96Å; I947-L950 WeakPolarHBondContact O-CB 3.4Å; I947-L950 PolarHBondContact O-N 3.43Å; L950-S952 PolarHBondContact O-N 3.31Å; L950-T953 PolarHBondContact O-N 3.47Å; L950-L954 HydrophobicContact CD1-CD1 4.04Å; L950-L954 HydrophobicContact CD1-CG 4.11Å; L950-L954 HydrophobicContact CG-CD1 4.09Å; L950-L954 WeakPolarHBondContact O-CG 3.33Å; L950-L954 PolarHBondContact O-N 2.93Å; L950-L1073 HydrophobicContact CD2-CB 4.48Å; L950-L1074 HydrophobicContact CB-CD1 4.09Å; L950-V1077 HydrophobicContact CD1-CB 4.03Å; L950-V1077 HydrophobicContact CD1-CG1 4.06Å; L950-V1077 HydrophobicContact CD1-CG2 3.73Å
951	V	95.5	Very high	93.6	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-45.6	176.6	171	0	0	0	0	111.3	I932 I947 A948 T953 L954 R955 V961 F963 I983	I932-V951 HydrophobicContact CD1-CG2 3.47Å; I932-V951 VanDerWaalsContact CD1-CG2 3.47Å; I947-V951 HydrophobicContact CG2-CG2 4.41Å; I947-V951 WeakPolarHBondContact O-CG2 3.38Å; I947-V951 PolarHBondContact O-N 3.3Å; A948-V951 PolarHBondContact O-N 2.84Å; V951-T953 VanDerWaalsContact C-N 3.29Å; V951-T953 PolarHBondContact O-N 3.3Å; V951-L954 PolarHBondContact O-N 2.83Å; V951-R955 HydrophobicContact CG1-CG 4.32Å; V951-R955 WeakPolarHBondContact O-CB 3.24Å; V951-R955 WeakPolarHBondContact O-CG 3.19Å; V951-R955 PolarHBondContact O-N 3.4Å; V951-V961 HydrophobicContact CB-CG1 4.37Å; V951-V961 HydrophobicContact CG1-CB 4.14Å; V951-V961 HydrophobicContact CG1-CG1 4.03Å; V951-V961 HydrophobicContact CG2-CG1 3.77Å; V951-F963 HydrophobicContact CB-CE2 4.44Å; V951-F963 HydrophobicContact CG1-CE2 4.26Å; V951-F963 HydrophobicContact CG2-CE2 3.72Å; V951-F963 HydrophobicContact CG2-CZ 3.61Å; V951-I983 HydrophobicContact CG1-CD1 3.73Å
952	S	93.6	Very high	94	Very high	56 Å²	56	51.2 Å²	51.2	39%	0.392	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-43.1	175.3	-173.1	0	0	0	0	111.7	A948 E949 L950 K956	A948-S952 PolarHBondContact O-N 3.24Å; E949-S952 PolarHBondContact O-N 3.04Å; L950-S952 PolarHBondContact O-N 3.31Å; S952-K956 WeakPolarHBondContact O-CG 3.48Å; S952-K956 PolarHBondContact O-N 2.89Å; S952-K956 VanDerWaalsContact O-N 3.11Å
953	T	94.3	Very high	94.3	Very high	22 Å²	22	45.2 Å²	45.2	14%	0.135	21%	0.213	C	C	.	.	H	α-helix	trans	-66.2	-43.5	-179.2	-56.7	0	0	0	0	112.1	E949 L950 V951 K956 V1077 I1081	E949-T953 WeakPolarHBondContact O-CB 3.31Å; E949-T953 PolarHBondContact O-N 2.96Å; E949-T953 PolarHBondContact O-OG1 3.05Å; L950-T953 PolarHBondContact O-N 3.47Å; V951-T953 VanDerWaalsContact C-N 3.29Å; V951-T953 PolarHBondContact O-N 3.3Å; T953-K956 PolarHBondContact O-N 3.5Å; T953-V1077 HydrophobicContact CG2-CG1 4.02Å; T953-I1081 HydrophobicContact CG2-CD1 3.49Å; T953-I1081 VanDerWaalsContact CG2-CD1 3.49Å
954	L	94.9	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68	-42.8	176.8	-67.7	174.3	0	0	0	111.9	L925 L950 V951 K956 R957 I959 V961 V1077	L925-L954 HydrophobicContact CD2-CD2 4.14Å; L950-L954 HydrophobicContact CD1-CD1 4.04Å; L950-L954 HydrophobicContact CD1-CG 4.11Å; L950-L954 HydrophobicContact CG-CD1 4.09Å; L950-L954 WeakPolarHBondContact O-CG 3.33Å; L950-L954 PolarHBondContact O-N 2.93Å; V951-L954 PolarHBondContact O-N 2.83Å; L954-K956 VanDerWaalsContact C-N 3.27Å; L954-K956 PolarHBondContact O-N 2.85Å; L954-R957 PolarHBondContact O-N 2.81Å; L954-I959 HydrophobicContact CB-CB 4.36Å; L954-I959 HydrophobicContact CB-CD1 4.29Å; L954-I959 HydrophobicContact CD2-CD1 3.8Å; L954-I959 WeakPolarHBondContact O-CB 3.36Å; L954-I959 PolarHBondContact O-N 3.44Å; L954-V961 HydrophobicContact CB-CG2 3.72Å; L954-V961 HydrophobicContact CD1-CG2 4.15Å; L954-V1077 HydrophobicContact CD2-CG1 4.23Å
955	R	93.8	Very high	93.7	Very high	100 Å²	100	45.3 Å²	45.3	38%	0.377	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-32.2	177.9	-73.9	-175.9	72	-177.2	6.3	112.7	V951 R957 N958 V961 I983	V951-R955 HydrophobicContact CG1-CG 4.32Å; V951-R955 WeakPolarHBondContact O-CB 3.24Å; V951-R955 WeakPolarHBondContact O-CG 3.19Å; V951-R955 PolarHBondContact O-N 3.4Å; R955-R957 PolarHBondContact O-N 2.96Å; R955-N958 PolarHBondContact O-N 3.34Å; R955-V961 HydrophobicContact CG-CB 4.16Å; R955-V961 HydrophobicContact CG-CG2 4.27Å; R955-I983 VanDerWaalsContact NH1-CG2 3.3Å
956	K	93.3	Very high	92.6	Very high	166 Å²	166	41.8 Å²	41.8	72%	0.722	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.1	172.3	-75.7	172.4	-175.5	177.1	0	113.4	S952 T953 L954	S952-K956 WeakPolarHBondContact O-CG 3.48Å; S952-K956 PolarHBondContact O-N 2.89Å; S952-K956 VanDerWaalsContact O-N 3.11Å; T953-K956 PolarHBondContact O-N 3.5Å; L954-K956 VanDerWaalsContact C-N 3.27Å; L954-K956 PolarHBondContact O-N 2.85Å
957	R	91.4	Very high	90.8	Very high	105 Å²	105	44.1 Å²	44.1	40%	0.396	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	19	173.5	-58.3	-169	94.3	169.8	13.4	113.4	L954 R955 I959 S1084	L954-R957 PolarHBondContact O-N 2.81Å; R955-R957 PolarHBondContact O-N 2.96Å; R957-I959 HydrophobicContact CB-CD1 4.41Å; R957-I959 HydrophobicContact CB-CG1 4.4Å; R957-I959 PolarHBondContact O-N 2.83Å; R957-S1084 PolarHBondContact NH2-OG 3.47Å
958	N	92.6	Very high	89.3	Confident	157 Å²	157	45.4 Å²	45.4	84%	0.84	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	24.7	-176.2	-60.3	-45	0	0	0	114.4	R955	R955-N958 PolarHBondContact O-N 3.34Å
959	I	95.1	Very high	88.2	Confident	13 Å²	13	46.8 Å²	46.8	7%	0.067	23%	0.233	C	C	.	.			trans	-81.5	126.5	169.2	-57.1	170.2	0	0	0	107.6	V930 L954 R957 V961	V930-I959 HydrophobicContact CG2-CG2 3.84Å; L954-I959 HydrophobicContact CB-CB 4.36Å; L954-I959 HydrophobicContact CB-CD1 4.29Å; L954-I959 HydrophobicContact CD2-CD1 3.8Å; L954-I959 WeakPolarHBondContact O-CB 3.36Å; L954-I959 PolarHBondContact O-N 3.44Å; R957-I959 HydrophobicContact CB-CD1 4.41Å; R957-I959 HydrophobicContact CB-CG1 4.4Å; R957-I959 PolarHBondContact O-N 2.83Å; I959-V961 HydrophobicContact CB-CG2 4.33Å; I959-V961 HydrophobicContact CG2-CG2 3.86Å; I959-V961 PolarHBondContact O-N 2.79Å; I959-V961 VanDerWaalsContact O-N 3.16Å
960	N	96.1	Very high	87.5	Confident	68 Å²	68	43.8 Å²	43.8	36%	0.364	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	99.2	178.2	179.8	27.3	0	0	0	109.7	K928 N929 V930	K928-N960 PolarHBondContact O-N 3.05Å; N929-N960 WeakPolarHBondContact OD1-CB 3.41Å; N929-N960 PolarHBondContact OD1-ND2 3.28Å; N929-N960 VanDerWaalsContact OD1-ND2 3.07Å; V930-N960 PolarHBondContact N-O 3.2Å
961	V	96.8	Very high	87	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.9	-179.3	-169.3	0	0	0	0	110.7	V930 I932 V951 L954 R955 I959	V930-V961 HydrophobicContact CB-CG1 4.38Å; V930-V961 HydrophobicContact CB-CG2 4.23Å; V930-V961 HydrophobicContact CG1-CG1 4.39Å; V930-V961 WeakPolarHBondContact O-CA 3.18Å; I932-V961 HydrophobicContact CD1-CG1 4.02Å; I932-V961 HydrophobicContact CG1-CG1 4.21Å; V951-V961 HydrophobicContact CB-CG1 4.37Å; V951-V961 HydrophobicContact CG1-CB 4.14Å; V951-V961 HydrophobicContact CG1-CG1 4.03Å; V951-V961 HydrophobicContact CG2-CG1 3.77Å; L954-V961 HydrophobicContact CB-CG2 3.72Å; L954-V961 HydrophobicContact CD1-CG2 4.15Å; R955-V961 HydrophobicContact CG-CB 4.16Å; R955-V961 HydrophobicContact CG-CG2 4.27Å; I959-V961 HydrophobicContact CB-CG2 4.33Å; I959-V961 HydrophobicContact CG2-CG2 3.86Å; I959-V961 PolarHBondContact O-N 2.79Å; I959-V961 VanDerWaalsContact O-N 3.16Å
962	R	96.4	Very high	86.4	Confident	42 Å²	42	43.8 Å²	43.8	16%	0.158	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.6	-179.2	-60	-179.8	-66.6	161	1.6	110.9	V930 I931 I932 I983 I990 D993	V930-R962 PolarHBondContact O-N 3.37Å; I931-R962 CarbonylContact C-O 3.58Å; I931-R962 WeakPolarHBondContact CA-O 3.26Å; I932-R962 PolarHBondContact N-O 2.97Å; R962-I983 CarbonylContact C-O 3.57Å; R962-I990 HydrophobicContact CB-CD1 4.48Å; R962-D993 IonicContact CZ-OD2 2.61Å; R962-D993 IonicContact NH1-OD2 3.64Å; R962-D993 PolarHBondContact NH1-OD2 2.92Å; R962-D993 IonicContact NH2-OD2 3.25Å; R962-D993 PolarHBondContact NH2-OD2 3.26Å
963	F	94.8	Very high	86	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.6	173.5	-69.4	-97.4	0	0	0	110.1	I932 P934 I947 V951 L974 V979 I983 V984 L985	I932-F963 HydrophobicContact CB-CD1 3.77Å; I932-F963 HydrophobicContact CB-CE1 3.84Å; I932-F963 HydrophobicContact CB-CG 4.41Å; I932-F963 HydrophobicContact CD1-CE1 4.14Å; I932-F963 HydrophobicContact CD1-CZ 4.1Å; I932-F963 HydrophobicContact CG2-CD1 3.87Å; I932-F963 HydrophobicContact CG2-CE1 3.69Å; I932-F963 CarbonylContact O-C 3.3Å; I932-F963 VanDerWaalsContact O-CA 3.25Å; I932-F963 WeakPolarHBondContact O-CA 3.16Å; P934-F963 HydrophobicContact CG-CD1 4.12Å; I947-F963 HydrophobicContact CG2-CE1 3.82Å; I947-F963 HydrophobicContact CG2-CZ 3.75Å; V951-F963 HydrophobicContact CB-CE2 4.44Å; V951-F963 HydrophobicContact CG1-CE2 4.26Å; V951-F963 HydrophobicContact CG2-CE2 3.72Å; V951-F963 HydrophobicContact CG2-CZ 3.61Å; F963-L974 HydrophobicContact CD1-CD1 4.07Å; F963-L974 HydrophobicContact CD1-CD2 4.22Å; F963-L974 HydrophobicContact CE1-CD2 3.88Å; F963-L974 HydrophobicContact CG-CD1 4.3Å; F963-L974 HydrophobicContact CZ-CD2 4.33Å; F963-V979 HydrophobicContact CD2-CG1 3.78Å; F963-V979 HydrophobicContact CE2-CB 4.47Å; F963-V979 HydrophobicContact CE2-CG1 3.44Å; F963-V979 VanDerWaalsContact CE2-CG1 3.44Å; F963-V979 HydrophobicContact CE2-CG2 4.14Å; F963-V979 HydrophobicContact CZ-CG1 4.22Å; F963-V979 HydrophobicContact CZ-CG2 4.14Å; F963-I983 HydrophobicContact CD2-CD1 4.21Å; F963-I983 HydrophobicContact CD2-CG1 4.49Å; F963-I983 HydrophobicContact CE2-CD1 4.15Å; F963-I983 PolarHBondContact N-O 2.88Å; F963-V984 HydrophobicContact CB-CB 4.5Å; F963-V984 HydrophobicContact CB-CG1 4.42Å; F963-V984 HydrophobicContact CB-CG2 4.25Å; F963-V984 HydrophobicContact CD2-CG2 4.23Å; F963-V984 HydrophobicContact CG-CG2 4.45Å; F963-L985 PolarHBondContact O-N 2.77Å
964	G	87.9	Confident	85.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.7	169.5	0	0	0	0	0	110.4	I932 V933 P934 L1027	I932-G964 PolarHBondContact O-N 2.84Å; V933-G964 WeakPolarHBondContact CA-O 3.43Å; P934-G964 WeakPolarHBondContact CD-O 3.34Å; G964-L1027 WeakPolarHBondContact O-CD1 3.46Å
965	R	82.6	Confident	85.5	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.015	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	169.2	-177.2	60.5	161.6	178.3	90.6	2	112.5	P934 L970 N971 V984 L985 E986 M987	P934-R965 HydrophobicContact CG-CB 4.45Å; R965-L970 HydrophobicContact CB-CD1 4.46Å; R965-N971 WeakPolarHBondContact CD-OD1 3.34Å; R965-N971 VanDerWaalsContact CZ-ND2 3.28Å; R965-N971 VanDerWaalsContact NE-CG 3.34Å; R965-N971 PolarHBondContact NE-OD1 2.95Å; R965-N971 VanDerWaalsContact NH1-CG 3.33Å; R965-N971 PolarHBondContact NH1-ND2 3.34Å; R965-N971 PolarHBondContact NH1-OD1 2.94Å; R965-N971 PolarHBondContact NH2-ND2 3.43Å; R965-N971 VanDerWaalsContact NH2-ND2 3.14Å; R965-N971 PolarHBondContact NH2-OD1 3.04Å; R965-V984 HydrophobicContact CG-CG1 4.38Å; R965-L985 PolarHBondContact N-O 2.92Å; R965-E986 VanDerWaalsContact CZ-CD 3.47Å; R965-E986 IonicContact CZ-OE1 3.61Å; R965-E986 IonicContact CZ-OE2 3.44Å; R965-E986 IonicContact NH1-OE1 2.67Å; R965-E986 PolarHBondContact NH1-OE1 3.28Å; R965-E986 IonicContact NH1-OE2 3.57Å; R965-E986 PolarHBondContact NH1-OE2 3.38Å; R965-E986 IonicContact NH2-OE1 2.99Å; R965-E986 PolarHBondContact NH2-OE1 3.16Å; R965-E986 IonicContact NH2-OE2 3.48Å; R965-M987 PolarHBondContact O-N 2.7Å
966	M	70	Confident	85.3	Confident	29 Å²	29	38.7 Å²	38.7	14%	0.143	19%	0.194	C	C	.	.			trans	-83	159.5	160.9	-77.2	-166.7	-174.6	0	0	111.7	G968 M987 T1008 M1024 P1025	M966-G968 PolarHBondContact O-N 3.23Å; M966-M987 HydrophobicContact CE-SD 4.29Å; M966-T1008 HydrophobicContact CE-CG2 3.7Å; M966-T1008 HydrophobicContact CG-CG2 4.17Å; M966-T1008 HydrophobicContact SD-CG2 3.53Å; M966-T1008 VanDerWaalsContact SD-CG2 3.53Å; M966-M1024 HydrophobicContact CE-CE 3.51Å; M966-M1024 HydrophobicContact SD-CE 3.93Å; M966-P1025 WeakPolarHBondContact CE-O 3.41Å
967	P	58.6	Low	85.1	Confident	56 Å²	56	31.6 Å²	31.6	36%	0.364	17%	0.167	S	C	.	.	S	Bend	trans	-53.6	135.4	169.5	-26	34.6	0	0	0	111.7
968	G	64.1	Low	85	Confident	26 Å²	26	29.4 Å²	29.4	27%	0.268	18%	0.176	S	C	.	.	S	Bend	trans	158.9	-157.6	175.1	0	0	0	0	0	115.4	M966 L970 N971	M966-G968 PolarHBondContact O-N 3.23Å; G968-L970 VanDerWaalsContact C-N 3.29Å; G968-L970 PolarHBondContact O-N 3.14Å; G968-N971 VanDerWaalsContact O-CG 3.23Å; G968-N971 PolarHBondContact O-ND2 3.32Å; G968-N971 PolarHBondContact O-OD1 2.9Å; G968-N971 VanDerWaalsContact O-OD1 3.08Å
969	Q	69.8	Low	85	Confident	44 Å²	44	22.3 Å²	22.3	21%	0.206	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-18.5	-176	-168.7	-174.3	-3.3	0	0	113.6	V687 T688 P691 N971 V972 L973	V687-Q969 PolarHBondContact O-NE2 3.46Å; T688-Q969 PolarHBondContact O-NE2 3.36Å; P691-Q969 VanDerWaalsContact CD-NE2 3.35Å; P691-Q969 VanDerWaalsContact CG-CD 3.46Å; Q969-N971 PolarHBondContact O-N 3.21Å; Q969-V972 PolarHBondContact O-N 3.49Å; Q969-L973 HydrophobicContact CG-CD1 4.11Å; Q969-L973 HydrophobicContact CG-CG 4.37Å; Q969-L973 PolarHBondContact O-N 2.8Å
970	L	81.5	Confident	84.7	Confident	26 Å²	26	23.8 Å²	23.8	14%	0.136	15%	0.149	C	C	.	.	H	α-helix	trans	-55.5	-27.6	-173.9	-72.5	170	0	0	0	113	P934 C939 R965 G968 L973 L974	P934-L970 WeakPolarHBondContact O-CD1 3.26Å; C939-L970 VanDerWaalsContact SG-CD2 3.51Å; R965-L970 HydrophobicContact CB-CD1 4.46Å; G968-L970 VanDerWaalsContact C-N 3.29Å; G968-L970 PolarHBondContact O-N 3.14Å; L970-L973 PolarHBondContact O-N 3.38Å; L970-L974 WeakPolarHBondContact O-CB 3.49Å; L970-L974 VanDerWaalsContact O-CG 3.25Å; L970-L974 WeakPolarHBondContact O-CG 3.28Å; L970-L974 PolarHBondContact O-N 3.48Å
971	N	84.3	Confident	84.4	Confident	5 Å²	5	23.1 Å²	23.1	3%	0.027	14%	0.142	C	C	.	.	H	α-helix	trans	-70.3	-44.9	-173.4	-24.9	-18.5	0	0	0	109.6	A512 F575 R965 G968 Q969 L973 L974 A975	A512-N971 WeakPolarHBondContact CA-ND2 3.36Å; A512-N971 PolarHBondContact O-ND2 3.47Å; F575-N971 HydrophobicContact CE1-CB 4.36Å; F575-N971 HydrophobicContact CZ-CB 4.24Å; R965-N971 WeakPolarHBondContact CD-OD1 3.34Å; R965-N971 VanDerWaalsContact CZ-ND2 3.28Å; R965-N971 VanDerWaalsContact NE-CG 3.34Å; R965-N971 PolarHBondContact NE-OD1 2.95Å; R965-N971 VanDerWaalsContact NH1-CG 3.33Å; R965-N971 PolarHBondContact NH1-ND2 3.34Å; R965-N971 PolarHBondContact NH1-OD1 2.94Å; R965-N971 PolarHBondContact NH2-ND2 3.43Å; R965-N971 VanDerWaalsContact NH2-ND2 3.14Å; R965-N971 PolarHBondContact NH2-OD1 3.04Å; G968-N971 VanDerWaalsContact O-CG 3.23Å; G968-N971 PolarHBondContact O-ND2 3.32Å; G968-N971 PolarHBondContact O-OD1 2.9Å; G968-N971 VanDerWaalsContact O-OD1 3.08Å; Q969-N971 PolarHBondContact O-N 3.21Å; N971-L973 VanDerWaalsContact C-N 3.27Å; N971-L973 PolarHBondContact O-N 2.98Å; N971-L974 PolarHBondContact O-N 3Å; N971-A975 WeakPolarHBondContact O-CB 3.42Å; N971-A975 PolarHBondContact O-N 3.37Å
972	V	82.9	Confident	84.1	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-37.5	177.3	-174.4	0	0	0	0	109.5	M571 M574 F575 V687 Q969 A975 E976	M571-V972 HydrophobicContact CE-CG1 4.11Å; M571-V972 HydrophobicContact CE-CG2 3.83Å; M571-V972 HydrophobicContact CG-CG1 4.38Å; M574-V972 HydrophobicContact CE-CG1 3.38Å; M574-V972 HydrophobicContact SD-CG1 4.42Å; F575-V972 HydrophobicContact CE2-CG2 4.12Å; F575-V972 HydrophobicContact CZ-CG2 4.07Å; V687-V972 HydrophobicContact CG1-CG1 3.67Å; Q969-V972 PolarHBondContact O-N 3.49Å; V972-A975 PolarHBondContact O-N 2.99Å; V972-E976 WeakPolarHBondContact O-CB 3.37Å; V972-E976 PolarHBondContact O-N 2.72Å
973	L	86	Confident	83.9	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-73.8	-33.7	179.8	-61.6	170.3	0	0	0	112.9	V687 T688 C939 Q969 L970 N971 A977	V687-L973 HydrophobicContact CG1-CD2 3.99Å; T688-L973 HydrophobicContact CG2-CD2 3.78Å; C939-L973 HydrophobicContact CB-CD1 3.7Å; C939-L973 VanDerWaalsContact SG-CD1 3.56Å; Q969-L973 HydrophobicContact CG-CD1 4.11Å; Q969-L973 HydrophobicContact CG-CG 4.37Å; Q969-L973 PolarHBondContact O-N 2.8Å; L970-L973 PolarHBondContact O-N 3.38Å; N971-L973 VanDerWaalsContact C-N 3.27Å; N971-L973 PolarHBondContact O-N 2.98Å; L973-A977 PolarHBondContact O-N 3.31Å
974	L	90.2	Very high	83.8	Confident	1 Å²	1	26 Å²	26	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-72.1	-40.8	171.4	-70.5	173.5	0	0	0	111.1	P934 F963 L970 N971 E976 A977 G978 V979 V984	P934-L974 HydrophobicContact CG-CD1 4.18Å; F963-L974 HydrophobicContact CD1-CD1 4.07Å; F963-L974 HydrophobicContact CD1-CD2 4.22Å; F963-L974 HydrophobicContact CE1-CD2 3.88Å; F963-L974 HydrophobicContact CG-CD1 4.3Å; F963-L974 HydrophobicContact CZ-CD2 4.33Å; L970-L974 WeakPolarHBondContact O-CB 3.49Å; L970-L974 VanDerWaalsContact O-CG 3.25Å; L970-L974 WeakPolarHBondContact O-CG 3.28Å; L970-L974 PolarHBondContact O-N 3.48Å; N971-L974 PolarHBondContact O-N 3Å; L974-E976 VanDerWaalsContact C-N 3.34Å; L974-A977 WeakPolarHBondContact O-CB 3.5Å; L974-A977 PolarHBondContact O-N 2.9Å; L974-A977 VanDerWaalsContact O-N 3.14Å; L974-G978 PolarHBondContact O-N 3.25Å; L974-V979 HydrophobicContact CB-CB 4.11Å; L974-V979 HydrophobicContact CB-CG2 4.27Å; L974-V979 HydrophobicContact CD2-CG2 4.26Å; L974-V979 VanDerWaalsContact O-CB 3.31Å; L974-V979 WeakPolarHBondContact O-CB 3.45Å; L974-V979 WeakPolarHBondContact O-CG2 3.2Å; L974-V979 PolarHBondContact O-N 2.97Å; L974-V984 HydrophobicContact CD1-CG1 4.03Å; L974-V984 HydrophobicContact CD1-CG2 4.17Å
975	A	88.4	Confident	84	Confident	10 Å²	10	27.7 Å²	27.7	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-41.5	174.2	0	0	0	0	0	111.2	M574 F575 N971 V972 A977 G978	M574-A975 HydrophobicContact CB-CB 4.22Å; F575-A975 HydrophobicContact CD1-CB 3.85Å; F575-A975 HydrophobicContact CE1-CB 3.85Å; F575-A975 HydrophobicContact CG-CB 4.25Å; F575-A975 HydrophobicContact CZ-CB 4.26Å; N971-A975 WeakPolarHBondContact O-CB 3.42Å; N971-A975 PolarHBondContact O-N 3.37Å; V972-A975 PolarHBondContact O-N 2.99Å; A975-A977 VanDerWaalsContact C-N 3.26Å; A975-A977 PolarHBondContact O-N 3.33Å; A975-G978 WeakPolarHBondContact O-CA 3.38Å; A975-G978 PolarHBondContact O-N 2.91Å
976	E	88.4	Confident	84.3	Confident	57 Å²	57	28.5 Å²	28.5	27%	0.266	17%	0.174	S	C	.	.	H	α-helix	trans	-56.9	-39.1	171.9	-173.6	-174.4	-178	0	0	112.3	M574 V687 Y945 V972 L974 G978	M574-E976 HydrophobicContact SD-CB 3.52Å; M574-E976 VanDerWaalsContact SD-CB 3.52Å; M574-E976 HydrophobicContact SD-CG 3.75Å; V687-E976 WeakPolarHBondContact CB-OE2 3.41Å; Y945-E976 PolarHBondContact OH-OE1 3.14Å; Y945-E976 VanDerWaalsContact OH-OE1 3.14Å; V972-E976 WeakPolarHBondContact O-CB 3.37Å; V972-E976 PolarHBondContact O-N 2.72Å; L974-E976 VanDerWaalsContact C-N 3.34Å; E976-G978 PolarHBondContact O-N 2.91Å
977	A	89.6	Confident	85.1	Confident	17 Å²	17	28 Å²	28	14%	0.14	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.1	176.1	0	0	0	0	0	113.7	Q944 Y945 A948 L973 L974 A975	Q944-A977 HydrophobicContact CB-CB 3.78Å; Q944-A977 HydrophobicContact CG-CB 3.66Å; Y945-A977 HydrophobicContact CD1-CB 4.19Å; A948-A977 HydrophobicContact CB-CB 3.94Å; A948-A977 WeakPolarHBondContact CB-O 3.36Å; L973-A977 PolarHBondContact O-N 3.31Å; L974-A977 WeakPolarHBondContact O-CB 3.5Å; L974-A977 PolarHBondContact O-N 2.9Å; L974-A977 VanDerWaalsContact O-N 3.14Å; A975-A977 VanDerWaalsContact C-N 3.26Å; A975-A977 PolarHBondContact O-N 3.33Å
978	G	88.9	Confident	86.5	Confident	58 Å²	58	31.6 Å²	31.6	60%	0.598	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	17	-178.7	0	0	0	0	0	114.3	L974 A975 E976 P980	L974-G978 PolarHBondContact O-N 3.25Å; A975-G978 WeakPolarHBondContact O-CA 3.38Å; A975-G978 PolarHBondContact O-N 2.91Å; E976-G978 PolarHBondContact O-N 2.91Å; G978-P980 WeakPolarHBondContact O-CD 3.34Å
979	V	91.7	Very high	87.8	Confident	9 Å²	9	35.9 Å²	35.9	6%	0.055	20%	0.2	C	C	.	.			trans	-73.8	122.8	174	-178.3	0	0	0	0	109.3	A948 F963 L974 I983 V984	A948-V979 HydrophobicContact CB-CG2 3.66Å; F963-V979 HydrophobicContact CD2-CG1 3.78Å; F963-V979 HydrophobicContact CE2-CB 4.47Å; F963-V979 HydrophobicContact CE2-CG1 3.44Å; F963-V979 VanDerWaalsContact CE2-CG1 3.44Å; F963-V979 HydrophobicContact CE2-CG2 4.14Å; F963-V979 HydrophobicContact CZ-CG1 4.22Å; F963-V979 HydrophobicContact CZ-CG2 4.14Å; L974-V979 HydrophobicContact CB-CB 4.11Å; L974-V979 HydrophobicContact CB-CG2 4.27Å; L974-V979 HydrophobicContact CD2-CG2 4.26Å; L974-V979 VanDerWaalsContact O-CB 3.31Å; L974-V979 WeakPolarHBondContact O-CB 3.45Å; L974-V979 WeakPolarHBondContact O-CG2 3.2Å; L974-V979 PolarHBondContact O-N 2.97Å; V979-I983 HydrophobicContact CG1-CD1 3.88Å; V979-I983 HydrophobicContact CG1-CG1 3.99Å; V979-V984 HydrophobicContact CG1-CG2 3.65Å
980	P	90.5	Very high	89	Confident	43 Å²	43	33.8 Å²	33.8	28%	0.279	19%	0.191	S	C	.	.			trans	-61	137.1	176.2	-23.7	35.1	0	0	0	112	G978 D982 I983	G978-P980 WeakPolarHBondContact O-CD 3.34Å; P980-D982 WeakPolarHBondContact CB-OD1 3.17Å; P980-D982 PolarHBondContact O-N 2.78Å; P980-I983 HydrophobicContact CB-CG1 4.44Å; P980-I983 WeakPolarHBondContact O-CG1 3.29Å; P980-I983 PolarHBondContact O-N 2.79Å
981	Y	88.4	Confident	89.5	Confident	54 Å²	54	33.6 Å²	33.6	21%	0.212	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-67	-22.7	-174.4	64.3	-98.2	0	0	0	113.9	R577 Q632 I983 V984	R577-Y981 HydrophobicContact CG-CD1 4.22Å; R577-Y981 HydrophobicContact CG-CE1 4.01Å; R577-Y981 VanDerWaalsContact CZ-OH 3.26Å; R577-Y981 PolarHBondContact NH2-OH 2.85Å; Q632-Y981 HydrophobicContact CB-CE2 4.49Å; Q632-Y981 HydrophobicContact CG-CD2 4.34Å; Q632-Y981 HydrophobicContact CG-CG 4.37Å; Y981-I983 VanDerWaalsContact C-N 3.26Å; Y981-I983 PolarHBondContact O-N 3.33Å; Y981-V984 PolarHBondContact O-N 3.49Å; Y981-V984 VanDerWaalsContact O-N 3.16Å
982	D	90.7	Very high	90	Very high	78 Å²	78	37.3 Å²	37.3	42%	0.417	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-70.1	-19.9	-179.9	55.5	-57.5	0	0	0	113.7	R577 P980	R577-D982 IonicContact NH1-OD1 3.83Å; P980-D982 WeakPolarHBondContact CB-OD1 3.17Å; P980-D982 PolarHBondContact O-N 2.78Å
983	I	93	Very high	90.6	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.041	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-100.5	6.2	173.2	62	160.9	0	0	0	112.8	V951 R955 R962 F963 V979 P980 Y981	V951-I983 HydrophobicContact CG1-CD1 3.73Å; R955-I983 VanDerWaalsContact NH1-CG2 3.3Å; R962-I983 CarbonylContact C-O 3.57Å; F963-I983 HydrophobicContact CD2-CD1 4.21Å; F963-I983 HydrophobicContact CD2-CG1 4.49Å; F963-I983 HydrophobicContact CE2-CD1 4.15Å; F963-I983 PolarHBondContact N-O 2.88Å; V979-I983 HydrophobicContact CG1-CD1 3.88Å; V979-I983 HydrophobicContact CG1-CG1 3.99Å; P980-I983 HydrophobicContact CB-CG1 4.44Å; P980-I983 WeakPolarHBondContact O-CG1 3.29Å; P980-I983 PolarHBondContact O-N 2.79Å; Y981-I983 VanDerWaalsContact C-N 3.26Å; Y981-I983 PolarHBondContact O-N 3.33Å
984	V	92.3	Very high	91	Very high	18 Å²	18	39.5 Å²	39.5	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	96.1	177.7	-177	0	0	0	0	108.9	F963 R965 L974 V979 Y981	F963-V984 HydrophobicContact CB-CB 4.5Å; F963-V984 HydrophobicContact CB-CG1 4.42Å; F963-V984 HydrophobicContact CB-CG2 4.25Å; F963-V984 HydrophobicContact CD2-CG2 4.23Å; F963-V984 HydrophobicContact CG-CG2 4.45Å; R965-V984 HydrophobicContact CG-CG1 4.38Å; L974-V984 HydrophobicContact CD1-CG1 4.03Å; L974-V984 HydrophobicContact CD1-CG2 4.17Å; V979-V984 HydrophobicContact CG1-CG2 3.65Å; Y981-V984 PolarHBondContact O-N 3.49Å; Y981-V984 VanDerWaalsContact O-N 3.16Å
985	L	91.9	Very high	91.2	Very high	34 Å²	34	43.9 Å²	43.9	18%	0.178	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	149	-174.5	-58.6	177.5	0	0	0	111.5	F963 R965 E989 I990	F963-L985 PolarHBondContact O-N 2.77Å; R965-L985 PolarHBondContact N-O 2.92Å; L985-E989 HydrophobicContact CB-CB 4.31Å; L985-I990 HydrophobicContact CB-CB 4.06Å; L985-I990 HydrophobicContact CB-CD1 4.34Å; L985-I990 HydrophobicContact CD1-CB 4.31Å; L985-I990 HydrophobicContact CD1-CD1 4.25Å; L985-I990 HydrophobicContact CD1-CG1 4.17Å
986	E	88.3	Confident	91.4	Very high	22 Å²	22	49.1 Å²	49.1	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	160.7	170.4	-62.2	-67	173.4	0	0	110.9	P511 R965 D988 E989 I990	P511-E986 HydrophobicContact CB-CG 4.38Å; P511-E986 WeakPolarHBondContact CB-OE1 3.26Å; R965-E986 VanDerWaalsContact CZ-CD 3.47Å; R965-E986 IonicContact CZ-OE1 3.61Å; R965-E986 IonicContact CZ-OE2 3.44Å; R965-E986 IonicContact NH1-OE1 2.67Å; R965-E986 PolarHBondContact NH1-OE1 3.28Å; R965-E986 IonicContact NH1-OE2 3.57Å; R965-E986 PolarHBondContact NH1-OE2 3.38Å; R965-E986 IonicContact NH2-OE1 2.99Å; R965-E986 PolarHBondContact NH2-OE1 3.16Å; R965-E986 IonicContact NH2-OE2 3.48Å; E986-D988 VanDerWaalsContact C-N 3.3Å; E986-D988 PolarHBondContact O-N 2.95Å; E986-E989 HydrophobicContact CB-CG 4.4Å; E986-E989 PolarHBondContact N-OE2 3.46Å; E986-E989 PolarHBondContact O-N 2.96Å; E986-E989 VanDerWaalsContact O-N 3.12Å; E986-I990 WeakPolarHBondContact O-CG2 3.41Å; E986-I990 PolarHBondContact O-N 3.29Å; E986-I990 VanDerWaalsContact O-N 3.13Å
987	M	88.5	Confident	91.8	Very high	19 Å²	19	46.4 Å²	46.4	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-54	-42.6	-179.4	175.5	-170.9	74.4	0	0	113.4	R965 M966 E989 I990 N991 P1025 L1027	R965-M987 PolarHBondContact O-N 2.7Å; M966-M987 HydrophobicContact CE-SD 4.29Å; M987-E989 VanDerWaalsContact C-N 3.29Å; M987-E989 PolarHBondContact O-N 3.32Å; M987-I990 PolarHBondContact O-N 3.03Å; M987-N991 VanDerWaalsContact CG-ND2 3.32Å; M987-N991 WeakPolarHBondContact CG-ND2 3.48Å; M987-N991 WeakPolarHBondContact O-CB 3.34Å; M987-N991 VanDerWaalsContact O-CG 3.27Å; M987-N991 PolarHBondContact O-N 3.06Å; M987-N991 PolarHBondContact O-ND2 3.44Å; M987-P1025 HydrophobicContact CE-CB 3.35Å; M987-P1025 HydrophobicContact CE-CG 4.43Å; M987-P1025 HydrophobicContact SD-CB 3.79Å; M987-L1027 HydrophobicContact CB-CD2 3.99Å; M987-L1027 HydrophobicContact CB-CG 4.49Å; M987-L1027 HydrophobicContact CG-CD2 3.9Å; M987-L1027 HydrophobicContact CG-CG 4.22Å
988	D	87.2	Confident	92.2	Very high	131 Å²	131	47 Å²	47	70%	0.701	26%	0.264	S	S	*	.	H	α-helix	trans	-68.6	-28.8	-178.5	-66.8	-24.5	0	0	0	112.5	E986	E986-D988 VanDerWaalsContact C-N 3.3Å; E986-D988 PolarHBondContact O-N 2.95Å
989	E	91.1	Very high	92.5	Very high	115 Å²	115	44.6 Å²	44.6	54%	0.537	24%	0.238	S	C	.	.	H	α-helix	trans	-79.7	-36.3	-180	-59.9	171.9	146.1	0	0	111.8	L985 E986 M987	L985-E989 HydrophobicContact CB-CB 4.31Å; E986-E989 HydrophobicContact CB-CG 4.4Å; E986-E989 PolarHBondContact N-OE2 3.46Å; E986-E989 PolarHBondContact O-N 2.96Å; E986-E989 VanDerWaalsContact O-N 3.12Å; M987-E989 VanDerWaalsContact C-N 3.29Å; M987-E989 PolarHBondContact O-N 3.32Å
990	I	94.1	Very high	92.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-98.3	-19.4	-171.8	-155.5	172.1	0	0	0	114.3	I931 R962 L985 E986 M987 P992 D993 F994 L1027	I931-I990 HydrophobicContact CB-CD1 4.5Å; I931-I990 HydrophobicContact CD1-CD1 3.86Å; I931-I990 HydrophobicContact CD1-CG1 3.9Å; I931-I990 HydrophobicContact CG1-CD1 4.08Å; I931-I990 HydrophobicContact CG2-CD1 3.63Å; R962-I990 HydrophobicContact CB-CD1 4.48Å; L985-I990 HydrophobicContact CB-CB 4.06Å; L985-I990 HydrophobicContact CB-CD1 4.34Å; L985-I990 HydrophobicContact CD1-CB 4.31Å; L985-I990 HydrophobicContact CD1-CD1 4.25Å; L985-I990 HydrophobicContact CD1-CG1 4.17Å; E986-I990 WeakPolarHBondContact O-CG2 3.41Å; E986-I990 PolarHBondContact O-N 3.29Å; E986-I990 VanDerWaalsContact O-N 3.13Å; M987-I990 PolarHBondContact O-N 3.03Å; I990-P992 VanDerWaalsContact C-CD 3.45Å; I990-D993 WeakPolarHBondContact O-CB 3.16Å; I990-D993 PolarHBondContact O-N 2.92Å; I990-D993 VanDerWaalsContact O-N 3.07Å; I990-F994 HydrophobicContact CG2-CE2 4.23Å; I990-L1027 HydrophobicContact CG2-CD2 3.65Å
991	N	93.7	Very high	93.2	Very high	22 Å²	22	42.1 Å²	42.1	12%	0.118	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-57.7	-37	-176.7	-98.8	-19.9	0	0	0	115.3	M987 D993 F994 V1026 L1027 R1028	M987-N991 VanDerWaalsContact CG-ND2 3.32Å; M987-N991 WeakPolarHBondContact CG-ND2 3.48Å; M987-N991 WeakPolarHBondContact O-CB 3.34Å; M987-N991 VanDerWaalsContact O-CG 3.27Å; M987-N991 PolarHBondContact O-N 3.06Å; M987-N991 PolarHBondContact O-ND2 3.44Å; N991-D993 PolarHBondContact O-N 3.3Å; N991-F994 WeakPolarHBondContact OD1-CE2 3.49Å; N991-V1026 PolarHBondContact ND2-O 3.43Å; N991-L1027 WeakPolarHBondContact OD1-CA 3.22Å; N991-R1028 PolarHBondContact OD1-N 2.77Å; N991-R1028 VanDerWaalsContact OD1-N 3.13Å
992	P	94.3	Very high	93.6	Very high	84 Å²	84	39.5 Å²	39.5	55%	0.545	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-62	-28.7	175	-25.3	36.4	0	0	0	114	I990 F994	I990-P992 VanDerWaalsContact C-CD 3.45Å; P992-F994 PolarHBondContact O-N 3.43Å
993	D	95	Very high	93.8	Very high	49 Å²	49	35.8 Å²	35.8	26%	0.262	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-84.6	-9.8	-169	-65.8	-1	0	0	0	114.2	R962 I990 N991 N995 D996 T997	R962-D993 IonicContact CZ-OD2 2.61Å; R962-D993 IonicContact NH1-OD2 3.64Å; R962-D993 PolarHBondContact NH1-OD2 2.92Å; R962-D993 IonicContact NH2-OD2 3.25Å; R962-D993 PolarHBondContact NH2-OD2 3.26Å; I990-D993 WeakPolarHBondContact O-CB 3.16Å; I990-D993 PolarHBondContact O-N 2.92Å; I990-D993 VanDerWaalsContact O-N 3.07Å; N991-D993 PolarHBondContact O-N 3.3Å; D993-N995 PolarHBondContact O-N 3.37Å; D993-D996 PolarHBondContact O-N 2.88Å; D993-T997 PolarHBondContact O-N 3.27Å; D993-T997 PolarHBondContact O-OG1 3.42Å
994	F	95.6	Very high	93.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-61.7	-30.6	-178.4	-79.5	-69.1	0	0	0	113	I931 V933 I990 N991 P992 D996 T997 V1000 L1027 R1028 V1029 K1031 A1032	I931-F994 HydrophobicContact CB-CE1 4.27Å; I931-F994 HydrophobicContact CD1-CD1 3.99Å; I931-F994 HydrophobicContact CD1-CE1 3.97Å; I931-F994 HydrophobicContact CG2-CE1 3.84Å; I931-F994 HydrophobicContact CG2-CZ 4.16Å; V933-F994 HydrophobicContact CG2-CE1 4.43Å; V933-F994 HydrophobicContact CG2-CZ 4.23Å; I990-F994 HydrophobicContact CG2-CE2 4.23Å; N991-F994 WeakPolarHBondContact OD1-CE2 3.49Å; P992-F994 PolarHBondContact O-N 3.43Å; F994-D996 VanDerWaalsContact C-N 3.27Å; F994-D996 PolarHBondContact O-N 2.8Å; F994-T997 WeakPolarHBondContact O-CB 3.48Å; F994-T997 PolarHBondContact O-N 2.93Å; F994-V1000 HydrophobicContact CD1-CG2 3.76Å; F994-V1000 HydrophobicContact CE1-CG1 4.15Å; F994-V1000 HydrophobicContact CE1-CG2 3.83Å; F994-L1027 HydrophobicContact CE2-CB 4.2Å; F994-L1027 HydrophobicContact CE2-CD2 3.91Å; F994-L1027 HydrophobicContact CZ-CB 4.15Å; F994-L1027 HydrophobicContact CZ-CD2 4.06Å; F994-R1028 HydrophobicContact CD2-CB 4.42Å; F994-V1029 HydrophobicContact CE1-CB 4.34Å; F994-V1029 HydrophobicContact CE1-CG1 3.84Å; F994-V1029 HydrophobicContact CZ-CG1 3.96Å; F994-K1031 HydrophobicContact CB-CB 4.08Å; F994-K1031 CarbonylContact O-C 3.56Å; F994-A1032 WeakPolarHBondContact O-CA 3.47Å; F994-A1032 PolarHBondContact O-N 2.92Å
995	N	92.9	Very high	93.5	Very high	93 Å²	93	36.3 Å²	36.3	50%	0.497	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-63.8	-33	178	-64.6	-48.5	0	0	0	112.7	D993 K1031	D993-N995 PolarHBondContact O-N 3.37Å; N995-K1031 WeakPolarHBondContact OD1-CD 3.44Å
996	D	93.8	Very high	93.4	Very high	120 Å²	120	35.5 Å²	35.5	64%	0.642	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-97	10.3	-177.7	-61.7	-43.1	0	0	0	112.6	N929 D993 F994	N929-D996 PolarHBondContact ND2-O 2.86Å; D993-D996 PolarHBondContact O-N 2.88Å; F994-D996 VanDerWaalsContact C-N 3.27Å; F994-D996 PolarHBondContact O-N 2.8Å
997	T	96.2	Very high	93.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	20%	0.198	C	C	.	.			trans	-96	130.6	-178.1	-62.2	0	0	0	0	111.3	I931 D993 F994 V999 V1000 A1032 K1033	I931-T997 HydrophobicContact CB-CG2 4.13Å; I931-T997 HydrophobicContact CD1-CG2 3.92Å; I931-T997 WeakPolarHBondContact CD1-OG1 3.44Å; I931-T997 HydrophobicContact CG1-CG2 3.8Å; D993-T997 PolarHBondContact O-N 3.27Å; D993-T997 PolarHBondContact O-OG1 3.42Å; F994-T997 WeakPolarHBondContact O-CB 3.48Å; F994-T997 PolarHBondContact O-N 2.93Å; T997-V999 WeakPolarHBondContact CG2-O 3.47Å; T997-V1000 HydrophobicContact CG2-CG2 3.8Å; T997-A1032 HydrophobicContact CG2-CB 4.4Å; T997-K1033 PolarHBondContact O-N 3.12Å; T997-K1033 VanDerWaalsContact O-N 3.11Å
998	D	96.8	Very high	93.4	Very high	29 Å²	29	36.1 Å²	36.1	16%	0.155	20%	0.203	C	C	.	.	S	Bend	trans	-78.7	-47.5	-178	-58.8	-52.4	0	0	0	111.6	A927 K928 N929 K1033 Q1034	A927-D998 HydrophobicContact CB-CB 3.87Å; K928-D998 WeakPolarHBondContact CA-OD2 3.26Å; K928-D998 WeakPolarHBondContact CB-OD2 3.29Å; K928-D998 PolarHBondContact N-OD2 2.87Å; N929-D998 PolarHBondContact N-OD2 3.28Å; N929-D998 PolarHBondContact O-N 3.5Å; D998-K1033 IonicContact OD1-NZ 3.52Å; D998-K1033 PolarHBondContact OD1-NZ 2.99Å; D998-Q1034 PolarHBondContact O-N 3.41Å
999	V	97.2	Very high	93.7	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.042	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.9	-177.9	-179.2	0	0	0	0	110.6	W923 L924 A927 N929 V930 I931 T997 Q1034	W923-V999 HydrophobicContact CB-CG2 4.02Å; L924-V999 HydrophobicContact CD2-CG1 3.95Å; A927-V999 HydrophobicContact CB-CB 4.41Å; A927-V999 HydrophobicContact CB-CG2 3.9Å; N929-V999 PolarHBondContact O-N 3.07Å; V930-V999 VanDerWaalsContact CA-O 3.29Å; V930-V999 WeakPolarHBondContact CA-O 3.45Å; V930-V999 HydrophobicContact CG2-CB 4.45Å; I931-V999 PolarHBondContact N-O 3.42Å; T997-V999 WeakPolarHBondContact CG2-O 3.47Å; V999-Q1034 CarbonylContact C-O 3.59Å; V999-Q1034 WeakPolarHBondContact CA-O 3.45Å
1000	V	98	Very high	93.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.9	169.7	-179.5	0	0	0	0	110.1	I931 V933 F994 T997 V1002 V1029 A1032 Q1034 V1035 V1036	I931-V1000 HydrophobicContact CB-CG2 4.33Å; I931-V1000 CarbonylContact O-C 3.54Å; I931-V1000 VanDerWaalsContact O-CA 3.23Å; I931-V1000 WeakPolarHBondContact O-CA 3.24Å; V933-V1000 HydrophobicContact CG2-CG1 4.01Å; F994-V1000 HydrophobicContact CD1-CG2 3.76Å; F994-V1000 HydrophobicContact CE1-CG1 4.15Å; F994-V1000 HydrophobicContact CE1-CG2 3.83Å; T997-V1000 HydrophobicContact CG2-CG2 3.8Å; V1000-V1002 HydrophobicContact CG1-CG2 4.02Å; V1000-V1029 HydrophobicContact CG1-CB 3.98Å; V1000-V1029 HydrophobicContact CG1-CG1 3.85Å; V1000-A1032 HydrophobicContact CB-CB 4.36Å; V1000-A1032 HydrophobicContact CG2-CB 3.33Å; V1000-Q1034 PolarHBondContact N-O 3.42Å; V1000-V1035 HydrophobicContact CB-CG1 4.43Å; V1000-V1035 HydrophobicContact CB-CG2 4.35Å; V1000-V1035 CarbonylContact O-C 3.57Å; V1000-V1035 WeakPolarHBondContact O-CA 3.2Å; V1000-V1036 PolarHBondContact O-N 3.23Å
1001	L	97.3	Very high	93.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	106.5	172.7	-68.8	174.9	0	0	0	110	T920 L924 I931 I932 V933 I1003 V1036	T920-L1001 HydrophobicContact CG2-CD2 4.22Å; L924-L1001 HydrophobicContact CD1-CD1 4.08Å; L924-L1001 HydrophobicContact CD1-CD2 4.46Å; L924-L1001 HydrophobicContact CD2-CD1 3.69Å; L924-L1001 HydrophobicContact CD2-CD2 4.23Å; L924-L1001 HydrophobicContact CD2-CG 3.98Å; I931-L1001 PolarHBondContact O-N 2.86Å; I932-L1001 CarbonylContact C-O 3.33Å; I932-L1001 WeakPolarHBondContact CA-O 3.48Å; I932-L1001 HydrophobicContact CD1-CD1 4.33Å; I932-L1001 HydrophobicContact CG1-CB 4.24Å; I932-L1001 HydrophobicContact CG1-CD1 4.2Å; I932-L1001 HydrophobicContact CG2-CB 4.47Å; V933-L1001 PolarHBondContact N-O 3.32Å; L1001-I1003 HydrophobicContact CB-CG1 4.43Å; L1001-V1036 HydrophobicContact CD2-CB 4.01Å; L1001-V1036 HydrophobicContact CD2-CG1 4.39Å
1002	V	96.8	Very high	93.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113.2	175.1	-177.4	0	0	0	0	109.2	V933 V1000 A1005 V1009 V1029 V1035 V1036 V1037 M1038	V933-V1002 HydrophobicContact CB-CG2 4.37Å; V1000-V1002 HydrophobicContact CG1-CG2 4.02Å; V1002-A1005 HydrophobicContact CG1-CB 3.89Å; V1002-V1009 HydrophobicContact CG1-CG1 4.16Å; V1002-V1009 HydrophobicContact CG1-CG2 3.99Å; V1002-V1009 HydrophobicContact CG2-CG1 4.43Å; V1002-V1029 HydrophobicContact CG2-CB 4.39Å; V1002-V1029 HydrophobicContact CG2-CG1 4.17Å; V1002-V1029 HydrophobicContact CG2-CG2 4.3Å; V1002-V1035 HydrophobicContact CG2-CG1 3.87Å; V1002-V1036 PolarHBondContact N-O 3.09Å; V1002-V1037 HydrophobicContact CB-CB 4.47Å; V1002-V1037 HydrophobicContact CB-CG1 4.4Å; V1002-V1037 HydrophobicContact CB-CG2 4.12Å; V1002-V1037 HydrophobicContact CG1-CG1 4.39Å; V1002-V1037 HydrophobicContact CG2-CG2 4.37Å; V1002-M1038 PolarHBondContact O-N 3.43Å
1003	I	94.9	Very high	93.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	103.2	-172.7	-46.5	178.2	0	0	0	110.8	I932 V933 G935 L938 I947 L1001 A1005 M1038 A1066	I932-I1003 HydrophobicContact CG2-CD1 3.91Å; I932-I1003 HydrophobicContact CG2-CG1 4.4Å; V933-I1003 PolarHBondContact O-N 3.42Å; G935-I1003 PolarHBondContact N-O 2.84Å; L938-I1003 HydrophobicContact CB-CB 4.43Å; L938-I1003 HydrophobicContact CB-CG2 3.98Å; L938-I1003 HydrophobicContact CD1-CB 3.92Å; L938-I1003 HydrophobicContact CD1-CD1 4.03Å; L938-I1003 HydrophobicContact CD1-CG2 3.87Å; L938-I1003 HydrophobicContact CG-CG2 4.29Å; I947-I1003 HydrophobicContact CD1-CD1 3.5Å; I947-I1003 HydrophobicContact CG1-CD1 3.93Å; L1001-I1003 HydrophobicContact CB-CG1 4.43Å; I1003-A1005 PolarHBondContact O-N 3.49Å; I1003-M1038 HydrophobicContact CD1-SD 4.19Å; I1003-M1038 HydrophobicContact CG1-SD 3.94Å; I1003-M1038 HydrophobicContact CG2-CB 4.29Å; I1003-M1038 HydrophobicContact CG2-CE 4.22Å; I1003-M1038 HydrophobicContact CG2-SD 4.44Å; I1003-A1066 HydrophobicContact CG2-CB 4.27Å
1004	G	90	Very high	92.7	Very high	27 Å²	27	21.9 Å²	21.9	28%	0.278	13%	0.125	S	C	.	.	S	Bend	trans	67.2	18.5	176.4	0	0	0	0	0	115	G935 G937 M1038	G935-G1004 WeakPolarHBondContact CA-O 3.45Å; G937-G1004 PolarHBondContact N-O 3.37Å; G1004-M1038 PolarHBondContact N-O 2.85Å; G1004-M1038 VanDerWaalsContact N-O 3.1Å
1005	A	90.1	Very high	92.3	Very high	9 Å²	9	26.3 Å²	26.3	7%	0.074	15%	0.149	C	C	.	.			trans	-103	149.3	169.3	0	0	0	0	0	110.4	V933 V1002 I1003	V933-A1005 HydrophobicContact CG1-CB 4.36Å; V1002-A1005 HydrophobicContact CG1-CB 3.89Å; I1003-A1005 PolarHBondContact O-N 3.49Å
1006	N	90.2	Very high	91.8	Very high	18 Å²	18	22.5 Å²	22.5	10%	0.096	13%	0.129	C	C	.	.			trans	-139.3	-70.2	175.5	-169.5	1.8	0	0	0	111	T1008 V1009 N1010 G1045 N1051 F1054	N1006-T1008 VanDerWaalsContact C-N 3.26Å; N1006-T1008 PolarHBondContact O-N 3.48Å; N1006-V1009 WeakPolarHBondContact O-CG2 3.12Å; N1006-V1009 PolarHBondContact O-N 2.9Å; N1006-V1009 VanDerWaalsContact O-N 3.09Å; N1006-N1010 PolarHBondContact O-N 2.96Å; N1006-G1045 WeakPolarHBondContact ND2-CA 3.43Å; N1006-G1045 PolarHBondContact ND2-N 3.13Å; N1006-N1051 PolarHBondContact O-ND2 2.92Å; N1006-N1051 WeakPolarHBondContact OD1-CB 3.47Å; N1006-N1051 PolarHBondContact OD1-ND2 3.34Å; N1006-F1054 WeakPolarHBondContact OD1-CZ 3.28Å
1007	D	87.3	Confident	91.3	Very high	19 Å²	19	20.5 Å²	20.5	10%	0.102	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-63.4	-33.5	-173.9	-55.4	-5.9	0	0	0	112.1	V1009 N1010 V1026 G1045 Y1046 A1047	D1007-V1009 PolarHBondContact O-N 2.88Å; D1007-N1010 PolarHBondContact O-N 3.28Å; D1007-V1026 WeakPolarHBondContact O-CG1 3.26Å; D1007-G1045 WeakPolarHBondContact OD1-CA 3.1Å; D1007-Y1046 WeakPolarHBondContact OD2-CA 3.41Å; D1007-Y1046 VanDerWaalsContact OD2-CB 3.23Å; D1007-Y1046 WeakPolarHBondContact OD2-CB 3.46Å; D1007-Y1046 PolarHBondContact OD2-N 2.99Å; D1007-A1047 PolarHBondContact OD2-N 2.87Å
1008	T	89.5	Confident	90.6	Very high	35 Å²	35	22.5 Å²	22.5	22%	0.215	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-72.5	-6.3	179.7	61.8	0	0	0	0	114.6	M966 N1006 M1024 V1026 L1027	M966-T1008 HydrophobicContact CE-CG2 3.7Å; M966-T1008 HydrophobicContact CG-CG2 4.17Å; M966-T1008 HydrophobicContact SD-CG2 3.53Å; M966-T1008 VanDerWaalsContact SD-CG2 3.53Å; N1006-T1008 VanDerWaalsContact C-N 3.26Å; N1006-T1008 PolarHBondContact O-N 3.48Å; T1008-M1024 HydrophobicContact CG2-CE 4.35Å; T1008-V1026 WeakPolarHBondContact O-CB 3.38Å; T1008-L1027 PolarHBondContact O-N 3.49Å
1009	V	93.3	Very high	89.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-124.5	8	177.4	-62.9	0	0	0	0	111.9	V933 V1002 N1006 D1007 S1011 L1027 V1029 W1030 I1053	V933-V1009 HydrophobicContact CG1-CG1 3.65Å; V1002-V1009 HydrophobicContact CG1-CG1 4.16Å; V1002-V1009 HydrophobicContact CG1-CG2 3.99Å; V1002-V1009 HydrophobicContact CG2-CG1 4.43Å; N1006-V1009 WeakPolarHBondContact O-CG2 3.12Å; N1006-V1009 PolarHBondContact O-N 2.9Å; N1006-V1009 VanDerWaalsContact O-N 3.09Å; D1007-V1009 PolarHBondContact O-N 2.88Å; V1009-S1011 PolarHBondContact O-N 3.43Å; V1009-L1027 HydrophobicContact CG1-CB 4.28Å; V1009-V1029 HydrophobicContact CB-CG1 4.27Å; V1009-V1029 HydrophobicContact CB-CG2 3.88Å; V1009-V1029 HydrophobicContact CG1-CG1 3.74Å; V1009-V1029 HydrophobicContact CG1-CG2 4.25Å; V1009-W1030 WeakPolarHBondContact O-CZ3 2.91Å; V1009-I1053 HydrophobicContact CB-CD1 4.06Å; V1009-I1053 HydrophobicContact CG2-CD1 3.63Å; V1009-I1053 WeakPolarHBondContact O-CD1 3.38Å
1010	N	91.8	Very high	88.9	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.131	C	C	.	.			trans	-82.3	116.3	-171.2	-170.9	-21.9	0	0	0	111.3	N1006 D1007 A1012 A1013 I1021 D1050 N1051 P1052	N1006-N1010 PolarHBondContact O-N 2.96Å; D1007-N1010 PolarHBondContact O-N 3.28Å; N1010-A1012 PolarHBondContact O-N 3.45Å; N1010-A1012 WeakPolarHBondContact OD1-CB 3.37Å; N1010-A1012 PolarHBondContact OD1-N 2.82Å; N1010-A1013 WeakPolarHBondContact O-CB 3.4Å; N1010-A1013 PolarHBondContact O-N 2.95Å; N1010-I1021 HydrophobicContact CB-CD1 3.69Å; N1010-D1050 PolarHBondContact ND2-O 2.88Å; N1010-D1050 VanDerWaalsContact ND2-O 3.14Å; N1010-N1051 WeakPolarHBondContact CA-OD1 3.35Å; N1010-N1051 PolarHBondContact OD1-OD1 2.94Å; N1010-P1052 WeakPolarHBondContact OD1-CD 3.45Å
1011	S	92.7	Very high	88.1	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.028	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.9	-178.8	81.9	0	0	0	0	113.5	V1009 A1013 E1014 D1015	V1009-S1011 PolarHBondContact O-N 3.43Å; S1011-A1013 PolarHBondContact O-N 3.15Å; S1011-E1014 PolarHBondContact O-N 2.86Å; S1011-D1015 VanDerWaalsContact CB-OD2 3.23Å; S1011-D1015 WeakPolarHBondContact CB-OD2 3.43Å; S1011-D1015 PolarHBondContact O-N 3.49Å; S1011-D1015 PolarHBondContact OG-OD2 3.41Å
1012	A	88.6	Confident	87.3	Confident	5 Å²	5	23 Å²	23	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-16.2	174.6	0	0	0	0	0	113.3	N1010 E1014 D1016 S1019 P1052	N1010-A1012 PolarHBondContact O-N 3.45Å; N1010-A1012 WeakPolarHBondContact OD1-CB 3.37Å; N1010-A1012 PolarHBondContact OD1-N 2.82Å; A1012-E1014 VanDerWaalsContact C-N 3.33Å; A1012-D1016 HydrophobicContact CB-CB 4.34Å; A1012-D1016 PolarHBondContact O-N 3.33Å; A1012-S1019 VanDerWaalsContact O-CB 3.29Å; A1012-S1019 WeakPolarHBondContact O-CB 3.41Å; A1012-P1052 HydrophobicContact CB-CG 4.08Å
1013	A	86.4	Confident	86.7	Confident	6 Å²	6	25 Å²	25	5%	0.05	16%	0.155	C	C	.	.	H	α-helix	trans	-68.3	-30.5	171.8	0	0	0	0	0	113.1	N1010 S1011 I1021 G1023 M1024 V1026	N1010-A1013 WeakPolarHBondContact O-CB 3.4Å; N1010-A1013 PolarHBondContact O-N 2.95Å; S1011-A1013 PolarHBondContact O-N 3.15Å; A1013-I1021 HydrophobicContact CB-CD1 4.18Å; A1013-I1021 HydrophobicContact CB-CG1 4.23Å; A1013-I1021 WeakPolarHBondContact CB-O 3.09Å; A1013-G1023 PolarHBondContact O-N 3.13Å; A1013-M1024 HydrophobicContact CB-CB 4.19Å; A1013-M1024 WeakPolarHBondContact CB-O 3.25Å; A1013-V1026 HydrophobicContact CB-CG1 3.82Å; A1013-V1026 HydrophobicContact CB-CG2 4.26Å
1014	E	88.3	Confident	86.3	Confident	86 Å²	86	25.9 Å²	25.9	40%	0.402	16%	0.16	S	C	.	.	H	α-helix	trans	-101	-36.8	177.4	-63.1	-169.6	163.8	0	0	112	S1011 A1012 V1026 R1028	S1011-E1014 PolarHBondContact O-N 2.86Å; A1012-E1014 VanDerWaalsContact C-N 3.33Å; E1014-V1026 HydrophobicContact CG-CG2 4.45Å; E1014-R1028 IonicContact OE1-CZ 2.67Å; E1014-R1028 VanDerWaalsContact OE1-CZ 3.25Å; E1014-R1028 IonicContact OE1-NE 2.86Å; E1014-R1028 PolarHBondContact OE1-NE 3.17Å; E1014-R1028 IonicContact OE1-NH2 2.61Å; E1014-R1028 PolarHBondContact OE1-NH2 3.34Å; E1014-R1028 IonicContact OE2-CZ 3.52Å; E1014-R1028 IonicContact OE2-NE 2.76Å; E1014-R1028 PolarHBondContact OE2-NE 3.49Å; E1014-R1028 IonicContact OE2-NH2 3.71Å
1015	D	85.4	Confident	86.2	Confident	94 Å²	94	27 Å²	27	50%	0.503	16%	0.163	S	C	.	.	H	α-helix	trans	-90.7	-20.9	-169.9	-59.2	-32.7	0	0	0	114.6	S1011	S1011-D1015 VanDerWaalsContact CB-OD2 3.23Å; S1011-D1015 WeakPolarHBondContact CB-OD2 3.43Å; S1011-D1015 PolarHBondContact O-N 3.49Å; S1011-D1015 PolarHBondContact OG-OD2 3.41Å
1016	D	83.8	Confident	86.2	Confident	13 Å²	13	26.7 Å²	26.7	7%	0.07	16%	0.159	C	C	.	.			trans	-126.3	102	-175.8	-177.2	7.3	0	0	0	112.1	P905 R906 A1012 N1018 S1019	P905-D1016 VanDerWaalsContact CA-OD2 3.31Å; P905-D1016 WeakPolarHBondContact CA-OD2 3.45Å; R906-D1016 PolarHBondContact N-OD2 3.14Å; A1012-D1016 HydrophobicContact CB-CB 4.34Å; A1012-D1016 PolarHBondContact O-N 3.33Å; D1016-N1018 PolarHBondContact O-N 2.96Å; D1016-N1018 VanDerWaalsContact O-N 3.13Å; D1016-N1018 WeakPolarHBondContact OD1-CB 3.26Å; D1016-N1018 PolarHBondContact OD1-N 3.36Å; D1016-S1019 WeakPolarHBondContact O-CB 3.36Å; D1016-S1019 PolarHBondContact O-N 3.21Å
1017	P	83.1	Confident	86.4	Confident	77 Å²	77	25.9 Å²	25.9	50%	0.5	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.7	178.6	28	-35.1	0	0	0	113.5	T900 A901	T900-P1017 WeakPolarHBondContact CA-O 3.4Å; A901-P1017 HydrophobicContact CB-CB 4.32Å; A901-P1017 PolarHBondContact N-O 3.48Å
1018	N	82.2	Confident	86.8	Confident	43 Å²	43	29 Å²	29	23%	0.23	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.2	176.5	-60.2	-55.2	0	0	0	112.9	G903 K904 D1016	G903-N1018 WeakPolarHBondContact CA-OD1 3.47Å; G903-N1018 PolarHBondContact N-OD1 3.14Å; G903-N1018 VanDerWaalsContact N-OD1 3.08Å; K904-N1018 WeakPolarHBondContact O-CB 3.49Å; D1016-N1018 PolarHBondContact O-N 2.96Å; D1016-N1018 VanDerWaalsContact O-N 3.13Å; D1016-N1018 WeakPolarHBondContact OD1-CB 3.26Å; D1016-N1018 PolarHBondContact OD1-N 3.36Å
1019	S	79.5	Confident	87.1	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-63.1	144.1	174.7	-176.6	0	0	0	0	111.1	T900 A1012 D1016 I1021 A1022	T900-S1019 WeakPolarHBondContact CG2-O 3.5Å; T900-S1019 PolarHBondContact OG1-O 3.43Å; A1012-S1019 VanDerWaalsContact O-CB 3.29Å; A1012-S1019 WeakPolarHBondContact O-CB 3.41Å; D1016-S1019 WeakPolarHBondContact O-CB 3.36Å; D1016-S1019 PolarHBondContact O-N 3.21Å; S1019-I1021 PolarHBondContact O-N 3.4Å; S1019-I1021 VanDerWaalsContact O-N 3.14Å; S1019-I1021 WeakPolarHBondContact OG-CG1 3.14Å; S1019-I1021 PolarHBondContact OG-N 2.87Å; S1019-A1022 VanDerWaalsContact O-CB 3.22Å; S1019-A1022 WeakPolarHBondContact O-CB 3.41Å; S1019-A1022 PolarHBondContact O-N 3.05Å
1020	I	78.7	Confident	87.2	Confident	33 Å²	33	29.2 Å²	29.2	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16	175.6	-158.5	-178.6	0	0	0	112.3	Y895 T897 A1047 V1049	Y895-I1020 HydrophobicContact CD2-CD1 4.13Å; Y895-I1020 HydrophobicContact CE1-CD1 4Å; Y895-I1020 HydrophobicContact CE1-CG1 4.18Å; Y895-I1020 HydrophobicContact CE2-CD1 3.55Å; Y895-I1020 VanDerWaalsContact CZ-CD1 3.47Å; T897-I1020 VanDerWaalsContact CG2-O 3.32Å; T897-I1020 WeakPolarHBondContact CG2-O 3.27Å; T897-I1020 PolarHBondContact N-O 2.85Å; I1020-A1047 HydrophobicContact CG2-CB 3.74Å; I1020-V1049 HydrophobicContact CB-CG2 4.35Å; I1020-V1049 HydrophobicContact CG2-CG2 3.26Å
1021	I	80.2	Confident	87.4	Confident	11 Å²	11	33.2 Å²	33.2	6%	0.056	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	14.4	176.5	58.6	169.4	0	0	0	112.1	N1010 A1013 S1019 G1023 M1024 A1047	N1010-I1021 HydrophobicContact CB-CD1 3.69Å; A1013-I1021 HydrophobicContact CB-CD1 4.18Å; A1013-I1021 HydrophobicContact CB-CG1 4.23Å; A1013-I1021 WeakPolarHBondContact CB-O 3.09Å; S1019-I1021 PolarHBondContact O-N 3.4Å; S1019-I1021 VanDerWaalsContact O-N 3.14Å; S1019-I1021 WeakPolarHBondContact OG-CG1 3.14Å; S1019-I1021 PolarHBondContact OG-N 2.87Å; I1021-G1023 PolarHBondContact O-N 3.25Å; I1021-M1024 HydrophobicContact CB-CB 4.29Å; I1021-M1024 HydrophobicContact CB-SD 4.32Å; I1021-M1024 HydrophobicContact CG2-SD 4.29Å; I1021-M1024 WeakPolarHBondContact O-CB 3.4Å; I1021-M1024 PolarHBondContact O-N 3.4Å; I1021-A1047 HydrophobicContact CG2-CB 3.52Å
1022	A	81.7	Confident	87.5	Confident	2 Å²	2	33.2 Å²	33.2	2%	0.017	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	132.1	178.6	0	0	0	0	0	110.8	N884 T897 S1019 M1024	N884-A1022 PolarHBondContact ND2-O 2.97Å; T897-A1022 WeakPolarHBondContact CB-O 3.35Å; T897-A1022 PolarHBondContact OG1-O 3.34Å; S1019-A1022 VanDerWaalsContact O-CB 3.22Å; S1019-A1022 WeakPolarHBondContact O-CB 3.41Å; S1019-A1022 PolarHBondContact O-N 3.05Å; A1022-M1024 VanDerWaalsContact C-N 3.26Å; A1022-M1024 PolarHBondContact O-N 2.87Å
1023	G	83.6	Confident	87.8	Confident	42 Å²	42	39.3 Å²	39.3	43%	0.433	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	0.8	-178.1	0	0	0	0	0	115.7	N884 A1013 I1021 P1025	N884-G1023 WeakPolarHBondContact ND2-CA 3.29Å; A1013-G1023 PolarHBondContact O-N 3.13Å; I1021-G1023 PolarHBondContact O-N 3.25Å; G1023-P1025 WeakPolarHBondContact O-CD 3.5Å
1024	M	86	Confident	88.3	Confident	19 Å²	19	41 Å²	41	9%	0.094	21%	0.212	C	C	.	.			trans	-65.8	124.1	170.5	-179.8	171	165.5	0	0	109.4	N884 M966 T1008 A1013 I1021 A1022 V1026	N884-M1024 HydrophobicContact CB-CB 4.42Å; M966-M1024 HydrophobicContact CE-CE 3.51Å; M966-M1024 HydrophobicContact SD-CE 3.93Å; T1008-M1024 HydrophobicContact CG2-CE 4.35Å; A1013-M1024 HydrophobicContact CB-CB 4.19Å; A1013-M1024 WeakPolarHBondContact CB-O 3.25Å; I1021-M1024 HydrophobicContact CB-CB 4.29Å; I1021-M1024 HydrophobicContact CB-SD 4.32Å; I1021-M1024 HydrophobicContact CG2-SD 4.29Å; I1021-M1024 WeakPolarHBondContact O-CB 3.4Å; I1021-M1024 PolarHBondContact O-N 3.4Å; A1022-M1024 VanDerWaalsContact C-N 3.26Å; A1022-M1024 PolarHBondContact O-N 2.87Å; M1024-V1026 HydrophobicContact CG-CG1 4.38Å; M1024-V1026 PolarHBondContact O-N 2.78Å
1025	P	87	Confident	88.8	Confident	52 Å²	52	36.9 Å²	36.9	34%	0.338	19%	0.193	S	C	.	.			trans	-58.8	131.3	169.8	-23.7	35.1	0	0	0	110	M966 M987 G1023	M966-P1025 WeakPolarHBondContact CE-O 3.41Å; M987-P1025 HydrophobicContact CE-CB 3.35Å; M987-P1025 HydrophobicContact CE-CG 4.43Å; M987-P1025 HydrophobicContact SD-CB 3.79Å; G1023-P1025 WeakPolarHBondContact O-CD 3.5Å
1026	V	90.8	Very high	89.3	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.169	C	C	.	.			trans	-132.6	161	-178.9	-68.8	0	0	0	0	111	N991 D1007 T1008 A1013 E1014 M1024 R1028 W1030	N991-V1026 PolarHBondContact ND2-O 3.43Å; D1007-V1026 WeakPolarHBondContact O-CG1 3.26Å; T1008-V1026 WeakPolarHBondContact O-CB 3.38Å; A1013-V1026 HydrophobicContact CB-CG1 3.82Å; A1013-V1026 HydrophobicContact CB-CG2 4.26Å; E1014-V1026 HydrophobicContact CG-CG2 4.45Å; M1024-V1026 HydrophobicContact CG-CG1 4.38Å; M1024-V1026 PolarHBondContact O-N 2.78Å; V1026-R1028 PolarHBondContact O-N 2.98Å; V1026-W1030 HydrophobicContact CG2-CH2 3.63Å; V1026-W1030 HydrophobicContact CG2-CZ3 4.06Å
1027	L	94.5	Very high	89.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.166	C	C	.	.			trans	-75.8	118.8	170.2	-72.1	162.5	0	0	0	109	V933 G964 M987 I990 N991 F994 T1008 V1009 V1029	V933-L1027 HydrophobicContact CB-CD1 4.36Å; V933-L1027 HydrophobicContact CG1-CD1 3.4Å; V933-L1027 HydrophobicContact CG2-CD1 4.08Å; G964-L1027 WeakPolarHBondContact O-CD1 3.46Å; M987-L1027 HydrophobicContact CB-CD2 3.99Å; M987-L1027 HydrophobicContact CB-CG 4.49Å; M987-L1027 HydrophobicContact CG-CD2 3.9Å; M987-L1027 HydrophobicContact CG-CG 4.22Å; I990-L1027 HydrophobicContact CG2-CD2 3.65Å; N991-L1027 WeakPolarHBondContact OD1-CA 3.22Å; F994-L1027 HydrophobicContact CE2-CB 4.2Å; F994-L1027 HydrophobicContact CE2-CD2 3.91Å; F994-L1027 HydrophobicContact CZ-CB 4.15Å; F994-L1027 HydrophobicContact CZ-CD2 4.06Å; T1008-L1027 PolarHBondContact O-N 3.49Å; V1009-L1027 HydrophobicContact CG1-CB 4.28Å; L1027-V1029 HydrophobicContact CB-CG1 4.15Å; L1027-V1029 PolarHBondContact O-N 3.16Å
1028	R	95.4	Very high	90.5	Very high	86 Å²	86	28.2 Å²	28.2	33%	0.325	14%	0.142	S	C	.	.			trans	-79.4	52.8	-172.8	-62.8	176.1	174.4	159.8	-0.8	113	N991 F994 E1014 V1026 W1030 K1031	N991-R1028 PolarHBondContact OD1-N 2.77Å; N991-R1028 VanDerWaalsContact OD1-N 3.13Å; F994-R1028 HydrophobicContact CD2-CB 4.42Å; E1014-R1028 IonicContact OE1-CZ 2.67Å; E1014-R1028 VanDerWaalsContact OE1-CZ 3.25Å; E1014-R1028 IonicContact OE1-NE 2.86Å; E1014-R1028 PolarHBondContact OE1-NE 3.17Å; E1014-R1028 IonicContact OE1-NH2 2.61Å; E1014-R1028 PolarHBondContact OE1-NH2 3.34Å; E1014-R1028 IonicContact OE2-CZ 3.52Å; E1014-R1028 IonicContact OE2-NE 2.76Å; E1014-R1028 PolarHBondContact OE2-NE 3.49Å; E1014-R1028 IonicContact OE2-NH2 3.71Å; V1026-R1028 PolarHBondContact O-N 2.98Å; R1028-W1030 HydrophobicContact CB-CH2 4.32Å; R1028-W1030 HydrophobicContact CB-CZ2 4.13Å; R1028-W1030 HydrophobicContact CG-CH2 4.04Å; R1028-W1030 HydrophobicContact CG-CZ2 3.92Å; R1028-W1030 PolarHBondContact O-N 3.4Å; R1028-W1030 VanDerWaalsContact O-N 3.13Å; R1028-K1031 HydrophobicContact CB-CD 4.15Å; R1028-K1031 HydrophobicContact CB-CG 4.35Å; R1028-K1031 WeakPolarHBondContact O-CB 3.46Å; R1028-K1031 PolarHBondContact O-N 3.44Å; R1028-K1031 VanDerWaalsContact O-N 3.12Å
1029	V	96.7	Very high	91	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-58.9	-29.9	-172.3	-58.8	0	0	0	0	113.4	V933 F994 V1000 V1002 V1009 L1027 K1031 A1032 V1035 I1053	V933-V1029 HydrophobicContact CG2-CG1 3.82Å; F994-V1029 HydrophobicContact CE1-CB 4.34Å; F994-V1029 HydrophobicContact CE1-CG1 3.84Å; F994-V1029 HydrophobicContact CZ-CG1 3.96Å; V1000-V1029 HydrophobicContact CG1-CB 3.98Å; V1000-V1029 HydrophobicContact CG1-CG1 3.85Å; V1002-V1029 HydrophobicContact CG2-CB 4.39Å; V1002-V1029 HydrophobicContact CG2-CG1 4.17Å; V1002-V1029 HydrophobicContact CG2-CG2 4.3Å; V1009-V1029 HydrophobicContact CB-CG1 4.27Å; V1009-V1029 HydrophobicContact CB-CG2 3.88Å; V1009-V1029 HydrophobicContact CG1-CG1 3.74Å; V1009-V1029 HydrophobicContact CG1-CG2 4.25Å; L1027-V1029 HydrophobicContact CB-CG1 4.15Å; L1027-V1029 PolarHBondContact O-N 3.16Å; V1029-K1031 PolarHBondContact O-N 2.93Å; V1029-K1031 VanDerWaalsContact O-N 3.12Å; V1029-A1032 WeakPolarHBondContact O-CB 3.22Å; V1029-A1032 PolarHBondContact O-N 3.4Å; V1029-A1032 VanDerWaalsContact O-N 3.1Å; V1029-V1035 HydrophobicContact CG2-CG1 4.34Å; V1029-V1035 WeakPolarHBondContact O-CG2 3.07Å; V1029-I1053 HydrophobicContact CG2-CD1 4.04Å
1030	W	94.7	Very high	91.5	Very high	39 Å²	39	34.9 Å²	34.9	15%	0.148	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-66.1	-11.8	-179	59.4	89	0	0	0	113.9	V1009 V1026 R1028 A1032 I1053 N1058	V1009-W1030 WeakPolarHBondContact O-CZ3 2.91Å; V1026-W1030 HydrophobicContact CG2-CH2 3.63Å; V1026-W1030 HydrophobicContact CG2-CZ3 4.06Å; R1028-W1030 HydrophobicContact CB-CH2 4.32Å; R1028-W1030 HydrophobicContact CB-CZ2 4.13Å; R1028-W1030 HydrophobicContact CG-CH2 4.04Å; R1028-W1030 HydrophobicContact CG-CZ2 3.92Å; R1028-W1030 PolarHBondContact O-N 3.4Å; R1028-W1030 VanDerWaalsContact O-N 3.13Å; W1030-A1032 VanDerWaalsContact C-N 3.32Å; W1030-I1053 HydrophobicContact CB-CG2 4.4Å; W1030-I1053 HydrophobicContact CD2-CG2 4.5Å; W1030-I1053 HydrophobicContact CE3-CG2 3.88Å; W1030-N1058 PolarHBondContact O-ND2 3.36Å
1031	K	95.3	Very high	91.9	Very high	84 Å²	84	36.6 Å²	36.6	37%	0.365	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-79.1	-13	174.1	-66	-171.2	175.2	-169.8	0	113.8	F994 N995 R1028 V1029	F994-K1031 HydrophobicContact CB-CB 4.08Å; F994-K1031 CarbonylContact O-C 3.56Å; N995-K1031 WeakPolarHBondContact OD1-CD 3.44Å; R1028-K1031 HydrophobicContact CB-CD 4.15Å; R1028-K1031 HydrophobicContact CB-CG 4.35Å; R1028-K1031 WeakPolarHBondContact O-CB 3.46Å; R1028-K1031 PolarHBondContact O-N 3.44Å; R1028-K1031 VanDerWaalsContact O-N 3.12Å; V1029-K1031 PolarHBondContact O-N 2.93Å; V1029-K1031 VanDerWaalsContact O-N 3.12Å
1032	A	96.5	Very high	92.1	Very high	3 Å²	3	38.5 Å²	38.5	3%	0.025	19%	0.19	C	C	.	.	S	Bend	trans	-74.2	160.5	175.6	0	0	0	0	0	112.5	F994 T997 V1000 V1029 W1030 Q1034 V1035 N1058	F994-A1032 WeakPolarHBondContact O-CA 3.47Å; F994-A1032 PolarHBondContact O-N 2.92Å; T997-A1032 HydrophobicContact CG2-CB 4.4Å; V1000-A1032 HydrophobicContact CB-CB 4.36Å; V1000-A1032 HydrophobicContact CG2-CB 3.33Å; V1029-A1032 WeakPolarHBondContact O-CB 3.22Å; V1029-A1032 PolarHBondContact O-N 3.4Å; V1029-A1032 VanDerWaalsContact O-N 3.1Å; W1030-A1032 VanDerWaalsContact C-N 3.32Å; A1032-Q1034 PolarHBondContact O-N 2.81Å; A1032-V1035 HydrophobicContact CB-CG2 4.45Å; A1032-N1058 PolarHBondContact O-ND2 3.26Å
1033	K	94.6	Very high	91.8	Very high	133 Å²	133	40.2 Å²	40.2	58%	0.578	21%	0.208	S	C	*	.	S	Bend	trans	-63.5	-42.5	-179.6	-60.7	179.9	-170.5	162	0	112.2	T997 D998	T997-K1033 PolarHBondContact O-N 3.12Å; T997-K1033 VanDerWaalsContact O-N 3.11Å; D998-K1033 IonicContact OD1-NZ 3.52Å; D998-K1033 PolarHBondContact OD1-NZ 2.99Å
1034	Q	96.5	Very high	91.3	Very high	41 Å²	41	40.8 Å²	40.8	19%	0.192	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136.3	175.8	-169.9	63.9	28.5	0	0	110.8	W923 D998 V999 V1000 A1032 N1058	W923-Q1034 HydrophobicContact CD2-CG 4.14Å; W923-Q1034 HydrophobicContact CE3-CG 3.82Å; W923-Q1034 HydrophobicContact CH2-CG 4.22Å; W923-Q1034 HydrophobicContact CZ3-CG 3.87Å; D998-Q1034 PolarHBondContact O-N 3.41Å; V999-Q1034 CarbonylContact C-O 3.59Å; V999-Q1034 WeakPolarHBondContact CA-O 3.45Å; V1000-Q1034 PolarHBondContact N-O 3.42Å; A1032-Q1034 PolarHBondContact O-N 2.81Å; Q1034-N1058 CarbonylContact C-O 3.32Å; Q1034-N1058 WeakPolarHBondContact CA-O 3.38Å; Q1034-N1058 PolarHBondContact NE2-O 3.42Å
1035	V	97.5	Very high	90.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	134.1	174.9	-175.1	0	0	0	0	108.8	V1000 V1002 V1029 A1032 V1037 N1058 T1059 A1060	V1000-V1035 HydrophobicContact CB-CG1 4.43Å; V1000-V1035 HydrophobicContact CB-CG2 4.35Å; V1000-V1035 CarbonylContact O-C 3.57Å; V1000-V1035 WeakPolarHBondContact O-CA 3.2Å; V1002-V1035 HydrophobicContact CG2-CG1 3.87Å; V1029-V1035 HydrophobicContact CG2-CG1 4.34Å; V1029-V1035 WeakPolarHBondContact O-CG2 3.07Å; A1032-V1035 HydrophobicContact CB-CG2 4.45Å; V1035-V1037 HydrophobicContact CG1-CG2 4.06Å; V1035-N1058 PolarHBondContact N-O 3.43Å; V1035-T1059 HydrophobicContact CB-CG2 4.19Å; V1035-T1059 HydrophobicContact CG1-CG2 4.24Å; V1035-T1059 CarbonylContact O-C 3.57Å; V1035-T1059 WeakPolarHBondContact O-CA 3.35Å; V1035-A1060 PolarHBondContact O-N 3.22Å
1036	V	97.3	Very high	89.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.7	172.8	-179.7	0	0	0	0	108.9	V915 T920 W923 V1000 L1001 V1002 A1060 L1062	V915-V1036 HydrophobicContact CG2-CG1 4.5Å; T920-V1036 HydrophobicContact CG2-CG1 4.06Å; T920-V1036 HydrophobicContact CG2-CG2 4.29Å; W923-V1036 HydrophobicContact CE3-CG2 3.82Å; W923-V1036 HydrophobicContact CZ3-CG2 3.81Å; V1000-V1036 PolarHBondContact O-N 3.23Å; L1001-V1036 HydrophobicContact CD2-CB 4.01Å; L1001-V1036 HydrophobicContact CD2-CG1 4.39Å; V1002-V1036 PolarHBondContact N-O 3.09Å; V1036-A1060 CarbonylContact C-O 3.58Å; V1036-A1060 VanDerWaalsContact CA-O 3.27Å; V1036-A1060 WeakPolarHBondContact CA-O 3.5Å; V1036-L1062 HydrophobicContact CG1-CB 3.8Å; V1036-L1062 HydrophobicContact CG1-CD2 4.48Å
1037	V	96.8	Very high	87.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.9	-177.7	-176.4	0	0	0	0	110.4	V1002 V1035 K1039 F1054 T1059 A1060 M1061 L1062	V1002-V1037 HydrophobicContact CB-CB 4.47Å; V1002-V1037 HydrophobicContact CB-CG1 4.4Å; V1002-V1037 HydrophobicContact CB-CG2 4.12Å; V1002-V1037 HydrophobicContact CG1-CG1 4.39Å; V1002-V1037 HydrophobicContact CG2-CG2 4.37Å; V1035-V1037 HydrophobicContact CG1-CG2 4.06Å; V1037-K1039 HydrophobicContact CG1-CD 4.18Å; V1037-F1054 HydrophobicContact CB-CD1 4.49Å; V1037-F1054 HydrophobicContact CB-CE1 4.37Å; V1037-F1054 HydrophobicContact CG1-CD1 4.24Å; V1037-F1054 HydrophobicContact CG1-CE1 3.68Å; V1037-F1054 HydrophobicContact CG1-CZ 4.35Å; V1037-F1054 HydrophobicContact CG2-CD1 4.15Å; V1037-F1054 HydrophobicContact CG2-CE1 4.14Å; V1037-T1059 HydrophobicContact CG2-CG2 3.76Å; V1037-A1060 PolarHBondContact N-O 3.18Å; V1037-M1061 HydrophobicContact CB-CE 3.8Å; V1037-M1061 HydrophobicContact CB-SD 3.87Å; V1037-M1061 HydrophobicContact CG1-CE 3.82Å; V1037-M1061 HydrophobicContact CG1-SD 4.47Å; V1037-M1061 HydrophobicContact CG2-SD 4.33Å; V1037-L1062 PolarHBondContact O-N 3.27Å
1038	M	95.2	Very high	86.3	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113.8	177.8	-67.1	175.1	55.2	0	0	111.2	V1002 I1003 G1004 L1062 R1069 C1070 L1073	V1002-M1038 PolarHBondContact O-N 3.43Å; I1003-M1038 HydrophobicContact CD1-SD 4.19Å; I1003-M1038 HydrophobicContact CG1-SD 3.94Å; I1003-M1038 HydrophobicContact CG2-CB 4.29Å; I1003-M1038 HydrophobicContact CG2-CE 4.22Å; I1003-M1038 HydrophobicContact CG2-SD 4.44Å; G1004-M1038 PolarHBondContact N-O 2.85Å; G1004-M1038 VanDerWaalsContact N-O 3.1Å; M1038-L1062 WeakPolarHBondContact CA-O 3.47Å; M1038-L1062 HydrophobicContact CG-CB 4.06Å; M1038-L1062 HydrophobicContact CG-CD2 4Å; M1038-L1062 HydrophobicContact CG-CG 4.3Å; M1038-L1062 HydrophobicContact SD-CD2 4.24Å; M1038-R1069 HydrophobicContact CE-CB 3.35Å; M1038-R1069 HydrophobicContact CE-CG 4.47Å; M1038-C1070 VanDerWaalsContact CE-SG 3.53Å; M1038-L1073 HydrophobicContact CE-CD1 4.22Å; M1038-L1073 HydrophobicContact SD-CD1 3.73Å
1039	K	92.2	Very high	85.2	Confident	30 Å²	30	41.9 Å²	41.9	13%	0.13	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	161.7	176.5	64.9	-170.8	-55.8	-128.6	0	111.3	V1037 S1041 L1042 G1043 F1054 M1061 L1063 G1064	V1037-K1039 HydrophobicContact CG1-CD 4.18Å; K1039-S1041 VanDerWaalsContact CD-O 3.29Å; K1039-S1041 WeakPolarHBondContact CD-O 3.41Å; K1039-S1041 WeakPolarHBondContact CE-O 3.5Å; K1039-S1041 WeakPolarHBondContact CG-O 3.41Å; K1039-S1041 PolarHBondContact NZ-O 2.82Å; K1039-L1042 PolarHBondContact NZ-O 2.81Å; K1039-G1043 PolarHBondContact NZ-O 3.29Å; K1039-F1054 HydrophobicContact CD-CE2 4.09Å; K1039-F1054 HydrophobicContact CD-CZ 4.03Å; K1039-M1061 HydrophobicContact CD-CE 3.55Å; K1039-M1061 HydrophobicContact CG-CE 3.94Å; K1039-L1063 HydrophobicContact CG-CD2 4.06Å; K1039-L1063 VanDerWaalsContact O-CA 3.31Å; K1039-L1063 WeakPolarHBondContact O-CA 3.45Å; K1039-G1064 CarbonylContact C-O 3.44Å; K1039-G1064 VanDerWaalsContact C-O 3.22Å; K1039-G1064 PolarHBondContact O-N 3.2Å
1040	R	89.3	Confident	84.5	Confident	154 Å²	154	45.7 Å²	45.7	58%	0.581	24%	0.243	S	C	*	.	S	Bend	trans	-67.7	-36.5	-177	-67.5	172.5	-63.8	170.9	5.6	114	G1064	R1040-G1064 WeakPolarHBondContact CA-O 3.26Å; R1040-G1064 PolarHBondContact N-O 3.03Å
1041	S	87.8	Confident	84.3	Confident	69 Å²	69	43.8 Å²	43.8	48%	0.483	24%	0.236	S	C	.	.	S	Bend	trans	-157.7	173.3	-179.4	70	0	0	0	0	110.3	K1039 G1043	K1039-S1041 VanDerWaalsContact CD-O 3.29Å; K1039-S1041 WeakPolarHBondContact CD-O 3.41Å; K1039-S1041 WeakPolarHBondContact CE-O 3.5Å; K1039-S1041 WeakPolarHBondContact CG-O 3.41Å; K1039-S1041 PolarHBondContact NZ-O 2.82Å; S1041-G1043 PolarHBondContact O-N 3.33Å; S1041-G1043 PolarHBondContact OG-N 3.37Å
1042	L	84.9	Confident	84	Confident	51 Å²	51	41.5 Å²	41.5	27%	0.267	23%	0.229	S	C	.	.	S	Bend	trans	-70.6	5.9	176.2	-67.6	170.6	0	0	0	114.9	H912 K1039 M1061	H912-L1042 HydrophobicContact CB-CD2 4.45Å; H912-L1042 WeakPolarHBondContact ND1-CD1 3.35Å; K1039-L1042 PolarHBondContact NZ-O 2.81Å; L1042-M1061 HydrophobicContact CD2-CE 4.02Å; L1042-M1061 HydrophobicContact CD2-CG 4.31Å
1043	G	75.9	Confident	83.8	Confident	37 Å²	37	41.3 Å²	41.3	38%	0.381	23%	0.228	S	C	.	.			trans	-60.5	162.6	-179.5	0	0	0	0	0	115.5	K1039 S1041	K1039-G1043 PolarHBondContact NZ-O 3.29Å; S1041-G1043 PolarHBondContact O-N 3.33Å; S1041-G1043 PolarHBondContact OG-N 3.37Å
1044	V	73.3	Confident	83.8	Confident	54 Å²	54	35.1 Å²	35.1	33%	0.327	20%	0.201	S	C	.	.			trans	-71.6	163.3	-175.5	-62.5	0	0	0	0	114.5	A1048 D1050	V1044-A1048 HydrophobicContact CG2-CB 4.2Å; V1044-D1050 WeakPolarHBondContact CG1-OD1 3.09Å
1045	G	67.9	Low	83.5	Confident	15 Å²	15	36.1 Å²	36.1	16%	0.155	20%	0.204	C	C	.	.			trans	-85.8	-150.8	175.1	0	0	0	0	0	113.4	N1006 D1007	N1006-G1045 WeakPolarHBondContact ND2-CA 3.43Å; N1006-G1045 PolarHBondContact ND2-N 3.13Å; D1007-G1045 WeakPolarHBondContact OD1-CA 3.1Å
1046	Y	62.3	Low	83.2	Confident	68 Å²	68	38.3 Å²	38.3	27%	0.267	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-45.2	-179.4	165.6	-102.7	0	0	0	111.3	A832 D833 D1007 A1048	A832-Y1046 HydrophobicContact CB-CD1 3.66Å; A832-Y1046 HydrophobicContact CB-CD2 3.6Å; A832-Y1046 HydrophobicContact CB-CE1 3.67Å; A832-Y1046 HydrophobicContact CB-CE2 3.62Å; A832-Y1046 HydrophobicContact CB-CG 3.6Å; D833-Y1046 PolarHBondContact OD1-OH 3.08Å; D833-Y1046 PolarHBondContact OD2-OH 3.39Å; D1007-Y1046 WeakPolarHBondContact OD2-CA 3.41Å; D1007-Y1046 VanDerWaalsContact OD2-CB 3.23Å; D1007-Y1046 WeakPolarHBondContact OD2-CB 3.46Å; D1007-Y1046 PolarHBondContact OD2-N 2.99Å; Y1046-A1048 PolarHBondContact O-N 3.31Å
1047	A	58.1	Low	82.7	Confident	18 Å²	18	44.2 Å²	44.2	15%	0.149	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-6	178.6	0	0	0	0	0	114.1	D1007 I1020 I1021 V1049	D1007-A1047 PolarHBondContact OD2-N 2.87Å; I1020-A1047 HydrophobicContact CG2-CB 3.74Å; I1021-A1047 HydrophobicContact CG2-CB 3.52Å; A1047-V1049 HydrophobicContact CB-CG2 3.99Å; A1047-V1049 PolarHBondContact O-N 2.89Å
1048	A	64.5	Low	82.6	Confident	58 Å²	58	45.9 Å²	45.9	48%	0.479	26%	0.263	S	S	.	.			trans	55.5	27.5	-175.5	0	0	0	0	0	114.1	V1044 Y1046	V1044-A1048 HydrophobicContact CG2-CB 4.2Å; Y1046-A1048 PolarHBondContact O-N 3.31Å
1049	V	72	Confident	82.6	Confident	24 Å²	24	45.9 Å²	45.9	15%	0.145	26%	0.263	C	S	.	.			trans	-99.1	141.9	172.2	-162.9	0	0	0	0	108.6	I1020 A1047	I1020-V1049 HydrophobicContact CB-CG2 4.35Å; I1020-V1049 HydrophobicContact CG2-CG2 3.26Å; A1047-V1049 HydrophobicContact CB-CG2 3.99Å; A1047-V1049 PolarHBondContact O-N 2.89Å
1050	D	81.9	Confident	82.8	Confident	79 Å²	79	44.4 Å²	44.4	42%	0.422	26%	0.256	S	S	.	.			trans	-67.6	158.9	165.1	-70	-44.1	0	0	0	110.4	I908 N1010 V1044	I908-D1050 HydrophobicContact CD1-CB 3.25Å; I908-D1050 HydrophobicContact CG1-CB 4.47Å; N1010-D1050 PolarHBondContact ND2-O 2.88Å; N1010-D1050 VanDerWaalsContact ND2-O 3.14Å; V1044-D1050 WeakPolarHBondContact CG1-OD1 3.09Å
1051	N	89.6	Confident	83.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.229	C	C	.	.			trans	-112.1	112.8	-176	-165.6	-24.2	0	0	0	110	N1006 N1010 I1053 F1054	N1006-N1051 PolarHBondContact O-ND2 2.92Å; N1006-N1051 WeakPolarHBondContact OD1-CB 3.47Å; N1006-N1051 PolarHBondContact OD1-ND2 3.34Å; N1010-N1051 WeakPolarHBondContact CA-OD1 3.35Å; N1010-N1051 PolarHBondContact OD1-OD1 2.94Å; N1051-I1053 WeakPolarHBondContact ND2-CD1 3.39Å; N1051-I1053 PolarHBondContact O-N 2.93Å; N1051-I1053 VanDerWaalsContact OD1-CG1 3.23Å; N1051-I1053 WeakPolarHBondContact OD1-CG1 3.48Å; N1051-I1053 WeakPolarHBondContact OD1-CG2 3.47Å; N1051-I1053 PolarHBondContact OD1-N 3.35Å; N1051-F1054 HydrophobicContact CB-CD1 4.23Å; N1051-F1054 HydrophobicContact CB-CD2 3.76Å; N1051-F1054 HydrophobicContact CB-CE1 3.97Å; N1051-F1054 HydrophobicContact CB-CE2 3.49Å; N1051-F1054 VanDerWaalsContact CB-CE2 3.49Å; N1051-F1054 HydrophobicContact CB-CG 4.12Å; N1051-F1054 HydrophobicContact CB-CZ 3.6Å; N1051-F1054 PolarHBondContact O-N 3.29Å
1052	P	90.3	Very high	83.4	Confident	35 Å²	35	33.9 Å²	33.9	23%	0.227	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-56.6	-31.3	179.9	-25	35.1	0	0	0	112.9	I908 N1010 A1012 F1054 Y1055	I908-P1052 HydrophobicContact CD1-CG 4.23Å; I908-P1052 HydrophobicContact CG1-CG 4.45Å; N1010-P1052 WeakPolarHBondContact OD1-CD 3.45Å; A1012-P1052 HydrophobicContact CB-CG 4.08Å; P1052-F1054 PolarHBondContact O-N 3.3Å; P1052-F1054 VanDerWaalsContact O-N 3.11Å; P1052-Y1055 PolarHBondContact O-N 3Å
1053	I	92.9	Very high	83.9	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-60.5	-28.6	-177	82.5	-171.2	0	0	0	112.3	V1009 V1029 W1030 N1051 Y1055 N1056 T1059	V1009-I1053 HydrophobicContact CB-CD1 4.06Å; V1009-I1053 HydrophobicContact CG2-CD1 3.63Å; V1009-I1053 WeakPolarHBondContact O-CD1 3.38Å; V1029-I1053 HydrophobicContact CG2-CD1 4.04Å; W1030-I1053 HydrophobicContact CB-CG2 4.4Å; W1030-I1053 HydrophobicContact CD2-CG2 4.5Å; W1030-I1053 HydrophobicContact CE3-CG2 3.88Å; N1051-I1053 WeakPolarHBondContact ND2-CD1 3.39Å; N1051-I1053 PolarHBondContact O-N 2.93Å; N1051-I1053 VanDerWaalsContact OD1-CG1 3.23Å; N1051-I1053 WeakPolarHBondContact OD1-CG1 3.48Å; N1051-I1053 WeakPolarHBondContact OD1-CG2 3.47Å; N1051-I1053 PolarHBondContact OD1-N 3.35Å; I1053-Y1055 PolarHBondContact O-N 3.23Å; I1053-Y1055 VanDerWaalsContact O-N 3.08Å; I1053-N1056 WeakPolarHBondContact O-CB 3.16Å; I1053-N1056 PolarHBondContact O-N 2.85Å; I1053-N1056 VanDerWaalsContact O-N 3.11Å; I1053-T1059 WeakPolarHBondContact O-CB 3.3Å; I1053-T1059 VanDerWaalsContact O-CG2 3.29Å; I1053-T1059 WeakPolarHBondContact O-CG2 3.38Å; I1053-T1059 PolarHBondContact O-OG1 3.31Å
1054	F	93.2	Very high	84.6	Confident	3 Å²	3	32.1 Å²	32.1	1%	0.013	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-65.4	-14.5	-179.3	-59.3	-18.6	0	0	0	112.7	H912 N1006 V1037 K1039 N1051 P1052 M1061	H912-F1054 WeakPolarHBondContact CA-O 3.43Å; H912-F1054 VanDerWaalsContact CB-O 3.31Å; H912-F1054 WeakPolarHBondContact CB-O 3.35Å; N1006-F1054 WeakPolarHBondContact OD1-CZ 3.28Å; V1037-F1054 HydrophobicContact CB-CD1 4.49Å; V1037-F1054 HydrophobicContact CB-CE1 4.37Å; V1037-F1054 HydrophobicContact CG1-CD1 4.24Å; V1037-F1054 HydrophobicContact CG1-CE1 3.68Å; V1037-F1054 HydrophobicContact CG1-CZ 4.35Å; V1037-F1054 HydrophobicContact CG2-CD1 4.15Å; V1037-F1054 HydrophobicContact CG2-CE1 4.14Å; K1039-F1054 HydrophobicContact CD-CE2 4.09Å; K1039-F1054 HydrophobicContact CD-CZ 4.03Å; N1051-F1054 HydrophobicContact CB-CD1 4.23Å; N1051-F1054 HydrophobicContact CB-CD2 3.76Å; N1051-F1054 HydrophobicContact CB-CE1 3.97Å; N1051-F1054 HydrophobicContact CB-CE2 3.49Å; N1051-F1054 VanDerWaalsContact CB-CE2 3.49Å; N1051-F1054 HydrophobicContact CB-CG 4.12Å; N1051-F1054 HydrophobicContact CB-CZ 3.6Å; N1051-F1054 PolarHBondContact O-N 3.29Å; P1052-F1054 PolarHBondContact O-N 3.3Å; P1052-F1054 VanDerWaalsContact O-N 3.11Å; F1054-M1061 HydrophobicContact CB-CE 4.48Å; F1054-M1061 HydrophobicContact CB-SD 3.85Å; F1054-M1061 HydrophobicContact CD1-CE 4.02Å; F1054-M1061 HydrophobicContact CD1-SD 3.87Å; F1054-M1061 HydrophobicContact CD2-CE 4.45Å; F1054-M1061 HydrophobicContact CE1-CE 4.43Å; F1054-M1061 HydrophobicContact CG-CE 4.06Å; F1054-M1061 HydrophobicContact CG-SD 3.94Å
1055	Y	90.8	Very high	85.4	Confident	61 Å²	61	33.1 Å²	33.1	24%	0.239	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-111.1	3.6	-178.6	-54	-91.8	0	0	0	112.1	I908 G910 H912 P1052 I1053	I908-Y1055 HydrophobicContact CD1-CE2 4.31Å; I908-Y1055 HydrophobicContact CG2-CD1 4.36Å; I908-Y1055 HydrophobicContact CG2-CD2 3.33Å; I908-Y1055 HydrophobicContact CG2-CE2 3.54Å; I908-Y1055 HydrophobicContact CG2-CG 3.77Å; G910-Y1055 WeakPolarHBondContact O-CD1 3.43Å; H912-Y1055 HydrophobicContact CB-CD1 4.47Å; P1052-Y1055 PolarHBondContact O-N 3Å; I1053-Y1055 PolarHBondContact O-N 3.23Å; I1053-Y1055 VanDerWaalsContact O-N 3.08Å
1056	N	90.1	Very high	86.5	Confident	47 Å²	47	32.9 Å²	32.9	25%	0.251	19%	0.192	S	C	.	.	S	Bend	trans	-73.9	144.7	175.2	-73.2	-4.7	0	0	0	110.8	I1053 N1058 T1059	I1053-N1056 WeakPolarHBondContact O-CB 3.16Å; I1053-N1056 PolarHBondContact O-N 2.85Å; I1053-N1056 VanDerWaalsContact O-N 3.11Å; N1056-N1058 VanDerWaalsContact C-N 3.26Å; N1056-N1058 WeakPolarHBondContact CB-OD1 3.18Å; N1056-N1058 PolarHBondContact O-N 3Å; N1056-T1059 PolarHBondContact O-N 2.93Å
1057	P	88.9	Confident	88	Confident	124 Å²	124	32.8 Å²	32.8	81%	0.805	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.1	-177.1	25.6	-34.8	0	0	0	114	T1059	P1057-T1059 VanDerWaalsContact C-N 3.3Å
1058	N	93.3	Very high	89.8	Confident	35 Å²	35	37.8 Å²	37.8	19%	0.187	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.7	175.6	68.5	-21.4	0	0	0	113.5	W1030 A1032 Q1034 V1035 N1056	W1030-N1058 PolarHBondContact O-ND2 3.36Å; A1032-N1058 PolarHBondContact O-ND2 3.26Å; Q1034-N1058 CarbonylContact C-O 3.32Å; Q1034-N1058 WeakPolarHBondContact CA-O 3.38Å; Q1034-N1058 PolarHBondContact NE2-O 3.42Å; V1035-N1058 PolarHBondContact N-O 3.43Å; N1056-N1058 VanDerWaalsContact C-N 3.26Å; N1056-N1058 WeakPolarHBondContact CB-OD1 3.18Å; N1056-N1058 PolarHBondContact O-N 3Å
1059	T	95.9	Very high	91.2	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	128	-178.3	-59.2	0	0	0	0	110.7	V1035 V1037 I1053 N1056 P1057 M1061	V1035-T1059 HydrophobicContact CB-CG2 4.19Å; V1035-T1059 HydrophobicContact CG1-CG2 4.24Å; V1035-T1059 CarbonylContact O-C 3.57Å; V1035-T1059 WeakPolarHBondContact O-CA 3.35Å; V1037-T1059 HydrophobicContact CG2-CG2 3.76Å; I1053-T1059 WeakPolarHBondContact O-CB 3.3Å; I1053-T1059 VanDerWaalsContact O-CG2 3.29Å; I1053-T1059 WeakPolarHBondContact O-CG2 3.38Å; I1053-T1059 PolarHBondContact O-OG1 3.31Å; N1056-T1059 PolarHBondContact O-N 2.93Å; P1057-T1059 VanDerWaalsContact C-N 3.3Å; T1059-M1061 HydrophobicContact CG2-SD 4.49Å
1060	A	95.2	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.7	177.8	0	0	0	0	0	110.7	T913 V915 W923 V1035 V1036 V1037	T913-A1060 CarbonylContact O-C 3.56Å; T913-A1060 WeakPolarHBondContact O-CA 3.48Å; V915-A1060 HydrophobicContact CB-CB 4.21Å; V915-A1060 HydrophobicContact CG1-CB 3.54Å; V915-A1060 HydrophobicContact CG2-CB 3.63Å; W923-A1060 HydrophobicContact CH2-CB 4.1Å; W923-A1060 HydrophobicContact CZ3-CB 3.94Å; V1035-A1060 PolarHBondContact O-N 3.22Å; V1036-A1060 CarbonylContact C-O 3.58Å; V1036-A1060 VanDerWaalsContact CA-O 3.27Å; V1036-A1060 WeakPolarHBondContact CA-O 3.5Å; V1037-A1060 PolarHBondContact N-O 3.18Å
1061	M	95.6	Very high	93	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.3	-179.9	-55.6	-55.6	-58.7	0	0	109.2	H912 T913 E914 V915 V1037 K1039 L1042 F1054 T1059 L1063	H912-M1061 HydrophobicContact CB-CG 4.03Å; T913-M1061 WeakPolarHBondContact O-CB 3.45Å; T913-M1061 PolarHBondContact O-N 2.92Å; E914-M1061 WeakPolarHBondContact CA-O 3.44Å; E914-M1061 WeakPolarHBondContact CG-O 3.34Å; V915-M1061 PolarHBondContact N-O 3.45Å; V1037-M1061 HydrophobicContact CB-CE 3.8Å; V1037-M1061 HydrophobicContact CB-SD 3.87Å; V1037-M1061 HydrophobicContact CG1-CE 3.82Å; V1037-M1061 HydrophobicContact CG1-SD 4.47Å; V1037-M1061 HydrophobicContact CG2-SD 4.33Å; K1039-M1061 HydrophobicContact CD-CE 3.55Å; K1039-M1061 HydrophobicContact CG-CE 3.94Å; L1042-M1061 HydrophobicContact CD2-CE 4.02Å; L1042-M1061 HydrophobicContact CD2-CG 4.31Å; F1054-M1061 HydrophobicContact CB-CE 4.48Å; F1054-M1061 HydrophobicContact CB-SD 3.85Å; F1054-M1061 HydrophobicContact CD1-CE 4.02Å; F1054-M1061 HydrophobicContact CD1-SD 3.87Å; F1054-M1061 HydrophobicContact CD2-CE 4.45Å; F1054-M1061 HydrophobicContact CE1-CE 4.43Å; F1054-M1061 HydrophobicContact CG-CE 4.06Å; F1054-M1061 HydrophobicContact CG-SD 3.94Å; T1059-M1061 HydrophobicContact CG2-SD 4.49Å; M1061-L1063 HydrophobicContact CB-CD2 4.26Å; M1061-L1063 HydrophobicContact CB-CG 4.34Å; M1061-L1063 HydrophobicContact CE-CD2 4.36Å
1062	L	95.5	Very high	93.2	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	88.4	170.3	-179.4	61.2	0	0	0	108.3	V915 V917 T920 V1036 V1037 M1038 L1073	V915-L1062 HydrophobicContact CG2-CB 4.42Å; V915-L1062 WeakPolarHBondContact O-CD1 3.35Å; V917-L1062 HydrophobicContact CG2-CD1 4.13Å; T920-L1062 HydrophobicContact CG2-CD2 4.41Å; V1036-L1062 HydrophobicContact CG1-CB 3.8Å; V1036-L1062 HydrophobicContact CG1-CD2 4.48Å; V1037-L1062 PolarHBondContact O-N 3.27Å; M1038-L1062 WeakPolarHBondContact CA-O 3.47Å; M1038-L1062 HydrophobicContact CG-CB 4.06Å; M1038-L1062 HydrophobicContact CG-CD2 4Å; M1038-L1062 HydrophobicContact CG-CG 4.3Å; M1038-L1062 HydrophobicContact SD-CD2 4.24Å; L1062-L1073 HydrophobicContact CD2-CD1 4.07Å; L1062-L1073 HydrophobicContact CD2-CD2 4.33Å; L1062-L1073 HydrophobicContact CD2-CG 4.37Å
1063	L	94	Very high	93.5	Very high	33 Å²	33	37.2 Å²	37.2	17%	0.173	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.3	-171.2	-62.4	-178.8	0	0	0	112.5	K1039 M1061 R1069	K1039-L1063 HydrophobicContact CG-CD2 4.06Å; K1039-L1063 VanDerWaalsContact O-CA 3.31Å; K1039-L1063 WeakPolarHBondContact O-CA 3.45Å; M1061-L1063 HydrophobicContact CB-CD2 4.26Å; M1061-L1063 HydrophobicContact CB-CG 4.34Å; M1061-L1063 HydrophobicContact CE-CD2 4.36Å; L1063-R1069 VanDerWaalsContact O-CZ 3.3Å; L1063-R1069 PolarHBondContact O-NE 3.02Å; L1063-R1069 PolarHBondContact O-NH2 3.29Å
1064	G	90.9	Very high	93.6	Very high	17 Å²	17	37.8 Å²	37.8	18%	0.175	19%	0.194	C	C	.	.	S	Bend	trans	155.5	176.2	176.8	0	0	0	0	0	113.7	K1039 R1040	K1039-G1064 CarbonylContact C-O 3.44Å; K1039-G1064 VanDerWaalsContact C-O 3.22Å; K1039-G1064 PolarHBondContact O-N 3.2Å; R1040-G1064 WeakPolarHBondContact CA-O 3.26Å; R1040-G1064 PolarHBondContact N-O 3.03Å
1065	D	91.2	Very high	93.7	Very high	75 Å²	75	42.1 Å²	42.1	40%	0.401	21%	0.214	S	C	.	.			trans	-65.7	137.4	168.6	-179.1	73	0	0	0	110.5	K1067 K1068 R1069	D1065-K1067 VanDerWaalsContact C-N 3.34Å; D1065-K1067 PolarHBondContact O-N 3.37Å; D1065-K1067 WeakPolarHBondContact OD2-CB 3.47Å; D1065-K1067 PolarHBondContact OD2-N 2.92Å; D1065-K1068 HydrophobicContact CB-CB 4.4Å; D1065-K1068 PolarHBondContact O-N 3.18Å; D1065-R1069 WeakPolarHBondContact O-CG 3.42Å; D1065-R1069 PolarHBondContact O-N 3.43Å
1066	A	90.9	Very high	93.9	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-40.3	-173.6	0	0	0	0	0	112	A941 A943 I1003 C1070	A941-A1066 HydrophobicContact CB-CB 3.94Å; A943-A1066 HydrophobicContact CB-CB 4.28Å; I1003-A1066 HydrophobicContact CG2-CB 4.27Å; A1066-C1070 VanDerWaalsContact O-CB 3.3Å; A1066-C1070 WeakPolarHBondContact O-CB 3.45Å; A1066-C1070 PolarHBondContact O-N 3.17Å; A1066-C1070 PolarHBondContact O-SG 2.83Å
1067	K	93.3	Very high	94.1	Very high	66 Å²	66	37.9 Å²	37.9	29%	0.287	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-50.9	-179.8	-176.7	62.2	172.3	78.5	0	110.8	A941 R942 A943 P946 D1065 R1069 C1070 D1071	A941-K1067 HydrophobicContact CB-CB 4.26Å; A941-K1067 WeakPolarHBondContact O-CB 3.06Å; R942-K1067 WeakPolarHBondContact O-CD 3.17Å; A943-K1067 HydrophobicContact CB-CB 4.43Å; A943-K1067 HydrophobicContact CB-CD 4.29Å; P946-K1067 HydrophobicContact CG-CD 4.2Å; D1065-K1067 VanDerWaalsContact C-N 3.34Å; D1065-K1067 PolarHBondContact O-N 3.37Å; D1065-K1067 WeakPolarHBondContact OD2-CB 3.47Å; D1065-K1067 PolarHBondContact OD2-N 2.92Å; K1067-R1069 PolarHBondContact O-N 3.25Å; K1067-C1070 PolarHBondContact O-N 2.89Å; K1067-D1071 IonicContact NZ-OD1 2.65Å; K1067-D1071 PolarHBondContact NZ-OD1 3.28Å; K1067-D1071 IonicContact NZ-OD2 2.86Å; K1067-D1071 PolarHBondContact NZ-OD2 3.16Å; K1067-D1071 VanDerWaalsContact O-CG 3.23Å; K1067-D1071 PolarHBondContact O-N 3.39Å
1068	K	94.9	Very high	94.3	Very high	124 Å²	124	35.4 Å²	35.4	54%	0.539	18%	0.175	S	C	.	.	H	α-helix	trans	-59.3	-47.3	-178.9	-177.8	173.9	173.4	177.7	0	111.7	D1065 D1071 E1072	D1065-K1068 HydrophobicContact CB-CB 4.4Å; D1065-K1068 PolarHBondContact O-N 3.18Å; K1068-D1071 PolarHBondContact O-N 3.26Å; K1068-E1072 WeakPolarHBondContact CE-OE1 3.45Å; K1068-E1072 WeakPolarHBondContact CG-OE1 3.27Å; K1068-E1072 IonicContact NZ-OE1 3.9Å; K1068-E1072 WeakPolarHBondContact O-CB 3.48Å; K1068-E1072 VanDerWaalsContact O-CG 3.29Å; K1068-E1072 WeakPolarHBondContact O-CG 3.38Å; K1068-E1072 PolarHBondContact O-N 3.43Å
1069	R	94.4	Very high	94.3	Very high	65 Å²	65	38.5 Å²	38.5	25%	0.245	19%	0.188	C	C	.	.	H	α-helix	trans	-68.2	-37.7	179.9	-67.3	-56.7	178.9	-166.5	4.1	112.9	M1038 L1063 D1065 K1067 E1072 L1073	M1038-R1069 HydrophobicContact CE-CB 3.35Å; M1038-R1069 HydrophobicContact CE-CG 4.47Å; L1063-R1069 VanDerWaalsContact O-CZ 3.3Å; L1063-R1069 PolarHBondContact O-NE 3.02Å; L1063-R1069 PolarHBondContact O-NH2 3.29Å; D1065-R1069 WeakPolarHBondContact O-CG 3.42Å; D1065-R1069 PolarHBondContact O-N 3.43Å; K1067-R1069 PolarHBondContact O-N 3.25Å; R1069-E1072 VanDerWaalsContact CD-OE2 3.31Å; R1069-E1072 WeakPolarHBondContact CD-OE2 3.47Å; R1069-E1072 IonicContact CZ-OE2 2.84Å; R1069-E1072 IonicContact NE-OE2 3.44Å; R1069-E1072 IonicContact NH1-OE1 3.89Å; R1069-E1072 IonicContact NH1-OE2 2.72Å; R1069-E1072 PolarHBondContact NH1-OE2 3.46Å; R1069-E1072 PolarHBondContact O-N 2.9Å; R1069-L1073 WeakPolarHBondContact O-CB 3.46Å; R1069-L1073 VanDerWaalsContact O-CG 3.26Å; R1069-L1073 WeakPolarHBondContact O-CG 3.45Å; R1069-L1073 PolarHBondContact O-N 3.08Å
1070	C	95.2	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.2	-39.6	174.5	-67.1	0	0	0	0	112.1	A943 P946 I947 M1038 A1066 K1067 L1074	A943-C1070 HydrophobicContact CB-CB 4.36Å; P946-C1070 HydrophobicContact CB-CB 4.27Å; P946-C1070 HydrophobicContact CG-CB 3.86Å; I947-C1070 HydrophobicContact CD1-CB 4.02Å; I947-C1070 VanDerWaalsContact CD1-SG 3.51Å; I947-C1070 HydrophobicContact CG1-CB 4.03Å; I947-C1070 WeakPolarHBondContact CG1-SG 3.26Å; M1038-C1070 VanDerWaalsContact CE-SG 3.53Å; A1066-C1070 VanDerWaalsContact O-CB 3.3Å; A1066-C1070 WeakPolarHBondContact O-CB 3.45Å; A1066-C1070 PolarHBondContact O-N 3.17Å; A1066-C1070 PolarHBondContact O-SG 2.83Å; K1067-C1070 PolarHBondContact O-N 2.89Å; C1070-L1074 WeakPolarHBondContact O-CB 3.21Å; C1070-L1074 PolarHBondContact O-N 3.07Å
1071	D	96.2	Very high	93.7	Very high	60 Å²	60	43.2 Å²	43.2	32%	0.321	21%	0.21	S	C	.	.	H	α-helix	trans	-65.2	-44.5	175.3	-67.7	-24.3	0	0	0	111.6	P946 K1067 K1068 L1074 E1075	P946-D1071 VanDerWaalsContact CB-OD1 3.26Å; P946-D1071 WeakPolarHBondContact CB-OD1 3.4Å; P946-D1071 WeakPolarHBondContact CG-OD1 3.41Å; K1067-D1071 IonicContact NZ-OD1 2.65Å; K1067-D1071 PolarHBondContact NZ-OD1 3.28Å; K1067-D1071 IonicContact NZ-OD2 2.86Å; K1067-D1071 PolarHBondContact NZ-OD2 3.16Å; K1067-D1071 VanDerWaalsContact O-CG 3.23Å; K1067-D1071 PolarHBondContact O-N 3.39Å; K1068-D1071 PolarHBondContact O-N 3.26Å; D1071-L1074 PolarHBondContact O-N 3.44Å; D1071-E1075 WeakPolarHBondContact O-CB 3.27Å; D1071-E1075 PolarHBondContact O-N 3.16Å
1072	E	95.6	Very high	93.3	Very high	59 Å²	59	47.1 Å²	47.1	28%	0.276	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-42.2	176.6	-73.3	169.9	179	0	0	112	V917 K1068 R1069 A1076	V917-E1072 HydrophobicContact CG1-CB 4.15Å; V917-E1072 HydrophobicContact CG2-CB 4.18Å; K1068-E1072 WeakPolarHBondContact CE-OE1 3.45Å; K1068-E1072 WeakPolarHBondContact CG-OE1 3.27Å; K1068-E1072 IonicContact NZ-OE1 3.9Å; K1068-E1072 WeakPolarHBondContact O-CB 3.48Å; K1068-E1072 VanDerWaalsContact O-CG 3.29Å; K1068-E1072 WeakPolarHBondContact O-CG 3.38Å; K1068-E1072 PolarHBondContact O-N 3.43Å; R1069-E1072 VanDerWaalsContact CD-OE2 3.31Å; R1069-E1072 WeakPolarHBondContact CD-OE2 3.47Å; R1069-E1072 IonicContact CZ-OE2 2.84Å; R1069-E1072 IonicContact NE-OE2 3.44Å; R1069-E1072 IonicContact NH1-OE1 3.89Å; R1069-E1072 IonicContact NH1-OE2 2.72Å; R1069-E1072 PolarHBondContact NH1-OE2 3.46Å; R1069-E1072 PolarHBondContact O-N 2.9Å; E1072-A1076 WeakPolarHBondContact O-CB 3.24Å; E1072-A1076 PolarHBondContact O-N 3.07Å
1073	L	95.6	Very high	92.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-45.8	174.5	-76.2	169.4	0	0	0	111.5	V917 T920 V921 L924 L950 M1038 L1062 R1069 V1077	V917-L1073 HydrophobicContact CG1-CD2 3.91Å; V917-L1073 HydrophobicContact CG1-CG 4.27Å; T920-L1073 HydrophobicContact CG2-CD2 3.65Å; V921-L1073 HydrophobicContact CG2-CD2 3.88Å; L924-L1073 HydrophobicContact CD1-CD2 4.49Å; L950-L1073 HydrophobicContact CD2-CB 4.48Å; M1038-L1073 HydrophobicContact CE-CD1 4.22Å; M1038-L1073 HydrophobicContact SD-CD1 3.73Å; L1062-L1073 HydrophobicContact CD2-CD1 4.07Å; L1062-L1073 HydrophobicContact CD2-CD2 4.33Å; L1062-L1073 HydrophobicContact CD2-CG 4.37Å; R1069-L1073 WeakPolarHBondContact O-CB 3.46Å; R1069-L1073 VanDerWaalsContact O-CG 3.26Å; R1069-L1073 WeakPolarHBondContact O-CG 3.45Å; R1069-L1073 PolarHBondContact O-N 3.08Å; L1073-V1077 WeakPolarHBondContact O-CB 3.31Å; L1073-V1077 WeakPolarHBondContact O-CG2 3.49Å; L1073-V1077 PolarHBondContact O-N 3.45Å
1074	L	95.5	Very high	91.5	Very high	12 Å²	12	57.6 Å²	57.6	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-47.3	178.6	175.6	62.4	0	0	0	111.6	P946 E949 L950 C1070 D1071 V1077 K1078	P946-L1074 HydrophobicContact CB-CD2 4.04Å; E949-L1074 HydrophobicContact CB-CD1 4.21Å; E949-L1074 HydrophobicContact CB-CD2 4.09Å; E949-L1074 HydrophobicContact CG-CD1 4.08Å; E949-L1074 HydrophobicContact CG-CD2 4.25Å; E949-L1074 WeakPolarHBondContact OE2-CD2 3.38Å; L950-L1074 HydrophobicContact CB-CD1 4.09Å; C1070-L1074 WeakPolarHBondContact O-CB 3.21Å; C1070-L1074 PolarHBondContact O-N 3.07Å; D1071-L1074 PolarHBondContact O-N 3.44Å; L1074-V1077 PolarHBondContact O-N 3.2Å; L1074-K1078 HydrophobicContact CD1-CD 4.34Å; L1074-K1078 HydrophobicContact CD1-CG 4.46Å; L1074-K1078 HydrophobicContact CG-CD 4.36Å; L1074-K1078 WeakPolarHBondContact O-CG 3.43Å; L1074-K1078 PolarHBondContact O-N 3.5Å
1075	E	95.6	Very high	91.5	Very high	94 Å²	94	59.7 Å²	59.7	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-45.4	-179.9	-175.7	56.5	-153.1	0	0	111.4	D1071 V1077 K1078 Q1079	D1071-E1075 WeakPolarHBondContact O-CB 3.27Å; D1071-E1075 PolarHBondContact O-N 3.16Å; E1075-V1077 VanDerWaalsContact C-N 3.34Å; E1075-V1077 PolarHBondContact O-N 3.32Å; E1075-K1078 PolarHBondContact O-N 2.87Å; E1075-Q1079 WeakPolarHBondContact O-CB 3.43Å; E1075-Q1079 VanDerWaalsContact O-CG 3.29Å; E1075-Q1079 WeakPolarHBondContact O-CG 3.42Å; E1075-Q1079 PolarHBondContact O-N 2.89Å; E1075-Q1079 PolarHBondContact OE1-NE2 3.28Å
1076	A	94.7	Very high	91.5	Very high	18 Å²	18	58.8 Å²	58.8	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-36.7	177.7	0	0	0	0	0	112.6	V917 V921 E1072 K1080	V917-A1076 HydrophobicContact CG1-CB 4.12Å; V921-A1076 HydrophobicContact CG2-CB 3.75Å; E1072-A1076 WeakPolarHBondContact O-CB 3.24Å; E1072-A1076 PolarHBondContact O-N 3.07Å; A1076-K1080 WeakPolarHBondContact O-CB 3.46Å; A1076-K1080 PolarHBondContact O-N 3.5Å
1077	V	94	Very high	91.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-47.7	172	166.2	0	0	0	0	110.6	V921 L925 L950 T953 L954 L1073 L1074 E1075 Q1079 K1080 I1081	V921-V1077 HydrophobicContact CB-CG2 4.31Å; V921-V1077 HydrophobicContact CG1-CB 4.45Å; V921-V1077 HydrophobicContact CG1-CG2 3.65Å; V921-V1077 HydrophobicContact CG2-CG2 3.84Å; L925-V1077 HydrophobicContact CD2-CG1 4.39Å; L950-V1077 HydrophobicContact CD1-CB 4.03Å; L950-V1077 HydrophobicContact CD1-CG1 4.06Å; L950-V1077 HydrophobicContact CD1-CG2 3.73Å; T953-V1077 HydrophobicContact CG2-CG1 4.02Å; L954-V1077 HydrophobicContact CD2-CG1 4.23Å; L1073-V1077 WeakPolarHBondContact O-CB 3.31Å; L1073-V1077 WeakPolarHBondContact O-CG2 3.49Å; L1073-V1077 PolarHBondContact O-N 3.45Å; L1074-V1077 PolarHBondContact O-N 3.2Å; E1075-V1077 VanDerWaalsContact C-N 3.34Å; E1075-V1077 PolarHBondContact O-N 3.32Å; V1077-Q1079 VanDerWaalsContact C-N 3.35Å; V1077-Q1079 PolarHBondContact O-N 3.17Å; V1077-K1080 PolarHBondContact O-N 3.05Å; V1077-I1081 HydrophobicContact CG1-CD1 3.54Å; V1077-I1081 HydrophobicContact CG1-CG1 4.37Å; V1077-I1081 WeakPolarHBondContact O-CB 3.42Å; V1077-I1081 WeakPolarHBondContact O-CD1 3.14Å; V1077-I1081 WeakPolarHBondContact O-CG1 3.35Å; V1077-I1081 PolarHBondContact O-N 3.08Å
1078	K	93.9	Very high	91.5	Very high	72 Å²	72	61.3 Å²	61.3	31%	0.313	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-43	177.4	-76.5	175.5	175.3	176.5	0	112.1	E949 L1074 E1075 I1081 A1082	E949-K1078 VanDerWaalsContact OE1-CE 3.25Å; E949-K1078 WeakPolarHBondContact OE1-CE 3.37Å; E949-K1078 IonicContact OE1-NZ 3.79Å; E949-K1078 PolarHBondContact OE1-NZ 2.84Å; E949-K1078 IonicContact OE2-NZ 3.66Å; L1074-K1078 HydrophobicContact CD1-CD 4.34Å; L1074-K1078 HydrophobicContact CD1-CG 4.46Å; L1074-K1078 HydrophobicContact CG-CD 4.36Å; L1074-K1078 WeakPolarHBondContact O-CG 3.43Å; L1074-K1078 PolarHBondContact O-N 3.5Å; E1075-K1078 PolarHBondContact O-N 2.87Å; K1078-I1081 PolarHBondContact O-N 3.03Å; K1078-A1082 WeakPolarHBondContact O-CB 3.39Å; K1078-A1082 PolarHBondContact O-N 2.85Å
1079	Q	92.8	Very high	91.2	Very high	101 Å²	101	57.4 Å²	57.4	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-47.1	177.6	-72.7	176.8	6.1	0	0	111.9	E1075 V1077 I1081 A1082 N1083	E1075-Q1079 WeakPolarHBondContact O-CB 3.43Å; E1075-Q1079 VanDerWaalsContact O-CG 3.29Å; E1075-Q1079 WeakPolarHBondContact O-CG 3.42Å; E1075-Q1079 PolarHBondContact O-N 2.89Å; E1075-Q1079 PolarHBondContact OE1-NE2 3.28Å; V1077-Q1079 VanDerWaalsContact C-N 3.35Å; V1077-Q1079 PolarHBondContact O-N 3.17Å; Q1079-I1081 VanDerWaalsContact C-N 3.3Å; Q1079-I1081 PolarHBondContact O-N 3.41Å; Q1079-A1082 PolarHBondContact O-N 3.07Å; Q1079-N1083 WeakPolarHBondContact O-CB 3.5Å; Q1079-N1083 PolarHBondContact O-N 2.93Å; Q1079-N1083 PolarHBondContact O-ND2 3.08Å
1080	K	90.4	Very high	91	Very high	58 Å²	58	56.9 Å²	56.9	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-33.6	176.4	-78.8	-168.4	-179.3	176.5	0	112.6	E918 V921 D922 L925 A1076 V1077 S1084	E918-K1080 PolarHBondContact O-NZ 3.33Å; E918-K1080 VanDerWaalsContact O-NZ 3.17Å; V921-K1080 HydrophobicContact CG1-CD 3.76Å; V921-K1080 HydrophobicContact CG1-CG 4.49Å; D922-K1080 IonicContact OD1-NZ 2.8Å; D922-K1080 PolarHBondContact OD1-NZ 3.31Å; D922-K1080 IonicContact OD2-NZ 3.48Å; D922-K1080 PolarHBondContact OD2-NZ 2.87Å; L925-K1080 HydrophobicContact CD1-CB 3.69Å; L925-K1080 HydrophobicContact CD1-CD 4.13Å; A1076-K1080 WeakPolarHBondContact O-CB 3.46Å; A1076-K1080 PolarHBondContact O-N 3.5Å; V1077-K1080 PolarHBondContact O-N 3.05Å; K1080-S1084 VanDerWaalsContact O-CB 3.3Å; K1080-S1084 WeakPolarHBondContact O-CB 3.42Å; K1080-S1084 PolarHBondContact O-N 2.87Å; K1080-S1084 VanDerWaalsContact O-N 3.14Å; K1080-S1084 PolarHBondContact O-OG 2.97Å
1081	I	88.4	Confident	90.7	Very high	41 Å²	41	60.9 Å²	60.9	21%	0.21	34%	0.338	C	S	.	.	H	α-helix	trans	-69.2	-41.4	173	-68.9	168.2	0	0	0	111.3	L925 T953 V1077 K1078 Q1079 N1083 S1084	L925-I1081 HydrophobicContact CD2-CD1 4.37Å; L925-I1081 HydrophobicContact CD2-CG1 4.2Å; T953-I1081 HydrophobicContact CG2-CD1 3.49Å; T953-I1081 VanDerWaalsContact CG2-CD1 3.49Å; V1077-I1081 HydrophobicContact CG1-CD1 3.54Å; V1077-I1081 HydrophobicContact CG1-CG1 4.37Å; V1077-I1081 WeakPolarHBondContact O-CB 3.42Å; V1077-I1081 WeakPolarHBondContact O-CD1 3.14Å; V1077-I1081 WeakPolarHBondContact O-CG1 3.35Å; V1077-I1081 PolarHBondContact O-N 3.08Å; K1078-I1081 PolarHBondContact O-N 3.03Å; Q1079-I1081 VanDerWaalsContact C-N 3.3Å; Q1079-I1081 PolarHBondContact O-N 3.41Å; I1081-N1083 PolarHBondContact O-N 3.14Å; I1081-S1084 WeakPolarHBondContact CA-OG 3.33Å; I1081-S1084 PolarHBondContact O-N 3.42Å; I1081-S1084 PolarHBondContact O-OG 2.93Å
1082	A	86.5	Confident	90.3	Very high	83 Å²	83	61 Å²	61	69%	0.686	34%	0.339	S	S	*	.	H	α-helix	trans	-67	-28.6	178	0	0	0	0	0	112.5	K1078 Q1079	K1078-A1082 WeakPolarHBondContact O-CB 3.39Å; K1078-A1082 PolarHBondContact O-N 2.85Å; Q1079-A1082 PolarHBondContact O-N 3.07Å
1083	N	80.9	Confident	89.9	Confident	143 Å²	143	61.2 Å²	61.2	77%	0.765	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.1	176.9	-65.8	-19	0	0	0	113.8	Q1079 I1081	Q1079-N1083 WeakPolarHBondContact O-CB 3.5Å; Q1079-N1083 PolarHBondContact O-N 2.93Å; Q1079-N1083 PolarHBondContact O-ND2 3.08Å; I1081-N1083 PolarHBondContact O-N 3.14Å
1084	S	70.3	Confident	89.3	Confident	112 Å²	112	66.7 Å²	66.7	78%	0.783	38%	0.376	S	S	*	.			trans	-102.8	0	-179.4	71.5	0	0	0	0	111.8	R957 K1080 I1081	R957-S1084 PolarHBondContact NH2-OG 3.47Å; K1080-S1084 VanDerWaalsContact O-CB 3.3Å; K1080-S1084 WeakPolarHBondContact O-CB 3.42Å; K1080-S1084 PolarHBondContact O-N 2.87Å; K1080-S1084 VanDerWaalsContact O-N 3.14Å; K1080-S1084 PolarHBondContact O-OG 2.97Å; I1081-S1084 WeakPolarHBondContact CA-OG 3.33Å; I1081-S1084 PolarHBondContact O-N 3.42Å; I1081-S1084 PolarHBondContact O-OG 2.93Å

Retrieved 1,084 of 1,084 residues in 2577.8 ms (Link to these results)

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